HEADER NEUROPEPTIDE INHIBITOR 23-JUL-09 SMS20089 TITLE SOLUTION STRUCTURE OF NOCICEPTIN ANALOGUE(FORM III) 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,G.RUIZ-GOMEZ 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 SMS20089. 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 41.75 -83.99 REMARK 500 3 THR A 5 -57.92 -154.41 REMARK 500 4 PHE A 4 138.35 68.39 REMARK 500 5 PHE A 4 45.38 -168.76 REMARK 500 5 LYS A 7 32.75 -95.02 REMARK 500 7 PHE A 4 49.19 -155.65 REMARK 500 7 THR A 5 -38.93 -153.51 REMARK 500 8 PHE A 4 89.64 59.87 REMARK 500 9 PHE A 4 138.58 68.32 REMARK 500 11 PHE A 4 -155.41 -166.17 REMARK 500 12 PHE A 4 117.62 -166.23 REMARK 500 12 THR A 5 -32.37 165.61 REMARK 500 14 PHE A 4 64.06 -161.16 REMARK 500 14 THR A 5 -73.12 60.82 REMARK 500 14 GLN A 17 23.70 -79.47 REMARK 500 15 PHE A 4 116.92 71.56 REMARK 500 15 THR A 5 -82.05 -163.50 REMARK 500 18 LYS A 7 37.09 -96.21 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20089 RELATED DB: BMRB REMARK 900 RELATED ID: 20086 RELATED DB: BMRB REMARK 900 NOCICEPTIN AGONIST REMARK 900 RELATED ID: 20087 RELATED DB: BMRB REMARK 900 NOCICEPTIN ANALOGUE(FORM I) REMARK 900 RELATED ID: 20088 RELATED DB: BMRB REMARK 900 NOCICEPTIN ANALOGUE(FORM II) DBREF A 1 18 BMRB SMS20089 SMS20089 1 18 SEQADV NH2 A 19 BMRB SMS20089 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 THR A 5 ASP A 18 1 14 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 24.818 -8.231 8.558 1.00 0.00 N ATOM 2 CA PHE A 1 24.310 -7.954 7.218 1.00 0.00 C ATOM 3 C PHE A 1 24.391 -6.466 6.893 1.00 0.00 C ATOM 4 O PHE A 1 23.926 -5.624 7.668 1.00 0.00 O ATOM 5 CB PHE A 1 22.856 -8.424 7.081 1.00 0.00 C ATOM 6 CG PHE A 1 22.683 -9.919 7.009 1.00 0.00 C ATOM 7 CD1 PHE A 1 23.331 -10.760 7.902 1.00 0.00 C ATOM 8 CD2 PHE A 1 21.866 -10.482 6.040 1.00 0.00 C ATOM 9 CE1 PHE A 1 23.165 -12.130 7.830 1.00 0.00 C ATOM 10 CE2 PHE A 1 21.697 -11.850 5.965 1.00 0.00 C ATOM 11 CZ PHE A 1 22.348 -12.676 6.860 1.00 0.00 C ATOM 12 H1 PHE A 1 25.658 -8.726 8.659 1.00 0.00 H ATOM 13 HA PHE A 1 24.920 -8.498 6.513 1.00 0.00 H ATOM 14 HB2 PHE A 1 22.293 -8.070 7.932 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.437 -7.997 6.181 1.00 0.00 H ATOM 16 HD1 PHE A 1 23.970 -10.335 8.661 1.00 0.00 H ATOM 17 HD2 PHE A 1 21.355 -9.837 5.339 1.00 0.00 H ATOM 18 HE1 PHE A 1 23.675 -12.773 8.531 1.00 0.00 H ATOM 19 HE2 PHE A 1 21.057 -12.275 5.206 1.00 0.00 H ATOM 20 HZ PHE A 1 22.217 -13.746 6.802 1.00 0.00 H ATOM 21 N GLY A 2 24.968 -6.149 5.734 1.00 0.00 N ATOM 22 CA GLY A 2 25.083 -4.764 5.312 1.00 0.00 C ATOM 23 C GLY A 2 23.823 -4.276 4.624 1.00 0.00 C ATOM 24 O GLY A 2 23.250 -3.257 5.014 1.00 0.00 O ATOM 25 H GLY A 2 25.306 -6.863 5.154 1.00 0.00 H ATOM 26 HA2 GLY A 2 25.274 -4.147 6.178 1.00 0.00 H ATOM 27 HA3 GLY A 2 25.913 -4.674 4.626 1.00 0.00 H ATOM 28 N GLY A 3 23.387 -5.016 3.602 1.00 0.00 N ATOM 29 CA GLY A 3 22.184 -4.658 2.872 1.00 0.00 C ATOM 30 C GLY A 3 20.919 -5.031 3.623 1.00 0.00 C ATOM 31 O GLY A 3 20.857 -6.085 4.260 1.00 0.00 O ATOM 32 H GLY A 3 23.885 -5.821 3.347 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.184 -3.592 2.698 1.00 0.00 H ATOM 34 HA3 GLY A 3 22.187 -5.167 1.920 1.00 0.00 H ATOM 35 N PHE A 4 19.911 -4.163 3.550 1.00 0.00 N ATOM 36 CA PHE A 4 18.637 -4.398 4.230 1.00 0.00 C ATOM 37 C PHE A 4 17.529 -3.515 3.655 1.00 0.00 C ATOM 38 O PHE A 4 17.773 -2.377 3.248 1.00 0.00 O ATOM 39 CB PHE A 4 18.785 -4.180 5.745 1.00 0.00 C ATOM 40 CG PHE A 4 19.520 -2.922 6.132 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.994 -1.672 5.847 1.00 0.00 C ATOM 42 CD2 PHE A 4 20.737 -2.994 6.794 1.00 0.00 C ATOM 43 CE1 PHE A 4 19.667 -0.521 6.211 1.00 0.00 C ATOM 44 CE2 PHE A 4 21.413 -1.846 7.161 1.00 0.00 C ATOM 45 CZ PHE A 4 20.878 -0.608 6.868 1.00 0.00 C ATOM 46 H PHE A 4 20.026 -3.341 3.028 1.00 0.00 H ATOM 47 HA PHE A 4 18.368 -5.430 4.057 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.803 -4.134 6.188 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.320 -5.019 6.166 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.048 -1.600 5.335 1.00 0.00 H ATOM 51 HD2 PHE A 4 21.159 -3.962 7.022 1.00 0.00 H ATOM 52 HE1 PHE A 4 19.246 0.446 5.980 1.00 0.00 H ATOM 53 HE2 PHE A 4 22.360 -1.917 7.677 1.00 0.00 H ATOM 54 HZ PHE A 4 21.404 0.291 7.154 1.00 0.00 H ATOM 55 N THR A 5 16.310 -4.059 3.606 1.00 0.00 N ATOM 56 CA THR A 5 15.157 -3.336 3.063 1.00 0.00 C ATOM 57 C THR A 5 14.503 -2.415 4.104 1.00 0.00 C ATOM 58 O THR A 5 13.274 -2.328 4.180 1.00 0.00 O ATOM 59 CB THR A 5 14.093 -4.312 2.513 1.00 0.00 C ATOM 60 OG1 THR A 5 13.618 -5.169 3.560 1.00 0.00 O ATOM 61 CG2 THR A 5 14.662 -5.158 1.381 1.00 0.00 C ATOM 62 H THR A 5 16.185 -4.976 3.933 1.00 0.00 H ATOM 63 HA THR A 5 15.509 -2.730 2.241 1.00 0.00 H ATOM 64 HB THR A 5 13.264 -3.736 2.127 1.00 0.00 H ATOM 65 HG1 THR A 5 12.729 -4.907 3.810 1.00 0.00 H ATOM 66 HG21 THR A 5 13.891 -5.811 0.999 1.00 0.00 H ATOM 67 HG22 THR A 5 15.482 -5.751 1.753 1.00 0.00 H ATOM 68 HG23 THR A 5 15.013 -4.514 0.589 1.00 0.00 H ATOM 69 N GLY A 6 15.325 -1.715 4.893 1.00 0.00 N ATOM 70 CA GLY A 6 14.801 -0.806 5.902 1.00 0.00 C ATOM 71 C GLY A 6 13.883 0.250 5.310 1.00 0.00 C ATOM 72 O GLY A 6 12.852 0.587 5.897 1.00 0.00 O ATOM 73 H GLY A 6 16.291 -1.809 4.783 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.250 -1.378 6.633 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.628 -0.314 6.393 1.00 0.00 H ATOM 76 N LYS A 7 14.262 0.760 4.136 1.00 0.00 N ATOM 77 CA LYS A 7 13.481 1.776 3.432 1.00 0.00 C ATOM 78 C LYS A 7 12.076 1.270 3.082 1.00 0.00 C ATOM 79 O LYS A 7 11.106 2.027 3.158 1.00 0.00 O ATOM 80 CB LYS A 7 14.225 2.212 2.160 1.00 0.00 C ATOM 81 CG LYS A 7 13.364 2.982 1.169 1.00 0.00 C ATOM 82 CD LYS A 7 12.825 4.273 1.764 1.00 0.00 C ATOM 83 CE LYS A 7 11.648 4.796 0.958 1.00 0.00 C ATOM 84 NZ LYS A 7 10.514 3.878 1.018 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.092 0.437 3.726 1.00 0.00 H ATOM 86 HA LYS A 7 13.387 2.627 4.088 1.00 0.00 H ATOM 87 HB2 LYS A 7 15.056 2.841 2.441 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.605 1.332 1.662 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.960 3.221 0.301 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.533 2.358 0.873 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.499 4.085 2.776 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.609 5.016 1.765 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.349 5.754 1.358 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.953 4.914 -0.072 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.709 2.917 1.010 1.00 0.00 H ATOM 96 N ARG A 8 11.972 -0.006 2.699 1.00 0.00 N ATOM 97 CA ARG A 8 10.684 -0.597 2.336 1.00 0.00 C ATOM 98 C ARG A 8 9.703 -0.571 3.502 1.00 0.00 C ATOM 99 O ARG A 8 8.525 -0.268 3.321 1.00 0.00 O ATOM 100 CB ARG A 8 10.863 -2.032 1.833 1.00 0.00 C ATOM 101 CG ARG A 8 11.309 -2.114 0.382 1.00 0.00 C ATOM 102 CD ARG A 8 11.417 -3.557 -0.091 1.00 0.00 C ATOM 103 NE ARG A 8 11.574 -3.650 -1.543 1.00 0.00 N ATOM 104 CZ ARG A 8 12.638 -3.204 -2.221 1.00 0.00 C ATOM 105 NH1 ARG A 8 13.696 -2.712 -1.579 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 12.651 -3.274 -3.548 1.00 0.00 N ATOM 107 H ARG A 8 12.780 -0.561 2.661 1.00 0.00 H ATOM 108 HA ARG A 8 10.273 -0.002 1.536 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.604 -2.525 2.444 1.00 0.00 H ATOM 110 HB3 ARG A 8 9.923 -2.556 1.929 1.00 0.00 H ATOM 111 HG2 ARG A 8 10.589 -1.597 -0.234 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.275 -1.639 0.286 1.00 0.00 H ATOM 113 HD2 ARG A 8 12.271 -4.015 0.384 1.00 0.00 H ATOM 114 HD3 ARG A 8 10.519 -4.085 0.199 1.00 0.00 H ATOM 115 HE ARG A 8 10.832 -4.045 -2.048 1.00 0.00 H ATOM 116 HH11 ARG A 8 13.706 -2.675 -0.580 1.00 0.00 H ATOM 117 HH12 ARG A 8 14.484 -2.377 -2.098 1.00 0.00 H ATOM 118 HH21 ARG A 8 11.867 -3.659 -4.037 1.00 0.00 H ATOM 119 HH22 ARG A 8 13.442 -2.938 -4.060 1.00 0.00 H ATOM 120 N LYS A 9 10.188 -0.891 4.695 1.00 0.00 N ATOM 121 CA LYS A 9 9.332 -0.901 5.881 1.00 0.00 C ATOM 122 C LYS A 9 8.567 0.415 6.016 1.00 0.00 C ATOM 123 O LYS A 9 7.354 0.417 6.233 1.00 0.00 O ATOM 124 CB LYS A 9 10.154 -1.154 7.151 1.00 0.00 C ATOM 125 CG LYS A 9 10.896 -2.482 7.145 1.00 0.00 C ATOM 126 CD LYS A 9 11.496 -2.816 8.508 1.00 0.00 C ATOM 127 CE LYS A 9 12.630 -1.871 8.898 1.00 0.00 C ATOM 128 NZ LYS A 9 12.146 -0.512 9.279 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.136 -1.126 4.779 1.00 0.00 H ATOM 130 HA LYS A 9 8.620 -1.702 5.763 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.879 -0.362 7.259 1.00 0.00 H ATOM 132 HB3 LYS A 9 9.491 -1.141 8.005 1.00 0.00 H ATOM 133 HG2 LYS A 9 10.207 -3.265 6.870 1.00 0.00 H ATOM 134 HG3 LYS A 9 11.692 -2.431 6.416 1.00 0.00 H ATOM 135 HD2 LYS A 9 10.720 -2.750 9.255 1.00 0.00 H ATOM 136 HD3 LYS A 9 11.880 -3.826 8.478 1.00 0.00 H ATOM 137 HE2 LYS A 9 13.160 -2.299 9.736 1.00 0.00 H ATOM 138 HE3 LYS A 9 13.305 -1.780 8.060 1.00 0.00 H ATOM 139 HZ1 LYS A 9 12.660 -0.175 10.119 1.00 0.00 H ATOM 140 HZ2 LYS A 9 11.130 -0.538 9.498 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.305 0.156 8.499 1.00 0.00 H ATOM 142 N SER A 10 9.286 1.530 5.892 1.00 0.00 N ATOM 143 CA SER A 10 8.683 2.858 6.007 1.00 0.00 C ATOM 144 C SER A 10 7.718 3.147 4.855 1.00 0.00 C ATOM 145 O SER A 10 6.567 3.524 5.085 1.00 0.00 O ATOM 146 CB SER A 10 9.776 3.930 6.059 1.00 0.00 C ATOM 147 OG SER A 10 9.217 5.228 6.180 1.00 0.00 O ATOM 148 H SER A 10 10.248 1.457 5.725 1.00 0.00 H ATOM 149 HA SER A 10 8.129 2.885 6.931 1.00 0.00 H ATOM 150 HB2 SER A 10 10.415 3.748 6.909 1.00 0.00 H ATOM 151 HB3 SER A 10 10.363 3.887 5.152 1.00 0.00 H ATOM 152 HG SER A 10 9.152 5.632 5.312 1.00 0.00 H ATOM 153 N ASP A 11 8.193 2.978 3.620 1.00 0.00 N ATOM 154 CA ASP A 11 7.369 3.231 2.436 1.00 0.00 C ATOM 155 C ASP A 11 6.190 2.262 2.346 1.00 0.00 C ATOM 156 O ASP A 11 5.088 2.663 1.969 1.00 0.00 O ATOM 157 CB ASP A 11 8.212 3.159 1.159 1.00 0.00 C ATOM 158 CG ASP A 11 9.247 4.267 1.092 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.907 5.452 1.115 1.00 0.00 O ATOM 160 H ASP A 11 9.119 2.682 3.503 1.00 0.00 H ATOM 161 HA ASP A 11 6.975 4.231 2.529 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.726 2.209 1.126 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.564 3.243 0.299 1.00 0.00 H ATOM 164 N ARG A 12 6.419 0.991 2.690 1.00 0.00 N ATOM 165 CA ARG A 12 5.356 -0.015 2.641 1.00 0.00 C ATOM 166 C ARG A 12 4.191 0.397 3.536 1.00 0.00 C ATOM 167 O ARG A 12 3.042 0.415 3.093 1.00 0.00 O ATOM 168 CB ARG A 12 5.889 -1.396 3.044 1.00 0.00 C ATOM 169 CG ARG A 12 4.880 -2.524 2.863 1.00 0.00 C ATOM 170 CD ARG A 12 3.894 -2.596 4.021 1.00 0.00 C ATOM 171 NE ARG A 12 4.566 -2.881 5.291 1.00 0.00 N ATOM 172 CZ ARG A 12 5.151 -4.048 5.586 1.00 0.00 C ATOM 173 NH1 ARG A 12 5.084 -5.071 4.739 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 5.795 -4.197 6.739 1.00 0.00 N ATOM 175 H ARG A 12 7.317 0.728 2.983 1.00 0.00 H ATOM 176 HA ARG A 12 5.001 -0.063 1.626 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.759 -1.622 2.445 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.179 -1.366 4.085 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.330 -2.356 1.948 1.00 0.00 H ATOM 180 HG3 ARG A 12 5.412 -3.460 2.795 1.00 0.00 H ATOM 181 HD2 ARG A 12 3.376 -1.653 4.100 1.00 0.00 H ATOM 182 HD3 ARG A 12 3.179 -3.381 3.819 1.00 0.00 H ATOM 183 HE ARG A 12 4.606 -2.156 5.949 1.00 0.00 H ATOM 184 HH11 ARG A 12 4.593 -4.976 3.874 1.00 0.00 H ATOM 185 HH12 ARG A 12 5.529 -5.938 4.966 1.00 0.00 H ATOM 186 HH21 ARG