HEADER NEUROPEPTIDE INHIBITOR 23-JUL-09 SMS20087 TITLE SOLUTION STRUCTURE OF NOCICEPTIN ANALOGUE(FORM I) COMPND MOL_ID: 1; COMPND 2 MOLECULE: NOCICEPTIN ANALOGUE; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 4 ORGANISM_TAXID: 32630; SOURCE 5 OTHER_DETAILS: CHEMICAL SYNTHESIS KEYWDS HELIX, NOCICEPTIN, SYNTHETIC PEPTIDE MIMETIC, NEUROPEPTIDE INHIBITOR EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR D.P.FAIRLIE JRNL AUTH R.S.HARRISON,N.E.SHEPHERD,H.N.HOANG,G.RUIZ-GOMEZ,T.A.HILL, JRNL AUTH 2 R.W.DRIVER,V.S.DESAI,P.R.YOUNG,G.ABBENANTE,D.P.FAIRLIE JRNL TITL DOWNSIZING HUMAN, BACTERIAL, AND VIRAL PROTEINS TO SHORT JRNL TITL 2 WATER-STABLE ALPHA HELICES THAT MAINTAIN BIOLOGICAL POTENCY JRNL REF PROC.NATL.ACAD.SCI.USA V. 107 11686 2010 JRNL REFN ISSN 0027-8424 JRNL PMID 20543141 JRNL DOI 10.1073/PNAS.1002498107 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR_NIH REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 19-OCT-10. REMARK 100 THE BMRB ID CODE IS SMS20087. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 288 REMARK 210 PH : 4.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 3-5MM NOCICEPTIN ANALOGUE; 90% REMARK 210 H2O/10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY; 2D 1H-1H TOCSY; REMARK 210 2D DQF-COSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR_NIH REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 50 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 1 THR A 5 126.13 70.53 REMARK 500 1 LYS A 7 46.76 -85.50 REMARK 500 2 PHE A 4 138.03 72.13 REMARK 500 3 PHE A 4 49.75 -150.32 REMARK 500 3 THR A 5 39.67 -161.83 REMARK 500 3 LYS A 7 36.86 -96.08 REMARK 500 4 PHE A 4 130.07 66.90 REMARK 500 4 THR A 5 49.99 -157.28 REMARK 500 4 LYS A 7 44.05 -88.94 REMARK 500 5 PHE A 4 41.08 -177.96 REMARK 500 5 THR A 5 51.23 -177.00 REMARK 500 5 LYS A 7 44.31 -87.42 REMARK 500 6 THR A 5 -51.20 179.09 REMARK 500 7 PHE A 4 138.63 66.61 REMARK 500 7 THR A 5 44.41 -146.71 REMARK 500 8 THR A 5 128.42 -175.23 REMARK 500 9 PHE A 4 128.48 67.32 REMARK 500 9 THR A 5 -155.31 -80.00 REMARK 500 10 PHE A 4 56.67 -93.15 REMARK 500 12 PHE A 4 161.46 68.76 REMARK 500 12 THR A 5 134.58 75.22 REMARK 500 13 LYS A 7 43.88 -95.58 REMARK 500 14 THR A 5 -36.60 164.71 REMARK 500 14 LYS A 7 36.00 -84.52 REMARK 500 14 ARG A 8 -64.21 -95.91 REMARK 500 15 PHE A 4 -156.60 -100.86 REMARK 500 17 THR A 5 -39.60 -176.91 REMARK 500 18 PHE A 4 145.28 178.38 REMARK 500 18 THR A 5 15.24 -148.51 REMARK 500 18 LYS A 7 49.11 -86.21 REMARK 500 19 PHE A 4 145.07 65.16 REMARK 500 19 THR A 5 88.12 -63.08 REMARK 500 19 LYS A 7 48.69 -96.99 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20087 RELATED DB: BMRB REMARK 900 RELATED ID: 20086 RELATED DB: BMRB REMARK 900 NOCICEPTIN AGONIST REMARK 900 RELATED ID: 20088 RELATED DB: BMRB REMARK 900 NOCICEPTIN ANALOGUE(FORM II) REMARK 900 RELATED ID: 20089 RELATED DB: BMRB REMARK 900 NOCICEPTIN ANALOGUE(FORM III) DBREF A 1 18 BMRB SMS20087 SMS20087 1 18 SEQADV NH2 A 19 BMRB SMS20087 AMIDATION SEQRES 1 A 19 PHE GLY GLY PHE THR GLY LYS ARG LYS SER ASP ARG LYS SEQRES 2 A 19 LYS LYS ASN GLN ASP NH2 HET NH2 A 19 3 HETNAM NH2 AMINO GROUP FORMUL 1 NH2 H2 N HELIX 1 1 LYS A 7 ASP A 18 1 12 LINK NZ LYS A 7 CG ASP A 11 1555 1555 1.33 LINK NZ LYS A 14 CG ASP A 18 1555 1555 1.33 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 MODEL 1 ATOM 1 N PHE A 1 3.653 -7.845 -5.620 1.00 0.00 N ATOM 2 CA PHE A 1 4.514 -8.812 -4.947 1.00 0.00 C ATOM 3 C PHE A 1 4.425 -8.656 -3.429 1.00 0.00 C ATOM 4 O PHE A 1 4.492 -7.541 -2.907 1.00 0.00 O ATOM 5 CB PHE A 1 5.965 -8.643 -5.413 1.00 0.00 C ATOM 6 CG PHE A 1 6.926 -9.629 -4.801 1.00 0.00 C ATOM 7 CD1 PHE A 1 6.610 -10.978 -4.731 1.00 0.00 C ATOM 8 CD2 PHE A 1 8.145 -9.205 -4.296 1.00 0.00 C ATOM 9 CE1 PHE A 1 7.492 -11.883 -4.170 1.00 0.00 C ATOM 10 CE2 PHE A 1 9.030 -10.105 -3.734 1.00 0.00 C ATOM 11 CZ PHE A 1 8.703 -11.445 -3.671 1.00 0.00 C ATOM 12 H1 PHE A 1 3.193 -8.107 -6.445 1.00 0.00 H ATOM 13 HA PHE A 1 4.172 -9.801 -5.216 1.00 0.00 H ATOM 14 HB2 PHE A 1 6.007 -8.764 -6.485 1.00 0.00 H ATOM 15 HB3 PHE A 1 6.302 -7.649 -5.157 1.00 0.00 H ATOM 16 HD1 PHE A 1 5.663 -11.322 -5.121 1.00 0.00 H ATOM 17 HD2 PHE A 1 8.403 -8.157 -4.345 1.00 0.00 H ATOM 18 HE1 PHE A 1 7.234 -12.930 -4.121 1.00 0.00 H ATOM 19 HE2 PHE A 1 9.976 -9.761 -3.344 1.00 0.00 H ATOM 20 HZ PHE A 1 9.393 -12.150 -3.232 1.00 0.00 H ATOM 21 N GLY A 2 4.276 -9.783 -2.728 1.00 0.00 N ATOM 22 CA GLY A 2 4.182 -9.760 -1.276 1.00 0.00 C ATOM 23 C GLY A 2 5.418 -9.170 -0.618 1.00 0.00 C ATOM 24 O GLY A 2 5.307 -8.348 0.294 1.00 0.00 O ATOM 25 H GLY A 2 4.231 -10.640 -3.203 1.00 0.00 H ATOM 26 HA2 GLY A 2 3.322 -9.172 -0.992 1.00 0.00 H ATOM 27 HA3 GLY A 2 4.046 -10.771 -0.920 1.00 0.00 H ATOM 28 N GLY A 3 6.597 -9.589 -1.086 1.00 0.00 N ATOM 29 CA GLY A 3 7.848 -9.088 -0.536 1.00 0.00 C ATOM 30 C GLY A 3 7.988 -7.580 -0.669 1.00 0.00 C ATOM 31 O GLY A 3 8.502 -6.921 0.236 1.00 0.00 O ATOM 32 H GLY A 3 6.618 -10.243 -1.816 1.00 0.00 H ATOM 33 HA2 GLY A 3 7.900 -9.352 0.510 1.00 0.00 H ATOM 34 HA3 GLY A 3 8.669 -9.561 -1.055 1.00 0.00 H ATOM 35 N PHE A 4 7.531 -7.037 -1.800 1.00 0.00 N ATOM 36 CA PHE A 4 7.606 -5.598 -2.056 1.00 0.00 C ATOM 37 C PHE A 4 6.871 -4.806 -0.974 1.00 0.00 C ATOM 38 O PHE A 4 5.769 -5.176 -0.563 1.00 0.00 O ATOM 39 CB PHE A 4 7.019 -5.273 -3.435 1.00 0.00 C ATOM 40 CG PHE A 4 7.063 -3.810 -3.789 1.00 0.00 C ATOM 41 CD1 PHE A 4 8.238 -3.085 -3.663 1.00 0.00 C ATOM 42 CD2 PHE A 4 5.926 -3.162 -4.244 1.00 0.00 C ATOM 43 CE1 PHE A 4 8.278 -1.742 -3.986 1.00 0.00 C ATOM 44 CE2 PHE A 4 5.960 -1.819 -4.568 1.00 0.00 C ATOM 45 CZ PHE A 4 7.137 -1.108 -4.439 1.00 0.00 C ATOM 46 H PHE A 4 7.134 -7.619 -2.481 1.00 0.00 H ATOM 47 HA PHE A 4 8.648 -5.316 -2.045 1.00 0.00 H ATOM 48 HB2 PHE A 4 7.573 -5.811 -4.189 1.00 0.00 H ATOM 49 HB3 PHE A 4 5.987 -5.591 -3.462 1.00 0.00 H ATOM 50 HD1 PHE A 4 9.131 -3.580 -3.310 1.00 0.00 H ATOM 51 HD2 PHE A 4 5.005 -3.716 -4.346 1.00 0.00 H ATOM 52 HE1 PHE A 4 9.199 -1.188 -3.883 1.00 0.00 H ATOM 53 HE2 PHE A 4 5.067 -1.326 -4.922 1.00 0.00 H ATOM 54 HZ PHE A 4 7.166 -0.059 -4.691 1.00 0.00 H ATOM 55 N THR A 5 7.498 -3.713 -0.523 1.00 0.00 N ATOM 56 CA THR A 5 6.931 -2.844 0.512 1.00 0.00 C ATOM 57 C THR A 5 6.934 -3.529 1.880 1.00 0.00 C ATOM 58 O THR A 5 6.417 -4.637 2.035 1.00 0.00 O ATOM 59 CB THR A 5 5.492 -2.401 0.164 1.00 0.00 C ATOM 60 OG1 THR A 5 5.473 -1.761 -1.118 1.00 0.00 O ATOM 61 CG2 THR A 5 4.945 -1.445 1.215 1.00 0.00 C ATOM 62 H THR A 5 8.373 -3.484 -0.899 1.00 0.00 H ATOM 63 HA THR A 5 7.549 -1.959 0.568 1.00 0.00 H ATOM 64 HB THR A 5 4.858 -3.276 0.131 1.00 0.00 H ATOM 65 HG1 THR A 5 4.978 -2.302 -1.739 1.00 0.00 H ATOM 66 HG21 THR A 5 4.000 -1.043 0.879 1.00 0.00 H ATOM 67 HG22 THR A 5 5.646 -0.638 1.367 1.00 0.00 H ATOM 68 HG23 THR A 5 4.799 -1.976 2.144 1.00 0.00 H ATOM 69 N GLY A 6 7.522 -2.854 2.871 1.00 0.00 N ATOM 70 CA GLY A 6 7.589 -3.400 4.218 1.00 0.00 C ATOM 71 C GLY A 6 6.454 -2.923 5.108 1.00 0.00 C ATOM 72 O GLY A 6 6.690 -2.488 6.237 1.00 0.00 O ATOM 73 H GLY A 6 7.915 -1.975 2.685 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.555 -4.477 4.159 1.00 0.00 H ATOM 75 HA3 GLY A 6 8.528 -3.106 4.664 1.00 0.00 H ATOM 76 N LYS A 7 5.220 -3.000 4.603 1.00 0.00 N ATOM 77 CA LYS A 7 4.045 -2.569 5.366 1.00 0.00 C ATOM 78 C LYS A 7 3.526 -3.696 6.279 1.00 0.00 C ATOM 79 O LYS A 7 2.325 -3.963 6.338 1.00 0.00 O ATOM 80 CB LYS A 7 2.940 -2.070 4.409 1.00 0.00 C ATOM 81 CG LYS A 7 2.058 -3.161 3.799 1.00 0.00 C ATOM 82 CD LYS A 7 2.868 -4.288 3.176 1.00 0.00 C ATOM 83 CE LYS A 7 2.018 -5.533 2.980 1.00 0.00 C ATOM 84 NZ LYS A 7 1.570 -6.090 4.259 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.099 -3.353 3.699 1.00 0.00 H ATOM 86 HA LYS A 7 4.354 -1.744 5.992 1.00 0.00 H ATOM 87 HB2 LYS A 7 2.298 -1.393 4.952 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.408 -1.527 3.600 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.424 -3.571 4.567 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.442 -2.714 3.033 1.00 0.00 H ATOM 91 HD2 LYS A 7 3.243 -3.965 2.217 1.00 0.00 H ATOM 92 HD3 LYS A 7 3.694 -4.530 3.827 1.00 0.00 H ATOM 93 HE2 LYS A 7 1.153 -5.274 2.387 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.603 -6.276 2.459 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.260 -6.312 4.920 1.00 0.00 H ATOM 96 N ARG A 8 4.439 -4.347 7.007 1.00 0.00 N ATOM 97 CA ARG A 8 4.065 -5.432 7.917 1.00 0.00 C ATOM 98 C ARG A 8 3.018 -4.962 8.923 1.00 0.00 C ATOM 99 O ARG A 8 2.049 -5.672 9.200 1.00 0.00 O ATOM 100 CB ARG A 8 5.293 -5.982 8.659 1.00 0.00 C ATOM 101 CG ARG A 8 6.195 -6.869 7.808 1.00 0.00 C ATOM 102 CD ARG A 8 6.928 -6.085 6.726 1.00 0.00 C ATOM 103 NE ARG A 8 7.824 -5.069 7.285 1.00 0.00 N ATOM 104 CZ ARG A 8 8.941 -5.341 7.968 1.00 0.00 C ATOM 105 NH1 ARG A 8 9.336 -6.599 8.154 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.673 -4.347 8.458 1.00 0.00 N ATOM 107 H ARG A 8 5.378 -4.086 6.939 1.00 0.00 H ATOM 108 HA ARG A 8 3.636 -6.223 7.321 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.881 -5.151 9.019 1.00 0.00 H ATOM 110 HB3 ARG A 8 4.954 -6.561 9.506 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.925 -7.339 8.449 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.589 -7.630 7.337 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.510 -6.775 6.134 1.00 0.00 H ATOM 114 HD3 ARG A 8 6.199 -5.601 6.094 1.00 0.00 H ATOM 115 HE ARG A 8 7.574 -4.131 7.153 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.800 -7.355 7.781 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.173 -6.789 8.668 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.388 -3.399 8.316 1.00 0.00 H ATOM 119 HH22 ARG A 8 10.509 -4.546 8.970 1.00 0.00 H ATOM 120 N LYS A 9 3.220 -3.760 9.460 1.00 0.00 N ATOM 121 CA LYS A 9 2.293 -3.182 10.433 1.00 0.00 C ATOM 122 C LYS A 9 0.889 -3.034 9.839 1.00 0.00 C ATOM 123 O LYS A 9 -0.106 -3.275 10.523 1.00 0.00 O ATOM 124 CB LYS A 9 2.802 -1.820 10.940 1.00 0.00 C ATOM 125 CG LYS A 9 2.698 -0.674 9.932 1.00 0.00 C ATOM 126 CD LYS A 9 3.660 -0.833 8.760 1.00 0.00 C ATOM 127 CE LYS A 9 5.114 -0.850 9.214 1.00 0.00 C ATOM 128 NZ LYS A 9 5.507 0.420 9.888 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.012 -3.250 9.192 1.00 0.00 H ATOM 130 HA LYS A 9 2.238 -3.862 11.269 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.232 -1.544 11.814 1.00 0.00 H ATOM 132 HB3 LYS A 9 3.839 -1.925 11.223 1.00 0.00 H ATOM 133 HG2 LYS A 9 1.691 -0.638 9.548 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.919 0.254 10.440 1.00 0.00 H ATOM 135 HD2 LYS A 9 3.443 -1.758 8.250 1.00 0.00 H ATOM 136 HD3 LYS A 9 3.517 -0.006 8.079 1.00 0.00 H ATOM 137 HE2 LYS A 9 5.253 -1.669 9.904 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.745 -0.999 8.350 1.00 0.00 H ATOM 139 HZ1 LYS A 9 6.543 0.498 9.927 1.00 0.00 H ATOM 140 HZ2 LYS A 9 5.133 0.442 10.858 1.00 0.00 H ATOM 141 HZ3 LYS A 9 5.129 1.236 9.364 1.00 0.00 H ATOM 142 N SER A 10 0.821 -2.633 8.565 1.00 0.00 N ATOM 143 CA SER A 10 -0.457 -2.447 7.875 1.00 0.00 C ATOM 144 C SER A 10 -1.153 -3.783 7.618 1.00 0.00 C ATOM 145 O SER A 10 -2.336 -3.941 7.923 1.00 0.00 O ATOM 146 CB SER A 10 -0.246 -1.708 6.550 1.00 0.00 C ATOM 147 OG SER A 10 0.342 -0.435 6.762 1.00 0.00 O ATOM 148 H SER A 10 1.651 -2.457 8.078 1.00 0.00 H ATOM 149 HA SER A 10 -1.088 -1.848 8.511 1.00 0.00 H ATOM 150 HB2 SER A 10 0.406 -2.290 5.915 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.199 -1.573 6.060 1.00 0.00 H ATOM 152 HG SER A 10 1.293 -0.532 6.852 1.00 0.00 H ATOM 153 N ASP A 11 -0.413 -4.740 7.059 1.00 0.00 N ATOM 154 CA ASP A 11 -0.963 -6.065 6.766 1.00 0.00 C ATOM 155 C ASP A 11 -1.327 -6.806 8.053 1.00 0.00 C ATOM 156 O ASP A 11 -2.347 -7.493 8.112 1.00 0.00 O ATOM 157 CB ASP A 11 0.028 -6.900 5.945 1.00 0.00 C ATOM 158 CG ASP A 11 0.293 -6.312 4.569 1.00 0.00 C ATOM 159 OD1 ASP A 11 -0.637 -6.070 3.797 1.00 0.00 O ATOM 160 H ASP A 11 0.524 -4.553 6.841 1.00 0.00 H ATOM 161 HA ASP A 11 -1.862 -5.923 6.186 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.966 -6.958 6.476 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.371 -7.896 5.819 1.00 0.00 H ATOM 164 N ARG A 12 -0.484 -6.661 9.078 1.00 0.00 N ATOM 165 CA ARG A 12 -0.710 -7.315 10.367 1.00 0.00 C ATOM 166 C ARG A 12 -2.015 -6.838 11.006 1.00 0.00 C ATOM 167 O ARG A 12 -2.852 -7.653 11.400 1.00 0.00 O ATOM 168 CB ARG A 12 0.481 -7.047 11.300 1.00 0.00 C ATOM 169 CG ARG A 12 0.412 -7.762 12.647 1.00 0.00 C ATOM 170 CD ARG A 12 -0.595 -7.119 13.595 1.00 0.00 C ATOM 171 NE ARG A 12 -0.349 -5.686 13.780 1.00 0.00 N ATOM 172 CZ ARG A 12 0.728 -5.175 14.385 1.00 0.00 C ATOM 173 NH1 ARG A 12 1.650 -5.972 14.922 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 0.876 -3.857 14.467 1.00 0.00 N ATOM 175 H ARG A 12 0.312 -6.101 8.963 1.00 0.00 H ATOM 176 HA ARG A 12 -0.781 -8.375 10.188 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.386 -7.361 10.803 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.540 -5.984 11.487 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.123 -8.789 12.480 1.00 0.00 H ATOM 180 HG3 ARG A 12 1.390 -7.736 13.104 1.00 0.00 H ATOM 181 HD2 ARG A 12 -1.586 -7.255 13.196 1.00 0.00 H ATOM 182 HD3 ARG A 12 -0.526 -7.611 14.554 1.00 0.00 H ATOM 183 HE ARG A 12 -1.019 -5.067 13.420 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.544 -6.965 14.878 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.452 -5.577 15.370 1.00 0.00 H ATOM 186 HH21 ARG A 12 0.183 -3.251 14.075 1.00 0.00 H ATOM 187 HH22 ARG A 12 1.680 -3.470 14.919 1.00 0.00 H ATOM 188 N LYS A 13 -2.183 -5.518 11.105 1.00 0.00 N ATOM 189 CA LYS A 13 -3.388 -4.936 11.701 1.00 0.00 C ATOM 190 C LYS A 13 -4.631 -5.255 10.868 1.00 0.00 C ATOM 191 O LYS A 13 -5.688 -5.566 11.418 1.00 0.00 O ATOM 192 CB LYS A 13 -3.238 -3.418 11.870 1.00 0.00 C ATOM 193 CG LYS A 13 -3.113 -2.651 10.560 1.00 0.00 C ATOM 194 CD LYS A 13 -2.926 -1.159 10.796 1.00 0.00 C ATOM 195 CE LYS A 13 -4.122 -0.547 11.511 1.00 0.00 C ATOM 196 NZ LYS A 13 -3.953 0.917 11.731 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.479 -4.923 10.772 1.00 0.00 H ATOM 198 HA LYS A 13 -3.511 -5.380 12.676 1.00 0.00 H ATOM 199 HB2 LYS A 13 -4.101 -3.042 12.398 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.355 -3.221 12.460 1.00 0.00 H ATOM 201 HG2 LYS A 13 -2.263 -3.027 10.013 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.012 -2.803 9.979 1.00 0.00 H ATOM 203 HD2 LYS A 13 -2.044 -1.009 11.401 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.797 -0.668 9.843 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.006 -0.711 10.911 1.00 0.00 H ATOM 206 HE3 LYS A 13 -4.242 -1.035 12.467 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -3.011 1.113 12.127 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -4.674 1.264 12.395 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -4.053 1.428 10.831 1.00 0.00 H ATOM 210 N LYS A 14 -4.496 -5.177 9.542 1.00 0.00 N ATOM 211 CA LYS A 14 -5.607 -5.460 8.635 1.00 0.00 C ATOM 212 C LYS A 14 -6.060 -6.916 8.749 1.00 0.00 C ATOM 213 O LYS A 14 -7.259 -7.197 8.789 1.00 0.00 O ATOM 214 CB LYS A 14 -5.214 -5.145 7.186 1.00 0.00 C ATOM 215 CG LYS A 14 -6.281 -5.527 6.171 1.00 0.00 C ATOM 216 CD LYS A 14 -7.580 -4.771 6.410 1.00 0.00 C ATOM 217 CE LYS A 14 -8.764 -5.481 5.771 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.032 -6.770 6.410 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.626 -4.925 9.166 1.00 0.00 H ATOM 220 HA LYS A 14 -6.429 -4.822 8.918 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.026 -4.085 7.098 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.309 -5.683 6.946 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.920 -5.295 5.180 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.471 -6.587 6.247 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.752 -4.693 7.473 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.493 -3.782 5.984 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.638 -4.853 5.864 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.549 -5.645 4.725 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -8.270 -7.367 6.560 1.00 0.00 H ATOM 230 N LYS A 15 -5.094 -7.835 8.804 1.00 0.00 N ATOM 231 CA LYS A 15 -5.388 -9.263 8.918 1.00 0.00 C ATOM 232 C LYS A 15 -6.228 -9.547 10.161 1.00 0.00 C ATOM 233 O LYS A 15 -7.188 -10.317 10.110 1.00 0.00 O ATOM 234 CB LYS A 15 -4.085 -10.069 8.968 1.00 0.00 C ATOM 235 CG LYS A 15 -4.296 -11.573 9.081 1.00 0.00 C ATOM 236 CD LYS A 15 -2.972 -12.322 9.155 1.00 0.00 C ATOM 237 CE LYS A 15 -2.165 -11.928 10.385 1.00 0.00 C ATOM 238 NZ LYS A 15 -2.889 -12.230 11.654 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.159 -7.543 8.772 1.00 0.00 H ATOM 240 HA LYS A 15 -5.949 -9.556 8.044 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.521 -9.874 8.069 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.508 -9.744 9.821 1.00 0.00 H ATOM 243 HG2 LYS A 15 -4.865 -11.781 9.974 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.845 -11.915 8.215 1.00 0.00 H ATOM 245 HD2 LYS A 15 -3.173 -13.382 9.194 1.00 0.00 H ATOM 246 HD3 LYS A 15 -2.394 -12.097 8.270 1.00 0.00 H ATOM 247 HE2 LYS A 15 -1.233 -12.473 10.377 1.00 0.00 H ATOM 248 HE3 LYS A 15 -1.961 -10.868 10.341 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -2.229 -12.200 12.457 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.317 -13.177 11.607 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -3.642 -11.529 11.811 1.00 0.00 H ATOM 252 N ASN A 16 -5.859 -8.913 11.273 1.00 0.00 N ATOM 253 CA ASN A 16 -6.575 -9.083 12.536 1.00 0.00 C ATOM 254 C ASN A 16 -7.964 -8.442 12.476 1.00 0.00 C ATOM 255 O ASN A 16 -8.939 -9.014 12.966 1.00 0.00 O ATOM 256 CB ASN A 16 -5.765 -8.478 13.688 1.00 0.00 C ATOM 257 CG ASN A 16 -6.449 -8.643 15.034 1.00 0.00 C ATOM 258 OD1 ASN A 16 -6.680 -9.762 15.492 1.00 0.00 O ATOM 259 ND2 ASN A 16 -6.780 -7.526 15.674 1.00 0.00 N ATOM 260 H ASN A 16 -5.086 -8.309 11.241 1.00 0.00 H ATOM 261 HA ASN A 16 -6.690 -10.142 12.708 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.802 -8.963 13.735 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.622 -7.423 13.503 1.00 0.00 H ATOM 264 HD21 ASN A 16 -6.569 -6.667 15.250 1.00 0.00 H ATOM 265 HD22 ASN A 16 -7.222 -7.606 16.545 1.00 0.00 H ATOM 266 N GLN A 17 -8.039 -7.250 11.881 1.00 0.00 N ATOM 267 CA GLN A 17 -9.302 -6.518 11.761 1.00 0.00 C ATOM 268 C GLN A 17 -10.334 -7.316 10.960 1.00 0.00 C ATOM 269 O GLN A 17 -11.439 -7.569 11.442 1.00 0.00 O ATOM 270 CB GLN A 17 -9.053 -5.151 11.107 1.00 0.00 C ATOM 271 CG GLN A 17 -10.270 -4.233 11.081 1.00 0.00 C ATOM 272 CD GLN A 17 -11.355 -4.706 10.129 1.00 0.00 C ATOM 273 OE1 GLN A 17 -11.126 -4.833 8.926 1.00 0.00 O ATOM 274 NE2 GLN A 17 -12.545 -4.967 10.661 1.00 0.00 N ATOM 275 H GLN A 17 -7.222 -6.848 11.518 1.00 0.00 H ATOM 276 HA GLN A 17 -9.686 -6.363 12.756 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.267 -4.648 11.648 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.729 -5.308 10.088 1.00 0.00 H ATOM 279 HG2 GLN A 17 -10.687 -4.184 12.076 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.952 -3.246 10.778 1.00 0.00 H ATOM 281 HE21 GLN A 17 -12.659 -4.842 11.627 1.00 0.00 H ATOM 282 HE22 GLN A 17 -13.260 -5.274 10.066 1.00 0.00 H ATOM 283 N ASP A 18 -9.966 -7.711 9.741 1.00 0.00 N ATOM 284 CA ASP A 18 -10.863 -8.482 8.878 1.00 0.00 C ATOM 285 C ASP A 18 -11.069 -9.896 9.420 1.00 0.00 C ATOM 286 O ASP A 18 -12.193 -10.298 9.719 1.00 0.00 O ATOM 287 CB ASP A 18 -10.319 -8.541 7.446 1.00 0.00 C ATOM 288 CG ASP A 18 -10.243 -7.170 6.796 1.00 0.00 C ATOM 289 OD1 ASP A 18 -11.257 -6.485 6.649 1.00 0.00 O ATOM 290 H ASP A 18 -9.071 -7.481 9.416 1.00 0.00 H ATOM 291 HA ASP A 18 -11.818 -7.976 8.867 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.327 -8.966 7.462 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.965 -9.167 6.848 1.00 0.00 H HETATM 294 N NH2 A 19 -9.983 -10.652 9.550 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.117 -10.270 9.294 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.092 -11.562 9.897 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 2 ATOM 1 N PHE A 1 2.656 -3.935 -1.099 1.00 0.00 N ATOM 2 CA PHE A 1 3.431 -4.940 -1.817 1.00 0.00 C ATOM 3 C PHE A 1 3.939 -6.020 -0.860 1.00 0.00 C ATOM 4 O PHE A 1 4.450 -5.713 0.220 1.00 0.00 O ATOM 5 CB PHE A 1 4.611 -4.282 -2.541 1.00 0.00 C ATOM 6 CG PHE A 1 5.394 -5.219 -3.421 1.00 0.00 C ATOM 7 CD1 PHE A 1 4.759 -5.973 -4.398 1.00 0.00 C ATOM 8 CD2 PHE A 1 6.767 -5.339 -3.277 1.00 0.00 C ATOM 9 CE1 PHE A 1 5.481 -6.829 -5.210 1.00 0.00 C ATOM 10 CE2 PHE A 1 7.492 -6.192 -4.087 1.00 0.00 C ATOM 11 CZ PHE A 1 6.849 -6.938 -5.054 1.00 0.00 C ATOM 12 H1 PHE A 1 2.185 -3.241 -1.607 1.00 0.00 H ATOM 13 HA PHE A 1 2.782 -5.399 -2.547 1.00 0.00 H ATOM 14 HB2 PHE A 1 4.239 -3.482 -3.163 1.00 0.00 H ATOM 15 HB3 PHE A 1 5.289 -3.871 -1.806 1.00 0.00 H ATOM 16 HD1 PHE A 1 3.690 -5.889 -4.522 1.00 0.00 H ATOM 17 HD2 PHE A 1 7.271 -4.757 -2.519 1.00 0.00 H ATOM 18 HE1 PHE A 1 4.977 -7.412 -5.967 1.00 0.00 H ATOM 19 HE2 PHE A 1 8.561 -6.275 -3.963 1.00 0.00 H ATOM 20 HZ PHE A 1 7.414 -7.604 -5.688 1.00 0.00 H ATOM 21 N GLY A 2 3.790 -7.282 -1.265 1.00 0.00 N ATOM 22 CA GLY A 2 4.232 -8.395 -0.440 1.00 0.00 C ATOM 23 C GLY A 2 5.737 -8.428 -0.241 1.00 0.00 C ATOM 24 O GLY A 2 6.213 -8.670 0.871 1.00 0.00 O ATOM 25 H GLY A 2 3.374 -7.459 -2.135 1.00 0.00 H ATOM 26 HA2 GLY A 2 3.756 -8.320 0.527 1.00 0.00 H ATOM 27 HA3 GLY A 2 3.923 -9.319 -0.908 1.00 0.00 H ATOM 28 N GLY A 3 6.487 -8.185 -1.321 1.00 0.00 N ATOM 29 CA GLY A 3 7.940 -8.192 -1.246 1.00 0.00 C ATOM 30 C GLY A 3 8.481 -7.210 -0.220 1.00 0.00 C ATOM 31 O GLY A 3 7.981 -6.088 -0.108 1.00 0.00 O ATOM 32 H GLY A 3 6.048 -8.001 -2.177 1.00 0.00 H ATOM 33 HA2 GLY A 3 8.270 -9.186 -0.982 1.00 0.00 H ATOM 34 HA3 GLY A 3 8.340 -7.938 -2.216 1.00 0.00 H ATOM 35 N PHE A 4 9.500 -7.644 0.533 1.00 0.00 N ATOM 36 CA PHE A 4 10.122 -6.816 1.571 1.00 0.00 C ATOM 37 C PHE A 4 9.185 -6.672 2.774 1.00 0.00 C ATOM 38 O PHE A 4 7.976 -6.493 2.609 1.00 0.00 O ATOM 39 CB PHE A 4 10.492 -5.433 1.012 1.00 0.00 C ATOM 40 CG PHE A 4 11.423 -4.641 1.892 1.00 0.00 C ATOM 41 CD1 PHE A 4 12.587 -5.212 2.389 1.00 0.00 C ATOM 42 CD2 PHE A 4 11.141 -3.320 2.209 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.448 -4.482 3.187 1.00 0.00 C ATOM 44 CE2 PHE A 4 12.001 -2.583 3.005 1.00 0.00 C ATOM 45 CZ PHE A 4 13.156 -3.167 3.495 1.00 0.00 C ATOM 46 H PHE A 4 9.841 -8.551 0.390 1.00 0.00 H ATOM 47 HA PHE A 4 11.023 -7.317 1.893 1.00 0.00 H ATOM 48 HB2 PHE A 4 10.973 -5.558 0.055 1.00 0.00 H ATOM 49 HB3 PHE A 4 9.589 -4.855 0.879 1.00 0.00 H ATOM 50 HD1 PHE A 4 12.817 -6.241 2.150 1.00 0.00 H ATOM 51 HD2 PHE A 4 10.236 -2.866 1.828 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.351 -4.939 3.569 1.00 0.00 H ATOM 53 HE2 PHE A 4 11.772 -1.555 3.244 1.00 0.00 H ATOM 54 HZ PHE A 4 13.828 -2.593 4.116 1.00 0.00 H ATOM 55 N THR A 5 9.745 -6.765 3.982 1.00 0.00 N ATOM 56 CA THR A 5 8.953 -6.657 5.212 1.00 0.00 C ATOM 57 C THR A 5 8.591 -5.199 5.542 1.00 0.00 C ATOM 58 O THR A 5 8.794 -4.731 6.666 1.00 0.00 O ATOM 59 CB THR A 5 9.681 -7.309 6.413 1.00 0.00 C ATOM 60 OG1 THR A 5 8.867 -7.227 7.592 1.00 0.00 O ATOM 61 CG2 THR A 5 11.027 -6.644 6.675 1.00 0.00 C ATOM 62 H THR A 5 10.712 -6.917 4.049 1.00 0.00 H ATOM 63 HA THR A 5 8.033 -7.203 5.050 1.00 0.00 H ATOM 64 HB THR A 5 9.853 -8.350 6.182 1.00 0.00 H ATOM 65 HG1 THR A 5 9.155 -7.885 8.229 1.00 0.00 H ATOM 66 HG21 THR A 5 10.868 -5.650 7.065 1.00 0.00 H ATOM 67 HG22 THR A 5 11.585 -6.584 5.752 1.00 0.00 H ATOM 68 HG23 THR A 5 11.582 -7.229 7.393 1.00 0.00 H ATOM 69 N GLY A 6 8.038 -4.489 4.557 1.00 0.00 N ATOM 70 CA GLY A 6 7.638 -3.107 4.758 1.00 0.00 C ATOM 71 C GLY A 6 6.199 -2.990 5.229 1.00 0.00 C ATOM 72 O GLY A 6 5.900 -2.222 6.145 1.00 0.00 O ATOM 73 H GLY A 6 7.886 -4.912 3.687 1.00 0.00 H ATOM 74 HA2 GLY A 6 8.286 -2.658 5.498 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.746 -2.573 3.827 1.00 0.00 H ATOM 76 N LYS A 7 5.303 -3.756 4.595 1.00 0.00 N ATOM 77 CA LYS A 7 3.881 -3.740 4.942 1.00 0.00 C ATOM 78 C LYS A 7 3.552 -4.705 6.092 1.00 0.00 C ATOM 79 O LYS A 7 2.406 -5.141 6.223 1.00 0.00 O ATOM 80 CB LYS A 7 3.038 -4.121 3.722 1.00 0.00 C ATOM 81 CG LYS A 7 3.242 -5.564 3.286 1.00 0.00 C ATOM 82 CD LYS A 7 2.039 -6.100 2.530 1.00 0.00 C ATOM 83 CE LYS A 7 1.760 -7.549 2.905 1.00 0.00 C ATOM 84 NZ LYS A 7 1.447 -7.689 4.330 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.609 -4.344 3.872 1.00 0.00 H ATOM 86 HA LYS A 7 3.621 -2.736 5.245 1.00 0.00 H ATOM 87 HB2 LYS A 7 1.993 -3.980 3.959 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.303 -3.476 2.897 1.00 0.00 H ATOM 89 HG2 LYS A 7 4.108 -5.615 2.643 1.00 0.00 H ATOM 90 HG3 LYS A 7 3.408 -6.174 4.161 1.00 0.00 H ATOM 91 HD2 LYS A 7 1.174 -5.501 2.772 1.00 0.00 H ATOM 92 HD3 LYS A 7 2.236 -6.043 1.470 1.00 0.00 H ATOM 93 HE2 LYS A 7 0.925 -7.905 2.323 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.636 -8.141 2.679 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.191 -7.632 4.966 1.00 0.00 H ATOM 96 N ARG A 8 4.542 -5.038 6.927 1.00 0.00 N ATOM 97 CA ARG A 8 4.314 -5.947 8.048 1.00 0.00 C ATOM 98 C ARG A 8 3.219 -5.390 8.952 1.00 0.00 C ATOM 99 O ARG A 8 2.395 -6.132 9.487 1.00 0.00 O ATOM 100 CB ARG A 8 5.610 -6.168 8.838 1.00 0.00 C ATOM 101 CG ARG A 8 5.467 -7.138 10.003 1.00 0.00 C ATOM 102 CD ARG A 8 4.967 -8.505 9.547 1.00 0.00 C ATOM 103 NE ARG A 8 5.880 -9.151 8.599 1.00 0.00 N ATOM 104 CZ ARG A 8 7.099 -9.605 8.912 1.00 0.00 C ATOM 105 NH1 ARG A 8 7.565 -9.509 10.155 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 7.854 -10.167 7.974 1.00 0.00 N ATOM 107 H ARG A 8 5.437 -4.667 6.787 1.00 0.00 H ATOM 108 HA ARG A 8 3.982 -6.892 7.644 1.00 0.00 H ATOM 109 HB2 ARG A 8 6.362 -6.556 8.167 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.946 -5.219 9.228 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.429 -7.260 10.476 1.00 0.00 H ATOM 112 HG3 ARG A 8 4.765 -6.729 10.714 1.00 0.00 H ATOM 113 HD2 ARG A 8 4.857 -9.140 10.412 1.00 0.00 H ATOM 114 HD3 ARG A 8 4.004 -8.380 9.072 1.00 0.00 H ATOM 115 HE ARG A 8 5.568 -9.249 7.675 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.004 -9.095 10.872 1.00 0.00 H ATOM 117 HH12 ARG A 8 8.478 -9.852 10.374 1.00 0.00 H ATOM 118 HH21 ARG A 8 7.510 -10.248 7.038 1.00 0.00 H ATOM 119 HH22 ARG A 8 8.764 -10.509 8.204 1.00 0.00 H ATOM 120 N LYS A 9 3.213 -4.070 9.092 1.00 0.00 N ATOM 121 CA LYS A 9 2.216 -3.381 9.904 1.00 0.00 C ATOM 122 C LYS A 9 0.838 -3.433 9.239 1.00 0.00 C ATOM 123 O LYS A 9 -0.172 -3.654 9.907 1.00 0.00 O ATOM 124 CB LYS A 9 2.642 -1.924 10.120 1.00 0.00 C ATOM 125 CG LYS A 9 1.620 -1.076 10.863 1.00 0.00 C ATOM 126 CD LYS A 9 1.398 -1.572 12.285 1.00 0.00 C ATOM 127 CE LYS A 9 0.392 -0.703 13.026 1.00 0.00 C ATOM 128 NZ LYS A 9 0.810 0.729 13.074 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.890 -3.541 8.622 1.00 0.00 H ATOM 130 HA LYS A 9 2.162 -3.880 10.859 1.00 0.00 H ATOM 131 HB2 LYS A 9 3.562 -1.912 10.686 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.820 -1.469 9.157 1.00 0.00 H ATOM 133 HG2 LYS A 9 1.974 -0.058 10.900 1.00 0.00 H ATOM 134 HG3 LYS A 9 0.684 -1.113 10.329 1.00 0.00 H ATOM 135 HD2 LYS A 9 1.027 -2.585 12.250 1.00 0.00 H ATOM 136 HD3 LYS A 9 2.339 -1.549 12.816 1.00 0.00 H ATOM 137 HE2 LYS A 9 -0.562 -0.771 12.522 1.00 0.00 H ATOM 138 HE3 LYS A 9 0.290 -1.073 14.035 1.00 0.00 H ATOM 139 HZ1 LYS A 9 0.563 1.140 13.997 1.00 0.00 H ATOM 140 HZ2 LYS A 9 0.328 1.268 12.327 1.00 0.00 H ATOM 141 HZ3 LYS A 9 1.838 0.809 12.935 1.00 0.00 H ATOM 142 N SER A 10 0.809 -3.216 7.920 1.00 0.00 N ATOM 143 CA SER A 10 -0.439 -3.224 7.155 1.00 0.00 C ATOM 144 C SER A 10 -1.127 -4.589 7.202 1.00 0.00 C ATOM 145 O SER A 10 -2.312 -4.678 7.522 1.00 0.00 O ATOM 146 CB SER A 10 -0.176 -2.828 5.699 1.00 0.00 C ATOM 147 OG SER A 10 0.382 -1.528 5.615 1.00 0.00 O ATOM 148 H SER A 10 1.652 -3.039 7.451 1.00 0.00 H ATOM 149 HA SER A 10 -1.097 -2.494 7.598 1.00 0.00 H ATOM 150 HB2 SER A 10 0.514 -3.530 5.257 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.106 -2.845 5.150 1.00 0.00 H ATOM 152 HG SER A 10 1.140 -1.541 5.026 1.00 0.00 H ATOM 153 N ASP A 11 -0.379 -5.647 6.880 1.00 0.00 N ATOM 154 CA ASP A 11 -0.927 -7.005 6.889 1.00 0.00 C ATOM 155 C ASP A 11 -1.361 -7.419 8.295 1.00 0.00 C ATOM 156 O ASP A 11 -2.416 -8.030 8.465 1.00 0.00 O ATOM 157 CB ASP A 11 0.078 -8.010 6.314 1.00 0.00 C ATOM 158 CG ASP A 11 0.215 -7.888 4.803 1.00 0.00 C ATOM 159 OD1 ASP A 11 -0.774 -7.977 4.074 1.00 0.00 O ATOM 160 H ASP A 11 0.559 -5.511 6.634 1.00 0.00 H ATOM 161 HA ASP A 11 -1.803 -6.998 6.258 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.046 -7.838 6.760 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.249 -9.013 6.548 1.00 0.00 H ATOM 164 N ARG A 12 -0.556 -7.066 9.301 1.00 0.00 N ATOM 165 CA ARG A 12 -0.881 -7.389 10.690 1.00 0.00 C ATOM 166 C ARG A 12 -2.162 -6.671 11.117 1.00 0.00 C ATOM 167 O ARG A 12 -3.045 -7.272 11.733 1.00 0.00 O ATOM 168 CB ARG A 12 0.278 -7.005 11.621 1.00 0.00 C ATOM 169 CG ARG A 12 -0.032 -7.190 13.100 1.00 0.00 C ATOM 170 CD ARG A 12 -0.440 -8.621 13.416 1.00 0.00 C ATOM 171 NE ARG A 12 -0.827 -8.786 14.817 1.00 0.00 N ATOM 172 CZ ARG A 12 -1.258 -9.933 15.345 1.00 0.00 C ATOM 173 NH1 ARG A 12 -1.360 -11.028 14.594 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -1.589 -9.987 16.631 1.00 0.00 N ATOM 175 H ARG A 12 0.265 -6.568 9.105 1.00 0.00 H ATOM 176 HA ARG A 12 -1.044 -8.454 10.751 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.136 -7.614 11.378 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.526 -5.967 11.455 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.848 -6.945 13.674 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.838 -6.527 13.375 1.00 0.00 H ATOM 181 HD2 ARG A 12 -1.277 -8.891 12.788 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.394 -9.274 13.203 1.00 0.00 H ATOM 183 HE ARG A 12 -0.764 -7.997 15.397 1.00 0.00 H ATOM 184 HH11 ARG A 12 -1.114 -10.997 13.625 1.00 0.00 H ATOM 185 HH12 ARG A 12 -1.683 -11.884 14.999 1.00 0.00 H ATOM 186 HH21 ARG A 12 -1.515 -9.169 17.201 1.00 0.00 H ATOM 187 HH22 ARG A 12 -1.911 -10.846 17.030 1.00 0.00 H ATOM 188 N LYS A 13 -2.254 -5.386 10.773 1.00 0.00 N ATOM 189 CA LYS A 13 -3.424 -4.575 11.102 1.00 0.00 C ATOM 190 C LYS A 13 -4.677 -5.155 10.449 1.00 0.00 C ATOM 191 O LYS A 13 -5.717 -5.291 11.093 1.00 0.00 O ATOM 192 CB LYS A 13 -3.215 -3.133 10.634 1.00 0.00 C ATOM 193 CG LYS A 13 -4.316 -2.178 11.069 1.00 0.00 C ATOM 194 CD LYS A 13 -4.189 -0.811 10.403 1.00 0.00 C ATOM 195 CE LYS A 13 -2.853 -0.138 10.703 1.00 0.00 C ATOM 196 NZ LYS A 13 -1.729 -0.731 9.921 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.516 -4.975 10.276 1.00 0.00 H ATOM 198 HA LYS A 13 -3.549 -4.586 12.172 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.280 -2.773 11.036 1.00 0.00 H ATOM 200 HB3 LYS A 13 -3.161 -3.121 9.555 1.00 0.00 H ATOM 201 HG2 LYS A 13 -5.271 -2.605 10.804 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.263 -2.052 12.141 1.00 0.00 H ATOM 203 HD2 LYS A 13 -4.281 -0.936 9.335 1.00 0.00 H ATOM 204 HD3 LYS A 13 -4.988 -0.176 10.759 1.00 0.00 H ATOM 205 HE2 LYS A 13 -2.932 0.911 10.459 1.00 0.00 H ATOM 206 HE3 LYS A 13 -2.642 -0.245 11.757 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -2.097 -1.275 9.115 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -1.169 -1.365 10.524 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -1.107 0.022 9.562 1.00 0.00 H ATOM 210 N LYS A 14 -4.559 -5.502 9.166 1.00 0.00 N ATOM 211 CA LYS A 14 -5.669 -6.079 8.413 1.00 0.00 C ATOM 212 C LYS A 14 -6.071 -7.440 8.967 1.00 0.00 C ATOM 213 O LYS A 14 -7.255 -7.741 9.070 1.00 0.00 O ATOM 214 CB LYS A 14 -5.315 -6.200 6.927 1.00 0.00 C ATOM 215 CG LYS A 14 -5.661 -4.964 6.115 1.00 0.00 C ATOM 216 CD LYS A 14 -7.153 -4.634 6.170 1.00 0.00 C ATOM 217 CE LYS A 14 -8.014 -5.694 5.486 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.306 -6.843 6.353 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.697 -5.371 8.716 1.00 0.00 H ATOM 220 HA LYS A 14 -6.510 -5.409 8.516 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.252 -6.373 6.840 1.00 0.00 H ATOM 222 HB3 LYS A 14 -5.840 -7.043 6.507 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.106 -4.123 6.505 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.379 -5.134 5.086 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.455 -4.560 7.203 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.316 -3.684 5.682 1.00 0.00 H ATOM 227 HE2 LYS A 14 -8.945 -5.241 5.186 1.00 0.00 H ATOM 228 HE3 LYS A 14 -7.492 -6.045 4.607 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -7.555 -7.277 6.801 1.00 0.00 H ATOM 230 N LYS A 15 -5.085 -8.257 9.327 1.00 0.00 N ATOM 231 CA LYS A 15 -5.358 -9.584 9.876 1.00 0.00 C ATOM 232 C LYS A 15 -6.265 -9.488 11.103 1.00 0.00 C ATOM 233 O LYS A 15 -7.145 -10.326 11.303 1.00 0.00 O ATOM 234 CB LYS A 15 -4.049 -10.299 10.232 1.00 0.00 C ATOM 235 CG LYS A 15 -4.250 -11.654 10.898 1.00 0.00 C ATOM 236 CD LYS A 15 -5.110 -12.578 10.047 1.00 0.00 C ATOM 237 CE LYS A 15 -5.365 -13.908 10.743 1.00 0.00 C ATOM 238 NZ LYS A 15 -6.076 -13.734 12.043 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.157 -7.962 9.225 1.00 0.00 H ATOM 240 HA LYS A 15 -5.870 -10.153 9.115 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.478 -10.450 9.328 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.480 -9.674 10.903 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.286 -12.115 11.049 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.734 -11.503 11.852 1.00 0.00 H ATOM 245 HD2 LYS A 15 -6.057 -12.098 9.857 1.00 0.00 H ATOM 246 HD3 LYS A 15 -4.603 -12.763 9.111 1.00 0.00 H ATOM 247 HE2 LYS A 15 -5.966 -14.527 10.095 1.00 0.00 H ATOM 248 HE3 LYS A 15 -4.417 -14.393 10.923 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -6.887 -13.092 11.925 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -5.430 -13.330 12.751 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -6.420 -14.652 12.388 1.00 0.00 H ATOM 252 N ASN A 16 -6.041 -8.458 11.920 1.00 0.00 N ATOM 253 CA ASN A 16 -6.831 -8.242 13.129 1.00 0.00 C ATOM 254 C ASN A 16 -8.195 -7.620 12.812 1.00 0.00 C ATOM 255 O ASN A 16 -9.217 -8.052 13.348 1.00 0.00 O ATOM 256 CB ASN A 16 -6.062 -7.346 14.106 1.00 0.00 C ATOM 257 CG ASN A 16 -6.749 -7.227 15.455 1.00 0.00 C ATOM 258 OD1 ASN A 16 -6.929 -8.218 16.163 1.00 0.00 O ATOM 259 ND2 ASN A 16 -7.139 -6.008 15.817 1.00 0.00 N ATOM 260 H ASN A 16 -5.323 -7.825 11.702 1.00 0.00 H ATOM 261 HA ASN A 16 -6.991 -9.202 13.591 1.00 0.00 H ATOM 262 HB2 ASN A 16 -5.075 -7.757 14.262 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.970 -6.357 13.680 1.00 0.00 H ATOM 264 HD21 ASN A 16 -6.966 -5.263 15.205 1.00 0.00 H ATOM 265 HD22 ASN A 16 -7.584 -5.905 16.684 1.00 0.00 H ATOM 266 N GLN A 17 -8.204 -6.592 11.957 1.00 0.00 N ATOM 267 CA GLN A 17 -9.447 -5.902 11.597 1.00 0.00 C ATOM 268 C GLN A 17 -10.333 -6.770 10.695 1.00 0.00 C ATOM 269 O GLN A 17 -11.534 -6.896 10.939 1.00 0.00 O ATOM 270 CB GLN A 17 -9.135 -4.537 10.944 1.00 0.00 C ATOM 271 CG GLN A 17 -8.944 -4.559 9.429 1.00 0.00 C ATOM 272 CD GLN A 17 -10.245 -4.522 8.624 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.212 -4.559 7.396 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.397 -4.433 9.293 1.00 0.00 N ATOM 275 H GLN A 17 -7.357 -6.283 11.574 1.00 0.00 H ATOM 276 HA GLN A 17 -9.986 -5.722 12.514 1.00 0.00 H ATOM 277 HB2 GLN A 17 -9.937 -3.854 11.170 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.226 -4.153 11.384 1.00 0.00 H ATOM 279 HG2 GLN A 17 -8.352 -3.702 9.148 1.00 0.00 H ATOM 280 HG3 GLN A 17 -8.404 -5.457 9.165 1.00 0.00 H ATOM 281 HE21 GLN A 17 -11.373 -4.394 10.269 1.00 0.00 H ATOM 282 HE22 GLN A 17 -12.228 -4.411 8.774 1.00 0.00 H ATOM 283 N ASP A 18 -9.736 -7.375 9.665 1.00 0.00 N ATOM 284 CA ASP A 18 -10.474 -8.238 8.742 1.00 0.00 C ATOM 285 C ASP A 18 -10.868 -9.550 9.416 1.00 0.00 C ATOM 286 O ASP A 18 -12.031 -9.950 9.383 1.00 0.00 O ATOM 287 CB ASP A 18 -9.644 -8.528 7.482 1.00 0.00 C ATOM 288 CG ASP A 18 -9.534 -7.327 6.556 1.00 0.00 C ATOM 289 OD1 ASP A 18 -10.541 -6.850 6.028 1.00 0.00 O ATOM 290 H ASP A 18 -8.776 -7.242 9.530 1.00 0.00 H ATOM 291 HA ASP A 18 -11.374 -7.715 8.453 1.00 0.00 H ATOM 292 HB2 ASP A 18 -8.649 -8.823 7.775 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.107 -9.337 6.936 1.00 0.00 H HETATM 294 N NH2 A 19 -9.898 -10.223 10.031 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.992 -9.848 10.019 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.129 -11.067 10.470 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 3 ATOM 1 N PHE A 1 15.372 -1.280 7.782 1.00 0.00 N ATOM 2 CA PHE A 1 14.033 -1.328 7.202 1.00 0.00 C ATOM 3 C PHE A 1 14.065 -1.974 5.820 1.00 0.00 C ATOM 4 O PHE A 1 14.984 -1.734 5.034 1.00 0.00 O ATOM 5 CB PHE A 1 13.432 0.079 7.102 1.00 0.00 C ATOM 6 CG PHE A 1 13.308 0.787 8.426 1.00 0.00 C ATOM 7 CD1 PHE A 1 14.436 1.125 9.157 1.00 0.00 C ATOM 8 CD2 PHE A 1 12.062 1.113 8.936 1.00 0.00 C ATOM 9 CE1 PHE A 1 14.323 1.775 10.371 1.00 0.00 C ATOM 10 CE2 PHE A 1 11.943 1.763 10.149 1.00 0.00 C ATOM 11 CZ PHE A 1 13.075 2.094 10.867 1.00 0.00 C ATOM 12 H1 PHE A 1 16.105 -0.890 7.261 1.00 0.00 H ATOM 13 HA PHE A 1 13.412 -1.927 7.851 1.00 0.00 H ATOM 14 HB2 PHE A 1 14.057 0.683 6.462 1.00 0.00 H ATOM 15 HB3 PHE A 1 12.445 0.009 6.668 1.00 0.00 H ATOM 16 HD1 PHE A 1 15.413 0.877 8.771 1.00 0.00 H ATOM 17 HD2 PHE A 1 11.175 0.853 8.375 1.00 0.00 H ATOM 18 HE1 PHE A 1 15.209 2.032 10.932 1.00 0.00 H ATOM 19 HE2 PHE A 1 10.966 2.012 10.536 1.00 0.00 H ATOM 20 HZ PHE A 1 12.985 2.603 11.816 1.00 0.00 H ATOM 21 N GLY A 2 13.053 -2.795 5.532 1.00 0.00 N ATOM 22 CA GLY A 2 12.975 -3.467 4.247 1.00 0.00 C ATOM 23 C GLY A 2 12.893 -2.497 3.082 1.00 0.00 C ATOM 24 O GLY A 2 12.132 -1.527 3.129 1.00 0.00 O ATOM 25 H GLY A 2 12.351 -2.944 6.201 1.00 0.00 H ATOM 26 HA2 GLY A 2 13.852 -4.087 4.124 1.00 0.00 H ATOM 27 HA3 GLY A 2 12.098 -4.097 4.236 1.00 0.00 H ATOM 28 N GLY A 3 13.679 -2.761 2.036 1.00 0.00 N ATOM 29 CA GLY A 3 13.686 -1.901 0.861 1.00 0.00 C ATOM 30 C GLY A 3 12.315 -1.776 0.216 1.00 0.00 C ATOM 31 O GLY A 3 11.945 -0.703 -0.262 1.00 0.00 O ATOM 32 H GLY A 3 14.261 -3.549 2.062 1.00 0.00 H ATOM 33 HA2 GLY A 3 14.028 -0.918 1.149 1.00 0.00 H ATOM 34 HA3 GLY A 3 14.375 -2.310 0.136 1.00 0.00 H ATOM 35 N PHE A 4 11.564 -2.879 0.205 1.00 0.00 N ATOM 36 CA PHE A 4 10.226 -2.901 -0.382 1.00 0.00 C ATOM 37 C PHE A 4 9.330 -3.927 0.322 1.00 0.00 C ATOM 38 O PHE A 4 8.676 -4.751 -0.321 1.00 0.00 O ATOM 39 CB PHE A 4 10.306 -3.189 -1.891 1.00 0.00 C ATOM 40 CG PHE A 4 11.307 -4.253 -2.270 1.00 0.00 C ATOM 41 CD1 PHE A 4 11.389 -5.445 -1.566 1.00 0.00 C ATOM 42 CD2 PHE A 4 12.171 -4.051 -3.335 1.00 0.00 C ATOM 43 CE1 PHE A 4 12.313 -6.411 -1.917 1.00 0.00 C ATOM 44 CE2 PHE A 4 13.095 -5.014 -3.689 1.00 0.00 C ATOM 45 CZ PHE A 4 13.166 -6.194 -2.980 1.00 0.00 C ATOM 46 H PHE A 4 11.921 -3.701 0.604 1.00 0.00 H ATOM 47 HA PHE A 4 9.794 -1.921 -0.240 1.00 0.00 H ATOM 48 HB2 PHE A 4 9.337 -3.513 -2.238 1.00 0.00 H ATOM 49 HB3 PHE A 4 10.578 -2.279 -2.405 1.00 0.00 H ATOM 50 HD1 PHE A 4 10.723 -5.617 -0.736 1.00 0.00 H ATOM 51 HD2 PHE A 4 12.117 -3.127 -3.892 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.368 -7.334 -1.360 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.761 -4.842 -4.521 1.00 0.00 H ATOM 54 HZ PHE A 4 13.888 -6.949 -3.256 1.00 0.00 H ATOM 55 N THR A 5 9.306 -3.860 1.655 1.00 0.00 N ATOM 56 CA THR A 5 8.497 -4.771 2.463 1.00 0.00 C ATOM 57 C THR A 5 8.291 -4.218 3.881 1.00 0.00 C ATOM 58 O THR A 5 8.317 -4.962 4.866 1.00 0.00 O ATOM 59 CB THR A 5 9.144 -6.178 2.530 1.00 0.00 C ATOM 60 OG1 THR A 5 8.305 -7.082 3.265 1.00 0.00 O ATOM 61 CG2 THR A 5 10.526 -6.119 3.172 1.00 0.00 C ATOM 62 H THR A 5 9.847 -3.178 2.107 1.00 0.00 H ATOM 63 HA THR A 5 7.532 -4.868 1.985 1.00 0.00 H ATOM 64 HB THR A 5 9.254 -6.549 1.522 1.00 0.00 H ATOM 65 HG1 THR A 5 8.333 -6.863 4.200 1.00 0.00 H ATOM 66 HG21 THR A 5 10.438 -5.764 4.190 1.00 0.00 H ATOM 67 HG22 THR A 5 11.157 -5.446 2.611 1.00 0.00 H ATOM 68 HG23 THR A 5 10.965 -7.107 3.172 1.00 0.00 H ATOM 69 N GLY A 6 8.076 -2.901 3.976 1.00 0.00 N ATOM 70 CA GLY A 6 7.861 -2.272 5.270 1.00 0.00 C ATOM 71 C GLY A 6 6.388 -2.145 5.639 1.00 0.00 C ATOM 72 O GLY A 6 6.042 -1.400 6.557 1.00 0.00 O ATOM 73 H GLY A 6 8.057 -2.356 3.162 1.00 0.00 H ATOM 74 HA2 GLY A 6 8.358 -2.857 6.029 1.00 0.00 H ATOM 75 HA3 GLY A 6 8.299 -1.285 5.251 1.00 0.00 H ATOM 76 N LYS A 7 5.518 -2.874 4.931 1.00 0.00 N ATOM 77 CA LYS A 7 4.081 -2.836 5.198 1.00 0.00 C ATOM 78 C LYS A 7 3.665 -3.998 6.116 1.00 0.00 C ATOM 79 O LYS A 7 2.592 -4.577 5.955 1.00 0.00 O ATOM 80 CB LYS A 7 3.308 -2.905 3.876 1.00 0.00 C ATOM 81 CG LYS A 7 1.820 -2.619 4.009 1.00 0.00 C ATOM 82 CD LYS A 7 1.039 -3.154 2.817 1.00 0.00 C ATOM 83 CE LYS A 7 1.206 -4.662 2.673 1.00 0.00 C ATOM 84 NZ LYS A 7 0.972 -5.358 3.937 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.851 -3.453 4.214 1.00 0.00 H ATOM 86 HA LYS A 7 3.856 -1.902 5.691 1.00 0.00 H ATOM 87 HB2 LYS A 7 3.729 -2.183 3.190 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.426 -3.893 3.457 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.449 -3.086 4.908 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.674 -1.550 4.072 1.00 0.00 H ATOM 91 HD2 LYS A 7 -0.009 -2.928 2.953 1.00 0.00 H ATOM 92 HD3 LYS A 7 1.400 -2.673 1.919 1.00 0.00 H ATOM 93 HE2 LYS A 7 0.500 -5.022 1.939 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.211 -4.872 2.337 1.00 0.00 H ATOM 95 HZ1 LYS A 7 1.751 -5.536 4.505 1.00 0.00 H ATOM 96 N ARG A 8 4.524 -4.340 7.076 1.00 0.00 N ATOM 97 CA ARG A 8 4.243 -5.436 8.002 1.00 0.00 C ATOM 98 C ARG A 8 3.191 -5.039 9.034 1.00 0.00 C ATOM 99 O ARG A 8 2.316 -5.834 9.379 1.00 0.00 O ATOM 100 CB ARG A 8 5.530 -5.885 8.696 1.00 0.00 C ATOM 101 CG ARG A 8 6.571 -6.439 7.733 1.00 0.00 C ATOM 102 CD ARG A 8 7.848 -6.842 8.454 1.00 0.00 C ATOM 103 NE ARG A 8 8.532 -5.696 9.058 1.00 0.00 N ATOM 104 CZ ARG A 8 9.689 -5.782 9.720 1.00 0.00 C ATOM 105 NH1 ARG A 8 10.300 -6.955 9.866 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.238 -4.688 10.239 1.00 0.00 N ATOM 107 H ARG A 8 5.369 -3.851 7.161 1.00 0.00 H ATOM 108 HA ARG A 8 3.856 -6.261 7.421 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.961 -5.041 9.215 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.289 -6.655 9.414 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.161 -7.308 7.239 1.00 0.00 H ATOM 112 HG3 ARG A 8 6.805 -5.682 6.998 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.599 -7.549 9.229 1.00 0.00 H ATOM 114 HD3 ARG A 8 8.512 -7.310 7.742 1.00 0.00 H ATOM 115 HE ARG A 8 8.107 -4.817 8.967 1.00 0.00 H ATOM 116 HH11 ARG A 8 9.896 -7.784 9.479 1.00 0.00 H ATOM 117 HH12 ARG A 8 11.166 -7.009 10.363 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.785 -3.802 10.134 1.00 0.00 H ATOM 119 HH22 ARG A 8 11.104 -4.750 10.735 1.00 0.00 H ATOM 120 N LYS A 9 3.285 -3.811 9.527 1.00 0.00 N ATOM 121 CA LYS A 9 2.343 -3.311 10.525 1.00 0.00 C ATOM 122 C LYS A 9 0.946 -3.128 9.925 1.00 0.00 C ATOM 123 O LYS A 9 -0.045 -3.577 10.503 1.00 0.00 O ATOM 124 CB LYS A 9 2.856 -1.987 11.110 1.00 0.00 C ATOM 125 CG LYS A 9 2.103 -1.506 12.347 1.00 0.00 C ATOM 126 CD LYS A 9 0.732 -0.938 12.005 1.00 0.00 C ATOM 127 CE LYS A 9 0.011 -0.437 13.247 1.00 0.00 C ATOM 128 NZ LYS A 9 0.737 0.684 13.907 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.007 -3.227 9.215 1.00 0.00 H ATOM 130 HA LYS A 9 2.286 -4.043 11.315 1.00 0.00 H ATOM 131 HB2 LYS A 9 3.896 -2.107 11.378 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.780 -1.222 10.352 1.00 0.00 H ATOM 133 HG2 LYS A 9 1.974 -2.339 13.021 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.687 -0.738 12.833 1.00 0.00 H ATOM 135 HD2 LYS A 9 0.855 -0.116 11.317 1.00 0.00 H ATOM 136 HD3 LYS A 9 0.137 -1.710 11.544 1.00 0.00 H ATOM 137 HE2 LYS A 9 -0.973 -0.096 12.962 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.083 -1.255 13.946 1.00 0.00 H ATOM 139 HZ1 LYS A 9 1.025 1.391 13.199 1.00 0.00 H ATOM 140 HZ2 LYS A 9 1.587 0.328 14.388 1.00 0.00 H ATOM 141 HZ3 LYS A 9 0.122 1.144 14.609 1.00 0.00 H ATOM 142 N SER A 10 0.875 -2.459 8.773 1.00 0.00 N ATOM 143 CA SER A 10 -0.402 -2.196 8.099 1.00 0.00 C ATOM 144 C SER A 10 -1.167 -3.485 7.787 1.00 0.00 C ATOM 145 O SER A 10 -2.326 -3.634 8.181 1.00 0.00 O ATOM 146 CB SER A 10 -0.164 -1.405 6.808 1.00 0.00 C ATOM 147 OG SER A 10 -1.385 -1.128 6.144 1.00 0.00 O ATOM 148 H SER A 10 1.703 -2.121 8.370 1.00 0.00 H ATOM 149 HA SER A 10 -1.001 -1.598 8.764 1.00 0.00 H ATOM 150 HB2 SER A 10 0.322 -0.470 7.046 1.00 0.00 H ATOM 151 HB3 SER A 10 0.469 -1.980 6.149 1.00 0.00 H ATOM 152 HG SER A 10 -1.260 -0.395 5.538 1.00 0.00 H ATOM 153 N ASP A 11 -0.520 -4.409 7.078 1.00 0.00 N ATOM 154 CA ASP A 11 -1.148 -5.681 6.710 1.00 0.00 C ATOM 155 C ASP A 11 -1.436 -6.541 7.938 1.00 0.00 C ATOM 156 O ASP A 11 -2.482 -7.190 8.013 1.00 0.00 O ATOM 157 CB ASP A 11 -0.276 -6.443 5.707 1.00 0.00 C ATOM 158 CG ASP A 11 -0.228 -5.746 4.359 1.00 0.00 C ATOM 159 OD1 ASP A 11 -1.260 -5.552 3.714 1.00 0.00 O ATOM 160 H ASP A 11 0.400 -4.230 6.790 1.00 0.00 H ATOM 161 HA ASP A 11 -2.089 -5.447 6.236 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.730 -6.516 6.093 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.678 -7.434 5.567 1.00 0.00 H ATOM 164 N ARG A 12 -0.514 -6.536 8.903 1.00 0.00 N ATOM 165 CA ARG A 12 -0.682 -7.309 10.135 1.00 0.00 C ATOM 166 C ARG A 12 -1.959 -6.895 10.866 1.00 0.00 C ATOM 167 O ARG A 12 -2.712 -7.743 11.346 1.00 0.00 O ATOM 168 CB ARG A 12 0.534 -7.123 11.052 1.00 0.00 C ATOM 169 CG ARG A 12 0.405 -7.822 12.399 1.00 0.00 C ATOM 170 CD ARG A 12 0.248 -9.329 12.249 1.00 0.00 C ATOM 171 NE ARG A 12 1.430 -9.955 11.655 1.00 0.00 N ATOM 172 CZ ARG A 12 1.566 -11.272 11.473 1.00 0.00 C ATOM 173 NH1 ARG A 12 0.602 -12.112 11.841 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 2.677 -11.752 10.924 1.00 0.00 N ATOM 175 H ARG A 12 0.293 -5.993 8.788 1.00 0.00 H ATOM 176 HA ARG A 12 -0.761 -8.351 9.862 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.408 -7.512 10.552 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.673 -6.066 11.232 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.291 -7.621 12.982 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.460 -7.429 12.915 1.00 0.00 H ATOM 181 HD2 ARG A 12 0.080 -9.759 13.225 1.00 0.00 H ATOM 182 HD3 ARG A 12 -0.607 -9.527 11.619 1.00 0.00 H ATOM 183 HE ARG A 12 2.161 -9.365 11.376 1.00 0.00 H ATOM 184 HH11 ARG A 12 -0.237 -11.763 12.258 1.00 0.00 H ATOM 185 HH12 ARG A 12 0.717 -13.096 11.702 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.407 -11.129 10.646 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.782 -12.737 10.787 1.00 0.00 H ATOM 188 N LYS A 13 -2.194 -5.584 10.942 1.00 0.00 N ATOM 189 CA LYS A 13 -3.380 -5.052 11.609 1.00 0.00 C ATOM 190 C LYS A 13 -4.648 -5.408 10.841 1.00 0.00 C ATOM 191 O LYS A 13 -5.608 -5.914 11.418 1.00 0.00 O ATOM 192 CB LYS A 13 -3.269 -3.532 11.773 1.00 0.00 C ATOM 193 CG LYS A 13 -2.222 -3.101 12.791 1.00 0.00 C ATOM 194 CD LYS A 13 -2.564 -3.597 14.188 1.00 0.00 C ATOM 195 CE LYS A 13 -1.537 -3.140 15.212 1.00 0.00 C ATOM 196 NZ LYS A 13 -1.858 -3.634 16.581 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.557 -4.960 10.536 1.00 0.00 H ATOM 198 HA LYS A 13 -3.434 -5.504 12.586 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.010 -3.098 10.818 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.227 -3.144 12.086 1.00 0.00 H ATOM 201 HG2 LYS A 13 -1.264 -3.505 12.501 1.00 0.00 H ATOM 202 HG3 LYS A 13 -2.170 -2.021 12.804 1.00 0.00 H ATOM 203 HD2 LYS A 13 -3.531 -3.211 14.469 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.594 -4.677 14.179 1.00 0.00 H ATOM 205 HE2 LYS A 13 -0.566 -3.514 14.922 1.00 0.00 H ATOM 206 HE3 LYS A 13 -1.517 -2.060 15.224 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -1.659 -4.653 16.649 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -2.863 -3.473 16.793 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -1.282 -3.132 17.287 1.00 0.00 H ATOM 210 N LYS A 14 -4.643 -5.151 9.539 1.00 0.00 N ATOM 211 CA LYS A 14 -5.802 -5.456 8.702 1.00 0.00 C ATOM 212 C LYS A 14 -6.195 -6.926 8.824 1.00 0.00 C ATOM 213 O LYS A 14 -7.381 -7.253 8.842 1.00 0.00 O ATOM 214 CB LYS A 14 -5.530 -5.109 7.234 1.00 0.00 C ATOM 215 CG LYS A 14 -6.674 -5.487 6.302 1.00 0.00 C ATOM 216 CD LYS A 14 -7.981 -4.824 6.716 1.00 0.00 C ATOM 217 CE LYS A 14 -9.159 -5.365 5.918 1.00 0.00 C ATOM 218 NZ LYS A 14 -10.113 -6.089 6.760 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.846 -4.751 9.132 1.00 0.00 H ATOM 220 HA LYS A 14 -6.627 -4.853 9.056 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.362 -4.045 7.152 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.643 -5.631 6.910 1.00 0.00 H ATOM 223 HG2 LYS A 14 -6.426 -5.172 5.300 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.802 -6.559 6.322 1.00 0.00 H ATOM 225 HD2 LYS A 14 -8.155 -5.014 7.765 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.904 -3.760 6.548 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.668 -4.538 5.446 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.783 -6.036 5.158 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -10.757 -5.556 7.272 1.00 0.00 H ATOM 230 N LYS A 15 -5.197 -7.811 8.915 1.00 0.00 N ATOM 231 CA LYS A 15 -5.458 -9.244 9.045 1.00 0.00 C ATOM 232 C LYS A 15 -6.313 -9.500 10.284 1.00 0.00 C ATOM 233 O LYS A 15 -7.305 -10.225 10.224 1.00 0.00 O ATOM 234 CB LYS A 15 -4.142 -10.029 9.130 1.00 0.00 C ATOM 235 CG LYS A 15 -4.315 -11.544 9.140 1.00 0.00 C ATOM 236 CD LYS A 15 -4.516 -12.120 7.740 1.00 0.00 C ATOM 237 CE LYS A 15 -5.804 -11.634 7.091 1.00 0.00 C ATOM 238 NZ LYS A 15 -6.064 -12.317 5.792 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.271 -7.492 8.900 1.00 0.00 H ATOM 240 HA LYS A 15 -6.009 -9.557 8.174 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.528 -9.768 8.281 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.627 -9.744 10.035 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.433 -11.991 9.573 1.00 0.00 H ATOM 244 HG3 LYS A 15 -5.176 -11.792 9.746 1.00 0.00 H ATOM 245 HD2 LYS A 15 -3.685 -11.823 7.120 1.00 0.00 H ATOM 246 HD3 LYS A 15 -4.545 -13.198 7.809 1.00 0.00 H ATOM 247 HE2 LYS A 15 -6.627 -11.831 7.761 1.00 0.00 H ATOM 248 HE3 LYS A 15 -5.727 -10.572 6.918 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -5.269 -12.160 5.140 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -6.931 -11.939 5.358 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -6.182 -13.339 5.940 1.00 0.00 H ATOM 252 N ASN A 16 -5.937 -8.868 11.395 1.00 0.00 N ATOM 253 CA ASN A 16 -6.687 -8.991 12.641 1.00 0.00 C ATOM 254 C ASN A 16 -8.050 -8.310 12.500 1.00 0.00 C ATOM 255 O ASN A 16 -9.059 -8.799 13.010 1.00 0.00 O ATOM 256 CB ASN A 16 -5.904 -8.367 13.800 1.00 0.00 C ATOM 257 CG ASN A 16 -6.617 -8.514 15.133 1.00 0.00 C ATOM 258 OD1 ASN A 16 -6.860 -9.627 15.599 1.00 0.00 O ATOM 259 ND2 ASN A 16 -6.960 -7.389 15.753 1.00 0.00 N ATOM 260 H ASN A 16 -5.151 -8.283 11.366 1.00 0.00 H ATOM 261 HA ASN A 16 -6.839 -10.041 12.838 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.940 -8.847 13.875 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.762 -7.314 13.603 1.00 0.00 H ATOM 264 HD21 ASN A 16 -6.739 -6.536 15.324 1.00 0.00 H ATOM 265 HD22 ASN A 16 -7.419 -7.459 16.615 1.00 0.00 H ATOM 266 N GLN A 17 -8.060 -7.178 11.790 1.00 0.00 N ATOM 267 CA GLN A 17 -9.281 -6.410 11.551 1.00 0.00 C ATOM 268 C GLN A 17 -10.296 -7.208 10.728 1.00 0.00 C ATOM 269 O GLN A 17 -11.505 -7.085 10.942 1.00 0.00 O ATOM 270 CB GLN A 17 -8.950 -5.092 10.839 1.00 0.00 C ATOM 271 CG GLN A 17 -8.136 -4.119 11.680 1.00 0.00 C ATOM 272 CD GLN A 17 -8.875 -3.638 12.916 1.00 0.00 C ATOM 273 OE1 GLN A 17 -9.189 -4.423 13.812 1.00 0.00 O ATOM 274 NE2 GLN A 17 -9.161 -2.342 12.972 1.00 0.00 N ATOM 275 H GLN A 17 -7.217 -6.852 11.408 1.00 0.00 H ATOM 276 HA GLN A 17 -9.717 -6.186 12.512 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.390 -5.314 9.945 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.872 -4.606 10.560 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.228 -4.610 11.994 1.00 0.00 H ATOM 280 HG3 GLN A 17 -7.887 -3.261 11.072 1.00 0.00 H ATOM 281 HE21 GLN A 17 -8.886 -1.773 12.222 1.00 0.00 H ATOM 282 HE22 GLN A 17 -9.637 -2.007 13.759 1.00 0.00 H ATOM 283 N ASP A 18 -9.802 -8.021 9.787 1.00 0.00 N ATOM 284 CA ASP A 18 -10.679 -8.829 8.935 1.00 0.00 C ATOM 285 C ASP A 18 -9.985 -10.084 8.387 1.00 0.00 C ATOM 286 O ASP A 18 -10.616 -11.128 8.228 1.00 0.00 O ATOM 287 CB ASP A 18 -11.235 -7.988 7.776 1.00 0.00 C ATOM 288 CG ASP A 18 -10.160 -7.419 6.858 1.00 0.00 C ATOM 289 OD1 ASP A 18 -9.398 -8.163 6.237 1.00 0.00 O ATOM 290 H ASP A 18 -8.832 -8.073 9.664 1.00 0.00 H ATOM 291 HA ASP A 18 -11.508 -9.150 9.549 1.00 0.00 H ATOM 292 HB2 ASP A 18 -11.890 -8.605 7.182 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.803 -7.164 8.185 1.00 0.00 H HETATM 294 N NH2 A 19 -8.693 -9.991 8.078 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.237 -9.140 8.225 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -8.251 -10.784 7.714 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 4 ATOM 1 N PHE A 1 12.421 -15.478 -2.667 1.00 0.00 N ATOM 2 CA PHE A 1 12.311 -14.601 -3.828 1.00 0.00 C ATOM 3 C PHE A 1 11.293 -13.487 -3.577 1.00 0.00 C ATOM 4 O PHE A 1 11.585 -12.310 -3.796 1.00 0.00 O ATOM 5 CB PHE A 1 11.913 -15.410 -5.067 1.00 0.00 C ATOM 6 CG PHE A 1 11.817 -14.591 -6.326 1.00 0.00 C ATOM 7 CD1 PHE A 1 12.867 -13.778 -6.724 1.00 0.00 C ATOM 8 CD2 PHE A 1 10.676 -14.639 -7.112 1.00 0.00 C ATOM 9 CE1 PHE A 1 12.780 -13.028 -7.882 1.00 0.00 C ATOM 10 CE2 PHE A 1 10.585 -13.892 -8.269 1.00 0.00 C ATOM 11 CZ PHE A 1 11.638 -13.085 -8.655 1.00 0.00 C ATOM 12 H1 PHE A 1 12.870 -15.151 -1.860 1.00 0.00 H ATOM 13 HA PHE A 1 13.280 -14.154 -3.996 1.00 0.00 H ATOM 14 HB2 PHE A 1 12.648 -16.184 -5.232 1.00 0.00 H ATOM 15 HB3 PHE A 1 10.950 -15.868 -4.893 1.00 0.00 H ATOM 16 HD1 PHE A 1 13.762 -13.733 -6.120 1.00 0.00 H ATOM 17 HD2 PHE A 1 9.853 -15.268 -6.812 1.00 0.00 H ATOM 18 HE1 PHE A 1 13.605 -12.398 -8.180 1.00 0.00 H ATOM 19 HE2 PHE A 1 9.691 -13.939 -8.874 1.00 0.00 H ATOM 20 HZ PHE A 1 11.568 -12.499 -9.560 1.00 0.00 H ATOM 21 N GLY A 2 10.100 -13.869 -3.115 1.00 0.00 N ATOM 22 CA GLY A 2 9.052 -12.899 -2.836 1.00 0.00 C ATOM 23 C GLY A 2 9.185 -12.264 -1.461 1.00 0.00 C ATOM 24 O GLY A 2 8.256 -12.331 -0.654 1.00 0.00 O ATOM 25 H GLY A 2 9.929 -14.822 -2.960 1.00 0.00 H ATOM 26 HA2 GLY A 2 9.091 -12.120 -3.583 1.00 0.00 H ATOM 27 HA3 GLY A 2 8.094 -13.394 -2.900 1.00 0.00 H ATOM 28 N GLY A 3 10.342 -11.654 -1.192 1.00 0.00 N ATOM 29 CA GLY A 3 10.576 -11.018 0.096 1.00 0.00 C ATOM 30 C GLY A 3 9.808 -9.717 0.264 1.00 0.00 C ATOM 31 O GLY A 3 8.636 -9.629 -0.109 1.00 0.00 O ATOM 32 H GLY A 3 11.046 -11.637 -1.874 1.00 0.00 H ATOM 33 HA2 GLY A 3 10.278 -11.700 0.879 1.00 0.00 H ATOM 34 HA3 GLY A 3 11.632 -10.814 0.195 1.00 0.00 H ATOM 35 N PHE A 4 10.477 -8.708 0.833 1.00 0.00 N ATOM 36 CA PHE A 4 9.877 -7.392 1.069 1.00 0.00 C ATOM 37 C PHE A 4 8.762 -7.466 2.116 1.00 0.00 C ATOM 38 O PHE A 4 7.862 -8.303 2.025 1.00 0.00 O ATOM 39 CB PHE A 4 9.332 -6.797 -0.237 1.00 0.00 C ATOM 40 CG PHE A 4 8.727 -5.428 -0.073 1.00 0.00 C ATOM 41 CD1 PHE A 4 9.437 -4.408 0.543 1.00 0.00 C ATOM 42 CD2 PHE A 4 7.445 -5.164 -0.530 1.00 0.00 C ATOM 43 CE1 PHE A 4 8.880 -3.152 0.697 1.00 0.00 C ATOM 44 CE2 PHE A 4 6.885 -3.910 -0.378 1.00 0.00 C ATOM 45 CZ PHE A 4 7.603 -2.903 0.236 1.00 0.00 C ATOM 46 H PHE A 4 11.408 -8.855 1.106 1.00 0.00 H ATOM 47 HA PHE A 4 10.655 -6.745 1.445 1.00 0.00 H ATOM 48 HB2 PHE A 4 10.137 -6.719 -0.951 1.00 0.00 H ATOM 49 HB3 PHE A 4 8.569 -7.452 -0.632 1.00 0.00 H ATOM 50 HD1 PHE A 4 10.436 -4.601 0.904 1.00 0.00 H ATOM 51 HD2 PHE A 4 6.882 -5.950 -1.011 1.00 0.00 H ATOM 52 HE1 PHE A 4 9.444 -2.366 1.178 1.00 0.00 H ATOM 53 HE2 PHE A 4 5.885 -3.717 -0.740 1.00 0.00 H ATOM 54 HZ PHE A 4 7.166 -1.922 0.355 1.00 0.00 H ATOM 55 N THR A 5 8.830 -6.575 3.106 1.00 0.00 N ATOM 56 CA THR A 5 7.832 -6.524 4.173 1.00 0.00 C ATOM 57 C THR A 5 7.808 -5.135 4.821 1.00 0.00 C ATOM 58 O THR A 5 7.869 -5.001 6.046 1.00 0.00 O ATOM 59 CB THR A 5 8.107 -7.595 5.257 1.00 0.00 C ATOM 60 OG1 THR A 5 8.279 -8.883 4.650 1.00 0.00 O ATOM 61 CG2 THR A 5 6.961 -7.668 6.259 1.00 0.00 C ATOM 62 H THR A 5 9.570 -5.932 3.116 1.00 0.00 H ATOM 63 HA THR A 5 6.864 -6.723 3.735 1.00 0.00 H ATOM 64 HB THR A 5 9.011 -7.330 5.785 1.00 0.00 H ATOM 65 HG1 THR A 5 9.215 -9.085 4.585 1.00 0.00 H ATOM 66 HG21 THR A 5 7.351 -7.546 7.259 1.00 0.00 H ATOM 67 HG22 THR A 5 6.472 -8.627 6.180 1.00 0.00 H ATOM 68 HG23 THR A 5 6.250 -6.883 6.052 1.00 0.00 H ATOM 69 N GLY A 6 7.722 -4.100 3.981 1.00 0.00 N ATOM 70 CA GLY A 6 7.696 -2.732 4.476 1.00 0.00 C ATOM 71 C GLY A 6 6.461 -2.432 5.308 1.00 0.00 C ATOM 72 O GLY A 6 6.570 -1.900 6.414 1.00 0.00 O ATOM 73 H GLY A 6 7.680 -4.266 3.016 1.00 0.00 H ATOM 74 HA2 GLY A 6 8.573 -2.565 5.083 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.721 -2.057 3.633 1.00 0.00 H ATOM 76 N LYS A 7 5.286 -2.772 4.776 1.00 0.00 N ATOM 77 CA LYS A 7 4.023 -2.533 5.478 1.00 0.00 C ATOM 78 C LYS A 7 3.655 -3.728 6.379 1.00 0.00 C ATOM 79 O LYS A 7 2.503 -4.162 6.418 1.00 0.00 O ATOM 80 CB LYS A 7 2.904 -2.226 4.459 1.00 0.00 C ATOM 81 CG LYS A 7 2.211 -3.449 3.855 1.00 0.00 C ATOM 82 CD LYS A 7 3.196 -4.485 3.333 1.00 0.00 C ATOM 83 CE LYS A 7 2.508 -5.817 3.081 1.00 0.00 C ATOM 84 NZ LYS A 7 1.935 -6.370 4.309 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.268 -3.191 3.889 1.00 0.00 H ATOM 86 HA LYS A 7 4.163 -1.666 6.107 1.00 0.00 H ATOM 87 HB2 LYS A 7 2.150 -1.629 4.949 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.327 -1.649 3.650 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.591 -3.908 4.607 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.588 -3.121 3.035 1.00 0.00 H ATOM 91 HD2 LYS A 7 3.625 -4.129 2.408 1.00 0.00 H ATOM 92 HD3 LYS A 7 3.978 -4.628 4.065 1.00 0.00 H ATOM 93 HE2 LYS A 7 1.718 -5.669 2.358 1.00 0.00 H ATOM 94 HE3 LYS A 7 3.232 -6.513 2.685 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.555 -6.597 5.034 1.00 0.00 H ATOM 96 N ARG A 8 4.644 -4.250 7.110 1.00 0.00 N ATOM 97 CA ARG A 8 4.425 -5.388 8.007 1.00 0.00 C ATOM 98 C ARG A 8 3.275 -5.119 8.977 1.00 0.00 C ATOM 99 O ARG A 8 2.515 -6.028 9.315 1.00 0.00 O ATOM 100 CB ARG A 8 5.715 -5.731 8.772 1.00 0.00 C ATOM 101 CG ARG A 8 6.240 -4.618 9.675 1.00 0.00 C ATOM 102 CD ARG A 8 5.574 -4.628 11.047 1.00 0.00 C ATOM 103 NE ARG A 8 5.801 -5.883 11.767 1.00 0.00 N ATOM 104 CZ ARG A 8 6.991 -6.282 12.229 1.00 0.00 C ATOM 105 NH1 ARG A 8 8.067 -5.511 12.091 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 7.100 -7.456 12.844 1.00 0.00 N ATOM 107 H ARG A 8 5.538 -3.862 7.050 1.00 0.00 H ATOM 108 HA ARG A 8 4.155 -6.234 7.392 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.531 -6.600 9.386 1.00 0.00 H ATOM 110 HB3 ARG A 8 6.485 -5.972 8.054 1.00 0.00 H ATOM 111 HG2 ARG A 8 7.303 -4.747 9.804 1.00 0.00 H ATOM 112 HG3 ARG A 8 6.049 -3.666 9.201 1.00 0.00 H ATOM 113 HD2 ARG A 8 5.975 -3.814 11.631 1.00 0.00 H ATOM 114 HD3 ARG A 8 4.513 -4.486 10.922 1.00 0.00 H ATOM 115 HE ARG A 8 5.027 -6.468 11.903 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.995 -4.622 11.640 1.00 0.00 H ATOM 117 HH12 ARG A 8 8.952 -5.821 12.441 1.00 0.00 H ATOM 118 HH21 ARG A 8 6.296 -8.037 12.959 1.00 0.00 H ATOM 119 HH22 ARG A 8 7.988 -7.757 13.191 1.00 0.00 H ATOM 120 N LYS A 9 3.151 -3.865 9.413 1.00 0.00 N ATOM 121 CA LYS A 9 2.090 -3.475 10.337 1.00 0.00 C ATOM 122 C LYS A 9 0.744 -3.393 9.617 1.00 0.00 C ATOM 123 O LYS A 9 -0.276 -3.833 10.146 1.00 0.00 O ATOM 124 CB LYS A 9 2.419 -2.134 10.999 1.00 0.00 C ATOM 125 CG LYS A 9 1.395 -1.698 12.036 1.00 0.00 C ATOM 126 CD LYS A 9 1.794 -0.391 12.702 1.00 0.00 C ATOM 127 CE LYS A 9 0.762 0.049 13.730 1.00 0.00 C ATOM 128 NZ LYS A 9 1.149 1.322 14.400 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.787 -3.186 9.101 1.00 0.00 H ATOM 130 HA LYS A 9 2.026 -4.235 11.101 1.00 0.00 H ATOM 131 HB2 LYS A 9 3.381 -2.212 11.485 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.473 -1.372 10.235 1.00 0.00 H ATOM 133 HG2 LYS A 9 0.440 -1.565 11.551 1.00 0.00 H ATOM 134 HG3 LYS A 9 1.313 -2.465 12.791 1.00 0.00 H ATOM 135 HD2 LYS A 9 2.744 -0.525 13.197 1.00 0.00 H ATOM 136 HD3 LYS A 9 1.885 0.375 11.945 1.00 0.00 H ATOM 137 HE2 LYS A 9 -0.186 0.189 13.232 1.00 0.00 H ATOM 138 HE3 LYS A 9 0.664 -0.726 14.476 1.00 0.00 H ATOM 139 HZ1 LYS A 9 0.392 1.634 15.038 1.00 0.00 H ATOM 140 HZ2 LYS A 9 1.315 2.064 13.690 1.00 0.00 H ATOM 141 HZ3 LYS A 9 2.020 1.185 14.951 1.00 0.00 H ATOM 142 N SER A 10 0.749 -2.825 8.410 1.00 0.00 N ATOM 143 CA SER A 10 -0.472 -2.679 7.615 1.00 0.00 C ATOM 144 C SER A 10 -1.128 -4.032 7.337 1.00 0.00 C ATOM 145 O SER A 10 -2.331 -4.198 7.542 1.00 0.00 O ATOM 146 CB SER A 10 -0.168 -1.970 6.292 1.00 0.00 C ATOM 147 OG SER A 10 0.368 -0.676 6.515 1.00 0.00 O ATOM 148 H SER A 10 1.597 -2.493 8.045 1.00 0.00 H ATOM 149 HA SER A 10 -1.161 -2.075 8.183 1.00 0.00 H ATOM 150 HB2 SER A 10 0.549 -2.551 5.733 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.079 -1.876 5.720 1.00 0.00 H ATOM 152 HG SER A 10 -0.342 -0.031 6.514 1.00 0.00 H ATOM 153 N ASP A 11 -0.332 -4.993 6.867 1.00 0.00 N ATOM 154 CA ASP A 11 -0.839 -6.332 6.556 1.00 0.00 C ATOM 155 C ASP A 11 -1.305 -7.062 7.818 1.00 0.00 C ATOM 156 O ASP A 11 -2.360 -7.697 7.819 1.00 0.00 O ATOM 157 CB ASP A 11 0.230 -7.166 5.839 1.00 0.00 C ATOM 158 CG ASP A 11 0.630 -6.581 4.494 1.00 0.00 C ATOM 159 OD1 ASP A 11 -0.219 -6.331 3.636 1.00 0.00 O ATOM 160 H ASP A 11 0.617 -4.797 6.722 1.00 0.00 H ATOM 161 HA ASP A 11 -1.686 -6.214 5.898 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.110 -7.221 6.461 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.151 -8.164 5.677 1.00 0.00 H ATOM 164 N ARG A 12 -0.508 -6.970 8.884 1.00 0.00 N ATOM 165 CA ARG A 12 -0.832 -7.629 10.153 1.00 0.00 C ATOM 166 C ARG A 12 -2.106 -7.056 10.778 1.00 0.00 C ATOM 167 O ARG A 12 -2.999 -7.808 11.171 1.00 0.00 O ATOM 168 CB ARG A 12 0.339 -7.495 11.133 1.00 0.00 C ATOM 169 CG ARG A 12 0.109 -8.204 12.459 1.00 0.00 C ATOM 170 CD ARG A 12 1.309 -8.061 13.382 1.00 0.00 C ATOM 171 NE ARG A 12 1.114 -8.759 14.653 1.00 0.00 N ATOM 172 CZ ARG A 12 2.024 -8.804 15.630 1.00 0.00 C ATOM 173 NH1 ARG A 12 3.198 -8.193 15.488 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 1.758 -9.463 16.752 1.00 0.00 N ATOM 175 H ARG A 12 0.321 -6.453 8.816 1.00 0.00 H ATOM 176 HA ARG A 12 -0.992 -8.674 9.944 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.224 -7.912 10.676 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.506 -6.447 11.333 1.00 0.00 H ATOM 179 HG2 ARG A 12 -0.756 -7.773 12.942 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.067 -9.253 12.270 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.178 -8.470 12.888 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.470 -7.011 13.581 1.00 0.00 H ATOM 183 HE ARG A 12 0.259 -9.221 14.787 1.00 0.00 H ATOM 184 HH11 ARG A 12 3.408 -7.696 14.647 1.00 0.00 H ATOM 185 HH12 ARG A 12 3.873 -8.234 16.225 1.00 0.00 H ATOM 186 HH21 ARG A 12 0.877 -9.924 16.864 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.437 -9.498 17.485 1.00 0.00 H ATOM 188 N LYS A 13 -2.181 -5.728 10.870 1.00 0.00 N ATOM 189 CA LYS A 13 -3.345 -5.059 11.454 1.00 0.00 C ATOM 190 C LYS A 13 -4.620 -5.376 10.676 1.00 0.00 C ATOM 191 O LYS A 13 -5.638 -5.726 11.268 1.00 0.00 O ATOM 192 CB LYS A 13 -3.130 -3.541 11.506 1.00 0.00 C ATOM 193 CG LYS A 13 -2.027 -3.104 12.460 1.00 0.00 C ATOM 194 CD LYS A 13 -2.361 -3.446 13.904 1.00 0.00 C ATOM 195 CE LYS A 13 -1.269 -2.976 14.852 1.00 0.00 C ATOM 196 NZ LYS A 13 -1.585 -3.298 16.271 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.433 -5.186 10.541 1.00 0.00 H ATOM 198 HA LYS A 13 -3.460 -5.426 12.460 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.877 -3.193 10.516 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.052 -3.071 11.817 1.00 0.00 H ATOM 201 HG2 LYS A 13 -1.110 -3.604 12.188 1.00 0.00 H ATOM 202 HG3 LYS A 13 -1.895 -2.036 12.374 1.00 0.00 H ATOM 203 HD2 LYS A 13 -3.289 -2.966 14.173 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.467 -4.518 13.995 1.00 0.00 H ATOM 205 HE2 LYS A 13 -0.342 -3.458 14.581 1.00 0.00 H ATOM 206 HE3 LYS A 13 -1.160 -1.905 14.752 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -1.627 -4.329 16.402 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -2.503 -2.889 16.536 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -0.851 -2.910 16.898 1.00 0.00 H ATOM 210 N LYS A 14 -4.554 -5.254 9.350 1.00 0.00 N ATOM 211 CA LYS A 14 -5.704 -5.529 8.485 1.00 0.00 C ATOM 212 C LYS A 14 -6.225 -6.952 8.715 1.00 0.00 C ATOM 213 O LYS A 14 -7.432 -7.176 8.771 1.00 0.00 O ATOM 214 CB LYS A 14 -5.310 -5.350 7.008 1.00 0.00 C ATOM 215 CG LYS A 14 -6.420 -4.823 6.098 1.00 0.00 C ATOM 216 CD LYS A 14 -7.737 -5.560 6.296 1.00 0.00 C ATOM 217 CE LYS A 14 -8.655 -4.800 7.246 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.767 -5.605 7.776 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.709 -4.971 8.941 1.00 0.00 H ATOM 220 HA LYS A 14 -6.487 -4.825 8.735 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.484 -4.658 6.955 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.986 -6.305 6.622 1.00 0.00 H ATOM 223 HG2 LYS A 14 -6.575 -3.776 6.311 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.107 -4.937 5.070 1.00 0.00 H ATOM 225 HD2 LYS A 14 -8.228 -5.662 5.340 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.534 -6.537 6.705 1.00 0.00 H ATOM 227 HE2 LYS A 14 -8.067 -4.443 8.077 1.00 0.00 H ATOM 228 HE3 LYS A 14 -9.064 -3.953 6.716 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -10.292 -5.202 8.499 1.00 0.00 H ATOM 230 N LYS A 15 -5.300 -7.907 8.856 1.00 0.00 N ATOM 231 CA LYS A 15 -5.661 -9.308 9.085 1.00 0.00 C ATOM 232 C LYS A 15 -6.501 -9.449 10.351 1.00 0.00 C ATOM 233 O LYS A 15 -7.589 -10.019 10.322 1.00 0.00 O ATOM 234 CB LYS A 15 -4.394 -10.168 9.186 1.00 0.00 C ATOM 235 CG LYS A 15 -4.639 -11.647 9.477 1.00 0.00 C ATOM 236 CD LYS A 15 -5.173 -12.403 8.263 1.00 0.00 C ATOM 237 CE LYS A 15 -6.658 -12.157 8.031 1.00 0.00 C ATOM 238 NZ LYS A 15 -7.491 -12.610 9.181 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.353 -7.663 8.813 1.00 0.00 H ATOM 240 HA LYS A 15 -6.246 -9.634 8.242 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.855 -10.099 8.252 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.771 -9.771 9.975 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.708 -12.099 9.782 1.00 0.00 H ATOM 244 HG3 LYS A 15 -5.355 -11.728 10.282 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.629 -12.084 7.388 1.00 0.00 H ATOM 246 HD3 LYS A 15 -5.015 -13.461 8.418 1.00 0.00 H ATOM 247 HE2 LYS A 15 -6.816 -11.102 7.877 1.00 0.00 H ATOM 248 HE3 LYS A 15 -6.963 -12.696 7.145 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -8.496 -12.621 8.911 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -7.370 -11.967 9.987 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -7.211 -13.569 9.471 1.00 0.00 H ATOM 252 N ASN A 16 -5.996 -8.903 11.455 1.00 0.00 N ATOM 253 CA ASN A 16 -6.713 -8.950 12.732 1.00 0.00 C ATOM 254 C ASN A 16 -8.015 -8.155 12.642 1.00 0.00 C ATOM 255 O ASN A 16 -9.048 -8.570 13.170 1.00 0.00 O ATOM 256 CB ASN A 16 -5.838 -8.401 13.865 1.00 0.00 C ATOM 257 CG ASN A 16 -4.622 -9.268 14.137 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.776 -9.465 13.265 1.00 0.00 O ATOM 259 ND2 ASN A 16 -4.526 -9.792 15.355 1.00 0.00 N ATOM 260 H ASN A 16 -5.130 -8.445 11.405 1.00 0.00 H ATOM 261 HA ASN A 16 -6.950 -9.983 12.939 1.00 0.00 H ATOM 262 HB2 ASN A 16 -5.498 -7.410 13.600 1.00 0.00 H ATOM 263 HB3 ASN A 16 -6.427 -8.343 14.769 1.00 0.00 H ATOM 264 HD21 ASN A 16 -5.236 -9.595 16.004 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.751 -10.355 15.557 1.00 0.00 H ATOM 266 N GLN A 17 -7.947 -7.011 11.961 1.00 0.00 N ATOM 267 CA GLN A 17 -9.098 -6.131 11.773 1.00 0.00 C ATOM 268 C GLN A 17 -10.213 -6.800 10.960 1.00 0.00 C ATOM 269 O GLN A 17 -11.387 -6.467 11.127 1.00 0.00 O ATOM 270 CB GLN A 17 -8.656 -4.835 11.082 1.00 0.00 C ATOM 271 CG GLN A 17 -7.897 -3.875 11.991 1.00 0.00 C ATOM 272 CD GLN A 17 -8.742 -3.352 13.141 1.00 0.00 C ATOM 273 OE1 GLN A 17 -9.177 -4.115 14.004 1.00 0.00 O ATOM 274 NE2 GLN A 17 -8.979 -2.044 13.159 1.00 0.00 N ATOM 275 H GLN A 17 -7.088 -6.749 11.566 1.00 0.00 H ATOM 276 HA GLN A 17 -9.487 -5.887 12.749 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.012 -5.089 10.254 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.525 -4.324 10.699 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.042 -4.390 12.401 1.00 0.00 H ATOM 280 HG3 GLN A 17 -7.559 -3.035 11.401 1.00 0.00 H ATOM 281 HE21 GLN A 17 -8.604 -1.493 12.441 1.00 0.00 H ATOM 282 HE22 GLN A 17 -9.521 -1.683 13.892 1.00 0.00 H ATOM 283 N ASP A 18 -9.844 -7.724 10.066 1.00 0.00 N ATOM 284 CA ASP A 18 -10.829 -8.406 9.219 1.00 0.00 C ATOM 285 C ASP A 18 -10.290 -9.713 8.625 1.00 0.00 C ATOM 286 O ASP A 18 -11.018 -10.699 8.521 1.00 0.00 O ATOM 287 CB ASP A 18 -11.276 -7.465 8.095 1.00 0.00 C ATOM 288 CG ASP A 18 -10.101 -6.837 7.369 1.00 0.00 C ATOM 289 OD1 ASP A 18 -9.502 -7.458 6.492 1.00 0.00 O ATOM 290 H ASP A 18 -8.894 -7.937 9.965 1.00 0.00 H ATOM 291 HA ASP A 18 -11.684 -8.638 9.835 1.00 0.00 H ATOM 292 HB2 ASP A 18 -11.861 -8.022 7.380 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.882 -6.675 8.515 1.00 0.00 H HETATM 294 N NH2 A 19 -9.028 -9.720 8.206 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.493 -8.908 8.316 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -8.684 -10.542 7.801 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 5 ATOM 1 N PHE A 1 20.769 -1.091 -2.244 1.00 0.00 N ATOM 2 CA PHE A 1 19.747 -0.410 -1.454 1.00 0.00 C ATOM 3 C PHE A 1 18.835 -1.421 -0.758 1.00 0.00 C ATOM 4 O PHE A 1 18.659 -2.543 -1.242 1.00 0.00 O ATOM 5 CB PHE A 1 18.922 0.544 -2.332 1.00 0.00 C ATOM 6 CG PHE A 1 19.716 1.687 -2.914 1.00 0.00 C ATOM 7 CD1 PHE A 1 20.784 1.451 -3.766 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.386 3.001 -2.611 1.00 0.00 C ATOM 9 CE1 PHE A 1 21.507 2.499 -4.302 1.00 0.00 C ATOM 10 CE2 PHE A 1 20.107 4.053 -3.145 1.00 0.00 C ATOM 11 CZ PHE A 1 21.168 3.801 -3.992 1.00 0.00 C ATOM 12 H1 PHE A 1 21.640 -0.664 -2.371 1.00 0.00 H ATOM 13 HA PHE A 1 20.254 0.168 -0.695 1.00 0.00 H ATOM 14 HB2 PHE A 1 18.499 -0.012 -3.153 1.00 0.00 H ATOM 15 HB3 PHE A 1 18.123 0.965 -1.740 1.00 0.00 H ATOM 16 HD1 PHE A 1 21.052 0.433 -4.014 1.00 0.00 H ATOM 17 HD2 PHE A 1 18.558 3.199 -1.948 1.00 0.00 H ATOM 18 HE1 PHE A 1 22.338 2.300 -4.964 1.00 0.00 H ATOM 19 HE2 PHE A 1 19.839 5.070 -2.903 1.00 0.00 H ATOM 20 HZ PHE A 1 21.733 4.621 -4.410 1.00 0.00 H ATOM 21 N GLY A 2 18.277 -1.021 0.390 1.00 0.00 N ATOM 22 CA GLY A 2 17.405 -1.904 1.156 1.00 0.00 C ATOM 23 C GLY A 2 16.110 -2.262 0.440 1.00 0.00 C ATOM 24 O GLY A 2 16.091 -2.438 -0.779 1.00 0.00 O ATOM 25 H GLY A 2 18.471 -0.121 0.727 1.00 0.00 H ATOM 26 HA2 GLY A 2 17.942 -2.816 1.369 1.00 0.00 H ATOM 27 HA3 GLY A 2 17.163 -1.420 2.090 1.00 0.00 H ATOM 28 N GLY A 3 15.024 -2.387 1.205 1.00 0.00 N ATOM 29 CA GLY A 3 13.742 -2.746 0.619 1.00 0.00 C ATOM 30 C GLY A 3 12.994 -1.558 0.039 1.00 0.00 C ATOM 31 O GLY A 3 13.598 -0.540 -0.306 1.00 0.00 O ATOM 32 H GLY A 3 15.096 -2.248 2.174 1.00 0.00 H ATOM 33 HA2 GLY A 3 13.912 -3.466 -0.168 1.00 0.00 H ATOM 34 HA3 GLY A 3 13.129 -3.204 1.382 1.00 0.00 H ATOM 35 N PHE A 4 11.669 -1.694 -0.062 1.00 0.00 N ATOM 36 CA PHE A 4 10.815 -0.634 -0.600 1.00 0.00 C ATOM 37 C PHE A 4 9.333 -1.037 -0.554 1.00 0.00 C ATOM 38 O PHE A 4 8.572 -0.771 -1.488 1.00 0.00 O ATOM 39 CB PHE A 4 11.248 -0.284 -2.036 1.00 0.00 C ATOM 40 CG PHE A 4 11.232 -1.454 -2.986 1.00 0.00 C ATOM 41 CD1 PHE A 4 10.090 -1.764 -3.706 1.00 0.00 C ATOM 42 CD2 PHE A 4 12.365 -2.235 -3.164 1.00 0.00 C ATOM 43 CE1 PHE A 4 10.075 -2.832 -4.580 1.00 0.00 C ATOM 44 CE2 PHE A 4 12.354 -3.305 -4.036 1.00 0.00 C ATOM 45 CZ PHE A 4 11.207 -3.604 -4.746 1.00 0.00 C ATOM 46 H PHE A 4 11.255 -2.534 0.232 1.00 0.00 H ATOM 47 HA PHE A 4 10.949 0.236 0.024 1.00 0.00 H ATOM 48 HB2 PHE A 4 10.582 0.470 -2.432 1.00 0.00 H ATOM 49 HB3 PHE A 4 12.252 0.112 -2.015 1.00 0.00 H ATOM 50 HD1 PHE A 4 9.203 -1.160 -3.579 1.00 0.00 H ATOM 51 HD2 PHE A 4 13.262 -2.003 -2.609 1.00 0.00 H ATOM 52 HE1 PHE A 4 9.177 -3.062 -5.134 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.242 -3.905 -4.167 1.00 0.00 H ATOM 54 HZ PHE A 4 11.196 -4.439 -5.430 1.00 0.00 H ATOM 55 N THR A 5 8.929 -1.672 0.552 1.00 0.00 N ATOM 56 CA THR A 5 7.545 -2.113 0.736 1.00 0.00 C ATOM 57 C THR A 5 7.341 -2.746 2.121 1.00 0.00 C ATOM 58 O THR A 5 6.813 -3.856 2.239 1.00 0.00 O ATOM 59 CB THR A 5 7.123 -3.116 -0.369 1.00 0.00 C ATOM 60 OG1 THR A 5 5.772 -3.548 -0.160 1.00 0.00 O ATOM 61 CG2 THR A 5 8.048 -4.327 -0.402 1.00 0.00 C ATOM 62 H THR A 5 9.580 -1.844 1.263 1.00 0.00 H ATOM 63 HA THR A 5 6.910 -1.241 0.659 1.00 0.00 H ATOM 64 HB THR A 5 7.184 -2.616 -1.325 1.00 0.00 H ATOM 65 HG1 THR A 5 5.187 -3.074 -0.755 1.00 0.00 H ATOM 66 HG21 THR A 5 8.803 -4.183 -1.159 1.00 0.00 H ATOM 67 HG22 THR A 5 7.476 -5.214 -0.628 1.00 0.00 H ATOM 68 HG23 THR A 5 8.525 -4.444 0.562 1.00 0.00 H ATOM 69 N GLY A 6 7.764 -2.031 3.167 1.00 0.00 N ATOM 70 CA GLY A 6 7.625 -2.526 4.530 1.00 0.00 C ATOM 71 C GLY A 6 6.184 -2.517 5.018 1.00 0.00 C ATOM 72 O GLY A 6 5.828 -1.717 5.885 1.00 0.00 O ATOM 73 H GLY A 6 8.176 -1.155 3.012 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.998 -3.539 4.574 1.00 0.00 H ATOM 75 HA3 GLY A 6 8.219 -1.908 5.186 1.00 0.00 H ATOM 76 N LYS A 7 5.356 -3.398 4.451 1.00 0.00 N ATOM 77 CA LYS A 7 3.941 -3.480 4.820 1.00 0.00 C ATOM 78 C LYS A 7 3.709 -4.415 6.019 1.00 0.00 C ATOM 79 O LYS A 7 2.777 -5.218 6.011 1.00 0.00 O ATOM 80 CB LYS A 7 3.122 -3.963 3.618 1.00 0.00 C ATOM 81 CG LYS A 7 1.626 -3.714 3.759 1.00 0.00 C ATOM 82 CD LYS A 7 0.822 -4.411 2.669 1.00 0.00 C ATOM 83 CE LYS A 7 0.871 -5.928 2.808 1.00 0.00 C ATOM 84 NZ LYS A 7 0.456 -6.366 4.138 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.701 -4.001 3.760 1.00 0.00 H ATOM 86 HA LYS A 7 3.612 -2.488 5.088 1.00 0.00 H ATOM 87 HB2 LYS A 7 3.469 -3.451 2.734 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.279 -5.025 3.494 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.300 -4.081 4.719 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.445 -2.650 3.701 1.00 0.00 H ATOM 91 HD2 LYS A 7 -0.206 -4.089 2.730 1.00 0.00 H ATOM 92 HD3 LYS A 7 1.229 -4.134 1.707 1.00 0.00 H ATOM 93 HE2 LYS A 7 0.211 -6.366 2.074 1.00 0.00 H ATOM 94 HE3 LYS A 7 1.883 -6.262 2.627 1.00 0.00 H ATOM 95 HZ1 LYS A 7 -0.397 -6.027 4.477 1.00 0.00 H ATOM 96 N ARG A 8 4.547 -4.306 7.051 1.00 0.00 N ATOM 97 CA ARG A 8 4.401 -5.149 8.239 1.00 0.00 C ATOM 98 C ARG A 8 3.116 -4.815 8.997 1.00 0.00 C ATOM 99 O ARG A 8 2.323 -5.701 9.319 1.00 0.00 O ATOM 100 CB ARG A 8 5.610 -4.977 9.168 1.00 0.00 C ATOM 101 CG ARG A 8 6.882 -5.643 8.662 1.00 0.00 C ATOM 102 CD ARG A 8 7.187 -6.922 9.433 1.00 0.00 C ATOM 103 NE ARG A 8 6.172 -7.961 9.232 1.00 0.00 N ATOM 104 CZ ARG A 8 6.035 -8.672 8.107 1.00 0.00 C ATOM 105 NH1 ARG A 8 6.871 -8.496 7.090 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 5.068 -9.579 8.013 1.00 0.00 N ATOM 107 H ARG A 8 5.271 -3.648 7.017 1.00 0.00 H ATOM 108 HA ARG A 8 4.353 -6.175 7.913 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.810 -3.923 9.286 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.370 -5.397 10.133 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.760 -5.883 7.616 1.00 0.00 H ATOM 112 HG3 ARG A 8 7.708 -4.956 8.780 1.00 0.00 H ATOM 113 HD2 ARG A 8 8.142 -7.303 9.104 1.00 0.00 H ATOM 114 HD3 ARG A 8 7.240 -6.687 10.485 1.00 0.00 H ATOM 115 HE ARG A 8 5.553 -8.133 9.971 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.612 -7.828 7.159 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.761 -9.032 6.253 1.00 0.00 H ATOM 118 HH21 ARG A 8 4.446 -9.729 8.780 1.00 0.00 H ATOM 119 HH22 ARG A 8 4.962 -10.112 7.173 1.00 0.00 H ATOM 120 N LYS A 9 2.931 -3.532 9.285 1.00 0.00 N ATOM 121 CA LYS A 9 1.761 -3.056 10.021 1.00 0.00 C ATOM 122 C LYS A 9 0.449 -3.327 9.281 1.00 0.00 C ATOM 123 O LYS A 9 -0.461 -3.938 9.835 1.00 0.00 O ATOM 124 CB LYS A 9 1.898 -1.555 10.299 1.00 0.00 C ATOM 125 CG LYS A 9 0.671 -0.924 10.945 1.00 0.00 C ATOM 126 CD LYS A 9 0.369 -1.501 12.322 1.00 0.00 C ATOM 127 CE LYS A 9 1.458 -1.177 13.333 1.00 0.00 C ATOM 128 NZ LYS A 9 1.064 -1.569 14.717 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.610 -2.883 9.002 1.00 0.00 H ATOM 130 HA LYS A 9 1.734 -3.578 10.963 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.744 -1.396 10.952 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.081 -1.048 9.362 1.00 0.00 H ATOM 133 HG2 LYS A 9 0.838 0.137 11.046 1.00 0.00 H ATOM 134 HG3 LYS A 9 -0.181 -1.092 10.302 1.00 0.00 H ATOM 135 HD2 LYS A 9 -0.564 -1.089 12.674 1.00 0.00 H ATOM 136 HD3 LYS A 9 0.277 -2.575 12.238 1.00 0.00 H ATOM 137 HE2 LYS A 9 2.355 -1.712 13.061 1.00 0.00 H ATOM 138 HE3 LYS A 9 1.650 -0.115 13.309 1.00 0.00 H ATOM 139 HZ1 LYS A 9 0.171 -1.102 14.980 1.00 0.00 H ATOM 140 HZ2 LYS A 9 1.801 -1.286 15.394 1.00 0.00 H ATOM 141 HZ3 LYS A 9 0.933 -2.599 14.775 1.00 0.00 H ATOM 142 N SER A 10 0.349 -2.845 8.044 1.00 0.00 N ATOM 143 CA SER A 10 -0.868 -3.004 7.237 1.00 0.00 C ATOM 144 C SER A 10 -1.298 -4.465 7.078 1.00 0.00 C ATOM 145 O SER A 10 -2.493 -4.769 7.141 1.00 0.00 O ATOM 146 CB SER A 10 -0.669 -2.366 5.861 1.00 0.00 C ATOM 147 OG SER A 10 -1.773 -2.620 5.007 1.00 0.00 O ATOM 148 H SER A 10 1.105 -2.349 7.668 1.00 0.00 H ATOM 149 HA SER A 10 -1.658 -2.475 7.745 1.00 0.00 H ATOM 150 HB2 SER A 10 -0.564 -1.299 5.977 1.00 0.00 H ATOM 151 HB3 SER A 10 0.224 -2.767 5.408 1.00 0.00 H ATOM 152 HG SER A 10 -1.541 -3.312 4.380 1.00 0.00 H ATOM 153 N ASP A 11 -0.335 -5.361 6.859 1.00 0.00 N ATOM 154 CA ASP A 11 -0.639 -6.783 6.673 1.00 0.00 C ATOM 155 C ASP A 11 -1.232 -7.409 7.933 1.00 0.00 C ATOM 156 O ASP A 11 -2.316 -7.993 7.889 1.00 0.00 O ATOM 157 CB ASP A 11 0.620 -7.567 6.267 1.00 0.00 C ATOM 158 CG ASP A 11 1.176 -7.195 4.895 1.00 0.00 C ATOM 159 OD1 ASP A 11 2.253 -7.662 4.520 1.00 0.00 O ATOM 160 H ASP A 11 0.594 -5.061 6.812 1.00 0.00 H ATOM 161 HA ASP A 11 -1.366 -6.859 5.880 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.393 -7.382 6.997 1.00 0.00 H ATOM 163 HB3 ASP A 11 0.389 -8.623 6.264 1.00 0.00 H ATOM 164 N ARG A 12 -0.505 -7.304 9.045 1.00 0.00 N ATOM 165 CA ARG A 12 -0.949 -7.893 10.314 1.00 0.00 C ATOM 166 C ARG A 12 -2.105 -7.119 10.960 1.00 0.00 C ATOM 167 O ARG A 12 -2.976 -7.724 11.590 1.00 0.00 O ATOM 168 CB ARG A 12 0.230 -8.021 11.287 1.00 0.00 C ATOM 169 CG ARG A 12 0.816 -6.695 11.749 1.00 0.00 C ATOM 170 CD ARG A 12 2.302 -6.822 12.057 1.00 0.00 C ATOM 171 NE ARG A 12 2.594 -7.832 13.077 1.00 0.00 N ATOM 172 CZ ARG A 12 3.828 -8.265 13.358 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.872 -7.814 12.664 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 4.019 -9.160 14.323 1.00 0.00 N ATOM 175 H ARG A 12 0.358 -6.839 9.006 1.00 0.00 H ATOM 176 HA ARG A 12 -1.304 -8.886 10.087 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.100 -8.564 12.160 1.00 0.00 H ATOM 178 HB3 ARG A 12 1.016 -8.585 10.803 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.680 -5.960 10.969 1.00 0.00 H ATOM 180 HG3 ARG A 12 0.297 -6.376 12.643 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.817 -7.092 11.148 1.00 0.00 H ATOM 182 HD3 ARG A 12 2.664 -5.865 12.401 1.00 0.00 H ATOM 183 HE ARG A 12 1.838 -8.198 13.586 1.00 0.00 H ATOM 184 HH11 ARG A 12 4.739 -7.150 11.929 1.00 0.00 H ATOM 185 HH12 ARG A 12 5.793 -8.141 12.878 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.239 -9.514 14.840 1.00 0.00 H ATOM 187 HH22 ARG A 12 4.943 -9.482 14.532 1.00 0.00 H ATOM 188 N LYS A 13 -2.113 -5.792 10.815 1.00 0.00 N ATOM 189 CA LYS A 13 -3.173 -4.964 11.401 1.00 0.00 C ATOM 190 C LYS A 13 -4.542 -5.350 10.836 1.00 0.00 C ATOM 191 O LYS A 13 -5.470 -5.652 11.588 1.00 0.00 O ATOM 192 CB LYS A 13 -2.895 -3.476 11.144 1.00 0.00 C ATOM 193 CG LYS A 13 -3.876 -2.535 11.827 1.00 0.00 C ATOM 194 CD LYS A 13 -3.828 -2.668 13.344 1.00 0.00 C ATOM 195 CE LYS A 13 -4.844 -1.748 14.010 1.00 0.00 C ATOM 196 NZ LYS A 13 -4.803 -1.840 15.498 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.395 -5.361 10.308 1.00 0.00 H ATOM 198 HA LYS A 13 -3.175 -5.140 12.466 1.00 0.00 H ATOM 199 HB2 LYS A 13 -1.900 -3.241 11.497 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.940 -3.295 10.080 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.629 -1.520 11.560 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.875 -2.766 11.486 1.00 0.00 H ATOM 203 HD2 LYS A 13 -4.049 -3.689 13.616 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.838 -2.406 13.689 1.00 0.00 H ATOM 205 HE2 LYS A 13 -4.635 -0.732 13.719 1.00 0.00 H ATOM 206 HE3 LYS A 13 -5.831 -2.023 13.670 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -3.840 -2.066 15.819 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -5.450 -2.584 15.829 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -5.094 -0.933 15.918 1.00 0.00 H ATOM 210 N LYS A 14 -4.649 -5.347 9.508 1.00 0.00 N ATOM 211 CA LYS A 14 -5.894 -5.703 8.818 1.00 0.00 C ATOM 212 C LYS A 14 -6.219 -7.188 8.950 1.00 0.00 C ATOM 213 O LYS A 14 -7.390 -7.562 9.018 1.00 0.00 O ATOM 214 CB LYS A 14 -5.809 -5.324 7.340 1.00 0.00 C ATOM 215 CG LYS A 14 -6.040 -3.847 7.077 1.00 0.00 C ATOM 216 CD LYS A 14 -7.463 -3.408 7.426 1.00 0.00 C ATOM 217 CE LYS A 14 -8.510 -4.036 6.507 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.884 -5.402 6.898 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.865 -5.104 8.972 1.00 0.00 H ATOM 220 HA LYS A 14 -6.695 -5.138 9.277 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.826 -5.580 6.975 1.00 0.00 H ATOM 222 HB3 LYS A 14 -6.541 -5.888 6.788 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.346 -3.277 7.676 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.858 -3.648 6.032 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.679 -3.690 8.444 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.522 -2.330 7.334 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.393 -3.419 6.522 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.112 -4.059 5.504 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -8.213 -6.106 6.790 1.00 0.00 H ATOM 230 N