A 12 5.845 -3.438 7.386 1.00 0.00 H ATOM 187 HH22 ARG A 12 6.231 -5.070 6.961 1.00 0.00 H ATOM 188 N LYS A 13 4.495 0.753 4.785 1.00 0.00 N ATOM 189 CA LYS A 13 3.466 1.192 5.728 1.00 0.00 C ATOM 190 C LYS A 13 2.746 2.433 5.201 1.00 0.00 C ATOM 191 O LYS A 13 1.543 2.589 5.398 1.00 0.00 O ATOM 192 CB LYS A 13 4.073 1.494 7.103 1.00 0.00 C ATOM 193 CG LYS A 13 4.645 0.277 7.816 1.00 0.00 C ATOM 194 CD LYS A 13 3.586 -0.791 8.047 1.00 0.00 C ATOM 195 CE LYS A 13 4.128 -1.941 8.882 1.00 0.00 C ATOM 196 NZ LYS A 13 3.186 -3.094 8.929 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.431 0.736 5.072 1.00 0.00 H ATOM 198 HA LYS A 13 2.748 0.392 5.829 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.869 2.215 6.980 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.308 1.925 7.733 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.435 -0.142 7.213 1.00 0.00 H ATOM 202 HG3 LYS A 13 5.045 0.588 8.771 1.00 0.00 H ATOM 203 HD2 LYS A 13 2.747 -0.349 8.565 1.00 0.00 H ATOM 204 HD3 LYS A 13 3.259 -1.174 7.091 1.00 0.00 H ATOM 205 HE2 LYS A 13 5.062 -2.268 8.456 1.00 0.00 H ATOM 206 HE3 LYS A 13 4.298 -1.587 9.889 1.00 0.00 H ATOM 207 HZ1 LYS A 13 3.666 -3.932 9.315 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.844 -3.316 7.972 1.00 0.00 H ATOM 209 HZ3 LYS A 13 2.370 -2.866 9.532 1.00 0.00 H ATOM 210 N LYS A 14 3.496 3.314 4.535 1.00 0.00 N ATOM 211 CA LYS A 14 2.938 4.548 3.982 1.00 0.00 C ATOM 212 C LYS A 14 1.921 4.259 2.872 1.00 0.00 C ATOM 213 O LYS A 14 0.757 4.638 2.984 1.00 0.00 O ATOM 214 CB LYS A 14 4.071 5.443 3.452 1.00 0.00 C ATOM 215 CG LYS A 14 3.611 6.704 2.720 1.00 0.00 C ATOM 216 CD LYS A 14 3.184 7.822 3.669 1.00 0.00 C ATOM 217 CE LYS A 14 1.884 7.510 4.401 1.00 0.00 C ATOM 218 NZ LYS A 14 0.794 7.181 3.482 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.452 3.131 4.417 1.00 0.00 H ATOM 220 HA LYS A 14 2.434 5.062 4.781 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.684 5.749 4.286 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.677 4.864 2.772 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.426 7.065 2.112 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.778 6.450 2.083 1.00 0.00 H ATOM 225 HD2 LYS A 14 3.964 7.973 4.400 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.053 8.730 3.097 1.00 0.00 H ATOM 227 HE2 LYS A 14 2.049 6.674 5.062 1.00 0.00 H ATOM 228 HE3 LYS A 14 1.602 8.375 4.984 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.027 6.687 2.669 1.00 0.00 H ATOM 230 N LYS A 15 2.362 3.593 1.802 1.00 0.00 N ATOM 231 CA LYS A 15 1.472 3.280 0.677 1.00 0.00 C ATOM 232 C LYS A 15 0.267 2.447 1.117 1.00 0.00 C ATOM 233 O LYS A 15 -0.846 2.662 0.636 1.00 0.00 O ATOM 234 CB LYS A 15 2.225 2.574 -0.462 1.00 0.00 C ATOM 235 CG LYS A 15 2.940 1.290 -0.064 1.00 0.00 C ATOM 236 CD LYS A 15 3.444 0.545 -1.294 1.00 0.00 C ATOM 237 CE LYS A 15 4.341 -0.629 -0.926 1.00 0.00 C ATOM 238 NZ LYS A 15 5.701 -0.187 -0.505 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.300 3.316 1.764 1.00 0.00 H ATOM 240 HA LYS A 15 1.102 4.222 0.302 1.00 0.00 H ATOM 241 HB2 LYS A 15 1.518 2.331 -1.241 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.960 3.256 -0.864 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.781 1.535 0.567 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.253 0.656 0.475 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.595 0.173 -1.847 1.00 0.00 H ATOM 246 HD3 LYS A 15 4.003 1.232 -1.912 1.00 0.00 H ATOM 247 HE2 LYS A 15 3.883 -1.175 -0.114 1.00 0.00 H ATOM 248 HE3 LYS A 15 4.432 -1.277 -1.786 1.00 0.00 H ATOM 249 HZ1 LYS A 15 6.112 -0.878 0.156 1.00 0.00 H ATOM 250 HZ2 LYS A 15 5.651 0.738 -0.034 1.00 0.00 H ATOM 251 HZ3 LYS A 15 6.324 -0.107 -1.334 1.00 0.00 H ATOM 252 N ASN A 16 0.489 1.501 2.030 1.00 0.00 N ATOM 253 CA ASN A 16 -0.591 0.644 2.528 1.00 0.00 C ATOM 254 C ASN A 16 -1.563 1.413 3.428 1.00 0.00 C ATOM 255 O ASN A 16 -2.779 1.271 3.297 1.00 0.00 O ATOM 256 CB ASN A 16 -0.024 -0.560 3.287 1.00 0.00 C ATOM 257 CG ASN A 16 0.585 -1.600 2.362 1.00 0.00 C ATOM 258 OD1 ASN A 16 1.525 -1.316 1.619 1.00 0.00 O ATOM 259 ND2 ASN A 16 0.047 -2.815 2.399 1.00 0.00 N ATOM 260 H ASN A 16 1.399 1.378 2.378 1.00 0.00 H ATOM 261 HA ASN A 16 -1.136 0.284 1.671 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.742 -0.221 3.968 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.818 -1.028 3.850 1.00 0.00 H ATOM 264 HD21 ASN A 16 -0.702 -2.973 3.013 1.00 0.00 H ATOM 265 HD22 ASN A 16 0.420 -3.504 1.811 1.00 0.00 H ATOM 266 N GLN A 17 -1.020 2.212 4.349 1.00 0.00 N ATOM 267 CA GLN A 17 -1.840 2.990 5.285 1.00 0.00 C ATOM 268 C GLN A 17 -2.618 4.098 4.570 1.00 0.00 C ATOM 269 O GLN A 17 -3.844 4.164 4.667 1.00 0.00 O ATOM 270 CB GLN A 17 -0.952 3.590 6.386 1.00 0.00 C ATOM 271 CG GLN A 17 -1.715 4.238 7.537 1.00 0.00 C ATOM 272 CD GLN A 17 -2.443 5.507 7.134 1.00 0.00 C ATOM 273 OE1 GLN A 17 -1.826 6.476 6.693 1.00 0.00 O ATOM 274 NE2 GLN A 17 -3.764 5.510 7.291 1.00 0.00 N ATOM 275 H GLN A 17 -0.043 2.271 4.410 1.00 0.00 H ATOM 276 HA GLN A 17 -2.546 2.314 5.740 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.334 2.806 6.796 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.313 4.340 5.942 1.00 0.00 H ATOM 279 HG2 GLN A 17 -2.441 3.533 7.912 1.00 0.00 H ATOM 280 HG3 GLN A 17 -1.013 4.478 8.323 1.00 0.00 H ATOM 281 HE21 GLN A 17 -4.191 4.704 7.652 1.00 0.00 H ATOM 282 HE22 GLN A 17 -4.257 6.319 7.041 1.00 0.00 H ATOM 283 N ASP A 18 -1.899 4.969 3.861 1.00 0.00 N ATOM 284 CA ASP A 18 -2.523 6.081 3.140 1.00 0.00 C ATOM 285 C ASP A 18 -3.388 5.568 1.988 1.00 0.00 C ATOM 286 O ASP A 18 -4.595 5.807 1.952 1.00 0.00 O ATOM 287 CB ASP A 18 -1.457 7.049 2.607 1.00 0.00 C ATOM 288 CG ASP A 18 -0.483 7.500 3.685 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.877 8.113 4.679 1.00 0.00 O ATOM 290 H ASP A 18 -0.925 4.864 3.828 1.00 0.00 H ATOM 291 HA ASP A 18 -3.157 6.610 3.837 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.895 6.560 1.825 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.945 7.923 2.200 1.00 0.00 H HETATM 294 N NH2 A 19 -2.772 4.856 1.047 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.808 4.703 1.137 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.309 4.513 0.303 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 2 ATOM 1 N PHE A 1 23.126 -8.298 11.303 1.00 0.00 N ATOM 2 CA PHE A 1 23.135 -8.272 9.844 1.00 0.00 C ATOM 3 C PHE A 1 23.104 -6.835 9.320 1.00 0.00 C ATOM 4 O PHE A 1 22.411 -5.977 9.873 1.00 0.00 O ATOM 5 CB PHE A 1 21.951 -9.077 9.286 1.00 0.00 C ATOM 6 CG PHE A 1 20.598 -8.584 9.732 1.00 0.00 C ATOM 7 CD1 PHE A 1 20.055 -7.422 9.203 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.872 -9.282 10.684 1.00 0.00 C ATOM 9 CE1 PHE A 1 18.817 -6.967 9.616 1.00 0.00 C ATOM 10 CE2 PHE A 1 18.634 -8.832 11.101 1.00 0.00 C ATOM 11 CZ PHE A 1 18.105 -7.674 10.565 1.00 0.00 C ATOM 12 H1 PHE A 1 22.408 -7.839 11.786 1.00 0.00 H ATOM 13 HA PHE A 1 24.053 -8.736 9.517 1.00 0.00 H ATOM 14 HB2 PHE A 1 21.975 -9.037 8.208 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.049 -10.107 9.601 1.00 0.00 H ATOM 16 HD1 PHE A 1 20.610 -6.870 8.459 1.00 0.00 H ATOM 17 HD2 PHE A 1 20.283 -10.189 11.104 1.00 0.00 H ATOM 18 HE1 PHE A 1 18.407 -6.061 9.197 1.00 0.00 H ATOM 19 HE2 PHE A 1 18.078 -9.386 11.843 1.00 0.00 H ATOM 20 HZ PHE A 1 17.138 -7.320 10.889 1.00 0.00 H ATOM 21 N GLY A 2 23.868 -6.580 8.257 1.00 0.00 N ATOM 22 CA GLY A 2 23.921 -5.247 7.678 1.00 0.00 C ATOM 23 C GLY A 2 22.585 -4.802 7.108 1.00 0.00 C ATOM 24 O GLY A 2 21.949 -5.542 6.353 1.00 0.00 O ATOM 25 H GLY A 2 24.402 -7.302 7.864 1.00 0.00 H ATOM 26 HA2 GLY A 2 24.225 -4.547 8.443 1.00 0.00 H ATOM 27 HA3 GLY A 2 24.656 -5.240 6.887 1.00 0.00 H ATOM 28 N GLY A 3 22.162 -3.589 7.467 1.00 0.00 N ATOM 29 CA GLY A 3 20.898 -3.056 6.980 1.00 0.00 C ATOM 30 C GLY A 3 20.893 -2.856 5.476 1.00 0.00 C ATOM 31 O GLY A 3 21.905 -2.452 4.894 1.00 0.00 O ATOM 32 H GLY A 3 22.715 -3.046 8.068 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.106 -3.741 7.244 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.711 -2.106 7.459 1.00 0.00 H ATOM 35 N PHE A 4 19.756 -3.144 4.842 1.00 0.00 N ATOM 36 CA PHE A 4 19.630 -3.000 3.394 1.00 0.00 C ATOM 37 C PHE A 4 18.163 -2.987 2.961 1.00 0.00 C ATOM 38 O PHE A 4 17.324 -3.662 3.560 1.00 0.00 O ATOM 39 CB PHE A 4 20.374 -4.135 2.682 1.00 0.00 C ATOM 40 CG PHE A 4 20.410 -3.991 1.185 1.00 0.00 C ATOM 41 CD1 PHE A 4 20.911 -2.840 0.596 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.939 -5.006 0.369 1.00 0.00 C ATOM 43 CE1 PHE A 4 20.942 -2.706 -0.778 1.00 0.00 C ATOM 44 CE2 PHE A 4 19.968 -4.876 -1.007 1.00 0.00 C ATOM 45 CZ PHE A 4 20.470 -3.725 -1.581 1.00 0.00 C ATOM 46 H PHE A 4 18.987 -3.465 5.359 1.00 0.00 H ATOM 47 HA PHE A 4 20.081 -2.059 3.117 1.00 0.00 H ATOM 48 HB2 PHE A 4 21.394 -4.164 3.037 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.893 -5.073 2.916 1.00 0.00 H ATOM 50 HD1 PHE A 4 21.282 -2.042 1.222 1.00 0.00 H ATOM 51 HD2 PHE A 4 19.546 -5.906 0.816 1.00 0.00 H ATOM 52 HE1 PHE A 4 21.336 -1.804 -1.225 1.00 0.00 H ATOM 53 HE2 PHE A 4 19.598 -5.674 -1.632 1.00 0.00 H ATOM 54 HZ PHE A 4 20.493 -3.622 -2.656 1.00 0.00 H ATOM 55 N THR A 5 17.878 -2.206 1.911 1.00 0.00 N ATOM 56 CA THR A 5 16.530 -2.067 1.347 1.00 0.00 C ATOM 57 C THR A 5 15.472 -1.738 2.412 1.00 0.00 C ATOM 58 O THR A 5 14.305 -2.123 2.284 1.00 0.00 O ATOM 59 CB THR A 5 16.114 -3.327 0.543 1.00 0.00 C ATOM 60 OG1 THR A 5 14.899 -3.075 -0.172 1.00 0.00 O ATOM 61 CG2 THR A 5 15.925 -4.544 1.441 1.00 0.00 C ATOM 62 H THR A 5 18.609 -1.701 1.497 1.00 0.00 H ATOM 63 HA THR A 5 16.567 -1.239 0.653 1.00 0.00 H ATOM 64 HB THR A 5 16.896 -3.547 -0.169 1.00 0.00 H ATOM 65 HG1 THR A 5 15.019 -3.298 -1.098 1.00 0.00 H ATOM 66 HG21 THR A 5 15.283 -5.259 0.949 1.00 0.00 H ATOM 67 HG22 THR A 5 15.474 -4.238 2.373 1.00 0.00 H ATOM 68 HG23 THR A 5 16.885 -4.999 1.638 1.00 0.00 H ATOM 69 N GLY A 6 15.878 -0.993 3.445 1.00 0.00 N ATOM 70 CA GLY A 6 14.950 -0.600 4.496 1.00 0.00 C ATOM 71 C GLY A 6 13.821 0.269 3.966 1.00 0.00 C ATOM 72 O GLY A 6 12.695 0.209 4.462 1.00 0.00 O ATOM 73 H GLY A 6 16.809 -0.693 3.485 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.529 -1.488 4.943 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.491 -0.049 5.251 1.00 0.00 H ATOM 76 N LYS A 7 14.139 1.077 2.949 1.00 0.00 N ATOM 77 CA LYS A 7 13.172 1.975 2.317 1.00 0.00 C ATOM 78 C LYS A 7 11.898 1.239 1.885 1.00 0.00 C ATOM 79 O LYS A 7 10.799 1.791 1.974 1.00 0.00 O ATOM 80 CB LYS A 7 13.825 2.660 1.106 1.00 0.00 C ATOM 81 CG LYS A 7 12.865 3.491 0.270 1.00 0.00 C ATOM 82 CD LYS A 7 12.304 4.667 1.055 1.00 0.00 C ATOM 83 CE LYS A 7 11.014 5.180 0.434 1.00 0.00 C ATOM 84 NZ LYS A 7 9.956 4.168 0.468 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.057 1.067 2.609 1.00 0.00 H ATOM 86 HA LYS A 7 12.905 2.730 3.040 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.613 3.310 1.458 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.255 1.902 0.470 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.393 3.870 -0.592 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.050 2.863 -0.054 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.106 4.352 2.068 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.033 5.465 1.058 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.685 6.050 0.985 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.205 5.455 -0.593 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.223 3.233 0.348 1.00 0.00 H ATOM 96 N ARG A 8 12.049 -0.002 1.413 1.00 0.00 N ATOM 97 CA ARG A 8 10.906 -0.801 0.963 1.00 0.00 C ATOM 98 C ARG A 8 9.884 -1.004 2.081 1.00 0.00 C ATOM 99 O ARG A 8 8.680 -0.889 1.856 1.00 0.00 O ATOM 100 CB ARG A 8 11.373 -2.164 0.439 1.00 0.00 C ATOM 101 CG ARG A 8 12.144 -2.092 -0.870 1.00 0.00 C ATOM 102 CD ARG A 8 11.254 -1.651 -2.026 1.00 0.00 C ATOM 103 NE ARG A 8 10.117 -2.554 -2.229 1.00 0.00 N ATOM 104 CZ ARG A 8 10.229 -3.835 -2.602 1.00 0.00 C ATOM 105 NH1 ARG A 8 11.420 -4.359 -2.880 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.140 -4.589 -2.712 1.00 0.00 N ATOM 107 H ARG A 8 12.949 -0.390 1.368 1.00 0.00 H ATOM 108 HA ARG A 8 10.428 -0.264 0.159 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.009 -2.622 1.181 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.507 -2.792 0.287 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.951 -1.382 -0.762 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.549 -3.068 -1.090 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.880 -0.661 -1.817 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.845 -1.626 -2.929 1.00 0.00 H ATOM 115 HE ARG A 8 9.221 -2.193 -2.062 1.00 0.00 H ATOM 116 HH11 ARG A 8 12.244 -3.797 -2.814 1.00 0.00 H ATOM 117 HH12 ARG A 8 11.492 -5.318 -3.153 1.00 0.00 H ATOM 118 HH21 ARG A 8 8.240 -4.202 -2.515 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.222 -5.547 -2.991 1.00 0.00 H ATOM 120 N LYS A 9 10.376 -1.312 3.281 1.00 0.00 N ATOM 121 CA LYS A 9 9.510 -1.540 4.439 1.00 0.00 C ATOM 122 C LYS A 9 8.774 -0.262 4.858 1.00 0.00 C ATOM 123 O LYS A 9 7.586 -0.303 5.183 1.00 0.00 O ATOM 124 CB LYS A 9 10.332 -2.077 5.618 1.00 0.00 C ATOM 125 CG LYS A 9 9.498 -2.439 6.842 1.00 0.00 C ATOM 126 CD LYS A 9 8.542 -3.591 6.562 1.00 0.00 C ATOM 127 CE LYS A 9 9.288 -4.871 6.209 1.00 0.00 C ATOM 128 NZ LYS A 9 8.359 -6.015 5.991 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.348 -1.391 3.388 1.00 0.00 H ATOM 130 HA LYS A 9 8.778 -2.280 4.160 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.862 -2.962 5.298 1.00 0.00 H ATOM 132 HB3 LYS A 9 11.052 -1.326 5.910 1.00 0.00 H ATOM 133 HG2 LYS A 9 10.162 -2.724 7.644 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.925 -1.574 7.141 1.00 0.00 H ATOM 135 HD2 LYS A 9 7.945 -3.769 7.444 1.00 0.00 H ATOM 136 HD3 LYS A 9 7.900 -3.321 5.738 1.00 0.00 H ATOM 137 HE2 LYS A 9 9.856 -4.704 5.306 1.00 0.00 H ATOM 138 HE3 LYS A 9 9.963 -5.114 7.016 1.00 0.00 H ATOM 139 HZ1 LYS A 9 8.899 -6.885 5.814 1.00 0.00 H ATOM 140 HZ2 LYS A 9 7.748 -5.828 5.171 1.00 0.00 H ATOM 141 HZ3 LYS A 9 7.761 -6.154 6.830 1.00 0.00 H ATOM 142 N SER A 10 9.493 0.863 4.865 1.00 0.00 N ATOM 143 CA SER A 10 8.920 2.152 5.265 1.00 0.00 C ATOM 144 C SER A 10 7.788 2.602 4.338 1.00 0.00 C ATOM 145 O SER A 10 6.698 2.936 4.803 1.00 0.00 O ATOM 146 CB SER A 10 10.011 3.228 5.297 1.00 0.00 C ATOM 147 OG SER A 10 11.040 2.886 6.210 1.00 0.00 O ATOM 148 H SER A 10 10.437 0.822 4.608 1.00 0.00 H ATOM 149 HA SER A 10 8.521 2.037 6.259 1.00 0.00 H ATOM 150 HB2 SER A 10 10.442 3.331 4.313 1.00 0.00 H ATOM 151 HB3 SER A 10 9.577 4.170 5.600 1.00 0.00 H ATOM 152 HG SER A 10 11.744 2.431 5.743 1.00 0.00 H ATOM 153 N ASP A 11 8.058 2.626 3.033 1.00 0.00 N ATOM 154 CA ASP A 11 7.066 3.057 2.043 1.00 0.00 C ATOM 155 C ASP A 11 5.903 2.076 1.925 1.00 0.00 C ATOM 156 O ASP A 11 4.743 2.487 1.912 1.00 0.00 O ATOM 157 CB ASP A 11 7.726 3.255 0.675 1.00 0.00 C ATOM 158 CG ASP A 11 8.671 4.444 0.663 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.246 5.588 0.834 1.00 0.00 O ATOM 160 H ASP A 11 8.951 2.360 2.729 1.00 0.00 H ATOM 161 HA ASP A 11 6.674 4.006 2.374 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.289 2.368 0.422 1.00 0.00 H ATOM 163 HB3 ASP A 11 6.962 3.415 -0.068 1.00 0.00 H ATOM 164 N ARG A 12 6.216 0.784 1.831 1.00 0.00 N ATOM 165 CA ARG A 12 5.186 -0.249 1.703 1.00 0.00 C ATOM 166 C ARG A 12 4.163 -0.145 2.836 1.00 0.00 C ATOM 167 O ARG A 12 2.955 -0.200 2.595 1.00 0.00 O ATOM 168 CB ARG A 12 5.820 -1.643 1.688 1.00 0.00 C ATOM 169 CG ARG A 12 4.838 -2.757 1.365 1.00 0.00 C ATOM 170 CD ARG A 12 5.531 -4.108 1.287 1.00 0.00 C ATOM 171 NE ARG A 12 4.622 -5.171 0.854 1.00 0.00 N ATOM 172 CZ ARG A 12 4.083 -5.250 -0.368 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.393 -4.357 -1.307 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.239 -6.234 -0.656 1.00 0.00 N ATOM 175 H ARG A 12 7.160 0.520 1.841 1.00 0.00 H ATOM 176 HA ARG A 12 4.676 -0.087 0.766 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.606 -1.658 0.946 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.250 -1.840 2.659 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.085 -2.795 2.138 1.00 0.00 H ATOM 180 HG3 ARG A 12 4.369 -2.546 0.415 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.348 -4.040 0.585 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.919 -4.357 2.265 1.00 0.00 H ATOM 183 HE ARG A 12 4.389 -5.859 1.512 1.00 0.00 H ATOM 184 HH11 ARG A 12 5.034 -3.618 -1.107 1.00 0.00 H ATOM 185 HH12 ARG A 12 3.982 -4.428 -2.218 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.007 -6.915 0.039 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.836 -6.296 -1.570 1.00 0.00 H ATOM 188 N LYS A 13 4.654 0.018 4.063 1.00 0.00 N ATOM 189 CA LYS A 13 3.782 0.146 5.229 1.00 0.00 C ATOM 190 C LYS A 13 3.042 1.487 5.204 1.00 0.00 C ATOM 191 O LYS A 13 1.860 1.558 5.544 1.00 0.00 O ATOM 192 CB LYS A 13 4.593 0.019 6.525 1.00 0.00 C ATOM 193 CG LYS A 13 3.750 -0.001 7.796 1.00 0.00 C ATOM 194 CD LYS A 13 3.202 -1.392 8.111 1.00 0.00 C ATOM 195 CE LYS A 13 2.197 -1.875 7.073 1.00 0.00 C ATOM 196 NZ LYS A 13 1.028 -0.957 6.948 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.626 0.065 4.187 1.00 0.00 H ATOM 198 HA LYS A 13 3.057 -0.648 5.185 1.00 0.00 H ATOM 199 HB2 LYS A 13 5.164 -0.898 6.486 1.00 0.00 H ATOM 200 HB3 LYS A 13 5.278 0.852 6.588 1.00 0.00 H ATOM 201 HG2 LYS A 13 4.361 0.324 8.624 1.00 0.00 H ATOM 202 HG3 LYS A 13 2.921 0.681 7.674 1.00 0.00 H ATOM 203 HD2 LYS A 13 4.026 -2.090 8.143 1.00 0.00 H ATOM 204 HD3 LYS A 13 2.719 -1.365 9.078 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.691 -1.947 6.117 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.844 -2.853 7.365 1.00 0.00 H ATOM 207 HZ1 LYS A 13 0.211 -1.471 6.564 1.00 0.00 H ATOM 208 HZ2 LYS A 13 1.259 -0.170 6.313 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.775 -0.572 7.880 1.00 0.00 H ATOM 210 N LYS A 14 3.752 2.545 4.800 1.00 0.00 N ATOM 211 CA LYS A 14 3.174 3.888 4.729 1.00 0.00 C ATOM 212 C LYS A 14 1.980 3.943 3.772 1.00 0.00 C ATOM 213 O LYS A 14 0.961 4.561 4.082 1.00 0.00 O ATOM 214 CB LYS A 14 4.240 4.905 4.298 1.00 0.00 C ATOM 215 CG LYS A 14 3.698 6.318 4.123 1.00 0.00 C ATOM 216 CD LYS A 14 3.091 6.851 5.413 1.00 0.00 C ATOM 217 CE LYS A 14 2.179 8.038 5.148 1.00 0.00 C ATOM 218 NZ LYS A 14 1.001 7.650 4.370 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.690 2.419 4.545 1.00 0.00 H ATOM 220 HA LYS A 14 2.832 4.145 5.718 1.00 0.00 H ATOM 221 HB2 LYS A 14 5.020 4.932 5.042 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.663 4.588 3.356 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.508 6.966 3.825 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.941 6.308 3.354 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.516 6.067 5.882 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.887 7.160 6.074 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.857 8.449 6.094 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.732 8.786 4.599 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.153 7.141 3.546 1.00 0.00 H ATOM 230 N LYS A 15 2.113 3.297 2.611 1.00 0.00 N ATOM 231 CA LYS A 15 1.043 3.276 1.609 1.00 0.00 C ATOM 232 C LYS A 15 -0.256 2.734 2.197 1.00 0.00 C ATOM 233 O LYS A 15 -1.337 3.253 1.915 1.00 0.00 O ATOM 234 CB LYS A 15 1.451 2.431 0.396 1.00 0.00 C ATOM 235 CG LYS A 15 2.595 3.025 -0.415 1.00 0.00 C ATOM 236 CD LYS A 15 2.272 4.421 -0.941 1.00 0.00 C ATOM 237 CE LYS A 15 1.229 4.399 -2.057 1.00 0.00 C ATOM 238 NZ LYS A 15 -0.140 4.074 -1.562 1.00 0.00 N1+ ATOM 239 H LYS A 15 2.949 2.823 2.425 1.00 0.00 H ATOM 240 HA LYS A 15 0.876 4.291 1.287 1.00 0.00 H ATOM 241 HB2 LYS A 15 1.758 1.455 0.742 1.00 0.00 H ATOM 242 HB3 LYS A 15 0.598 2.318 -0.252 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.470 3.086 0.210 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.798 2.375 -1.254 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.893 5.020 -0.126 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.179 4.866 -1.321 1.00 0.00 H ATOM 247 HE2 LYS A 15 1.207 5.373 -2.523 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.523 3.661 -2.787 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -0.329 3.058 -1.674 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -0.851 4.605 -2.104 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -0.231 4.326 -0.557 1.00 0.00 H ATOM 252 N ASN A 16 -0.141 1.691 3.013 1.00 0.00 N ATOM 253 CA ASN A 16 -1.304 1.072 3.647 1.00 0.00 C ATOM 254 C ASN A 16 -1.894 1.979 4.728 1.00 0.00 C ATOM 255 O ASN A 16 -3.115 2.103 4.843 1.00 0.00 O ATOM 256 CB ASN A 16 -0.924 -0.282 4.257 1.00 0.00 C ATOM 257 CG ASN A 16 -0.417 -1.300 3.238 1.00 0.00 C ATOM 258 OD1 ASN A 16 0.138 -2.332 3.618 1.00 0.00 O ATOM 259 ND2 ASN A 16 -0.620 -1.042 1.945 1.00 0.00 N ATOM 260 H ASN A 16 0.751 1.327 3.195 1.00 0.00 H ATOM 261 HA ASN A 16 -2.050 0.916 2.885 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.147 -0.127 4.988 1.00 0.00 H ATOM 263 HB3 ASN A 16 -1.790 -0.698 4.749 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.083 -0.216 1.699 1.00 0.00 H ATOM 265 HD22 ASN A 16 -0.297 -1.695 1.290 1.00 0.00 H ATOM 266 N GLN A 17 -1.021 2.604 5.522 1.00 0.00 N ATOM 267 CA GLN A 17 -1.453 3.492 6.601 1.00 0.00 C ATOM 268 C GLN A 17 -2.257 4.677 6.062 1.00 0.00 C ATOM 269 O GLN A 17 -3.372 4.934 6.517 1.00 0.00 O ATOM 270 CB GLN A 17 -0.241 3.994 7.398 1.00 0.00 C ATOM 271 CG GLN A 17 -0.604 4.925 8.549 1.00 0.00 C ATOM 272 CD GLN A 17 -1.548 4.283 9.550 1.00 0.00 C ATOM 273 OE1 GLN A 17 -1.208 3.291 10.194 1.00 0.00 O ATOM 274 NE2 GLN A 17 -2.746 4.844 9.680 1.00 0.00 N ATOM 275 H GLN A 17 -0.061 2.458 5.381 1.00 0.00 H ATOM 276 HA GLN A 17 -2.087 2.920 7.258 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.284 3.143 7.808 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.420 4.525 6.730 1.00 0.00 H ATOM 279 HG2 GLN A 17 0.302 5.207 9.064 1.00 0.00 H ATOM 280 HG3 GLN A 17 -1.076 5.807 8.144 1.00 0.00 H ATOM 281 HE21 GLN A 17 -2.955 5.630 9.131 1.00 0.00 H ATOM 282 HE22 GLN A 17 -3.374 4.449 10.322 1.00 0.00 H ATOM 283 N ASP A 18 -1.685 5.391 5.093 1.00 0.00 N ATOM 284 CA ASP A 18 -2.352 6.547 4.493 1.00 0.00 C ATOM 285 C ASP A 18 -3.442 6.108 3.516 1.00 0.00 C ATOM 286 O ASP A 18 -4.607 6.476 3.665 1.00 0.00 O ATOM 287 CB ASP A 18 -1.337 7.450 3.782 1.00 0.00 C ATOM 288 CG ASP A 18 -0.250 7.945 4.718 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.534 8.580 5.734 1.00 0.00 O ATOM 290 H ASP A 18 -0.795 5.132 4.774 1.00 0.00 H ATOM 291 HA ASP A 18 -2.814 7.107 5.292 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.873 6.897 2.978 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.853 8.307 3.372 1.00 0.00 H HETATM 294 N NH2 A 19 -3.067 5.321 2.511 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -2.122 5.064 2.450 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.750 5.030 1.871 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 3 ATOM 1 N PHE A 1 24.981 1.308 5.869 1.00 0.00 N ATOM 2 CA PHE A 1 24.127 0.139 6.047 1.00 0.00 C ATOM 3 C PHE A 1 