LYS A 15 -5.189 -8.036 8.976 1.00 0.00 N ATOM 231 CA LYS A 15 -5.398 -9.478 9.095 1.00 0.00 C ATOM 232 C LYS A 15 -6.312 -9.779 10.284 1.00 0.00 C ATOM 233 O LYS A 15 -7.227 -10.599 10.187 1.00 0.00 O ATOM 234 CB LYS A 15 -4.061 -10.215 9.257 1.00 0.00 C ATOM 235 CG LYS A 15 -4.163 -11.721 9.057 1.00 0.00 C ATOM 236 CD LYS A 15 -4.476 -12.065 7.608 1.00 0.00 C ATOM 237 CE LYS A 15 -4.486 -13.569 7.378 1.00 0.00 C ATOM 238 NZ LYS A 15 -4.802 -13.916 5.964 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.276 -7.687 8.915 1.00 0.00 H ATOM 240 HA LYS A 15 -5.880 -9.817 8.189 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.358 -9.828 8.534 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.680 -10.030 10.251 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.224 -12.178 9.332 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.952 -12.104 9.687 1.00 0.00 H ATOM 245 HD2 LYS A 15 -5.447 -11.668 7.356 1.00 0.00 H ATOM 246 HD3 LYS A 15 -3.726 -11.618 6.972 1.00 0.00 H ATOM 247 HE2 LYS A 15 -3.513 -13.964 7.627 1.00 0.00 H ATOM 248 HE3 LYS A 15 -5.229 -14.013 8.025 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -5.082 -14.916 5.895 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.968 -13.760 5.363 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -5.582 -13.324 5.615 1.00 0.00 H ATOM 252 N ASN A 16 -6.056 -9.093 11.401 1.00 0.00 N ATOM 253 CA ASN A 16 -6.844 -9.261 12.622 1.00 0.00 C ATOM 254 C ASN A 16 -8.102 -8.389 12.603 1.00 0.00 C ATOM 255 O ASN A 16 -9.206 -8.879 12.851 1.00 0.00 O ATOM 256 CB ASN A 16 -5.986 -8.925 13.844 1.00 0.00 C ATOM 257 CG ASN A 16 -4.743 -9.792 13.924 1.00 0.00 C ATOM 258 OD1 ASN A 16 -4.834 -11.006 14.107 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.573 -9.178 13.774 1.00 0.00 N ATOM 260 H ASN A 16 -5.315 -8.447 11.398 1.00 0.00 H ATOM 261 HA ASN A 16 -7.142 -10.295 12.680 1.00 0.00 H ATOM 262 HB2 ASN A 16 -5.682 -7.891 13.789 1.00 0.00 H ATOM 263 HB3 ASN A 16 -6.569 -9.078 14.739 1.00 0.00 H ATOM 264 HD21 ASN A 16 -3.571 -8.208 13.624 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.759 -9.720 13.810 1.00 0.00 H ATOM 266 N GLN A 17 -7.927 -7.097 12.305 1.00 0.00 N ATOM 267 CA GLN A 17 -9.046 -6.149 12.250 1.00 0.00 C ATOM 268 C GLN A 17 -10.162 -6.672 11.352 1.00 0.00 C ATOM 269 O GLN A 17 -11.294 -6.860 11.799 1.00 0.00 O ATOM 270 CB GLN A 17 -8.564 -4.783 11.743 1.00 0.00 C ATOM 271 CG GLN A 17 -7.731 -4.007 12.758 1.00 0.00 C ATOM 272 CD GLN A 17 -8.518 -3.638 14.008 1.00 0.00 C ATOM 273 OE1 GLN A 17 -9.532 -2.945 13.933 1.00 0.00 O ATOM 274 NE2 GLN A 17 -8.049 -4.096 15.166 1.00 0.00 N ATOM 275 H GLN A 17 -7.023 -6.775 12.116 1.00 0.00 H ATOM 276 HA GLN A 17 -9.434 -6.035 13.251 1.00 0.00 H ATOM 277 HB2 GLN A 17 -7.961 -4.936 10.859 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.421 -4.183 11.477 1.00 0.00 H ATOM 279 HG2 GLN A 17 -6.889 -4.614 13.050 1.00 0.00 H ATOM 280 HG3 GLN A 17 -7.375 -3.100 12.293 1.00 0.00 H ATOM 281 HE21 GLN A 17 -7.235 -4.640 15.155 1.00 0.00 H ATOM 282 HE22 GLN A 17 -8.540 -3.871 15.983 1.00 0.00 H ATOM 283 N ASP A 18 -9.826 -6.917 10.089 1.00 0.00 N ATOM 284 CA ASP A 18 -10.790 -7.437 9.127 1.00 0.00 C ATOM 285 C ASP A 18 -11.035 -8.929 9.365 1.00 0.00 C ATOM 286 O ASP A 18 -12.177 -9.383 9.389 1.00 0.00 O ATOM 287 CB ASP A 18 -10.303 -7.207 7.695 1.00 0.00 C ATOM 288 CG ASP A 18 -10.092 -5.736 7.364 1.00 0.00 C ATOM 289 OD1 ASP A 18 -11.006 -4.922 7.505 1.00 0.00 O ATOM 290 H ASP A 18 -8.905 -6.755 9.802 1.00 0.00 H ATOM 291 HA ASP A 18 -11.721 -6.905 9.271 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.368 -7.725 7.551 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.036 -7.607 7.009 1.00 0.00 H HETATM 294 N NH2 A 19 -9.957 -9.696 9.549 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.072 -9.274 9.519 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.094 -10.653 9.710 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 6 ATOM 1 N PHE A 1 2.518 -12.421 -4.545 1.00 0.00 N ATOM 2 CA PHE A 1 2.167 -11.565 -3.417 1.00 0.00 C ATOM 3 C PHE A 1 2.146 -10.097 -3.843 1.00 0.00 C ATOM 4 O PHE A 1 3.013 -9.648 -4.595 1.00 0.00 O ATOM 5 CB PHE A 1 3.162 -11.766 -2.266 1.00 0.00 C ATOM 6 CG PHE A 1 2.778 -11.059 -0.993 1.00 0.00 C ATOM 7 CD1 PHE A 1 1.495 -11.169 -0.483 1.00 0.00 C ATOM 8 CD2 PHE A 1 3.703 -10.285 -0.308 1.00 0.00 C ATOM 9 CE1 PHE A 1 1.140 -10.522 0.685 1.00 0.00 C ATOM 10 CE2 PHE A 1 3.352 -9.636 0.861 1.00 0.00 C ATOM 11 CZ PHE A 1 2.069 -9.755 1.359 1.00 0.00 C ATOM 12 H1 PHE A 1 1.986 -13.226 -4.720 1.00 0.00 H ATOM 13 HA PHE A 1 1.179 -11.846 -3.083 1.00 0.00 H ATOM 14 HB2 PHE A 1 3.237 -12.821 -2.048 1.00 0.00 H ATOM 15 HB3 PHE A 1 4.131 -11.400 -2.573 1.00 0.00 H ATOM 16 HD1 PHE A 1 0.767 -11.770 -1.007 1.00 0.00 H ATOM 17 HD2 PHE A 1 4.707 -10.191 -0.695 1.00 0.00 H ATOM 18 HE1 PHE A 1 0.136 -10.617 1.072 1.00 0.00 H ATOM 19 HE2 PHE A 1 4.082 -9.036 1.387 1.00 0.00 H ATOM 20 HZ PHE A 1 1.794 -9.249 2.271 1.00 0.00 H ATOM 21 N GLY A 2 1.144 -9.357 -3.361 1.00 0.00 N ATOM 22 CA GLY A 2 1.018 -7.948 -3.701 1.00 0.00 C ATOM 23 C GLY A 2 2.068 -7.076 -3.031 1.00 0.00 C ATOM 24 O GLY A 2 3.259 -7.399 -3.050 1.00 0.00 O ATOM 25 H GLY A 2 0.483 -9.773 -2.769 1.00 0.00 H ATOM 26 HA2 GLY A 2 1.109 -7.840 -4.772 1.00 0.00 H ATOM 27 HA3 GLY A 2 0.038 -7.606 -3.400 1.00 0.00 H ATOM 28 N GLY A 3 1.622 -5.963 -2.444 1.00 0.00 N ATOM 29 CA GLY A 3 2.532 -5.044 -1.775 1.00 0.00 C ATOM 30 C GLY A 3 3.322 -5.703 -0.658 1.00 0.00 C ATOM 31 O GLY A 3 2.795 -6.546 0.070 1.00 0.00 O ATOM 32 H GLY A 3 0.664 -5.761 -2.469 1.00 0.00 H ATOM 33 HA2 GLY A 3 3.223 -4.647 -2.504 1.00 0.00 H ATOM 34 HA3 GLY A 3 1.958 -4.228 -1.361 1.00 0.00 H ATOM 35 N PHE A 4 4.592 -5.316 -0.525 1.00 0.00 N ATOM 36 CA PHE A 4 5.459 -5.875 0.509 1.00 0.00 C ATOM 37 C PHE A 4 6.686 -4.991 0.736 1.00 0.00 C ATOM 38 O PHE A 4 7.439 -4.702 -0.197 1.00 0.00 O ATOM 39 CB PHE A 4 5.896 -7.293 0.123 1.00 0.00 C ATOM 40 CG PHE A 4 6.780 -7.965 1.140 1.00 0.00 C ATOM 41 CD1 PHE A 4 6.505 -7.873 2.497 1.00 0.00 C ATOM 42 CD2 PHE A 4 7.888 -8.693 0.735 1.00 0.00 C ATOM 43 CE1 PHE A 4 7.319 -8.492 3.426 1.00 0.00 C ATOM 44 CE2 PHE A 4 8.704 -9.314 1.660 1.00 0.00 C ATOM 45 CZ PHE A 4 8.419 -9.214 3.007 1.00 0.00 C ATOM 46 H PHE A 4 4.954 -4.641 -1.137 1.00 0.00 H ATOM 47 HA PHE A 4 4.891 -5.921 1.426 1.00 0.00 H ATOM 48 HB2 PHE A 4 5.018 -7.907 -0.006 1.00 0.00 H ATOM 49 HB3 PHE A 4 6.436 -7.250 -0.812 1.00 0.00 H ATOM 50 HD1 PHE A 4 5.646 -7.309 2.827 1.00 0.00 H ATOM 51 HD2 PHE A 4 8.113 -8.773 -0.320 1.00 0.00 H ATOM 52 HE1 PHE A 4 7.094 -8.412 4.479 1.00 0.00 H ATOM 53 HE2 PHE A 4 9.563 -9.880 1.330 1.00 0.00 H ATOM 54 HZ PHE A 4 9.054 -9.699 3.733 1.00 0.00 H ATOM 55 N THR A 5 6.878 -4.574 1.989 1.00 0.00 N ATOM 56 CA THR A 5 8.008 -3.725 2.370 1.00 0.00 C ATOM 57 C THR A 5 7.958 -3.388 3.863 1.00 0.00 C ATOM 58 O THR A 5 8.942 -3.580 4.581 1.00 0.00 O ATOM 59 CB THR A 5 8.061 -2.418 1.539 1.00 0.00 C ATOM 60 OG1 THR A 5 9.107 -1.565 2.023 1.00 0.00 O ATOM 61 CG2 THR A 5 6.733 -1.669 1.582 1.00 0.00 C ATOM 62 H THR A 5 6.239 -4.849 2.680 1.00 0.00 H ATOM 63 HA THR A 5 8.911 -4.283 2.177 1.00 0.00 H ATOM 64 HB THR A 5 8.273 -2.675 0.511 1.00 0.00 H ATOM 65 HG1 THR A 5 9.926 -1.771 1.568 1.00 0.00 H ATOM 66 HG21 THR A 5 6.646 -1.043 0.707 1.00 0.00 H ATOM 67 HG22 THR A 5 6.695 -1.055 2.470 1.00 0.00 H ATOM 68 HG23 THR A 5 5.919 -2.378 1.600 1.00 0.00 H ATOM 69 N GLY A 6 6.803 -2.901 4.320 1.00 0.00 N ATOM 70 CA GLY A 6 6.630 -2.560 5.722 1.00 0.00 C ATOM 71 C GLY A 6 5.970 -3.680 6.502 1.00 0.00 C ATOM 72 O GLY A 6 4.745 -3.718 6.618 1.00 0.00 O ATOM 73 H GLY A 6 6.056 -2.785 3.701 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.598 -2.352 6.156 1.00 0.00 H ATOM 75 HA3 GLY A 6 6.018 -1.677 5.794 1.00 0.00 H ATOM 76 N LYS A 7 6.781 -4.598 7.025 1.00 0.00 N ATOM 77 CA LYS A 7 6.272 -5.741 7.785 1.00 0.00 C ATOM 78 C LYS A 7 5.413 -5.314 8.983 1.00 0.00 C ATOM 79 O LYS A 7 4.502 -6.034 9.375 1.00 0.00 O ATOM 80 CB LYS A 7 7.435 -6.616 8.276 1.00 0.00 C ATOM 81 CG LYS A 7 6.991 -7.864 9.033 1.00 0.00 C ATOM 82 CD LYS A 7 6.346 -8.886 8.105 1.00 0.00 C ATOM 83 CE LYS A 7 5.515 -9.906 8.877 1.00 0.00 C ATOM 84 NZ LYS A 7 4.381 -9.281 9.561 1.00 0.00 N1+ ATOM 85 H LYS A 7 7.748 -4.513 6.885 1.00 0.00 H ATOM 86 HA LYS A 7 5.659 -6.328 7.119 1.00 0.00 H ATOM 87 HB2 LYS A 7 8.019 -6.929 7.423 1.00 0.00 H ATOM 88 HB3 LYS A 7 8.060 -6.028 8.932 1.00 0.00 H ATOM 89 HG2 LYS A 7 7.853 -8.313 9.501 1.00 0.00 H ATOM 90 HG3 LYS A 7 6.276 -7.577 9.790 1.00 0.00 H ATOM 91 HD2 LYS A 7 5.706 -8.371 7.405 1.00 0.00 H ATOM 92 HD3 LYS A 7 7.124 -9.406 7.566 1.00 0.00 H ATOM 93 HE2 LYS A 7 5.144 -10.647 8.185 1.00 0.00 H ATOM 94 HE3 LYS A 7 6.147 -10.384 9.611 1.00 0.00 H ATOM 95 HZ1 LYS A 7 4.279 -9.453 10.520 1.00 0.00 H ATOM 96 N ARG A 8 5.718 -4.163 9.580 1.00 0.00 N ATOM 97 CA ARG A 8 4.973 -3.698 10.751 1.00 0.00 C ATOM 98 C ARG A 8 3.530 -3.309 10.423 1.00 0.00 C ATOM 99 O ARG A 8 2.601 -3.795 11.069 1.00 0.00 O ATOM 100 CB ARG A 8 5.699 -2.530 11.433 1.00 0.00 C ATOM 101 CG ARG A 8 5.964 -1.337 10.523 1.00 0.00 C ATOM 102 CD ARG A 8 6.618 -0.191 11.280 1.00 0.00 C ATOM 103 NE ARG A 8 5.763 0.324 12.351 1.00 0.00 N ATOM 104 CZ ARG A 8 4.609 0.973 12.152 1.00 0.00 C ATOM 105 NH1 ARG A 8 4.184 1.242 10.919 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 3.888 1.369 13.194 1.00 0.00 N ATOM 107 H ARG A 8 6.464 -3.628 9.244 1.00 0.00 H ATOM 108 HA ARG A 8 4.937 -4.524 11.444 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.102 -2.190 12.265 1.00 0.00 H ATOM 110 HB3 ARG A 8 6.649 -2.885 11.807 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.620 -1.645 9.723 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.028 -0.996 10.111 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.542 -0.543 11.711 1.00 0.00 H ATOM 114 HD3 ARG A 8 6.828 0.609 10.584 1.00 0.00 H ATOM 115 HE ARG A 8 6.055 0.165 13.273 1.00 0.00 H ATOM 116 HH11 ARG A 8 4.725 0.961 10.127 1.00 0.00 H ATOM 117 HH12 ARG A 8 3.319 1.728 10.784 1.00 0.00 H ATOM 118 HH21 ARG A 8 4.205 1.180 14.124 1.00 0.00 H ATOM 119 HH22 ARG A 8 3.025 1.855 13.050 1.00 0.00 H ATOM 120 N LYS A 9 3.338 -2.435 9.437 1.00 0.00 N ATOM 121 CA LYS A 9 1.986 -2.000 9.071 1.00 0.00 C ATOM 122 C LYS A 9 1.282 -3.023 8.179 1.00 0.00 C ATOM 123 O LYS A 9 0.082 -3.254 8.331 1.00 0.00 O ATOM 124 CB LYS A 9 1.976 -0.603 8.422 1.00 0.00 C ATOM 125 CG LYS A 9 2.691 -0.485 7.081 1.00 0.00 C ATOM 126 CD LYS A 9 4.197 -0.342 7.240 1.00 0.00 C ATOM 127 CE LYS A 9 4.821 0.350 6.033 1.00 0.00 C ATOM 128 NZ LYS A 9 4.487 -0.332 4.748 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.112 -2.079 8.956 1.00 0.00 H ATOM 130 HA LYS A 9 1.426 -1.941 9.993 1.00 0.00 H ATOM 131 HB2 LYS A 9 0.949 -0.304 8.273 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.438 0.094 9.108 1.00 0.00 H ATOM 133 HG2 LYS A 9 2.488 -1.371 6.499 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.311 0.381 6.560 1.00 0.00 H ATOM 135 HD2 LYS A 9 4.404 0.243 8.124 1.00 0.00 H ATOM 136 HD3 LYS A 9 4.634 -1.323 7.345 1.00 0.00 H ATOM 137 HE2 LYS A 9 4.459 1.366 5.992 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.895 0.358 6.157 1.00 0.00 H ATOM 139 HZ1 LYS A 9 4.142 -1.297 4.930 1.00 0.00 H ATOM 140 HZ2 LYS A 9 5.333 -0.388 4.144 1.00 0.00 H ATOM 141 HZ3 LYS A 9 3.750 0.201 4.243 1.00 0.00 H ATOM 142 N SER A 10 2.028 -3.639 7.260 1.00 0.00 N ATOM 143 CA SER A 10 1.460 -4.643 6.360 1.00 0.00 C ATOM 144 C SER A 10 0.881 -5.815 7.153 1.00 0.00 C ATOM 145 O SER A 10 -0.226 -6.278 6.874 1.00 0.00 O ATOM 146 CB SER A 10 2.524 -5.150 5.380 1.00 0.00 C ATOM 147 OG SER A 10 1.976 -6.086 4.466 1.00 0.00 O ATOM 148 H SER A 10 2.981 -3.418 7.192 1.00 0.00 H ATOM 149 HA SER A 10 0.664 -4.174 5.803 1.00 0.00 H ATOM 150 HB2 SER A 10 2.923 -4.316 4.823 1.00 0.00 H ATOM 151 HB3 SER A 10 3.320 -5.629 5.932 1.00 0.00 H ATOM 152 HG SER A 10 2.429 -6.927 4.557 1.00 0.00 H ATOM 153 N ASP A 11 1.639 -6.281 8.147 1.00 0.00 N ATOM 154 CA ASP A 11 1.214 -7.393 8.995 1.00 0.00 C ATOM 155 C ASP A 11 0.066 -6.969 9.909 1.00 0.00 C ATOM 156 O ASP A 11 -0.984 -7.610 9.929 1.00 0.00 O ATOM 157 CB ASP A 11 2.399 -7.902 9.823 1.00 0.00 C ATOM 158 CG ASP A 11 3.502 -8.483 8.952 1.00 0.00 C ATOM 159 OD1 ASP A 11 3.576 -8.194 7.756 1.00 0.00 O ATOM 160 H ASP A 11 2.508 -5.860 8.315 1.00 0.00 H ATOM 161 HA ASP A 11 0.868 -8.185 8.351 1.00 0.00 H ATOM 162 HB2 ASP A 11 2.811 -7.083 10.392 1.00 0.00 H ATOM 163 HB3 ASP A 11 2.058 -8.666 10.502 1.00 0.00 H ATOM 164 N ARG A 12 0.267 -5.876 10.649 1.00 0.00 N ATOM 165 CA ARG A 12 -0.765 -5.361 11.552 1.00 0.00 C ATOM 166 C ARG A 12 -2.029 -4.992 10.774 1.00 0.00 C ATOM 167 O ARG A 12 -3.145 -5.245 11.233 1.00 0.00 O ATOM 168 CB ARG A 12 -0.252 -4.140 12.328 1.00 0.00 C ATOM 169 CG ARG A 12 -1.264 -3.586 13.323 1.00 0.00 C ATOM 170 CD ARG A 12 -0.720 -2.398 14.110 1.00 0.00 C ATOM 171 NE ARG A 12 -0.355 -1.273 13.247 1.00 0.00 N ATOM 172 CZ ARG A 12 0.840 -1.122 12.668 1.00 0.00 C ATOM 173 NH1 ARG A 12 1.841 -1.952 12.948 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 1.042 -0.116 11.826 1.00 0.00 N ATOM 175 H ARG A 12 1.121 -5.402 10.577 1.00 0.00 H ATOM 176 HA ARG A 12 -1.007 -6.144 12.253 1.00 0.00 H ATOM 177 HB2 ARG A 12 0.640 -4.419 12.870 1.00 0.00 H ATOM 178 HB3 ARG A 12 -0.006 -3.358 11.625 1.00 0.00 H ATOM 179 HG2 ARG A 12 -2.142 -3.268 12.784 1.00 0.00 H ATOM 180 HG3 ARG A 12 -1.532 -4.370 14.016 1.00 0.00 H ATOM 181 HD2 ARG A 12 -1.477 -2.070 14.807 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.154 -2.717 14.658 1.00 0.00 H ATOM 183 HE ARG A 12 -1.052 -0.608 13.061 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.709 -2.700 13.597 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.730 -1.826 12.509 1.00 0.00 H ATOM 186 HH21 ARG A 12 0.302 0.527 11.626 1.00 0.00 H ATOM 187 HH22 ARG A 12 1.933 -0.001 11.389 1.00 0.00 H ATOM 188 N LYS A 13 -1.840 -4.394 9.595 1.00 0.00 N ATOM 189 CA LYS A 13 -2.956 -3.986 8.743 1.00 0.00 C ATOM 190 C LYS A 13 -3.750 -5.197 8.244 1.00 0.00 C ATOM 191 O LYS A 13 -4.983 -5.187 8.261 1.00 0.00 O ATOM 192 CB LYS A 13 -2.439 -3.168 7.553 1.00 0.00 C ATOM 193 CG LYS A 13 -3.525 -2.663 6.606 1.00 0.00 C ATOM 194 CD LYS A 13 -4.254 -1.437 7.150 1.00 0.00 C ATOM 195 CE LYS A 13 -5.180 -1.775 8.311 1.00 0.00 C ATOM 196 NZ LYS A 13 -5.957 -0.588 8.766 1.00 0.00 N1+ ATOM 197 H LYS A 13 -0.925 -4.223 9.291 1.00 0.00 H ATOM 198 HA LYS A 13 -3.607 -3.370 9.336 1.00 0.00 H ATOM 199 HB2 LYS A 13 -1.901 -2.311 7.931 1.00 0.00 H ATOM 200 HB3 LYS A 13 -1.757 -3.783 6.984 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.069 -2.403 5.663 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.244 -3.455 6.449 1.00 0.00 H ATOM 203 HD2 LYS A 13 -3.521 -0.721 7.491 1.00 0.00 H ATOM 204 HD3 LYS A 13 -4.837 -0.999 6.353 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.868 -2.545 7.995 1.00 0.00 H ATOM 206 HE3 LYS A 13 -4.588 -2.139 9.134 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -5.311 0.174 9.056 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -6.559 -0.842 9.575 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -6.563 -0.240 7.994 1.00 0.00 H ATOM 210 N LYS A 14 -3.039 -6.235 7.792 1.00 0.00 N ATOM 211 CA LYS A 14 -3.688 -7.443 7.282 1.00 0.00 C ATOM 212 C LYS A 14 -4.447 -8.179 8.383 1.00 0.00 C ATOM 213 O LYS A 14 -5.581 -8.603 8.175 1.00 0.00 O ATOM 214 CB LYS A 14 -2.675 -8.390 6.638 1.00 0.00 C ATOM 215 CG LYS A 14 -3.331 -9.562 5.923 1.00 0.00 C ATOM 216 CD LYS A 14 -4.175 -9.091 4.745 1.00 0.00 C ATOM 217 CE LYS A 14 -4.879 -10.248 4.049 1.00 0.00 C ATOM 218 NZ LYS A 14 -6.195 -10.545 4.623 1.00 0.00 N1+ ATOM 219 H LYS A 14 -2.060 -6.183 7.799 1.00 0.00 H ATOM 220 HA LYS A 14 -4.396 -7.135 6.530 1.00 0.00 H ATOM 221 HB2 LYS A 14 -2.085 -7.839 5.921 1.00 0.00 H ATOM 222 HB3 LYS A 14 -2.023 -8.782 7.405 1.00 0.00 H ATOM 223 HG2 LYS A 14 -2.562 -10.228 5.560 1.00 0.00 H ATOM 224 HG3 LYS A 14 -3.963 -10.088 6.621 1.00 0.00 H ATOM 225 HD2 LYS A 14 -4.920 -8.399 5.105 1.00 0.00 H ATOM 226 HD3 LYS A 14 -3.533 -8.592 4.034 1.00 0.00 H ATOM 227 HE2 LYS A 14 -5.005 -9.995 3.007 1.00 0.00 H ATOM 228 HE3 LYS A 14 -4.257 -11.128 4.128 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -6.980 -10.235 4.124 1.00 0.00 H ATOM 230 N LYS A 15 -3.822 -8.321 9.554 1.00 0.00 N ATOM 231 CA LYS A 15 -4.458 -9.001 10.686 1.00 0.00 C ATOM 232 C LYS A 15 -5.807 -8.358 11.016 1.00 0.00 C ATOM 233 O LYS A 15 -6.727 -9.033 11.477 1.00 0.00 O ATOM 234 CB LYS A 15 -3.548 -8.986 11.921 1.00 0.00 C ATOM 235 CG LYS A 15 -2.718 -10.254 12.121 1.00 0.00 C ATOM 236 CD LYS A 15 -1.679 -10.463 11.024 1.00 0.00 C ATOM 237 CE LYS A 15 -2.294 -11.027 9.751 1.00 0.00 C ATOM 238 NZ LYS A 15 -1.273 -11.241 8.688 1.00 0.00 N1+ ATOM 239 H LYS A 15 -2.920 -7.957 9.660 1.00 0.00 H ATOM 240 HA LYS A 15 -4.635 -10.026 10.391 1.00 0.00 H ATOM 241 HB2 LYS A 15 -2.867 -8.151 11.836 1.00 0.00 H ATOM 242 HB3 LYS A 15 -4.161 -8.845 12.799 1.00 0.00 H ATOM 243 HG2 LYS A 15 -2.207 -10.186 13.068 1.00 0.00 H ATOM 244 HG3 LYS A 15 -3.385 -11.104 12.135 1.00 0.00 H ATOM 245 HD2 LYS A 15 -1.216 -9.516 10.797 1.00 0.00 H ATOM 246 HD3 LYS A 15 -0.928 -11.152 11.384 1.00 0.00 H ATOM 247 HE2 LYS A 15 -2.762 -11.972 9.981 1.00 0.00 H ATOM 248 HE3 LYS A 15 -3.039 -10.339 9.388 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -0.736 -10.365 8.527 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -1.735 -11.520 7.799 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -0.613 -11.992 8.973 1.00 0.00 H ATOM 252 N ASN A 16 -5.923 -7.052 10.765 1.00 0.00 N ATOM 253 CA ASN A 16 -7.167 -6.332 11.016 1.00 0.00 C ATOM 254 C ASN A 16 -8.213 -6.697 9.955 1.00 0.00 C ATOM 255 O ASN A 16 -9.381 -6.929 10.273 1.00 0.00 O ATOM 256 CB ASN A 16 -6.919 -4.816 11.013 1.00 0.00 C ATOM 257 CG ASN A 16 -8.123 -3.988 11.465 1.00 0.00 C ATOM 258 OD1 ASN A 16 -8.116 -2.764 11.336 1.00 0.00 O ATOM 259 ND2 ASN A 16 -9.151 -4.634 12.019 1.00 0.00 N ATOM 260 H ASN A 16 -5.159 -6.567 10.387 1.00 0.00 H ATOM 261 HA ASN A 16 -7.533 -6.629 11.986 1.00 0.00 H ATOM 262 HB2 ASN A 16 -6.094 -4.596 11.671 1.00 0.00 H ATOM 263 HB3 ASN A 16 -6.657 -4.509 10.010 1.00 0.00 H ATOM 264 HD21 ASN A 16 -9.099 -5.607 12.116 1.00 0.00 H ATOM 265 HD22 ASN A 16 -9.923 -4.105 12.309 1.00 0.00 H ATOM 266 N GLN A 17 -7.777 -6.740 8.693 1.00 0.00 N ATOM 267 CA GLN A 17 -8.662 -7.069 7.573 1.00 0.00 C ATOM 268 C GLN A 17 -9.016 -8.560 7.544 1.00 0.00 C ATOM 269 O GLN A 17 -10.194 -8.919 7.490 1.00 0.00 O ATOM 270 CB GLN A 17 -8.006 -6.662 6.247 1.00 0.00 C ATOM 271 CG GLN A 17 -8.870 -6.929 5.023 1.00 0.00 C ATOM 272 CD GLN A 17 -10.159 -6.126 5.025 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.136 -4.896 5.044 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.293 -6.819 5.004 1.00 0.00 N ATOM 275 H GLN A 17 -6.835 -6.543 8.510 1.00 0.00 H ATOM 276 HA GLN A 17 -9.570 -6.504 7.697 1.00 0.00 H ATOM 277 HB2 GLN A 17 -7.785 -5.604 6.281 1.00 0.00 H ATOM 278 HB3 GLN A 17 -7.081 -7.209 6.135 1.00 0.00 H ATOM 279 HG2 GLN A 17 -8.307 -6.673 4.138 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.118 -7.980 4.997 1.00 0.00 H ATOM 281 HE21 GLN A 17 -11.241 -7.797 4.989 1.00 0.00 H ATOM 282 HE22 GLN A 17 -12.137 -6.321 5.004 1.00 0.00 H ATOM 283 N ASP A 18 -7.994 -9.418 7.575 1.00 0.00 N ATOM 284 CA ASP A 18 -8.203 -10.868 7.546 1.00 0.00 C ATOM 285 C ASP A 18 -7.402 -11.581 8.641 1.00 0.00 C ATOM 286 O ASP A 18 -6.882 -12.679 8.432 1.00 0.00 O ATOM 287 CB ASP A 18 -7.844 -11.437 6.164 1.00 0.00 C ATOM 288 CG ASP A 18 -6.390 -11.218 5.759 1.00 0.00 C ATOM 289 OD1 ASP A 18 -5.467 -11.665 6.440 1.00 0.00 O ATOM 290 H ASP A 18 -7.080 -9.070 7.613 1.00 0.00 H ATOM 291 HA ASP A 18 -9.253 -11.046 7.727 1.00 0.00 H ATOM 292 HB2 ASP A 18 -8.032 -12.499 6.166 1.00 0.00 H ATOM 293 HB3 ASP A 18 -8.476 -10.970 5.422 1.00 0.00 H HETATM 294 N NH2 A 19 -7.317 -10.970 9.815 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -7.752 -10.098 9.918 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -6.820 -11.415 10.532 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 7 ATOM 1 N PHE A 1 18.453 -6.681 4.659 1.00 0.00 N ATOM 2 CA PHE A 1 18.487 -7.786 3.704 1.00 0.00 C ATOM 3 C PHE A 1 17.331 -7.674 2.708 1.00 0.00 C ATOM 4 O PHE A 1 17.551 -7.609 1.495 1.00 0.00 O ATOM 5 CB PHE A 1 18.424 -9.148 4.424 1.00 0.00 C ATOM 6 CG PHE A 1 18.500 -9.071 5.930 1.00 0.00 C ATOM 7 CD1 PHE A 1 17.493 -8.456 6.661 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.577 -9.616 6.612 1.00 0.00 C ATOM 9 CE1 PHE A 1 17.559 -8.388 8.040 1.00 0.00 C ATOM 10 CE2 PHE A 1 19.648 -9.550 7.991 1.00 0.00 C ATOM 11 CZ PHE A 1 18.638 -8.935 8.705 1.00 0.00 C ATOM 12 H1 PHE A 1 19.297 -6.270 4.943 1.00 0.00 H ATOM 13 HA PHE A 1 19.419 -7.724 3.159 1.00 0.00 H ATOM 14 HB2 PHE A 1 17.493 -9.633 4.172 1.00 0.00 H ATOM 15 HB3 PHE A 1 19.244 -9.764 4.082 1.00 0.00 H ATOM 16 HD1 PHE A 1 16.648 -8.026 6.142 1.00 0.00 H ATOM 17 HD2 PHE A 1 20.369 -10.097 6.057 1.00 0.00 H ATOM 18 HE1 PHE A 1 16.768 -7.905 8.596 1.00 0.00 H ATOM 19 HE2 PHE A 1 20.491 -9.979 8.510 1.00 0.00 H ATOM 20 HZ PHE A 1 18.691 -8.884 9.783 1.00 0.00 H ATOM 21 N GLY A 2 16.100 -7.643 3.226 1.00 0.00 N ATOM 22 CA GLY A 2 14.930 -7.529 2.371 1.00 0.00 C ATOM 23 C GLY A 2 14.577 -6.084 2.065 1.00 0.00 C ATOM 24 O GLY A 2 14.515 -5.254 2.974 1.00 0.00 O ATOM 25 H GLY A 2 15.987 -7.693 4.199 1.00 0.00 H ATOM 26 HA2 GLY A 2 15.122 -8.048 1.443 1.00 0.00 H ATOM 27 HA3 GLY A 2 14.090 -7.995 2.864 1.00 0.00 H ATOM 28 N GLY A 3 14.343 -5.783 0.787 1.00 0.00 N ATOM 29 CA GLY A 3 13.997 -4.426 0.393 1.00 0.00 C ATOM 30 C GLY A 3 12.635 -3.995 0.910 1.00 0.00 C ATOM 31 O GLY A 3 11.609 -4.517 0.472 1.00 0.00 O ATOM 32 H GLY A 3 14.406 -6.486 0.107 1.00 0.00 H ATOM 33 HA2 GLY A 3 14.748 -3.748 0.776 1.00 0.00 H ATOM 34 HA3 GLY A 3 13.994 -4.367 -0.686 1.00 0.00 H ATOM 35 N PHE A 4 12.635 -3.033 1.839 1.00 0.00 N ATOM 36 CA PHE A 4 11.402 -2.503 2.436 1.00 0.00 C ATOM 37 C PHE A 4 10.691 -3.562 3.284 1.00 0.00 C ATOM 38 O PHE A 4 10.608 -4.729 2.900 1.00 0.00 O ATOM 39 CB PHE A 4 10.456 -1.978 1.351 1.00 0.00 C ATOM 40 CG PHE A 4 9.380 -1.065 1.879 1.00 0.00 C ATOM 41 CD1 PHE A 4 9.713 0.081 2.584 1.00 0.00 C ATOM 42 CD2 PHE A 4 8.041 -1.349 1.664 1.00 0.00 C ATOM 43 CE1 PHE A 4 8.731 0.926 3.065 1.00 0.00 C ATOM 44 CE2 PHE A 4 7.054 -0.506 2.144 1.00 0.00 C ATOM 45 CZ PHE A 4 7.400 0.632 2.845 1.00 0.00 C ATOM 46 H PHE A 4 13.494 -2.663 2.132 1.00 0.00 H ATOM 47 HA PHE A 4 11.683 -1.683 3.078 1.00 0.00 H ATOM 48 HB2 PHE A 4 11.029 -1.427 0.621 1.00 0.00 H ATOM 49 HB3 PHE A 4 9.975 -2.815 0.867 1.00 0.00 H ATOM 50 HD1 PHE A 4 10.755 0.314 2.756 1.00 0.00 H ATOM 51 HD2 PHE A 4 7.768 -2.239 1.117 1.00 0.00 H ATOM 52 HE1 PHE A 4 9.005 1.817 3.613 1.00 0.00 H ATOM 53 HE2 PHE A 4 6.013 -0.736 1.971 1.00 0.00 H ATOM 54 HZ PHE A 4 6.632 1.292 3.219 1.00 0.00 H ATOM 55 N THR A 5 10.180 -3.143 4.442 1.00 0.00 N ATOM 56 CA THR A 5 9.477 -4.055 5.346 1.00 0.00 C ATOM 57 C THR A 5 8.349 -3.327 6.091 1.00 0.00 C ATOM 58 O THR A 5 8.171 -3.495 7.301 1.00 0.00 O ATOM 59 CB THR A 5 10.456 -4.691 6.361 1.00 0.00 C ATOM 60 OG1 THR A 5 11.578 -5.255 5.671 1.00 0.00 O ATOM 61 CG2 THR A 5 9.776 -5.780 7.177 1.00 0.00 C ATOM 62 H THR A 5 10.278 -2.201 4.696 1.00 0.00 H ATOM 63 HA THR A 5 9.046 -4.845 4.749 1.00 0.00 H ATOM 64 HB THR A 5 10.807 -3.921 7.035 1.00 0.00 H ATOM 65 HG1 THR A 5 12.318 -4.646 5.710 1.00 0.00 H ATOM 66 HG21 THR A 5 9.728 -5.476 8.212 1.00 0.00 H ATOM 67 HG22 THR A 5 10.341 -6.696 7.096 1.00 0.00 H ATOM 68 HG23 THR A 5 8.776 -5.940 6.803 1.00 0.00 H ATOM 69 N GLY A 6 7.584 -2.521 5.352 1.00 0.00 N ATOM 70 CA GLY A 6 6.477 -1.780 5.938 1.00 0.00 C ATOM 71 C GLY A 6 5.165 -2.550 5.899 1.00 0.00 C ATOM 72 O GLY A 6 4.335 -2.412 6.798 1.00 0.00 O ATOM 73 H GLY A 6 7.771 -2.430 4.393 1.00 0.00 H ATOM 74 HA2 GLY A 6 6.716 -1.551 6.967 1.00 0.00 H ATOM 75 HA3 GLY A 6 6.354 -0.854 5.395 1.00 0.00 H ATOM 76 N LYS A 7 4.976 -3.350 4.841 1.00 0.00 N ATOM 77 CA LYS A 7 3.754 -4.144 4.654 1.00 0.00 C ATOM 78 C LYS A 7 3.329 -4.896 5.914 1.00 0.00 C ATOM 79 O LYS A 7 2.151 -4.892 6.263 1.00 0.00 O ATOM 80 CB LYS A 7 3.940 -5.147 3.509 1.00 0.00 C ATOM 81 CG LYS A 7 3.287 -4.718 2.205 1.00 0.00 C ATOM 82 CD LYS A 7 1.763 -4.691 2.303 1.00 0.00 C ATOM 83 CE LYS A 7 1.177 -6.085 2.493 1.00 0.00 C ATOM 84 NZ LYS A 7 1.022 -6.450 3.905 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.676 -3.397 4.156 1.00 0.00 H ATOM 86 HA LYS A 7 2.965 -3.463 4.384 1.00 0.00 H ATOM 87 HB2 LYS A 7 4.998 -5.276 3.330 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.519 -6.095 3.804 1.00 0.00 H ATOM 89 HG2 LYS A 7 3.635 -3.729 1.947 1.00 0.00 H ATOM 90 HG3 LYS A 7 3.573 -5.413 1.429 1.00 0.00 H ATOM 91 HD2 LYS A 7 1.477 -4.077 3.144 1.00 0.00 H ATOM 92 HD3 LYS A 7 1.364 -4.264 1.394 1.00 0.00 H ATOM 93 HE2 LYS A 7 0.211 -6.124 2.014 1.00 0.00 H ATOM 94 HE3 LYS A 7 1.837 -6.800 2.021 1.00 0.00 H ATOM 95 HZ1 LYS A 7 1.831 -6.495 4.453 1.00 0.00 H ATOM 96 N ARG A 8 4.277 -5.552 6.584 1.00 0.00 N ATOM 97 CA ARG A 8 3.967 -6.319 7.795 1.00 0.00 C ATOM 98 C ARG A 8 3.165 -5.485 8.793 1.00 0.00 C ATOM 99 O ARG A 8 2.284 -6.003 9.482 1.00 0.00 O ATOM 100 CB ARG A 8 5.246 -6.847 8.457 1.00 0.00 C ATOM 101 CG ARG A 8 6.176 -5.763 8.992 1.00 0.00 C ATOM 102 CD ARG A 8 7.375 -6.372 9.702 1.00 0.00 C ATOM 103 NE ARG A 8 8.249 -5.356 10.291 1.00 0.00 N ATOM 104 CZ ARG A 8 9.348 -5.638 10.997 1.00 0.00 C ATOM 105 NH1 ARG A 8 9.730 -6.899 11.181 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.073 -4.654 11.516 1.00 0.00 N ATOM 107 H ARG A 8 5.199 -5.528 6.254 1.00 0.00 H ATOM 108 HA ARG A 8 3.361 -7.162 7.495 1.00 0.00 H ATOM 109 HB2 ARG A 8 4.969 -7.485 9.283 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.794 -7.432 7.734 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.524 -5.160 8.168 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.631 -5.143 9.691 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.019 -7.022 10.487 1.00 0.00 H ATOM 114 HD3 ARG A 8 7.944 -6.950 8.988 1.00 0.00 H ATOM 115 HE ARG A 8 8.000 -4.416 10.162 1.00 0.00 H ATOM 116 HH11 ARG A 8 9.195 -7.649 10.793 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.556 -7.099 11.710 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.796 -3.702 11.381 1.00 0.00 H ATOM 119 HH22 ARG A 8 10.896 -4.863 12.046 1.00 0.00 H ATOM 120 N LYS A 9 3.479 -4.192 8.861 1.00 0.00 N ATOM 121 CA LYS A 9 2.797 -3.273 9.771 1.00 0.00 C ATOM 122 C LYS A 9 1.321 -3.115 9.395 1.00 0.00 C ATOM 123 O LYS A 9 0.433 -3.335 10.223 1.00 0.00 O ATOM 124 CB LYS A 9 3.491 -1.906 9.745 1.00 0.00 C ATOM 125 CG LYS A 9 3.130 -1.006 10.917 1.00 0.00 C ATOM 126 CD LYS A 9 3.528 -1.615 12.258 1.00 0.00 C ATOM 127 CE LYS A 9 5.041 -1.654 12.452 1.00 0.00 C ATOM 128 NZ LYS A 9 5.708 -2.665 11.581 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.193 -3.847 8.282 1.00 0.00 H ATOM 130 HA LYS A 9 2.862 -3.680 10.767 1.00 0.00 H ATOM 131 HB2 LYS A 9 4.558 -2.057 9.746 1.00 0.00 H ATOM 132 HB3 LYS A 9 3.213 -1.397 8.833 1.00 0.00 H ATOM 133 HG2 LYS A 9 3.641 -0.062 10.800 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.064 -0.839 10.912 1.00 0.00 H ATOM 135 HD2 LYS A 9 3.093 -1.024 13.049 1.00 0.00 H ATOM 136 HD3 LYS A 9 3.144 -2.623 12.311 1.00 0.00 H ATOM 137 HE2 LYS A 9 5.444 -0.679 12.223 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.249 -1.891 13.486 1.00 0.00 H ATOM 139 HZ1 LYS A 9 5.024 -3.390 11.283 1.00 0.00 H ATOM 140 HZ2 LYS A 9 6.480 -3.129 12.102 1.00 0.00 H ATOM 141 HZ3 LYS A 9 6.104 -2.204 10.737 1.00 0.00 H ATOM 142 N SER A 10 1.072 -2.734 8.144 1.00 0.00 N ATOM 143 CA SER A 10 -0.291 -2.540 7.646 1.00 0.00 C ATOM 144 C SER A 10 -1.049 -3.864 7.567 1.00 0.00 C ATOM 145 O SER A 10 -2.174 -3.973 8.052 1.00 0.00 O ATOM 146 CB SER A 10 -0.259 -1.877 6.266 1.00 0.00 C ATOM 147 OG SER A 10 0.353 -0.600 6.326 1.00 0.00 O ATOM 148 H SER A 10 1.826 -2.576 7.538 1.00 0.00 H ATOM 149 HA SER A 10 -0.805 -1.887 8.335 1.00 0.00 H ATOM 150 HB2 SER A 10 0.305 -2.499 5.586 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.268 -1.765 5.900 1.00 0.00 H ATOM 152 HG SER A 10 1.263 -0.665 6.023 1.00 0.00 H ATOM 153 N ASP A 11 -0.419 -4.866 6.952 1.00 0.00 N ATOM 154 CA ASP A 11 -1.024 -6.189 6.803 1.00 0.00 C ATOM 155 C ASP A 11 -1.295 -6.837 8.163 1.00 0.00 C ATOM 156 O ASP A 11 -2.332 -7.466 8.355 1.00 0.00 O ATOM 157 CB ASP A 11 -0.131 -7.100 5.948 1.00 0.00 C ATOM 158 CG ASP A 11 -0.155 -6.730 4.472 1.00 0.00 C ATOM 159 OD1 ASP A 11 -1.218 -6.708 3.849 1.00 0.00 O ATOM 160 H ASP A 11 0.478 -4.710 6.589 1.00 0.00 H ATOM 161 HA ASP A 11 -1.967 -6.057 6.295 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.888 -7.030 6.301 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.471 -8.121 6.049 1.00 0.00 H ATOM 164 N ARG A 12 -0.358 -6.679 9.100 1.00 0.00 N ATOM 165 CA ARG A 12 -0.499 -7.250 10.445 1.00 0.00 C ATOM 166 C ARG A 12 -1.746 -6.711 11.152 1.00 0.00 C ATOM 167 O ARG A 12 -2.505 -7.471 11.755 1.00 0.00 O ATOM 168 CB ARG A 12 0.753 -6.951 11.280 1.00 0.00 C ATOM 169 CG ARG A 12 0.696 -7.478 12.711 1.00 0.00 C ATOM 170 CD ARG A 12 0.478 -8.986 12.750 1.00 0.00 C ATOM 171 NE ARG A 12 0.500 -9.519 14.115 1.00 0.00 N ATOM 172 CZ ARG A 12 -0.400 -9.227 15.064 1.00 0.00 C ATOM 173 NH1 ARG A 12 -1.438 -8.433 14.802 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -0.269 -9.749 16.280 1.00 0.00 N ATOM 175 H ARG A 12 0.448 -6.164 8.885 1.00 0.00 H ATOM 176 HA ARG A 12 -0.600 -8.317 10.339 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.608 -7.394 10.793 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.893 -5.881 11.322 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.629 -7.249 13.204 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.115 -6.991 13.231 1.00 0.00 H ATOM 181 HD2 ARG A 12 -0.478 -9.209 12.304 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.261 -9.462 12.177 1.00 0.00 H ATOM 183 HE ARG A 12 1.234 -10.127 14.344 1.00 0.00 H ATOM 184 HH11 ARG A 12 -1.558 -8.046 13.888 1.00 0.00 H ATOM 185 HH12 ARG A 12 -2.098 -8.221 15.522 1.00 0.00 H ATOM 186 HH21 ARG A 12 0.498 -10.358 16.483 1.00 0.00 H ATOM 187 HH22 ARG A 12 -0.938 -9.533 16.993 1.00 0.00 H ATOM 188 N LYS A 13 -1.940 -5.396 11.080 1.00 0.00 N ATOM 189 CA LYS A 13 -3.084 -4.747 11.718 1.00 0.00 C ATOM 190 C LYS A 13 -4.386 -5.059 10.973 1.00 0.00 C ATOM 191 O LYS A 13 -5.369 -5.493 11.576 1.00 0.00 O ATOM 192 CB LYS A 13 -2.855 -3.231 11.763 1.00 0.00 C ATOM 193 CG LYS A 13 -3.622 -2.509 12.863 1.00 0.00 C ATOM 194 CD LYS A 13 -5.128 -2.670 12.720 1.00 0.00 C ATOM 195 CE LYS A 13 -5.873 -1.864 13.772 1.00 0.00 C ATOM 196 NZ LYS A 13 -7.345 -2.066 13.692 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.292 -4.845 10.591 1.00 0.00 H ATOM 198 HA LYS A 13 -3.161 -5.121 12.726 1.00 0.00 H ATOM 199 HB2 LYS A 13 -1.802 -3.044 11.912 1.00 0.00 H ATOM 200 HB3 LYS A 13 -3.152 -2.808 10.814 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.320 -2.912 13.818 1.00 0.00 H ATOM 202 HG3 LYS A 13 -3.377 -1.458 12.823 1.00 0.00 H ATOM 203 HD2 LYS A 13 -5.428 -2.329 11.740 1.00 0.00 H ATOM 204 HD3 LYS A 13 -5.382 -3.714 12.833 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.530 -2.170 14.749 1.00 0.00 H ATOM 206 HE3 LYS A 13 -5.654 -0.816 13.626 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -7.831 -1.400 14.327 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -7.588 -3.036 13.976 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -7.677 -1.907 12.719 1.00 0.00 H ATOM 210 N LYS A 14 -4.384 -4.819 9.659 1.00 0.00 N ATOM 211 CA LYS A 14 -5.564 -5.046 8.820 1.00 0.00 C ATOM 212 C LYS A 14 -6.042 -6.500 8.893 1.00 0.00 C ATOM 213 O LYS A 14 -7.225 -6.752 9.129 1.00 0.00 O ATOM 214 CB LYS A 14 -5.259 -4.670 7.360 1.00 0.00 C ATOM 215 CG LYS A 14 -6.471 -4.187 6.566 1.00 0.00 C ATOM 216 CD LYS A 14 -7.639 -5.162 6.638 1.00 0.00 C ATOM 217 CE LYS A 14 -7.312 -6.503 5.989 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.025 -7.614 6.626 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.571 -4.462 9.247 1.00 0.00 H ATOM 220 HA LYS A 14 -6.351 -4.408 9.184 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.520 -3.882 7.353 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.851 -5.534 6.857 1.00 0.00 H ATOM 223 HG2 LYS A 14 -6.790 -3.235 6.964 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.181 -4.063 5.532 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.892 -5.326 7.673 1.00 0.00 H ATOM 226 HD3 LYS A 14 -8.486 -4.724 6.128 1.00 0.00 H ATOM 227 HE2 LYS A 14 -7.593 -6.461 4.946 1.00 0.00 H ATOM 228 HE3 LYS A 14 -6.249 -6.679 6.065 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -7.492 -8.388 6.901 1.00 0.00 H ATOM 230 N LYS A 15 -5.125 -7.452 8.685 1.00 0.00 N ATOM 231 CA LYS A 15 -5.475 -8.878 8.719 1.00 0.00 C ATOM 232 C LYS A 15 -6.179 -9.227 10.026 1.00 0.00 C ATOM 233 O LYS A 15 -7.118 -10.023 10.040 1.00 0.00 O ATOM 234 CB LYS A 15 -4.235 -9.767 8.503 1.00 0.00 C ATOM 235 CG LYS A 15 -3.354 -9.968 9.732 1.00 0.00 C ATOM 236 CD LYS A 15 -3.847 -11.123 10.599 1.00 0.00 C ATOM 237 CE LYS A 15 -2.902 -11.404 11.760 1.00 0.00 C ATOM 238 NZ LYS A 15 -2.914 -10.310 12.771 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.200 -7.189 8.501 1.00 0.00 H ATOM 240 HA LYS A 15 -6.166 -9.054 7.911 1.00 0.00 H ATOM 241 HB2 LYS A 15 -4.566 -10.740 8.172 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.629 -9.327 7.724 1.00 0.00 H ATOM 243 HG2 LYS A 15 -2.348 -10.182 9.406 1.00 0.00 H ATOM 244 HG3 LYS A 15 -3.360 -9.061 10.318 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.818 -10.873 10.996 1.00 0.00 H ATOM 246 HD3 LYS A 15 -3.926 -12.012 9.988 1.00 0.00 H ATOM 247 HE2 LYS A 15 -3.203 -12.325 12.237 1.00 0.00 H ATOM 248 HE3 LYS A 15 -1.900 -11.513 11.371 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -2.200 -10.496 13.504 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.848 -10.250 13.221 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -2.699 -9.399 12.317 1.00 0.00 H ATOM 252 N ASN A 16 -5.731 -8.606 11.119 1.00 0.00 N ATOM 253 CA ASN A 16 -6.331 -8.831 12.428 1.00 0.00 C ATOM 254 C ASN A 16 -7.783 -8.351 12.431 1.00 0.00 C ATOM 255 O ASN A 16 -8.677 -9.046 12.916 1.00 0.00 O ATOM 256 CB ASN A 16 -5.528 -8.100 13.511 1.00 0.00 C ATOM 257 CG ASN A 16 -6.003 -8.426 14.915 1.00 0.00 C ATOM 258 OD1 ASN A 16 -7.137 -8.123 15.288 1.00 0.00 O ATOM 259 ND2 ASN A 16 -5.135 -9.052 15.704 1.00 0.00 N ATOM 260 H ASN A 16 -4.987 -7.970 11.036 1.00 0.00 H ATOM 261 HA ASN A 16 -6.312 -9.890 12.628 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.488 -8.379 13.430 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.621 -7.035 13.359 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.249 -9.266 15.342 1.00 0.00 H ATOM 265 HD22 ASN A 16 -5.415 -9.274 16.615 1.00 0.00 H ATOM 266 N GLN A 17 -8.005 -7.157 11.878 1.00 0.00 N ATOM 267 CA GLN A 17 -9.341 -6.567 11.806 1.00 0.00 C ATOM 268 C GLN A 17 -10.288 -7.405 10.943 1.00 0.00 C ATOM 269 O GLN A 17 -11.413 -7.695 11.355 1.00 0.00 O ATOM 270 CB GLN A 17 -9.257 -5.143 11.247 1.00 0.00 C ATOM 271 CG GLN A 17 -10.596 -4.423 11.190 1.00 0.00 C ATOM 272 CD GLN A 17 -10.472 -3.008 10.657 1.00 0.00 C ATOM 273 OE1 GLN A 17 -9.772 -2.175 11.234 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.157 -2.723 9.552 1.00 0.00 N ATOM 275 H GLN A 17 -7.246 -6.659 11.509 1.00 0.00 H ATOM 276 HA GLN A 17 -9.736 -6.524 12.807 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.589 -4.565 11.868 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.854 -5.187 10.246 1.00 0.00 H ATOM 279 HG2 GLN A 17 -11.262 -4.978 10.546 1.00 0.00 H ATOM 280 HG3 GLN A 17 -11.011 -4.382 12.186 1.00 0.00 H ATOM 281 HE21 GLN A 17 -11.702 -3.430 9.148 1.00 0.00 H ATOM 282 HE22 GLN A 17 -11.089 -1.816 9.187 1.00 0.00 H ATOM 283 N ASP A 18 -9.831 -7.787 9.746 1.00 0.00 N ATOM 284 CA ASP A 18 -10.646 -8.589 8.828 1.00 0.00 C ATOM 285 C ASP A 18 -11.079 -9.897 9.487 1.00 0.00 C ATOM 286 O ASP A 18 -12.268 -10.211 9.545 1.00 0.00 O ATOM 287 CB ASP A 18 -9.877 -8.891 7.532 1.00 0.00 C ATOM 288 CG ASP A 18 -9.342 -7.638 6.854 1.00 0.00 C ATOM 289 OD1 ASP A 18 -10.097 -6.716 6.542 1.00 0.00 O ATOM 290 H ASP A 18 -8.928 -7.523 9.476 1.00 0.00 H ATOM 291 HA ASP A 18 -11.529 -8.016 8.585 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.042 -9.536 7.761 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.536 -9.398 6.841 1.00 0.00 H HETATM 294 N NH2 A 19 -10.113 -10.653 10.002 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.187 -10.342 9.919 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.367 -11.488 10.446 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 8 ATOM 1 N PHE A 1 13.876 -5.225 -4.862 1.00 0.00 N ATOM 2 CA PHE A 1 13.987 -3.834 -5.285 1.00 0.00 C ATOM 3 C PHE A 1 12.614 -3.276 -5.665 1.00 0.00 C ATOM 4 O PHE A 1 12.150 -2.294 -5.078 1.00 0.00 O ATOM 5 CB PHE A 1 14.948 -3.720 -6.477 1.00 0.00 C ATOM 6 CG PHE A 1 15.399 -2.314 -6.767 1.00 0.00 C ATOM 7 CD1 PHE A 1 14.478 -1.293 -6.957 1.00 0.00 C ATOM 8 CD2 PHE A 1 16.749 -2.013 -6.847 1.00 0.00 C ATOM 9 CE1 PHE A 1 14.896 -0.004 -7.220 1.00 0.00 C ATOM 10 CE2 PHE A 1 17.172 -0.725 -7.109 1.00 0.00 C ATOM 11 CZ PHE A 1 16.245 0.280 -7.296 1.00 0.00 C ATOM 12 H1 PHE A 1 13.893 -5.435 -3.903 1.00 0.00 H ATOM 13 HA PHE A 1 14.381 -3.263 -4.458 1.00 0.00 H ATOM 14 HB2 PHE A 1 15.827 -4.314 -6.278 1.00 0.00 H ATOM 15 HB3 PHE A 1 14.457 -4.102 -7.362 1.00 0.00 H ATOM 16 HD1 PHE A 1 13.423 -1.514 -6.899 1.00 0.00 H ATOM 17 HD2 PHE A 1 17.476 -2.800 -6.702 1.00 0.00 H ATOM 18 HE1 PHE A 1 14.168 0.781 -7.363 1.00 0.00 H ATOM 19 HE2 PHE A 1 18.228 -0.506 -7.170 1.00 0.00 H ATOM 20 HZ PHE A 1 16.574 1.288 -7.501 1.00 0.00 H ATOM 21 N GLY A 2 11.971 -3.911 -6.649 1.00 0.00 N ATOM 22 CA GLY A 2 10.658 -3.472 -7.096 1.00 0.00 C ATOM 23 C GLY A 2 9.564 -3.775 -6.091 1.00 0.00 C ATOM 24 O GLY A 2 8.719 -2.924 -5.813 1.00 0.00 O ATOM 25 H GLY A 2 12.392 -4.687 -7.074 1.00 0.00 H ATOM 26 HA2 GLY A 2 10.687 -2.406 -7.268 1.00 0.00 H ATOM 27 HA3 GLY A 2 10.424 -3.968 -8.026 1.00 0.00 H ATOM 28 N GLY A 3 9.578 -4.996 -5.552 1.00 0.00 N ATOM 29 CA GLY A 3 8.574 -5.403 -4.580 1.00 0.00 C ATOM 30 C GLY A 3 8.823 -4.854 -3.182 1.00 0.00 C ATOM 31 O GLY A 3 8.859 -5.617 -2.215 1.00 0.00 O ATOM 32 H GLY A 3 10.276 -5.629 -5.820 1.00 0.00 H ATOM 33 HA2 GLY A 3 7.609 -5.058 -4.917 1.00 0.00 H ATOM 34 HA3 GLY A 3 8.559 -6.483 -4.533 1.00 0.00 H ATOM 35 N PHE A 4 8.981 -3.533 -3.070 1.00 0.00 N ATOM 36 CA PHE A 4 9.207 -2.893 -1.775 1.00 0.00 C ATOM 37 C PHE A 4 7.889 -2.732 -1.019 1.00 0.00 C ATOM 38 O PHE A 4 6.987 -2.024 -1.475 1.00 0.00 O ATOM 39 CB PHE A 4 9.872 -1.524 -1.959 1.00 0.00 C ATOM 40 CG PHE A 4 11.372 -1.541 -1.840 1.00 0.00 C ATOM 41 CD1 PHE A 4 12.101 -2.699 -2.073 1.00 0.00 C ATOM 42 CD2 PHE A 4 12.052 -0.389 -1.481 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.478 -2.703 -1.950 1.00 0.00 C ATOM 44 CE2 PHE A 4 13.427 -0.389 -1.354 1.00 0.00 C ATOM 45 CZ PHE A 4 14.141 -1.547 -1.591 1.00 0.00 C ATOM 46 H PHE A 4 8.930 -2.976 -3.874 1.00 0.00 H ATOM 47 HA PHE A 4 9.863 -3.529 -1.199 1.00 0.00 H ATOM 48 HB2 PHE A 4 9.624 -1.140 -2.938 1.00 0.00 H ATOM 49 HB3 PHE A 4 9.489 -0.846 -1.209 1.00 0.00 H ATOM 50 HD1 PHE A 4 11.581 -3.605 -2.354 1.00 0.00 H ATOM 51 HD2 PHE A 4 11.495 0.518 -1.297 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.035 -3.611 -2.134 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.943 0.517 -1.074 1.00 0.00 H ATOM 54 HZ PHE A 4 15.216 -1.549 -1.491 1.00 0.00 H ATOM 55 N THR A 5 7.783 -3.387 0.138 1.00 0.00 N ATOM 56 CA THR A 5 6.570 -3.313 0.951 1.00 0.00 C ATOM 57 C THR A 5 6.739 -4.051 2.277 1.00 0.00 C ATOM 58 O THR A 5 7.132 -5.221 2.305 1.00 0.00 O ATOM 59 CB THR A 5 5.345 -3.894 0.203 1.00 0.00 C ATOM 60 OG1 THR A 5 4.186 -3.883 1.053 1.00 0.00 O ATOM 61 CG2 THR A 5 5.617 -5.314 -0.288 1.00 0.00 C ATOM 62 H THR A 5 8.535 -3.935 0.448 1.00 0.00 H ATOM 63 HA THR A 5 6.376 -2.272 1.157 1.00 0.00 H ATOM 64 HB THR A 5 5.147 -3.269 -0.657 1.00 0.00 H ATOM 65 HG1 THR A 5 4.213 -4.636 1.652 1.00 0.00 H ATOM 66 HG21 THR A 5 4.987 -6.008 0.247 1.00 0.00 H ATOM 67 HG22 THR A 5 6.654 -5.563 -0.118 1.00 0.00 H ATOM 68 HG23 THR A 5 5.403 -5.375 -1.346 1.00 0.00 H ATOM 69 N GLY A 6 6.423 -3.363 3.374 1.00 0.00 N ATOM 70 CA GLY A 6 6.528 -3.971 4.687 1.00 0.00 C ATOM 71 C GLY A 6 5.412 -4.969 4.933 1.00 0.00 C ATOM 72 O GLY A 6 4.241 -4.660 4.715 1.00 0.00 O ATOM 73 H GLY A 6 6.107 -2.441 3.288 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.480 -4.475 4.769 1.00 0.00 H ATOM 75 HA3 GLY A 6 6.475 -3.196 5.437 1.00 0.00 H ATOM 76 N LYS A 7 5.766 -6.169 5.381 1.00 0.00 N ATOM 77 CA LYS A 7 4.767 -7.200 5.652 1.00 0.00 C ATOM 78 C LYS A 7 4.090 -6.940 6.999 1.00 0.00 C ATOM 79 O LYS A 7 2.890 -7.168 7.156 1.00 0.00 O ATOM 80 CB LYS A 7 5.405 -8.595 5.635 1.00 0.00 C ATOM 81 CG LYS A 7 4.483 -9.690 5.098 1.00 0.00 C ATOM 82 CD LYS A 7 3.188 -9.796 5.893 1.00 0.00 C ATOM 83 CE LYS A 7 3.436 -10.309 7.304 1.00 0.00 C ATOM 84 NZ LYS A 7 2.589 -9.644 8.293 1.00 0.00 N1+ ATOM 85 H LYS A 7 6.715 -6.365 5.537 1.00 0.00 H ATOM 86 HA LYS A 7 4.022 -7.145 4.875 1.00 0.00 H ATOM 87 HB2 LYS A 7 6.288 -8.566 5.014 1.00 0.00 H ATOM 88 HB3 LYS A 7 5.693 -8.859 6.641 1.00 0.00 H ATOM 89 HG2 LYS A 7 4.239 -9.469 4.070 1.00 0.00 H ATOM 90 HG3 LYS A 7 5.002 -10.635 5.151 1.00 0.00 H ATOM 91 HD2 LYS A 7 2.727 -8.825 