24.199 -0.778 4.827 1.00 0.00 C ATOM 4 O PHE A 1 24.170 -0.312 3.686 1.00 0.00 O ATOM 5 CB PHE A 1 22.678 0.575 6.296 1.00 0.00 C ATOM 6 CG PHE A 1 21.737 -0.562 6.589 1.00 0.00 C ATOM 7 CD1 PHE A 1 22.071 -1.540 7.514 1.00 0.00 C ATOM 8 CD2 PHE A 1 20.515 -0.652 5.940 1.00 0.00 C ATOM 9 CE1 PHE A 1 21.207 -2.584 7.785 1.00 0.00 C ATOM 10 CE2 PHE A 1 19.646 -1.692 6.208 1.00 0.00 C ATOM 11 CZ PHE A 1 19.993 -2.659 7.131 1.00 0.00 C ATOM 12 H1 PHE A 1 25.286 1.805 6.657 1.00 0.00 H ATOM 13 HA PHE A 1 24.484 -0.402 6.911 1.00 0.00 H ATOM 14 HB2 PHE A 1 22.654 1.248 7.141 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.312 1.094 5.421 1.00 0.00 H ATOM 16 HD1 PHE A 1 23.020 -1.482 8.026 1.00 0.00 H ATOM 17 HD2 PHE A 1 20.244 0.103 5.217 1.00 0.00 H ATOM 18 HE1 PHE A 1 21.480 -3.338 8.507 1.00 0.00 H ATOM 19 HE2 PHE A 1 18.697 -1.749 5.695 1.00 0.00 H ATOM 20 HZ PHE A 1 19.315 -3.473 7.341 1.00 0.00 H ATOM 21 N GLY A 2 24.294 -2.086 5.080 1.00 0.00 N ATOM 22 CA GLY A 2 24.370 -3.063 4.002 1.00 0.00 C ATOM 23 C GLY A 2 23.058 -3.216 3.250 1.00 0.00 C ATOM 24 O GLY A 2 22.489 -2.232 2.775 1.00 0.00 O ATOM 25 H GLY A 2 24.314 -2.393 6.011 1.00 0.00 H ATOM 26 HA2 GLY A 2 25.136 -2.752 3.306 1.00 0.00 H ATOM 27 HA3 GLY A 2 24.648 -4.020 4.419 1.00 0.00 H ATOM 28 N GLY A 3 22.582 -4.460 3.138 1.00 0.00 N ATOM 29 CA GLY A 3 21.336 -4.726 2.436 1.00 0.00 C ATOM 30 C GLY A 3 20.161 -3.962 3.021 1.00 0.00 C ATOM 31 O GLY A 3 19.967 -3.949 4.237 1.00 0.00 O ATOM 32 H GLY A 3 23.084 -5.203 3.535 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.453 -4.448 1.399 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.124 -5.784 2.491 1.00 0.00 H ATOM 35 N PHE A 4 19.381 -3.318 2.150 1.00 0.00 N ATOM 36 CA PHE A 4 18.220 -2.537 2.579 1.00 0.00 C ATOM 37 C PHE A 4 17.182 -3.411 3.287 1.00 0.00 C ATOM 38 O PHE A 4 16.969 -4.568 2.916 1.00 0.00 O ATOM 39 CB PHE A 4 17.586 -1.809 1.383 1.00 0.00 C ATOM 40 CG PHE A 4 17.116 -2.716 0.275 1.00 0.00 C ATOM 41 CD1 PHE A 4 15.998 -3.518 0.439 1.00 0.00 C ATOM 42 CD2 PHE A 4 17.792 -2.757 -0.935 1.00 0.00 C ATOM 43 CE1 PHE A 4 15.565 -4.347 -0.579 1.00 0.00 C ATOM 44 CE2 PHE A 4 17.362 -3.583 -1.957 1.00 0.00 C ATOM 45 CZ PHE A 4 16.248 -4.379 -1.778 1.00 0.00 C ATOM 46 H PHE A 4 19.596 -3.366 1.195 1.00 0.00 H ATOM 47 HA PHE A 4 18.574 -1.797 3.282 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.732 -1.246 1.728 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.312 -1.125 0.967 1.00 0.00 H ATOM 50 HD1 PHE A 4 15.462 -3.494 1.377 1.00 0.00 H ATOM 51 HD2 PHE A 4 18.665 -2.137 -1.077 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.693 -4.968 -0.436 1.00 0.00 H ATOM 53 HE2 PHE A 4 17.897 -3.604 -2.895 1.00 0.00 H ATOM 54 HZ PHE A 4 15.911 -5.024 -2.576 1.00 0.00 H ATOM 55 N THR A 5 16.543 -2.843 4.309 1.00 0.00 N ATOM 56 CA THR A 5 15.522 -3.552 5.081 1.00 0.00 C ATOM 57 C THR A 5 14.549 -2.561 5.717 1.00 0.00 C ATOM 58 O THR A 5 13.344 -2.609 5.462 1.00 0.00 O ATOM 59 CB THR A 5 16.149 -4.429 6.187 1.00 0.00 C ATOM 60 OG1 THR A 5 17.089 -5.348 5.617 1.00 0.00 O ATOM 61 CG2 THR A 5 15.078 -5.206 6.940 1.00 0.00 C ATOM 62 H THR A 5 16.763 -1.918 4.551 1.00 0.00 H ATOM 63 HA THR A 5 14.977 -4.191 4.405 1.00 0.00 H ATOM 64 HB THR A 5 16.665 -3.787 6.887 1.00 0.00 H ATOM 65 HG1 THR A 5 17.976 -4.987 5.691 1.00 0.00 H ATOM 66 HG21 THR A 5 14.376 -5.626 6.235 1.00 0.00 H ATOM 67 HG22 THR A 5 14.557 -4.541 7.614 1.00 0.00 H ATOM 68 HG23 THR A 5 15.541 -6.001 7.506 1.00 0.00 H ATOM 69 N GLY A 6 15.084 -1.647 6.527 1.00 0.00 N ATOM 70 CA GLY A 6 14.254 -0.641 7.169 1.00 0.00 C ATOM 71 C GLY A 6 13.443 0.159 6.164 1.00 0.00 C ATOM 72 O GLY A 6 12.329 0.591 6.459 1.00 0.00 O ATOM 73 H GLY A 6 16.052 -1.648 6.676 1.00 0.00 H ATOM 74 HA2 GLY A 6 13.578 -1.130 7.855 1.00 0.00 H ATOM 75 HA3 GLY A 6 14.889 0.034 7.724 1.00 0.00 H ATOM 76 N LYS A 7 14.009 0.356 4.973 1.00 0.00 N ATOM 77 CA LYS A 7 13.341 1.107 3.916 1.00 0.00 C ATOM 78 C LYS A 7 12.117 0.370 3.366 1.00 0.00 C ATOM 79 O LYS A 7 11.078 0.990 3.135 1.00 0.00 O ATOM 80 CB LYS A 7 14.319 1.406 2.772 1.00 0.00 C ATOM 81 CG LYS A 7 13.652 2.028 1.555 1.00 0.00 C ATOM 82 CD LYS A 7 13.016 3.371 1.888 1.00 0.00 C ATOM 83 CE LYS A 7 11.922 3.730 0.896 1.00 0.00 C ATOM 84 NZ LYS A 7 10.763 2.845 1.018 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.900 -0.013 4.802 1.00 0.00 H ATOM 86 HA LYS A 7 13.015 2.041 4.341 1.00 0.00 H ATOM 87 HB2 LYS A 7 15.076 2.088 3.129 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.791 0.485 2.466 1.00 0.00 H ATOM 89 HG2 LYS A 7 14.394 2.176 0.785 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.886 1.357 1.193 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.588 3.320 2.877 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.779 4.135 1.862 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.609 4.748 1.079 1.00 0.00 H ATOM 94 HE3 LYS A 7 12.321 3.652 -0.105 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.924 1.879 0.974 1.00 0.00 H ATOM 96 N ARG A 8 12.239 -0.941 3.137 1.00 0.00 N ATOM 97 CA ARG A 8 11.123 -1.715 2.585 1.00 0.00 C ATOM 98 C ARG A 8 9.946 -1.814 3.556 1.00 0.00 C ATOM 99 O ARG A 8 8.793 -1.827 3.127 1.00 0.00 O ATOM 100 CB ARG A 8 11.570 -3.108 2.092 1.00 0.00 C ATOM 101 CG ARG A 8 12.341 -3.961 3.096 1.00 0.00 C ATOM 102 CD ARG A 8 11.445 -4.540 4.186 1.00 0.00 C ATOM 103 NE ARG A 8 10.291 -5.260 3.640 1.00 0.00 N ATOM 104 CZ ARG A 8 10.372 -6.405 2.951 1.00 0.00 C ATOM 105 NH1 ARG A 8 11.547 -6.999 2.753 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.267 -6.964 2.469 1.00 0.00 N ATOM 107 H ARG A 8 13.092 -1.388 3.330 1.00 0.00 H ATOM 108 HA ARG A 8 10.774 -1.162 1.724 1.00 0.00 H ATOM 109 HB2 ARG A 8 10.693 -3.662 1.797 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.196 -2.973 1.221 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.809 -4.775 2.567 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.102 -3.351 3.554 1.00 0.00 H ATOM 113 HD2 ARG A 8 12.029 -5.225 4.781 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.094 -3.740 4.812 1.00 0.00 H ATOM 115 HE ARG A 8 9.407 -4.863 3.785 1.00 0.00 H ATOM 116 HH11 ARG A 8 12.383 -6.594 3.121 1.00 0.00 H ATOM 117 HH12 ARG A 8 11.593 -7.855 2.237 1.00 0.00 H ATOM 118 HH21 ARG A 8 8.378 -6.531 2.623 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.323 -7.819 1.954 1.00 0.00 H ATOM 120 N LYS A 9 10.225 -1.870 4.858 1.00 0.00 N ATOM 121 CA LYS A 9 9.159 -1.956 5.856 1.00 0.00 C ATOM 122 C LYS A 9 8.485 -0.595 6.058 1.00 0.00 C ATOM 123 O LYS A 9 7.274 -0.525 6.277 1.00 0.00 O ATOM 124 CB LYS A 9 9.692 -2.522 7.185 1.00 0.00 C ATOM 125 CG LYS A 9 10.757 -1.674 7.868 1.00 0.00 C ATOM 126 CD LYS A 9 10.145 -0.574 8.725 1.00 0.00 C ATOM 127 CE LYS A 9 11.214 0.215 9.463 1.00 0.00 C ATOM 128 NZ LYS A 9 10.628 1.312 10.285 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.159 -1.847 5.152 1.00 0.00 H ATOM 130 HA LYS A 9 8.418 -2.639 5.468 1.00 0.00 H ATOM 131 HB2 LYS A 9 8.864 -2.631 7.868 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.113 -3.500 6.995 1.00 0.00 H ATOM 133 HG2 LYS A 9 11.358 -2.311 8.499 1.00 0.00 H ATOM 134 HG3 LYS A 9 11.382 -1.225 7.113 1.00 0.00 H ATOM 135 HD2 LYS A 9 9.590 0.099 8.091 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.479 -1.022 9.446 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.756 -0.457 10.112 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.893 0.642 8.741 1.00 0.00 H ATOM 139 HZ1 LYS A 9 11.386 1.859 10.741 1.00 0.00 H ATOM 140 HZ2 LYS A 9 10.009 0.917 11.021 1.00 0.00 H ATOM 141 HZ3 LYS A 9 10.069 1.949 9.683 1.00 0.00 H ATOM 142 N SER A 10 9.271 0.482 5.977 1.00 0.00 N ATOM 143 CA SER A 10 8.746 1.837 6.149 1.00 0.00 C ATOM 144 C SER A 10 7.849 2.243 4.978 1.00 0.00 C ATOM 145 O SER A 10 6.742 2.744 5.184 1.00 0.00 O ATOM 146 CB SER A 10 9.891 2.842 6.299 1.00 0.00 C ATOM 147 OG SER A 10 10.661 2.570 7.457 1.00 0.00 O ATOM 148 H SER A 10 10.227 0.363 5.795 1.00 0.00 H ATOM 149 HA SER A 10 8.155 1.846 7.051 1.00 0.00 H ATOM 150 HB2 SER A 10 10.535 2.783 5.433 1.00 0.00 H ATOM 151 HB3 SER A 10 9.484 3.839 6.378 1.00 0.00 H ATOM 152 HG SER A 10 10.993 3.393 7.822 1.00 0.00 H ATOM 153 N ASP A 11 8.335 2.029 3.753 1.00 0.00 N ATOM 154 CA ASP A 11 7.575 2.378 2.551 1.00 0.00 C ATOM 155 C ASP A 11 6.296 1.551 2.429 1.00 0.00 C ATOM 156 O ASP A 11 5.248 2.081 2.066 1.00 0.00 O ATOM 157 CB ASP A 11 8.434 2.215 1.292 1.00 0.00 C ATOM 158 CG ASP A 11 9.515 3.280 1.184 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.224 4.476 1.245 1.00 0.00 O ATOM 160 H ASP A 11 9.224 1.628 3.658 1.00 0.00 H ATOM 161 HA ASP A 11 7.296 3.416 2.642 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.911 1.246 1.312 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.801 2.281 0.419 1.00 0.00 H ATOM 164 N ARG A 12 6.383 0.254 2.735 1.00 0.00 N ATOM 165 CA ARG A 12 5.218 -0.632 2.659 1.00 0.00 C ATOM 166 C ARG A 12 4.097 -0.168 3.590 1.00 0.00 C ATOM 167 O ARG A 12 2.931 -0.132 3.194 1.00 0.00 O ATOM 168 CB ARG A 12 5.610 -2.074 2.997 1.00 0.00 C ATOM 169 CG ARG A 12 6.363 -2.782 1.880 1.00 0.00 C ATOM 170 CD ARG A 12 6.823 -4.168 2.309 1.00 0.00 C ATOM 171 NE ARG A 12 5.708 -5.020 2.729 1.00 0.00 N ATOM 172 CZ ARG A 12 4.757 -5.477 1.909 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.802 -5.218 0.604 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.761 -6.210 2.396 1.00 0.00 N ATOM 175 H ARG A 12 7.246 -0.113 3.022 1.00 0.00 H ATOM 176 HA ARG A 12 4.853 -0.601 1.644 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.236 -2.067 3.876 1.00 0.00 H ATOM 178 HB3 ARG A 12 4.713 -2.638 3.210 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.711 -2.879 1.026 1.00 0.00 H ATOM 180 HG3 ARG A 12 7.226 -2.192 1.610 1.00 0.00 H ATOM 181 HD2 ARG A 12 7.328 -4.638 1.478 1.00 0.00 H ATOM 182 HD3 ARG A 12 7.514 -4.064 3.134 1.00 0.00 H ATOM 183 HE ARG A 12 5.656 -5.252 3.681 1.00 0.00 H ATOM 184 HH11 ARG A 12 5.553 -4.679 0.223 1.00 0.00 H ATOM 185 HH12 ARG A 12 4.083 -5.565 0.000 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.726 -6.418 3.375 1.00 0.00 H ATOM 187 HH22 ARG A 12 3.046 -6.553 1.786 1.00 0.00 H ATOM 188 N LYS A 13 4.457 0.185 4.825 1.00 0.00 N ATOM 189 CA LYS A 13 3.476 0.646 5.810 1.00 0.00 C ATOM 190 C LYS A 13 2.864 1.987 5.407 1.00 0.00 C ATOM 191 O LYS A 13 1.642 2.154 5.446 1.00 0.00 O ATOM 192 CB LYS A 13 4.119 0.759 7.197 1.00 0.00 C ATOM 193 CG LYS A 13 4.583 -0.572 7.769 1.00 0.00 C ATOM 194 CD LYS A 13 3.421 -1.532 7.978 1.00 0.00 C ATOM 195 CE LYS A 13 3.891 -2.872 8.525 1.00 0.00 C ATOM 196 NZ LYS A 13 4.834 -3.558 7.597 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.403 0.134 5.079 1.00 0.00 H ATOM 198 HA LYS A 13 2.689 -0.090 5.852 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.975 1.415 7.131 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.400 1.189 7.879 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.285 -1.021 7.084 1.00 0.00 H ATOM 202 HG3 LYS A 13 5.067 -0.395 8.718 1.00 0.00 H ATOM 203 HD2 LYS A 13 2.726 -1.093 8.678 1.00 0.00 H ATOM 204 HD3 LYS A 13 2.926 -1.694 7.031 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.388 -2.705 9.469 1.00 0.00 H ATOM 206 HE3 LYS A 13 3.029 -3.504 8.682 1.00 0.00 H ATOM 207 HZ1 LYS A 13 5.773 -3.113 7.648 1.00 0.00 H ATOM 208 HZ2 LYS A 13 4.485 -3.495 6.619 1.00 0.00 H ATOM 209 HZ3 LYS A 13 4.923 -4.561 7.857 1.00 0.00 H ATOM 210 N LYS A 14 3.715 2.940 5.023 1.00 0.00 N ATOM 211 CA LYS A 14 3.254 4.267 4.616 1.00 0.00 C ATOM 212 C LYS A 14 2.399 4.174 3.350 1.00 0.00 C ATOM 213 O LYS A 14 1.309 4.743 3.285 1.00 