5.946 1.00 0.00 H ATOM 92 HD3 LYS A 7 2.524 -10.481 5.385 1.00 0.00 H ATOM 93 HE2 LYS A 7 3.233 -11.369 7.326 1.00 0.00 H ATOM 94 HE3 LYS A 7 4.472 -10.136 7.559 1.00 0.00 H ATOM 95 HZ1 LYS A 7 3.028 -9.034 8.921 1.00 0.00 H ATOM 96 N ARG A 8 4.868 -6.450 7.968 1.00 0.00 N ATOM 97 CA ARG A 8 4.351 -6.151 9.304 1.00 0.00 C ATOM 98 C ARG A 8 3.127 -5.250 9.245 1.00 0.00 C ATOM 99 O ARG A 8 2.137 -5.491 9.934 1.00 0.00 O ATOM 100 CB ARG A 8 5.426 -5.486 10.165 1.00 0.00 C ATOM 101 CG ARG A 8 6.507 -6.440 10.638 1.00 0.00 C ATOM 102 CD ARG A 8 7.485 -5.745 11.571 1.00 0.00 C ATOM 103 NE ARG A 8 8.280 -6.705 12.337 1.00 0.00 N ATOM 104 CZ ARG A 8 9.204 -7.509 11.808 1.00 0.00 C ATOM 105 NH1 ARG A 8 9.534 -7.409 10.524 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.813 -8.405 12.575 1.00 0.00 N ATOM 107 H ARG A 8 5.811 -6.278 7.778 1.00 0.00 H ATOM 108 HA ARG A 8 4.068 -7.086 9.761 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.897 -4.703 9.588 1.00 0.00 H ATOM 110 HB3 ARG A 8 4.955 -5.048 11.033 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.044 -7.263 11.163 1.00 0.00 H ATOM 112 HG3 ARG A 8 7.044 -6.815 9.778 1.00 0.00 H ATOM 113 HD2 ARG A 8 8.148 -5.129 10.982 1.00 0.00 H ATOM 114 HD3 ARG A 8 6.929 -5.121 12.257 1.00 0.00 H ATOM 115 HE ARG A 8 8.093 -6.776 13.297 1.00 0.00 H ATOM 116 HH11 ARG A 8 9.093 -6.724 9.944 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.228 -8.016 10.137 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.579 -8.475 13.547 1.00 0.00 H ATOM 119 HH22 ARG A 8 10.506 -9.012 12.184 1.00 0.00 H ATOM 120 N LYS A 9 3.201 -4.210 8.429 1.00 0.00 N ATOM 121 CA LYS A 9 2.087 -3.272 8.301 1.00 0.00 C ATOM 122 C LYS A 9 0.823 -3.973 7.804 1.00 0.00 C ATOM 123 O LYS A 9 -0.259 -3.780 8.364 1.00 0.00 O ATOM 124 CB LYS A 9 2.449 -2.097 7.381 1.00 0.00 C ATOM 125 CG LYS A 9 2.855 -2.500 5.971 1.00 0.00 C ATOM 126 CD LYS A 9 3.026 -1.288 5.067 1.00 0.00 C ATOM 127 CE LYS A 9 1.728 -0.502 4.934 1.00 0.00 C ATOM 128 NZ LYS A 9 1.845 0.612 3.954 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.021 -4.068 7.908 1.00 0.00 H ATOM 130 HA LYS A 9 1.886 -2.884 9.287 1.00 0.00 H ATOM 131 HB2 LYS A 9 1.594 -1.441 7.308 1.00 0.00 H ATOM 132 HB3 LYS A 9 3.268 -1.552 7.824 1.00 0.00 H ATOM 133 HG2 LYS A 9 3.793 -3.032 6.020 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.096 -3.143 5.554 1.00 0.00 H ATOM 135 HD2 LYS A 9 3.783 -0.643 5.486 1.00 0.00 H ATOM 136 HD3 LYS A 9 3.337 -1.622 4.087 1.00 0.00 H ATOM 137 HE2 LYS A 9 0.949 -1.174 4.609 1.00 0.00 H ATOM 138 HE3 LYS A 9 1.470 -0.095 5.900 1.00 0.00 H ATOM 139 HZ1 LYS A 9 2.518 1.326 4.302 1.00 0.00 H ATOM 140 HZ2 LYS A 9 0.919 1.062 3.814 1.00 0.00 H ATOM 141 HZ3 LYS A 9 2.184 0.250 3.039 1.00 0.00 H ATOM 142 N SER A 10 0.958 -4.792 6.758 1.00 0.00 N ATOM 143 CA SER A 10 -0.186 -5.516 6.202 1.00 0.00 C ATOM 144 C SER A 10 -0.844 -6.397 7.265 1.00 0.00 C ATOM 145 O SER A 10 -2.053 -6.320 7.480 1.00 0.00 O ATOM 146 CB SER A 10 0.233 -6.373 5.002 1.00 0.00 C ATOM 147 OG SER A 10 -0.886 -7.041 4.442 1.00 0.00 O ATOM 148 H SER A 10 1.844 -4.912 6.356 1.00 0.00 H ATOM 149 HA SER A 10 -0.905 -4.783 5.874 1.00 0.00 H ATOM 150 HB2 SER A 10 0.673 -5.740 4.246 1.00 0.00 H ATOM 151 HB3 SER A 10 0.955 -7.111 5.320 1.00 0.00 H ATOM 152 HG SER A 10 -0.614 -7.898 4.105 1.00 0.00 H ATOM 153 N ASP A 11 -0.036 -7.221 7.933 1.00 0.00 N ATOM 154 CA ASP A 11 -0.537 -8.114 8.982 1.00 0.00 C ATOM 155 C ASP A 11 -1.128 -7.316 10.150 1.00 0.00 C ATOM 156 O ASP A 11 -2.105 -7.742 10.767 1.00 0.00 O ATOM 157 CB ASP A 11 0.582 -9.031 9.501 1.00 0.00 C ATOM 158 CG ASP A 11 1.269 -9.819 8.396 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.627 -10.568 7.658 1.00 0.00 O ATOM 160 H ASP A 11 0.921 -7.226 7.721 1.00 0.00 H ATOM 161 HA ASP A 11 -1.316 -8.723 8.551 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.328 -8.430 10.002 1.00 0.00 H ATOM 163 HB3 ASP A 11 0.162 -9.733 10.208 1.00 0.00 H ATOM 164 N ARG A 12 -0.517 -6.165 10.451 1.00 0.00 N ATOM 165 CA ARG A 12 -0.965 -5.306 11.550 1.00 0.00 C ATOM 166 C ARG A 12 -2.449 -4.970 11.429 1.00 0.00 C ATOM 167 O ARG A 12 -3.225 -5.215 12.355 1.00 0.00 O ATOM 168 CB ARG A 12 -0.144 -4.013 11.570 1.00 0.00 C ATOM 169 CG ARG A 12 -0.337 -3.170 12.824 1.00 0.00 C ATOM 170 CD ARG A 12 0.334 -1.808 12.691 1.00 0.00 C ATOM 171 NE ARG A 12 1.754 -1.909 12.345 1.00 0.00 N ATOM 172 CZ ARG A 12 2.532 -0.854 12.088 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.030 0.378 12.133 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.812 -1.034 11.782 1.00 0.00 N ATOM 175 H ARG A 12 0.262 -5.890 9.923 1.00 0.00 H ATOM 176 HA ARG A 12 -0.803 -5.837 12.471 1.00 0.00 H ATOM 177 HB2 ARG A 12 0.901 -4.265 11.493 1.00 0.00 H ATOM 178 HB3 ARG A 12 -0.421 -3.414 10.716 1.00 0.00 H ATOM 179 HG2 ARG A 12 -1.393 -3.024 12.992 1.00 0.00 H ATOM 180 HG3 ARG A 12 0.095 -3.693 13.664 1.00 0.00 H ATOM 181 HD2 ARG A 12 -0.173 -1.246 11.922 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.241 -1.286 13.632 1.00 0.00 H ATOM 183 HE ARG A 12 2.148 -2.805 12.304 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.068 0.521 12.361 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.619 1.165 11.940 1.00 0.00 H ATOM 186 HH21 ARG A 12 4.194 -1.958 11.744 1.00 0.00 H ATOM 187 HH22 ARG A 12 4.397 -0.245 11.589 1.00 0.00 H ATOM 188 N LYS A 13 -2.838 -4.405 10.286 1.00 0.00 N ATOM 189 CA LYS A 13 -4.234 -4.035 10.053 1.00 0.00 C ATOM 190 C LYS A 13 -5.133 -5.261 9.863 1.00 0.00 C ATOM 191 O LYS A 13 -6.287 -5.244 10.276 1.00 0.00 O ATOM 192 CB LYS A 13 -4.360 -3.088 8.850 1.00 0.00 C ATOM 193 CG LYS A 13 -4.251 -1.612 9.221 1.00 0.00 C ATOM 194 CD LYS A 13 -2.907 -1.274 9.849 1.00 0.00 C ATOM 195 CE LYS A 13 -1.790 -1.286 8.819 1.00 0.00 C ATOM 196 NZ LYS A 13 -0.472 -0.955 9.429 1.00 0.00 N1+ ATOM 197 H LYS A 13 -2.173 -4.233 9.586 1.00 0.00 H ATOM 198 HA LYS A 13 -4.571 -3.509 10.934 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.577 -3.318 8.141 1.00 0.00 H ATOM 200 HB3 LYS A 13 -5.319 -3.247 8.378 1.00 0.00 H ATOM 201 HG2 LYS A 13 -4.374 -1.018 8.328 1.00 0.00 H ATOM 202 HG3 LYS A 13 -5.036 -1.371 9.923 1.00 0.00 H ATOM 203 HD2 LYS A 13 -2.964 -0.289 10.289 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.685 -2.000 10.616 1.00 0.00 H ATOM 205 HE2 LYS A 13 -1.736 -2.268 8.376 1.00 0.00 H ATOM 206 HE3 LYS A 13 -2.015 -0.558 8.054 1.00 0.00 H ATOM 207 HZ1 LYS A 13 0.207 -0.681 8.689 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -0.097 -1.780 9.938 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -0.576 -0.165 10.100 1.00 0.00 H ATOM 210 N LYS A 14 -4.609 -6.313 9.231 1.00 0.00 N ATOM 211 CA LYS A 14 -5.391 -7.530 8.982 1.00 0.00 C ATOM 212 C LYS A 14 -5.969 -8.138 10.259 1.00 0.00 C ATOM 213 O LYS A 14 -7.106 -8.605 10.260 1.00 0.00 O ATOM 214 CB LYS A 14 -4.555 -8.580 8.243 1.00 0.00 C ATOM 215 CG LYS A 14 -4.324 -8.253 6.775 1.00 0.00 C ATOM 216 CD LYS A 14 -5.628 -7.975 6.023 1.00 0.00 C ATOM 217 CE LYS A 14 -6.499 -9.218 5.868 1.00 0.00 C ATOM 218 NZ LYS A 14 -7.244 -9.569 7.086 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.683 -6.268 8.914 1.00 0.00 H ATOM 220 HA LYS A 14 -6.215 -7.250 8.348 1.00 0.00 H ATOM 221 HB2 LYS A 14 -3.592 -8.662 8.727 1.00 0.00 H ATOM 222 HB3 LYS A 14 -5.055 -9.535 8.304 1.00 0.00 H ATOM 223 HG2 LYS A 14 -3.698 -7.379 6.710 1.00 0.00 H ATOM 224 HG3 LYS A 14 -3.823 -9.089 6.308 1.00 0.00 H ATOM 225 HD2 LYS A 14 -6.187 -7.224 6.558 1.00 0.00 H ATOM 226 HD3 LYS A 14 -5.381 -7.600 5.039 1.00 0.00 H ATOM 227 HE2 LYS A 14 -7.204 -9.047 5.068 1.00 0.00 H ATOM 228 HE3 LYS A 14 -5.859 -10.049 5.602 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -6.727 -9.855 7.866 1.00 0.00 H ATOM 230 N LYS A 15 -5.201 -8.146 11.340 1.00 0.00 N ATOM 231 CA LYS A 15 -5.691 -8.726 12.588 1.00 0.00 C ATOM 232 C LYS A 15 -6.984 -8.038 13.025 1.00 0.00 C ATOM 233 O LYS A 15 -7.967 -8.702 13.362 1.00 0.00 O ATOM 234 CB LYS A 15 -4.646 -8.628 13.707 1.00 0.00 C ATOM 235 CG LYS A 15 -4.774 -9.731 14.752 1.00 0.00 C ATOM 236 CD LYS A 15 -3.929 -9.439 15.983 1.00 0.00 C ATOM 237 CE LYS A 15 -3.940 -10.601 16.970 1.00 0.00 C ATOM 238 NZ LYS A 15 -3.201 -10.270 18.222 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.298 -7.768 11.299 1.00 0.00 H ATOM 240 HA LYS A 15 -5.904 -9.767 12.399 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.658 -8.683 13.272 1.00 0.00 H ATOM 242 HB3 LYS A 15 -4.758 -7.677 14.207 1.00 0.00 H ATOM 243 HG2 LYS A 15 -5.809 -9.816 15.050 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.445 -10.665 14.312 1.00 0.00 H ATOM 245 HD2 LYS A 15 -2.909 -9.253 15.675 1.00 0.00 H ATOM 246 HD3 LYS A 15 -4.324 -8.560 16.474 1.00 0.00 H ATOM 247 HE2 LYS A 15 -4.965 -10.840 17.219 1.00 0.00 H ATOM 248 HE3 LYS A 15 -3.472 -11.458 16.503 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -2.843 -11.140 18.667 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.832 -9.785 18.895 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -2.395 -9.645 18.009 1.00 0.00 H ATOM 252 N ASN A 16 -6.976 -6.705 13.015 1.00 0.00 N ATOM 253 CA ASN A 16 -8.148 -5.921 13.409 1.00 0.00 C ATOM 254 C ASN A 16 -9.186 -5.867 12.282 1.00 0.00 C ATOM 255 O ASN A 16 -10.353 -6.201 12.485 1.00 0.00 O ATOM 256 CB ASN A 16 -7.722 -4.502 13.807 1.00 0.00 C ATOM 257 CG ASN A 16 -8.866 -3.687 14.390 1.00 0.00 C ATOM 258 OD1 ASN A 16 -9.812 -3.336 13.687 1.00 0.00 O ATOM 259 ND2 ASN A 16 -8.787 -3.388 15.686 1.00 0.00 N ATOM 260 H ASN A 16 -6.160 -6.239 12.731 1.00 0.00 H ATOM 261 HA ASN A 16 -8.594 -6.403 14.265 1.00 0.00 H ATOM 262 HB2 ASN A 16 -6.934 -4.561 14.542 1.00 0.00 H ATOM 263 HB3 ASN A 16 -7.354 -3.986 12.929 1.00 0.00 H ATOM 264 HD21 ASN A 16 -8.008 -3.705 16.190 1.00 0.00 H ATOM 265 HD22 ASN A 16 -9.513 -2.863 16.084 1.00 0.00 H ATOM 266 N GLN A 17 -8.739 -5.446 11.098 1.00 0.00 N ATOM 267 CA GLN A 17 -9.598 -5.334 9.917 1.00 0.00 C ATOM 268 C GLN A 17 -10.358 -6.633 9.649 1.00 0.00 C ATOM 269 O GLN A 17 -11.588 -6.670 9.724 1.00 0.00 O ATOM 270 CB GLN A 17 -8.740 -4.977 8.698 1.00 0.00 C ATOM 271 CG GLN A 17 -9.513 -4.909 7.390 1.00 0.00 C ATOM 272 CD GLN A 17 -8.604 -4.742 6.185 1.00 0.00 C ATOM 273 OE1 GLN A 17 -7.797 -5.620 5.875 1.00 0.00 O ATOM 274 NE2 GLN A 17 -8.726 -3.613 5.497 1.00 0.00 N ATOM 275 H GLN A 17 -7.795 -5.199 11.017 1.00 0.00 H ATOM 276 HA GLN A 17 -10.309 -4.542 10.092 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.281 -4.015 8.870 1.00 0.00 H ATOM 278 HB3 GLN A 17 -7.963 -5.720 8.593 1.00 0.00 H ATOM 279 HG2 GLN A 17 -10.075 -5.824 7.270 1.00 0.00 H ATOM 280 HG3 GLN A 17 -10.190 -4.070 7.431 1.00 0.00 H ATOM 281 HE21 GLN A 17 -9.385 -2.953 5.799 1.00 0.00 H ATOM 282 HE22 GLN A 17 -8.151 -3.485 4.715 1.00 0.00 H ATOM 283 N ASP A 18 -9.614 -7.695 9.342 1.00 0.00 N ATOM 284 CA ASP A 18 -10.210 -8.997 9.069 1.00 0.00 C ATOM 285 C ASP A 18 -10.844 -9.580 10.335 1.00 0.00 C ATOM 286 O ASP A 18 -11.978 -10.057 10.307 1.00 0.00 O ATOM 287 CB ASP A 18 -9.170 -9.979 8.513 1.00 0.00 C ATOM 288 CG ASP A 18 -8.579 -9.548 7.176 1.00 0.00 C ATOM 289 OD1 ASP A 18 -9.311 -9.239 6.233 1.00 0.00 O ATOM 290 H ASP A 18 -8.641 -7.596 9.303 1.00 0.00 H ATOM 291 HA ASP A 18 -10.985 -8.854 8.330 1.00 0.00 H ATOM 292 HB2 ASP A 18 -8.363 -10.075 9.222 1.00 0.00 H ATOM 293 HB3 ASP A 18 -9.639 -10.944 8.381 1.00 0.00 H HETATM 294 N NH2 A 19 -10.110 -9.543 11.448 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.213 -9.147 11.405 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.498 -9.916 12.267 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 9 ATOM 1 N PHE A 1 11.628 -9.474 -5.212 1.00 0.00 N ATOM 2 CA PHE A 1 10.740 -9.615 -4.060 1.00 0.00 C ATOM 3 C PHE A 1 9.896 -8.355 -3.840 1.00 0.00 C ATOM 4 O PHE A 1 9.645 -7.951 -2.701 1.00 0.00 O ATOM 5 CB PHE A 1 11.558 -9.955 -2.803 1.00 0.00 C ATOM 6 CG PHE A 1 12.751 -9.062 -2.571 1.00 0.00 C ATOM 7 CD1 PHE A 1 12.594 -7.715 -2.278 1.00 0.00 C ATOM 8 CD2 PHE A 1 14.036 -9.582 -2.634 1.00 0.00 C ATOM 9 CE1 PHE A 1 13.693 -6.905 -2.060 1.00 0.00 C ATOM 10 CE2 PHE A 1 15.137 -8.776 -2.415 1.00 0.00 C ATOM 11 CZ PHE A 1 14.965 -7.436 -2.127 1.00 0.00 C ATOM 12 H1 PHE A 1 12.172 -8.664 -5.301 1.00 0.00 H ATOM 13 HA PHE A 1 10.073 -10.438 -4.267 1.00 0.00 H ATOM 14 HB2 PHE A 1 10.917 -9.876 -1.937 1.00 0.00 H ATOM 15 HB3 PHE A 1 11.915 -10.970 -2.884 1.00 0.00 H ATOM 16 HD1 PHE A 1 11.602 -7.296 -2.223 1.00 0.00 H ATOM 17 HD2 PHE A 1 14.173 -10.628 -2.862 1.00 0.00 H ATOM 18 HE1 PHE A 1 13.556 -5.856 -1.834 1.00 0.00 H ATOM 19 HE2 PHE A 1 16.132 -9.193 -2.467 1.00 0.00 H ATOM 20 HZ PHE A 1 15.825 -6.805 -1.955 1.00 0.00 H ATOM 21 N GLY A 2 9.446 -7.747 -4.941 1.00 0.00 N ATOM 22 CA GLY A 2 8.625 -6.548 -4.857 1.00 0.00 C ATOM 23 C GLY A 2 7.287 -6.792 -4.177 1.00 0.00 C ATOM 24 O GLY A 2 6.800 -5.936 -3.436 1.00 0.00 O ATOM 25 H GLY A 2 9.667 -8.120 -5.821 1.00 0.00 H ATOM 26 HA2 GLY A 2 9.164 -5.795 -4.301 1.00 0.00 H ATOM 27 HA3 GLY A 2 8.443 -6.179 -5.856 1.00 0.00 H ATOM 28 N GLY A 3 6.689 -7.959 -4.440 1.00 0.00 N ATOM 29 CA GLY A 3 5.399 -8.301 -3.857 1.00 0.00 C ATOM 30 C GLY A 3 5.365 -8.170 -2.343 1.00 0.00 C ATOM 31 O GLY A 3 6.242 -8.688 -1.649 1.00 0.00 O ATOM 32 H GLY A 3 7.126 -8.594 -5.046 1.00 0.00 H ATOM 33 HA2 GLY A 3 4.646 -7.652 -4.276 1.00 0.00 H ATOM 34 HA3 GLY A 3 5.161 -9.321 -4.121 1.00 0.00 H ATOM 35 N PHE A 4 4.333 -7.481 -1.842 1.00 0.00 N ATOM 36 CA PHE A 4 4.136 -7.267 -0.404 1.00 0.00 C ATOM 37 C PHE A 4 5.213 -6.369 0.193 1.00 0.00 C ATOM 38 O PHE A 4 6.411 -6.600 0.018 1.00 0.00 O ATOM 39 CB PHE A 4 4.080 -8.600 0.353 1.00 0.00 C ATOM 40 CG PHE A 4 3.002 -9.528 -0.138 1.00 0.00 C ATOM 41 CD1 PHE A 4 3.215 -10.342 -1.240 1.00 0.00 C ATOM 42 CD2 PHE A 4 1.778 -9.588 0.508 1.00 0.00 C ATOM 43 CE1 PHE A 4 2.228 -11.197 -1.688 1.00 0.00 C ATOM 44 CE2 PHE A 4 0.787 -10.443 0.065 1.00 0.00 C ATOM 45 CZ PHE A 4 1.012 -11.247 -1.034 1.00 0.00 C ATOM 46 H PHE A 4 3.673 -7.109 -2.464 1.00 0.00 H ATOM 47 HA PHE A 4 3.189 -6.764 -0.277 1.00 0.00 H ATOM 48 HB2 PHE A 4 5.027 -9.107 0.249 1.00 0.00 H ATOM 49 HB3 PHE A 4 3.898 -8.404 1.400 1.00 0.00 H ATOM 50 HD1 PHE A 4 4.166 -10.304 -1.751 1.00 0.00 H ATOM 51 HD2 PHE A 4 1.601 -8.958 1.368 1.00 0.00 H ATOM 52 HE1 PHE A 4 2.407 -11.825 -2.548 1.00 0.00 H ATOM 53 HE2 PHE A 4 -0.163 -10.481 0.578 1.00 0.00 H ATOM 54 HZ PHE A 4 0.238 -11.915 -1.383 1.00 0.00 H ATOM 55 N THR A 5 4.758 -5.340 0.902 1.00 0.00 N ATOM 56 CA THR A 5 5.646 -4.380 1.545 1.00 0.00 C ATOM 57 C THR A 5 6.197 -4.932 2.865 1.00 0.00 C ATOM 58 O THR A 5 6.278 -6.149 3.056 1.00 0.00 O ATOM 59 CB THR A 5 4.904 -3.040 1.780 1.00 0.00 C ATOM 60 OG1 THR A 5 5.810 -2.034 2.252 1.00 0.00 O ATOM 61 CG2 THR A 5 3.769 -3.214 2.777 1.00 0.00 C ATOM 62 H THR A 5 3.789 -5.223 0.996 1.00 0.00 H ATOM 63 HA THR A 5 6.476 -4.192 0.888 1.00 0.00 H ATOM 64 HB THR A 5 4.484 -2.715 0.839 1.00 0.00 H ATOM 65 HG1 THR A 5 5.476 -1.166 2.017 1.00 0.00 H ATOM 66 HG21 THR A 5 3.470 -4.252 2.806 1.00 0.00 H ATOM 67 HG22 THR A 5 2.930 -2.606 2.475 1.00 0.00 H ATOM 68 HG23 THR A 5 4.102 -2.909 3.759 1.00 0.00 H ATOM 69 N GLY A 6 6.576 -4.030 3.762 1.00 0.00 N ATOM 70 CA GLY A 6 7.120 -4.421 5.046 1.00 0.00 C ATOM 71 C GLY A 6 6.053 -4.824 6.042 1.00 0.00 C ATOM 72 O GLY A 6 5.422 -5.873 5.901 1.00 0.00 O ATOM 73 H GLY A 6 6.487 -3.082 3.543 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.792 -5.253 4.900 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.678 -3.590 5.451 1.00 0.00 H ATOM 76 N LYS A 7 5.869 -3.988 7.060 1.00 0.00 N ATOM 77 CA LYS A 7 4.884 -4.252 8.112 1.00 0.00 C ATOM 78 C LYS A 7 3.476 -3.800 7.717 1.00 0.00 C ATOM 79 O LYS A 7 2.499 -4.240 8.319 1.00 0.00 O ATOM 80 CB LYS A 7 5.275 -3.569 9.427 1.00 0.00 C ATOM 81 CG LYS A 7 5.006 -2.070 9.446 1.00 0.00 C ATOM 82 CD LYS A 7 4.858 -1.542 10.866 1.00 0.00 C ATOM 83 CE LYS A 7 3.786 -2.302 11.646 1.00 0.00 C ATOM 84 NZ LYS A 7 2.496 -2.350 10.947 1.00 0.00 N1+ ATOM 85 H LYS A 7 6.414 -3.176 7.106 1.00 0.00 H ATOM 86 HA LYS A 7 4.865 -5.320 8.275 1.00 0.00 H ATOM 87 HB2 LYS A 7 4.718 -4.024 10.231 1.00 0.00 H ATOM 88 HB3 LYS A 7 6.330 -3.726 9.600 1.00 0.00 H ATOM 89 HG2 LYS A 7 5.829 -1.559 8.969 1.00 0.00 H ATOM 90 HG3 LYS A 7 4.095 -1.869 8.902 1.00 0.00 H ATOM 91 HD2 LYS A 7 5.803 -1.647 11.378 1.00 0.00 H ATOM 92 HD3 LYS A 7 4.586 -0.496 10.824 1.00 0.00 H ATOM 93 HE2 LYS A 7 4.130 -3.311 11.812 1.00 0.00 H ATOM 94 HE3 LYS A 7 3.647 -1.814 12.600 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.467 -2.021 10.024 1.00 0.00 H ATOM 96 N ARG A 8 3.373 -2.903 6.727 1.00 0.00 N ATOM 97 CA ARG A 8 2.076 -2.389 6.285 1.00 0.00 C ATOM 98 C ARG A 8 1.095 -3.536 6.094 1.00 0.00 C ATOM 99 O ARG A 8 -0.075 -3.445 6.468 1.00 0.00 O ATOM 100 CB ARG A 8 2.223 -1.619 4.972 1.00 0.00 C ATOM 101 CG ARG A 8 1.082 -0.656 4.687 1.00 0.00 C ATOM 102 CD ARG A 8 1.138 -0.131 3.256 1.00 0.00 C ATOM 103 NE ARG A 8 2.494 0.251 2.844 1.00 0.00 N ATOM 104 CZ ARG A 8 3.199 1.254 3.379 1.00 0.00 C ATOM 105 NH1 ARG A 8 2.673 2.024 4.329 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 4.434 1.496 2.952 1.00 0.00 N ATOM 107 H ARG A 8 4.186 -2.574 6.292 1.00 0.00 H ATOM 108 HA ARG A 8 1.699 -1.725 7.050 1.00 0.00 H ATOM 109 HB2 ARG A 8 3.142 -1.053 4.999 1.00 0.00 H ATOM 110 HB3 ARG A 8 2.272 -2.329 4.161 1.00 0.00 H ATOM 111 HG2 ARG A 8 0.144 -1.173 4.833 1.00 0.00 H ATOM 112 HG3 ARG A 8 1.147 0.176 5.372 1.00 0.00 H ATOM 113 HD2 ARG A 8 0.778 -0.903 2.592 1.00 0.00 H ATOM 114 HD3 ARG A 8 0.492 0.732 3.181 1.00 0.00 H ATOM 115 HE ARG A 8 2.909 -0.278 2.131 1.00 0.00 H ATOM 116 HH11 ARG A 8 1.742 1.861 4.651 1.00 0.00 H ATOM 117 HH12 ARG A 8 3.213 2.769 4.723 1.00 0.00 H ATOM 118 HH21 ARG A 8 4.834 0.928 2.232 1.00 0.00 H ATOM 119 HH22 ARG A 8 4.966 2.243 3.353 1.00 0.00 H ATOM 120 N LYS A 9 1.595 -4.621 5.521 1.00 0.00 N ATOM 121 CA LYS A 9 0.781 -5.807 5.284 1.00 0.00 C ATOM 122 C LYS A 9 0.377 -6.463 6.604 1.00 0.00 C ATOM 123 O LYS A 9 -0.783 -6.828 6.791 1.00 0.00 O ATOM 124 CB LYS A 9 1.537 -6.806 4.399 1.00 0.00 C ATOM 125 CG LYS A 9 0.802 -8.124 4.189 1.00 0.00 C ATOM 126 CD LYS A 9 1.592 -9.298 4.749 1.00 0.00 C ATOM 127 CE LYS A 9 0.827 -10.609 4.617 1.00 0.00 C ATOM 128 NZ LYS A 9 0.572 -10.974 3.194 1.00 0.00 N1+ ATOM 129 H LYS A 9 2.542 -4.627 5.261 1.00 0.00 H ATOM 130 HA LYS A 9 -0.112 -5.492 4.769 1.00 0.00 H ATOM 131 HB2 LYS A 9 1.701 -6.355 3.432 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.494 -7.019 4.854 1.00 0.00 H ATOM 133 HG2 LYS A 9 -0.155 -8.078 4.687 1.00 0.00 H ATOM 134 HG3 LYS A 9 0.652 -8.276 3.130 1.00 0.00 H ATOM 135 HD2 LYS A 9 2.522 -9.383 4.208 1.00 0.00 H ATOM 136 HD3 LYS A 9 1.797 -9.117 5.794 1.00 0.00 H ATOM 137 HE2 LYS A 9 1.405 -11.394 5.080 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.119 -10.511 5.129 1.00 0.00 H ATOM 139 HZ1 LYS A 9 0.057 -10.209 2.714 1.00 0.00 H ATOM 140 HZ2 LYS A 9 0.005 -11.844 3.145 1.00 0.00 H ATOM 141 HZ3 LYS A 9 1.474 -11.134 2.700 1.00 0.00 H ATOM 142 N SER A 10 1.341 -6.606 7.516 1.00 0.00 N ATOM 143 CA SER A 10 1.084 -7.214 8.822 1.00 0.00 C ATOM 144 C SER A 10 0.096 -6.381 9.640 1.00 0.00 C ATOM 145 O SER A 10 -0.873 -6.916 10.185 1.00 0.00 O ATOM 146 CB SER A 10 2.392 -7.386 9.602 1.00 0.00 C ATOM 147 OG SER A 10 2.157 -7.961 10.877 1.00 0.00 O ATOM 148 H SER A 10 2.246 -6.293 7.306 1.00 0.00 H ATOM 149 HA SER A 10 0.653 -8.187 8.649 1.00 0.00 H ATOM 150 HB2 SER A 10 3.057 -8.034 9.047 1.00 0.00 H ATOM 151 HB3 SER A 10 2.859 -6.420 9.736 1.00 0.00 H ATOM 152 HG SER A 10 2.260 -7.291 11.556 1.00 0.00 H ATOM 153 N ASP A 11 0.346 -5.074 9.722 1.00 0.00 N ATOM 154 CA ASP A 11 -0.522 -4.168 10.477 1.00 0.00 C ATOM 155 C ASP A 11 -1.893 -4.031 9.819 1.00 0.00 C ATOM 156 O ASP A 11 -2.919 -4.117 10.491 1.00 0.00 O ATOM 157 CB ASP A 11 0.128 -2.786 10.628 1.00 0.00 C ATOM 158 CG ASP A 11 1.373 -2.814 11.499 1.00 0.00 C ATOM 159 OD1 ASP A 11 1.321 -3.240 12.655 1.00 0.00 O ATOM 160 H ASP A 11 1.134 -4.710 9.267 1.00 0.00 H ATOM 161 HA ASP A 11 -0.660 -4.594 11.458 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.403 -2.416 9.652 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.586 -2.108 11.075 1.00 0.00 H ATOM 164 N ARG A 12 -1.907 -3.819 8.502 1.00 0.00 N ATOM 165 CA ARG A 12 -3.161 -3.671 7.764 1.00 0.00 C ATOM 166 C ARG A 12 -4.049 -4.901 7.949 1.00 0.00 C ATOM 167 O ARG A 12 -5.256 -4.781 8.161 1.00 0.00 O ATOM 168 CB ARG A 12 -2.883 -3.437 6.274 1.00 0.00 C ATOM 169 CG ARG A 12 -4.129 -3.169 5.433 1.00 0.00 C ATOM 170 CD ARG A 12 -4.780 -1.831 5.776 1.00 0.00 C ATOM 171 NE ARG A 12 -5.432 -1.843 7.086 1.00 0.00 N ATOM 172 CZ ARG A 12 -5.913 -0.755 7.694 1.00 0.00 C ATOM 173 NH1 ARG A 12 -5.793 0.446 7.137 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -6.516 -0.869 8.870 1.00 0.00 N ATOM 175 H ARG A 12 -1.057 -3.762 8.018 1.00 0.00 H ATOM 176 HA ARG A 12 -3.675 -2.810 8.164 1.00 0.00 H ATOM 177 HB2 ARG A 12 -2.223 -2.589 6.176 1.00 0.00 H ATOM 178 HB3 ARG A 12 -2.389 -4.310 5.876 1.00 0.00 H ATOM 179 HG2 ARG A 12 -3.851 -3.161 4.390 1.00 0.00 H ATOM 180 HG3 ARG A 12 -4.842 -3.961 5.609 1.00 0.00 H ATOM 181 HD2 ARG A 12 -4.020 -1.064 5.773 1.00 0.00 H ATOM 182 HD3 ARG A 12 -5.519 -1.605 5.022 1.00 0.00 H ATOM 183 HE ARG A 12 -5.531 -2.710 7.533 1.00 0.00 H ATOM 184 HH11 ARG A 12 -5.338 0.549 6.251 1.00 0.00 H ATOM 185 HH12 ARG A 12 -6.158 1.252 7.605 1.00 0.00 H ATOM 186 HH21 ARG A 12 -6.612 -1.767 9.298 1.00 0.00 H ATOM 187 HH22 ARG A 12 -6.876 -0.056 9.329 1.00 0.00 H ATOM 188 N LYS A 13 -3.442 -6.078 7.872 1.00 0.00 N ATOM 189 CA LYS A 13 -4.176 -7.332 8.036 1.00 0.00 C ATOM 190 C LYS A 13 -4.716 -7.457 9.461 1.00 0.00 C ATOM 191 O LYS A 13 -5.893 -7.759 9.658 1.00 0.00 O ATOM 192 CB LYS A 13 -3.267 -8.526 7.701 1.00 0.00 C ATOM 193 CG LYS A 13 -4.008 -9.843 7.472 1.00 0.00 C ATOM 194 CD LYS A 13 -4.582 -10.430 8.756 1.00 0.00 C ATOM 195 CE LYS A 13 -3.494 -10.802 9.755 1.00 0.00 C ATOM 196 NZ LYS A 13 -2.616 -11.896 9.247 1.00 0.00 N1+ ATOM 197 H LYS A 13 -2.477 -6.107 7.705 1.00 0.00 H ATOM 198 HA LYS A 13 -5.007 -7.318 7.350 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.712 -8.297 6.805 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.571 -8.669 8.515 1.00 0.00 H ATOM 201 HG2 LYS A 13 -4.820 -9.669 6.783 1.00 0.00 H ATOM 202 HG3 LYS A 13 -3.320 -10.556 7.039 1.00 0.00 H ATOM 203 HD2 LYS A 13 -5.239 -9.709 9.210 1.00 0.00 H ATOM 204 HD3 LYS A 13 -5.143 -11.320 8.507 1.00 0.00 H ATOM 205 HE2 LYS A 13 -2.889 -9.929 9.951 1.00 0.00 H ATOM 206 HE3 LYS A 13 -3.963 -11.126 10.671 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -2.202 -12.421 10.045 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -1.845 -11.501 8.671 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -3.167 -12.556 8.662 1.00 0.00 H ATOM 210 N LYS A 14 -3.848 -7.223 10.447 1.00 0.00 N ATOM 211 CA LYS A 14 -4.229 -7.314 11.860 1.00 0.00 C ATOM 212 C LYS A 14 -5.409 -6.403 12.205 1.00 0.00 C ATOM 213 O LYS A 14 -6.383 -6.854 12.803 1.00 0.00 O ATOM 214 CB LYS A 14 -3.032 -6.992 12.762 1.00 0.00 C ATOM 215 CG LYS A 14 -2.034 -8.137 12.888 1.00 0.00 C ATOM 216 CD LYS A 14 -2.393 -9.112 14.010 1.00 0.00 C ATOM 217 CE LYS A 14 -3.752 -9.780 13.813 1.00 0.00 C ATOM 218 NZ LYS A 14 -4.861 -8.949 14.289 1.00 0.00 N1+ ATOM 219 H LYS A 14 -2.924 -6.988 10.220 1.00 0.00 H ATOM 220 HA LYS A 14 -4.529 -8.333 12.041 1.00 0.00 H ATOM 221 HB2 LYS A 14 -2.514 -6.136 12.359 1.00 0.00 H ATOM 222 HB3 LYS A 14 -3.394 -6.750 13.751 1.00 0.00 H ATOM 223 HG2 LYS A 14 -2.010 -8.678 11.954 1.00 0.00 H ATOM 224 HG3 LYS A 14 -1.056 -7.722 13.086 1.00 0.00 H ATOM 225 HD2 LYS A 14 -1.637 -9.880 14.056 1.00 0.00 H ATOM 226 HD3 LYS A 14 -2.407 -8.569 14.945 1.00 0.00 H ATOM 227 HE2 LYS A 14 -3.892 -9.978 12.761 1.00 0.00 H ATOM 228 HE3 LYS A 14 -3.758 -10.714 14.356 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -4.750 -7.977 14.244 1.00 0.00 H ATOM 230 N LYS A 15 -5.327 -5.131 11.828 1.00 0.00 N ATOM 231 CA LYS A 15 -6.407 -4.182 12.111 1.00 0.00 C ATOM 232 C LYS A 15 -7.720 -4.617 11.457 1.00 0.00 C ATOM 233 O LYS A 15 -8.790 -4.482 12.052 1.00 0.00 O ATOM 234 CB LYS A 15 -6.024 -2.768 11.658 1.00 0.00 C ATOM 235 CG LYS A 15 -5.184 -2.001 12.674 1.00 0.00 C ATOM 236 CD LYS A 15 -3.909 -2.747 13.042 1.00 0.00 C ATOM 237 CE LYS A 15 -3.080 -1.977 14.061 1.00 0.00 C ATOM 238 NZ LYS A 15 -2.558 -0.693 13.508 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.529 -4.824 11.350 1.00 0.00 H ATOM 240 HA LYS A 15 -6.553 -4.172 13.182 1.00 0.00 H ATOM 241 HB2 LYS A 15 -5.461 -2.839 10.740 1.00 0.00 H ATOM 242 HB3 LYS A 15 -6.927 -2.205 11.473 1.00 0.00 H ATOM 243 HG2 LYS A 15 -4.919 -1.043 12.254 1.00 0.00 H ATOM 244 HG3 LYS A 15 -5.772 -1.851 13.569 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.173 -3.706 13.461 1.00 0.00 H ATOM 246 HD3 LYS A 15 -3.321 -2.891 12.150 1.00 0.00 H ATOM 247 HE2 LYS A 15 -3.697 -1.762 14.920 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.246 -2.593 14.365 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -3.336 -0.016 13.379 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -2.100 -0.857 12.589 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -1.857 -0.283 14.160 1.00 0.00 H ATOM 252 N ASN A 16 -7.631 -5.142 10.234 1.00 0.00 N ATOM 253 CA ASN A 16 -8.815 -5.601 9.503 1.00 0.00 C ATOM 254 C ASN A 16 -9.393 -6.882 10.111 1.00 0.00 C ATOM 255 O ASN A 16 -10.587 -6.953 10.407 1.00 0.00 O ATOM 256 CB ASN A 16 -8.471 -5.835 8.030 1.00 0.00 C ATOM 257 CG ASN A 16 -9.650 -6.364 7.233 1.00 0.00 C ATOM 258 OD1 ASN A 16 -10.676 -5.694 7.100 1.00 0.00 O ATOM 259 ND2 ASN A 16 -9.513 -7.577 6.705 1.00 0.00 N ATOM 260 H ASN A 16 -6.749 -5.226 9.814 1.00 0.00 H ATOM 261 HA ASN A 16 -9.560 -4.825 9.566 1.00 0.00 H ATOM 262 HB2 ASN A 16 -8.153 -4.902 7.588 1.00 0.00 H ATOM 263 HB3 ASN A 16 -7.665 -6.551 7.965 1.00 0.00 H ATOM 264 HD21 ASN A 16 -8.671 -8.057 6.857 1.00 0.00 H ATOM 265 HD22 ASN A 16 -10.258 -7.943 6.186 1.00 0.00 H ATOM 266 N GLN A 17 -8.541 -7.896 10.282 1.00 0.00 N ATOM 267 CA GLN A 17 -8.964 -9.183 10.836 1.00 0.00 C ATOM 268 C GLN A 17 -9.267 -9.090 12.330 1.00 0.00 C ATOM 269 O GLN A 17 -10.390 -9.360 12.760 1.00 0.00 O ATOM 270 CB GLN A 17 -7.880 -10.242 10.603 1.00 0.00 C ATOM 271 CG GLN A 17 -8.211 -11.599 11.209 1.00 0.00 C ATOM 272 CD GLN A 17 -7.032 -12.554 11.180 1.00 0.00 C ATOM 273 OE1 GLN A 17 -6.500 -12.869 10.115 1.00 0.00 O ATOM 274 NE2 GLN A 17 -6.617 -13.021 12.355 1.00 0.00 N ATOM 275 H GLN A 17 -7.605 -7.776 10.016 1.00 0.00 H ATOM 276 HA GLN A 17 -9.859 -9.485 10.320 1.00 0.00 H ATOM 277 HB2 GLN A 17 -7.744 -10.372 9.539 1.00 0.00 H ATOM 278 HB3 GLN A 17 -6.953 -9.895 11.035 1.00 0.00 H ATOM 279 HG2 GLN A 17 -8.513 -11.456 12.235 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.026 -12.037 10.653 1.00 0.00 H ATOM 281 HE21 GLN A 17 -7.089 -12.729 13.164 1.00 0.00 H ATOM 282 HE22 GLN A 17 -5.857 -13.638 12.364 1.00 0.00 H ATOM 283 N ASP A 18 -8.255 -8.724 13.112 1.00 0.00 N ATOM 284 CA ASP A 18 -8.397 -8.611 14.563 1.00 0.00 C ATOM 285 C ASP A 18 -9.335 -7.465 14.943 1.00 0.00 C ATOM 286 O ASP A 18 -10.150 -7.596 15.858 1.00 0.00 O ATOM 287 CB ASP A 18 -7.030 -8.407 15.227 1.00 0.00 C ATOM 288 CG ASP A 18 -6.001 -9.435 14.781 1.00 0.00 C ATOM 289 OD1 ASP A 18 -6.227 -10.642 14.887 1.00 0.00 O ATOM 290 H ASP A 18 -7.384 -8.534 12.703 1.00 0.00 H ATOM 291 HA ASP A 18 -8.822 -9.537 14.922 1.00 0.00 H ATOM 292 HB2 ASP A 18 -6.660 -7.423 14.979 1.00 0.00 H ATOM 293 HB3 ASP A 18 -7.145 -8.481 16.299 1.00 0.00 H HETATM 294 N NH2 A 19 -9.222 -6.336 14.246 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.552 -6.296 13.529 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -9.812 -5.589 14.478 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 10 ATOM 1 N PHE A 1 8.924 -4.359 -9.037 1.00 0.00 N ATOM 2 CA PHE A 1 10.014 -4.717 -8.134 1.00 0.00 C ATOM 3 C PHE A 1 9.541 -5.773 -7.119 1.00 0.00 C ATOM 4 O PHE A 1 8.802 -6.690 -7.484 1.00 0.00 O ATOM 5 CB PHE A 1 10.548 -3.464 -7.419 1.00 0.00 C ATOM 6 CG PHE A 1 11.031 -2.374 -8.343 1.00 0.00 C ATOM 7 CD1 PHE A 1 10.177 -1.787 -9.267 1.00 0.00 C ATOM 8 CD2 PHE A 1 12.342 -1.926 -8.277 1.00 0.00 C ATOM 9 CE1 PHE A 1 10.621 -0.783 -10.107 1.00 0.00 C ATOM 10 CE2 PHE A 1 12.791 -0.920 -9.115 1.00 0.00 C ATOM 11 CZ PHE A 1 11.929 -0.350 -10.031 1.00 0.00 C ATOM 12 H1 PHE A 1 9.099 -4.301 -9.999 1.00 0.00 H ATOM 13 HA PHE A 1 10.806 -5.145 -8.730 1.00 0.00 H ATOM 14 HB2 PHE A 1 9.764 -3.051 -6.803 1.00 0.00 H ATOM 15 HB3 PHE A 1 11.377 -3.751 -6.786 1.00 0.00 H ATOM 16 HD1 PHE A 1 9.152 -2.121 -9.331 1.00 0.00 H ATOM 17 HD2 PHE A 1 13.019 -2.372 -7.563 1.00 0.00 H ATOM 18 HE1 PHE A 1 9.944 -0.337 -10.823 1.00 0.00 H ATOM 19 HE2 PHE A 1 13.815 -0.582 -9.053 1.00 0.00 H ATOM 20 HZ PHE A 1 12.277 0.437 -10.685 1.00 0.00 H ATOM 21 N GLY A 2 9.964 -5.648 -5.853 1.00 0.00 N ATOM 22 CA GLY A 2 9.565 -6.603 -4.828 1.00 0.00 C ATOM 23 C GLY A 2 8.071 -6.582 -4.548 1.00 0.00 C ATOM 24 O GLY A 2 7.406 -5.568 -4.771 1.00 0.00 O ATOM 25 H GLY A 2 10.553 -4.905 -5.611 1.00 0.00 H ATOM 26 HA2 GLY A 2 9.843 -7.595 -5.152 1.00 0.00 H ATOM 27 HA3 GLY A 2 10.093 -6.375 -3.915 1.00 0.00 H ATOM 28 N GLY A 3 7.542 -7.710 -4.062 1.00 0.00 N ATOM 29 CA GLY A 3 6.121 -7.808 -3.757 1.00 0.00 C ATOM 30 C GLY A 3 5.710 -6.988 -2.544 1.00 0.00 C ATOM 31 O GLY A 3 6.184 -5.867 -2.353 1.00 0.00 O ATOM 32 H GLY A 3 8.124 -8.485 -3.909 1.00 0.00 H ATOM 33 HA2 GLY A 3 5.558 -7.466 -4.613 1.00 0.00 H ATOM 34 HA3 GLY A 3 5.877 -8.845 -3.574 1.00 0.00 H ATOM 35 N PHE A 4 4.821 -7.550 -1.726 1.00 0.00 N ATOM 36 CA PHE A 4 4.336 -6.869 -0.527 1.00 0.00 C ATOM 37 C PHE A 4 5.170 -7.252 0.698 1.00 0.00 C ATOM 38 O PHE A 4 4.642 -7.742 1.699 1.00 0.00 O ATOM 39 CB PHE A 4 2.853 -7.187 -0.295 1.00 0.00 C ATOM 40 CG PHE A 4 1.968 -6.793 -1.449 1.00 0.00 C ATOM 41 CD1 PHE A 4 2.023 -7.483 -2.651 1.00 0.00 C ATOM 42 CD2 PHE A 4 1.090 -5.726 -1.335 1.00 0.00 C ATOM 43 CE1 PHE A 4 1.222 -7.120 -3.714 1.00 0.00 C ATOM 44 CE2 PHE A 4 0.282 -5.358 -2.397 1.00 0.00 C ATOM 45 CZ PHE A 4 0.350 -6.058 -3.589 1.00 0.00 C ATOM 46 H PHE A 4 4.480 -8.446 -1.936 1.00 0.00 H ATOM 47 HA PHE A 4 4.439 -5.806 -0.690 1.00 0.00 H ATOM 48 HB2 PHE A 4 2.741 -8.250 -0.139 1.00 0.00 H ATOM 49 HB3 PHE A 4 2.512 -6.663 0.586 1.00 0.00 H ATOM 50 HD1 PHE A 4 2.703 -8.317 -2.751 1.00 0.00 H ATOM 51 HD2 PHE A 4 1.038 -5.177 -0.405 1.00 0.00 H ATOM 52 HE1 PHE A 4 1.278 -7.667 -4.644 1.00 0.00 H ATOM 53 HE2 PHE A 4 -0.397 -4.525 -2.298 1.00 0.00 H ATOM 54 HZ PHE A 4 -0.278 -5.773 -4.419 1.00 0.00 H ATOM 55 N THR A 5 6.482 -7.024 0.602 1.00 0.00 N ATOM 56 CA THR A 5 7.412 -7.338 1.688 1.00 0.00 C ATOM 57 C THR A 5 7.034 -6.626 2.988 1.00 0.00 C ATOM 58 O THR A 5 7.143 -7.204 4.070 1.00 0.00 O ATOM 59 CB THR A 5 8.864 -6.969 1.314 1.00 0.00 C ATOM 60 OG1 THR A 5 8.959 -5.569 1.004 1.00 0.00 O ATOM 61 CG2 THR A 5 9.340 -7.792 0.125 1.00 0.00 C ATOM 62 H THR A 5 6.836 -6.633 -0.225 1.00 0.00 H ATOM 63 HA THR A 5 7.369 -8.404 1.854 1.00 0.00 H ATOM 64 HB THR A 5 9.502 -7.184 2.159 1.00 0.00 H ATOM 65 HG1 THR A 5 8.553 -5.399 0.149 1.00 0.00 H ATOM 66 HG21 THR A 5 9.060 -8.824 0.268 1.00 0.00 H ATOM 67 HG22 THR A 5 10.414 -7.719 0.045 1.00 0.00 H ATOM 68 HG23 THR A 5 8.884 -7.417 -0.779 1.00 0.00 H ATOM 69 N GLY A 6 6.595 -5.370 2.870 1.00 0.00 N ATOM 70 CA GLY A 6 6.208 -4.592 4.038 1.00 0.00 C ATOM 71 C GLY A 6 4.862 -5.005 4.608 1.00 0.00 C ATOM 72 O GLY A 6 3.927 -4.202 4.641 1.00 0.00 O ATOM 73 H GLY A 6 6.533 -4.968 1.980 1.00 0.00 H ATOM 74 HA2 GLY A 6 6.960 -4.716 4.803 1.00 0.00 H ATOM 75 HA3 GLY A 6 6.163 -3.548 3.760 1.00 0.00 H ATOM 76 N LYS A 7 4.762 -6.257 5.055 1.00 0.00 N ATOM 77 CA LYS A 7 3.518 -6.773 5.625 1.00 0.00 C ATOM 78 C LYS A 7 3.241 -6.188 7.015 1.00 0.00 C ATOM 79 O LYS A 7 2.145 -6.356 7.545 1.00 0.00 O ATOM 80 CB LYS A 7 3.555 -8.301 5.723 1.00 0.00 C ATOM 81 CG LYS A 7 4.424 -8.820 6.862 1.00 0.00 C ATOM 82 CD LYS A 7 4.075 -10.256 7.231 1.00 0.00 C ATOM 83 CE LYS A 7 2.585 -10.426 7.504 1.00 0.00 C ATOM 84 NZ LYS A 7 2.067 -9.440 8.459 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.541 -6.848 5.002 1.00 0.00 H ATOM 86 HA LYS A 7 2.713 -6.488 4.966 1.00 0.00 H ATOM 87 HB2 LYS A 7 2.549 -8.662 5.868 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.941 -8.699 4.796 1.00 0.00 H ATOM 89 HG2 LYS A 7 5.458 -8.784 6.558 1.00 0.00 H ATOM 90 HG3 LYS A 7 4.281 -8.192 7.729 1.00 0.00 H ATOM 91 HD2 LYS A 7 4.356 -10.904 6.415 1.00 0.00 H ATOM 92 HD3 LYS A 7 4.628 -10.532 8.118 1.00 0.00 H ATOM 93 HE2 LYS A 7 2.051 -10.319 6.572 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.419 -11.417 7.898 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.663 -8.712 8.732 1.00 0.00 H ATOM 96 N ARG A 8 4.237 -5.521 7.610 1.00 0.00 N ATOM 97 CA ARG A 8 4.083 -4.939 8.943 1.00 0.00 C ATOM 98 C ARG A 8 2.790 -4.134 9.047 1.00 0.00 C ATOM 99 O ARG A 8 2.079 -4.211 10.049 1.00 0.00 O ATOM 100 CB ARG A 8 5.294 -4.062 9.296 1.00 0.00 C ATOM 101 CG ARG A 8 5.526 -2.904 8.333 1.00 0.00 C ATOM 102 CD ARG A 8 6.784 -2.120 8.687 1.00 0.00 C ATOM 103 NE ARG A 8 6.712 -1.526 10.023 1.00 0.00 N ATOM 104 CZ ARG A 8 7.699 -0.821 10.583 1.00 0.00 C ATOM 105 NH1 ARG A 8 8.838 -0.611 9.925 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 7.545 -0.322 11.805 1.00 0.00 N ATOM 107 H ARG A 8 5.093 -5.426 7.149 1.00 0.00 H ATOM 108 HA ARG A 8 4.033 -5.757 9.647 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.150 -3.656 10.285 1.00 0.00 H ATOM 110 HB3 ARG A 8 6.180 -4.681 9.298 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.629 -3.294 7.332 1.00 0.00 H ATOM 112 HG3 ARG A 8 4.675 -2.238 8.375 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.631 -2.788 8.646 1.00 0.00 H ATOM 114 HD3 ARG A 8 6.914 -1.331 7.960 1.00 0.00 H ATOM 115 HE ARG A 8 5.884 -1.659 10.532 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.961 -0.982 9.005 1.00 0.00 H ATOM 117 HH12 ARG A 8 9.571 -0.081 10.351 1.00 0.00 H ATOM 118 HH21 ARG A 8 6.692 -0.475 12.303 1.00 0.00 H ATOM 119 HH22 ARG A 8 8.281 0.207 12.226 1.00 0.00 H ATOM 120 N LYS A 9 2.484 -3.376 7.994 1.00 0.00 N ATOM 121 CA LYS A 9 1.267 -2.565 7.957 1.00 0.00 C ATOM 122 C LYS A 9 0.032 -3.428 7.678 1.00 0.00 C ATOM 123 O LYS A 9 -1.027 -3.211 8.269 1.00 0.00 O ATOM 124 CB LYS A 9 1.390 -1.462 6.902 1.00 0.00 C ATOM 125 CG LYS A 9 0.203 -0.509 6.877 1.00 0.00 C ATOM 126 CD LYS A 9 0.393 0.595 5.848 1.00 0.00 C ATOM 127 CE LYS A 9 0.491 0.038 4.437 1.00 0.00 C ATOM 128 NZ LYS A 9 0.693 1.112 3.424 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.089 -3.373 7.220 1.00 0.00 H ATOM 130 HA LYS A 9 1.152 -2.107 8.927 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.282 -0.888 7.100 1.00 0.00 H ATOM 132 HB3 LYS A 9 1.476 -1.921 5.929 1.00 0.00 H ATOM 133 HG2 LYS A 9 -0.689 -1.065 6.631 1.00 0.00 H ATOM 134 HG3 LYS A 9 0.093 -0.064 7.855 1.00 0.00 H ATOM 135 HD2 LYS A 9 -0.450 1.269 5.900 1.00 0.00 H ATOM 136 HD3 LYS A 9 1.300 1.134 6.078 1.00 0.00 H ATOM 137 HE2 LYS A 9 1.325 -0.647 4.390 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.422 -0.492 4.209 1.00 0.00 H ATOM 139 HZ1 LYS A 9 -0.103 1.781 3.448 1.00 0.00 H ATOM 140 HZ2 LYS A 9 0.757 0.699 2.472 1.00 0.00 H ATOM 141 HZ3 LYS A 9 1.574 1.630 3.624 1.00 0.00 H ATOM 142 N SER A 10 0.174 -4.403 6.772 1.00 0.00 N ATOM 143 CA SER A 10 -0.930 -5.297 6.414 1.00 0.00 C ATOM 144 C SER A 10 -1.394 -6.122 7.614 1.00 0.00 C ATOM 145 O SER A 10 -2.586 -6.169 7.911 1.00 0.00 O ATOM 146 CB SER A 10 -0.522 -6.230 5.273 1.00 0.00 C ATOM 147 OG SER A 10 -0.244 -5.501 4.092 1.00 0.00 O ATOM 148 H SER A 10 1.044 -4.523 6.335 1.00 0.00 H ATOM 149 HA SER A 10 -1.752 -4.684 6.084 1.00 0.00 H ATOM 150 HB2 SER A 10 0.363 -6.779 5.559 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.327 -6.923 5.073 1.00 0.00 H ATOM 152 HG SER A 10 0.705 -5.383 4.003 1.00 0.00 H ATOM 153 N ASP A 11 -0.448 -6.767 8.297 1.00 0.00 N ATOM 154 CA ASP A 11 -0.765 -7.586 9.468 1.00 0.00 C ATOM 155 C ASP A 11 -1.329 -6.737 10.606 1.00 0.00 C ATOM 156 O ASP A 11 -2.253 -7.162 11.298 1.00 0.00 O ATOM 157 CB ASP A 11 0.465 -8.370 9.935 1.00 0.00 C ATOM 158 CG ASP A 11 0.835 -9.481 8.964 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.020 -10.357 8.673 1.00 0.00 O ATOM 160 H ASP A 11 0.485 -6.687 8.009 1.00 0.00 H ATOM 161 HA ASP A 11 -1.527 -8.290 9.168 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.305 -7.696 10.021 1.00 0.00 H ATOM 163 HB3 ASP A 11 0.261 -8.811 10.900 1.00 0.00 H ATOM 164 N ARG A 12 -0.783 -5.528 10.786 1.00 0.00 N ATOM 165 CA ARG A 12 -1.262 -4.623 11.833 1.00 0.00 C ATOM 166 C ARG A 12 -2.753 -4.338 11.660 1.00 0.00 C ATOM 167 O ARG A 12 -3.525 -4.389 12.618 1.00 0.00 O ATOM 168 CB ARG A 12 -0.483 -3.305 11.813 1.00 0.00 C ATOM 169 CG ARG A 12 0.836 -3.350 12.569 1.00 0.00 C ATOM 170 CD ARG A 12 1.597 -2.041 12.427 1.00 0.00 C ATOM 171 NE ARG A 12 2.621 -1.881 13.461 1.00 0.00 N ATOM 172 CZ ARG A 12 2.353 -1.641 14.748 1.00 0.00 C ATOM 173 NH1 ARG A 12 1.095 -1.505 15.167 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.348 -1.529 15.622 1.00 0.00 N ATOM 175 H ARG A 12 -0.055 -5.237 10.195 1.00 0.00 H ATOM 176 HA ARG A 12 -1.109 -5.109 12.785 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.274 -3.042 10.786 1.00 0.00 H ATOM 178 HB3 ARG A 12 -1.097 -2.533 12.252 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.635 -3.529 13.615 1.00 0.00 H ATOM 180 HG3 ARG A 12 1.440 -4.152 12.172 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.075 -2.023 11.459 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.897 -1.221 12.498 1.00 0.00 H ATOM 183 HE ARG A 12 3.558 -1.964 13.183 1.00 0.00 H ATOM 184 HH11 ARG A 12 0.338 -1.583 14.519 1.00 0.00 H ATOM 185 HH12 ARG A 12 0.906 -1.321 16.133 1.00 0.00 H ATOM 186 HH21 ARG A 12 4.296 -1.625 15.315 1.00 0.00 H ATOM 187 HH22 ARG A 12 3.150 -1.344 16.585 1.00 0.00 H ATOM 188 N LYS A 13 -3.143 -4.035 10.428 1.00 0.00 N ATOM 189 CA LYS A 13 -4.538 -3.735 10.112 1.00 0.00 C ATOM 190 C LYS A 13 -5.394 -5.003 10.033 1.00 0.00 C ATOM 191 O LYS A 13 -6.485 -5.057 10.596 1.00 0.00 O ATOM 192 CB LYS A 13 -4.627 -2.962 8.792 1.00 0.00 C ATOM 193 CG LYS A 13 -5.049 -1.513 8.966 1.00 0.00 C ATOM 194 CD LYS A 13 -5.079 -0.776 7.636 1.00 0.00 C ATOM 195 CE LYS A 13 -5.655 0.623 7.789 1.00 0.00 C ATOM 196 NZ LYS A 13 -7.049 0.595 8.320 1.00 0.00 N1+ ATOM 197 H LYS A 13 -2.474 -4.011 9.711 1.00 0.00 H ATOM 198 HA LYS A 13 -4.924 -3.112 10.901 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.660 -2.978 8.310 1.00 0.00 H ATOM 200 HB3 LYS A 13 -5.348 -3.449 8.149 1.00 0.00 H ATOM 201 HG2 LYS A 13 -6.037 -1.486 9.405 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.348 -1.021 9.624 1.00 0.00 H ATOM 203 HD2 LYS A 13 -4.071 -0.698 7.257 1.00 0.00 H ATOM 204 HD3 LYS A 13 -5.687 -1.333 6.940 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.031 1.183 8.468 1.00 0.00 H ATOM 206 HE3 LYS A 13 -5.658 1.104 6.822 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -7.035 0.531 9.359 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -7.560 -0.226 7.941 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -7.554 1.461 8.044 1.00 0.00 H ATOM 210 N LYS A 14 -4.895 -6.008 9.317 1.00 0.00 N ATOM 211 CA LYS A 14 -5.606 -7.279 9.132 1.00 0.00 C ATOM 212 C LYS A 14 -5.951 -7.965 10.463 1.00 0.00 C ATOM 213 O LYS A 14 -7.028 -8.542 10.602 1.00 0.00 O ATOM 214 CB LYS A 14 -4.760 -8.218 8.256 1.00 0.00 C ATOM 215 CG LYS A 14 -5.375 -9.590 7.987 1.00 0.00 C ATOM 216 CD LYS A 14 -6.427 -9.562 6.876 1.00 0.00 C ATOM 217 CE LYS A 14 -7.715 -8.875 7.304 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.275 -9.465 8.518 1.00 0.00 N1+ ATOM 219 H LYS A 14 -4.022 -5.891 8.884 1.00 0.00 H ATOM 220 HA LYS A 14 -6.525 -7.060 8.614 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.592 -7.738 7.302 1.00 0.00 H ATOM 222 HB3 LYS A 14 -3.806 -8.366 8.739 1.00 0.00 H ATOM 223 HG2 LYS A 14 -4.587 -10.269 7.696 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.836 -9.947 8.896 1.00 0.00 H ATOM 225 HD2 LYS A 14 -6.020 -9.033 6.028 1.00 0.00 H ATOM 226 HD3 LYS A 14 -6.652 -10.580 6.588 1.00 0.00 H ATOM 227 HE2 LYS A 14 -7.513 -7.831 7.481 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.437 -8.969 6.505 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -7.653 -9.667 9.247 1.00 0.00 H ATOM 230 N LYS A 15 -5.036 -7.923 11.432 1.00 0.00 N ATOM 231 CA LYS A 15 -5.270 -8.573 12.725 1.00 0.00 C ATOM 232 C LYS A 15 -6.470 -7.976 13.463 1.00 0.00 C ATOM 233 O LYS A 15 -7.320 -8.711 13.968 1.00 0.00 O ATOM 234 CB LYS A 15 -4.028 -8.487 13.618 1.00 0.00 C ATOM 235 CG LYS A 15 -4.128 -9.344 14.873 1.00 0.00 C ATOM 236 CD LYS A 15 -2.955 -9.112 15.816 1.00 0.00 C ATOM 237 CE LYS A 15 -2.956 -7.697 16.382 1.00 0.00 C ATOM 238 NZ LYS A 15 -4.168 -7.419 17.208 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.188 -7.460 11.273 1.00 0.00 H ATOM 240 HA LYS A 15 -5.480 -9.612 12.528 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.166 -8.812 13.052 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.884 -7.461 13.919 1.00 0.00 H ATOM 243 HG2 LYS A 15 -5.044 -9.103 15.390 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.142 -10.386 14.583 1.00 0.00 H ATOM 245 HD2 LYS A 15 -3.021 -9.814 16.633 1.00 0.00 H ATOM 246 HD3 LYS A 15 -2.035 -9.273 15.274 1.00 0.00 H ATOM 247 HE2 LYS A 15 -2.078 -7.571 16.998 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.921 -6.995 15.562 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -4.840 -6.833 16.671 