0.00 O ATOM 214 CB LYS A 14 4.451 5.202 4.376 1.00 0.00 C ATOM 215 CG LYS A 14 4.147 6.684 4.599 1.00 0.00 C ATOM 216 CD LYS A 14 2.940 7.156 3.799 1.00 0.00 C ATOM 217 CE LYS A 14 3.173 7.050 2.297 1.00 0.00 C ATOM 218 NZ LYS A 14 1.929 6.799 1.566 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.677 2.744 5.015 1.00 0.00 H ATOM 220 HA LYS A 14 2.649 4.666 5.414 1.00 0.00 H ATOM 221 HB2 LYS A 14 5.248 4.920 5.045 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.790 5.078 3.358 1.00 0.00 H ATOM 223 HG2 LYS A 14 3.949 6.843 5.649 1.00 0.00 H ATOM 224 HG3 LYS A 14 5.010 7.263 4.306 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.086 6.554 4.066 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.742 8.188 4.049 1.00 0.00 H ATOM 227 HE2 LYS A 14 3.603 7.976 1.946 1.00 0.00 H ATOM 228 HE3 LYS A 14 3.860 6.240 2.108 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.923 6.044 0.944 1.00 0.00 H ATOM 230 N LYS A 15 2.898 3.440 2.351 1.00 0.00 N ATOM 231 CA LYS A 15 2.189 3.258 1.083 1.00 0.00 C ATOM 232 C LYS A 15 0.758 2.783 1.324 1.00 0.00 C ATOM 233 O LYS A 15 -0.178 3.254 0.675 1.00 0.00 O ATOM 234 CB LYS A 15 2.934 2.255 0.195 1.00 0.00 C ATOM 235 CG LYS A 15 2.311 2.065 -1.178 1.00 0.00 C ATOM 236 CD LYS A 15 3.102 1.071 -2.015 1.00 0.00 C ATOM 237 CE LYS A 15 2.481 0.873 -3.390 1.00 0.00 C ATOM 238 NZ LYS A 15 1.103 0.309 -3.308 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.765 3.004 2.474 1.00 0.00 H ATOM 240 HA LYS A 15 2.157 4.212 0.582 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.949 2.599 0.060 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.952 1.296 0.694 1.00 0.00 H ATOM 243 HG2 LYS A 15 1.303 1.699 -1.059 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.292 3.018 -1.689 1.00 0.00 H ATOM 245 HD2 LYS A 15 4.109 1.441 -2.137 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.125 0.122 -1.500 1.00 0.00 H ATOM 247 HE2 LYS A 15 2.439 1.828 -3.892 1.00 0.00 H ATOM 248 HE3 LYS A 15 3.104 0.197 -3.957 1.00 0.00 H ATOM 249 HZ1 LYS A 15 0.435 1.043 -3.002 1.00 0.00 H ATOM 250 HZ2 LYS A 15 1.077 -0.475 -2.627 1.00 0.00 H ATOM 251 HZ3 LYS A 15 0.809 -0.047 -4.240 1.00 0.00 H ATOM 252 N ASN A 16 0.601 1.857 2.269 1.00 0.00 N ATOM 253 CA ASN A 16 -0.714 1.323 2.614 1.00 0.00 C ATOM 254 C ASN A 16 -1.611 2.429 3.177 1.00 0.00 C ATOM 255 O ASN A 16 -2.788 2.524 2.826 1.00 0.00 O ATOM 256 CB ASN A 16 -0.575 0.181 3.629 1.00 0.00 C ATOM 257 CG ASN A 16 -1.901 -0.491 3.948 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.812 0.134 4.494 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.016 -1.771 3.608 1.00 0.00 N ATOM 260 H ASN A 16 1.391 1.534 2.753 1.00 0.00 H ATOM 261 HA ASN A 16 -1.163 0.939 1.711 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.095 -0.565 3.230 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.162 0.574 4.546 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.254 -2.207 3.175 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.862 -2.226 3.805 1.00 0.00 H ATOM 266 N GLN A 17 -1.038 3.262 4.048 1.00 0.00 N ATOM 267 CA GLN A 17 -1.771 4.368 4.664 1.00 0.00 C ATOM 268 C GLN A 17 -2.224 5.385 3.613 1.00 0.00 C ATOM 269 O GLN A 17 -3.388 5.791 3.600 1.00 0.00 O ATOM 270 CB GLN A 17 -0.894 5.049 5.727 1.00 0.00 C ATOM 271 CG GLN A 17 -1.587 6.169 6.495 1.00 0.00 C ATOM 272 CD GLN A 17 -1.805 7.419 5.660 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.855 7.997 5.129 1.00 0.00 O ATOM 274 NE2 GLN A 17 -3.057 7.849 5.542 1.00 0.00 N ATOM 275 H GLN A 17 -0.095 3.130 4.281 1.00 0.00 H ATOM 276 HA GLN A 17 -2.643 3.957 5.144 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.576 4.303 6.440 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.022 5.463 5.244 1.00 0.00 H ATOM 279 HG2 GLN A 17 -2.549 5.812 6.834 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.981 6.427 7.351 1.00 0.00 H ATOM 281 HE21 GLN A 17 -3.767 7.343 5.994 1.00 0.00 H ATOM 282 HE22 GLN A 17 -3.222 8.654 5.008 1.00 0.00 H ATOM 283 N ASP A 18 -1.302 5.790 2.736 1.00 0.00 N ATOM 284 CA ASP A 18 -1.610 6.762 1.683 1.00 0.00 C ATOM 285 C ASP A 18 -2.719 6.243 0.767 1.00 0.00 C ATOM 286 O ASP A 18 -3.722 6.921 0.547 1.00 0.00 O ATOM 287 CB ASP A 18 -0.363 7.082 0.849 1.00 0.00 C ATOM 288 CG ASP A 18 0.817 7.523 1.699 1.00 0.00 C ATOM 289 OD1 ASP A 18 0.724 8.490 2.456 1.00 0.00 O ATOM 290 H ASP A 18 -0.394 5.427 2.801 1.00 0.00 H ATOM 291 HA ASP A 18 -1.954 7.668 2.162 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.072 6.202 0.296 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.597 7.875 0.154 1.00 0.00 H HETATM 294 N NH2 A 19 -2.540 5.036 0.236 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.716 4.550 0.454 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.239 4.682 -0.352 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 4 ATOM 1 N PHE A 1 14.254 -10.662 14.453 1.00 0.00 N ATOM 2 CA PHE A 1 15.285 -9.913 13.743 1.00 0.00 C ATOM 3 C PHE A 1 15.129 -10.061 12.228 1.00 0.00 C ATOM 4 O PHE A 1 16.071 -10.447 11.529 1.00 0.00 O ATOM 5 CB PHE A 1 16.683 -10.370 14.182 1.00 0.00 C ATOM 6 CG PHE A 1 17.035 -9.987 15.594 1.00 0.00 C ATOM 7 CD1 PHE A 1 16.274 -10.431 16.665 1.00 0.00 C ATOM 8 CD2 PHE A 1 18.131 -9.177 15.847 1.00 0.00 C ATOM 9 CE1 PHE A 1 16.596 -10.074 17.958 1.00 0.00 C ATOM 10 CE2 PHE A 1 18.459 -8.816 17.140 1.00 0.00 C ATOM 11 CZ PHE A 1 17.691 -9.266 18.197 1.00 0.00 C ATOM 12 H1 PHE A 1 13.756 -10.226 15.175 1.00 0.00 H ATOM 13 HA PHE A 1 15.165 -8.871 14.000 1.00 0.00 H ATOM 14 HB2 PHE A 1 16.740 -11.446 14.108 1.00 0.00 H ATOM 15 HB3 PHE A 1 17.419 -9.931 13.523 1.00 0.00 H ATOM 16 HD1 PHE A 1 15.418 -11.065 16.479 1.00 0.00 H ATOM 17 HD2 PHE A 1 18.733 -8.824 15.022 1.00 0.00 H ATOM 18 HE1 PHE A 1 15.995 -10.426 18.784 1.00 0.00 H ATOM 19 HE2 PHE A 1 19.315 -8.185 17.323 1.00 0.00 H ATOM 20 HZ PHE A 1 17.946 -8.986 19.208 1.00 0.00 H ATOM 21 N GLY A 2 13.932 -9.749 11.727 1.00 0.00 N ATOM 22 CA GLY A 2 13.663 -9.847 10.300 1.00 0.00 C ATOM 23 C GLY A 2 14.533 -8.913 9.474 1.00 0.00 C ATOM 24 O GLY A 2 14.753 -7.762 9.857 1.00 0.00 O ATOM 25 H GLY A 2 13.223 -9.447 12.334 1.00 0.00 H ATOM 26 HA2 GLY A 2 13.840 -10.863 9.982 1.00 0.00 H ATOM 27 HA3 GLY A 2 12.625 -9.603 10.125 1.00 0.00 H ATOM 28 N GLY A 3 15.031 -9.416 8.342 1.00 0.00 N ATOM 29 CA GLY A 3 15.882 -8.618 7.468 1.00 0.00 C ATOM 30 C GLY A 3 15.120 -7.541 6.710 1.00 0.00 C ATOM 31 O GLY A 3 14.350 -6.783 7.306 1.00 0.00 O ATOM 32 H GLY A 3 14.822 -10.342 8.098 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.648 -8.146 8.067 1.00 0.00 H ATOM 34 HA3 GLY A 3 16.358 -9.275 6.755 1.00 0.00 H ATOM 35 N PHE A 4 15.345 -7.477 5.392 1.00 0.00 N ATOM 36 CA PHE A 4 14.691 -6.489 4.522 1.00 0.00 C ATOM 37 C PHE A 4 15.176 -5.067 4.807 1.00 0.00 C ATOM 38 O PHE A 4 15.345 -4.672 5.962 1.00 0.00 O ATOM 39 CB PHE A 4 13.164 -6.557 4.657 1.00 0.00 C ATOM 40 CG PHE A 4 12.485 -7.253 3.509 1.00 0.00 C ATOM 41 CD1 PHE A 4 12.868 -8.529 3.122 1.00 0.00 C ATOM 42 CD2 PHE A 4 11.460 -6.627 2.815 1.00 0.00 C ATOM 43 CE1 PHE A 4 12.242 -9.165 2.067 1.00 0.00 C ATOM 44 CE2 PHE A 4 10.832 -7.258 1.760 1.00 0.00 C ATOM 45 CZ PHE A 4 11.223 -8.529 1.385 1.00 0.00 C ATOM 46 H PHE A 4 15.975 -8.112 4.990 1.00 0.00 H ATOM 47 HA PHE A 4 14.956 -6.737 3.506 1.00 0.00 H ATOM 48 HB2 PHE A 4 12.911 -7.089 5.560 1.00 0.00 H ATOM 49 HB3 PHE A 4 12.772 -5.552 4.716 1.00 0.00 H ATOM 50 HD1 PHE A 4 13.665 -9.028 3.653 1.00 0.00 H ATOM 51 HD2 PHE A 4 11.152 -5.633 3.105 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.550 -10.159 1.776 1.00 0.00 H ATOM 53 HE2 PHE A 4 10.035 -6.758 1.227 1.00 0.00 H ATOM 54 HZ PHE A 4 10.732 -9.025 0.560 1.00 0.00 H ATOM 55 N THR A 5 15.396 -4.304 3.734 1.00 0.00 N ATOM 56 CA THR A 5 15.859 -2.923 3.850 1.00 0.00 C ATOM 57 C THR A 5 14.813 -2.038 4.526 1.00 0.00 C ATOM 58 O THR A 5 13.634 -2.060 4.159 1.00 0.00 O ATOM 59 CB THR A 5 16.206 -2.319 2.472 1.00 0.00 C ATOM 60 OG1 THR A 5 15.046 -2.315 1.630 1.00 0.00 O ATOM 61 CG2 THR A 5 17.325 -3.101 1.796 1.00 0.00 C ATOM 62 H THR A 5 15.239 -4.680 2.842 1.00 0.00 H ATOM 63 HA THR A 5 16.757 -2.923 4.453 1.00 0.00 H ATOM 64 HB THR A 5 16.538 -1.301 2.615 1.00 0.00 H ATOM 65 HG1 THR A 5 14.734 -1.414 1.521 1.00 0.00 H ATOM 66 HG21 THR A 5 18.165 -3.182 2.469 1.00 0.00 H ATOM 67 HG22 THR A 5 17.631 -2.587 0.897 1.00 0.00 H ATOM 68 HG23 THR A 5 16.971 -4.089 1.542 1.00 0.00 H ATOM 69 N GLY A 6 15.258 -1.256 5.511 1.00 0.00 N ATOM 70 CA GLY A 6 14.364 -0.362 6.232 1.00 0.00 C ATOM 71 C GLY A 6 13.564 0.547 5.312 1.00 0.00 C ATOM 72 O GLY A 6 12.409 0.862 5.600 1.00 0.00 O ATOM 73 H GLY A 6 16.209 -1.283 5.748 1.00 0.00 H ATOM 74 HA2 GLY A 6 13.676 -0.955 6.817 1.00 0.00 H ATOM 75 HA3 GLY A 6 14.950 0.253 6.900 1.00 0.00 H ATOM 76 N LYS A 7 14.180 0.965 4.202 1.00 0.00 N ATOM 77 CA LYS A 7 13.523 1.840 3.233 1.00 0.00 C ATOM 78 C LYS A 7 12.195 1.238 2.764 1.00 0.00 C ATOM 79 O LYS A 7 11.167 1.917 2.756 1.00 0.00 O ATOM 80 CB LYS A 7 14.456 2.090 2.036 1.00 0.00 C ATOM 81 CG LYS A 7 13.946 3.129 1.042 1.00 0.00 C ATOM 82 CD LYS A 7 12.775 2.607 0.222 1.00 0.00 C ATOM 83 CE LYS A 7 11.629 3.604 0.189 1.00 0.00 C ATOM 84 NZ LYS A 7 10.331 2.943 0.301 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.102 0.678 4.031 1.00 0.00 H ATOM 86 HA LYS A 7 13.320 2.780 3.722 1.00 0.00 H ATOM 87 HB2 LYS A 7 15.412 2.426 2.408 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.596 1.159 1.507 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.627 4.006 1.585 1.00 0.00 H ATOM 90 HG3 LYS A 7 14.752 3.394 0.373 1.00 0.00 H ATOM 91 HD2 LYS A 7 13.112 2.430 -0.790 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.427 1.681 0.648 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.743 4.295 1.011 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.667 4.146 -0.745 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.302 1.975 0.148 1.00 0.00 H ATOM 96 N ARG A 8 12.226 -0.041 2.381 1.00 0.00 N ATOM 97 CA ARG A 8 11.027 -0.738 1.909 1.00 0.00 C ATOM 98 C ARG A 8 9.946 -0.798 2.988 1.00 0.00 C ATOM 99 O ARG A 8 8.760 -0.641 2.693 1.00 0.00 O ATOM 100 CB ARG A 8 11.380 -2.154 1.433 1.00 0.00 C ATOM 101 CG ARG A 8 12.139 -2.183 0.113 1.00 0.00 C ATOM 102 CD ARG A 8 12.476 -3.607 -0.311 1.00 0.00 C ATOM 103 NE ARG A 8 12.997 -3.673 -1.680 1.00 0.00 N ATOM 104 CZ ARG A 8 14.161 -3.144 -2.077 1.00 0.00 C ATOM 105 NH1 ARG A 8 14.969 -2.548 -1.206 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 14.524 -3.229 -3.353 1.00 0.00 N ATOM 107 H ARG A 8 13.076 -0.528 2.419 1.00 0.00 H ATOM 108 HA ARG A 8 10.639 -0.181 1.071 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.990 -2.633 2.185 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.467 -2.718 1.310 1.00 0.00 H ATOM 111 HG2 ARG A 8 11.526 -1.729 -0.652 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.053 -1.621 0.223 1.00 0.00 H ATOM 113 HD2 ARG A 8 13.221 -4.003 0.364 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.582 -4.208 -0.248 1.00 0.00 H ATOM 115 HE ARG A 8 12.441 -4.126 -2.348 1.00 0.00 H ATOM 116 HH11 ARG A 8 14.714 -2.491 -0.243 1.00 0.00 H ATOM 117 HH12 ARG A 8 15.834 -2.152 -1.516 1.00 0.00 H ATOM 118 HH21 ARG A 8 13.929 -3.686 -4.012 1.00 0.00 H ATOM 119 HH22 ARG A 8 15.392 -2.832 -3.654 1.00 0.00 H ATOM 120 N LYS A 9 10.360 -1.025 4.236 1.00 0.00 N ATOM 121 CA LYS A 9 9.424 -1.107 5.360 1.00 0.00 C ATOM 122 C LYS A 9 8.600 0.175 5.504 1.00 0.00 C ATOM 123 O LYS A 9 7.393 0.120 5.736 1.00 0.00 O ATOM 124 CB LYS A 9 10.176 -1.374 6.668 1.00 0.00 C ATOM 125 CG LYS A 9 10.983 -2.663 6.669 1.00 0.00 C ATOM 126 CD LYS A 9 11.699 -2.867 7.995 1.00 0.00 C ATOM 127 CE LYS A 9 12.523 -4.145 7.996 1.00 0.00 C ATOM 128 NZ LYS A 9 13.218 -4.358 9.297 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.319 -1.142 4.404 1.00 0.00 H ATOM 130 HA LYS A 9 8.753 -1.928 5.169 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.853 -0.553 6.853 1.00 0.00 H ATOM 132 HB3 LYS A 9 9.460 -1.424 7.475 1.00 0.00 H ATOM 133 HG2 LYS A 9 10.317 -3.496 6.498 1.00 0.00 H ATOM 134 HG3 LYS A 9 11.717 -2.618 5.876 1.00 0.00 H ATOM 135 HD2 LYS A 9 12.356 -2.027 8.170 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.964 -2.922 8.785 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.867 -4.982 7.807 1.00 0.00 H ATOM 138 HE3 LYS A 9 13.262 -4.083 7.210 1.00 0.00 H ATOM 139 HZ1 LYS A 9 13.981 -3.661 9.413 1.00 0.00 H ATOM 140 HZ2 LYS A 9 13.627 -5.313 9.331 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.544 -4.254 10.083 1.00 0.00 H ATOM 142 N SER A 10 9.269 1.324 5.383 1.00 0.00 N ATOM 143 CA SER A 10 8.611 2.625 5.519 1.00 0.00 C ATOM 144 C SER A 10 7.614 2.895 4.388 1.00 0.00 C ATOM 145 O SER A 10 6.491 3.334 4.639 1.00 0.00 O ATOM 146 CB SER A 10 9.658 3.743 5.567 1.00 0.00 C ATOM 147 OG SER A 10 9.046 5.011 5.742 1.00 0.00 O ATOM 148 H SER A 10 10.233 1.295 5.212 1.00 0.00 H ATOM 149 HA SER A 10 8.073 2.620 6.453 1.00 0.00 H ATOM 150 HB2 SER A 10 10.332 3.567 6.391 1.00 0.00 H ATOM 151 HB3 SER A 10 10.215 3.750 4.642 1.00 0.00 H ATOM 152 HG SER A 10 9.581 5.546 6.332 1.00 0.00 H ATOM 153 N ASP A 11 8.034 2.652 3.145 1.00 0.00 N ATOM 154 CA ASP A 11 7.174 2.892 1.981 1.00 0.00 C ATOM 155 C ASP A 11 5.955 1.970 1.976 1.00 0.00 C ATOM 156 O ASP A 11 4.839 2.413 1.706 1.00 0.00 O ATOM 157 CB ASP A 11 7.954 2.711 0.672 1.00 0.00 C ATOM 158 CG ASP A 11 9.198 3.576 0.598 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.139 4.790 0.801 1.00 0.00 O ATOM 160 H ASP A 11 8.944 2.314 3.006 1.00 0.00 H ATOM 161 HA ASP A 11 6.829 3.912 2.038 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.254 1.677 0.583 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.311 2.965 -0.158 1.00 0.00 H ATOM 164 N ARG A 12 6.180 0.687 2.253 1.00 0.00 N ATOM 165 CA ARG A 12 5.102 -0.304 2.259 1.00 0.00 C ATOM 166 C ARG A 12 4.037 0.001 3.316 1.00 0.00 C ATOM 167 O ARG A 12 2.840 -0.075 3.032 1.00 0.00 O ATOM 168 CB ARG A 12 5.674 -1.709 2.483 1.00 0.00 C ATOM 169 CG ARG A 12 4.638 -2.821 2.395 1.00 0.00 C ATOM 170 CD ARG A 12 3.986 -2.874 1.021 1.00 0.00 C ATOM 171 NE ARG A 12 3.029 -3.977 0.902 1.00 0.00 N ATOM 172 CZ ARG A 12 1.872 -4.049 1.571 1.00 0.00 C ATOM 173 NH1 ARG A 12 1.484 -3.055 2.367 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 1.092 -5.114 1.425 1.00 0.00 N ATOM 175 H ARG A 12 7.096 0.395 2.445 1.00 0.00 H ATOM 176 HA ARG A 12 4.634 -0.276 1.288 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.434 -1.897 1.738 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.127 -1.745 3.462 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.122 -3.767 2.588 1.00 0.00 H ATOM 180 HG3 ARG A 12 3.875 -2.649 3.140 1.00 0.00 H ATOM 181 HD2 ARG A 12 3.466 -1.943 0.846 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.758 -2.999 0.275 1.00 0.00 H ATOM 183 HE ARG A 12 3.269 -4.715 0.303 1.00 0.00 H ATOM 184 HH11 ARG A 12 2.056 -2.243 2.473 1.00 0.00 H ATOM 185 HH12 ARG A 12 0.617 -3.121 2.863 1.00 0.00 H ATOM 186 HH21 ARG A 12 1.371 -5.859 0.820 1.00 0.00 H ATOM 187 HH22 ARG A 12 0.227 -5.174 1.924 1.00 0.00 H ATOM 188 N LYS A 13 4.472 0.323 4.536 1.00 0.00 N ATOM 189 CA LYS A 13 3.538 0.612 5.629 1.00 0.00 C ATOM 190 C LYS A 13 2.746 1.897 5.382 1.00 0.00 C ATOM 191 O LYS A 13 1.523 1.919 5.555 1.00 0.00 O ATOM 192 CB LYS A 13 4.271 0.692 6.978 1.00 0.00 C ATOM 193 CG LYS A 13 5.230 1.869 7.103 1.00 0.00 C ATOM 194 CD LYS A 13 5.819 1.965 8.504 1.00 0.00 C ATOM 195 CE LYS A 13 6.646 0.739 8.858 1.00 0.00 C ATOM 196 NZ LYS A 13 7.135 0.790 10.264 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.437 0.354 4.707 1.00 0.00 H ATOM 198 HA LYS A 13 2.839 -0.208 5.671 1.00 0.00 H ATOM 199 HB2 LYS A 13 3.539 0.771 7.766 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.836 -0.218 7.118 1.00 0.00 H ATOM 201 HG2 LYS A 13 6.033 1.744 6.395 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.695 2.780 6.886 1.00 0.00 H ATOM 203 HD2 LYS A 13 6.450 2.839 8.557 1.00 0.00 H ATOM 204 HD3 LYS A 13 5.009 2.059 9.214 1.00 0.00 H ATOM 205 HE2 LYS A 13 6.037 -0.142 8.730 1.00 0.00 H ATOM 206 HE3 LYS A 13 7.495 0.689 8.193 1.00 0.00 H ATOM 207 HZ1 LYS A 13 7.696 -0.060 10.480 1.00 0.00 H ATOM 208 HZ2 LYS A 13 6.330 0.835 10.921 1.00 0.00 H ATOM 209 HZ3 LYS A 13 7.731 1.630 10.406 1.00 0.00 H ATOM 210 N LYS A 14 3.439 2.964 4.984 1.00 0.00 N ATOM 211 CA LYS A 14 2.784 4.243 4.725 1.00 0.00 C ATOM 212 C LYS A 14 1.877 4.164 3.503 1.00 0.00 C ATOM 213 O LYS A 14 0.797 4.737 3.499 1.00 0.00 O ATOM 214 CB LYS A 14 3.809 5.365 4.538 1.00 0.00 C ATOM 215 CG LYS A 14 3.176 6.747 4.432 1.00 0.00 C ATOM 216 CD LYS A 14 2.455 7.127 5.719 1.00 0.00 C ATOM 217 CE LYS A 14 1.752 8.475 5.607 1.00 0.00 C ATOM 218 NZ LYS A 14 0.556 8.431 4.757 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.408 2.888 4.863 1.00 0.00 H ATOM 220 HA LYS A 14 2.174 4.472 5.586 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.484 5.363 5.380 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.370 5.178 3.635 1.00 0.00 H ATOM 223 HG2 LYS A 14 3.951 7.473 4.238 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.466 6.747 3.618 1.00 0.00 H ATOM 225 HD2 LYS A 14 1.719 6.370 5.942 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.176 7.175 6.521 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.461 8.794 6.596 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.448 9.191 5.193 1.00 0.00 H ATOM 229 HZ1 LYS A 14 0.526 9.040 3.990 1.00 0.00 H ATOM 230 N LYS A 15 2.324 3.456 2.469 1.00 0.00 N ATOM 231 CA LYS A 15 1.544 3.310 1.239 1.00 0.00 C ATOM 232 C LYS A 15 0.196 2.640 1.515 1.00 0.00 C ATOM 233 O LYS A 15 -0.822 3.019 0.934 1.00 0.00 O ATOM 234 CB LYS A 15 2.331 2.502 0.204 1.00 0.00 C ATOM 235 CG LYS A 15 1.592 2.295 -1.111 1.00 0.00 C ATOM 236 CD LYS A 15 2.431 1.515 -2.112 1.00 0.00 C ATOM 237 CE LYS A 15 2.788 0.131 -1.590 1.00 0.00 C ATOM 238 NZ LYS A 15 3.583 -0.649 -2.579 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.200 3.021 2.531 1.00 0.00 H ATOM 240 HA LYS A 15 1.362 4.298 0.847 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.257 3.016 -0.007 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.557 1.531 0.622 1.00 0.00 H ATOM 243 HG2 LYS A 15 0.681 1.747 -0.918 1.00 0.00 H ATOM 244 HG3 LYS A 15 1.352 3.260 -1.531 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.872 1.407 -3.029 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.342 2.062 -2.307 1.00 0.00 H ATOM 247 HE2 LYS A 15 3.367 0.239 -0.684 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.876 -0.404 -1.370 1.00 0.00 H ATOM 249 HZ1 LYS A 15 3.715 -1.624 -2.241 1.00 0.00 H ATOM 250 HZ2 LYS A 15 4.516 -0.211 -2.713 1.00 0.00 H ATOM 251 HZ3 LYS A 15 3.090 -0.675 -3.494 1.00 0.00 H ATOM 252 N ASN A 16 0.198 1.641 2.399 1.00 0.00 N ATOM 253 CA ASN A 16 -1.026 0.920 2.746 1.00 0.00 C ATOM 254 C ASN A 16 -2.016 1.831 3.473 1.00 0.00 C ATOM 255 O ASN A 16 -3.190 1.900 3.108 1.00 0.00 O ATOM 256 CB ASN A 16 -0.699 -0.301 3.613 1.00 0.00 C ATOM 257 CG ASN A 16 -1.919 -1.159 3.895 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.530 -1.707 2.978 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.284 -1.276 5.167 1.00 0.00 N ATOM 260 H ASN A 16 1.041 1.383 2.827 1.00 0.00 H ATOM 261 HA ASN A 16 -1.480 0.584 1.827 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.034 -0.908 3.104 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.290 0.035 4.554 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.755 -0.809 5.848 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.068 -1.827 5.374 1.00 0.00 H ATOM 266 N GLN A 17 -1.531 2.529 4.502 1.00 0.00 N ATOM 267 CA GLN A 17 -2.372 3.441 5.284 1.00 0.00 C ATOM 268 C GLN A 17 -2.669 4.728 4.512 1.00 0.00 C ATOM 269 O GLN A 17 -3.796 5.226 4.526 1.00 0.00 O ATOM 270 CB GLN A 17 -1.693 3.770 6.619 1.00 0.00 C ATOM 271 CG GLN A 17 -2.482 4.735 7.496 1.00 0.00 C ATOM 272 CD GLN A 17 -3.869 4.221 7.838 1.00 0.00 C ATOM 273 OE1 GLN A 17 -4.019 3.146 8.418 1.00 0.00 O ATOM 274 NE2 GLN A 17 -4.893 4.992 7.483 1.00 0.00 N ATOM 275 H GLN A 17 -0.585 2.429 4.740 1.00 0.00 H ATOM 276 HA GLN A 17 -3.304 2.935 5.484 1.00 0.00 H ATOM 277 HB2 GLN A 17 -1.550 2.854 7.172 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.727 4.212 6.418 1.00 0.00 H ATOM 279 HG2 GLN A 17 -1.938 4.891 8.414 1.00 0.00 H ATOM 280 HG3 GLN A 17 -2.580 5.676 6.975 1.00 0.00 H ATOM 281 HE21 GLN A 17 -4.702 5.838 7.026 1.00 0.00 H ATOM 282 HE22 GLN A 17 -5.799 4.682 7.693 1.00 0.00 H ATOM 283 N ASP A 18 -1.645 5.262 3.847 1.00 0.00 N ATOM 284 CA ASP A 18 -1.768 6.495 3.071 1.00 0.00 C ATOM 285 C ASP A 18 -0.715 6.558 1.960 1.00 0.00 C ATOM 286 O ASP A 18 0.254 7.314 2.046 1.00 0.00 O ATOM 287 CB ASP A 18 -1.642 7.721 3.987 1.00 0.00 C ATOM 288 CG ASP A 18 -0.483 7.619 4.973 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.528 6.825 5.914 1.00 0.00 O ATOM 290 H ASP A 18 -0.774 4.815 3.885 1.00 0.00 H ATOM 291 HA ASP A 18 -2.747 6.501 2.616 1.00 0.00 H ATOM 292 HB2 ASP A 18 -1.494 8.600 3.380 1.00 0.00 H ATOM 293 HB3 ASP A 18 -2.557 7.831 4.551 1.00 0.00 H HETATM 294 N NH2 A 19 -0.907 5.762 0.915 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.699 5.184 0.910 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -0.247 5.783 0.191 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 5 ATOM 1 N PHE A 1 11.795 1.819 -5.610 1.00 0.00 N ATOM 2 CA PHE A 1 10.839 0.721 -5.713 1.00 0.00 C ATOM 3 C PHE A 1 11.524 -0.627 -5.486 1.00 0.00 C ATOM 4 O PHE A 1 11.028 -1.461 -4.730 1.00 0.00 O ATOM 5 CB PHE A 1 10.158 0.739 -7.086 1.00 0.00 C ATOM 6 CG PHE A 1 9.122 -0.340 -7.268 1.00 0.00 C ATOM 7 CD1 PHE A 1 8.132 -0.542 -6.318 1.00 0.00 C ATOM 8 CD2 PHE A 1 9.139 -1.147 -8.393 1.00 0.00 C ATOM 9 CE1 PHE A 1 7.182 -1.531 -6.487 1.00 0.00 C ATOM 10 CE2 PHE A 1 8.191 -2.138 -8.568 1.00 0.00 C ATOM 11 CZ PHE A 1 7.211 -2.330 -7.614 1.00 0.00 C ATOM 12 H1 PHE A 1 12.254 1.975 -4.758 1.00 0.00 H ATOM 13 HA PHE A 1 10.090 0.862 -4.948 1.00 0.00 H ATOM 14 HB2 PHE A 1 9.670 1.692 -7.225 1.00 0.00 H ATOM 15 HB3 PHE A 1 10.909 0.611 -7.852 1.00 0.00 H ATOM 16 HD1 PHE A 1 8.108 0.082 -5.437 1.00 0.00 H ATOM 17 HD2 PHE A 1 9.906 -1.000 -9.141 1.00 0.00 H ATOM 18 HE1 PHE A 1 6.417 -1.680 -5.741 1.00 0.00 H ATOM 19 HE2 PHE A 1 8.217 -2.760 -9.450 1.00 0.00 H ATOM 20 HZ PHE A 1 6.471 -3.103 -7.749 1.00 0.00 H ATOM 21 N GLY A 2 12.663 -0.835 -6.147 1.00 0.00 N ATOM 22 CA GLY A 2 13.391 -2.083 -5.996 1.00 0.00 C ATOM 23 C GLY A 2 14.472 -2.003 -4.932 1.00 0.00 C ATOM 24 O GLY A 2 14.503 -2.820 -4.010 1.00 0.00 O ATOM 25 H GLY A 2 13.012 -0.136 -6.739 1.00 0.00 H ATOM 26 HA2 GLY A 2 12.695 -2.863 -5.728 1.00 0.00 H ATOM 27 HA3 GLY A 2 13.851 -2.335 -6.940 1.00 0.00 H ATOM 28 N GLY A 3 15.363 -1.019 -5.066 1.00 0.00 N ATOM 29 CA GLY A 3 16.445 -0.851 -4.111 1.00 0.00 C ATOM 30 C GLY A 3 16.093 0.079 -2.962 1.00 0.00 C ATOM 31 O GLY A 3 16.322 1.287 -3.047 1.00 0.00 O ATOM 32 H GLY A 3 15.287 -0.403 -5.825 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.703 -1.818 -3.706 1.00 0.00 H ATOM 34 HA3 GLY A 3 17.305 -0.452 -4.629 1.00 0.00 H ATOM 35 N PHE A 4 15.555 -0.486 -1.881 1.00 0.00 N ATOM 36 CA PHE A 4 15.190 0.299 -0.699 1.00 0.00 C ATOM 37 C PHE A 4 14.857 -0.612 