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.900 -6.911 18.075 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -4.636 -8.310 17.474 1.00 0.00 H ATOM 252 N ASN A 16 -6.523 -6.648 13.540 1.00 0.00 N ATOM 253 CA ASN A 16 -7.616 -5.966 14.243 1.00 0.00 C ATOM 254 C ASN A 16 -8.911 -5.923 13.425 1.00 0.00 C ATOM 255 O ASN A 16 -10.002 -6.060 13.983 1.00 0.00 O ATOM 256 CB ASN A 16 -7.197 -4.548 14.655 1.00 0.00 C ATOM 257 CG ASN A 16 -6.761 -3.682 13.484 1.00 0.00 C ATOM 258 OD1 ASN A 16 -7.558 -3.357 12.603 1.00 0.00 O ATOM 259 ND2 ASN A 16 -5.488 -3.304 13.469 1.00 0.00 N ATOM 260 H ASN A 16 -5.807 -6.117 13.130 1.00 0.00 H ATOM 261 HA ASN A 16 -7.812 -6.532 15.140 1.00 0.00 H ATOM 262 HB2 ASN A 16 -8.029 -4.063 15.141 1.00 0.00 H ATOM 263 HB3 ASN A 16 -6.373 -4.616 15.352 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.906 -3.602 14.200 1.00 0.00 H ATOM 265 HD22 ASN A 16 -5.182 -2.741 12.729 1.00 0.00 H ATOM 266 N GLN A 17 -8.793 -5.716 12.114 1.00 0.00 N ATOM 267 CA GLN A 17 -9.964 -5.635 11.236 1.00 0.00 C ATOM 268 C GLN A 17 -10.769 -6.934 11.229 1.00 0.00 C ATOM 269 O GLN A 17 -11.977 -6.924 11.468 1.00 0.00 O ATOM 270 CB GLN A 17 -9.537 -5.280 9.809 1.00 0.00 C ATOM 271 CG GLN A 17 -10.084 -3.947 9.324 1.00 0.00 C ATOM 272 CD GLN A 17 -11.602 -3.928 9.252 1.00 0.00 C ATOM 273 OE1 GLN A 17 -12.209 -4.733 8.547 1.00 0.00 O ATOM 274 NE2 GLN A 17 -12.223 -3.003 9.976 1.00 0.00 N ATOM 275 H GLN A 17 -7.900 -5.601 11.728 1.00 0.00 H ATOM 276 HA GLN A 17 -10.598 -4.848 11.614 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.460 -5.236 9.770 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.880 -6.052 9.138 1.00 0.00 H ATOM 279 HG2 GLN A 17 -9.764 -3.172 10.006 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.686 -3.745 8.341 1.00 0.00 H ATOM 281 HE21 GLN A 17 -11.678 -2.389 10.514 1.00 0.00 H ATOM 282 HE22 GLN A 17 -13.202 -2.971 9.944 1.00 0.00 H ATOM 283 N ASP A 18 -10.096 -8.046 10.947 1.00 0.00 N ATOM 284 CA ASP A 18 -10.752 -9.354 10.899 1.00 0.00 C ATOM 285 C ASP A 18 -10.941 -9.929 12.302 1.00 0.00 C ATOM 286 O ASP A 18 -12.039 -10.349 12.667 1.00 0.00 O ATOM 287 CB ASP A 18 -9.937 -10.324 10.042 1.00 0.00 C ATOM 288 CG ASP A 18 -9.567 -9.727 8.697 1.00 0.00 C ATOM 289 OD1 ASP A 18 -10.429 -9.488 7.849 1.00 0.00 O ATOM 290 H ASP A 18 -9.135 -7.987 10.760 1.00 0.00 H ATOM 291 HA ASP A 18 -11.723 -9.219 10.447 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.029 -10.585 10.565 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.519 -11.218 9.870 1.00 0.00 H HETATM 294 N NH2 A 19 -9.867 -9.956 13.088 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.022 -9.606 12.734 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -9.965 -10.328 13.990 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 11 ATOM 1 N PHE A 1 13.640 -8.359 -0.669 1.00 0.00 N ATOM 2 CA PHE A 1 13.285 -7.685 -1.915 1.00 0.00 C ATOM 3 C PHE A 1 12.453 -6.423 -1.634 1.00 0.00 C ATOM 4 O PHE A 1 12.500 -5.881 -0.526 1.00 0.00 O ATOM 5 CB PHE A 1 12.523 -8.653 -2.836 1.00 0.00 C ATOM 6 CG PHE A 1 13.367 -9.760 -3.419 1.00 0.00 C ATOM 7 CD1 PHE A 1 14.224 -10.512 -2.625 1.00 0.00 C ATOM 8 CD2 PHE A 1 13.295 -10.050 -4.775 1.00 0.00 C ATOM 9 CE1 PHE A 1 14.989 -11.527 -3.173 1.00 0.00 C ATOM 10 CE2 PHE A 1 14.057 -11.062 -5.325 1.00 0.00 C ATOM 11 CZ PHE A 1 14.904 -11.803 -4.524 1.00 0.00 C ATOM 12 H1 PHE A 1 12.970 -8.438 0.041 1.00 0.00 H ATOM 13 HA PHE A 1 14.203 -7.390 -2.401 1.00 0.00 H ATOM 14 HB2 PHE A 1 11.721 -9.111 -2.278 1.00 0.00 H ATOM 15 HB3 PHE A 1 12.102 -8.096 -3.660 1.00 0.00 H ATOM 16 HD1 PHE A 1 14.292 -10.301 -1.570 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.634 -9.474 -5.404 1.00 0.00 H ATOM 18 HE1 PHE A 1 15.651 -12.104 -2.546 1.00 0.00 H ATOM 19 HE2 PHE A 1 13.990 -11.277 -6.382 1.00 0.00 H ATOM 20 HZ PHE A 1 15.500 -12.594 -4.953 1.00 0.00 H ATOM 21 N GLY A 2 11.700 -5.952 -2.638 1.00 0.00 N ATOM 22 CA GLY A 2 10.886 -4.759 -2.476 1.00 0.00 C ATOM 23 C GLY A 2 9.843 -4.884 -1.378 1.00 0.00 C ATOM 24 O GLY A 2 9.098 -5.865 -1.323 1.00 0.00 O ATOM 25 H GLY A 2 11.707 -6.413 -3.499 1.00 0.00 H ATOM 26 HA2 GLY A 2 11.534 -3.927 -2.241 1.00 0.00 H ATOM 27 HA3 GLY A 2 10.383 -4.553 -3.410 1.00 0.00 H ATOM 28 N GLY A 3 9.795 -3.873 -0.508 1.00 0.00 N ATOM 29 CA GLY A 3 8.842 -3.856 0.591 1.00 0.00 C ATOM 30 C GLY A 3 7.400 -3.702 0.127 1.00 0.00 C ATOM 31 O GLY A 3 6.477 -4.125 0.826 1.00 0.00 O ATOM 32 H GLY A 3 10.415 -3.121 -0.617 1.00 0.00 H ATOM 33 HA2 GLY A 3 8.935 -4.778 1.145 1.00 0.00 H ATOM 34 HA3 GLY A 3 9.084 -3.032 1.244 1.00 0.00 H ATOM 35 N PHE A 4 7.211 -3.079 -1.045 1.00 0.00 N ATOM 36 CA PHE A 4 5.875 -2.845 -1.608 1.00 0.00 C ATOM 37 C PHE A 4 4.987 -4.093 -1.543 1.00 0.00 C ATOM 38 O PHE A 4 5.469 -5.222 -1.659 1.00 0.00 O ATOM 39 CB PHE A 4 5.972 -2.376 -3.067 1.00 0.00 C ATOM 40 CG PHE A 4 6.732 -1.091 -3.257 1.00 0.00 C ATOM 41 CD1 PHE A 4 6.299 0.081 -2.660 1.00 0.00 C ATOM 42 CD2 PHE A 4 7.878 -1.058 -4.038 1.00 0.00 C ATOM 43 CE1 PHE A 4 6.993 1.262 -2.835 1.00 0.00 C ATOM 44 CE2 PHE A 4 8.576 0.121 -4.217 1.00 0.00 C ATOM 45 CZ PHE A 4 8.133 1.283 -3.615 1.00 0.00 C ATOM 46 H PHE A 4 7.993 -2.758 -1.540 1.00 0.00 H ATOM 47 HA PHE A 4 5.412 -2.064 -1.025 1.00 0.00 H ATOM 48 HB2 PHE A 4 6.466 -3.139 -3.648 1.00 0.00 H ATOM 49 HB3 PHE A 4 4.974 -2.231 -3.454 1.00 0.00 H ATOM 50 HD1 PHE A 4 5.408 0.066 -2.048 1.00 0.00 H ATOM 51 HD2 PHE A 4 8.224 -1.965 -4.509 1.00 0.00 H ATOM 52 HE1 PHE A 4 6.644 2.170 -2.363 1.00 0.00 H ATOM 53 HE2 PHE A 4 9.465 0.135 -4.828 1.00 0.00 H ATOM 54 HZ PHE A 4 8.676 2.206 -3.755 1.00 0.00 H ATOM 55 N THR A 5 3.683 -3.858 -1.362 1.00 0.00 N ATOM 56 CA THR A 5 2.671 -4.921 -1.285 1.00 0.00 C ATOM 57 C THR A 5 2.999 -5.972 -0.215 1.00 0.00 C ATOM 58 O THR A 5 2.932 -7.176 -0.477 1.00 0.00 O ATOM 59 CB THR A 5 2.450 -5.621 -2.651 1.00 0.00 C ATOM 60 OG1 THR A 5 3.599 -6.402 -3.019 1.00 0.00 O ATOM 61 CG2 THR A 5 2.155 -4.604 -3.744 1.00 0.00 C ATOM 62 H THR A 5 3.382 -2.929 -1.286 1.00 0.00 H ATOM 63 HA THR A 5 1.739 -4.449 -1.007 1.00 0.00 H ATOM 64 HB THR A 5 1.597 -6.279 -2.561 1.00 0.00 H ATOM 65 HG1 THR A 5 4.288 -5.827 -3.355 1.00 0.00 H ATOM 66 HG21 THR A 5 3.020 -3.973 -3.895 1.00 0.00 H ATOM 67 HG22 THR A 5 1.312 -3.994 -3.450 1.00 0.00 H ATOM 68 HG23 THR A 5 1.923 -5.120 -4.663 1.00 0.00 H ATOM 69 N GLY A 6 3.333 -5.519 0.994 1.00 0.00 N ATOM 70 CA GLY A 6 3.636 -6.449 2.074 1.00 0.00 C ATOM 71 C GLY A 6 2.379 -7.113 2.620 1.00 0.00 C ATOM 72 O GLY A 6 1.494 -6.432 3.140 1.00 0.00 O ATOM 73 H GLY A 6 3.359 -4.551 1.160 1.00 0.00 H ATOM 74 HA2 GLY A 6 4.307 -7.210 1.703 1.00 0.00 H ATOM 75 HA3 GLY A 6 4.124 -5.911 2.873 1.00 0.00 H ATOM 76 N LYS A 7 2.293 -8.441 2.490 1.00 0.00 N ATOM 77 CA LYS A 7 1.124 -9.188 2.967 1.00 0.00 C ATOM 78 C LYS A 7 1.087 -9.297 4.490 1.00 0.00 C ATOM 79 O LYS A 7 0.083 -8.960 5.117 1.00 0.00 O ATOM 80 CB LYS A 7 1.087 -10.596 2.353 1.00 0.00 C ATOM 81 CG LYS A 7 0.032 -11.499 2.982 1.00 0.00 C ATOM 82 CD LYS A 7 -1.368 -10.927 2.814 1.00 0.00 C ATOM 83 CE LYS A 7 -2.310 -11.436 3.896 1.00 0.00 C ATOM 84 NZ LYS A 7 -1.956 -10.924 5.222 1.00 0.00 N1+ ATOM 85 H LYS A 7 3.028 -8.929 2.060 1.00 0.00 H ATOM 86 HA LYS A 7 0.246 -8.653 2.646 1.00 0.00 H ATOM 87 HB2 LYS A 7 0.880 -10.513 1.297 1.00 0.00 H ATOM 88 HB3 LYS A 7 2.053 -11.061 2.488 1.00 0.00 H ATOM 89 HG2 LYS A 7 0.071 -12.468 2.506 1.00 0.00 H ATOM 90 HG3 LYS A 7 0.244 -11.606 4.036 1.00 0.00 H ATOM 91 HD2 LYS A 7 -1.317 -9.851 2.873 1.00 0.00 H ATOM 92 HD3 LYS A 7 -1.752 -11.219 1.848 1.00 0.00 H ATOM 93 HE2 LYS A 7 -3.315 -11.122 3.656 1.00 0.00 H ATOM 94 HE3 LYS A 7 -2.266 -12.515 3.913 1.00 0.00 H ATOM 95 HZ1 LYS A 7 -1.020 -11.005 5.506 1.00 0.00 H ATOM 96 N ARG A 8 2.178 -9.788 5.076 1.00 0.00 N ATOM 97 CA ARG A 8 2.260 -9.962 6.529 1.00 0.00 C ATOM 98 C ARG A 8 2.023 -8.638 7.251 1.00 0.00 C ATOM 99 O ARG A 8 1.358 -8.598 8.286 1.00 0.00 O ATOM 100 CB ARG A 8 3.620 -10.541 6.933 1.00 0.00 C ATOM 101 CG ARG A 8 4.064 -11.722 6.082 1.00 0.00 C ATOM 102 CD ARG A 8 5.250 -12.446 6.701 1.00 0.00 C ATOM 103 NE ARG A 8 4.846 -13.305 7.814 1.00 0.00 N ATOM 104 CZ ARG A 8 4.052 -14.373 7.685 1.00 0.00 C ATOM 105 NH1 ARG A 8 3.615 -14.752 6.484 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 3.706 -15.076 8.758 1.00 0.00 N ATOM 107 H ARG A 8 2.940 -10.049 4.518 1.00 0.00 H ATOM 108 HA ARG A 8 1.485 -10.656 6.819 1.00 0.00 H ATOM 109 HB2 ARG A 8 4.367 -9.765 6.849 1.00 0.00 H ATOM 110 HB3 ARG A 8 3.565 -10.866 7.961 1.00 0.00 H ATOM 111 HG2 ARG A 8 3.240 -12.414 5.988 1.00 0.00 H ATOM 112 HG3 ARG A 8 4.344 -11.362 5.103 1.00 0.00 H ATOM 113 HD2 ARG A 8 5.721 -13.053 5.942 1.00 0.00 H ATOM 114 HD3 ARG A 8 5.953 -11.711 7.062 1.00 0.00 H ATOM 115 HE ARG A 8 5.174 -13.068 8.708 1.00 0.00 H ATOM 116 HH11 ARG A 8 3.880 -14.240 5.669 1.00 0.00 H ATOM 117 HH12 ARG A 8 3.018 -15.549 6.398 1.00 0.00 H ATOM 118 HH21 ARG A 8 4.040 -14.808 9.662 1.00 0.00 H ATOM 119 HH22 ARG A 8 3.110 -15.874 8.662 1.00 0.00 H ATOM 120 N LYS A 9 2.571 -7.562 6.690 1.00 0.00 N ATOM 121 CA LYS A 9 2.425 -6.226 7.263 1.00 0.00 C ATOM 122 C LYS A 9 0.964 -5.770 7.246 1.00 0.00 C ATOM 123 O LYS A 9 0.411 -5.374 8.279 1.00 0.00 O ATOM 124 CB LYS A 9 3.284 -5.230 6.477 1.00 0.00 C ATOM 125 CG LYS A 9 4.778 -5.506 6.554 1.00 0.00 C ATOM 126 CD LYS A 9 5.514 -4.943 5.346 1.00 0.00 C ATOM 127 CE LYS A 9 5.305 -3.443 5.196 1.00 0.00 C ATOM 128 NZ LYS A 9 6.037 -2.893 4.018 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.085 -7.670 5.862 1.00 0.00 H ATOM 130 HA LYS A 9 2.771 -6.261 8.283 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.989 -5.261 5.438 1.00 0.00 H ATOM 132 HB3 LYS A 9 3.104 -4.237 6.862 1.00 0.00 H ATOM 133 HG2 LYS A 9 5.173 -5.048 7.449 1.00 0.00 H ATOM 134 HG3 LYS A 9 4.935 -6.574 6.595 1.00 0.00 H ATOM 135 HD2 LYS A 9 6.570 -5.138 5.458 1.00 0.00 H ATOM 136 HD3 LYS A 9 5.149 -5.438 4.457 1.00 0.00 H ATOM 137 HE2 LYS A 9 4.249 -3.249 5.072 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.658 -2.950 6.090 1.00 0.00 H ATOM 139 HZ1 LYS A 9 6.310 -1.905 4.198 1.00 0.00 H ATOM 140 HZ2 LYS A 9 5.430 -2.924 3.174 1.00 0.00 H ATOM 141 HZ3 LYS A 9 6.895 -3.454 3.835 1.00 0.00 H ATOM 142 N SER A 10 0.344 -5.829 6.065 1.00 0.00 N ATOM 143 CA SER A 10 -1.050 -5.417 5.902 1.00 0.00 C ATOM 144 C SER A 10 -1.980 -6.223 6.806 1.00 0.00 C ATOM 145 O SER A 10 -2.848 -5.658 7.467 1.00 0.00 O ATOM 146 CB SER A 10 -1.490 -5.556 4.441 1.00 0.00 C ATOM 147 OG SER A 10 -0.690 -4.756 3.586 1.00 0.00 O ATOM 148 H SER A 10 0.840 -6.154 5.284 1.00 0.00 H ATOM 149 HA SER A 10 -1.116 -4.380 6.188 1.00 0.00 H ATOM 150 HB2 SER A 10 -1.397 -6.588 4.135 1.00 0.00 H ATOM 151 HB3 SER A 10 -2.519 -5.243 4.346 1.00 0.00 H ATOM 152 HG SER A 10 -0.885 -3.829 3.734 1.00 0.00 H ATOM 153 N ASP A 11 -1.791 -7.543 6.835 1.00 0.00 N ATOM 154 CA ASP A 11 -2.618 -8.418 7.665 1.00 0.00 C ATOM 155 C ASP A 11 -2.464 -8.093 9.152 1.00 0.00 C ATOM 156 O ASP A 11 -3.443 -8.115 9.897 1.00 0.00 O ATOM 157 CB ASP A 11 -2.290 -9.891 7.394 1.00 0.00 C ATOM 158 CG ASP A 11 -2.831 -10.363 6.055 1.00 0.00 C ATOM 159 OD1 ASP A 11 -4.026 -10.229 5.779 1.00 0.00 O ATOM 160 H ASP A 11 -1.080 -7.935 6.288 1.00 0.00 H ATOM 161 HA ASP A 11 -3.646 -8.240 7.387 1.00 0.00 H ATOM 162 HB2 ASP A 11 -1.218 -10.021 7.395 1.00 0.00 H ATOM 163 HB3 ASP A 11 -2.723 -10.501 8.174 1.00 0.00 H ATOM 164 N ARG A 12 -1.237 -7.780 9.580 1.00 0.00 N ATOM 165 CA ARG A 12 -0.980 -7.442 10.984 1.00 0.00 C ATOM 166 C ARG A 12 -1.867 -6.290 11.452 1.00 0.00 C ATOM 167 O ARG A 12 -2.477 -6.364 12.519 1.00 0.00 O ATOM 168 CB ARG A 12 0.494 -7.067 11.200 1.00 0.00 C ATOM 169 CG ARG A 12 1.438 -8.257 11.305 1.00 0.00 C ATOM 170 CD ARG A 12 1.195 -9.071 12.571 1.00 0.00 C ATOM 171 NE ARG A 12 -0.047 -9.848 12.508 1.00 0.00 N ATOM 172 CZ ARG A 12 -0.251 -10.866 11.668 1.00 0.00 C ATOM 173 NH1 ARG A 12 0.713 -11.273 10.845 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -1.424 -11.490 11.662 1.00 0.00 N ATOM 175 H ARG A 12 -0.496 -7.772 8.941 1.00 0.00 H ATOM 176 HA ARG A 12 -1.209 -8.310 11.574 1.00 0.00 H ATOM 177 HB2 ARG A 12 0.820 -6.456 10.370 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.577 -6.491 12.108 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.289 -8.896 10.448 1.00 0.00 H ATOM 180 HG3 ARG A 12 2.455 -7.894 11.311 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.022 -9.749 12.712 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.139 -8.395 13.411 1.00 0.00 H ATOM 183 HE ARG A 12 -0.771 -9.588 13.116 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.602 -10.818 10.849 1.00 0.00 H ATOM 185 HH12 ARG A 12 0.548 -12.037 10.221 1.00 0.00 H ATOM 186 HH21 ARG A 12 -2.149 -11.196 12.284 1.00 0.00 H ATOM 187 HH22 ARG A 12 -1.582 -12.253 11.035 1.00 0.00 H ATOM 188 N LYS A 13 -1.927 -5.225 10.654 1.00 0.00 N ATOM 189 CA LYS A 13 -2.737 -4.054 11.000 1.00 0.00 C ATOM 190 C LYS A 13 -4.218 -4.244 10.639 1.00 0.00 C ATOM 191 O LYS A 13 -5.099 -3.885 11.421 1.00 0.00 O ATOM 192 CB LYS A 13 -2.191 -2.791 10.316 1.00 0.00 C ATOM 193 CG LYS A 13 -0.810 -2.355 10.803 1.00 0.00 C ATOM 194 CD LYS A 13 0.296 -3.280 10.310 1.00 0.00 C ATOM 195 CE LYS A 13 1.674 -2.811 10.761 1.00 0.00 C ATOM 196 NZ LYS A 13 1.816 -2.810 12.245 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.412 -5.223 9.818 1.00 0.00 H ATOM 198 HA LYS A 13 -2.667 -3.920 12.068 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.131 -2.971 9.253 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.881 -1.978 10.493 1.00 0.00 H ATOM 201 HG2 LYS A 13 -0.613 -1.356 10.442 1.00 0.00 H ATOM 202 HG3 LYS A 13 -0.807 -2.352 11.884 1.00 0.00 H ATOM 203 HD2 LYS A 13 0.125 -4.272 10.696 1.00 0.00 H ATOM 204 HD3 LYS A 13 0.273 -3.304 9.231 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.418 -3.472 10.341 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.838 -1.810 10.392 1.00 0.00 H ATOM 207 HZ1 LYS A 13 1.087 -2.206 12.675 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.753 -2.447 12.514 1.00 0.00 H ATOM 209 HZ3 LYS A 13 1.712 -3.777 12.616 1.00 0.00 H ATOM 210 N LYS A 14 -4.480 -4.783 9.446 1.00 0.00 N ATOM 211 CA LYS A 14 -5.853 -4.991 8.966 1.00 0.00 C ATOM 212 C LYS A 14 -6.620 -6.008 9.817 1.00 0.00 C ATOM 213 O LYS A 14 -7.654 -5.682 10.399 1.00 0.00 O ATOM 214 CB LYS A 14 -5.826 -5.465 7.502 1.00 0.00 C ATOM 215 CG LYS A 14 -7.142 -5.289 6.739 1.00 0.00 C ATOM 216 CD LYS A 14 -8.298 -6.051 7.379 1.00 0.00 C ATOM 217 CE LYS A 14 -9.318 -5.104 7.997 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.997 -5.702 9.144 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.732 -5.029 8.864 1.00 0.00 H ATOM 220 HA LYS A 14 -6.366 -4.044 9.013 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.063 -4.915 6.976 1.00 0.00 H ATOM 222 HB3 LYS A 14 -5.570 -6.514 7.486 1.00 0.00 H ATOM 223 HG2 LYS A 14 -7.389 -4.240 6.714 1.00 0.00 H ATOM 224 HG3 LYS A 14 -7.005 -5.648 5.729 1.00 0.00 H ATOM 225 HD2 LYS A 14 -8.789 -6.641 6.618 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.912 -6.703 8.146 1.00 0.00 H ATOM 227 HE2 LYS A 14 -8.811 -4.207 8.320 1.00 0.00 H ATOM 228 HE3 LYS A 14 -10.054 -4.849 7.248 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.748 -6.618 9.388 1.00 0.00 H ATOM 230 N LYS A 15 -6.118 -7.242 9.861 1.00 0.00 N ATOM 231 CA LYS A 15 -6.765 -8.325 10.603 1.00 0.00 C ATOM 232 C LYS A 15 -7.046 -7.927 12.049 1.00 0.00 C ATOM 233 O LYS A 15 -8.159 -8.108 12.544 1.00 0.00 O ATOM 234 CB LYS A 15 -5.892 -9.587 10.551 1.00 0.00 C ATOM 235 CG LYS A 15 -6.666 -10.895 10.689 1.00 0.00 C ATOM 236 CD LYS A 15 -7.266 -11.078 12.076 1.00 0.00 C ATOM 237 CE LYS A 15 -6.191 -11.145 13.148 1.00 0.00 C ATOM 238 NZ LYS A 15 -6.769 -11.371 14.501 1.00 0.00 N1+ ATOM 239 H LYS A 15 -5.298 -7.435 9.367 1.00 0.00 H ATOM 240 HA LYS A 15 -7.705 -8.536 10.118 1.00 0.00 H ATOM 241 HB2 LYS A 15 -5.370 -9.606 9.605 1.00 0.00 H ATOM 242 HB3 LYS A 15 -5.165 -9.538 11.347 1.00 0.00 H ATOM 243 HG2 LYS A 15 -7.465 -10.902 9.965 1.00 0.00 H ATOM 244 HG3 LYS A 15 -5.993 -11.716 10.488 1.00 0.00 H ATOM 245 HD2 LYS A 15 -7.923 -10.250 12.289 1.00 0.00 H ATOM 246 HD3 LYS A 15 -7.832 -11.999 12.090 1.00 0.00 H ATOM 247 HE2 LYS A 15 -5.518 -11.956 12.914 1.00 0.00 H ATOM 248 HE3 LYS A 15 -5.644 -10.215 13.149 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -7.421 -12.181 14.482 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -7.290 -10.527 14.813 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -6.009 -11.567 15.185 1.00 0.00 H ATOM 252 N ASN A 16 -6.037 -7.377 12.717 1.00 0.00 N ATOM 253 CA ASN A 16 -6.185 -6.948 14.112 1.00 0.00 C ATOM 254 C ASN A 16 -7.109 -5.733 14.239 1.00 0.00 C ATOM 255 O ASN A 16 -7.900 -5.647 15.182 1.00 0.00 O ATOM 256 CB ASN A 16 -4.820 -6.640 14.738 1.00 0.00 C ATOM 257 CG ASN A 16 -3.972 -7.889 14.931 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.599 -8.557 13.968 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.672 -8.212 16.186 1.00 0.00 N ATOM 260 H ASN A 16 -5.177 -7.254 12.260 1.00 0.00 H ATOM 261 HA ASN A 16 -6.631 -7.769 14.652 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.281 -5.958 14.098 1.00 0.00 H ATOM 263 HB3 ASN A 16 -4.969 -6.179 15.702 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.009 -7.638 16.906 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.126 -9.011 16.340 1.00 0.00 H ATOM 266 N GLN A 17 -7.004 -4.797 13.292 1.00 0.00 N ATOM 267 CA GLN A 17 -7.826 -3.580 13.302 1.00 0.00 C ATOM 268 C GLN A 17 -9.322 -3.905 13.344 1.00 0.00 C ATOM 269 O GLN A 17 -10.059 -3.353 14.165 1.00 0.00 O ATOM 270 CB GLN A 17 -7.514 -2.723 12.069 1.00 0.00 C ATOM 271 CG GLN A 17 -8.267 -1.400 12.028 1.00 0.00 C ATOM 272 CD GLN A 17 -7.989 -0.530 13.242 1.00 0.00 C ATOM 273 OE1 GLN A 17 -6.847 -0.148 13.498 1.00 0.00 O ATOM 274 NE2 GLN A 17 -9.036 -0.212 13.996 1.00 0.00 N ATOM 275 H GLN A 17 -6.354 -4.923 12.571 1.00 0.00 H ATOM 276 HA GLN A 17 -7.572 -3.021 14.188 1.00 0.00 H ATOM 277 HB2 GLN A 17 -6.456 -2.508 12.055 1.00 0.00 H ATOM 278 HB3 GLN A 17 -7.769 -3.284 11.182 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.967 -0.859 11.143 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.328 -1.603 11.982 1.00 0.00 H ATOM 281 HE21 GLN A 17 -9.918 -0.549 13.734 1.00 0.00 H ATOM 282 HE22 GLN A 17 -8.882 0.349 14.786 1.00 0.00 H ATOM 283 N ASP A 18 -9.763 -4.795 12.458 1.00 0.00 N ATOM 284 CA ASP A 18 -11.171 -5.187 12.393 1.00 0.00 C ATOM 285 C ASP A 18 -11.524 -6.129 13.543 1.00 0.00 C ATOM 286 O ASP A 18 -12.449 -5.868 14.311 1.00 0.00 O ATOM 287 CB ASP A 18 -11.480 -5.853 11.047 1.00 0.00 C ATOM 288 CG ASP A 18 -10.908 -5.070 9.880 1.00 0.00 C ATOM 289 OD1 ASP A 18 -11.265 -3.910 9.660 1.00 0.00 O ATOM 290 H ASP A 18 -9.126 -5.196 11.831 1.00 0.00 H ATOM 291 HA ASP A 18 -11.767 -4.290 12.486 1.00 0.00 H ATOM 292 HB2 ASP A 18 -11.054 -6.846 11.036 1.00 0.00 H ATOM 293 HB3 ASP A 18 -12.550 -5.923 10.922 1.00 0.00 H HETATM 294 N NH2 A 19 -10.782 -7.227 13.664 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -10.060 -7.374 13.017 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.985 -7.845 14.397 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 12 ATOM 1 N PHE A 1 3.718 -8.286 -7.668 1.00 0.00 N ATOM 2 CA PHE A 1 2.557 -8.439 -6.795 1.00 0.00 C ATOM 3 C PHE A 1 2.163 -7.099 -6.176 1.00 0.00 C ATOM 4 O PHE A 1 3.022 -6.278 -5.846 1.00 0.00 O ATOM 5 CB PHE A 1 2.837 -9.457 -5.681 1.00 0.00 C ATOM 6 CG PHE A 1 3.177 -10.840 -6.173 1.00 0.00 C ATOM 7 CD1 PHE A 1 4.299 -11.060 -6.960 1.00 0.00 C ATOM 8 CD2 PHE A 1 2.371 -11.919 -5.848 1.00 0.00 C ATOM 9 CE1 PHE A 1 4.609 -12.329 -7.409 1.00 0.00 C ATOM 10 CE2 PHE A 1 2.677 -13.191 -6.294 1.00 0.00 C ATOM 11 CZ PHE A 1 3.798 -13.396 -7.076 1.00 0.00 C ATOM 12 H1 PHE A 1 3.585 -7.982 -8.590 1.00 0.00 H ATOM 13 HA PHE A 1 1.736 -8.798 -7.398 1.00 0.00 H ATOM 14 HB2 PHE A 1 3.665 -9.106 -5.086 1.00 0.00 H ATOM 15 HB3 PHE A 1 1.962 -9.535 -5.053 1.00 0.00 H ATOM 16 HD1 PHE A 1 4.936 -10.228 -7.220 1.00 0.00 H ATOM 17 HD2 PHE A 1 1.494 -11.761 -5.237 1.00 0.00 H ATOM 18 HE1 PHE A 1 5.486 -12.487 -8.021 1.00 0.00 H ATOM 19 HE2 PHE A 1 2.041 -14.023 -6.034 1.00 0.00 H ATOM 20 HZ PHE A 1 4.040 -14.389 -7.426 1.00 0.00 H ATOM 21 N GLY A 2 0.853 -6.893 -6.012 1.00 0.00 N ATOM 22 CA GLY A 2 0.349 -5.661 -5.423 1.00 0.00 C ATOM 23 C GLY A 2 0.945 -5.370 -4.053 1.00 0.00 C ATOM 24 O GLY A 2 1.085 -4.207 -3.671 1.00 0.00 O ATOM 25 H GLY A 2 0.221 -7.589 -6.288 1.00 0.00 H ATOM 26 HA2 GLY A 2 0.581 -4.839 -6.084 1.00 0.00 H ATOM 27 HA3 GLY A 2 -0.724 -5.735 -5.327 1.00 0.00 H ATOM 28 N GLY A 3 1.291 -6.433 -3.316 1.00 0.00 N ATOM 29 CA GLY A 3 1.870 -6.286 -1.987 1.00 0.00 C ATOM 30 C GLY A 3 3.216 -5.576 -1.992 1.00 0.00 C ATOM 31 O GLY A 3 3.295 -4.391 -2.321 1.00 0.00 O ATOM 32 H GLY A 3 1.148 -7.332 -3.679 1.00 0.00 H ATOM 33 HA2 GLY A 3 1.184 -5.724 -1.371 1.00 0.00 H ATOM 34 HA3 GLY A 3 1.998 -7.269 -1.556 1.00 0.00 H ATOM 35 N PHE A 4 4.274 -6.301 -1.608 1.00 0.00 N ATOM 36 CA PHE A 4 5.631 -5.742 -1.548 1.00 0.00 C ATOM 37 C PHE A 4 5.758 -4.709 -0.428 1.00 0.00 C ATOM 38 O PHE A 4 4.755 -4.196 0.073 1.00 0.00 O ATOM 39 CB PHE A 4 6.039 -5.123 -2.892 1.00 0.00 C ATOM 40 CG PHE A 4 6.425 -6.135 -3.940 1.00 0.00 C ATOM 41 CD1 PHE A 4 5.635 -7.248 -4.185 1.00 0.00 C ATOM 42 CD2 PHE A 4 7.587 -5.969 -4.677 1.00 0.00 C ATOM 43 CE1 PHE A 4 5.997 -8.174 -5.146 1.00 0.00 C ATOM 44 CE2 PHE A 4 7.953 -6.891 -5.638 1.00 0.00 C ATOM 45 CZ PHE A 4 7.157 -7.995 -5.872 1.00 0.00 C ATOM 46 H PHE A 4 4.137 -7.236 -1.345 1.00 0.00 H ATOM 47 HA PHE A 4 6.303 -6.559 -1.329 1.00 0.00 H ATOM 48 HB2 PHE A 4 5.216 -4.545 -3.281 1.00 0.00 H ATOM 49 HB3 PHE A 4 6.886 -4.469 -2.736 1.00 0.00 H ATOM 50 HD1 PHE A 4 4.726 -7.389 -3.619 1.00 0.00 H ATOM 51 HD2 PHE A 4 8.211 -5.106 -4.495 1.00 0.00 H ATOM 52 HE1 PHE A 4 5.375 -9.037 -5.327 1.00 0.00 H ATOM 53 HE2 PHE A 4 8.861 -6.749 -6.204 1.00 0.00 H ATOM 54 HZ PHE A 4 7.442 -8.716 -6.623 1.00 0.00 H ATOM 55 N THR A 5 7.005 -4.424 -0.031 1.00 0.00 N ATOM 56 CA THR A 5 7.295 -3.466 1.040 1.00 0.00 C ATOM 57 C THR A 5 6.985 -4.064 2.412 1.00 0.00 C ATOM 58 O THR A 5 5.938 -4.686 2.608 1.00 0.00 O ATOM 59 CB THR A 5 6.506 -2.146 0.873 1.00 0.00 C ATOM 60 OG1 THR A 5 6.805 -1.553 -0.397 1.00 0.00 O ATOM 61 CG2 THR A 5 6.845 -1.163 1.987 1.00 0.00 C ATOM 62 H THR A 5 7.754 -4.879 -0.467 1.00 0.00 H ATOM 63 HA THR A 5 8.350 -3.234 0.995 1.00 0.00 H ATOM 64 HB THR A 5 5.450 -2.364 0.920 1.00 0.00 H ATOM 65 HG1 THR A 5 6.182 -1.873 -1.056 1.00 0.00 H ATOM 66 HG21 THR A 5 7.910 -1.184 2.173 1.00 0.00 H ATOM 67 HG22 THR A 5 6.316 -1.444 2.886 1.00 0.00 H ATOM 68 HG23 THR A 5 6.552 -0.168 1.692 1.00 0.00 H ATOM 69 N GLY A 6 7.909 -3.875 3.356 1.00 0.00 N ATOM 70 CA GLY A 6 7.733 -4.400 4.702 1.00 0.00 C ATOM 71 C GLY A 6 6.741 -3.600 5.532 1.00 0.00 C ATOM 72 O GLY A 6 7.099 -3.074 6.587 1.00 0.00 O ATOM 73 H GLY A 6 8.722 -3.375 3.134 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.385 -5.420 4.633 1.00 0.00 H ATOM 75 HA3 GLY A 6 8.691 -4.393 5.203 1.00 0.00 H ATOM 76 N LYS A 7 5.495 -3.506 5.056 1.00 0.00 N ATOM 77 CA LYS A 7 4.446 -2.765 5.763 1.00 0.00 C ATOM 78 C LYS A 7 3.905 -3.579 6.954 1.00 0.00 C ATOM 79 O LYS A 7 2.712 -3.858 7.045 1.00 0.00 O ATOM 80 CB LYS A 7 3.318 -2.366 4.784 1.00 0.00 C ATOM 81 CG LYS A 7 2.301 -3.463 4.456 1.00 0.00 C ATOM 82 CD LYS A 7 2.956 -4.762 4.010 1.00 0.00 C ATOM 83 CE LYS A 7 1.950 -5.904 3.984 1.00 0.00 C ATOM 84 NZ LYS A 7 1.395 -6.170 5.313 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.277 -3.946 4.211 1.00 0.00 H ATOM 86 HA LYS A 7 4.899 -1.863 6.150 1.00 0.00 H ATOM 87 HB2 LYS A 7 2.776 -1.534 5.207 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.770 -2.045 3.856 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.703 -3.661 5.329 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.660 -3.109 3.662 1.00 0.00 H ATOM 91 HD2 LYS A 7 3.362 -4.629 3.017 1.00 0.00 H ATOM 92 HD3 LYS A 7 3.750 -5.010 4.697 1.00 0.00 H ATOM 93 HE2 LYS A 7 1.146 -5.645 3.312 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.445 -6.795 3.625 1.00 0.00 H ATOM 95 HZ1 LYS A 7 0.463 -5.919 5.469 1.00 0.00 H ATOM 96 N ARG A 8 4.803 -3.958 7.867 1.00 0.00 N ATOM 97 CA ARG A 8 4.431 -4.743 9.047 1.00 0.00 C ATOM 98 C ARG A 8 3.285 -4.083 9.800 1.00 0.00 C ATOM 99 O ARG A 8 2.397 -4.758 10.320 1.00 0.00 O ATOM 100 CB ARG A 8 5.637 -4.927 9.977 1.00 0.00 C ATOM 101 CG ARG A 8 6.852 -5.530 9.285 1.00 0.00 C ATOM 102 CD ARG A 8 6.521 -6.867 8.637 1.00 0.00 C ATOM 103 NE ARG A 8 7.608 -7.352 7.788 1.00 0.00 N ATOM 104 CZ ARG A 8 7.562 -8.492 7.089 1.00 0.00 C ATOM 105 NH1 ARG A 8 6.487 -9.276 7.145 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 8.596 -8.847 6.333 1.00 0.00 N ATOM 107 H ARG A 8 5.738 -3.705 7.743 1.00 0.00 H ATOM 108 HA ARG A 8 4.103 -5.714 8.705 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.918 -3.966 10.381 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.352 -5.581 10.789 1.00 0.00 H ATOM 111 HG2 ARG A 8 7.194 -4.847 8.523 1.00 0.00 H ATOM 112 HG3 ARG A 8 7.633 -5.677 10.017 1.00 0.00 H ATOM 113 HD2 ARG A 8 6.335 -7.593 9.414 1.00 0.00 H ATOM 114 HD3 ARG A 8 5.632 -6.750 8.035 1.00 0.00 H ATOM 115 HE ARG A 8 8.416 -6.800 7.728 1.00 0.00 H ATOM 116 HH11 ARG A 8 5.705 -9.019 7.712 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.461 -10.125 6.616 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.406 -8.263 6.288 1.00 0.00 H ATOM 119 HH22 ARG A 8 8.563 -9.698 5.809 1.00 0.00 H ATOM 120 N LYS A 9 3.304 -2.759 9.842 1.00 0.00 N ATOM 121 CA LYS A 9 2.253 -2.010 10.517 1.00 0.00 C ATOM 122 C LYS A 9 0.902 -2.295 9.861 1.00 0.00 C ATOM 123 O LYS A 9 -0.061 -2.663 10.532 1.00 0.00 O ATOM 124 CB LYS A 9 2.560 -0.509 10.487 1.00 0.00 C ATOM 125 CG LYS A 9 3.871 -0.147 11.173 1.00 0.00 C ATOM 126 CD LYS A 9 4.101 1.355 11.185 1.00 0.00 C ATOM 127 CE LYS A 9 5.410 1.715 11.870 1.00 0.00 C ATOM 128 NZ LYS A 9 5.612 3.189 11.949 1.00 0.00 N1+ ATOM 129 H LYS A 9 4.033 -2.276 9.398 1.00 0.00 H ATOM 130 HA LYS A 9 2.218 -2.341 11.543 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.617 -0.185 9.457 1.00 0.00 H ATOM 132 HB3 LYS A 9 1.760 0.024 10.979 1.00 0.00 H ATOM 133 HG2 LYS A 9 3.844 -0.504 12.191 1.00 0.00 H ATOM 134 HG3 LYS A 9 4.684 -0.623 10.643 1.00 0.00 H ATOM 135 HD2 LYS A 9 4.130 1.713 10.166 1.00 0.00 H ATOM 136 HD3 LYS A 9 3.287 1.827 11.711 1.00 0.00 H ATOM 137 HE2 LYS A 9 5.401 1.309 12.870 1.00 0.00 H ATOM 138 HE3 LYS A 9 6.226 1.277 11.314 1.00 0.00 H ATOM 139 HZ1 LYS A 9 6.438 3.404 12.543 1.00 0.00 H ATOM 140 HZ2 LYS A 9 4.773 3.645 12.362 1.00 0.00 H ATOM 141 HZ3 LYS A 9 5.773 3.579 10.999 1.00 0.00 H ATOM 142 N SER A 10 0.845 -2.141 8.540 1.00 0.00 N ATOM 143 CA SER A 10 -0.381 -2.397 7.787 1.00 0.00 C ATOM 144 C SER A 10 -0.749 -3.884 7.814 1.00 0.00 C ATOM 145 O SER A 10 -1.930 -4.232 7.868 1.00 0.00 O ATOM 146 CB SER A 10 -0.228 -1.922 6.339 1.00 0.00 C ATOM 147 OG SER A 10 -1.400 -2.185 5.587 1.00 0.00 O ATOM 148 H SER A 10 1.651 -1.860 8.059 1.00 0.00 H ATOM 149 HA SER A 10 -1.176 -1.837 8.255 1.00 0.00 H ATOM 150 HB2 SER A 10 -0.040 -0.859 6.329 1.00 0.00 H ATOM 151 HB3 SER A 10 0.602 -2.437 5.882 1.00 0.00 H ATOM 152 HG SER A 10 -1.172 -2.694 4.805 1.00 0.00 H ATOM 153 N ASP A 11 0.265 -4.754 7.771 1.00 0.00 N ATOM 154 CA ASP A 11 0.047 -6.203 7.784 1.00 0.00 C ATOM 155 C ASP A 11 -0.644 -6.656 9.072 1.00 0.00 C ATOM 156 O ASP A 11 -1.590 -7.443 9.030 1.00 0.00 O ATOM 157 CB ASP A 11 1.380 -6.958 7.636 1.00 0.00 C ATOM 158 CG ASP A 11 2.092 -6.736 6.304 1.00 0.00 C ATOM 159 OD1 ASP A 11 3.265 -7.088 6.167 1.00 0.00 O ATOM 160 H ASP A 11 1.182 -4.412 7.727 1.00 0.00 H ATOM 161 HA ASP A 11 -0.587 -6.449 6.949 1.00 0.00 H ATOM 162 HB2 ASP A 11 2.045 -6.643 8.426 1.00 0.00 H ATOM 163 HB3 ASP A 11 1.189 -8.017 7.744 1.00 0.00 H ATOM 164 N ARG A 12 -0.153 -6.166 10.214 1.00 0.00 N ATOM 165 CA ARG A 12 -0.717 -6.539 11.514 1.00 0.00 C ATOM 166 C ARG A 12 -2.149 -6.019 11.686 1.00 0.00 C ATOM 167 O ARG A 12 -3.001 -6.723 12.232 1.00 0.00 O ATOM 168 CB ARG A 12 0.191 -6.070 12.660 1.00 0.00 C ATOM 169 CG ARG A 12 0.406 -4.566 12.727 1.00 0.00 C ATOM 170 CD ARG A 12 1.543 -4.211 13.673 1.00 0.00 C ATOM 171 NE ARG A 12 1.332 -4.737 15.024 1.00 0.00 N ATOM 172 CZ ARG A 12 2.259 -4.718 15.985 1.00 0.00 C ATOM 173 NH1 ARG A 12 3.468 -4.212 15.748 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 1.978 -5.213 17.188 1.00 0.00 N ATOM 175 H ARG A 12 0.610 -5.552 10.179 1.00 0.00 H ATOM 176 HA ARG A 12 -0.756 -7.617 11.537 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.243 -6.386 13.596 1.00 0.00 H ATOM 178 HB3 ARG A 12 1.156 -6.542 12.548 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.648 -4.204 11.741 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.501 -4.097 13.075 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.460 -4.620 13.278 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.624 -3.136 13.725 1.00 0.00 H ATOM 183 HE ARG A 12 0.453 -5.120 15.227 1.00 0.00 H ATOM 184 HH11 ARG A 12 3.690 -3.841 14.846 1.00 0.00 H ATOM 185 HH12 ARG A 12 4.158 -4.205 16.472 1.00 0.00 H ATOM 186 HH21 ARG A 12 1.074 -5.598 17.371 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.672 -5.202 17.908 1.00 0.00 H ATOM 188 N LYS A 13 -2.421 -4.805 11.201 1.00 0.00 N ATOM 189 CA LYS A 13 -3.770 -4.234 11.290 1.00 0.00 C ATOM 190 C LYS A 13 -4.738 -4.964 10.353 1.00 0.00 C ATOM 191 O LYS A 13 -5.909 -5.161 10.683 1.00 0.00 O ATOM 192 CB LYS A 13 -3.768 -2.735 10.957 1.00 0.00 C ATOM 193 CG LYS A 13 -3.429 -1.835 12.136 1.00 0.00 C ATOM 194 CD LYS A 13 -1.982 -1.986 12.568 1.00 0.00 C ATOM 195 CE LYS A 13 -1.678 -1.160 13.807 1.00 0.00 C ATOM 196 NZ LYS A 13 -0.241 -1.245 14.194 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.712 -4.294 10.759 1.00 0.00 H ATOM 198 HA LYS A 13 -4.112 -4.364 12.304 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.043 -2.554 10.176 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.747 -2.459 10.592 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.600 -0.807 11.850 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.073 -2.088 12.967 1.00 0.00 H ATOM 203 HD2 LYS A 13 -1.786 -3.025 12.781 1.00 0.00 H ATOM 204 HD3 LYS A 13 -1.346 -1.654 11.763 1.00 0.00 H ATOM 205 HE2 LYS A 13 -1.928 -0.130 13.608 1.00 0.00 H ATOM 206 HE3 LYS A 13 -2.285 -1.525 14.623 1.00 0.00 H ATOM 207 HZ1 LYS A 13 0.359 -1.281 13.344 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -0.072 -2.101 14.760 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.027 -0.413 14.759 1.00 0.00 H ATOM 210 N LYS A 14 -4.240 -5.341 9.175 1.00 0.00 N ATOM 211 CA LYS A 14 -5.042 -6.025 8.161 1.00 0.00 C ATOM 212 C LYS A 14 -5.392 -7.470 8.537 1.00 0.00 C ATOM 213 O LYS A 14 -6.531 -7.895 8.358 1.00 0.00 O ATOM 214 CB LYS A 14 -4.295 -6.010 6.817 1.00 0.00 C ATOM 215 CG LYS A 14 -4.879 -6.940 5.756 1.00 0.00 C ATOM 216 CD LYS A 14 -5.870 -6.233 4.834 1.00 0.00 C ATOM 217 CE LYS A 14 -6.999 -5.550 5.595 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.188 -6.393 5.807 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.302 -5.136 8.974 1.00 0.00 H ATOM 220 HA LYS A 14 -5.961 -5.472 8.053 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.313 -5.003 6.425 1.00 0.00 H ATOM 222 HB3 LYS A 14 -3.269 -6.298 6.989 1.00 0.00 H ATOM 223 HG2 LYS A 14 -4.070 -7.330 5.157 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.378 -7.756 6.251 1.00 0.00 H ATOM 225 HD2 LYS A 14 -5.339 -5.488 4.262 1.00 0.00 H ATOM 226 HD3 LYS A 14 -6.295 -6.964 4.161 1.00 0.00 H ATOM 227 HE2 LYS A 14 -6.626 -5.241 6.556 1.00 0.00 H ATOM 228 HE3 LYS A 14 -7.296 -4.673 5.038 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.044 -5.924 5.901 1.00 0.00 H ATOM 230 N LYS A 15 -4.412 -8.232 9.020 1.00 0.00 N ATOM 231 CA LYS A 15 -4.637 -9.639 9.367 1.00 0.00 C ATOM 232 C LYS A 15 -5.781 -9.819 10.363 1.00 0.00 C ATOM 233 O LYS A 15 -6.542 -10.782 10.265 1.00 0.00 O ATOM 234 CB LYS A 15 -3.349 -10.293 9.894 1.00 0.00 C ATOM 235 CG LYS A 15 -2.787 -9.678 11.174 1.00 0.00 C ATOM 236 CD LYS A 15 -3.451 -10.237 12.430 1.00 0.00 C ATOM 237 CE LYS A 15 -3.268 -11.744 12.552 1.00 0.00 C ATOM 238 NZ LYS A 15 -1.833 -12.132 12.668 1.00 0.00 N1+ ATOM 239 H LYS A 15 -3.519 -7.850 9.121 1.00 0.00 H ATOM 240 HA LYS A 15 -4.920 -10.141 8.452 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.549 -11.336 10.087 1.00 0.00 H ATOM 242 HB3 LYS A 15 -2.590 -10.225 9.128 1.00 0.00 H ATOM 243 HG2 LYS A 15 -1.729 -9.883 11.222 1.00 0.00 H ATOM 244 HG3 LYS A 15 -2.944 -8.611 11.142 1.00 0.00 H ATOM 245 HD2 LYS A 15 -3.012 -9.765 13.295 1.00 0.00 H ATOM 246 HD3 LYS A 15 -4.505 -10.016 12.400 1.00 0.00 H ATOM 247 HE2 LYS A 15 -3.793 -12.085 13.432 1.00 0.00 H ATOM 248 HE3 LYS A 15 -3.691 -12.217 11.678 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -1.374 -11.589 13.427 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -1.337 -11.945 11.773 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -1.755 -13.147 12.887 1.00 0.00 H ATOM 252 N ASN A 16 -5.899 -8.902 11.317 1.00 0.00 N ATOM 253 CA ASN A 16 -6.958 -8.987 12.326 1.00 0.00 C ATOM 254 C ASN A 16 -8.284 -8.427 11.809 1.00 0.00 C ATOM 255 O ASN A 16 -9.349 -8.956 12.131 1.00 0.00 O ATOM 256 CB ASN A 16 -6.542 -8.284 13.625 1.00 0.00 C ATOM 257 CG ASN A 16 -6.157 -6.828 13.428 1.00 0.00 C ATOM 258 OD1 ASN A 16 -6.989 -5.994 13.073 1.00 0.00 O ATOM 259 ND2 ASN A 16 -4.887 -6.517 13.660 1.00 0.00 N ATOM 260 H ASN A 16 -5.260 -8.157 11.347 1.00 0.00 H ATOM 261 HA ASN A 16 -7.103 -10.036 12.541 1.00 0.00 H ATOM 262 HB2 ASN A 16 -7.365 -8.323 14.322 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.697 -8.806 14.048 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.276 -7.232 13.939 1.00 0.00 H ATOM 265 HD22 ASN A 16 -4.613 -5.585 13.550 1.00 0.00 H ATOM 266 N GLN A 17 -8.217 -7.357 11.017 1.00 0.00 N ATOM 267 CA GLN A 17 -9.419 -6.730 10.471 1.00 0.00 C ATOM 268 C GLN A 17 -10.049 -7.597 9.371 1.00 0.00 C ATOM 269 O GLN A 17 -11.272 -7.686 9.269 1.00 0.00 O ATOM 270 CB GLN A 17 -9.098 -5.323 9.947 1.00 0.00 C ATOM 271 CG GLN A 17 -8.433 -5.295 8.583 1.00 0.00 C ATOM 272 CD GLN A 17 -8.011 -3.895 8.176 1.00 0.00 C ATOM 273 OE1 GLN A 17 -7.150 -3.286 8.810 1.00 0.00 O ATOM 274 NE2 GLN A 17 -8.623 -3.370 7.119 1.00 0.00 N ATOM 275 H GLN A 17 -7.339 -6.977 10.800 1.00 0.00 H ATOM 276 HA GLN A 17 -10.130 -6.642 11.278 1.00 0.00 H ATOM 277 HB2 GLN A 17 -10.013 -4.755 9.887 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.432 -4.839 10.647 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.560 -5.925 8.611 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.130 -5.675 7.852 1.00 0.00 H ATOM 281 HE21 GLN A 17 -9.310 -3.904 6.666 1.00 0.00 H ATOM 282 HE22 GLN A 17 -8.362 -2.469 6.833 1.00 0.00 H ATOM 283 N ASP A 18 -9.203 -8.230 8.550 1.00 0.00 N ATOM 284 CA ASP A 18 -9.679 -9.087 7.455 1.00 0.00 C ATOM 285 C ASP A 18 -8.936 -10.430 7.383 1.00 0.00 C ATOM 286 O ASP A 18 -9.479 -11.416 6.884 1.00 0.00 O ATOM 287 CB ASP A 18 -9.566 -8.358 6.111 1.00 0.00 C ATOM 288 CG ASP A 18 -8.202 -7.730 5.882 1.00 0.00 C ATOM 289 OD1 ASP A 18 -7.202 -8.437 5.779 1.00 0.00 O ATOM 290 H ASP A 18 -8.241 -8.112 8.679 1.00 0.00 H ATOM 291 HA ASP A 18 -10.721 -9.293 7.642 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.750 -9.064 5.315 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.312 -7.579 6.071 1.00 0.00 H HETATM 294 N NH2 A 19 -7.696 -10.485 7.867 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -7.308 -9.677 8.255 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -7.220 -11.339 7.813 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 13 ATOM 1 N PHE A 1 9.384 -9.227 -4.972 1.00 0.00 N ATOM 2 CA PHE A 1 8.255 -8.390 -5.371 1.00 0.00 C ATOM 3 C PHE A 1 8.738 -6.976 -5.720 1.00 0.00 C ATOM 4 O PHE A 1 9.940 -6.754 -5.887 1.00 0.00 O ATOM 5 CB PHE A 1 7.225 -8.341 -4.232 1.00 0.00 C ATOM 6 CG PHE A 1 5.796 -8.256 -4.696 1.00 0.00 C ATOM 7 CD1 PHE A 1 5.278 -9.206 -5.565 1.00 0.00 C ATOM 8 CD2 PHE A 1 4.967 -7.232 -4.260 1.00 0.00 C ATOM 9 CE1 PHE A 1 3.966 -9.134 -5.990 1.00 0.00 C ATOM 10 CE2 PHE A 1 3.654 -7.157 -4.684 1.00 0.00 C ATOM 11 CZ PHE A 1 3.152 -8.110 -5.549 1.00 0.00 C ATOM 12 H1 PHE A 1 10.099 -9.406 -5.617 1.00 0.00 H ATOM 13 HA PHE A 1 7.800 -8.834 -6.244 1.00 0.00 H ATOM 14 HB2 PHE A 1 7.323 -9.232 -3.631 1.00 0.00 H ATOM 15 HB3 PHE A 1 7.427 -7.475 -3.614 1.00 0.00 H ATOM 16 HD1 PHE A 1 5.914 -10.008 -5.910 1.00 0.00 H ATOM 17 HD2 PHE A 1 5.359 -6.486 -3.584 1.00 0.00 H ATOM 18 HE1 PHE A 1 3.576 -9.881 -6.667 1.00 0.00 H ATOM 19 HE2 PHE A 1 3.020 -6.356 -4.336 1.00 0.00 H ATOM 20 HZ PHE A 1 2.126 -8.053 -5.881 1.00 0.00 H ATOM 21 N GLY A 2 7.808 -6.021 -5.823 1.00 0.00 N ATOM 22 CA GLY A 2 8.177 -4.648 -6.136 1.00 0.00 C ATOM 23 C GLY A 2 8.959 -4.007 -5.005 1.00 0.00 C ATOM 24 O GLY A 2 10.171 -4.207 -4.891 1.00 0.00 O ATOM 25 H GLY A 2 6.868 -6.246 -5.676 1.00 0.00 H ATOM 26 HA2 GLY A 2 8.783 -4.640 -7.031 1.00 0.00 H ATOM 27 HA3 GLY A 2 7.280 -4.074 -6.314 1.00 0.00 H ATOM 28 N GLY A 3 8.259 -3.255 -4.158 1.00 0.00 N ATOM 29 CA GLY A 3 8.901 -2.615 -3.023 1.00 0.00 C ATOM 30 C GLY A 3 9.153 -3.600 -1.897 1.00 0.00 C ATOM 31 O GLY A 3 9.812 -4.622 -2.098 1.00 0.00 O ATOM 32 H GLY A 3 7.295 -3.147 -4.294 1.00 0.00 H ATOM 33 HA2 GLY A 3 9.843 -2.193 -3.341 1.00 0.00 H ATOM 34 HA3 GLY A 3 8.266 -1.822 -2.660 1.00 0.00 H ATOM 35 N PHE A 4 8.620 -3.303 -0.712 1.00 0.00 N ATOM 36 CA PHE A 4 8.783 -4.186 0.440 1.00 0.00 C ATOM 37 C PHE A 4 7.922 -5.436 0.285 1.00 0.00 C ATOM 38 O PHE A 4 6.705 -5.346 0.106 1.00 0.00 O ATOM 39 CB PHE A 4 8.437 -3.455 1.742 1.00 0.00 C ATOM 40 CG PHE A 4 9.499 -2.487 2.191 1.00 0.00 C ATOM 41 CD1 PHE A 4 10.026 -1.553 1.314 1.00 0.00 C ATOM 42 CD2 PHE A 4 9.977 -2.522 3.493 1.00 0.00 C ATOM 43 CE1 PHE A 4 11.008 -0.673 1.723 1.00 0.00 C ATOM 44 CE2 PHE A 4 10.958 -1.643 3.908 1.00 0.00 C ATOM 45 CZ PHE A 4 11.475 -0.717 3.022 1.00 0.00 C ATOM 46 H PHE A 4 8.095 -2.480 -0.616 1.00 0.00 H ATOM 47 HA PHE A 4 9.820 -4.486 0.475 1.00 0.00 H ATOM 48 HB2 PHE A 4 7.522 -2.899 1.602 1.00 0.00 H ATOM 49 HB3 PHE A 4 8.293 -4.182 2.529 1.00 0.00 H ATOM 50 HD1 PHE A 4 9.661 -1.515 0.300 1.00 0.00 H ATOM 51 HD2 PHE A 4 9.573 -3.245 4.185 1.00 0.00 H ATOM 52 HE1 PHE A 4 11.411 0.049 1.029 1.00 0.00 H ATOM 53 HE2 PHE A 4 11.322 -1.679 4.924 1.00 0.00 H ATOM 54 HZ PHE A 4 12.244 -0.030 3.344 1.00 0.00 H ATOM 55 N THR A 5 8.567 -6.601 0.346 1.00 0.00 N ATOM 56 CA THR A 5 7.872 -7.879 0.205 1.00 0.00 C ATOM 57 C THR A 5 6.948 -8.151 1.392 1.00 0.00 C ATOM 58 O THR A 5 5.816 -8.603 1.211 1.00 0.00 O ATOM 59 CB THR A 5 8.867 -9.048 0.046 1.00 0.00 C ATOM 60 OG1 THR A 5 9.739 -9.112 1.181 1.00 0.00 O ATOM 61 CG2 THR A 5 9.693 -8.890 -1.225 1.00 0.00 C ATOM 62 H THR A 5 9.538 -6.601 0.485 1.00 0.00 H ATOM 63 HA THR A 5 7.272 -7.828 -0.691 1.00 0.00 H ATOM 64 HB THR A 5 8.307 -9.970 -0.021 1.00 0.00 H ATOM 65 HG1 THR A 5 9.533 -9.893 1.698 1.00 0.00 H ATOM 66 HG21 THR A 5 9.917 -9.863 -1.634 1.00 0.00 H ATOM 67 HG22 THR A 5 10.615 -8.376 -0.995 1.00 0.00 H ATOM 68 HG23 THR A 5 9.133 -8.316 -1.950 1.00 0.00 H ATOM 69 N GLY A 6 7.433 -7.871 2.604 1.00 0.00 N ATOM 70 CA GLY A 6 6.630 -8.089 3.795 1.00 0.00 C ATOM 71 C GLY A 6 5.460 -7.123 3.890 1.00 0.00 C ATOM 72 O GLY A 6 5.655 -5.908 3.950 1.00 0.00 O ATOM 73 H GLY A 6 8.340 -7.510 2.688 1.00 0.00 H ATOM 74 HA2 GLY A 6 6.249 -9.099 3.785 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.256 -7.963 4.666 1.00 0.00 H ATOM 76 N LYS A 7 4.245 -7.670 3.908 1.00 0.00 N ATOM 77 CA LYS A 7 3.028 -6.859 4.002 1.00 0.00 C ATOM 78 C LYS A 7 2.545 -6.746 5.456 1.00 0.00 C ATOM 79 O LYS A 7 1.352 -6.864 5.741 1.00 0.00 O ATOM 80 CB LYS A 7 1.932 -7.429 3.077 1.00 0.00 C ATOM 81 CG LYS A 7 1.762 -8.953 3.104 1.00 0.00 C ATOM 82 CD LYS A 7 1.004 -9.439 4.333 1.00 0.00 C ATOM 83 CE LYS A 7 1.918 -9.676 5.529 1.00 0.00 C ATOM 84 NZ LYS A 7 1.297 -9.228 6.774 1.00 0.00 N1+ ATOM 85 H LYS A 7 4.165 -8.644 3.864 1.00 0.00 H ATOM 86 HA LYS A 7 3.281 -5.866 3.659 1.00 0.00 H ATOM 87 HB2 LYS A 7 0.986 -6.989 3.354 1.00 0.00 H ATOM 88 HB3 LYS A 7 2.161 -7.138 2.062 1.00 0.00 H ATOM 89 HG2 LYS A 7 1.213 -9.253 2.223 1.00 0.00 H ATOM 90 HG3 LYS A 7 2.738 -9.414 3.087 1.00 0.00 H ATOM 91 HD2 LYS A 7 0.268 -8.697 4.602 1.00 0.00 H ATOM 92 HD3 LYS A 7 0.504 -10.365 4.086 1.00 0.00 H ATOM 93 HE2 LYS A 7 2.127 -10.732 5.602 1.00 0.00 H ATOM 94 HE3 LYS A 7 2.841 -9.135 5.379 1.00 0.00 H ATOM 95 HZ1 LYS A 7 1.816 -8.620 7.340 1.00 0.00 H ATOM 96 N ARG A 8 3.498 -6.508 6.363 1.00 0.00 N ATOM 97 CA ARG A 8 3.231 -6.379 7.801 1.00 0.00 C ATOM 98 C ARG A 8 2.101 -5.395 8.100 1.00 0.00 C ATOM 99 O ARG A 8 1.229 -5.677 8.923 1.00 0.00 O ATOM 100 CB ARG A 8 4.509 -5.924 8.516 1.00 0.00 C ATOM 101 CG ARG A 8 4.382 -5.806 10.029 1.00 0.00 C ATOM 102 CD ARG A 8 4.719 -7.107 10.755 1.00 0.00 C ATOM 103 NE ARG A 8 3.703 -8.147 10.577 1.00 0.00 N ATOM 104 CZ ARG A 8 3.699 -9.047 9.587 1.00 0.00 C ATOM 105 NH1 ARG A 8 4.681 -9.081 8.688 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 2.714 -9.936 9.514 1.00 0.00 N ATOM 107 H ARG A 8 4.420 -6.415 6.057 1.00 0.00 H ATOM 108 HA ARG A 8 2.951 -7.349 8.173 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.296 -6.630 8.300 1.00 0.00 H ATOM 110 HB3 ARG A 8 4.795 -4.958 8.125 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.054 -5.036 10.373 1.00 0.00 H ATOM 112 HG3 ARG A 8 3.366 -5.526 10.270 1.00 0.00 H ATOM 113 HD2 ARG A 8 5.662 -7.475 10.382 1.00 0.00 H ATOM 114 HD3 ARG A 8 4.815 -6.893 11.810 1.00 0.00 H ATOM 115 HE ARG A 8 2.973 -8.171 11.230 1.00 0.00 H ATOM 116 HH11 ARG A 8 5.436 -8.430 8.744 1.00 0.00 H ATOM 117 HH12 ARG A 8 4.661 -9.757 7.952 1.00 0.00 H ATOM 118 HH21 ARG A 8 1.982 -9.929 10.194 1.00 0.00 H ATOM 119 HH22 ARG A 8 2.704 -10.615 8.778 1.00 0.00 H ATOM 120 N LYS A 9 2.133 -4.239 7.443 1.00 0.00 N ATOM 121 CA LYS A 9 1.116 -3.204 7.659 1.00 0.00 C ATOM 122 C LYS A 9 -0.295 -3.733 7.391 1.00 0.00 C ATOM 123 O LYS A 9 -1.219 -3.468 8.163 1.00 0.00 O ATOM 124 CB LYS A 9 1.390 -1.981 6.774 1.00 0.00 C ATOM 125 CG LYS A 9 0.502 -0.784 7.091 1.00 0.00 C ATOM 126 CD LYS A 9 0.794 -0.222 8.476 1.00 0.00 C ATOM 127 CE LYS A 9 -0.149 0.919 8.836 1.00 0.00 C ATOM 128 NZ LYS A 9 -1.554 0.452 9.012 1.00 0.00 N1+ ATOM 129 H LYS A 9 2.865 -4.073 6.808 1.00 0.00 H ATOM 130 HA LYS A 9 1.177 -2.903 8.692 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.419 -1.680 6.907 1.00 0.00 H ATOM 132 HB3 LYS A 9 1.234 -2.254 5.742 1.00 0.00 H ATOM 133 HG2 LYS A 9 0.681 -0.012 6.356 1.00 0.00 H ATOM 134 HG3 LYS A 9 -0.533 -1.092 7.047 1.00 0.00 H ATOM 135 HD2 LYS A 9 0.680 -1.011 9.205 1.00 0.00 H ATOM 136 HD3 LYS A 9 1.811 0.143 8.497 1.00 0.00 H ATOM 137 HE2 LYS A 9 0.188 1.370 9.757 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.120 1.653 8.044 1.00 0.00 H ATOM 139 HZ1 LYS A 9 -2.099 1.158 9.549 1.00 0.00 H ATOM 140 HZ2 LYS A 9 -1.572 -0.448 9.533 1.00 0.00 H ATOM 141 HZ3 LYS A 9 -2.005 0.313 8.086 1.00 0.00 H ATOM 142 N SER A 10 -0.451 -4.475 6.296 1.00 0.00 N ATOM 143 CA SER A 10 -1.748 -5.039 5.917 1.00 0.00 C ATOM 144 C SER A 10 -2.211 -6.120 6.898 1.00 0.00 C ATOM 145 O SER A 10 -3.394 -6.190 7.236 1.00 0.00 O ATOM 146 CB SER A 10 -1.681 -5.612 4.498 1.00 0.00 C ATOM 147 OG SER A 10 -2.934 -6.142 4.101 1.00 0.00 O ATOM 148 H SER A 10 0.325 -4.644 5.723 1.00 0.00 H ATOM 149 HA SER A 10 -2.469 -4.237 5.930 1.00 0.00 H ATOM 150 HB2 SER A 10 -1.403 -4.828 3.809 1.00 0.00 H ATOM 151 HB3 SER A 10 -0.943 -6.399 4.464 1.00 0.00 H ATOM 152 HG SER A 10 -3.364 -5.530 3.497 1.00 0.00 H ATOM 153 N ASP A 11 -1.279 -6.966 7.344 1.00 0.00 N ATOM 154 CA ASP A 11 -1.603 -8.051 8.278 1.00 0.00 C ATOM 155 C ASP A 11 -2.080 -7.510 9.623 1.00 0.00 C ATOM 156 O ASP A 11 -3.098 -7.961 10.146 1.00 0.00 O ATOM 157 CB ASP A 11 -0.399 -8.974 8.475 1.00 0.00 C ATOM 158 CG ASP A 11 0.072 -9.572 7.166 1.00 0.00 C ATOM 159 OD1 ASP A 11 -0.664 -10.310 6.511 1.00 0.00 O ATOM 160 H ASP A 11 -0.355 -6.864 7.033 1.00 0.00 H ATOM 161 HA ASP A 11 -2.406 -8.622 7.840 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.414 -8.410 8.909 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.672 -9.777 9.141 1.00 0.00 H ATOM 164 N ARG A 12 -1.347 -6.539 10.174 1.00 0.00 N ATOM 165 CA ARG A 12 -1.714 -5.938 11.459 1.00 0.00 C ATOM 166 C ARG A 12 -3.105 -5.320 11.381 1.00 0.00 C ATOM 167 O ARG A 12 -3.960 -5.572 12.229 1.00 0.00 O ATOM 168 CB ARG A 12 -0.705 -4.863 11.870 1.00 0.00 C ATOM 169 CG ARG A 12 0.664 -5.402 12.253 1.00 0.00 C ATOM 170 CD ARG A 12 1.610 -4.265 12.605 1.00 0.00 C ATOM 171 NE ARG A 12 2.980 -4.723 12.840 1.00 0.00 N ATOM 172 CZ ARG A 12 3.362 -5.475 13.876 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.488 -5.851 14.806 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 4.634 -5.843 13.985 1.00 0.00 N ATOM 175 H ARG A 12 -0.549 -6.218 9.703 1.00 0.00 H ATOM 176 HA ARG A 12 -1.721 -6.721 12.203 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.576 -4.178 11.044 1.00 0.00 H ATOM 178 HB3 ARG A 12 -1.103 -4.318 12.715 1.00 0.00 H ATOM 179 HG2 ARG A 12 0.557 -6.048 13.112 1.00 0.00 H ATOM 180 HG3 ARG A 12 1.072 -5.960 11.425 1.00 0.00 H ATOM 181 HD2 ARG A 12 1.616 -3.559 11.787 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.245 -3.776 13.496 1.00 0.00 H ATOM 183 HE ARG A 12 3.657 -4.454 12.187 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.531 -5.572 14.739 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.790 -6.411 15.577 1.00 0.00 H ATOM 186 HH21 ARG A 12 5.297 -5.556 13.294 1.00 0.00 H ATOM 187 HH22 ARG A 12 4.928 -6.402 14.758 1.00 0.00 H ATOM 188 N LYS A 13 -3.321 -4.515 10.346 1.00 0.00 N ATOM 189 CA LYS A 13 -4.609 -3.861 10.141 1.00 0.00 C ATOM 190 C LYS A 13 -5.733 -4.895 10.172 1.00 0.00 C ATOM 191 O LYS A 13 -6.764 -4.688 10.815 1.00 0.00 O ATOM 192 CB LYS A 13 -4.616 -3.128 8.795 1.00 0.00 C ATOM 193 CG LYS A 13 -5.743 -2.116 8.643 1.00 0.00 C ATOM 194 CD LYS A 13 -5.509 -0.882 9.505 1.00 0.00 C ATOM 195 CE LYS A 13 -6.557 0.194 9.251 1.00 0.00 C ATOM 196 NZ LYS A 13 -7.934 -0.260 9.593 1.00 0.00 N1+ ATOM 197 H LYS A 13 -2.599 -4.364 9.703 1.00 0.00 H ATOM 198 HA LYS A 13 -4.756 -3.149 10.937 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.679 -2.607 8.678 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.711 -3.858 8.004 1.00 0.00 H ATOM 201 HG2 LYS A 13 -5.805 -1.812 7.609 1.00 0.00 H ATOM 202 HG3 LYS A 13 -6.673 -2.579 8.939 1.00 0.00 H ATOM 203 HD2 LYS A 13 -5.547 -1.167 10.546 1.00 0.00 H ATOM 204 HD3 LYS A 13 -4.533 -0.479 9.277 1.00 0.00 H ATOM 205 HE2 LYS A 13 -6.316 1.059 9.849 1.00 0.00 H ATOM 206 HE3 LYS A 13 -6.526 0.465 8.205 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -7.898 -1.008 10.314 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -8.409 -0.631 8.746 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -8.489 0.538 9.964 1.00 0.00 H ATOM 210 N LYS A 14 -5.516 -6.009 9.468 1.00 0.00 N ATOM 211 CA LYS A 14 -6.494 -7.095 9.397 1.00 0.00 C ATOM 212 C LYS A 14 -6.724 -7.730 10.771 1.00 0.00 C ATOM 213 O LYS A 14 -7.862 -7.972 11.166 1.00 0.00 O ATOM 214 CB LYS A 14 -6.023 -8.173 8.406 1.00 0.00 C ATOM 215 CG LYS A 14 -7.027 -8.493 7.302 1.00 0.00 C ATOM 216 CD LYS A 14 -8.410 -8.788 7.865 1.00 0.00 C ATOM 217 CE LYS A 14 -8.387 -9.972 8.828 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.548 -10.032 9.735 1.00 0.00 N1+ ATOM 219 H LYS A 14 -4.670 -6.103 8.983 1.00 0.00 H ATOM 220 HA LYS A 14 -7.425 -6.679 9.046 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.107 -7.841 7.941 1.00 0.00 H ATOM 222 HB3 LYS A 14 -5.824 -9.083 8.954 1.00 0.00 H ATOM 223 HG2 LYS A 14 -7.095 -7.647 6.635 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.680 -9.357 6.754 1.00 0.00 H ATOM 225 HD2 LYS A 14 -8.754 -7.914 8.382 1.00 0.00 H ATOM 226 HD3 LYS A 14 -9.080 -9.012 7.048 1.00 0.00 H ATOM 227 HE2 LYS A 14 -8.361 -10.881 8.246 1.00 0.00 H ATOM 228 HE3 LYS A 14 -7.487 -9.911 9.424 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.765 -10.910 10.115 1.00 0.00 H ATOM 230 N LYS A 15 -5.635 -8.007 11.486 1.00 0.00 N ATOM 231 CA LYS A 15 -5.710 -8.633 12.807 1.00 0.00 C ATOM 232 C LYS A 15 -6.539 -7.809 13.788 1.00 0.00 C ATOM 233 O LYS A 15 -7.351 -8.359 14.530 1.00 0.00 O ATOM 234 CB LYS A 15 -4.306 -8.860 13.376 1.00 0.00 C ATOM 235 CG LYS A 15 -3.520 -9.940 12.649 1.00 0.00 C ATOM 236 CD LYS A 15 -2.157 -10.158 13.289 1.00 0.00 C ATOM 237 CE LYS A 15 -1.394 -11.297 12.624 1.00 0.00 C ATOM 238 NZ LYS A 15 -0.989 -10.971 11.225 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.756 -7.793 11.112 1.00 0.00 H ATOM 240 HA LYS A 15 -6.190 -9.590 12.682 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.750 -7.937 13.308 1.00 0.00 H ATOM 242 HB3 LYS A 15 -4.390 -9.143 14.415 1.00 0.00 H ATOM 243 HG2 LYS A 15 -4.077 -10.864 12.686 1.00 0.00 H ATOM 244 HG3 LYS A 15 -3.384 -9.642 11.622 1.00 0.00 H ATOM 245 HD2 LYS A 15 -1.579 -9.250 13.196 1.00 0.00 H ATOM 246 HD3 LYS A 15 -2.295 -10.392 14.334 1.00 0.00 H ATOM 247 HE2 LYS A 15 -0.507 -11.503 13.204 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.024 -12.175 12.612 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -1.711 -10.374 10.770 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -0.883 -11.846 10.671 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -0.083 -10.462 11.225 1.00 0.00 H ATOM 252 N ASN A 16 -6.325 -6.498 13.797 1.00 0.00 N ATOM 253 CA ASN A 16 -7.054 -5.614 14.707 1.00 0.00 C ATOM 254 C ASN A 16 -8.524 -5.468 14.313 1.00 0.00 C ATOM 255 O ASN A 16 -9.413 -5.558 15.161 1.00 0.00 O ATOM 256 CB ASN A 16 -6.397 -4.233 14.763 1.00 0.00 C ATOM 257 CG ASN A 16 -4.983 -4.285 15.311 1.00 0.00 C ATOM 258 OD1 ASN A 16 -4.756 -4.740 16.432 1.00 0.00 O ATOM 259 ND2 ASN A 16 -4.023 -3.816 14.522 1.00 0.00 N ATOM 260 H ASN A 16 -5.657 -6.119 13.185 1.00 0.00 H ATOM 261 HA ASN A 16 -7.009 -6.055 15.689 1.00 0.00 H ATOM 262 HB2 ASN A 16 -6.362 -3.816 13.768 1.00 0.00 H ATOM 263 HB3 ASN A 16 -6.987 -3.589 15.399 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.275 -3.465 13.642 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.102 -3.839 14.853 1.00 0.00 H ATOM 266 N GLN A 17 -8.767 -5.223 13.027 1.00 0.00 N ATOM 267 CA GLN A 17 -10.124 -5.037 12.509 1.00 0.00 C ATOM 268 C GLN A 17 -10.987 -6.294 12.680 1.00 0.00 C ATOM 269 O GLN A 17 -12.157 -6.202 13.049 1.00 0.00 O ATOM 270 CB GLN A 17 -10.057 -4.641 11.032 1.00 0.00 C ATOM 271 CG GLN A 17 -11.398 -4.253 10.431 1.00 0.00 C ATOM 272 CD GLN A 17 -11.282 -3.842 8.975 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.610 -2.863 8.648 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.933 -4.589 8.090 1.00 0.00 N ATOM 275 H GLN A 17 -8.009 -5.151 12.409 1.00 0.00 H ATOM 276 HA GLN A 17 -10.576 -4.231 13.063 1.00 0.00 H ATOM 277 HB2 GLN A 17 -9.388 -3.800 10.930 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.662 -5.474 10.469 1.00 0.00 H ATOM 279 HG2 GLN A 17 -12.069 -5.097 10.499 1.00 0.00 H ATOM 280 HG3 GLN A 17 -11.804 -3.425 10.991 1.00 0.00 H ATOM 281 HE21 GLN A 17 -12.446 -5.356 8.420 1.00 0.00 H ATOM 282 HE22 GLN A 17 -11.872 -4.343 7.144 1.00 0.00 H ATOM 283 N ASP A 18 -10.404 -7.455 12.388 1.00 0.00 N ATOM 284 CA ASP A 18 -11.116 -8.737 12.481 1.00 0.00 C ATOM 285 C ASP A 18 -10.319 -9.785 13.265 1.00 0.00 C ATOM 286 O ASP A 18 -10.896 -10.601 13.984 1.00 0.00 O ATOM 287 CB ASP A 18 -11.431 -9.264 11.072 1.00 0.00 C ATOM 288 CG ASP A 18 -10.302 -8.983 10.097 1.00 0.00 C ATOM 289 OD1 ASP A 18 -10.104 -7.834 9.708 1.00 0.00 O ATOM 290 H ASP A 18 -9.474 -7.451 12.084 1.00 0.00 H ATOM 291 HA ASP A 18 -12.045 -8.557 12.998 1.00 0.00 H ATOM 292 HB2 ASP A 18 -11.590 -10.330 11.118 1.00 0.00 H ATOM 293 HB3 ASP A 18 -12.326 -8.783 10.707 1.00 0.00 H HETATM 294 N NH2 A 19 -8.995 -9.787 13.117 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.589 -9.114 12.534 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -8.479 -10.466 13.598 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 14 ATOM 1 N PHE A 1 10.705 -9.635 -5.580 1.00 0.00 N ATOM 2 CA PHE A 1 10.550 -8.647 -6.640 1.00 0.00 C ATOM 3 C PHE A 1 11.267 -7.344 -6.244 1.00 0.00 C ATOM 4 O PHE A 1 12.401 -7.393 -5.763 1.00 0.00 O ATOM 5 CB PHE A 1 9.052 -8.426 -6.912 1.00 0.00 C ATOM 6 CG PHE A 1 8.735 -7.785 -8.243 1.00 0.00 C ATOM 7 CD1 PHE A 1 9.340 -8.223 -9.415 1.00 0.00 C ATOM 8 CD2 PHE A 1 7.816 -6.749 -8.319 1.00 0.00 C ATOM 9 CE1 PHE A 1 9.036 -7.635 -10.631 1.00 0.00 C ATOM 10 CE2 PHE A 1 7.509 -6.161 -9.531 1.00 0.00 C ATOM 11 CZ PHE A 1 8.118 -6.605 -10.688 1.00 0.00 C ATOM 12 H1 PHE A 1 10.305 -9.459 -4.702 1.00 0.00 H ATOM 13 HA PHE A 1 11.018 -9.044 -7.530 1.00 0.00 H ATOM 14 HB2 PHE A 1 8.551 -9.381 -6.883 1.00 0.00 H ATOM 15 HB3 PHE A 1 8.646 -7.795 -6.134 1.00 0.00 H ATOM 16 HD1 PHE A 1 10.058 -9.028 -9.372 1.00 0.00 H ATOM 17 HD2 PHE A 1 7.339 -6.398 -7.416 1.00 0.00 H ATOM 18 HE1 PHE A 1 9.513 -7.983 -11.536 1.00 0.00 H ATOM 19 HE2 PHE A 1 6.791 -5.356 -9.572 1.00 0.00 H ATOM 20 HZ PHE A 1 7.876 -6.147 -11.635 1.00 0.00 H ATOM 21 N GLY A 2 10.620 -6.187 -6.431 1.00 0.00 N ATOM 22 CA GLY A 2 11.236 -4.922 -6.068 1.00 0.00 C ATOM 23 C GLY A 2 11.257 -4.702 -4.564 1.00 0.00 C ATOM 24 O GLY A 2 11.632 -5.598 -3.807 1.00 0.00 O ATOM 25 H GLY A 2 9.721 -6.190 -6.808 1.00 0.00 H ATOM 26 HA2 GLY A 2 12.249 -4.904 -6.441 1.00 0.00 H ATOM 27 HA3 GLY A 2 10.680 -4.119 -6.528 1.00 0.00 H ATOM 28 N GLY A 3 10.846 -3.510 -4.136 1.00 0.00 N ATOM 29 CA GLY A 3 10.813 -3.191 -2.718 1.00 0.00 C ATOM 30 C GLY A 3 9.702 -3.926 -1.983 1.00 0.00 C ATOM 31 O GLY A 3 8.610 -4.109 -2.525 1.00 0.00 O ATOM 32 H GLY A 3 10.554 -2.840 -4.789 1.00 0.00 H ATOM 33 HA2 GLY A 3 11.761 -3.461 -2.278 1.00 0.00 H ATOM 34 HA3 GLY A 3 10.665 -2.127 -2.602 1.00 0.00 H ATOM 35 N PHE A 4 9.979 -4.349 -0.746 1.00 0.00 N ATOM 36 CA PHE A 4 8.989 -5.069 0.058 1.00 0.00 C ATOM 37 C PHE A 4 9.208 -4.815 1.551 1.00 0.00 C ATOM 38 O PHE A 4 10.292 -5.074 2.078 1.00 0.00 O ATOM 39 CB PHE A 4 9.060 -6.574 -0.246 1.00 0.00 C ATOM 40 CG PHE A 4 10.393 -7.196 0.084 1.00 0.00 C ATOM 41 CD1 PHE A 4 11.419 -7.197 -0.848 1.00 0.00 C ATOM 42 CD2 PHE A 4 10.621 -7.773 1.325 1.00 0.00 C ATOM 43 CE1 PHE A 4 12.647 -7.756 -0.550 1.00 0.00 C ATOM 44 CE2 PHE A 4 11.847 -8.336 1.628 1.00 0.00 C ATOM 45 CZ PHE A 4 12.861 -8.326 0.690 1.00 0.00 C ATOM 46 H PHE A 4 10.866 -4.173 -0.368 1.00 0.00 H ATOM 47 HA PHE A 4 8.011 -4.702 -0.216 1.00 0.00 H ATOM 48 HB2 PHE A 4 8.303 -7.087 0.326 1.00 0.00 H ATOM 49 HB3 PHE A 4 8.873 -6.730 -1.300 1.00 0.00 H ATOM 50 HD1 PHE A 4 11.253 -6.752 -1.818 1.00 0.00 H ATOM 51 HD2 PHE A 4 9.829 -7.783 2.058 1.00 0.00 H ATOM 52 HE1 PHE A 4 13.438 -7.750 -1.286 1.00 0.00 H ATOM 53 HE2 PHE A 4 12.013 -8.779 2.598 1.00 0.00 H ATOM 54 HZ PHE A 4 13.822 -8.763 0.925 1.00 0.00 H ATOM 55 N THR A 5 8.167 -4.307 2.218 1.00 0.00 N ATOM 56 CA THR A 5 8.218 -4.007 3.656 1.00 0.00 C ATOM 57 C THR A 5 7.054 -3.103 4.079 1.00 0.00 C ATOM 58 O THR A 5 6.518 -3.246 5.178 1.00 0.00 O ATOM 59 CB THR A 5 9.546 -3.331 4.077 1.00 0.00 C ATOM 60 OG1 THR A 5 9.520 -3.028 5.478 1.00 0.00 O ATOM 61 CG2 THR A 5 9.792 -2.053 3.284 1.00 0.00 C ATOM 62 H THR A 5 7.337 -4.127 1.728 1.00 0.00 H ATOM 63 HA THR A 5 8.135 -4.944 4.187 1.00 0.00 H ATOM 64 HB THR A 5 10.359 -4.016 3.885 1.00 0.00 H ATOM 65 HG1 THR A 5 9.658 -3.834 5.983 1.00 0.00 H ATOM 66 HG21 THR A 5 9.459 -2.191 2.266 1.00 0.00 H ATOM 67 HG22 THR A 5 10.847 -1.823 3.290 1.00 0.00 H ATOM 68 HG23 THR A 5 9.244 -1.239 3.737 1.00 0.00 H ATOM 69 N GLY A 6 6.682 -2.166 3.202 1.00 0.00 N ATOM 70 CA GLY A 6 5.599 -1.237 3.493 1.00 0.00 C ATOM 71 C GLY A 6 4.285 -1.924 3.823 1.00 0.00 C ATOM 72 O GLY A 6 3.617 -1.553 4.791 1.00 0.00 O ATOM 73 H GLY A 6 7.157 -2.098 2.348 1.00 0.00 H ATOM 74 HA2 GLY A 6 5.888 -0.625 4.335 1.00 0.00 H ATOM 75 HA3 GLY A 6 5.452 -0.598 2.634 1.00 0.00 H ATOM 76 N LYS A 7 3.912 -2.928 3.021 1.00 0.00 N ATOM 77 CA LYS A 7 2.667 -3.668 3.239 1.00 0.00 C ATOM 78 C LYS A 7 2.858 -4.800 4.267 1.00 0.00 C ATOM 79 O LYS A 7 2.255 -5.868 4.149 1.00 0.00 O ATOM 80 CB LYS A 7 2.154 -4.235 1.903 1.00 0.00 C ATOM 81 CG LYS A 7 0.818 -4.958 2.012 1.00 0.00 C ATOM 82 CD LYS A 7 0.898 -6.357 1.423 1.00 0.00 C ATOM 83 CE LYS A 7 -0.155 -7.274 2.021 1.00 0.00 C ATOM 84 NZ LYS A 7 -0.031 -7.366 3.475 1.00 0.00 N1+ ATOM 85 H LYS A 7 4.488 -3.175 2.269 1.00 0.00 H ATOM 86 HA LYS A 7 1.935 -2.973 3.624 1.00 0.00 H ATOM 87 HB2 LYS A 7 2.042 -3.424 1.199 1.00 0.00 H ATOM 88 HB3 LYS A 7 2.885 -4.932 1.519 1.00 0.00 H ATOM 89 HG2 LYS A 7 0.536 -5.029 3.052 1.00 0.00 H ATOM 90 HG3 LYS A 7 0.070 -4.394 1.473 1.00 0.00 H ATOM 91 HD2 LYS A 7 0.744 -6.296 0.357 1.00 0.00 H ATOM 92 HD3 LYS A 7 1.878 -6.768 1.624 1.00 0.00 H ATOM 93 HE2 LYS A 7 -1.134 -6.890 1.774 1.00 0.00 H ATOM 94 HE3 LYS A 7 -0.038 -8.260 1.595 1.00 0.00 H ATOM 95 HZ1 LYS A 7 0.874 -7.413 3.849 1.00 0.00 H ATOM 96 N ARG A 8 3.688 -4.559 5.285 1.00 0.00 N ATOM 97 CA ARG A 8 3.933 -5.550 6.330 1.00 0.00 C ATOM 98 C ARG A 8 3.028 -5.276 7.525 1.00 0.00 C ATOM 99 O ARG A 8 2.148 -6.076 7.848 1.00 0.00 O ATOM 100 CB ARG A 8 5.408 -5.517 6.753 1.00 0.00 C ATOM 101 CG ARG A 8 5.786 -6.564 7.789 1.00 0.00 C ATOM 102 CD ARG A 8 5.486 -7.975 7.302 1.00 0.00 C ATOM 103 NE ARG A 8 6.216 -8.983 8.071 1.00 0.00 N ATOM 104 CZ ARG A 8 7.540 -9.152 8.010 1.00 0.00 C ATOM 105 NH1 ARG A 8 8.276 -8.441 7.156 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 8.128 -10.049 8.792 1.00 0.00 N ATOM 107 H ARG A 8 4.134 -3.691 5.344 1.00 0.00 H ATOM 108 HA ARG A 8 3.698 -6.524 5.930 1.00 0.00 H ATOM 109 HB2 ARG A 8 6.024 -5.672 5.880 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.628 -4.543 7.166 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.842 -6.483 7.996 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.226 -6.378 8.693 1.00 0.00 H ATOM 113 HD2 ARG A 8 4.427 -8.158 7.403 1.00 0.00 H ATOM 114 HD3 ARG A 8 5.767 -8.054 6.262 1.00 0.00 H ATOM 115 HE ARG A 8 5.696 -9.546 8.683 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.843 -7.770 6.555 1.00 0.00 H ATOM 117 HH12 ARG A 8 9.267 -8.580 7.115 1.00 0.00 H ATOM 118 HH21 ARG A 8 7.581 -10.593 9.429 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.119 -10.179 8.747 1.00 0.00 H ATOM 120 N LYS A 9 3.240 -4.122 8.156 1.00 0.00 N ATOM 121 CA LYS A 9 2.438 -3.706 9.303 1.00 0.00 C ATOM 122 C LYS A 9 0.977 -3.522 8.895 1.00 0.00 C ATOM 123 O LYS A 9 0.067 -3.796 9.677 1.00 0.00 O ATOM 124 CB LYS A 9 2.996 -2.409 9.910 1.00 0.00 C ATOM 125 CG LYS A 9 2.979 -1.209 8.965 1.00 0.00 C ATOM 126 CD LYS A 9 1.628 -0.492 8.952 1.00 0.00 C ATOM 127 CE LYS A 9 1.260 0.065 10.321 1.00 0.00 C ATOM 128 NZ LYS A 9 2.284 1.020 10.835 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.948 -3.529 7.832 1.00 0.00 H ATOM 130 HA LYS A 9 2.491 -4.490 10.044 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.414 -2.158 10.783 1.00 0.00 H ATOM 132 HB3 LYS A 9 4.019 -2.583 10.211 1.00 0.00 H ATOM 133 HG2 LYS A 9 3.739 -0.508 9.274 1.00 0.00 H ATOM 134 HG3 LYS A 9 3.196 -1.553 7.963 1.00 0.00 H ATOM 135 HD2 LYS A 9 1.672 0.324 8.249 1.00 0.00 H ATOM 136 HD3 LYS A 9 0.864 -1.188 8.644 1.00 0.00 H ATOM 137 HE2 LYS A 9 0.314 0.580 10.241 1.00 0.00 H ATOM 138 HE3 LYS A 9 1.161 -0.754 11.018 1.00 0.00 H ATOM 139 HZ1 LYS A 9 1.917 1.519 11.671 1.00 0.00 H ATOM 140 HZ2 LYS A 9 2.520 1.720 10.103 1.00 0.00 H ATOM 141 HZ3 LYS A 9 3.149 0.507 11.104 1.00 0.00 H ATOM 142 N SER A 10 0.763 -3.053 7.661 1.00 0.00 N ATOM 143 CA SER A 10 -0.582 -2.824 7.138 1.00 0.00 C ATOM 144 C SER A 10 -1.409 -4.107 7.157 1.00 0.00 C ATOM 145 O SER A 10 -2.558 -4.102 7.601 1.00 0.00 O ATOM 146 CB SER A 10 -0.513 -2.270 5.711 1.00 0.00 C ATOM 147 OG SER A 10 0.126 -1.004 5.683 1.00 0.00 O ATOM 148 H SER A 10 1.532 -2.851 7.089 1.00 0.00 H ATOM 149 HA SER A 10 -1.063 -2.096 7.772 1.00 0.00 H ATOM 150 HB2 SER A 10 0.047 -2.954 5.089 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.513 -2.164 5.318 1.00 0.00 H ATOM 152 HG SER A 10 0.267 -0.737 4.772 1.00 0.00 H ATOM 153 N ASP A 11 -0.818 -5.202 6.678 1.00 0.00 N ATOM 154 CA ASP A 11 -1.505 -6.493 6.642 1.00 0.00 C ATOM 155 C ASP A 11 -1.716 -7.065 8.040 1.00 0.00 C ATOM 156 O ASP A 11 -2.833 -7.432 8.395 1.00 0.00 O ATOM 157 CB ASP A 11 -0.734 -7.505 5.785 1.00 0.00 C ATOM 158 CG ASP A 11 -1.067 -7.399 4.308 1.00 0.00 C ATOM 159 OD1 ASP A 11 -2.237 -7.363 3.924 1.00 0.00 O ATOM 160 H ASP A 11 0.101 -5.140 6.342 1.00 0.00 H ATOM 161 HA ASP A 11 -2.471 -6.331 6.193 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.325 -7.332 5.904 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.968 -8.504 6.119 1.00 0.00 H ATOM 164 N ARG A 12 -0.643 -7.149 8.823 1.00 0.00 N ATOM 165 CA ARG A 12 -0.722 -7.696 10.179 1.00 0.00 C ATOM 166 C ARG A 12 -1.789 -6.987 11.009 1.00 0.00 C ATOM 167 O ARG A 12 -2.479 -7.612 11.813 1.00 0.00 O ATOM 168 CB ARG A 12 0.633 -7.599 10.884 1.00 0.00 C ATOM 169 CG ARG A 12 1.764 -8.336 10.172 1.00 0.00 C ATOM 170 CD ARG A 12 1.468 -9.823 10.007 1.00 0.00 C ATOM 171 NE ARG A 12 0.584 -10.094 8.870 1.00 0.00 N ATOM 172 CZ ARG A 12 0.150 -11.310 8.531 1.00 0.00 C ATOM 173 NH1 ARG A 12 0.501 -12.376 9.247 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -0.640 -11.459 7.472 1.00 0.00 N ATOM 175 H ARG A 12 0.223 -6.846 8.478 1.00 0.00 H ATOM 176 HA ARG A 12 -0.993 -8.737 10.094 1.00 0.00 H ATOM 177 HB2 ARG A 12 0.907 -6.558 10.965 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.534 -8.013 11.877 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.903 -7.900 9.195 1.00 0.00 H ATOM 180 HG3 ARG A 12 2.671 -8.222 10.749 1.00 0.00 H ATOM 181 HD2 ARG A 12 2.400 -10.347 9.856 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.997 -10.182 10.909 1.00 0.00 H ATOM 183 HE ARG A 12 0.302 -9.331 8.325 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.095 -12.271 10.045 1.00 0.00 H ATOM 185 HH12 ARG A 12 0.172 -13.284 8.986 1.00 0.00 H ATOM 186 HH21 ARG A 12 -0.907 -10.661 6.931 1.00 0.00 H ATOM 187 HH22 ARG A 12 -0.968 -12.369 7.214 1.00 0.00 H ATOM 188 N LYS A 13 -1.915 -5.682 10.815 1.00 0.00 N ATOM 189 CA LYS A 13 -2.897 -4.890 11.554 1.00 0.00 C ATOM 190 C LYS A 13 -4.303 -5.026 10.964 1.00 0.00 C ATOM 191 O LYS A 13 -5.280 -5.157 11.703 1.00 0.00 O ATOM 192 CB LYS A 13 -2.487 -3.411 11.571 1.00 0.00 C ATOM 193 CG LYS A 13 -1.217 -3.126 12.364 1.00 0.00 C ATOM 194 CD LYS A 13 -1.475 -3.099 13.866 1.00 0.00 C ATOM 195 CE LYS A 13 -2.377 -1.933 14.249 1.00 0.00 C ATOM 196 NZ LYS A 13 -2.639 -1.872 15.715 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.335 -5.237 10.161 1.00 0.00 H ATOM 198 HA LYS A 13 -2.912 -5.256 12.567 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.333 -3.080 10.555 1.00 0.00 H ATOM 200 HB3 LYS A 13 -3.292 -2.836 12.006 1.00 0.00 H ATOM 201 HG2 LYS A 13 -0.489 -3.894 12.151 1.00 0.00 H ATOM 202 HG3 LYS A 13 -0.825 -2.166 12.060 1.00 0.00 H ATOM 203 HD2 LYS A 13 -1.951 -4.023 14.158 1.00 0.00 H ATOM 204 HD3 LYS A 13 -0.531 -2.997 14.381 1.00 0.00 H ATOM 205 HE2 LYS A 13 -1.900 -1.014 13.942 1.00 0.00 H ATOM 206 HE3 LYS A 13 -3.318 -2.038 13.728 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -1.744 -1.766 16.236 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -3.111 -2.742 16.033 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -3.254 -1.061 15.934 1.00 0.00 H ATOM 210 N LYS A 14 -4.402 -4.957 9.635 1.00 0.00 N ATOM 211 CA LYS A 14 -5.693 -5.032 8.949 1.00 0.00 C ATOM 212 C LYS A 14 -6.268 -6.452 8.882 1.00 0.00 C ATOM 213 O LYS A 14 -7.410 -6.674 9.287 1.00 0.00 O ATOM 214 CB LYS A 14 -5.577 -4.461 7.531 1.00 0.00 C ATOM 215 CG LYS A 14 -6.910 -4.403 6.805 1.00 0.00 C ATOM 216 CD LYS A 14 -7.893 -3.488 7.522 1.00 0.00 C ATOM 217 CE LYS A 14 -9.331 -3.858 7.201 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.646 -5.226 7.624 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.589 -4.827 9.105 1.00 0.00 H ATOM 220 HA LYS A 14 -6.383 -4.417 9.502 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.173 -3.462 7.584 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.907 -5.084 6.958 1.00 0.00 H ATOM 223 HG2 LYS A 14 -6.748 -4.030 5.804 1.00 0.00 H ATOM 224 HG3 LYS A 14 -7.325 -5.398 6.757 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.739 -3.570 8.587 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.715 -2.469 7.207 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.992 -3.172 7.710 1.00 0.00 H ATOM 228 HE3 LYS A 14 -9.481 -3.778 6.134 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.066 -5.944 7.292 1.00 0.00 H ATOM 230 N LYS A 15 -5.494 -7.400 8.347 1.00 0.00 N ATOM 231 CA LYS A 15 -5.959 -8.787 8.203 1.00 0.00 C ATOM 232 C LYS A 15 -6.392 -9.370 9.543 1.00 0.00 C ATOM 233 O LYS A 15 -7.390 -10.087 9.622 1.00 0.00 O ATOM 234 CB LYS A 15 -4.877 -9.673 7.551 1.00 0.00 C ATOM 235 CG LYS A 15 -3.735 -10.091 8.478 1.00 0.00 C ATOM 236 CD LYS A 15 -4.059 -11.362 9.264 1.00 0.00 C ATOM 237 CE LYS A 15 -3.795 -12.634 8.458 1.00 0.00 C ATOM 238 NZ LYS A 15 -4.620 -12.713 7.219 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.602 -7.160 8.026 1.00 0.00 H ATOM 240 HA LYS A 15 -6.821 -8.767 7.552 1.00 0.00 H ATOM 241 HB2 LYS A 15 -5.348 -10.569 7.180 1.00 0.00 H ATOM 242 HB3 LYS A 15 -4.452 -9.137 6.717 1.00 0.00 H ATOM 243 HG2 LYS A 15 -2.850 -10.266 7.885 1.00 0.00 H ATOM 244 HG3 LYS A 15 -3.544 -9.291 9.178 1.00 0.00 H ATOM 245 HD2 LYS A 15 -3.449 -11.387 10.154 1.00 0.00 H ATOM 246 HD3 LYS A 15 -5.101 -11.340 9.545 1.00 0.00 H ATOM 247 HE2 LYS A 15 -2.751 -12.663 8.185 1.00 0.00 H ATOM 248 HE3 LYS A 15 -4.022 -13.487 9.083 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -5.607 -12.456 7.428 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -4.602 -13.681 6.838 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -4.247 -12.063 6.498 1.00 0.00 H ATOM 252 N ASN A 16 -5.633 -9.059 10.590 1.00 0.00 N ATOM 253 CA ASN A 16 -5.930 -9.555 11.930 1.00 0.00 C ATOM 254 C ASN A 16 -7.144 -8.849 12.542 1.00 0.00 C ATOM 255 O ASN A 16 -7.985 -9.493 13.170 1.00 0.00 O ATOM 256 CB ASN A 16 -4.711 -9.387 12.840 1.00 0.00 C ATOM 257 CG ASN A 16 -4.915 -10.008 14.211 1.00 0.00 C ATOM 258 OD1 ASN A 16 -5.015 -11.228 14.343 1.00 0.00 O ATOM 259 ND2 ASN A 16 -4.991 -9.168 15.239 1.00 0.00 N ATOM 260 H ASN A 16 -4.849 -8.483 10.455 1.00 0.00 H ATOM 261 HA ASN A 16 -6.154 -10.607 11.843 1.00 0.00 H ATOM 262 HB2 ASN A 16 -3.857 -9.860 12.377 1.00 0.00 H ATOM 263 HB3 ASN A 16 -4.506 -8.334 12.967 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.909 -8.209 15.062 1.00 0.00 H ATOM 265 HD22 ASN A 16 -5.125 -9.546 16.133 1.00 0.00 H ATOM 266 N GLN A 17 -7.219 -7.522 12.375 1.00 0.00 N ATOM 267 CA GLN A 17 -8.324 -6.738 12.938 1.00 0.00 C ATOM 268 C GLN A 17 -9.664 -7.079 12.278 1.00 0.00 C ATOM 269 O GLN A 17 -10.630 -7.395 12.974 1.00 0.00 O ATOM 270 CB GLN A 17 -8.042 -5.236 12.824 1.00 0.00 C ATOM 271 CG GLN A 17 -9.049 -4.374 13.573 1.00 0.00 C ATOM 272 CD GLN A 17 -8.697 -2.898 13.542 1.00 0.00 C ATOM 273 OE1 GLN A 17 -8.573 -2.302 12.472 1.00 0.00 O ATOM 274 NE2 GLN A 17 -8.543 -2.298 14.718 1.00 0.00 N ATOM 275 H GLN A 17 -6.511 -7.062 11.879 1.00 0.00 H ATOM 276 HA GLN A 17 -8.393 -6.994 13.984 1.00 0.00 H ATOM 277 HB2 GLN A 17 -7.059 -5.033 13.225 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.061 -4.952 11.782 1.00 0.00 H ATOM 279 HG2 GLN A 17 -10.020 -4.504 13.122 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.085 -4.699 14.602 1.00 0.00 H ATOM 281 HE21 GLN A 17 -8.659 -2.832 15.532 1.00 0.00 H ATOM 282 HE22 GLN A 17 -8.323 -1.344 14.723 1.00 0.00 H ATOM 283 N ASP A 18 -9.720 -7.022 10.942 1.00 0.00 N ATOM 284 CA ASP A 18 -10.956 -7.341 10.217 1.00 0.00 C ATOM 285 C ASP A 18 -11.321 -8.813 10.389 1.00 0.00 C ATOM 286 O ASP A 18 -12.433 -9.144 10.798 1.00 0.00 O ATOM 287 CB ASP A 18 -10.831 -7.030 8.717 1.00 0.00 C ATOM 288 CG ASP A 18 -10.671 -5.550 8.413 1.00 0.00 C ATOM 289 OD1 ASP A 18 -11.465 -4.721 8.860 1.00 0.00 O ATOM 290 H ASP A 18 -8.918 -6.771 10.440 1.00 0.00 H ATOM 291 HA ASP A 18 -11.749 -6.738 10.635 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.973 -7.549 8.322 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.719 -7.385 8.212 1.00 0.00 H HETATM 294 N NH2 A 19 -10.386 -9.701 10.062 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.520 -9.368 9.744 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.602 -10.652 10.152 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 15 ATOM 1 N PHE A 1 6.022 -9.005 -5.632 1.00 0.00 N ATOM 2 CA PHE A 1 7.361 -9.254 -6.156 1.00 0.00 C ATOM 3 C PHE A 1 8.333 -8.154 -5.733 1.00 0.00 C ATOM 4 O PHE A 1 9.452 -8.439 -5.299 1.00 0.00 O ATOM 5 CB PHE A 1 7.329 -9.363 -7.684 1.00 0.00 C ATOM 6 CG PHE A 1 6.533 -10.534 -8.195 1.00 0.00 C ATOM 7 CD1 PHE A 1 5.155 -10.580 -8.039 1.00 0.00 C ATOM 8 CD2 PHE A 1 7.167 -11.593 -8.825 1.00 0.00 C ATOM 9 CE1 PHE A 1 4.426 -11.658 -8.504 1.00 0.00 C ATOM 10 CE2 PHE A 1 6.442 -12.673 -9.292 1.00 0.00 C ATOM 11 CZ PHE A 1 5.071 -12.706 -9.131 1.00 0.00 C ATOM 12 H1 PHE A 1 5.583 -9.692 -5.087 1.00 0.00 H ATOM 13 HA PHE A 1 7.704 -10.194 -5.748 1.00 0.00 H ATOM 14 HB2 PHE A 1 6.890 -8.463 -8.090 1.00 0.00 H ATOM 15 HB3 PHE A 1 8.340 -9.460 -8.052 1.00 0.00 H ATOM 16 HD1 PHE A 1 4.649 -9.760 -7.551 1.00 0.00 H ATOM 17 HD2 PHE A 1 8.238 -11.570 -8.952 1.00 0.00 H ATOM 18 HE1 PHE A 1 3.354 -11.682 -8.376 1.00 0.00 H ATOM 19 HE2 PHE A 1 6.948 -13.492 -9.781 1.00 0.00 H ATOM 20 HZ PHE A 1 4.503 -13.549 -9.495 1.00 0.00 H ATOM 21 N GLY A 2 7.899 -6.896 -5.860 1.00 0.00 N ATOM 22 CA GLY A 2 8.738 -5.767 -5.485 1.00 0.00 C ATOM 23 C GLY A 2 9.097 -5.767 -4.009 1.00 0.00 C ATOM 24 O GLY A 2 8.319 -6.244 -3.180 1.00 0.00 O ATOM 25 H GLY A 2 6.997 -6.734 -6.209 1.00 0.00 H ATOM 26 HA2 GLY A 2 9.649 -5.804 -6.065 1.00 0.00 H ATOM 27 HA3 GLY A 2 8.215 -4.852 -5.718 1.00 0.00 H ATOM 28 N GLY A 3 10.279 -5.239 -3.682 1.00 0.00 N ATOM 29 CA GLY A 3 10.729 -5.191 -2.295 1.00 0.00 C ATOM 30 C GLY A 3 10.027 -4.126 -1.461 1.00 0.00 C ATOM 31 O GLY A 3 10.686 -3.335 -0.784 1.00 0.00 O ATOM 32 H GLY A 3 10.855 -4.880 -4.390 1.00 0.00 H ATOM 33 HA2 GLY A 3 10.551 -6.154 -1.842 1.00 0.00 H ATOM 34 HA3 GLY A 3 11.791 -4.995 -2.285 1.00 0.00 H ATOM 35 N PHE A 4 8.694 -4.112 -1.501 1.00 0.00 N ATOM 36 CA PHE A 4 7.905 -3.148 -0.738 1.00 0.00 C ATOM 37 C PHE A 4 7.345 -3.796 0.532 1.00 0.00 C ATOM 38 O PHE A 4 7.900 -4.780 1.026 1.00 0.00 O ATOM 39 CB PHE A 4 6.779 -2.583 -1.621 1.00 0.00 C ATOM 40 CG PHE A 4 7.267 -1.670 -2.713 1.00 0.00 C ATOM 41 CD1 PHE A 4 8.178 -2.114 -3.661 1.00 0.00 C ATOM 42 CD2 PHE A 4 6.820 -0.361 -2.784 1.00 0.00 C ATOM 43 CE1 PHE A 4 8.631 -1.268 -4.655 1.00 0.00 C ATOM 44 CE2 PHE A 4 7.268 0.488 -3.777 1.00 0.00 C ATOM 45 CZ PHE A 4 8.176 0.034 -4.713 1.00 0.00 C ATOM 46 H PHE A 4 8.227 -4.773 -2.051 1.00 0.00 H ATOM 47 HA PHE A 4 8.555 -2.339 -0.446 1.00 0.00 H ATOM 48 HB2 PHE A 4 6.252 -3.401 -2.086 1.00 0.00 H ATOM 49 HB3 PHE A 4 6.091 -2.023 -1.007 1.00 0.00 H ATOM 50 HD1 PHE A 4 8.535 -3.132 -3.619 1.00 0.00 H ATOM 51 HD2 PHE A 4 6.110 -0.003 -2.052 1.00 0.00 H ATOM 52 HE1 PHE A 4 9.341 -1.625 -5.387 1.00 0.00 H ATOM 53 HE2 PHE A 4 6.910 1.507 -3.820 1.00 0.00 H ATOM 54 HZ PHE A 4 8.528 0.697 -5.489 1.00 0.00 H ATOM 55 N THR A 5 6.256 -3.234 1.061 1.00 0.00 N ATOM 56 CA THR A 5 5.624 -3.746 2.278 1.00 0.00 C ATOM 57 C THR A 5 5.416 -5.262 2.222 1.00 0.00 C ATOM 58 O THR A 5 4.745 -5.779 1.327 1.00 0.00 O ATOM 59 CB THR A 5 4.262 -3.059 2.540 1.00 0.00 C ATOM 60 OG1 THR A 5 3.629 -3.634 3.690 1.00 0.00 O ATOM 61 CG2 THR A 5 3.338 -3.186 1.333 1.00 0.00 C ATOM 62 H THR A 5 5.875 -2.446 0.628 1.00 0.00 H ATOM 63 HA THR A 5 6.278 -3.517 3.107 1.00 0.00 H ATOM 64 HB THR A 5 4.438 -2.010 2.727 1.00 0.00 H ATOM 65 HG1 THR A 5 4.293 -3.851 4.350 1.00 0.00 H ATOM 66 HG21 THR A 5 2.979 -2.207 1.050 1.00 0.00 H ATOM 67 HG22 THR A 5 2.498 -3.817 1.586 1.00 0.00 H ATOM 68 HG23 THR A 5 3.881 -3.622 0.507 1.00 0.00 H ATOM 69 N GLY A 6 5.998 -5.961 3.197 1.00 0.00 N ATOM 70 CA GLY A 6 5.876 -7.409 3.266 1.00 0.00 C ATOM 71 C GLY A 6 4.752 -7.849 4.185 1.00 0.00 C ATOM 72 O GLY A 6 3.594 -7.502 3.964 1.00 0.00 O ATOM 73 H GLY A 6 6.516 -5.488 3.881 1.00 0.00 H ATOM 74 HA2 GLY A 6 5.687 -7.792 2.273 1.00 0.00 H ATOM 75 HA3 GLY A 6 6.806 -7.820 3.629 1.00 0.00 H ATOM 76 N LYS A 7 5.106 -8.607 5.225 1.00 0.00 N ATOM 77 CA LYS A 7 4.137 -9.102 6.208 1.00 0.00 C ATOM 78 C LYS A 7 3.392 -7.931 6.876 1.00 0.00 C ATOM 79 O LYS A 7 2.245 -8.073 7.296 1.00 0.00 O ATOM 80 CB LYS A 7 4.872 -9.951 7.265 1.00 0.00 C ATOM 81 CG LYS A 7 4.010 -10.987 7.991 1.00 0.00 C ATOM 82 CD LYS A 7 2.917 -10.353 8.838 1.00 0.00 C ATOM 83 CE LYS A 7 3.485 -9.388 9.872 1.00 0.00 C ATOM 84 NZ LYS A 7 2.541 -8.317 10.184 1.00 0.00 N1+ ATOM 85 H LYS A 7 6.053 -8.835 5.339 1.00 0.00 H ATOM 86 HA LYS A 7 3.422 -9.722 5.689 1.00 0.00 H ATOM 87 HB2 LYS A 7 5.678 -10.480 6.778 1.00 0.00 H ATOM 88 HB3 LYS A 7 5.294 -9.287 8.005 1.00 0.00 H ATOM 89 HG2 LYS A 7 3.547 -11.628 7.257 1.00 0.00 H ATOM 90 HG3 LYS A 7 4.648 -11.579 8.632 1.00 0.00 H ATOM 91 HD2 LYS A 7 2.237 -9.824 8.197 1.00 0.00 H ATOM 92 HD3 LYS A 7 2.384 -11.138 9.355 1.00 0.00 H ATOM 93 HE2 LYS A 7 3.705 -9.936 10.776 1.00 0.00 H ATOM 94 HE3 LYS A 7 4.393 -8.953 9.484 1.00 0.00 H ATOM 95 HZ1 LYS A 7 2.751 -7.421 9.846 1.00 0.00 H ATOM 96 N ARG A 8 4.058 -6.772 6.960 1.00 0.00 N ATOM 97 CA ARG A 8 3.485 -5.567 7.571 1.00 0.00 C ATOM 98 C ARG A 8 2.047 -5.307 7.120 1.00 0.00 C ATOM 99 O ARG A 8 1.208 -4.896 7.922 1.00 0.00 O ATOM 100 CB ARG A 8 4.349 -4.344 7.238 1.00 0.00 C ATOM 101 CG ARG A 8 5.767 -4.416 7.789 1.00 0.00 C ATOM 102 CD ARG A 8 6.810 -4.249 6.687 1.00 0.00 C ATOM 103 NE ARG A 8 6.657 -2.993 5.947 1.00 0.00 N ATOM 104 CZ ARG A 8 6.838 -1.776 6.471 1.00 0.00 C ATOM 105 NH1 ARG A 8 7.206 -1.629 7.742 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 6.664 -0.698 5.713 1.00 0.00 N ATOM 107 H ARG A 8 4.962 -6.722 6.595 1.00 0.00 H ATOM 108 HA ARG A 8 3.488 -5.709 8.639 1.00 0.00 H ATOM 109 HB2 ARG A 8 4.409 -4.246 6.166 1.00 0.00 H ATOM 110 HB3 ARG A 8 3.874 -3.463 7.644 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.899 -3.630 8.517 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.909 -5.376 8.264 1.00 0.00 H ATOM 113 HD2 ARG A 8 7.791 -4.271 7.134 1.00 0.00 H ATOM 114 HD3 ARG A 8 6.715 -5.074 5.997 1.00 0.00 H ATOM 115 HE ARG A 8 6.401 -3.059 5.004 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.352 -2.431 8.320 1.00 0.00 H ATOM 117 HH12 ARG A 8 7.335 -0.712 8.122 1.00 0.00 H ATOM 118 HH21 ARG A 8 6.399 -0.798 4.753 1.00 0.00 H ATOM 119 HH22 ARG A 8 6.797 0.215 6.100 1.00 0.00 H ATOM 120 N LYS A 9 1.773 -5.535 5.837 1.00 0.00 N ATOM 121 CA LYS A 9 0.431 -5.303 5.286 1.00 0.00 C ATOM 122 C LYS A 9 -0.617 -6.228 5.915 1.00 0.00 C ATOM 123 O LYS A 9 -1.734 -5.797 6.205 1.00 0.00 O ATOM 124 CB LYS A 9 0.431 -5.465 3.763 1.00 0.00 C ATOM 125 CG LYS A 9 0.659 -6.891 3.287 1.00 0.00 C ATOM 126 CD LYS A 9 0.801 -6.960 1.775 1.00 0.00 C ATOM 127 CE LYS A 9 -0.453 -6.463 1.063 1.00 0.00 C ATOM 128 NZ LYS A 9 -1.649 -7.290 1.390 1.00 0.00 N1+ ATOM 129 H LYS A 9 2.492 -5.855 5.248 1.00 0.00 H ATOM 130 HA LYS A 9 0.163 -4.285 5.522 1.00 0.00 H ATOM 131 HB2 LYS A 9 -0.523 -5.130 3.381 1.00 0.00 H ATOM 132 HB3 LYS A 9 1.210 -4.841 3.349 1.00 0.00 H ATOM 133 HG2 LYS A 9 1.558 -7.272 3.740 1.00 0.00 H ATOM 134 HG3 LYS A 9 -0.181 -7.499 3.588 1.00 0.00 H ATOM 135 HD2 LYS A 9 1.637 -6.348 1.474 1.00 0.00 H ATOM 136 HD3 LYS A 9 0.983 -7.985 1.489 1.00 0.00 H ATOM 137 HE2 LYS A 9 -0.640 -5.443 1.361 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.282 -6.500 -0.003 1.00 0.00 H ATOM 139 HZ1 LYS A 9 -1.995 -7.055 2.343 1.00 0.00 H ATOM 140 HZ2 LYS A 9 -1.407 -8.301 1.360 1.00 0.00 H ATOM 141 HZ3 LYS A 9 -2.409 -7.107 0.703 1.00 0.00 H ATOM 142 N SER A 10 -0.257 -7.498 6.117 1.00 0.00 N ATOM 143 CA SER A 10 -1.174 -8.476 6.707 1.00 0.00 C ATOM 144 C SER A 10 -1.559 -8.087 8.135 1.00 0.00 C ATOM 145 O SER A 10 -2.738 -8.088 8.491 1.00 0.00 O ATOM 146 CB SER A 10 -0.540 -9.870 6.700 1.00 0.00 C ATOM 147 OG SER A 10 -1.417 -10.835 7.258 1.00 0.00 O ATOM 148 H SER A 10 0.645 -7.783 5.861 1.00 0.00 H ATOM 149 HA SER A 10 -2.067 -8.497 6.101 1.00 0.00 H ATOM 150 HB2 SER A 10 -0.313 -10.154 5.684 1.00 0.00 H ATOM 151 HB3 SER A 10 0.369 -9.851 7.281 1.00 0.00 H ATOM 152 HG SER A 10 -1.857 -11.315 6.553 1.00 0.00 H ATOM 153 N ASP A 11 -0.556 -7.753 8.943 1.00 0.00 N ATOM 154 CA ASP A 11 -0.775 -7.353 10.335 1.00 0.00 C ATOM 155 C ASP A 11 -1.516 -6.016 10.404 1.00 0.00 C ATOM 156 O ASP A 11 -2.284 -5.766 11.334 1.00 0.00 O ATOM 157 CB ASP A 11 0.563 -7.251 11.073 1.00 0.00 C ATOM 158 CG ASP A 11 1.418 -8.490 10.878 1.00 0.00 C ATOM 159 OD1 ASP A 11 1.060 -9.582 11.322 1.00 0.00 O ATOM 160 H ASP A 11 0.360 -7.770 8.593 1.00 0.00 H ATOM 161 HA ASP A 11 -1.380 -8.112 10.807 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.109 -6.395 10.701 1.00 0.00 H ATOM 163 HB3 ASP A 11 0.378 -7.125 12.129 1.00 0.00 H ATOM 164 N ARG A 12 -1.271 -5.161 9.409 1.00 0.00 N ATOM 165 CA ARG A 12 -1.899 -3.844 9.339 1.00 0.00 C ATOM 166 C ARG A 12 -3.417 -3.961 9.223 1.00 0.00 C ATOM 167 O ARG A 12 -4.157 -3.310 9.960 1.00 0.00 O ATOM 168 CB ARG A 12 -1.357 -3.076 8.130 1.00 0.00 C ATOM 169 CG ARG A 12 -1.710 -1.597 8.124 1.00 0.00 C ATOM 170 CD ARG A 12 -0.791 -0.803 9.036 1.00 0.00 C ATOM 171 NE ARG A 12 -1.101 0.626 9.020 1.00 0.00 N ATOM 172 CZ ARG A 12 -0.318 1.564 9.555 1.00 0.00 C ATOM 173 NH1 ARG A 12 0.839 1.237 10.128 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -0.687 2.840 9.508 1.00 0.00 N ATOM 175 H ARG A 12 -0.643 -5.422 8.703 1.00 0.00 H ATOM 176 HA ARG A 12 -1.654 -3.306 10.239 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.281 -3.164 8.115 1.00 0.00 H ATOM 178 HB3 ARG A 12 -1.755 -3.522 7.231 1.00 0.00 H ATOM 179 HG2 ARG A 12 -1.616 -1.219 7.117 1.00 0.00 H ATOM 180 HG3 ARG A 12 -2.728 -1.478 8.462 1.00 0.00 H ATOM 181 HD2 ARG A 12 -0.897 -1.172 10.046 1.00 0.00 H ATOM 182 HD3 ARG A 12 0.229 -0.944 8.708 1.00 0.00 H ATOM 183 HE ARG A 12 -1.940 0.901 8.594 1.00 0.00 H ATOM 184 HH11 ARG A 12 1.130 0.281 10.162 1.00 0.00 H ATOM 185 HH12 ARG A 12 1.420 1.948 10.522 1.00 0.00 H ATOM 186 HH21 ARG A 12 -1.551 3.094 9.074 1.00 0.00 H ATOM 187 HH22 ARG A 12 -0.101 3.545 9.906 1.00 0.00 H ATOM 188 N LYS A 13 -3.872 -4.783 8.282 1.00 0.00 N ATOM 189 CA LYS A 13 -5.305 -4.973 8.057 1.00 0.00 C ATOM 190 C LYS A 13 -5.973 -5.694 9.226 1.00 0.00 C ATOM 191 O LYS A 13 -7.036 -5.273 9.688 1.00 0.00 O ATOM 192 CB LYS A 13 -5.560 -5.733 6.746 1.00 0.00 C ATOM 193 CG LYS A 13 -4.965 -7.136 6.711 1.00 0.00 C ATOM 194 CD LYS A 13 -5.287 -7.855 5.408 1.00 0.00 C ATOM 195 CE LYS A 13 -6.784 -8.080 5.248 1.00 0.00 C ATOM 196 NZ LYS A 13 -7.104 -8.812 3.991 1.00 0.00 N1+ ATOM 197 H LYS A 13 -3.230 -5.264 7.721 1.00 0.00 H ATOM 198 HA LYS A 13 -5.747 -3.992 7.973 1.00 0.00 H ATOM 199 HB2 LYS A 13 -6.626 -5.817 6.597 1.00 0.00 H ATOM 200 HB3 LYS A 13 -5.137 -5.168 5.929 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.892 -7.063 6.811 1.00 0.00 H ATOM 202 HG3 LYS A 13 -5.366 -7.708 7.535 1.00 0.00 H ATOM 203 HD2 LYS A 13 -4.933 -7.258 4.581 1.00 0.00 H ATOM 204 HD3 LYS A 13 -4.786 -8.811 5.404 1.00 0.00 H ATOM 205 HE2 LYS A 13 -7.139 -8.655 6.090 1.00 0.00 H ATOM 206 HE3 LYS A 13 -7.280 -7.120 5.233 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -8.093 -9.134 4.008 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -6.483 -9.640 3.890 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -6.968 -8.188 3.170 1.00 0.00 H ATOM 210 N LYS A 14 -5.356 -6.779 9.703 1.00 0.00 N ATOM 211 CA LYS A 14 -5.918 -7.543 10.819 1.00 0.00 C ATOM 212 C LYS A 14 -6.068 -6.663 12.057 1.00 0.00 C ATOM 213 O LYS A 14 -6.933 -6.913 12.890 1.00 0.00 O ATOM 214 CB LYS A 14 -5.072 -8.787 11.136 1.00 0.00 C ATOM 215 CG LYS A 14 -3.733 -8.501 11.805 1.00 0.00 C ATOM 216 CD LYS A 14 -3.867 -8.183 13.294 1.00 0.00 C ATOM 217 CE LYS A 14 -4.255 -9.405 14.118 1.00 0.00 C ATOM 218 NZ LYS A 14 -5.682 -9.746 14.033 1.00 0.00 N1+ ATOM 219 H LYS A 14 -4.512 -7.069 9.296 1.00 0.00 H ATOM 220 HA LYS A 14 -6.904 -7.868 10.517 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.638 -9.429 11.789 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.878 -9.316 10.213 1.00 0.00 H ATOM 223 HG2 LYS A 14 -3.100 -9.367 11.695 1.00 0.00 H ATOM 224 HG3 LYS A 14 -3.273 -7.659 11.309 1.00 0.00 H ATOM 225 HD2 LYS A 14 -2.920 -7.813 13.655 1.00 0.00 H ATOM 226 HD3 LYS A 14 -4.617 -7.422 13.427 1.00 0.00 H ATOM 227 HE2 LYS A 14 -3.679 -10.248 13.768 1.00 0.00 H ATOM 228 HE3 LYS A 14 -4.005 -9.212 15.151 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -5.956 -10.373 13.331 1.00 0.00 H ATOM 230 N LYS A 15 -5.232 -5.626 12.171 1.00 0.00 N ATOM 231 CA LYS A 15 -5.305 -4.714 13.311 1.00 0.00 C ATOM 232 C LYS A 15 -6.737 -4.217 13.478 1.00 0.00 C ATOM 233 O LYS A 15 -7.273 -4.187 14.585 1.00 0.00 O ATOM 234 CB LYS A 15 -4.361 -3.527 13.108 1.00 0.00 C ATOM 235 CG LYS A 15 -4.357 -2.536 14.264 1.00 0.00 C ATOM 236 CD LYS A 15 -3.606 -1.262 13.903 1.00 0.00 C ATOM 237 CE LYS A 15 -2.160 -1.545 13.517 1.00 0.00 C ATOM 238 NZ LYS A 15 -1.438 -0.303 13.120 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.566 -5.464 11.474 1.00 0.00 H ATOM 240 HA LYS A 15 -5.015 -5.260 14.197 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.356 -3.899 12.980 1.00 0.00 H ATOM 242 HB3 LYS A 15 -4.656 -2.999 12.214 1.00 0.00 H ATOM 243 HG2 LYS A 15 -5.377 -2.283 14.512 1.00 0.00 H ATOM 244 HG3 LYS A 15 -3.881 -2.996 15.118 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.102 -0.790 13.069 1.00 0.00 H ATOM 246 HD3 LYS A 15 -3.620 -0.597 14.754 1.00 0.00 H ATOM 247 HE2 LYS A 15 -1.655 -1.989 14.362 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.150 -2.237 12.689 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -1.955 0.184 12.360 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -0.485 -0.537 12.779 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -1.354 0.340 13.935 1.00 0.00 H ATOM 252 N ASN A 16 -7.346 -3.847 12.353 1.00 0.00 N ATOM 253 CA ASN A 16 -8.724 -3.367 12.335 1.00 0.00 C ATOM 254 C ASN A 16 -9.703 -4.539 12.376 1.00 0.00 C ATOM 255 O ASN A 16 -10.724 -4.482 13.064 1.00 0.00 O ATOM 256 CB ASN A 16 -8.979 -2.517 11.082 1.00 0.00 C ATOM 257 CG ASN A 16 -8.140 -1.242 11.010 1.00 0.00 C ATOM 258 OD1 ASN A 16 -8.189 -0.525 10.010 1.00 0.00 O ATOM 259 ND2 ASN A 16 -7.377 -0.934 12.061 1.00 0.00 N ATOM 260 H ASN A 16 -6.856 -3.914 11.505 1.00 0.00 H ATOM 261 HA ASN A 16 -8.874 -2.758 13.212 1.00 0.00 H ATOM 262 HB2 ASN A 16 -8.756 -3.111 10.209 1.00 0.00 H ATOM 263 HB3 ASN A 16 -10.021 -2.238 11.057 1.00 0.00 H ATOM 264 HD21 ASN A 16 -7.382 -1.529 12.836 1.00 0.00 H ATOM 265 HD22 ASN A 16 -6.838 -0.117 12.013 1.00 0.00 H ATOM 266 N GLN A 17 -9.387 -5.599 11.625 1.00 0.00 N ATOM 267 CA GLN A 17 -10.238 -6.786 11.560 1.00 0.00 C ATOM 268 C GLN A 17 -10.316 -7.495 12.913 1.00 0.00 C ATOM 269 O GLN A 17 -11.389 -7.575 13.514 1.00 0.00 O ATOM 270 CB GLN A 17 -9.718 -7.756 10.491 1.00 0.00 C ATOM 271 CG GLN A 17 -9.642 -7.153 9.094 1.00 0.00 C ATOM 272 CD GLN A 17 -10.989 -6.678 8.577 1.00 0.00 C ATOM 273 OE1 GLN A 17 -11.926 -7.465 8.438 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.091 -5.385 8.289 1.00 0.00 N ATOM 275 H GLN A 17 -8.561 -5.577 11.097 1.00 0.00 H ATOM 276 HA GLN A 17 -11.229 -6.465 11.285 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.728 -8.082 10.771 1.00 0.00 H ATOM 278 HB3 GLN A 17 -10.370 -8.615 10.453 1.00 0.00 H ATOM 279 HG2 GLN A 17 -8.969 -6.310 9.118 1.00 0.00 H ATOM 280 HG3 GLN A 17 -9.257 -7.900 8.415 1.00 0.00 H ATOM 281 HE21 GLN A 17 -10.303 -4.816 8.422 1.00 0.00 H ATOM 282 HE22 GLN A 17 -11.949 -5.052 7.955 1.00 0.00 H ATOM 283 N ASP A 18 -9.178 -8.009 13.387 1.00 0.00 N ATOM 284 CA ASP A 18 -9.130 -8.709 14.669 1.00 0.00 C ATOM 285 C ASP A 18 -8.936 -7.735 15.839 1.00 0.00 C ATOM 286 O ASP A 18 -9.366 -8.008 16.959 1.00 0.00 O ATOM 287 CB ASP A 18 -8.036 -9.799 14.672 1.00 0.00 C ATOM 288 CG ASP A 18 -6.609 -9.290 14.885 1.00 0.00 C ATOM 289 OD1 ASP A 18 -6.335 -8.545 15.828 1.00 0.00 O ATOM 290 H ASP A 18 -8.357 -7.913 12.862 1.00 0.00 H ATOM 291 HA ASP A 18 -10.088 -9.193 14.800 1.00 0.00 H ATOM 292 HB2 ASP A 18 -8.254 -10.501 15.460 1.00 0.00 H ATOM 293 HB3 ASP A 18 -8.070 -10.320 13.725 1.00 0.00 H HETATM 294 N NH2 A 19 -8.287 -6.599 15.585 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -7.967 -6.436 14.673 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -8.155 -5.970 16.324 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 16 ATOM 1 N PHE A 1 11.642 -7.446 8.909 1.00 0.00 N ATOM 2 CA PHE A 1 10.794 -8.617 8.699 1.00 0.00 C ATOM 3 C PHE A 1 10.103 -8.576 7.331 1.00 0.00 C ATOM 4 O PHE A 1 9.935 -9.614 6.686 1.00 0.00 O ATOM 5 CB PHE A 1 9.761 -8.744 9.832 1.00 0.00 C ATOM 6 CG PHE A 1 8.979 -7.485 10.108 1.00 0.00 C ATOM 7 CD1 PHE A 1 8.018 -7.027 9.219 1.00 0.00 C ATOM 8 CD2 PHE A 1 9.204 -6.764 11.271 1.00 0.00 C ATOM 9 CE1 PHE A 1 7.302 -5.874 9.482 1.00 0.00 C ATOM 10 CE2 PHE A 1 8.490 -5.612 11.539 1.00 0.00 C ATOM 11 CZ PHE A 1 7.539 -5.167 10.645 1.00 0.00 C ATOM 12 H1 PHE A 1 12.600 -7.508 8.715 1.00 0.00 H ATOM 13 HA PHE A 1 11.438 -9.486 8.725 1.00 0.00 H ATOM 14 HB2 PHE A 1 9.054 -9.519 9.576 1.00 0.00 H ATOM 15 HB3 PHE A 1 10.272 -9.023 10.743 1.00 0.00 H ATOM 16 HD1 PHE A 1 7.830 -7.580 8.310 1.00 0.00 H ATOM 17 HD2 PHE A 1 9.950 -7.110 11.971 1.00 0.00 H ATOM 18 HE1 PHE A 1 6.559 -5.528 8.780 1.00 0.00 H ATOM 19 HE2 PHE A 1 8.676 -5.062 12.450 1.00 0.00 H ATOM 20 HZ PHE A 1 6.980 -4.267 10.853 1.00 0.00 H ATOM 21 N GLY A 2 9.710 -7.377 6.890 1.00 0.00 N ATOM 22 CA GLY A 2 9.048 -7.232 5.603 1.00 0.00 C ATOM 23 C GLY A 2 10.018 -7.283 4.435 1.00 0.00 C ATOM 24 O GLY A 2 11.068 -6.638 4.469 1.00 0.00 O ATOM 25 H GLY A 2 9.872 -6.584 7.443 1.00 0.00 H ATOM 26 HA2 GLY A 2 8.326 -8.027 5.491 1.00 0.00 H ATOM 27 HA3 GLY A 2 8.528 -6.285 5.583 1.00 0.00 H ATOM 28 N GLY A 3 9.661 -8.047 3.400 1.00 0.00 N ATOM 29 CA GLY A 3 10.507 -8.169 2.221 1.00 0.00 C ATOM 30 C GLY A 3 10.360 -6.991 1.275 1.00 0.00 C ATOM 31 O GLY A 3 9.976 -7.165 0.115 1.00 0.00 O ATOM 32 H GLY A 3 8.810 -8.532 3.435 1.00 0.00 H ATOM 33 HA2 GLY A 3 11.538 -8.235 2.538 1.00 0.00 H ATOM 34 HA3 GLY A 3 10.245 -9.076 1.697 1.00 0.00 H ATOM 35 N PHE A 4 10.661 -5.790 1.774 1.00 0.00 N ATOM 36 CA PHE A 4 10.559 -4.563 0.983 1.00 0.00 C ATOM 37 C PHE A 4 9.114 -4.331 0.534 1.00 0.00 C ATOM 38 O PHE A 4 8.850 -4.076 -0.643 1.00 0.00 O ATOM 39 CB PHE A 4 11.494 -4.616 -0.237 1.00 0.00 C ATOM 40 CG PHE A 4 12.931 -4.929 0.098 1.00 0.00 C ATOM 41 CD1 PHE A 4 13.360 -6.243 0.208 1.00 0.00 C ATOM 42 CD2 PHE A 4 13.852 -3.911 0.288 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.676 -6.536 0.505 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.171 -4.199 0.587 1.00 0.00 C ATOM 45 CZ PHE A 4 15.584 -5.513 0.695 1.00 0.00 C ATOM 46 H PHE A 4 10.955 -5.723 2.706 1.00 0.00 H ATOM 47 HA PHE A 4 10.858 -3.739 1.617 1.00 0.00 H ATOM 48 HB2 PHE A 4 11.143 -5.377 -0.918 1.00 0.00 H ATOM 49 HB3 PHE A 4 11.471 -3.658 -0.737 1.00 0.00 H ATOM 50 HD1 PHE A 4 12.651 -7.045 0.057 1.00 0.00 H ATOM 51 HD2 PHE A 4 13.530 -2.883 0.206 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.997 -7.565 0.589 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.879 -3.396 0.733 1.00 0.00 H ATOM 54 HZ PHE A 4 16.613 -5.739 0.929 1.00 0.00 H ATOM 55 N THR A 5 8.177 -4.430 1.484 1.00 0.00 N ATOM 56 CA THR A 5 6.758 -4.241 1.187 1.00 0.00 C ATOM 57 C THR A 5 6.038 -3.519 2.328 1.00 0.00 C ATOM 58 O THR A 5 6.143 -3.912 3.491 1.00 0.00 O ATOM 59 CB THR A 5 6.052 -5.590 0.922 1.00 0.00 C ATOM 60 OG1 THR A 5 6.163 -6.446 2.070 1.00 0.00 O ATOM 61 CG2 THR A 5 6.649 -6.286 -0.295 1.00 0.00 C ATOM 62 H THR A 5 8.448 -4.642 2.403 1.00 0.00 H ATOM 63 HA THR A 5 6.683 -3.640 0.293 1.00 0.00 H ATOM 64 HB THR A 5 5.007 -5.400 0.727 1.00 0.00 H ATOM 65 HG1 THR A 5 7.079 -6.709 2.189 1.00 0.00 H ATOM 66 HG21 THR A 5 7.727 -6.234 -0.247 1.00 0.00 H ATOM 67 HG22 THR A 5 6.305 -5.799 -1.195 1.00 0.00 H ATOM 68 HG23 THR A 5 6.339 -7.321 -0.306 1.00 0.00 H ATOM 69 N GLY A 6 5.306 -2.461 1.975 1.00 0.00 N ATOM 70 CA GLY A 6 4.567 -1.685 2.962 1.00 0.00 C ATOM 71 C GLY A 6 3.290 -2.372 3.417 1.00 0.00 C ATOM 72 O GLY A 6 2.925 -2.296 4.592 1.00 0.00 O ATOM 73 H GLY A 6 5.264 -2.203 1.029 1.00 0.00 H ATOM 74 HA2 GLY A 6 5.198 -1.523 3.822 1.00 0.00 H ATOM 75 HA3 GLY A 6 4.314 -0.728 2.532 1.00 0.00 H ATOM 76 N LYS A 7 2.608 -3.041 2.483 1.00 0.00 N ATOM 77 CA LYS A 7 1.357 -3.746 2.783 1.00 0.00 C ATOM 78 C LYS A 7 1.573 -5.044 3.574 1.00 0.00 C ATOM 79 O LYS A 7 0.672 -5.880 3.639 1.00 0.00 O ATOM 80 CB LYS A 7 0.609 -4.056 1.483 1.00 0.00 C ATOM 81 CG LYS A 7 -0.278 -2.920 0.998 1.00 0.00 C ATOM 82 CD LYS A 7 -1.473 -2.686 1.919 1.00 0.00 C ATOM 83 CE LYS A 7 -2.344 -3.933 2.059 1.00 0.00 C ATOM 84 NZ LYS A 7 -1.921 -4.801 3.165 1.00 0.00 N1+ ATOM 85 H LYS A 7 2.952 -3.059 1.565 1.00 0.00 H ATOM 86 HA LYS A 7 0.747 -3.083 3.377 1.00 0.00 H ATOM 87 HB2 LYS A 7 1.332 -4.270 0.710 1.00 0.00 H ATOM 88 HB3 LYS A 7 -0.009 -4.928 1.632 1.00 0.00 H ATOM 89 HG2 LYS A 7 0.309 -2.015 0.955 1.00 0.00 H ATOM 90 HG3 LYS A 7 -0.639 -3.159 0.009 1.00 0.00 H ATOM 91 HD2 LYS A 7 -1.113 -2.400 2.896 1.00 0.00 H ATOM 92 HD3 LYS A 7 -2.075 -1.886 1.511 1.00 0.00 H ATOM 93 HE2 LYS A 7 -3.365 -3.625 2.228 1.00 0.00 H ATOM 94 HE3 LYS A 7 -2.290 -4.495 1.137 1.00 0.00 H ATOM 95 HZ1 LYS A 7 -0.975 -5.048 3.213 1.00 0.00 H ATOM 96 N ARG A 8 2.745 -5.218 4.188 1.00 0.00 N ATOM 97 CA ARG A 8 3.004 -6.420 4.969 1.00 0.00 C ATOM 98 C ARG A 8 2.679 -6.182 6.436 1.00 0.00 C ATOM 99 O ARG A 8 1.899 -6.919 7.028 1.00 0.00 O ATOM 100 CB ARG A 8 4.457 -6.880 4.808 1.00 0.00 C ATOM 101 CG ARG A 8 4.764 -8.197 5.512 1.00 0.00 C ATOM 102 CD ARG A 8 3.751 -9.282 5.153 1.00 0.00 C ATOM 103 NE ARG A 8 3.638 -9.488 3.709 1.00 0.00 N ATOM 104 CZ ARG A 8 4.590 -10.036 2.948 1.00 0.00 C ATOM 105 NH1 ARG A 8 5.726 -10.467 3.490 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 4.400 -10.159 1.640 1.00 0.00 N ATOM 107 H ARG A 8 3.438 -4.531 4.126 1.00 0.00 H ATOM 108 HA ARG A 8 2.351 -7.194 4.597 1.00 0.00 H ATOM 109 HB2 ARG A 8 4.672 -7.002 3.756 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.109 -6.121 5.215 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.748 -8.527 5.217 1.00 0.00 H ATOM 112 HG3 ARG A 8 4.741 -8.035 6.579 1.00 0.00 H ATOM 113 HD2 ARG A 8 4.062 -10.208 5.613 1.00 0.00 H ATOM 114 HD3 ARG A 8 2.785 -8.996 5.544 1.00 0.00 H ATOM 115 HE ARG A 8 2.809 -9.192 3.279 1.00 0.00 H ATOM 116 HH11 ARG A 8 5.878 -10.383 4.474 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.432 -10.877 2.911 1.00 0.00 H ATOM 118 HH21 ARG A 8 3.547 -9.841 1.226 1.00 0.00 H ATOM 119 HH22 ARG A 8 5.109 -10.571 1.067 1.00 0.00 H ATOM 120 N LYS A 9 3.276 -5.140 7.010 1.00 0.00 N ATOM 121 CA LYS A 9 3.045 -4.797 8.412 1.00 0.00 C ATOM 122 C LYS A 9 1.621 -4.275 8.625 1.00 0.00 C ATOM 123 O LYS A 9 0.900 -4.751 9.508 1.00 0.00 O ATOM 124 CB LYS A 9 4.064 -3.742 8.880 1.00 0.00 C ATOM 125 CG LYS A 9 3.915 -3.328 10.340 1.00 0.00 C ATOM 126 CD LYS A 9 4.109 -4.505 11.285 1.00 0.00 C ATOM 127 CE LYS A 9 3.919 -4.100 12.742 1.00 0.00 C ATOM 128 NZ LYS A 9 2.530 -3.635 13.022 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.884 -4.588 6.476 1.00 0.00 H ATOM 130 HA LYS A 9 3.176 -5.693 8.998 1.00 0.00 H ATOM 131 HB2 LYS A 9 5.060 -4.138 8.743 1.00 0.00 H ATOM 132 HB3 LYS A 9 3.956 -2.858 8.266 1.00 0.00 H ATOM 133 HG2 LYS A 9 4.657 -2.576 10.567 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.928 -2.916 10.488 1.00 0.00 H ATOM 135 HD2 LYS A 9 3.390 -5.272 11.041 1.00 0.00 H ATOM 136 HD3 LYS A 9 5.109 -4.893 11.156 1.00 0.00 H ATOM 137 HE2 LYS A 9 4.135 -4.951 13.369 1.00 0.00 H ATOM 138 HE3 LYS A 9 4.610 -3.301 12.972 1.00 0.00 H ATOM 139 HZ1 LYS A 9 2.074 -3.303 12.146 1.00 0.00 H ATOM 140 HZ2 LYS A 9 2.545 -2.853 13.707 1.00 0.00 H ATOM 141 HZ3 LYS A 9 1.967 -4.414 13.418 1.00 0.00 H ATOM 142 N SER A 10 1.234 -3.288 7.815 1.00 0.00 N ATOM 143 CA SER A 10 -0.093 -2.675 7.908 1.00 0.00 C ATOM 144 C SER A 10 -1.212 -3.715 7.829 1.00 0.00 C ATOM 145 O SER A 10 -2.062 -3.783 8.717 1.00 0.00 O ATOM 146 CB SER A 10 -0.272 -1.624 6.807 1.00 0.00 C ATOM 147 OG SER A 10 -0.094 -2.192 5.519 1.00 0.00 O ATOM 148 H SER A 10 1.863 -2.953 7.143 1.00 0.00 H ATOM 149 HA SER A 10 -0.155 -2.183 8.866 1.00 0.00 H ATOM 150 HB2 SER A 10 -1.265 -1.206 6.867 1.00 0.00 H ATOM 151 HB3 SER A 10 0.457 -0.837 6.941 1.00 0.00 H ATOM 152 HG SER A 10 -0.946 -2.268 5.083 1.00 0.00 H ATOM 153 N ASP A 11 -1.206 -4.520 6.765 1.00 0.00 N ATOM 154 CA ASP A 11 -2.225 -5.555 6.570 1.00 0.00 C ATOM 155 C ASP A 11 -2.131 -6.659 7.624 1.00 0.00 C ATOM 156 O ASP A 11 -3.153 -7.183 8.056 1.00 0.00 O ATOM 157 CB ASP A 11 -2.135 -6.165 5.165 1.00 0.00 C ATOM 158 CG ASP A 11 -2.752 -5.272 4.096 1.00 0.00 C ATOM 159 OD1 ASP A 11 -3.960 -5.017 4.109 1.00 0.00 O ATOM 160 H ASP A 11 -0.501 -4.412 6.094 1.00 0.00 H ATOM 161 HA ASP A 11 -3.187 -5.079 6.672 1.00 0.00 H ATOM 162 HB2 ASP A 11 -1.100 -6.332 4.916 1.00 0.00 H ATOM 163 HB3 ASP A 11 -2.657 -7.111 5.159 1.00 0.00 H ATOM 164 N ARG A 12 -0.912 -7.019 8.033 1.00 0.00 N ATOM 165 CA ARG A 12 -0.729 -8.074 9.036 1.00 0.00 C ATOM 166 C ARG A 12 -1.559 -7.790 10.285 1.00 0.00 C ATOM 167 O ARG A 12 -2.214 -8.682 10.818 1.00 0.00 O ATOM 168 CB ARG A 12 0.745 -8.222 9.430 1.00 0.00 C ATOM 169 CG ARG A 12 1.264 -9.651 9.329 1.00 0.00 C ATOM 170 CD ARG A 12 0.617 -10.562 10.363 1.00 0.00 C ATOM 171 NE ARG A 12 0.921 -11.973 10.121 1.00 0.00 N ATOM 172 CZ ARG A 12 0.436 -12.679 9.094 1.00 0.00 C ATOM 173 NH1 ARG A 12 -0.415 -12.125 8.234 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 0.791 -13.949 8.933 1.00 0.00 N ATOM 175 H ARG A 12 -0.126 -6.576 7.652 1.00 0.00 H ATOM 176 HA ARG A 12 -1.069 -9.002 8.603 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.345 -7.599 8.790 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.865 -7.892 10.450 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.047 -10.033 8.344 1.00 0.00 H ATOM 180 HG3 ARG A 12 2.333 -9.646 9.486 1.00 0.00 H ATOM 181 HD2 ARG A 12 0.980 -10.287 11.342 1.00 0.00 H ATOM 182 HD3 ARG A 12 -0.454 -10.421 10.325 1.00 0.00 H ATOM 183 HE ARG A 12 1.529 -12.417 10.749 1.00 0.00 H ATOM 184 HH11 ARG A 12 -0.698 -11.175 8.348 1.00 0.00 H ATOM 185 HH12 ARG A 12 -0.773 -12.662 7.469 1.00 0.00 H ATOM 186 HH21 ARG A 12 1.424 -14.377 9.578 1.00 0.00 H ATOM 187 HH22 ARG A 12 0.427 -14.478 8.166 1.00 0.00 H ATOM 188 N LYS A 13 -1.522 -6.543 10.751 1.00 0.00 N ATOM 189 CA LYS A 13 -2.269 -6.157 11.946 1.00 0.00 C ATOM 190 C LYS A 13 -3.733 -5.828 11.625 1.00 0.00 C ATOM 191 O LYS A 13 -4.626 -6.146 12.413 1.00 0.00 O ATOM 192 CB LYS A 13 -1.592 -4.969 12.637 1.00 0.00 C ATOM 193 CG LYS A 13 -1.861 -4.915 14.132 1.00 0.00 C ATOM 194 CD LYS A 13 -0.995 -3.874 14.821 1.00 0.00 C ATOM 195 CE LYS A 13 -0.986 -4.056 16.336 1.00 0.00 C ATOM 196 NZ LYS A 13 -0.416 -5.375 16.750 1.00 0.00 N1+ ATOM 197 H LYS A 13 -0.976 -5.873 10.287 1.00 0.00 H ATOM 198 HA LYS A 13 -2.253 -6.999 12.619 1.00 0.00 H ATOM 199 HB2 LYS A 13 -0.526 -5.035 12.486 1.00 0.00 H ATOM 200 HB3 LYS A 13 -1.956 -4.052 12.196 1.00 0.00 H ATOM 201 HG2 LYS A 13 -2.900 -4.666 14.294 1.00 0.00 H ATOM 202 HG3 LYS A 13 -1.652 -5.885 14.557 1.00 0.00 H ATOM 203 HD2 LYS A 13 0.016 -3.959 14.453 1.00 0.00 H ATOM 204 HD3 LYS A 13 -1.381 -2.892 14.589 1.00 0.00 H ATOM 205 HE2 LYS A 13 -0.394 -3.268 16.774 1.00 0.00 H ATOM 206 HE3 LYS A 13 -2.001 -3.983 16.699 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -0.560 -6.083 16.001 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -0.883 -5.709 17.616 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.604 -5.283 16.934 1.00 0.00 H ATOM 210 N LYS A 14 -3.971 -5.177 10.481 1.00 0.00 N ATOM 211 CA LYS A 14 -5.328 -4.788 10.071 1.00 0.00 C ATOM 212 C LYS A 14 -6.197 -5.982 9.673 1.00 0.00 C ATOM 213 O LYS A 14 -7.340 -6.082 10.110 1.00 0.00 O ATOM 214 CB LYS A 14 -5.280 -3.788 8.910 1.00 0.00 C ATOM 215 CG LYS A 14 -5.669 -2.373 9.308 1.00 0.00 C ATOM 216 CD LYS A 14 -7.126 -2.278 9.753 1.00 0.00 C ATOM 217 CE LYS A 14 -8.094 -2.614 8.626 1.00 0.00 C ATOM 218 NZ LYS A 14 -8.657 -3.961 8.747 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.216 -4.941 9.903 1.00 0.00 H ATOM 220 HA LYS A 14 -5.791 -4.304 10.914 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.276 -3.763 8.515 1.00 0.00 H ATOM 222 HB3 LYS A 14 -5.953 -4.120 8.133 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.037 -2.053 10.122 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.520 -1.720 8.460 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.286 -2.968 10.567 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.321 -1.271 10.092 1.00 0.00 H ATOM 227 HE2 LYS A 14 -8.901 -1.898 8.639 1.00 0.00 H ATOM 228 HE3 LYS A 14 -7.569 -2.539 7.685 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -8.084 -4.716 8.497 1.00 0.00 H ATOM 230 N LYS A 15 -5.669 -6.870 8.833 1.00 0.00 N ATOM 231 CA LYS A 15 -6.426 -8.039 8.372 1.00 0.00 C ATOM 232 C LYS A 15 -6.969 -8.848 9.543 1.00 0.00 C ATOM 233 O LYS A 15 -8.118 -9.290 9.518 1.00 0.00 O ATOM 234 CB LYS A 15 -5.568 -8.926 7.468 1.00 0.00 C ATOM 235 CG LYS A 15 -5.223 -8.275 6.139 1.00 0.00 C ATOM 236 CD LYS A 15 -4.349 -9.171 5.275 1.00 0.00 C ATOM 237 CE LYS A 15 -5.031 -10.492 4.952 1.00 0.00 C ATOM 238 NZ LYS A 15 -4.209 -11.326 4.030 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.757 -6.733 8.509 1.00 0.00 H ATOM 240 HA LYS A 15 -7.261 -7.671 7.798 1.00 0.00 H ATOM 241 HB2 LYS A 15 -4.647 -9.166 7.980 1.00 0.00 H ATOM 242 HB3 LYS A 15 -6.107 -9.840 7.266 1.00 0.00 H ATOM 243 HG2 LYS A 15 -6.138 -8.062 5.608 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.696 -7.350 6.330 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.133 -8.658 4.350 1.00 0.00 H ATOM 246 HD3 LYS A 15 -3.427 -9.371 5.800 1.00 0.00 H ATOM 247 HE2 LYS A 15 -5.188 -11.038 5.870 1.00 0.00 H ATOM 248 HE3 LYS A 15 -5.985 -10.289 4.487 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -3.314 -11.593 4.490 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.994 -10.792 3.164 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -4.726 -12.190 3.773 1.00 0.00 H ATOM 252 N ASN A 16 -6.141 -9.029 10.569 1.00 0.00 N ATOM 253 CA ASN A 16 -6.546 -9.777 11.757 1.00 0.00 C ATOM 254 C ASN A 16 -7.594 -9.015 12.571 1.00 0.00 C ATOM 255 O ASN A 16 -8.562 -9.606 13.049 1.00 0.00 O ATOM 256 CB ASN A 16 -5.333 -10.101 12.634 1.00 0.00 C ATOM 257 CG ASN A 16 -4.489 -11.228 12.063 1.00 0.00 C ATOM 258 OD1 ASN A 16 -4.986 -12.332 11.824 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.203 -10.966 11.853 1.00 0.00 N ATOM 260 H ASN A 16 -5.239 -8.641 10.527 1.00 0.00 H ATOM 261 HA ASN A 16 -6.985 -10.704 11.421 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.713 -9.219 12.720 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.672 -10.392 13.617 1.00 0.00 H ATOM 264 HD21 ASN A 16 -2.866 -10.070 12.072 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.642 -11.679 11.484 1.00 0.00 H ATOM 266 N GLN A 17 -7.391 -7.706 12.729 1.00 0.00 N ATOM 267 CA GLN A 17 -8.319 -6.869 13.491 1.00 0.00 C ATOM 268 C GLN A 17 -9.645 -6.694 12.744 1.00 0.00 C ATOM 269 O GLN A 17 -10.718 -6.889 13.316 1.00 0.00 O ATOM 270 CB GLN A 17 -7.694 -5.496 13.767 1.00 0.00 C ATOM 271 CG GLN A 17 -7.989 -4.940 15.155 1.00 0.00 C ATOM 272 CD GLN A 17 -9.467 -4.955 15.505 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.287 -4.345 14.818 1.00 0.00 O ATOM 274 NE2 GLN A 17 -9.815 -5.650 16.585 1.00 0.00 N ATOM 275 H GLN A 17 -6.598 -7.295 12.327 1.00 0.00 H ATOM 276 HA GLN A 17 -8.512 -7.363 14.430 1.00 0.00 H ATOM 277 HB2 GLN A 17 -6.622 -5.576 13.659 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.065 -4.793 13.037 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.457 -5.533 15.886 1.00 0.00 H ATOM 280 HG3 GLN A 17 -7.636 -3.920 15.198 1.00 0.00 H ATOM 281 HE21 GLN A 17 -9.110 -6.108 17.090 1.00 0.00 H ATOM 282 HE22 GLN A 17 -10.762 -5.676 16.833 1.00 0.00 H ATOM 283 N ASP A 18 -9.556 -6.329 11.462 1.00 0.00 N ATOM 284 CA ASP A 18 -10.739 -6.125 10.622 1.00 0.00 C ATOM 285 C ASP A 18 -11.583 -7.398 10.528 1.00 0.00 C ATOM 286 O ASP A 18 -12.747 -7.411 10.928 1.00 0.00 O ATOM 287 CB ASP A 18 -10.331 -5.666 9.214 1.00 0.00 C ATOM 288 CG ASP A 18 -9.903 -4.206 9.163 1.00 0.00 C ATOM 289 OD1 ASP A 18 -10.688 -3.311 9.480 1.00 0.00 O ATOM 290 H ASP A 18 -8.668 -6.195 11.071 1.00 0.00 H ATOM 291 HA ASP A 18 -11.336 -5.351 11.081 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.506 -6.273 8.869 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.168 -5.797 8.545 1.00 0.00 H HETATM 294 N NH2 A 19 -11.000 -8.470 9.998 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -10.069 -8.394 9.699 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -11.525 -9.294 9.929 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 17 ATOM 1 N PHE A 1 16.939 -0.544 -4.287 1.00 0.00 N ATOM 2 CA PHE A 1 15.845 -1.388 -4.763 1.00 0.00 C ATOM 3 C PHE A 1 14.482 -0.715 -4.544 1.00 0.00 C ATOM 4 O PHE A 1 14.412 0.495 -4.317 1.00 0.00 O ATOM 5 CB PHE A 1 15.905 -2.764 -4.073 1.00 0.00 C ATOM 6 CG PHE A 1 16.094 -2.708 -2.575 1.00 0.00 C ATOM 7 CD1 PHE A 1 15.317 -1.876 -1.781 1.00 0.00 C ATOM 8 CD2 PHE A 1 17.056 -3.499 -1.964 1.00 0.00 C ATOM 9 CE1 PHE A 1 15.498 -1.834 -0.411 1.00 0.00 C ATOM 10 CE2 PHE A 1 17.240 -3.460 -0.595 1.00 0.00 C ATOM 11 CZ PHE A 1 16.460 -2.627 0.182 1.00 0.00 C ATOM 12 H1 PHE A 1 16.883 -0.140 -3.396 1.00 0.00 H ATOM 13 HA PHE A 1 15.989 -1.530 -5.824 1.00 0.00 H ATOM 14 HB2 PHE A 1 14.988 -3.296 -4.269 1.00 0.00 H ATOM 15 HB3 PHE A 1 16.731 -3.324 -4.489 1.00 0.00 H ATOM 16 HD1 PHE A 1 14.563 -1.254 -2.243 1.00 0.00 H ATOM 17 HD2 PHE A 1 17.668 -4.151 -2.571 1.00 0.00 H ATOM 18 HE1 PHE A 1 14.887 -1.181 0.195 1.00 0.00 H ATOM 19 HE2 PHE A 1 17.993 -4.082 -0.133 1.00 0.00 H ATOM 20 HZ PHE A 1 16.603 -2.596 1.252 1.00 0.00 H ATOM 21 N GLY A 2 13.399 -1.501 -4.625 1.00 0.00 N ATOM 22 CA GLY A 2 12.060 -0.957 -4.446 1.00 0.00 C ATOM 23 C GLY A 2 11.828 -0.377 -3.061 1.00 0.00 C ATOM 24 O GLY A 2 12.144 -1.012 -2.053 1.00 0.00 O ATOM 25 H GLY A 2 13.510 -2.455 -4.819 1.00 0.00 H ATOM 26 HA2 GLY A 2 11.900 -0.180 -5.178 1.00 0.00 H ATOM 27 HA3 GLY A 2 11.341 -1.744 -4.617 1.00 0.00 H ATOM 28 N GLY A 3 11.267 0.836 -3.020 1.00 0.00 N ATOM 29 CA GLY A 3 10.988 1.499 -1.755 1.00 0.00 C ATOM 30 C GLY A 3 9.920 0.787 -0.941 1.00 0.00 C ATOM 31 O GLY A 3 10.096 0.567 0.258 1.00 0.00 O ATOM 32 H GLY A 3 11.037 1.284 -3.860 1.00 0.00 H ATOM 33 HA2 GLY A 3 11.898 1.541 -1.175 1.00 0.00 H ATOM 34 HA3 GLY A 3 10.658 2.508 -1.958 1.00 0.00 H ATOM 35 N PHE A 4 8.810 0.425 -1.595 1.00 0.00 N ATOM 36 CA PHE A 4 7.708 -0.269 -0.926 1.00 0.00 C ATOM 37 C PHE A 4 8.168 -1.629 -0.396 1.00 0.00 C ATOM 38 O PHE A 4 8.799 -2.405 -1.117 1.00 0.00 O ATOM 39 CB PHE A 4 6.528 -0.449 -1.891 1.00 0.00 C ATOM 40 CG PHE A 4 5.287 -1.007 -1.248 1.00 0.00 C ATOM 41 CD1 PHE A 4 4.786 -0.455 -0.079 1.00 0.00 C ATOM 42 CD2 PHE A 4 4.623 -2.084 -1.813 1.00 0.00 C ATOM 43 CE1 PHE A 4 3.648 -0.967 0.513 1.00 0.00 C ATOM 44 CE2 PHE A 4 3.484 -2.600 -1.225 1.00 0.00 C ATOM 45 CZ PHE A 4 2.996 -2.041 -0.061 1.00 0.00 C ATOM 46 H PHE A 4 8.733 0.630 -2.551 1.00 0.00 H ATOM 47 HA PHE A 4 7.391 0.339 -0.092 1.00 0.00 H ATOM 48 HB2 PHE A 4 6.273 0.509 -2.318 1.00 0.00 H ATOM 49 HB3 PHE A 4 6.822 -1.121 -2.685 1.00 0.00 H ATOM 50 HD1 PHE A 4 5.295 0.387 0.370 1.00 0.00 H ATOM 51 HD2 PHE A 4 5.003 -2.521 -2.725 1.00 0.00 H ATOM 52 HE1 PHE A 4 3.269 -0.528 1.423 1.00 0.00 H ATOM 53 HE2 PHE A 4 2.976 -3.440 -1.676 1.00 0.00 H ATOM 54 HZ PHE A 4 2.107 -2.443 0.401 1.00 0.00 H ATOM 55 N THR A 5 7.851 -1.906 0.870 1.00 0.00 N ATOM 56 CA THR A 5 8.233 -3.168 1.506 1.00 0.00 C ATOM 57 C THR A 5 7.687 -3.274 2.933 1.00 0.00 C ATOM 58 O THR A 5 7.256 -4.348 3.353 1.00 0.00 O ATOM 59 CB THR A 5 9.768 -3.355 1.531 1.00 0.00 C ATOM 60 OG1 THR A 5 10.105 -4.588 2.176 1.00 0.00 O ATOM 61 CG2 THR A 5 10.456 -2.202 2.248 1.00 0.00 C ATOM 62 H THR A 5 7.349 -1.243 1.389 1.00 0.00 H ATOM 63 HA THR A 5 7.810 -3.968 0.918 1.00 0.00 H ATOM 64 HB THR A 5 10.127 -3.385 0.511 1.00 0.00 H ATOM 65 HG1 THR A 5 9.999 -5.312 1.557 1.00 0.00 H ATOM 66 HG21 THR A 5 11.518 -2.243 2.059 1.00 0.00 H ATOM 67 HG22 THR A 5 10.276 -2.281 3.310 1.00 0.00 H ATOM 68 HG23 THR A 5 10.061 -1.265 1.886 1.00 0.00 H ATOM 69 N GLY A 6 7.716 -2.161 3.674 1.00 0.00 N ATOM 70 CA GLY A 6 7.228 -2.153 5.048 1.00 0.00 C ATOM 71 C GLY A 6 5.709 -2.117 5.152 1.00 0.00 C ATOM 72 O GLY A 6 5.156 -1.288 5.876 1.00 0.00 O ATOM 73 H GLY A 6 8.078 -1.339 3.285 1.00 0.00 H ATOM 74 HA2 GLY A 6 7.585 -3.041 5.547 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.629 -1.288 5.551 1.00 0.00 H ATOM 76 N LYS A 7 5.034 -3.019 4.438 1.00 0.00 N ATOM 77 CA LYS A 7 3.571 -3.091 4.463 1.00 0.00 C ATOM 78 C LYS A 7 3.068 -4.038 5.562 1.00 0.00 C ATOM 79 O LYS A 7 1.868 -4.090 5.835 1.00 0.00 O ATOM 80 CB LYS A 7 3.036 -3.572 3.114 1.00 0.00 C ATOM 81 CG LYS A 7 3.422 -5.010 2.791 1.00 0.00 C ATOM 82 CD LYS A 7 2.442 -5.656 1.821 1.00 0.00 C ATOM 83 CE LYS A 7 1.003 -5.571 2.319 1.00 0.00 C ATOM 84 NZ LYS A 7 0.846 -6.064 3.691 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.529 -3.659 3.889 1.00 0.00 H ATOM 86 HA LYS A 7 3.194 -2.099 4.658 1.00 0.00 H ATOM 87 HB2 LYS A 7 1.960 -3.500 3.120 1.00 0.00 H ATOM 88 HB3 LYS A 7 3.428 -2.933 2.336 1.00 0.00 H ATOM 89 HG2 LYS A 7 4.405 -5.015 2.346 1.00 0.00 H ATOM 90 HG3 LYS A 7 3.439 -5.581 3.706 1.00 0.00 H ATOM 91 HD2 LYS A 7 2.510 -5.153 0.869 1.00 0.00 H ATOM 92 HD3 LYS A 7 2.709 -6.696 1.700 1.00 0.00 H ATOM 93 HE2 LYS A 7 0.685 -4.539 2.280 1.00 0.00 H ATOM 94 HE3 LYS A 7 0.378 -6.160 1.663 1.00 0.00 H ATOM 95 HZ1 LYS A 7 1.642 -6.082 4.264 1.00 0.00 H ATOM 96 N ARG A 8 3.986 -4.798 6.169 1.00 0.00 N ATOM 97 CA ARG A 8 3.632 -5.759 7.212 1.00 0.00 C ATOM 98 C ARG A 8 2.814 -5.108 8.326 1.00 0.00 C ATOM 99 O ARG A 8 1.906 -5.727 8.872 1.00 0.00 O ATOM 100 CB ARG A 8 4.882 -6.449 7.791 1.00 0.00 C ATOM 101 CG ARG A 8 5.935 -5.501 8.355 1.00 0.00 C ATOM 102 CD ARG A 8 7.016 -5.135 7.334 1.00 0.00 C ATOM 103 NE ARG A 8 7.860 -6.277 6.962 1.00 0.00 N ATOM 104 CZ ARG A 8 7.608 -7.120 5.952 1.00 0.00 C ATOM 105 NH1 ARG A 8 6.575 -6.924 5.136 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 8.419 -8.150 5.737 1.00 0.00 N ATOM 107 H ARG A 8 4.916 -4.720 5.900 1.00 0.00 H ATOM 108 HA ARG A 8 3.015 -6.513 6.747 1.00 0.00 H ATOM 109 HB2 ARG A 8 4.573 -7.111 8.587 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.343 -7.038 7.012 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.447 -4.594 8.679 1.00 0.00 H ATOM 112 HG3 ARG A 8 6.405 -5.974 9.204 1.00 0.00 H ATOM 113 HD2 ARG A 8 6.544 -4.750 6.447 1.00 0.00 H ATOM 114 HD3 ARG A 8 7.643 -4.367 7.762 1.00 0.00 H ATOM 115 HE ARG A 8 8.657 -6.437 7.510 1.00 0.00 H ATOM 116 HH11 ARG A 8 5.975 -6.142 5.265 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.401 -7.566 4.390 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.214 -8.292 6.326 1.00 0.00 H ATOM 119 HH22 ARG A 8 8.234 -8.785 4.987 1.00 0.00 H ATOM 120 N LYS A 9 3.125 -3.855 8.651 1.00 0.00 N ATOM 121 CA LYS A 9 2.393 -3.135 9.696 1.00 0.00 C ATOM 122 C LYS A 9 0.893 -3.082 9.388 1.00 0.00 C ATOM 123 O LYS A 9 0.062 -3.391 10.246 1.00 0.00 O ATOM 124 CB LYS A 9 2.933 -1.711 9.856 1.00 0.00 C ATOM 125 CG LYS A 9 4.359 -1.643 10.387 1.00 0.00 C ATOM 126 CD LYS A 9 4.811 -0.204 10.593 1.00 0.00 C ATOM 127 CE LYS A 9 4.962 0.534 9.269 1.00 0.00 C ATOM 128 NZ LYS A 9 6.079 -0.011 8.443 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.854 -3.402 8.172 1.00 0.00 H ATOM 130 HA LYS A 9 2.534 -3.668 10.623 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.907 -1.222 8.894 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.292 -1.173 10.539 1.00 0.00 H ATOM 133 HG2 LYS A 9 4.409 -2.165 11.333 1.00 0.00 H ATOM 134 HG3 LYS A 9 5.019 -2.119 9.676 1.00 0.00 H ATOM 135 HD2 LYS A 9 4.076 0.310 11.197 1.00 0.00 H ATOM 136 HD3 LYS A 9 5.762 -0.204 11.105 1.00 0.00 H ATOM 137 HE2 LYS A 9 4.040 0.439 8.715 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.151 1.577 9.473 1.00 0.00 H ATOM 139 HZ1 LYS A 9 6.297 0.643 7.663 1.00 0.00 H ATOM 140 HZ2 LYS A 9 5.814 -0.933 8.043 1.00 0.00 H ATOM 141 HZ3 LYS A 9 6.931 -0.131 9.027 1.00 0.00 H ATOM 142 N SER A 10 0.558 -2.685 8.160 1.00 0.00 N ATOM 143 CA SER A 10 -0.839 -2.580 7.734 1.00 0.00 C ATOM 144 C SER A 10 -1.475 -3.951 7.511 1.00 0.00 C ATOM 145 O SER A 10 -2.592 -4.198 7.968 1.00 0.00 O ATOM 146 CB SER A 10 -0.948 -1.742 6.459 1.00 0.00 C ATOM 147 OG SER A 10 -0.460 -0.430 6.673 1.00 0.00 O ATOM 148 H SER A 10 1.268 -2.450 7.526 1.00 0.00 H ATOM 149 HA SER A 10 -1.381 -2.081 8.520 1.00 0.00 H ATOM 150 HB2 SER A 10 -0.371 -2.206 5.672 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.984 -1.683 6.158 1.00 0.00 H ATOM 152 HG SER A 10 -0.154 -0.062 5.842 1.00 0.00 H ATOM 153 N ASP A 11 -0.766 -4.836 6.807 1.00 0.00 N ATOM 154 CA ASP A 11 -1.277 -6.180 6.525 1.00 0.00 C ATOM 155 C ASP A 11 -1.560 -6.953 7.812 1.00 0.00 C ATOM 156 O ASP A 11 -2.560 -7.668 7.905 1.00 0.00 O ATOM 157 CB ASP A 11 -0.298 -6.962 5.639 1.00 0.00 C ATOM 158 CG ASP A 11 -0.315 -6.484 4.196 1.00 0.00 C ATOM 159 OD1 ASP A 11 -1.361 -6.498 3.544 1.00 0.00 O ATOM 160 H ASP A 11 0.116 -4.579 6.468 1.00 0.00 H ATOM 161 HA ASP A 11 -2.206 -6.064 5.991 1.00 0.00 H ATOM 162 HB2 ASP A 11 0.702 -6.845 6.028 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.566 -8.008 5.655 1.00 0.00 H ATOM 164 N ARG A 12 -0.683 -6.800 8.804 1.00 0.00 N ATOM 165 CA ARG A 12 -0.848 -7.477 10.088 1.00 0.00 C ATOM 166 C ARG A 12 -2.076 -6.949 10.829 1.00 0.00 C ATOM 167 O ARG A 12 -2.917 -7.730 11.272 1.00 0.00 O ATOM 168 CB ARG A 12 0.411 -7.315 10.940 1.00 0.00 C ATOM 169 CG ARG A 12 1.607 -8.086 10.396 1.00 0.00 C ATOM 170 CD ARG A 12 2.902 -7.745 11.126 1.00 0.00 C ATOM 171 NE ARG A 12 2.816 -7.995 12.565 1.00 0.00 N ATOM 172 CZ ARG A 12 2.300 -7.136 13.449 1.00 0.00 C ATOM 173 NH1 ARG A 12 1.929 -5.915 13.074 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 2.188 -7.491 14.725 1.00 0.00 N ATOM 175 H ARG A 12 0.090 -6.213 8.669 1.00 0.00 H ATOM 176 HA ARG A 12 -0.998 -8.525 9.886 1.00 0.00 H ATOM 177 HB2 ARG A 12 0.670 -6.268 10.981 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.204 -7.668 11.939 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.416 -9.143 10.510 1.00 0.00 H ATOM 180 HG3 ARG A 12 1.724 -7.856 9.348 1.00 0.00 H ATOM 181 HD2 ARG A 12 3.698 -8.346 10.714 1.00 0.00 H ATOM 182 HD3 ARG A 12 3.124 -6.700 10.965 1.00 0.00 H ATOM 183 HE ARG A 12 3.134 -8.865 12.888 1.00 0.00 H ATOM 184 HH11 ARG A 12 2.038 -5.628 12.123 1.00 0.00 H ATOM 185 HH12 ARG A 12 1.541 -5.282 13.744 1.00 0.00 H ATOM 186 HH21 ARG A 12 2.490 -8.396 15.020 1.00 0.00 H ATOM 187 HH22 ARG A 12 1.802 -6.851 15.389 1.00 0.00 H ATOM 188 N LYS A 13 -2.187 -5.620 10.936 1.00 0.00 N ATOM 189 CA LYS A 13 -3.336 -4.996 11.600 1.00 0.00 C ATOM 190 C LYS A 13 -4.634 -5.365 10.887 1.00 0.00 C ATOM 191 O LYS A 13 -5.629 -5.709 11.527 1.00 0.00 O ATOM 192 CB LYS A 13 -3.186 -3.471 11.644 1.00 0.00 C ATOM 193 CG LYS A 13 -2.227 -2.971 12.714 1.00 0.00 C ATOM 194 CD LYS A 13 -2.731 -3.284 14.118 1.00 0.00 C ATOM 195 CE LYS A 13 -4.098 -2.664 14.377 1.00 0.00 C ATOM 196 NZ LYS A 13 -4.565 -2.902 15.771 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.493 -5.050 10.545 1.00 0.00 H ATOM 198 HA LYS A 13 -3.379 -5.373 12.610 1.00 0.00 H ATOM 199 HB2 LYS A 13 -2.825 -3.131 10.684 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.155 -3.032 11.827 1.00 0.00 H ATOM 201 HG2 LYS A 13 -1.269 -3.446 12.573 1.00 0.00 H ATOM 202 HG3 LYS A 13 -2.119 -1.901 12.610 1.00 0.00 H ATOM 203 HD2 LYS A 13 -2.807 -4.354 14.234 1.00 0.00 H ATOM 204 HD3 LYS A 13 -2.027 -2.891 14.837 1.00 0.00 H ATOM 205 HE2 LYS A 13 -4.034 -1.600 14.206 1.00 0.00 H ATOM 206 HE3 LYS A 13 -4.811 -3.096 13.691 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -5.541 -2.564 15.884 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -3.954 -2.395 16.444 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -4.533 -3.918 15.991 1.00 0.00 H ATOM 210 N LYS A 14 -4.608 -5.296 9.555 1.00 0.00 N ATOM 211 CA LYS A 14 -5.773 -5.631 8.742 1.00 0.00 C ATOM 212 C LYS A 14 -6.179 -7.085 8.941 1.00 0.00 C ATOM 213 O LYS A 14 -7.344 -7.376 9.169 1.00 0.00 O ATOM 214 CB LYS A 14 -5.494 -5.348 7.259 1.00 0.00 C ATOM 215 CG LYS A 14 -5.668 -3.887 6.854 1.00 0.00 C ATOM 216 CD LYS A 14 -7.138 -3.493 6.705 1.00 0.00 C ATOM 217 CE LYS A 14 -7.838 -3.347 8.053 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.035 -4.193 8.183 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.780 -5.020 9.110 1.00 0.00 H ATOM 220 HA LYS A 14 -6.586 -5.011 9.068 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.478 -5.638 7.039 1.00 0.00 H ATOM 222 HB3 LYS A 14 -6.163 -5.946 6.659 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.217 -3.262 7.609 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.166 -3.729 5.910 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.190 -2.549 6.186 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.646 -4.247 6.124 1.00 0.00 H ATOM 227 HE2 LYS A 14 -7.146 -3.600 8.834 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.133 -2.314 8.169 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.800 -3.806 8.661 1.00 0.00 H ATOM 230 N LYS A 15 -5.215 -7.992 8.874 1.00 0.00 N ATOM 231 CA LYS A 15 -5.497 -9.411 9.067 1.00 0.00 C ATOM 232 C LYS A 15 -6.138 -9.656 10.437 1.00 0.00 C ATOM 233 O LYS A 15 -7.064 -10.460 10.564 1.00 0.00 O ATOM 234 CB LYS A 15 -4.203 -10.227 8.935 1.00 0.00 C ATOM 235 CG LYS A 15 -4.388 -11.727 9.122 1.00 0.00 C ATOM 236 CD LYS A 15 -5.212 -12.343 8.001 1.00 0.00 C ATOM 237 CE LYS A 15 -4.484 -12.269 6.667 1.00 0.00 C ATOM 238 NZ LYS A 15 -5.297 -12.832 5.549 1.00 0.00 N1+ ATOM 239 H LYS A 15 -4.295 -7.703 8.703 1.00 0.00 H ATOM 240 HA LYS A 15 -6.192 -9.716 8.299 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.787 -10.058 7.953 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.499 -9.879 9.676 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.416 -12.197 9.137 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.887 -11.902 10.063 1.00 0.00 H ATOM 245 HD2 LYS A 15 -5.403 -13.380 8.237 1.00 0.00 H ATOM 246 HD3 LYS A 15 -6.150 -11.813 7.922 1.00 0.00 H ATOM 247 HE2 LYS A 15 -4.260 -11.236 6.449 1.00 0.00 H ATOM 248 HE3 LYS A 15 -3.562 -12.828 6.745 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -4.773 -12.755 4.654 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -6.192 -12.312 5.460 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -5.508 -13.835 5.731 1.00 0.00 H ATOM 252 N ASN A 16 -5.636 -8.947 11.451 1.00 0.00 N ATOM 253 CA ASN A 16 -6.137 -9.071 12.820 1.00 0.00 C ATOM 254 C ASN A 16 -7.611 -8.686 12.918 1.00 0.00 C ATOM 255 O ASN A 16 -8.432 -9.459 13.414 1.00 0.00 O ATOM 256 CB ASN A 16 -5.318 -8.177 13.763 1.00 0.00 C ATOM 257 CG ASN A 16 -3.848 -8.564 13.868 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.028 -7.773 14.335 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.498 -9.782 13.462 1.00 0.00 N ATOM 260 H ASN A 16 -4.906 -8.321 11.274 1.00 0.00 H ATOM 261 HA ASN A 16 -6.026 -10.098 13.124 1.00 0.00 H ATOM 262 HB2 ASN A 16 -5.369 -7.160 13.408 1.00 0.00 H ATOM 263 HB3 ASN A 16 -5.752 -8.225 14.750 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.193 -10.379 13.117 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.555 -10.034 13.526 1.00 0.00 H ATOM 266 N GLN A 17 -7.933 -7.481 12.458 1.00 0.00 N ATOM 267 CA GLN A 17 -9.305 -6.982 12.513 1.00 0.00 C ATOM 268 C GLN A 17 -10.123 -7.416 11.298 1.00 0.00 C ATOM 269 O GLN A 17 -11.135 -8.103 11.441 1.00 0.00 O ATOM 270 CB GLN A 17 -9.303 -5.456 12.642 1.00 0.00 C ATOM 271 CG GLN A 17 -10.689 -4.828 12.572 1.00 0.00 C ATOM 272 CD GLN A 17 -11.668 -5.368 13.612 1.00 0.00 C ATOM 273 OE1 GLN A 17 -12.880 -5.193 13.472 1.00 0.00 O ATOM 274 NE2 GLN A 17 -11.164 -5.999 14.673 1.00 0.00 N ATOM 275 H GLN A 17 -7.226 -6.911 12.087 1.00 0.00 H ATOM 276 HA GLN A 17 -9.765 -7.398 13.395 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.857 -5.187 13.588 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.703 -5.041 11.844 1.00 0.00 H ATOM 279 HG2 GLN A 17 -10.589 -3.765 12.724 1.00 0.00 H ATOM 280 HG3 GLN A 17 -11.097 -5.008 11.588 1.00 0.00 H ATOM 281 HE21 GLN A 17 -10.193 -6.088 14.747 1.00 0.00 H ATOM 282 HE22 GLN A 17 -11.790 -6.352 15.339 1.00 0.00 H ATOM 283 N ASP A 18 -9.681 -7.013 10.111 1.00 0.00 N ATOM 284 CA ASP A 18 -10.373 -7.361 8.869 1.00 0.00 C ATOM 285 C ASP A 18 -9.684 -8.518 8.130 1.00 0.00 C ATOM 286 O ASP A 18 -9.668 -8.558 6.899 1.00 0.00 O ATOM 287 CB ASP A 18 -10.486 -6.128 7.958 1.00 0.00 C ATOM 288 CG ASP A 18 -9.154 -5.440 7.703 1.00 0.00 C ATOM 289 OD1 ASP A 18 -8.260 -6.020 7.090 1.00 0.00 O ATOM 290 H ASP A 18 -8.869 -6.469 10.067 1.00 0.00 H ATOM 291 HA ASP A 18 -11.370 -7.677 9.136 1.00 0.00 H ATOM 292 HB2 ASP A 18 -10.890 -6.434 7.006 1.00 0.00 H ATOM 293 HB3 ASP A 18 -11.155 -5.416 8.415 1.00 0.00 H HETATM 294 N NH2 A 19 -9.128 -9.475 8.876 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.168 -9.395 9.853 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -8.699 -10.226 8.414 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 18 ATOM 1 N PHE A 1 10.751 -4.773 -3.674 1.00 0.00 N ATOM 2 CA PHE A 1 11.718 -5.869 -3.666 1.00 0.00 C ATOM 3 C PHE A 1 12.953 -5.519 -2.835 1.00 0.00 C ATOM 4 O PHE A 1 13.413 -6.336 -2.033 1.00 0.00 O ATOM 5 CB PHE A 1 12.135 -6.234 -5.094 1.00 0.00 C ATOM 6 CG PHE A 1 11.063 -6.933 -5.889 1.00 0.00 C ATOM 7 CD1 PHE A 1 9.803 -6.374 -6.038 1.00 0.00 C ATOM 8 CD2 PHE A 1 11.322 -8.157 -6.487 1.00 0.00 C ATOM 9 CE1 PHE A 1 8.824 -7.019 -6.770 1.00 0.00 C ATOM 10 CE2 PHE A 1 10.346 -8.807 -7.219 1.00 0.00 C ATOM 11 CZ PHE A 1 9.097 -8.238 -7.361 1.00 0.00 C ATOM 12 H1 PHE A 1 10.173 -4.642 -2.894 1.00 0.00 H ATOM 13 HA PHE A 1 11.234 -6.724 -3.217 1.00 0.00 H ATOM 14 HB2 PHE A 1 12.406 -5.334 -5.623 1.00 0.00 H ATOM 15 HB3 PHE A 1 12.995 -6.888 -5.049 1.00 0.00 H ATOM 16 HD1 PHE A 1 9.587 -5.420 -5.578 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.298 -8.604 -6.377 1.00 0.00 H ATOM 18 HE1 PHE A 1 7.847 -6.573 -6.879 1.00 0.00 H ATOM 19 HE2 PHE A 1 10.562 -9.760 -7.681 1.00 0.00 H ATOM 20 HZ PHE A 1 8.334 -8.744 -7.934 1.00 0.00 H ATOM 21 N GLY A 2 13.489 -4.308 -3.026 1.00 0.00 N ATOM 22 CA GLY A 2 14.665 -3.888 -2.275 1.00 0.00 C ATOM 23 C GLY A 2 14.405 -3.829 -0.782 1.00 0.00 C ATOM 24 O GLY A 2 15.024 -4.565 -0.010 1.00 0.00 O ATOM 25 H GLY A 2 13.083 -3.698 -3.677 1.00 0.00 H ATOM 26 HA2 GLY A 2 15.468 -4.584 -2.465 1.00 0.00 H ATOM 27 HA3 GLY A 2 14.964 -2.907 -2.616 1.00 0.00 H ATOM 28 N GLY A 3 13.475 -2.964 -0.376 1.00 0.00 N ATOM 29 CA GLY A 3 13.135 -2.838 1.030 1.00 0.00 C ATOM 30 C GLY A 3 11.967 -3.726 1.416 1.00 0.00 C ATOM 31 O GLY A 3 12.086 -4.567 2.308 1.00 0.00 O ATOM 32 H GLY A 3 13.008 -2.415 -1.040 1.00 0.00 H ATOM 33 HA2 GLY A 3 13.995 -3.112 1.626 1.00 0.00 H ATOM 34 HA3 GLY A 3 12.877 -1.811 1.237 1.00 0.00 H ATOM 35 N PHE A 4 10.838 -3.535 0.730 1.00 0.00 N ATOM 36 CA PHE A 4 9.626 -4.316 0.985 1.00 0.00 C ATOM 37 C PHE A 4 8.478 -3.858 0.082 1.00 0.00 C ATOM 38 O PHE A 4 8.361 -2.672 -0.238 1.00 0.00 O ATOM 39 CB PHE A 4 9.216 -4.226 2.465 1.00 0.00 C ATOM 40 CG PHE A 4 9.277 -2.836 3.046 1.00 0.00 C ATOM 41 CD1 PHE A 4 8.489 -1.812 2.542 1.00 0.00 C ATOM 42 CD2 PHE A 4 10.137 -2.555 4.095 1.00 0.00 C ATOM 43 CE1 PHE A 4 8.559 -0.539 3.072 1.00 0.00 C ATOM 44 CE2 PHE A 4 10.211 -1.284 4.631 1.00 0.00 C ATOM 45 CZ PHE A 4 9.420 -0.274 4.119 1.00 0.00 C ATOM 46 H PHE A 4 10.819 -2.848 0.031 1.00 0.00 H ATOM 47 HA PHE A 4 9.851 -5.345 0.751 1.00 0.00 H ATOM 48 HB2 PHE A 4 8.203 -4.582 2.571 1.00 0.00 H ATOM 49 HB3 PHE A 4 9.873 -4.857 3.048 1.00 0.00 H ATOM 50 HD1 PHE A 4 7.812 -2.017 1.728 1.00 0.00 H ATOM 51 HD2 PHE A 4 10.757 -3.343 4.499 1.00 0.00 H ATOM 52 HE1 PHE A 4 7.940 0.250 2.669 1.00 0.00 H ATOM 53 HE2 PHE A 4 10.884 -1.079 5.449 1.00 0.00 H ATOM 54 HZ PHE A 4 9.477 0.721 4.535 1.00 0.00 H ATOM 55 N THR A 5 7.639 -4.809 -0.332 1.00 0.00 N ATOM 56 CA THR A 5 6.503 -4.503 -1.203 1.00 0.00 C ATOM 57 C THR A 5 5.305 -5.439 -0.949 1.00 0.00 C ATOM 58 O THR A 5 4.378 -5.502 -1.759 1.00 0.00 O ATOM 59 CB THR A 5 6.915 -4.585 -2.693 1.00 0.00 C ATOM 60 OG1 THR A 5 5.818 -4.207 -3.536 1.00 0.00 O ATOM 61 CG2 THR A 5 7.376 -5.989 -3.059 1.00 0.00 C ATOM 62 H THR A 5 7.794 -5.736 -0.052 1.00 0.00 H ATOM 63 HA THR A 5 6.194 -3.489 -0.998 1.00 0.00 H ATOM 64 HB THR A 5 7.734 -3.901 -2.859 1.00 0.00 H ATOM 65 HG1 THR A 5 6.006 -3.360 -3.946 1.00 0.00 H ATOM 66 HG21 THR A 5 7.455 -6.074 -4.133 1.00 0.00 H ATOM 67 HG22 THR A 5 6.661 -6.711 -2.693 1.00 0.00 H ATOM 68 HG23 THR A 5 8.341 -6.179 -2.613 1.00 0.00 H ATOM 69 N GLY A 6 5.322 -6.153 0.183 1.00 0.00 N ATOM 70 CA GLY A 6 4.230 -7.056 0.518 1.00 0.00 C ATOM 71 C GLY A 6 3.216 -6.426 1.459 1.00 0.00 C ATOM 72 O GLY A 6 3.593 -5.756 2.423 1.00 0.00 O ATOM 73 H GLY A 6 6.075 -6.062 0.802 1.00 0.00 H ATOM 74 HA2 GLY A 6 3.726 -7.345 -0.392 1.00 0.00 H ATOM 75 HA3 GLY A 6 4.639 -7.939 0.985 1.00 0.00 H ATOM 76 N LYS A 7 1.925 -6.647 1.187 1.00 0.00 N ATOM 77 CA LYS A 7 0.855 -6.101 2.027 1.00 0.00 C ATOM 78 C LYS A 7 0.547 -7.035 3.209 1.00 0.00 C ATOM 79 O LYS A 7 -0.612 -7.362 3.470 1.00 0.00 O ATOM 80 CB LYS A 7 -0.422 -5.871 1.201 1.00 0.00 C ATOM 81 CG LYS A 7 -1.530 -5.162 1.975 1.00 0.00 C ATOM 82 CD LYS A 7 -2.901 -5.469 1.389 1.00 0.00 C ATOM 83 CE LYS A 7 -4.021 -5.166 2.380 1.00 0.00 C ATOM 84 NZ LYS A 7 -3.806 -5.812 3.681 1.00 0.00 N1+ ATOM 85 H LYS A 7 1.688 -7.196 0.409 1.00 0.00 H ATOM 86 HA LYS A 7 1.195 -5.153 2.416 1.00 0.00 H ATOM 87 HB2 LYS A 7 -0.177 -5.272 0.337 1.00 0.00 H ATOM 88 HB3 LYS A 7 -0.801 -6.827 0.870 1.00 0.00 H ATOM 89 HG2 LYS A 7 -1.506 -5.486 3.003 1.00 0.00 H ATOM 90 HG3 LYS A 7 -1.360 -4.096 1.928 1.00 0.00 H ATOM 91 HD2 LYS A 7 -3.045 -4.865 0.507 1.00 0.00 H ATOM 92 HD3 LYS A 7 -2.942 -6.514 1.121 1.00 0.00 H ATOM 93 HE2 LYS A 7 -4.079 -4.099 2.524 1.00 0.00 H ATOM 94 HE3 LYS A 7 -4.953 -5.521 1.964 1.00 0.00 H ATOM 95 HZ1 LYS A 7 -3.826 -5.238 4.471 1.00 0.00 H ATOM 96 N ARG A 8 1.587 -7.464 3.924 1.00 0.00 N ATOM 97 CA ARG A 8 1.409 -8.351 5.070 1.00 0.00 C ATOM 98 C ARG A 8 1.241 -7.544 6.350 1.00 0.00 C ATOM 99 O ARG A 8 0.441 -7.891 7.218 1.00 0.00 O ATOM 100 CB ARG A 8 2.593 -9.311 5.201 1.00 0.00 C ATOM 101 CG ARG A 8 2.771 -10.223 3.995 1.00 0.00 C ATOM 102 CD ARG A 8 2.912 -11.680 4.409 1.00 0.00 C ATOM 103 NE ARG A 8 4.085 -11.908 5.255 1.00 0.00 N ATOM 104 CZ ARG A 8 4.388 -13.084 5.810 1.00 0.00 C ATOM 105 NH1 ARG A 8 3.610 -14.147 5.614 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 5.474 -13.198 6.564 1.00 0.00 N ATOM 107 H ARG A 8 2.492 -7.176 3.680 1.00 0.00 H ATOM 108 HA ARG A 8 0.510 -8.926 4.903 1.00 0.00 H ATOM 109 HB2 ARG A 8 3.497 -8.733 5.326 1.00 0.00 H ATOM 110 HB3 ARG A 8 2.447 -9.927 6.075 1.00 0.00 H ATOM 111 HG2 ARG A 8 1.909 -10.125 3.350 1.00 0.00 H ATOM 112 HG3 ARG A 8 3.659 -9.922 3.458 1.00 0.00 H ATOM 113 HD2 ARG A 8 2.028 -11.971 4.955 1.00 0.00 H ATOM 114 HD3 ARG A 8 2.999 -12.287 3.521 1.00 0.00 H ATOM 115 HE ARG A 8 4.678 -11.145 5.420 1.00 0.00 H ATOM 116 HH11 ARG A 8 2.788 -14.071 5.049 1.00 0.00 H ATOM 117 HH12 ARG A 8 3.847 -15.023 6.033 1.00 0.00 H ATOM 118 HH21 ARG A 8 6.062 -12.404 6.716 1.00 0.00 H ATOM 119 HH22 ARG A 8 5.704 -14.077 6.981 1.00 0.00 H ATOM 120 N LYS A 9 2.005 -6.464 6.454 1.00 0.00 N ATOM 121 CA LYS A 9 1.952 -5.594 7.623 1.00 0.00 C ATOM 122 C LYS A 9 0.619 -4.848 7.702 1.00 0.00 C ATOM 123 O LYS A 9 0.005 -4.774 8.766 1.00 0.00 O ATOM 124 CB LYS A 9 3.123 -4.597 7.600 1.00 0.00 C ATOM 125 CG LYS A 9 3.159 -3.702 6.366 1.00 0.00 C ATOM 126 CD LYS A 9 4.317 -2.716 6.418 1.00 0.00 C ATOM 127 CE LYS A 9 4.194 -1.760 7.598 1.00 0.00 C ATOM 128 NZ LYS A 9 2.957 -0.931 7.523 1.00 0.00 N1+ ATOM 129 H LYS A 9 2.619 -6.246 5.723 1.00 0.00 H ATOM 130 HA LYS A 9 2.047 -6.220 8.497 1.00 0.00 H ATOM 131 HB2 LYS A 9 3.057 -3.964 8.472 1.00 0.00 H ATOM 132 HB3 LYS A 9 4.049 -5.151 7.640 1.00 0.00 H ATOM 133 HG2 LYS A 9 3.269 -4.321 5.489 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.233 -3.150 6.305 1.00 0.00 H ATOM 135 HD2 LYS A 9 5.241 -3.266 6.511 1.00 0.00 H ATOM 136 HD3 LYS A 9 4.331 -2.142 5.502 1.00 0.00 H ATOM 137 HE2 LYS A 9 4.174 -2.336 8.510 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.055 -1.107 7.604 1.00 0.00 H ATOM 139 HZ1 LYS A 9 3.032 -0.119 8.170 1.00 0.00 H ATOM 140 HZ2 LYS A 9 2.129 -1.498 7.795 1.00 0.00 H ATOM 141 HZ3 LYS A 9 2.818 -0.577 6.554 1.00 0.00 H ATOM 142 N SER A 10 0.182 -4.295 6.571 1.00 0.00 N ATOM 143 CA SER A 10 -1.076 -3.551 6.510 1.00 0.00 C ATOM 144 C SER A 10 -2.276 -4.453 6.797 1.00 0.00 C ATOM 145 O SER A 10 -3.163 -4.090 7.575 1.00 0.00 O ATOM 146 CB SER A 10 -1.236 -2.890 5.136 1.00 0.00 C ATOM 147 OG SER A 10 -0.195 -1.958 4.891 1.00 0.00 O ATOM 148 H SER A 10 0.718 -4.391 5.757 1.00 0.00 H ATOM 149 HA SER A 10 -1.038 -2.781 7.263 1.00 0.00 H ATOM 150 HB2 SER A 10 -1.209 -3.650 4.368 1.00 0.00 H ATOM 151 HB3 SER A 10 -2.183 -2.374 5.096 1.00 0.00 H ATOM 152 HG SER A 10 0.455 -2.351 4.304 1.00 0.00 H ATOM 153 N ASP A 11 -2.300 -5.625 6.165 1.00 0.00 N ATOM 154 CA ASP A 11 -3.395 -6.578 6.352 1.00 0.00 C ATOM 155 C ASP A 11 -3.317 -7.245 7.726 1.00 0.00 C ATOM 156 O ASP A 11 -4.330 -7.404 8.403 1.00 0.00 O ATOM 157 CB ASP A 11 -3.381 -7.656 5.256 1.00 0.00 C ATOM 158 CG ASP A 11 -3.590 -7.126 3.835 1.00 0.00 C ATOM 159 OD1 ASP A 11 -3.559 -7.905 2.882 1.00 0.00 O ATOM 160 H ASP A 11 -1.565 -5.857 5.561 1.00 0.00 H ATOM 161 HA ASP A 11 -4.321 -6.028 6.289 1.00 0.00 H ATOM 162 HB2 ASP A 11 -2.430 -8.165 5.283 1.00 0.00 H ATOM 163 HB3 ASP A 11 -4.163 -8.371 5.468 1.00 0.00 H ATOM 164 N ARG A 12 -2.107 -7.641 8.122 1.00 0.00 N ATOM 165 CA ARG A 12 -1.887 -8.308 9.408 1.00 0.00 C ATOM 166 C ARG A 12 -2.478 -7.516 10.576 1.00 0.00 C ATOM 167 O ARG A 12 -3.206 -8.071 11.399 1.00 0.00 O ATOM 168 CB ARG A 12 -0.389 -8.534 9.633 1.00 0.00 C ATOM 169 CG ARG A 12 -0.060 -9.212 10.954 1.00 0.00 C ATOM 170 CD ARG A 12 -0.789 -10.541 11.094 1.00 0.00 C ATOM 171 NE ARG A 12 -0.354 -11.295 12.270 1.00 0.00 N ATOM 172 CZ ARG A 12 -0.580 -10.923 13.534 1.00 0.00 C ATOM 173 NH1 ARG A 12 -1.258 -9.811 13.808 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -0.132 -11.676 14.533 1.00 0.00 N ATOM 175 H ARG A 12 -1.342 -7.491 7.528 1.00 0.00 H ATOM 176 HA ARG A 12 -2.377 -9.267 9.364 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.007 -9.152 8.834 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.115 -7.580 9.608 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.004 -9.391 11.001 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.354 -8.561 11.764 1.00 0.00 H ATOM 181 HD2 ARG A 12 -1.847 -10.346 11.177 1.00 0.00 H ATOM 182 HD3 ARG A 12 -0.602 -11.131 10.210 1.00 0.00 H ATOM 183 HE ARG A 12 0.141 -12.125 12.110 1.00 0.00 H ATOM 184 HH11 ARG A 12 -1.607 -9.240 13.066 1.00 0.00 H ATOM 185 HH12 ARG A 12 -1.421 -9.547 14.759 1.00 0.00 H ATOM 186 HH21 ARG A 12 0.374 -12.517 14.337 1.00 0.00 H ATOM 187 HH22 ARG A 12 -0.301 -11.405 15.480 1.00 0.00 H ATOM 188 N LYS A 13 -2.158 -6.226 10.651 1.00 0.00 N ATOM 189 CA LYS A 13 -2.660 -5.375 11.731 1.00 0.00 C ATOM 190 C LYS A 13 -4.157 -5.092 11.598 1.00 0.00 C ATOM 191 O LYS A 13 -4.882 -5.113 12.591 1.00 0.00 O ATOM 192 CB LYS A 13 -1.883 -4.056 11.791 1.00 0.00 C ATOM 193 CG LYS A 13 -0.903 -3.978 12.954 1.00 0.00 C ATOM 194 CD LYS A 13 0.211 -5.007 12.826 1.00 0.00 C ATOM 195 CE LYS A 13 1.168 -4.662 11.695 1.00 0.00 C ATOM 196 NZ LYS A 13 2.205 -5.715 11.502 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.570 -5.840 9.969 1.00 0.00 H ATOM 198 HA LYS A 13 -2.500 -5.906 12.656 1.00 0.00 H ATOM 199 HB2 LYS A 13 -1.328 -3.937 10.873 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.585 -3.240 11.885 1.00 0.00 H ATOM 201 HG2 LYS A 13 -0.464 -2.993 12.975 1.00 0.00 H ATOM 202 HG3 LYS A 13 -1.439 -4.154 13.875 1.00 0.00 H ATOM 203 HD2 LYS A 13 0.762 -5.044 13.753 1.00 0.00 H ATOM 204 HD3 LYS A 13 -0.229 -5.974 12.628 1.00 0.00 H ATOM 205 HE2 LYS A 13 0.604 -4.554 10.783 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.656 -3.726 11.926 1.00 0.00 H ATOM 207 HZ1 LYS A 13 2.582 -6.018 12.422 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.987 -5.344 10.925 1.00 0.00 H ATOM 209 HZ3 LYS A 13 1.792 -6.538 11.019 1.00 0.00 H ATOM 210 N LYS A 14 -4.610 -4.806 10.378 1.00 0.00 N ATOM 211 CA LYS A 14 -6.020 -4.492 10.130 1.00 0.00 C ATOM 212 C LYS A 14 -6.940 -5.674 10.444 1.00 0.00 C ATOM 213 O LYS A 14 -7.887 -5.536 11.220 1.00 0.00 O ATOM 214 CB LYS A 14 -6.208 -4.053 8.670 1.00 0.00 C ATOM 215 CG LYS A 14 -7.527 -3.337 8.390 1.00 0.00 C ATOM 216 CD LYS A 14 -8.725 -4.260 8.550 1.00 0.00 C ATOM 217 CE LYS A 14 -9.732 -3.699 9.541 1.00 0.00 C ATOM 218 NZ LYS A 14 -10.350 -4.755 10.340 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.980 -4.789 9.628 1.00 0.00 H ATOM 220 HA LYS A 14 -6.290 -3.670 10.776 1.00 0.00 H ATOM 221 HB2 LYS A 14 -5.402 -3.386 8.404 1.00 0.00 H ATOM 222 HB3 LYS A 14 -6.159 -4.927 8.038 1.00 0.00 H ATOM 223 HG2 LYS A 14 -7.629 -2.513 9.080 1.00 0.00 H ATOM 224 HG3 LYS A 14 -7.508 -2.960 7.378 1.00 0.00 H ATOM 225 HD2 LYS A 14 -9.207 -4.374 7.592 1.00 0.00 H ATOM 226 HD3 LYS A 14 -8.388 -5.224 8.898 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.225 -3.010 10.202 1.00 0.00 H ATOM 228 HE3 LYS A 14 -10.503 -3.173 8.996 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -10.123 -5.681 10.115 1.00 0.00 H ATOM 230 N LYS A 15 -6.670 -6.827 9.832 1.00 0.00 N ATOM 231 CA LYS A 15 -7.495 -8.022 10.038 1.00 0.00 C ATOM 232 C LYS A 15 -7.585 -8.380 11.519 1.00 0.00 C ATOM 233 O LYS A 15 -8.667 -8.690 12.022 1.00 0.00 O ATOM 234 CB LYS A 15 -6.958 -9.208 9.227 1.00 0.00 C ATOM 235 CG LYS A 15 -6.839 -8.918 7.735 1.00 0.00 C ATOM 236 CD LYS A 15 -6.513 -10.170 6.934 1.00 0.00 C ATOM 237 CE LYS A 15 -7.767 -10.979 6.628 1.00 0.00 C ATOM 238 NZ LYS A 15 -8.665 -10.270 5.668 1.00 0.00 N1+ ATOM 239 H LYS A 15 -5.908 -6.874 9.222 1.00 0.00 H ATOM 240 HA LYS A 15 -8.490 -7.788 9.686 1.00 0.00 H ATOM 241 HB2 LYS A 15 -5.980 -9.474 9.601 1.00 0.00 H ATOM 242 HB3 LYS A 15 -7.623 -10.049 9.355 1.00 0.00 H ATOM 243 HG2 LYS A 15 -7.775 -8.516 7.384 1.00 0.00 H ATOM 244 HG3 LYS A 15 -6.058 -8.191 7.581 1.00 0.00 H ATOM 245 HD2 LYS A 15 -6.050 -9.877 6.004 1.00 0.00 H ATOM 246 HD3 LYS A 15 -5.828 -10.783 7.500 1.00 0.00 H ATOM 247 HE2 LYS A 15 -7.474 -11.927 6.200 1.00 0.00 H ATOM 248 HE3 LYS A 15 -8.303 -11.151 7.550 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -9.660 -10.415 5.936 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -8.520 -10.636 4.705 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -8.462 -9.249 5.672 1.00 0.00 H ATOM 252 N ASN A 16 -6.453 -8.308 12.215 1.00 0.00 N ATOM 253 CA ASN A 16 -6.416 -8.601 13.649 1.00 0.00 C ATOM 254 C ASN A 16 -7.130 -7.503 14.442 1.00 0.00 C ATOM 255 O ASN A 16 -7.795 -7.781 15.442 1.00 0.00 O ATOM 256 CB ASN A 16 -4.974 -8.761 14.136 1.00 0.00 C ATOM 257 CG ASN A 16 -4.343 -10.052 13.641 1.00 0.00 C ATOM 258 OD1 ASN A 16 -4.235 -10.285 12.438 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.924 -10.900 14.573 1.00 0.00 N ATOM 260 H ASN A 16 -5.628 -8.035 11.759 1.00 0.00 H ATOM 261 HA ASN A 16 -6.942 -9.531 13.804 1.00 0.00 H ATOM 262 HB2 ASN A 16 -4.381 -7.932 13.780 1.00 0.00 H ATOM 263 HB3 ASN A 16 -4.964 -8.770 15.215 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.045 -10.652 15.514 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.514 -11.740 14.281 1.00 0.00 H ATOM 266 N GLN A 17 -6.993 -6.258 13.977 1.00 0.00 N ATOM 267 CA GLN A 17 -7.626 -5.101 14.616 1.00 0.00 C ATOM 268 C GLN A 17 -9.146 -5.259 14.697 1.00 0.00 C ATOM 269 O GLN A 17 -9.745 -5.013 15.747 1.00 0.00 O ATOM 270 CB GLN A 17 -7.281 -3.823 13.837 1.00 0.00 C ATOM 271 CG GLN A 17 -6.108 -3.040 14.406 1.00 0.00 C ATOM 272 CD GLN A 17 -6.459 -2.307 15.690 1.00 0.00 C ATOM 273 OE1 GLN A 17 -6.817 -2.922 16.693 1.00 0.00 O ATOM 274 NE2 GLN A 17 -6.363 -0.980 15.662 1.00 0.00 N ATOM 275 H GLN A 17 -6.453 -6.113 13.171 1.00 0.00 H ATOM 276 HA GLN A 17 -7.230 -5.018 15.615 1.00 0.00 H ATOM 277 HB2 GLN A 17 -7.039 -4.092 12.822 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.145 -3.177 13.827 1.00 0.00 H ATOM 279 HG2 GLN A 17 -5.302 -3.726 14.613 1.00 0.00 H ATOM 280 HG3 GLN A 17 -5.785 -2.316 13.673 1.00 0.00 H ATOM 281 HE21 GLN A 17 -6.073 -0.552 14.827 1.00 0.00 H ATOM 282 HE22 GLN A 17 -6.585 -0.484 16.477 1.00 0.00 H ATOM 283 N ASP A 18 -9.761 -5.659 13.586 1.00 0.00 N ATOM 284 CA ASP A 18 -11.213 -5.839 13.527 1.00 0.00 C ATOM 285 C ASP A 18 -11.632 -7.165 14.165 1.00 0.00 C ATOM 286 O ASP A 18 -12.400 -7.185 15.126 1.00 0.00 O ATOM 287 CB ASP A 18 -11.699 -5.767 12.074 1.00 0.00 C ATOM 288 CG ASP A 18 -11.180 -4.531 11.356 1.00 0.00 C ATOM 289 OD1 ASP A 18 -11.507 -3.401 11.723 1.00 0.00 O ATOM 290 H ASP A 18 -9.226 -5.831 12.782 1.00 0.00 H ATOM 291 HA ASP A 18 -11.664 -5.032 14.084 1.00 0.00 H ATOM 292 HB2 ASP A 18 -11.358 -6.642 11.540 1.00 0.00 H ATOM 293 HB3 ASP A 18 -12.778 -5.741 12.062 1.00 0.00 H HETATM 294 N NH2 A 19 -11.127 -8.274 13.634 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -10.521 -8.190 12.869 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -11.382 -9.134 14.030 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 19 ATOM 1 N PHE A 1 18.574 -0.963 4.432 1.00 0.00 N ATOM 2 CA PHE A 1 17.571 -0.089 3.832 1.00 0.00 C ATOM 3 C PHE A 1 16.211 -0.777 3.741 1.00 0.00 C ATOM 4 O PHE A 1 16.129 -2.001 3.603 1.00 0.00 O ATOM 5 CB PHE A 1 18.025 0.385 2.444 1.00 0.00 C ATOM 6 CG PHE A 1 18.480 -0.722 1.522 1.00 0.00 C ATOM 7 CD1 PHE A 1 17.600 -1.711 1.104 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.790 -0.766 1.067 1.00 0.00 C ATOM 9 CE1 PHE A 1 18.017 -2.718 0.253 1.00 0.00 C ATOM 10 CE2 PHE A 1 20.211 -1.770 0.216 1.00 0.00 C ATOM 11 CZ PHE A 1 19.325 -2.748 -0.190 1.00 0.00 C ATOM 12 H1 PHE A 1 19.143 -0.613 5.149 1.00 0.00 H ATOM 13 HA PHE A 1 17.473 0.774 4.474 1.00 0.00 H ATOM 14 HB2 PHE A 1 17.203 0.894 1.962 1.00 0.00 H ATOM 15 HB3 PHE A 1 18.846 1.076 2.563 1.00 0.00 H ATOM 16 HD1 PHE A 1 16.578 -1.690 1.449 1.00 0.00 H ATOM 17 HD2 PHE A 1 20.488 -0.006 1.384 1.00 0.00 H ATOM 18 HE1 PHE A 1 17.321 -3.482 -0.063 1.00 0.00 H ATOM 19 HE2 PHE A 1 21.234 -1.791 -0.131 1.00 0.00 H ATOM 20 HZ PHE A 1 19.653 -3.534 -0.856 1.00 0.00 H ATOM 21 N GLY A 2 15.149 0.026 3.830 1.00 0.00 N ATOM 22 CA GLY A 2 13.791 -0.496 3.761 1.00 0.00 C ATOM 23 C GLY A 2 13.376 -0.886 2.351 1.00 0.00 C ATOM 24 O GLY A 2 12.471 -0.276 1.780 1.00 0.00 O ATOM 25 H GLY A 2 15.287 0.989 3.947 1.00 0.00 H ATOM 26 HA2 GLY A 2 13.719 -1.367 4.395 1.00 0.00 H ATOM 27 HA3 GLY A 2 13.110 0.257 4.126 1.00 0.00 H ATOM 28 N GLY A 3 14.043 -1.900 1.792 1.00 0.00 N ATOM 29 CA GLY A 3 13.734 -2.354 0.444 1.00 0.00 C ATOM 30 C GLY A 3 12.254 -2.633 0.236 1.00 0.00 C ATOM 31 O GLY A 3 11.665 -3.453 0.943 1.00 0.00 O ATOM 32 H GLY A 3 14.757 -2.343 2.298 1.00 0.00 H ATOM 33 HA2 GLY A 3 14.047 -1.594 -0.255 1.00 0.00 H ATOM 34 HA3 GLY A 3 14.289 -3.259 0.247 1.00 0.00 H ATOM 35 N PHE A 4 11.659 -1.941 -0.745 1.00 0.00 N ATOM 36 CA PHE A 4 10.238 -2.093 -1.073 1.00 0.00 C ATOM 37 C PHE A 4 9.356 -1.617 0.085 1.00 0.00 C ATOM 38 O PHE A 4 9.709 -1.779 1.253 1.00 0.00 O ATOM 39 CB PHE A 4 9.915 -3.550 -1.417 1.00 0.00 C ATOM 40 CG PHE A 4 8.689 -3.707 -2.267 1.00 0.00 C ATOM 41 CD1 PHE A 4 8.752 -3.503 -3.637 1.00 0.00 C ATOM 42 CD2 PHE A 4 7.479 -4.078 -1.703 1.00 0.00 C ATOM 43 CE1 PHE A 4 7.631 -3.659 -4.428 1.00 0.00 C ATOM 44 CE2 PHE A 4 6.353 -4.237 -2.489 1.00 0.00 C ATOM 45 CZ PHE A 4 6.430 -4.028 -3.853 1.00 0.00 C ATOM 46 H PHE A 4 12.195 -1.307 -1.266 1.00 0.00 H ATOM 47 HA PHE A 4 10.034 -1.475 -1.936 1.00 0.00 H ATOM 48 HB2 PHE A 4 10.746 -3.980 -1.956 1.00 0.00 H ATOM 49 HB3 PHE A 4 9.759 -4.102 -0.504 1.00 0.00 H ATOM 50 HD1 PHE A 4 9.691 -3.215 -4.086 1.00 0.00 H ATOM 51 HD2 PHE A 4 7.416 -4.235 -0.638 1.00 0.00 H ATOM 52 HE1 PHE A 4 7.695 -3.496 -5.494 1.00 0.00 H ATOM 53 HE2 PHE A 4 5.416 -4.526 -2.036 1.00 0.00 H ATOM 54 HZ PHE A 4 5.552 -4.154 -4.469 1.00 0.00 H ATOM 55 N THR A 5 8.206 -1.026 -0.246 1.00 0.00 N ATOM 56 CA THR A 5 7.285 -0.529 0.774 1.00 0.00 C ATOM 57 C THR A 5 6.755 -1.670 1.642 1.00 0.00 C ATOM 58 O THR A 5 5.707 -2.254 1.355 1.00 0.00 O ATOM 59 CB THR A 5 6.100 0.258 0.158 1.00 0.00 C ATOM 60 OG1 THR A 5 5.188 0.666 1.191 1.00 0.00 O ATOM 61 CG2 THR A 5 5.357 -0.572 -0.886 1.00 0.00 C ATOM 62 H THR A 5 7.977 -0.921 -1.193 1.00 0.00 H ATOM 63 HA THR A 5 7.840 0.151 1.406 1.00 0.00 H ATOM 64 HB THR A 5 6.493 1.143 -0.324 1.00 0.00 H ATOM 65 HG1 THR A 5 4.787 -0.110 1.596 1.00 0.00 H ATOM 66 HG21 THR A 5 5.507 -0.141 -1.864 1.00 0.00 H ATOM 67 HG22 THR A 5 4.299 -0.580 -0.657 1.00 0.00 H ATOM 68 HG23 THR A 5 5.731 -1.584 -0.877 1.00 0.00 H ATOM 69 N GLY A 6 7.494 -1.981 2.709 1.00 0.00 N ATOM 70 CA GLY A 6 7.097 -3.045 3.611 1.00 0.00 C ATOM 71 C GLY A 6 5.961 -2.633 4.526 1.00 0.00 C ATOM 72 O GLY A 6 6.154 -1.824 5.437 1.00 0.00 O ATOM 73 H GLY A 6 8.320 -1.481 2.884 1.00 0.00 H ATOM 74 HA2 GLY A 6 6.787 -3.901 3.028 1.00 0.00 H ATOM 75 HA3 GLY A 6 7.946 -3.321 4.215 1.00 0.00 H ATOM 76 N LYS A 7 4.774 -3.193 4.290 1.00 0.00 N ATOM 77 CA LYS A 7 3.605 -2.882 5.109 1.00 0.00 C ATOM 78 C LYS A 7 3.411 -3.949 6.192 1.00 0.00 C ATOM 79 O LYS A 7 2.312 -4.475 6.378 1.00 0.00 O ATOM 80 CB LYS A 7 2.348 -2.733 4.237 1.00 0.00 C ATOM 81 CG LYS A 7 1.853 -4.023 3.595 1.00 0.00 C ATOM 82 CD LYS A 7 0.498 -3.817 2.920 1.00 0.00 C ATOM 83 CE LYS A 7 -0.384 -5.055 3.027 1.00 0.00 C ATOM 84 NZ LYS A 7 -0.429 -5.565 4.398 1.00 0.00 N1+ ATOM 85 H LYS A 7 4.685 -3.835 3.555 1.00 0.00 H ATOM 86 HA LYS A 7 3.799 -1.938 5.600 1.00 0.00 H ATOM 87 HB2 LYS A 7 1.550 -2.338 4.846 1.00 0.00 H ATOM 88 HB3 LYS A 7 2.562 -2.028 3.447 1.00 0.00 H ATOM 89 HG2 LYS A 7 2.569 -4.340 2.852 1.00 0.00 H ATOM 90 HG3 LYS A 7 1.758 -4.784 4.354 1.00 0.00 H ATOM 91 HD2 LYS A 7 -0.009 -2.985 3.391 1.00 0.00 H ATOM 92 HD3 LYS A 7 0.662 -3.594 1.876 1.00 0.00 H ATOM 93 HE2 LYS A 7 -1.386 -4.794 2.715 1.00 0.00 H ATOM 94 HE3 LYS A 7 0.005 -5.823 2.376 1.00 0.00 H ATOM 95 HZ1 LYS A 7 -1.042 -5.128 5.022 1.00 0.00 H ATOM 96 N ARG A 8 4.497 -4.265 6.901 1.00 0.00 N ATOM 97 CA ARG A 8 4.474 -5.272 7.963 1.00 0.00 C ATOM 98 C ARG A 8 3.495 -4.905 9.086 1.00 0.00 C ATOM 99 O ARG A 8 2.851 -5.786 9.669 1.00 0.00 O ATOM 100 CB ARG A 8 5.892 -5.487 8.515 1.00 0.00 C ATOM 101 CG ARG A 8 6.713 -6.466 7.684 1.00 0.00 C ATOM 102 CD ARG A 8 8.134 -6.636 8.212 1.00 0.00 C ATOM 103 NE ARG A 8 8.776 -7.839 7.672 1.00 0.00 N ATOM 104 CZ ARG A 8 9.014 -8.050 6.370 1.00 0.00 C ATOM 105 NH1 ARG A 8 8.735 -7.112 5.467 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.550 -9.202 5.976 1.00 0.00 N ATOM 107 H ARG A 8 5.342 -3.808 6.705 1.00 0.00 H ATOM 108 HA ARG A 8 4.139 -6.197 7.518 1.00 0.00 H ATOM 109 HB2 ARG A 8 6.407 -4.537 8.530 1.00 0.00 H ATOM 110 HB3 ARG A 8 5.824 -5.866 9.524 1.00 0.00 H ATOM 111 HG2 ARG A 8 6.223 -7.427 7.694 1.00 0.00 H ATOM 112 HG3 ARG A 8 6.759 -6.100 6.668 1.00 0.00 H ATOM 113 HD2 ARG A 8 8.716 -5.772 7.927 1.00 0.00 H ATOM 114 HD3 ARG A 8 8.101 -6.706 9.289 1.00 0.00 H ATOM 115 HE ARG A 8 9.029 -8.536 8.313 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.350 -6.235 5.753 1.00 0.00 H ATOM 117 HH12 ARG A 8 8.912 -7.286 4.499 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.778 -9.906 6.650 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.727 -9.365 5.006 1.00 0.00 H ATOM 120 N LYS A 9 3.374 -3.609 9.377 1.00 0.00 N ATOM 121 CA LYS A 9 2.467 -3.139 10.425 1.00 0.00 C ATOM 122 C LYS A 9 1.021 -3.144 9.937 1.00 0.00 C ATOM 123 O LYS A 9 0.119 -3.600 10.642 1.00 0.00 O ATOM 124 CB LYS A 9 2.837 -1.726 10.907 1.00 0.00 C ATOM 125 CG LYS A 9 4.287 -1.568 11.356 1.00 0.00 C ATOM 126 CD LYS A 9 5.242 -1.255 10.202 1.00 0.00 C ATOM 127 CE LYS A 9 5.103 0.181 9.705 1.00 0.00 C ATOM 128 NZ LYS A 9 3.778 0.451 9.073 1.00 0.00 N1+ ATOM 129 H LYS A 9 3.893 -2.959 8.866 1.00 0.00 H ATOM 130 HA LYS A 9 2.549 -3.821 11.258 1.00 0.00 H ATOM 131 HB2 LYS A 9 2.648 -1.029 10.112 1.00 0.00 H ATOM 132 HB3 LYS A 9 2.202 -1.474 11.744 1.00 0.00 H ATOM 133 HG2 LYS A 9 4.339 -0.763 12.071 1.00 0.00 H ATOM 134 HG3 LYS A 9 4.602 -2.487 11.830 1.00 0.00 H ATOM 135 HD2 LYS A 9 6.255 -1.403 10.544 1.00 0.00 H ATOM 136 HD3 LYS A 9 5.045 -1.925 9.385 1.00 0.00 H ATOM 137 HE2 LYS A 9 5.230 0.849 10.542 1.00 0.00 H ATOM 138 HE3 LYS A 9 5.881 0.370 8.978 1.00 0.00 H ATOM 139 HZ1 LYS A 9 3.098 0.774 9.793 1.00 0.00 H ATOM 140 HZ2 LYS A 9 3.409 -0.411 8.621 1.00 0.00 H ATOM 141 HZ3 LYS A 9 3.875 1.190 8.349 1.00 0.00 H ATOM 142 N SER A 10 0.807 -2.620 8.729 1.00 0.00 N ATOM 143 CA SER A 10 -0.531 -2.548 8.141 1.00 0.00 C ATOM 144 C SER A 10 -1.136 -3.930 7.916 1.00 0.00 C ATOM 145 O SER A 10 -2.305 -4.158 8.235 1.00 0.00 O ATOM 146 CB SER A 10 -0.494 -1.771 6.824 1.00 0.00 C ATOM 147 OG SER A 10 -0.282 -0.387 7.055 1.00 0.00 O ATOM 148 H SER A 10 1.568 -2.267 8.223 1.00 0.00 H ATOM 149 HA SER A 10 -1.159 -2.016 8.837 1.00 0.00 H ATOM 150 HB2 SER A 10 0.314 -2.148 6.212 1.00 0.00 H ATOM 151 HB3 SER A 10 -1.432 -1.901 6.303 1.00 0.00 H ATOM 152 HG SER A 10 -1.018 0.114 6.695 1.00 0.00 H ATOM 153 N ASP A 11 -0.346 -4.851 7.365 1.00 0.00 N ATOM 154 CA ASP A 11 -0.828 -6.205 7.103 1.00 0.00 C ATOM 155 C ASP A 11 -1.160 -6.949 8.397 1.00 0.00 C ATOM 156 O ASP A 11 -2.173 -7.649 8.461 1.00 0.00 O ATOM 157 CB ASP A 11 0.190 -7.015 6.287 1.00 0.00 C ATOM 158 CG ASP A 11 0.327 -6.583 4.826 1.00 0.00 C ATOM 159 OD1 ASP A 11 1.120 -7.168 4.084 1.00 0.00 O ATOM 160 H ASP A 11 0.574 -4.614 7.132 1.00 0.00 H ATOM 161 HA ASP A 11 -1.735 -6.116 6.527 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.160 -6.921 6.749 1.00 0.00 H ATOM 163 HB3 ASP A 11 -0.103 -8.057 6.304 1.00 0.00 H ATOM 164 N ARG A 12 -0.314 -6.811 9.423 1.00 0.00 N ATOM 165 CA ARG A 12 -0.557 -7.499 10.694 1.00 0.00 C ATOM 166 C ARG A 12 -1.866 -7.046 11.347 1.00 0.00 C ATOM 167 O ARG A 12 -2.695 -7.879 11.719 1.00 0.00 O ATOM 168 CB ARG A 12 0.605 -7.297 11.667 1.00 0.00 C ATOM 169 CG ARG A 12 0.463 -8.110 12.946 1.00 0.00 C ATOM 170 CD ARG A 12 0.554 -9.607 12.669 1.00 0.00 C ATOM 171 NE ARG A 12 0.172 -10.415 13.829 1.00 0.00 N ATOM 172 CZ ARG A 12 -1.091 -10.595 14.237 1.00 0.00 C ATOM 173 NH1 ARG A 12 -2.105 -10.067 13.554 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -1.340 -11.322 15.321 1.00 0.00 N ATOM 175 H ARG A 12 0.485 -6.246 9.322 1.00 0.00 H ATOM 176 HA ARG A 12 -0.640 -8.551 10.473 1.00 0.00 H ATOM 177 HB2 ARG A 12 1.523 -7.587 11.180 1.00 0.00 H ATOM 178 HB3 ARG A 12 0.661 -6.252 11.933 1.00 0.00 H ATOM 179 HG2 ARG A 12 1.252 -7.831 13.626 1.00 0.00 H ATOM 180 HG3 ARG A 12 -0.496 -7.893 13.394 1.00 0.00 H ATOM 181 HD2 ARG A 12 -0.105 -9.847 11.846 1.00 0.00 H ATOM 182 HD3 ARG A 12 1.571 -9.848 12.393 1.00 0.00 H ATOM 183 HE ARG A 12 0.895 -10.835 14.341 1.00 0.00 H ATOM 184 HH11 ARG A 12 -1.930 -9.528 12.729 1.00 0.00 H ATOM 185 HH12 ARG A 12 -3.045 -10.210 13.863 1.00 0.00 H ATOM 186 HH21 ARG A 12 -0.584 -11.733 15.833 1.00 0.00 H ATOM 187 HH22 ARG A 12 -2.281 -11.461 15.626 1.00 0.00 H ATOM 188 N LYS A 13 -2.052 -5.730 11.492 1.00 0.00 N ATOM 189 CA LYS A 13 -3.273 -5.202 12.113 1.00 0.00 C ATOM 190 C LYS A 13 -4.495 -5.453 11.225 1.00 0.00 C ATOM 191 O LYS A 13 -5.568 -5.791 11.725 1.00 0.00 O ATOM 192 CB LYS A 13 -3.130 -3.707 12.460 1.00 0.00 C ATOM 193 CG LYS A 13 -3.098 -2.751 11.270 1.00 0.00 C ATOM 194 CD LYS A 13 -4.499 -2.406 10.774 1.00 0.00 C ATOM 195 CE LYS A 13 -4.492 -1.193 9.851 1.00 0.00 C ATOM 196 NZ LYS A 13 -3.558 -1.354 8.700 1.00 0.00 N1+ ATOM 197 H LYS A 13 -1.359 -5.111 11.181 1.00 0.00 H ATOM 198 HA LYS A 13 -3.418 -5.752 13.031 1.00 0.00 H ATOM 199 HB2 LYS A 13 -3.959 -3.423 13.090 1.00 0.00 H ATOM 200 HB3 LYS A 13 -2.214 -3.575 13.020 1.00 0.00 H ATOM 201 HG2 LYS A 13 -2.602 -1.840 11.568 1.00 0.00 H ATOM 202 HG3 LYS A 13 -2.547 -3.214 10.467 1.00 0.00 H ATOM 203 HD2 LYS A 13 -4.899 -3.248 10.234 1.00 0.00 H ATOM 204 HD3 LYS A 13 -5.130 -2.193 11.625 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.490 -1.046 9.468 1.00 0.00 H ATOM 206 HE3 LYS A 13 -4.199 -0.324 10.422 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -2.690 -0.806 8.865 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -4.009 -1.014 7.828 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -3.306 -2.356 8.578 1.00 0.00 H ATOM 210 N LYS A 14 -4.322 -5.304 9.909 1.00 0.00 N ATOM 211 CA LYS A 14 -5.413 -5.535 8.964 1.00 0.00 C ATOM 212 C LYS A 14 -5.846 -7.002 8.985 1.00 0.00 C ATOM 213 O LYS A 14 -7.019 -7.308 8.773 1.00 0.00 O ATOM 214 CB LYS A 14 -5.017 -5.125 7.541 1.00 0.00 C ATOM 215 CG LYS A 14 -6.141 -5.317 6.532 1.00 0.00 C ATOM 216 CD LYS A 14 -7.341 -4.428 6.850 1.00 0.00 C ATOM 217 CE LYS A 14 -8.590 -4.878 6.104 1.00 0.00 C ATOM 218 NZ LYS A 14 -9.154 -6.104 6.675 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.439 -5.044 9.568 1.00 0.00 H ATOM 220 HA LYS A 14 -6.251 -4.928 9.281 1.00 0.00 H ATOM 221 HB2 LYS A 14 -4.732 -4.083 7.543 1.00 0.00 H ATOM 222 HB3 LYS A 14 -4.173 -5.722 7.226 1.00 0.00 H ATOM 223 HG2 LYS A 14 -5.772 -5.067 5.548 1.00 0.00 H ATOM 224 HG3 LYS A 14 -6.451 -6.350 6.552 1.00 0.00 H ATOM 225 HD2 LYS A 14 -7.537 -4.470 7.912 1.00 0.00 H ATOM 226 HD3 LYS A 14 -7.110 -3.411 6.566 1.00 0.00 H ATOM 227 HE2 LYS A 14 -9.328 -4.091 6.158 1.00 0.00 H ATOM 228 HE3 LYS A 14 -8.332 -5.057 5.071 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -9.818 -6.003 7.384 1.00 0.00 H ATOM 230 N LYS A 15 -4.898 -7.907 9.251 1.00 0.00 N ATOM 231 CA LYS A 15 -5.197 -9.338 9.314 1.00 0.00 C ATOM 232 C LYS A 15 -6.312 -9.606 10.329 1.00 0.00 C ATOM 233 O LYS A 15 -7.241 -10.368 10.053 1.00 0.00 O ATOM 234 CB LYS A 15 -3.933 -10.134 9.675 1.00 0.00 C ATOM 235 CG LYS A 15 -4.184 -11.621 9.884 1.00 0.00 C ATOM 236 CD LYS A 15 -2.884 -12.379 10.110 1.00 0.00 C ATOM 237 CE LYS A 15 -3.132 -13.840 10.463 1.00 0.00 C ATOM 238 NZ LYS A 15 -3.815 -13.995 11.779 1.00 0.00 N1+ ATOM 239 H LYS A 15 -3.981 -7.603 9.419 1.00 0.00 H ATOM 240 HA LYS A 15 -5.538 -9.645 8.337 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.213 -10.023 8.877 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.515 -9.731 10.583 1.00 0.00 H ATOM 243 HG2 LYS A 15 -4.823 -11.751 10.747 1.00 0.00 H ATOM 244 HG3 LYS A 15 -4.675 -12.020 9.008 1.00 0.00 H ATOM 245 HD2 LYS A 15 -2.293 -12.334 9.208 1.00 0.00 H ATOM 246 HD3 LYS A 15 -2.341 -11.910 10.919 1.00 0.00 H ATOM 247 HE2 LYS A 15 -3.749 -14.284 9.696 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.181 -14.353 10.498 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -4.824 -13.762 11.689 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.386 -13.358 12.483 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -3.725 -14.975 12.115 1.00 0.00 H ATOM 252 N ASN A 16 -6.227 -8.953 11.490 1.00 0.00 N ATOM 253 CA ASN A 16 -7.246 -9.102 12.529 1.00 0.00 C ATOM 254 C ASN A 16 -8.506 -8.320 12.165 1.00 0.00 C ATOM 255 O ASN A 16 -9.621 -8.822 12.319 1.00 0.00 O ATOM 256 CB ASN A 16 -6.722 -8.637 13.891 1.00 0.00 C ATOM 257 CG ASN A 16 -6.416 -9.796 14.822 1.00 0.00 C ATOM 258 OD1 ASN A 16 -7.270 -10.649 15.067 1.00 0.00 O ATOM 259 ND2 ASN A 16 -5.202 -9.824 15.362 1.00 0.00 N ATOM 260 H ASN A 16 -5.472 -8.345 11.641 1.00 0.00 H ATOM 261 HA ASN A 16 -7.499 -10.149 12.591 1.00 0.00 H ATOM 262 HB2 ASN A 16 -5.814 -8.071 13.746 1.00 0.00 H ATOM 263 HB3 ASN A 16 -7.466 -8.010 14.361 1.00 0.00 H ATOM 264 HD21 ASN A 16 -4.575 -9.107 15.130 1.00 0.00 H ATOM 265 HD22 ASN A 16 -4.987 -10.556 15.976 1.00 0.00 H ATOM 266 N GLN A 17 -8.321 -7.089 11.677 1.00 0.00 N ATOM 267 CA GLN A 17 -9.443 -6.236 11.279 1.00 0.00 C ATOM 268 C GLN A 17 -10.321 -6.927 10.239 1.00 0.00 C ATOM 269 O GLN A 17 -11.543 -6.979 10.386 1.00 0.00 O ATOM 270 CB GLN A 17 -8.932 -4.902 10.715 1.00 0.00 C ATOM 271 CG GLN A 17 -8.559 -3.875 11.773 1.00 0.00 C ATOM 272 CD GLN A 17 -9.761 -3.383 12.560 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.769 -2.974 11.985 1.00 0.00 O ATOM 274 NE2 GLN A 17 -9.649 -3.406 13.886 1.00 0.00 N ATOM 275 H GLN A 17 -7.407 -6.749 11.577 1.00 0.00 H ATOM 276 HA GLN A 17 -10.038 -6.039 12.158 1.00 0.00 H ATOM 277 HB2 GLN A 17 -8.058 -5.093 10.113 1.00 0.00 H ATOM 278 HB3 GLN A 17 -9.699 -4.474 10.087 1.00 0.00 H ATOM 279 HG2 GLN A 17 -7.860 -4.321 12.463 1.00 0.00 H ATOM 280 HG3 GLN A 17 -8.095 -3.027 11.287 1.00 0.00 H ATOM 281 HE21 GLN A 17 -8.813 -3.735 14.276 1.00 0.00 H ATOM 282 HE22 GLN A 17 -10.406 -3.083 14.419 1.00 0.00 H ATOM 283 N ASP A 18 -9.690 -7.459 9.191 1.00 0.00 N ATOM 284 CA ASP A 18 -10.417 -8.149 8.128 1.00 0.00 C ATOM 285 C ASP A 18 -11.107 -9.402 8.669 1.00 0.00 C ATOM 286 O ASP A 18 -12.300 -9.608 8.449 1.00 0.00 O ATOM 287 CB ASP A 18 -9.477 -8.527 6.969 1.00 0.00 C ATOM 288 CG ASP A 18 -8.805 -7.336 6.278 1.00 0.00 C ATOM 289 OD1 ASP A 18 -7.976 -7.531 5.389 1.00 0.00 O ATOM 290 H ASP A 18 -8.714 -7.386 9.134 1.00 0.00 H ATOM 291 HA ASP A 18 -11.175 -7.473 7.756 1.00 0.00 H ATOM 292 HB2 ASP A 18 -8.698 -9.168 7.351 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.044 -9.071 6.227 1.00 0.00 H HETATM 294 N NH2 A 19 -10.357 -10.241 9.384 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -9.412 -10.020 9.523 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -10.782 -11.049 9.742 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 20 ATOM 1 N PHE A 1 9.773 -10.185 -4.761 1.00 0.00 N ATOM 2 CA PHE A 1 10.166 -8.937 -5.407 1.00 0.00 C ATOM 3 C PHE A 1 9.113 -7.852 -5.157 1.00 0.00 C ATOM 4 O PHE A 1 8.850 -7.016 -6.024 1.00 0.00 O ATOM 5 CB PHE A 1 10.335 -9.141 -6.920 1.00 0.00 C ATOM 6 CG PHE A 1 10.974 -10.450 -7.306 1.00 0.00 C ATOM 7 CD1 PHE A 1 10.289 -11.646 -7.143 1.00 0.00 C ATOM 8 CD2 PHE A 1 12.256 -10.481 -7.830 1.00 0.00 C ATOM 9 CE1 PHE A 1 10.872 -12.848 -7.496 1.00 0.00 C ATOM 10 CE2 PHE A 1 12.843 -11.682 -8.184 1.00 0.00 C ATOM 11 CZ PHE A 1 12.151 -12.865 -8.017 1.00 0.00 C ATOM 12 H1 PHE A 1 10.413 -10.648 -4.179 1.00 0.00 H ATOM 13 HA PHE A 1 11.106 -8.622 -4.983 1.00 0.00 H ATOM 14 HB2 PHE A 1 9.364 -9.098 -7.392 1.00 0.00 H ATOM 15 HB3 PHE A 1 10.949 -8.343 -7.311 1.00 0.00 H ATOM 16 HD1 PHE A 1 9.289 -11.630 -6.737 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.798 -9.555 -7.961 1.00 0.00 H ATOM 18 HE1 PHE A 1 10.330 -13.771 -7.363 1.00 0.00 H ATOM 19 HE2 PHE A 1 13.843 -11.694 -8.591 1.00 0.00 H ATOM 20 HZ PHE A 1 12.609 -13.804 -8.292 1.00 0.00 H ATOM 21 N GLY A 2 8.503 -7.882 -3.970 1.00 0.00 N ATOM 22 CA GLY A 2 7.474 -6.916 -3.629 1.00 0.00 C ATOM 23 C GLY A 2 8.026 -5.574 -3.189 1.00 0.00 C ATOM 24 O GLY A 2 8.958 -5.510 -2.385 1.00 0.00 O ATOM 25 H GLY A 2 8.747 -8.578 -3.323 1.00 0.00 H ATOM 26 HA2 GLY A 2 6.846 -6.762 -4.494 1.00 0.00 H ATOM 27 HA3 GLY A 2 6.870 -7.322 -2.832 1.00 0.00 H ATOM 28 N GLY A 3 7.427 -4.496 -3.705 1.00 0.00 N ATOM 29 CA GLY A 3 7.852 -3.157 -3.338 1.00 0.00 C ATOM 30 C GLY A 3 7.535 -2.856 -1.887 1.00 0.00 C ATOM 31 O GLY A 3 8.432 -2.565 -1.096 1.00 0.00 O ATOM 32 H GLY A 3 6.678 -4.613 -4.328 1.00 0.00 H ATOM 33 HA2 GLY A 3 8.920 -3.070 -3.493 1.00 0.00 H ATOM 34 HA3 GLY A 3 7.345 -2.441 -3.966 1.00 0.00 H ATOM 35 N PHE A 4 6.253 -2.956 -1.533 1.00 0.00 N ATOM 36 CA PHE A 4 5.810 -2.722 -0.161 1.00 0.00 C ATOM 37 C PHE A 4 5.996 -3.980 0.681 1.00 0.00 C ATOM 38 O PHE A 4 5.825 -5.096 0.185 1.00 0.00 O ATOM 39 CB PHE A 4 4.343 -2.274 -0.131 1.00 0.00 C ATOM 40 CG PHE A 4 4.135 -0.843 -0.561 1.00 0.00 C ATOM 41 CD1 PHE A 4 4.929 -0.270 -1.546 1.00 0.00 C ATOM 42 CD2 PHE A 4 3.149 -0.068 0.031 1.00 0.00 C ATOM 43 CE1 PHE A 4 4.742 1.043 -1.930 1.00 0.00 C ATOM 44 CE2 PHE A 4 2.958 1.247 -0.350 1.00 0.00 C ATOM 45 CZ PHE A 4 3.756 1.802 -1.334 1.00 0.00 C ATOM 46 H PHE A 4 5.590 -3.211 -2.210 1.00 0.00 H ATOM 47 HA PHE A 4 6.423 -1.934 0.254 1.00 0.00 H ATOM 48 HB2 PHE A 4 3.765 -2.907 -0.788 1.00 0.00 H ATOM 49 HB3 PHE A 4 3.967 -2.375 0.879 1.00 0.00 H ATOM 50 HD1 PHE A 4 5.702 -0.860 -2.014 1.00 0.00 H ATOM 51 HD2 PHE A 4 2.525 -0.501 0.798 1.00 0.00 H ATOM 52 HE1 PHE A 4 5.368 1.478 -2.698 1.00 0.00 H ATOM 53 HE2 PHE A 4 2.187 1.839 0.118 1.00 0.00 H ATOM 54 HZ PHE A 4 3.608 2.830 -1.633 1.00 0.00 H ATOM 55 N THR A 5 6.359 -3.801 1.951 1.00 0.00 N ATOM 56 CA THR A 5 6.580 -4.933 2.850 1.00 0.00 C ATOM 57 C THR A 5 5.354 -5.853 2.884 1.00 0.00 C ATOM 58 O THR A 5 4.227 -5.392 3.061 1.00 0.00 O ATOM 59 CB THR A 5 6.926 -4.462 4.278 1.00 0.00 C ATOM 60 OG1 THR A 5 8.072 -3.601 4.250 1.00 0.00 O ATOM 61 CG2 THR A 5 7.207 -5.649 5.189 1.00 0.00 C ATOM 62 H THR A 5 6.488 -2.889 2.290 1.00 0.00 H ATOM 63 HA THR A 5 7.422 -5.494 2.469 1.00 0.00 H ATOM 64 HB THR A 5 6.086 -3.911 4.675 1.00 0.00 H ATOM 65 HG1 THR A 5 8.847 -4.100 3.978 1.00 0.00 H ATOM 66 HG21 THR A 5 7.001 -5.374 6.214 1.00 0.00 H ATOM 67 HG22 THR A 5 8.244 -5.935 5.096 1.00 0.00 H ATOM 68 HG23 THR A 5 6.579 -6.481 4.905 1.00 0.00 H ATOM 69 N GLY A 6 5.591 -7.154 2.683 1.00 0.00 N ATOM 70 CA GLY A 6 4.510 -8.130 2.659 1.00 0.00 C ATOM 71 C GLY A 6 3.806 -8.312 3.993 1.00 0.00 C ATOM 72 O GLY A 6 2.588 -8.141 4.077 1.00 0.00 O ATOM 73 H GLY A 6 6.512 -7.452 2.532 1.00 0.00 H ATOM 74 HA2 GLY A 6 3.780 -7.819 1.928 1.00 0.00 H ATOM 75 HA3 GLY A 6 4.915 -9.082 2.355 1.00 0.00 H ATOM 76 N LYS A 7 4.561 -8.676 5.033 1.00 0.00 N ATOM 77 CA LYS A 7 3.974 -8.897 6.354 1.00 0.00 C ATOM 78 C LYS A 7 3.439 -7.600 6.959 1.00 0.00 C ATOM 79 O LYS A 7 2.448 -7.627 7.682 1.00 0.00 O ATOM 80 CB LYS A 7 4.969 -9.564 7.310 1.00 0.00 C ATOM 81 CG LYS A 7 4.442 -10.866 7.912 1.00 0.00 C ATOM 82 CD LYS A 7 3.107 -10.666 8.628 1.00 0.00 C ATOM 83 CE LYS A 7 3.271 -9.953 9.967 1.00 0.00 C ATOM 84 NZ LYS A 7 2.273 -8.896 10.177 1.00 0.00 N1+ ATOM 85 H LYS A 7 5.525 -8.811 4.906 1.00 0.00 H ATOM 86 HA LYS A 7 3.138 -9.566 6.213 1.00 0.00 H ATOM 87 HB2 LYS A 7 5.879 -9.782 6.772 1.00 0.00 H ATOM 88 HB3 LYS A 7 5.191 -8.883 8.118 1.00 0.00 H ATOM 89 HG2 LYS A 7 4.308 -11.587 7.119 1.00 0.00 H ATOM 90 HG3 LYS A 7 5.168 -11.242 8.620 1.00 0.00 H ATOM 91 HD2 LYS A 7 2.457 -10.081 7.998 1.00 0.00 H ATOM 92 HD3 LYS A 7 2.660 -11.635 8.803 1.00 0.00 H ATOM 93 HE2 LYS A 7 3.167 -10.682 10.755 1.00 0.00 H ATOM 94 HE3 LYS A 7 4.259 -9.518 10.012 1.00 0.00 H ATOM 95 HZ1 LYS A 7 1.332 -9.123 10.032 1.00 0.00 H ATOM 96 N ARG A 8 4.079 -6.467 6.653 1.00 0.00 N ATOM 97 CA ARG A 8 3.628 -5.170 7.169 1.00 0.00 C ATOM 98 C ARG A 8 2.161 -4.959 6.822 1.00 0.00 C ATOM 99 O ARG A 8 1.376 -4.458 7.629 1.00 0.00 O ATOM 100 CB ARG A 8 4.455 -4.034 6.568 1.00 0.00 C ATOM 101 CG ARG A 8 5.258 -3.242 7.588 1.00 0.00 C ATOM 102 CD ARG A 8 4.353 -2.654 8.660 1.00 0.00 C ATOM 103 NE ARG A 8 5.020 -1.626 9.463 1.00 0.00 N ATOM 104 CZ ARG A 8 6.036 -1.848 10.305 1.00 0.00 C ATOM 105 NH1 ARG A 8 6.525 -3.075 10.485 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 6.561 -0.830 10.977 1.00 0.00 N ATOM 107 H ARG A 8 4.856 -6.501 6.059 1.00 0.00 H ATOM 108 HA ARG A 8 3.745 -5.172 8.242 1.00 0.00 H ATOM 109 HB2 ARG A 8 5.140 -4.451 5.850 1.00 0.00 H ATOM 110 HB3 ARG A 8 3.789 -3.352 6.060 1.00 0.00 H ATOM 111 HG2 ARG A 8 5.979 -3.897 8.053 1.00 0.00 H ATOM 112 HG3 ARG A 8 5.773 -2.438 7.081 1.00 0.00 H ATOM 113 HD2 ARG A 8 3.492 -2.215 8.179 1.00 0.00 H ATOM 114 HD3 ARG A 8 4.030 -3.454 9.310 1.00 0.00 H ATOM 115 HE ARG A 8 4.689 -0.708 9.369 1.00 0.00 H ATOM 116 HH11 ARG A 8 6.134 -3.850 9.989 1.00 0.00 H ATOM 117 HH12 ARG A 8 7.287 -3.222 11.118 1.00 0.00 H ATOM 118 HH21 ARG A 8 6.195 0.093 10.852 1.00 0.00 H ATOM 119 HH22 ARG A 8 7.319 -0.985 11.610 1.00 0.00 H ATOM 120 N LYS A 9 1.814 -5.369 5.610 1.00 0.00 N ATOM 121 CA LYS A 9 0.449 -5.265 5.106 1.00 0.00 C ATOM 122 C LYS A 9 -0.484 -6.187 5.885 1.00 0.00 C ATOM 123 O LYS A 9 -1.589 -5.795 6.260 1.00 0.00 O ATOM 124 CB LYS A 9 0.420 -5.640 3.625 1.00 0.00 C ATOM 125 CG LYS A 9 1.295 -4.754 2.755 1.00 0.00 C ATOM 126 CD LYS A 9 1.403 -5.288 1.332 1.00 0.00 C ATOM 127 CE LYS A 9 0.035 -5.510 0.694 1.00 0.00 C ATOM 128 NZ LYS A 9 -0.890 -4.358 0.911 1.00 0.00 N1+ ATOM 129 H LYS A 9 2.500 -5.769 5.038 1.00 0.00 H ATOM 130 HA LYS A 9 0.120 -4.245 5.222 1.00 0.00 H ATOM 131 HB2 LYS A 9 0.763 -6.658 3.521 1.00 0.00 H ATOM 132 HB3 LYS A 9 -0.595 -5.573 3.268 1.00 0.00 H ATOM 133 HG2 LYS A 9 0.870 -3.762 2.725 1.00 0.00 H ATOM 134 HG3 LYS A 9 2.281 -4.708 3.187 1.00 0.00 H ATOM 135 HD2 LYS A 9 1.955 -4.578 0.735 1.00 0.00 H ATOM 136 HD3 LYS A 9 1.935 -6.228 1.355 1.00 0.00 H ATOM 137 HE2 LYS A 9 0.171 -5.647 -0.368 1.00 0.00 H ATOM 138 HE3 LYS A 9 -0.406 -6.401 1.115 1.00 0.00 H ATOM 139 HZ1 LYS A 9 -0.876 -4.067 1.910 1.00 0.00 H ATOM 140 HZ2 LYS A 9 -1.860 -4.628 0.658 1.00 0.00 H ATOM 141 HZ3 LYS A 9 -0.601 -3.551 0.323 1.00 0.00 H ATOM 142 N SER A 10 -0.019 -7.415 6.114 1.00 0.00 N ATOM 143 CA SER A 10 -0.780 -8.429 6.844 1.00 0.00 C ATOM 144 C SER A 10 -0.960 -8.046 8.314 1.00 0.00 C ATOM 145 O SER A 10 -2.023 -8.262 8.896 1.00 0.00 O ATOM 146 CB SER A 10 -0.067 -9.779 6.756 1.00 0.00 C ATOM 147 OG SER A 10 -0.782 -10.788 7.452 1.00 0.00 O ATOM 148 H SER A 10 0.872 -7.649 5.777 1.00 0.00 H ATOM 149 HA SER A 10 -1.751 -8.512 6.382 1.00 0.00 H ATOM 150 HB2 SER A 10 0.024 -10.068 5.721 1.00 0.00 H ATOM 151 HB3 SER A 10 0.917 -9.688 7.192 1.00 0.00 H ATOM 152 HG SER A 10 -0.239 -11.128 8.168 1.00 0.00 H ATOM 153 N ASP A 11 0.097 -7.494 8.904 1.00 0.00 N ATOM 154 CA ASP A 11 0.082 -7.095 10.308 1.00 0.00 C ATOM 155 C ASP A 11 -0.931 -5.965 10.550 1.00 0.00 C ATOM 156 O ASP A 11 -1.720 -6.019 11.498 1.00 0.00 O ATOM 157 CB ASP A 11 1.479 -6.628 10.748 1.00 0.00 C ATOM 158 CG ASP A 11 2.600 -7.653 10.557 1.00 0.00 C ATOM 159 OD1 ASP A 11 3.768 -7.320 10.757 1.00 0.00 O ATOM 160 H ASP A 11 0.915 -7.361 8.384 1.00 0.00 H ATOM 161 HA ASP A 11 -0.204 -7.954 10.894 1.00 0.00 H ATOM 162 HB2 ASP A 11 1.740 -5.746 10.182 1.00 0.00 H ATOM 163 HB3 ASP A 11 1.443 -6.367 11.798 1.00 0.00 H ATOM 164 N ARG A 12 -0.886 -4.945 9.687 1.00 0.00 N ATOM 165 CA ARG A 12 -1.776 -3.784 9.791 1.00 0.00 C ATOM 166 C ARG A 12 -3.228 -4.158 9.487 1.00 0.00 C ATOM 167 O ARG A 12 -4.136 -3.778 10.224 1.00 0.00 O ATOM 168 CB ARG A 12 -1.297 -2.674 8.844 1.00 0.00 C ATOM 169 CG ARG A 12 -1.801 -1.280 9.201 1.00 0.00 C ATOM 170 CD ARG A 12 -3.077 -0.903 8.456 1.00 0.00 C ATOM 171 NE ARG A 12 -3.361 0.531 8.583 1.00 0.00 N ATOM 172 CZ ARG A 12 -2.607 1.497 8.036 1.00 0.00 C ATOM 173 NH1 ARG A 12 -1.588 1.190 7.234 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 -2.881 2.777 8.283 1.00 0.00 N ATOM 175 H ARG A 12 -0.226 -4.969 8.963 1.00 0.00 H ATOM 176 HA ARG A 12 -1.721 -3.422 10.805 1.00 0.00 H ATOM 177 HB2 ARG A 12 -0.219 -2.650 8.856 1.00 0.00 H ATOM 178 HB3 ARG A 12 -1.629 -2.908 7.841 1.00 0.00 H ATOM 179 HG2 ARG A 12 -2.001 -1.248 10.263 1.00 0.00 H ATOM 180 HG3 ARG A 12 -1.030 -0.564 8.960 1.00 0.00 H ATOM 181 HD2 ARG A 12 -2.956 -1.146 7.410 1.00 0.00 H ATOM 182 HD3 ARG A 12 -3.904 -1.465 8.864 1.00 0.00 H ATOM 183 HE ARG A 12 -4.130 0.791 9.131 1.00 0.00 H ATOM 184 HH11 ARG A 12 -1.381 0.234 7.030 1.00 0.00 H ATOM 185 HH12 ARG A 12 -1.032 1.919 6.830 1.00 0.00 H ATOM 186 HH21 ARG A 12 -3.650 3.021 8.873 1.00 0.00 H ATOM 187 HH22 ARG A 12 -2.315 3.496 7.877 1.00 0.00 H ATOM 188 N LYS A 13 -3.444 -4.900 8.401 1.00 0.00 N ATOM 189 CA LYS A 13 -4.796 -5.312 8.013 1.00 0.00 C ATOM 190 C LYS A 13 -5.437 -6.199 9.079 1.00 0.00 C ATOM 191 O LYS A 13 -6.602 -6.012 9.429 1.00 0.00 O ATOM 192 CB LYS A 13 -4.782 -6.057 6.674 1.00 0.00 C ATOM 193 CG LYS A 13 -4.037 -7.384 6.712 1.00 0.00 C ATOM 194 CD LYS A 13 -3.974 -8.036 5.339 1.00 0.00 C ATOM 195 CE LYS A 13 -5.359 -8.213 4.732 1.00 0.00 C ATOM 196 NZ LYS A 13 -6.208 -9.159 5.515 1.00 0.00 N1+ ATOM 197 H LYS A 13 -2.681 -5.171 7.848 1.00 0.00 H ATOM 198 HA LYS A 13 -5.391 -4.418 7.907 1.00 0.00 H ATOM 199 HB2 LYS A 13 -5.804 -6.254 6.385 1.00 0.00 H ATOM 200 HB3 LYS A 13 -4.321 -5.430 5.927 1.00 0.00 H ATOM 201 HG2 LYS A 13 -3.034 -7.212 7.063 1.00 0.00 H ATOM 202 HG3 LYS A 13 -4.547 -8.053 7.391 1.00 0.00 H ATOM 203 HD2 LYS A 13 -3.382 -7.417 4.684 1.00 0.00 H ATOM 204 HD3 LYS A 13 -3.508 -9.007 5.436 1.00 0.00 H ATOM 205 HE2 LYS A 13 -5.847 -7.250 4.702 1.00 0.00 H ATOM 206 HE3 LYS A 13 -5.250 -8.590 3.725 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -7.212 -9.013 5.282 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -6.077 -9.004 6.536 1.00 0.00 H ATOM 209 HZ3 LYS A 13 -5.951 -10.140 5.289 1.00 0.00 H ATOM 210 N LYS A 14 -4.670 -7.174 9.570 1.00 0.00 N ATOM 211 CA LYS A 14 -5.153 -8.115 10.580 1.00 0.00 C ATOM 212 C LYS A 14 -5.600 -7.411 11.860 1.00 0.00 C ATOM 213 O LYS A 14 -6.626 -7.765 12.430 1.00 0.00 O ATOM 214 CB LYS A 14 -4.065 -9.142 10.919 1.00 0.00 C ATOM 215 CG LYS A 14 -4.481 -10.175 11.963 1.00 0.00 C ATOM 216 CD LYS A 14 -5.128 -11.408 11.337 1.00 0.00 C ATOM 217 CE LYS A 14 -6.525 -11.132 10.792 1.00 0.00 C ATOM 218 NZ LYS A 14 -7.512 -10.882 11.847 1.00 0.00 N1+ ATOM 219 H LYS A 14 -3.754 -7.271 9.232 1.00 0.00 H ATOM 220 HA LYS A 14 -5.998 -8.633 10.162 1.00 0.00 H ATOM 221 HB2 LYS A 14 -3.791 -9.669 10.016 1.00 0.00 H ATOM 222 HB3 LYS A 14 -3.197 -8.615 11.292 1.00 0.00 H ATOM 223 HG2 LYS A 14 -3.606 -10.482 12.514 1.00 0.00 H ATOM 224 HG3 LYS A 14 -5.188 -9.715 12.639 1.00 0.00 H ATOM 225 HD2 LYS A 14 -4.503 -11.750 10.525 1.00 0.00 H ATOM 226 HD3 LYS A 14 -5.191 -12.183 12.086 1.00 0.00 H ATOM 227 HE2 LYS A 14 -6.481 -10.270 10.146 1.00 0.00 H ATOM 228 HE3 LYS A 14 -6.844 -11.990 10.217 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -7.451 -11.416 12.667 1.00 0.00 H ATOM 230 N LYS A 15 -4.818 -6.438 12.323 1.00 0.00 N ATOM 231 CA LYS A 15 -5.144 -5.723 13.559 1.00 0.00 C ATOM 232 C LYS A 15 -6.426 -4.904 13.429 1.00 0.00 C ATOM 233 O LYS A 15 -7.306 -4.980 14.286 1.00 0.00 O ATOM 234 CB LYS A 15 -3.987 -4.811 13.975 1.00 0.00 C ATOM 235 CG LYS A 15 -4.176 -4.181 15.349 1.00 0.00 C ATOM 236 CD LYS A 15 -4.220 -5.238 16.444 1.00 0.00 C ATOM 237 CE LYS A 15 -2.926 -6.039 16.504 1.00 0.00 C ATOM 238 NZ LYS A 15 -2.944 -7.049 17.600 1.00 0.00 N1+ ATOM 239 H LYS A 15 -3.999 -6.209 11.835 1.00 0.00 H ATOM 240 HA LYS A 15 -5.293 -6.461 14.330 1.00 0.00 H ATOM 241 HB2 LYS A 15 -3.075 -5.390 13.990 1.00 0.00 H ATOM 242 HB3 LYS A 15 -3.888 -4.018 13.250 1.00 0.00 H ATOM 243 HG2 LYS A 15 -3.354 -3.508 15.544 1.00 0.00 H ATOM 244 HG3 LYS A 15 -5.105 -3.629 15.356 1.00 0.00 H ATOM 245 HD2 LYS A 15 -4.377 -4.752 17.395 1.00 0.00 H ATOM 246 HD3 LYS A 15 -5.039 -5.913 16.243 1.00 0.00 H ATOM 247 HE2 LYS A 15 -2.791 -6.549 15.562 1.00 0.00 H ATOM 248 HE3 LYS A 15 -2.101 -5.359 16.664 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -2.089 -7.639 17.557 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -3.780 -7.661 17.508 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -2.978 -6.572 18.524 1.00 0.00 H ATOM 252 N ASN A 16 -6.520 -4.110 12.367 1.00 0.00 N ATOM 253 CA ASN A 16 -7.693 -3.262 12.146 1.00 0.00 C ATOM 254 C ASN A 16 -8.957 -4.088 11.887 1.00 0.00 C ATOM 255 O ASN A 16 -10.015 -3.812 12.455 1.00 0.00 O ATOM 256 CB ASN A 16 -7.442 -2.297 10.983 1.00 0.00 C ATOM 257 CG ASN A 16 -6.302 -1.332 11.263 1.00 0.00 C ATOM 258 OD1 ASN A 16 -5.167 -1.746 11.505 1.00 0.00 O ATOM 259 ND2 ASN A 16 -6.597 -0.040 11.237 1.00 0.00 N ATOM 260 H ASN A 16 -5.779 -4.085 11.724 1.00 0.00 H ATOM 261 HA ASN A 16 -7.845 -2.683 13.044 1.00 0.00 H ATOM 262 HB2 ASN A 16 -7.197 -2.864 10.099 1.00 0.00 H ATOM 263 HB3 ASN A 16 -8.337 -1.722 10.799 1.00 0.00 H ATOM 264 HD21 ASN A 16 -7.519 0.222 11.038 1.00 0.00 H ATOM 265 HD22 ASN A 16 -5.877 0.601 11.414 1.00 0.00 H ATOM 266 N GLN A 17 -8.838 -5.094 11.026 1.00 0.00 N ATOM 267 CA GLN A 17 -9.960 -5.968 10.673 1.00 0.00 C ATOM 268 C GLN A 17 -10.270 -6.994 11.771 1.00 0.00 C ATOM 269 O GLN A 17 -11.421 -7.405 11.932 1.00 0.00 O ATOM 270 CB GLN A 17 -9.646 -6.676 9.349 1.00 0.00 C ATOM 271 CG GLN A 17 -10.605 -7.798 8.967 1.00 0.00 C ATOM 272 CD GLN A 17 -10.228 -8.443 7.646 1.00 0.00 C ATOM 273 OE1 GLN A 17 -10.365 -7.830 6.585 1.00 0.00 O ATOM 274 NE2 GLN A 17 -9.727 -9.673 7.701 1.00 0.00 N ATOM 275 H GLN A 17 -7.964 -5.255 10.610 1.00 0.00 H ATOM 276 HA GLN A 17 -10.829 -5.344 10.531 1.00 0.00 H ATOM 277 HB2 GLN A 17 -9.665 -5.943 8.557 1.00 0.00 H ATOM 278 HB3 GLN A 17 -8.651 -7.092 9.410 1.00 0.00 H ATOM 279 HG2 GLN A 17 -10.582 -8.554 9.737 1.00 0.00 H ATOM 280 HG3 GLN A 17 -11.603 -7.394 8.885 1.00 0.00 H ATOM 281 HE21 GLN A 17 -9.627 -10.096 8.580 1.00 0.00 H ATOM 282 HE22 GLN A 17 -9.477 -10.108 6.859 1.00 0.00 H ATOM 283 N ASP A 18 -9.239 -7.429 12.499 1.00 0.00 N ATOM 284 CA ASP A 18 -9.402 -8.440 13.552 1.00 0.00 C ATOM 285 C ASP A 18 -8.289 -8.365 14.603 1.00 0.00 C ATOM 286 O ASP A 18 -7.515 -9.308 14.774 1.00 0.00 O ATOM 287 CB ASP A 18 -9.438 -9.839 12.918 1.00 0.00 C ATOM 288 CG ASP A 18 -8.482 -9.977 11.737 1.00 0.00 C ATOM 289 OD1 ASP A 18 -8.623 -9.280 10.731 1.00 0.00 O ATOM 290 H ASP A 18 -8.341 -7.083 12.308 1.00 0.00 H ATOM 291 HA ASP A 18 -10.348 -8.257 14.038 1.00 0.00 H ATOM 292 HB2 ASP A 18 -9.166 -10.572 13.665 1.00 0.00 H ATOM 293 HB3 ASP A 18 -10.439 -10.041 12.569 1.00 0.00 H HETATM 294 N NH2 A 19 -8.227 -7.256 15.330 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -8.870 -6.540 15.145 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -7.539 -7.200 16.027 1.00 0.00 H TER 297 NH2 A 19 ENDMDL CONECT 84 158 CONECT 158 84 CONECT 218 288 CONECT 288 218 CONECT 294 295 296 CONECT 295 294 CONECT 296 294 MASTER 124 0 1 1 0 0 0 6 146 1 7 2 END