0.491 1.00 0.00 C ATOM 38 O PHE A 4 13.863 -0.402 1.191 1.00 0.00 O ATOM 39 CB PHE A 4 14.015 1.247 -1.005 1.00 0.00 C ATOM 40 CG PHE A 4 12.721 0.579 -1.415 1.00 0.00 C ATOM 41 CD1 PHE A 4 12.560 -0.800 -1.352 1.00 0.00 C ATOM 42 CD2 PHE A 4 11.655 1.347 -1.861 1.00 0.00 C ATOM 43 CE1 PHE A 4 11.370 -1.391 -1.724 1.00 0.00 C ATOM 44 CE2 PHE A 4 10.463 0.759 -2.234 1.00 0.00 C ATOM 45 CZ PHE A 4 10.320 -0.612 -2.163 1.00 0.00 C ATOM 46 H PHE A 4 15.411 -1.457 -1.872 1.00 0.00 H ATOM 47 HA PHE A 4 16.051 0.894 -0.434 1.00 0.00 H ATOM 48 HB2 PHE A 4 13.808 1.834 -0.127 1.00 0.00 H ATOM 49 HB3 PHE A 4 14.307 1.912 -1.805 1.00 0.00 H ATOM 50 HD1 PHE A 4 13.377 -1.414 -1.011 1.00 0.00 H ATOM 51 HD2 PHE A 4 11.764 2.420 -1.918 1.00 0.00 H ATOM 52 HE1 PHE A 4 11.261 -2.463 -1.669 1.00 0.00 H ATOM 53 HE2 PHE A 4 9.642 1.371 -2.579 1.00 0.00 H ATOM 54 HZ PHE A 4 9.387 -1.074 -2.453 1.00 0.00 H ATOM 55 N THR A 5 15.704 -1.622 0.711 1.00 0.00 N ATOM 56 CA THR A 5 15.516 -2.575 1.807 1.00 0.00 C ATOM 57 C THR A 5 15.410 -1.874 3.163 1.00 0.00 C ATOM 58 O THR A 5 14.584 -2.246 3.997 1.00 0.00 O ATOM 59 CB THR A 5 16.663 -3.610 1.859 1.00 0.00 C ATOM 60 OG1 THR A 5 17.928 -2.942 1.961 1.00 0.00 O ATOM 61 CG2 THR A 5 16.653 -4.495 0.620 1.00 0.00 C ATOM 62 H THR A 5 16.477 -1.729 0.117 1.00 0.00 H ATOM 63 HA THR A 5 14.597 -3.108 1.622 1.00 0.00 H ATOM 64 HB THR A 5 16.524 -4.235 2.729 1.00 0.00 H ATOM 65 HG1 THR A 5 18.214 -2.934 2.877 1.00 0.00 H ATOM 66 HG21 THR A 5 15.643 -4.827 0.423 1.00 0.00 H ATOM 67 HG22 THR A 5 17.287 -5.353 0.785 1.00 0.00 H ATOM 68 HG23 THR A 5 17.018 -3.935 -0.227 1.00 0.00 H ATOM 69 N GLY A 6 16.250 -0.863 3.374 1.00 0.00 N ATOM 70 CA GLY A 6 16.236 -0.127 4.629 1.00 0.00 C ATOM 71 C GLY A 6 14.887 0.504 4.936 1.00 0.00 C ATOM 72 O GLY A 6 14.399 0.411 6.063 1.00 0.00 O ATOM 73 H GLY A 6 16.887 -0.613 2.672 1.00 0.00 H ATOM 74 HA2 GLY A 6 16.494 -0.803 5.430 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.982 0.652 4.580 1.00 0.00 H ATOM 76 N LYS A 7 14.287 1.152 3.934 1.00 0.00 N ATOM 77 CA LYS A 7 12.989 1.809 4.106 1.00 0.00 C ATOM 78 C LYS A 7 11.821 0.906 3.673 1.00 0.00 C ATOM 79 O LYS A 7 10.800 1.398 3.186 1.00 0.00 O ATOM 80 CB LYS A 7 12.955 3.114 3.301 1.00 0.00 C ATOM 81 CG LYS A 7 13.125 2.900 1.803 1.00 0.00 C ATOM 82 CD LYS A 7 12.748 4.136 0.997 1.00 0.00 C ATOM 83 CE LYS A 7 11.360 4.652 1.359 1.00 0.00 C ATOM 84 NZ LYS A 7 10.362 3.582 1.449 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.731 1.194 3.060 1.00 0.00 H ATOM 86 HA LYS A 7 12.874 2.043 5.153 1.00 0.00 H ATOM 87 HB2 LYS A 7 12.008 3.604 3.471 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.751 3.757 3.645 1.00 0.00 H ATOM 89 HG2 LYS A 7 14.158 2.660 1.602 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.499 2.077 1.494 1.00 0.00 H ATOM 91 HD2 LYS A 7 13.470 4.915 1.193 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.766 3.886 -0.053 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.417 5.154 2.313 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.048 5.359 0.603 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.683 2.673 1.624 1.00 0.00 H ATOM 96 N ARG A 8 11.965 -0.408 3.857 1.00 0.00 N ATOM 97 CA ARG A 8 10.910 -1.356 3.483 1.00 0.00 C ATOM 98 C ARG A 8 9.683 -1.232 4.390 1.00 0.00 C ATOM 99 O ARG A 8 8.549 -1.291 3.915 1.00 0.00 O ATOM 100 CB ARG A 8 11.445 -2.792 3.526 1.00 0.00 C ATOM 101 CG ARG A 8 12.330 -3.150 2.343 1.00 0.00 C ATOM 102 CD ARG A 8 11.509 -3.496 1.108 1.00 0.00 C ATOM 103 NE ARG A 8 10.778 -4.754 1.273 1.00 0.00 N ATOM 104 CZ ARG A 8 10.029 -5.317 0.321 1.00 0.00 C ATOM 105 NH1 ARG A 8 9.878 -4.727 -0.860 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.424 -6.477 0.554 1.00 0.00 N ATOM 107 H ARG A 8 12.794 -0.750 4.253 1.00 0.00 H ATOM 108 HA ARG A 8 10.611 -1.127 2.472 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.022 -2.921 4.430 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.608 -3.475 3.543 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.963 -2.306 2.113 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.942 -3.999 2.607 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.803 -2.700 0.925 1.00 0.00 H ATOM 114 HD3 ARG A 8 12.176 -3.585 0.262 1.00 0.00 H ATOM 115 HE ARG A 8 10.856 -5.210 2.137 1.00 0.00 H ATOM 116 HH11 ARG A 8 10.325 -3.854 -1.044 1.00 0.00 H ATOM 117 HH12 ARG A 8 9.317 -5.158 -1.567 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.528 -6.926 1.442 1.00 0.00 H ATOM 119 HH22 ARG A 8 8.866 -6.902 -0.158 1.00 0.00 H ATOM 120 N LYS A 9 9.918 -1.075 5.691 1.00 0.00 N ATOM 121 CA LYS A 9 8.830 -0.960 6.666 1.00 0.00 C ATOM 122 C LYS A 9 8.075 0.365 6.536 1.00 0.00 C ATOM 123 O LYS A 9 6.843 0.386 6.543 1.00 0.00 O ATOM 124 CB LYS A 9 9.366 -1.110 8.097 1.00 0.00 C ATOM 125 CG LYS A 9 9.816 -2.526 8.453 1.00 0.00 C ATOM 126 CD LYS A 9 11.047 -2.959 7.665 1.00 0.00 C ATOM 127 CE LYS A 9 12.252 -2.081 7.975 1.00 0.00 C ATOM 128 NZ LYS A 9 13.436 -2.453 7.152 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.845 -1.043 6.006 1.00 0.00 H ATOM 130 HA LYS A 9 8.138 -1.765 6.474 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.210 -0.448 8.223 1.00 0.00 H ATOM 132 HB3 LYS A 9 8.590 -0.821 8.791 1.00 0.00 H ATOM 133 HG2 LYS A 9 10.052 -2.561 9.506 1.00 0.00 H ATOM 134 HG3 LYS A 9 9.009 -3.210 8.242 1.00 0.00 H ATOM 135 HD2 LYS A 9 11.285 -3.979 7.925 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.828 -2.897 6.610 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.995 -1.052 7.773 1.00 0.00 H ATOM 138 HE3 LYS A 9 12.501 -2.190 9.019 1.00 0.00 H ATOM 139 HZ1 LYS A 9 13.714 -3.436 7.350 1.00 0.00 H ATOM 140 HZ2 LYS A 9 14.236 -1.828 7.374 1.00 0.00 H ATOM 141 HZ3 LYS A 9 13.211 -2.364 6.140 1.00 0.00 H ATOM 142 N SER A 10 8.820 1.465 6.433 1.00 0.00 N ATOM 143 CA SER A 10 8.226 2.800 6.322 1.00 0.00 C ATOM 144 C SER A 10 7.359 2.945 5.070 1.00 0.00 C ATOM 145 O SER A 10 6.217 3.398 5.150 1.00 0.00 O ATOM 146 CB SER A 10 9.325 3.867 6.319 1.00 0.00 C ATOM 147 OG SER A 10 8.777 5.170 6.215 1.00 0.00 O ATOM 148 H SER A 10 9.796 1.379 6.446 1.00 0.00 H ATOM 149 HA SER A 10 7.602 2.951 7.188 1.00 0.00 H ATOM 150 HB2 SER A 10 9.890 3.802 7.238 1.00 0.00 H ATOM 151 HB3 SER A 10 9.985 3.699 5.481 1.00 0.00 H ATOM 152 HG SER A 10 8.708 5.560 7.091 1.00 0.00 H ATOM 153 N ASP A 11 7.914 2.579 3.915 1.00 0.00 N ATOM 154 CA ASP A 11 7.196 2.690 2.643 1.00 0.00 C ATOM 155 C ASP A 11 6.050 1.684 2.518 1.00 0.00 C ATOM 156 O ASP A 11 4.983 2.031 2.014 1.00 0.00 O ATOM 157 CB ASP A 11 8.165 2.555 1.465 1.00 0.00 C ATOM 158 CG ASP A 11 9.053 3.781 1.324 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.562 4.892 1.118 1.00 0.00 O ATOM 160 H ASP A 11 8.833 2.238 3.916 1.00 0.00 H ATOM 161 HA ASP A 11 6.768 3.680 2.613 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.794 1.691 1.618 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.604 2.430 0.552 1.00 0.00 H ATOM 164 N ARG A 12 6.262 0.448 2.970 1.00 0.00 N ATOM 165 CA ARG A 12 5.218 -0.581 2.891 1.00 0.00 C ATOM 166 C ARG A 12 3.954 -0.158 3.642 1.00 0.00 C ATOM 167 O ARG A 12 2.845 -0.274 3.115 1.00 0.00 O ATOM 168 CB ARG A 12 5.730 -1.924 3.424 1.00 0.00 C ATOM 169 CG ARG A 12 4.634 -2.965 3.605 1.00 0.00 C ATOM 170 CD ARG A 12 5.196 -4.377 3.648 1.00 0.00 C ATOM 171 NE ARG A 12 5.655 -4.822 2.332 1.00 0.00 N ATOM 172 CZ ARG A 12 6.124 -6.045 2.075 1.00 0.00 C ATOM 173 NH1 ARG A 12 6.233 -6.946 3.048 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 6.490 -6.367 0.839 1.00 0.00 N ATOM 175 H ARG A 12 7.131 0.222 3.363 1.00 0.00 H ATOM 176 HA ARG A 12 4.965 -0.698 1.848 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.461 -2.318 2.733 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.204 -1.761 4.381 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.116 -2.769 4.532 1.00 0.00 H ATOM 180 HG3 ARG A 12 3.940 -2.889 2.781 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.029 -4.399 4.336 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.424 -5.048 3.997 1.00 0.00 H ATOM 183 HE ARG A 12 5.599 -4.178 1.594 1.00 0.00 H ATOM 184 HH11 ARG A 12 5.962 -6.713 3.982 1.00 0.00 H ATOM 185 HH12 ARG A 12 6.585 -7.861 2.845 1.00 0.00 H ATOM 186 HH21 ARG A 12 6.414 -5.693 0.103 1.00 0.00 H ATOM 187 HH22 ARG A 12 6.839 -7.283 0.642 1.00 0.00 H ATOM 188 N LYS A 13 4.124 0.335 4.869 1.00 0.00 N ATOM 189 CA LYS A 13 2.989 0.776 5.681 1.00 0.00 C ATOM 190 C LYS A 13 2.332 2.015 5.075 1.00 0.00 C ATOM 191 O LYS A 13 1.118 2.048 4.885 1.00 0.00 O ATOM 192 CB LYS A 13 3.428 1.067 7.119 1.00 0.00 C ATOM 193 CG LYS A 13 3.993 -0.145 7.844 1.00 0.00 C ATOM 194 CD LYS A 13 4.344 0.171 9.293 1.00 0.00 C ATOM 195 CE LYS A 13 3.113 0.186 10.193 1.00 0.00 C ATOM 196 NZ LYS A 13 2.166 1.288 9.858 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.030 0.406 5.233 1.00 0.00 H ATOM 198 HA LYS A 13 2.266 -0.024 5.692 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.187 1.835 7.101 1.00 0.00 H ATOM 200 HB3 LYS A 13 2.577 1.428 7.672 1.00 0.00 H ATOM 201 HG2 LYS A 13 3.258 -0.935 7.829 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.885 -0.474 7.331 1.00 0.00 H ATOM 203 HD2 LYS A 13 5.030 -0.580 9.656 1.00 0.00 H ATOM 204 HD3 LYS A 13 4.819 1.140 9.332 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.599 -0.757 10.088 1.00 0.00 H ATOM 206 HE3 LYS A 13 3.438 0.303 11.217 1.00 0.00 H ATOM 207 HZ1 LYS A 13 1.639 1.574 10.708 1.00 0.00 H ATOM 208 HZ2 LYS A 13 1.488 0.970 9.137 1.00 0.00 H ATOM 209 HZ3 LYS A 13 2.685 2.111 9.493 1.00 0.00 H ATOM 210 N LYS A 14 3.148 3.023 4.770 1.00 0.00 N ATOM 211 CA LYS A 14 2.664 4.273 4.176 1.00 0.00 C ATOM 212 C LYS A 14 1.963 4.021 2.843 1.00 0.00 C ATOM 213 O LYS A 14 1.006 4.708 2.497 1.00 0.00 O ATOM 214 CB LYS A 14 3.832 5.245 3.971 1.00 0.00 C ATOM 215 CG LYS A 14 4.289 5.941 5.245 1.00 0.00 C ATOM 216 CD LYS A 14 3.692 7.341 5.394 1.00 0.00 C ATOM 217 CE LYS A 14 2.176 7.328 5.563 1.00 0.00 C ATOM 218 NZ LYS A 14 1.463 7.202 4.288 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.107 2.923 4.945 1.00 0.00 H ATOM 220 HA LYS A 14 1.953 4.713 4.864 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.670 4.695 3.571 1.00 0.00 H ATOM 222 HB3 LYS A 14 3.537 5.999 3.258 1.00 0.00 H ATOM 223 HG2 LYS A 14 3.990 5.346 6.094 1.00 0.00 H ATOM 224 HG3 LYS A 14 5.366 6.022 5.226 1.00 0.00 H ATOM 225 HD2 LYS A 14 4.130 7.813 6.260 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.939 7.916 4.513 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.907 6.493 6.194 1.00 0.00 H ATOM 228 HE3 LYS A 14 1.876 8.248 6.042 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.853 6.623 3.605 1.00 0.00 H ATOM 230 N LYS A 15 2.448 3.038 2.097 1.00 0.00 N ATOM 231 CA LYS A 15 1.862 2.706 0.803 1.00 0.00 C ATOM 232 C LYS A 15 0.380 2.372 0.957 1.00 0.00 C ATOM 233 O LYS A 15 -0.464 2.904 0.234 1.00 0.00 O ATOM 234 CB LYS A 15 2.612 1.528 0.170 1.00 0.00 C ATOM 235 CG LYS A 15 2.105 1.144 -1.210 1.00 0.00 C ATOM 236 CD LYS A 15 2.894 -0.022 -1.787 1.00 0.00 C ATOM 237 CE LYS A 15 2.394 -0.409 -3.172 1.00 0.00 C ATOM 238 NZ LYS A 15 2.521 0.710 -4.149 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.213 2.522 2.423 1.00 0.00 H ATOM 240 HA LYS A 15 1.959 3.571 0.164 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.656 1.789 0.083 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.518 0.668 0.817 1.00 0.00 H ATOM 243 HG2 LYS A 15 1.066 0.859 -1.135 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.201 1.994 -1.869 1.00 0.00 H ATOM 245 HD2 LYS A 15 3.935 0.260 -1.857 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.793 -0.872 -1.127 1.00 0.00 H ATOM 247 HE2 LYS A 15 2.974 -1.248 -3.526 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.356 -0.696 -3.098 1.00 0.00 H ATOM 249 HZ1 LYS A 15 2.397 0.353 -5.118 1.00 0.00 H ATOM 250 HZ2 LYS A 15 3.460 1.150 -4.071 1.00 0.00 H ATOM 251 HZ3 LYS A 15 1.794 1.432 -3.963 1.00 0.00 H ATOM 252 N ASN A 16 0.077 1.492 1.911 1.00 0.00 N ATOM 253 CA ASN A 16 -1.303 1.080 2.178 1.00 0.00 C ATOM 254 C ASN A 16 -2.047 2.138 2.994 1.00 0.00 C ATOM 255 O ASN A 16 -3.192 2.478 2.691 1.00 0.00 O ATOM 256 CB ASN A 16 -1.327 -0.260 2.929 1.00 0.00 C ATOM 257 CG ASN A 16 -0.701 -1.418 2.155 1.00 0.00 C ATOM 258 OD1 ASN A 16 -0.503 -2.499 2.712 1.00 0.00 O ATOM 259 ND2 ASN A 16 -0.400 -1.221 0.871 1.00 0.00 N ATOM 260 H ASN A 16 0.802 1.114 2.453 1.00 0.00 H ATOM 261 HA ASN A 16 -1.802 0.961 1.230 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.789 -0.148 3.857 1.00 0.00 H ATOM 263 HB3 ASN A 16 -2.353 -0.517 3.148 1.00 0.00 H ATOM 264 HD21 ASN A 16 -0.592 -0.349 0.474 1.00 0.00 H ATOM 265 HD22 ASN A 16 0.007 -1.962 0.375 1.00 0.00 H ATOM 266 N GLN A 17 -1.383 2.643 4.034 1.00 0.00 N ATOM 267 CA GLN A 17 -1.960 3.656 4.917 1.00 0.00 C ATOM 268 C GLN A 17 -2.349 4.918 4.154 1.00 0.00 C ATOM 269 O GLN A 17 -3.511 5.330 4.168 1.00 0.00 O ATOM 270 CB GLN A 17 -0.960 4.011 6.023 1.00 0.00 C ATOM 271 CG GLN A 17 -0.786 2.919 7.066 1.00 0.00 C ATOM 272 CD GLN A 17 0.219 3.290 8.137 1.00 0.00 C ATOM 273 OE1 GLN A 17 1.386 3.557 7.845 1.00 0.00 O ATOM 274 NE2 GLN A 17 -0.225 3.307 9.389 1.00 0.00 N ATOM 275 H GLN A 17 -0.475 2.319 4.217 1.00 0.00 H ATOM 276 HA GLN A 17 -2.844 3.237 5.368 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.004 4.197 5.570 1.00 0.00 H ATOM 278 HB3 GLN A 17 -1.288 4.909 6.521 1.00 0.00 H ATOM 279 HG2 GLN A 17 -1.740 2.735 7.537 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.451 2.018 6.573 1.00 0.00 H ATOM 281 HE21 GLN A 17 -1.165 3.081 9.552 1.00 0.00 H ATOM 282 HE22 GLN A 17 0.406 3.540 10.101 1.00 0.00 H ATOM 283 N ASP A 18 -1.368 5.530 3.500 1.00 0.00 N ATOM 284 CA ASP A 18 -1.588 6.754 2.736 1.00 0.00 C ATOM 285 C ASP A 18 -2.124 6.445 1.338 1.00 0.00 C ATOM 286 O ASP A 18 -3.121 7.021 0.904 1.00 0.00 O ATOM 287 CB ASP A 18 -0.283 7.551 2.645 1.00 0.00 C ATOM 288 CG ASP A 18 0.313 7.820 4.016 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.262 8.556 4.820 1.00 0.00 O ATOM 290 H ASP A 18 -0.466 5.150 3.538 1.00 0.00 H ATOM 291 HA ASP A 18 -2.321 7.345 3.265 1.00 0.00 H ATOM 292 HB2 ASP A 18 0.433 6.993 2.060 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.478 8.498 2.162 1.00 0.00 H HETATM 294 N NH2 A 19 -1.462 5.533 0.630 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.675 5.109 1.033 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -1.790 5.320 -0.269 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 6 ATOM 1 N PHE A 1 26.532 -8.280 4.726 1.00 0.00 N ATOM 2 CA PHE A 1 27.166 -7.889 3.469 1.00 0.00 C ATOM 3 C PHE A 1 26.118 -7.489 2.431 1.00 0.00 C ATOM 4 O PHE A 1 26.245 -6.452 1.778 1.00 0.00 O ATOM 5 CB PHE A 1 28.033 -9.030 2.924 1.00 0.00 C ATOM 6 CG PHE A 1 29.143 -9.449 3.850 1.00 0.00 C ATOM 7 CD1 PHE A 1 28.862 -10.030 5.078 1.00 0.00 C ATOM 8 CD2 PHE A 1 30.469 -9.272 3.485 1.00 0.00 C ATOM 9 CE1 PHE A 1 29.881 -10.418 5.926 1.00 0.00 C ATOM 10 CE2 PHE A 1 31.491 -9.660 4.330 1.00 0.00 C ATOM 11 CZ PHE A 1 31.197 -10.234 5.551 1.00 0.00 C ATOM 12 H1 PHE A 1 26.848 -7.886 5.567 1.00 0.00 H ATOM 13 HA PHE A 1 27.797 -7.035 3.671 1.00 0.00 H ATOM 14 HB2 PHE A 1 27.408 -9.892 2.745 1.00 0.00 H ATOM 15 HB3 PHE A 1 28.478 -8.718 1.989 1.00 0.00 H ATOM 16 HD1 PHE A 1 27.833 -10.175 5.372 1.00 0.00 H ATOM 17 HD2 PHE A 1 30.700 -8.821 2.532 1.00 0.00 H ATOM 18 HE1 PHE A 1 29.648 -10.867 6.880 1.00 0.00 H ATOM 19 HE2 PHE A 1 32.520 -9.516 4.035 1.00 0.00 H ATOM 20 HZ PHE A 1 31.995 -10.537 6.213 1.00 0.00 H ATOM 21 N GLY A 2 25.084 -8.322 2.288 1.00 0.00 N ATOM 22 CA GLY A 2 24.023 -8.049 1.331 1.00 0.00 C ATOM 23 C GLY A 2 23.174 -6.850 1.722 1.00 0.00 C ATOM 24 O GLY A 2 22.867 -6.659 2.900 1.00 0.00 O ATOM 25 H GLY A 2 25.042 -9.133 2.837 1.00 0.00 H ATOM 26 HA2 GLY A 2 24.466 -7.863 0.365 1.00 0.00 H ATOM 27 HA3 GLY A 2 23.387 -8.919 1.261 1.00 0.00 H ATOM 28 N GLY A 3 22.793 -6.043 0.725 1.00 0.00 N ATOM 29 CA GLY A 3 21.974 -4.865 0.979 1.00 0.00 C ATOM 30 C GLY A 3 20.628 -5.212 1.594 1.00 0.00 C ATOM 31 O GLY A 3 20.001 -6.199 1.205 1.00 0.00 O ATOM 32 H GLY A 3 23.068 -6.252 -0.192 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.506 -4.208 1.649 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.807 -4.351 0.044 1.00 0.00 H ATOM 35 N PHE A 4 20.185 -4.404 2.558 1.00 0.00 N ATOM 36 CA PHE A 4 18.907 -4.640 3.227 1.00 0.00 C ATOM 37 C PHE A 4 18.013 -3.402 3.156 1.00 0.00 C ATOM 38 O PHE A 4 18.445 -2.294 3.482 1.00 0.00 O ATOM 39 CB PHE A 4 19.139 -5.031 4.691 1.00 0.00 C ATOM 40 CG PHE A 4 17.896 -5.498 5.398 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.248 -6.657 4.996 1.00 0.00 C ATOM 42 CD2 PHE A 4 17.372 -4.776 6.457 1.00 0.00 C ATOM 43 CE1 PHE A 4 16.103 -7.084 5.639 1.00 0.00 C ATOM 44 CE2 PHE A 4 16.227 -5.200 7.104 1.00 0.00 C ATOM 45 CZ PHE A 4 15.592 -6.355 6.694 1.00 0.00 C ATOM 46 H PHE A 4 20.730 -3.634 2.827 1.00 0.00 H ATOM 47 HA PHE A 4 18.411 -5.456 2.721 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.864 -5.830 4.734 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.525 -4.175 5.228 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.648 -7.230 4.172 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.868 -3.872 6.779 1.00 0.00 H ATOM 52 HE1 PHE A 4 15.609 -7.989 5.316 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.829 -4.627 7.929 1.00 0.00 H ATOM 54 HZ PHE A 4 14.695 -6.688 7.197 1.00 0.00 H ATOM 55 N THR A 5 16.763 -3.606 2.736 1.00 0.00 N ATOM 56 CA THR A 5 15.790 -2.519 2.627 1.00 0.00 C ATOM 57 C THR A 5 15.148 -2.218 3.985 1.00 0.00 C ATOM 58 O THR A 5 13.984 -2.550 4.223 1.00 0.00 O ATOM 59 CB THR A 5 14.693 -2.842 1.591 1.00 0.00 C ATOM 60 OG1 THR A 5 14.093 -4.111 1.888 1.00 0.00 O ATOM 61 CG2 THR A 5 15.266 -2.860 0.181 1.00 0.00 C ATOM 62 H THR A 5 16.484 -4.515 2.499 1.00 0.00 H ATOM 63 HA THR A 5 16.319 -1.636 2.293 1.00 0.00 H ATOM 64 HB THR A 5 13.936 -2.073 1.643 1.00 0.00 H ATOM 65 HG1 THR A 5 13.413 -4.304 1.238 1.00 0.00 H ATOM 66 HG21 THR A 5 14.513 -3.216 -0.508 1.00 0.00 H ATOM 67 HG22 THR A 5 16.123 -3.514 0.148 1.00 0.00 H ATOM 68 HG23 THR A 5 15.564 -1.860 -0.099 1.00 0.00 H ATOM 69 N GLY A 6 15.926 -1.601 4.872 1.00 0.00 N ATOM 70 CA GLY A 6 15.443 -1.269 6.204 1.00 0.00 C ATOM 71 C GLY A 6 14.249 -0.326 6.205 1.00 0.00 C ATOM 72 O GLY A 6 13.351 -0.467 7.035 1.00 0.00 O ATOM 73 H GLY A 6 16.846 -1.372 4.624 1.00 0.00 H ATOM 74 HA2 GLY A 6 15.162 -2.181 6.706 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.249 -0.804 6.756 1.00 0.00 H ATOM 76 N LYS A 7 14.245 0.647 5.290 1.00 0.00 N ATOM 77 CA LYS A 7 13.158 1.627 5.208 1.00 0.00 C ATOM 78 C LYS A 7 11.834 1.018 4.714 1.00 0.00 C ATOM 79 O LYS A 7 10.823 1.721 4.656 1.00 0.00 O ATOM 80 CB LYS A 7 13.549 2.782 4.283 1.00 0.00 C ATOM 81 CG LYS A 7 13.440 2.437 2.805 1.00 0.00 C ATOM 82 CD LYS A 7 12.900 3.610 2.004 1.00 0.00 C ATOM 83 CE LYS A 7 12.144 3.141 0.770 1.00 0.00 C ATOM 84 NZ LYS A 7 10.931 2.391 1.119 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.996 0.716 4.662 1.00 0.00 H ATOM 86 HA LYS A 7 13.002 2.021 6.200 1.00 0.00 H ATOM 87 HB2 LYS A 7 12.905 3.625 4.484 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.571 3.062 4.491 1.00 0.00 H ATOM 89 HG2 LYS A 7 14.421 2.182 2.432 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.777 1.595 2.686 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.228 4.182 2.628 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.726 4.234 1.695 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.867 4.002 0.184 1.00 0.00 H ATOM 94 HE3 LYS A 7 12.795 2.505 0.187 1.00 0.00 H ATOM 95 HZ1 LYS A 7 11.040 1.451 1.375 1.00 0.00 H ATOM 96 N ARG A 8 11.835 -0.272 4.354 1.00 0.00 N ATOM 97 CA ARG A 8 10.623 -0.936 3.867 1.00 0.00 C ATOM 98 C ARG A 8 9.447 -0.711 4.808 1.00 0.00 C ATOM 99 O ARG A 8 8.306 -0.587 4.365 1.00 0.00 O ATOM 100 CB ARG A 8 10.865 -2.437 3.679 1.00 0.00 C ATOM 101 CG ARG A 8 11.387 -2.806 2.298 1.00 0.00 C ATOM 102 CD ARG A 8 10.348 -2.540 1.215 1.00 0.00 C ATOM 103 NE ARG A 8 9.118 -3.306 1.430 1.00 0.00 N ATOM 104 CZ ARG A 8 9.033 -4.639 1.355 1.00 0.00 C ATOM 105 NH1 ARG A 8 10.091 -5.370 1.005 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 7.878 -5.241 1.614 1.00 0.00 N ATOM 107 H ARG A 8 12.663 -0.786 4.415 1.00 0.00 H ATOM 108 HA ARG A 8 10.380 -0.501 2.909 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.588 -2.767 4.410 1.00 0.00 H ATOM 110 HB3 ARG A 8 9.937 -2.964 3.841 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.267 -2.217 2.089 1.00 0.00 H ATOM 112 HG3 ARG A 8 11.643 -3.855 2.290 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.108 -1.488 1.214 1.00 0.00 H ATOM 114 HD3 ARG A 8 10.767 -2.814 0.258 1.00 0.00 H ATOM 115 HE ARG A 8 8.311 -2.799 1.661 1.00 0.00 H ATOM 116 HH11 ARG A 8 10.961 -4.927 0.792 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.014 -6.366 0.956 1.00 0.00 H ATOM 118 HH21 ARG A 8 7.076 -4.699 1.866 1.00 0.00 H ATOM 119 HH22 ARG A 8 7.810 -6.238 1.558 1.00 0.00 H ATOM 120 N LYS A 9 9.734 -0.648 6.107 1.00 0.00 N ATOM 121 CA LYS A 9 8.700 -0.425 7.111 1.00 0.00 C ATOM 122 C LYS A 9 7.954 0.882 6.835 1.00 0.00 C ATOM 123 O LYS A 9 6.729 0.938 6.929 1.00 0.00 O ATOM 124 CB LYS A 9 9.316 -0.401 8.514 1.00 0.00 C ATOM 125 CG LYS A 9 8.293 -0.270 9.632 1.00 0.00 C ATOM 126 CD LYS A 9 7.291 -1.418 9.617 1.00 0.00 C ATOM 127 CE LYS A 9 7.975 -2.768 9.799 1.00 0.00 C ATOM 128 NZ LYS A 9 7.001 -3.897 9.799 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.668 -0.749 6.395 1.00 0.00 H ATOM 130 HA LYS A 9 7.999 -1.243 7.048 1.00 0.00 H ATOM 131 HB2 LYS A 9 9.868 -1.318 8.667 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.000 0.433 8.580 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.810 -0.269 10.580 1.00 0.00 H ATOM 134 HG3 LYS A 9 7.761 0.662 9.510 1.00 0.00 H ATOM 135 HD2 LYS A 9 6.584 -1.275 10.420 1.00 0.00 H ATOM 136 HD3 LYS A 9 6.769 -1.413 8.672 1.00 0.00 H ATOM 137 HE2 LYS A 9 8.676 -2.913 8.991 1.00 0.00 H ATOM 138 HE3 LYS A 9 8.506 -2.763 10.739 1.00 0.00 H ATOM 139 HZ1 LYS A 9 7.495 -4.792 9.604 1.00 0.00 H ATOM 140 HZ2 LYS A 9 6.278 -3.747 9.067 1.00 0.00 H ATOM 141 HZ3 LYS A 9 6.533 -3.965 10.725 1.00 0.00 H ATOM 142 N SER A 10 8.707 1.928 6.486 1.00 0.00 N ATOM 143 CA SER A 10 8.130 3.238 6.186 1.00 0.00 C ATOM 144 C SER A 10 7.452 3.248 4.814 1.00 0.00 C ATOM 145 O SER A 10 6.346 3.775 4.670 1.00 0.00 O ATOM 146 CB SER A 10 9.213 4.320 6.244 1.00 0.00 C ATOM 147 OG SER A 10 8.657 5.610 6.063 1.00 0.00 O ATOM 148 H SER A 10 9.679 1.813 6.424 1.00 0.00 H ATOM 149 HA SER A 10 7.388 3.447 6.938 1.00 0.00 H ATOM 150 HB2 SER A 10 9.702 4.285 7.207 1.00 0.00 H ATOM 151 HB3 SER A 10 9.940 4.142 5.465 1.00 0.00 H ATOM 152 HG SER A 10 9.264 6.153 5.556 1.00 0.00 H ATOM 153 N ASP A 11 8.115 2.666 3.807 1.00 0.00 N ATOM 154 CA ASP A 11 7.564 2.616 2.451 1.00 0.00 C ATOM 155 C ASP A 11 6.239 1.860 2.424 1.00 0.00 C ATOM 156 O ASP A 11 5.272 2.316 1.815 1.00 0.00 O ATOM 157 CB ASP A 11 8.558 1.977 1.468 1.00 0.00 C ATOM 158 CG ASP A 11 9.701 2.911 1.092 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.474 4.075 0.759 1.00 0.00 O ATOM 160 H ASP A 11 8.990 2.262 3.983 1.00 0.00 H ATOM 161 HA ASP A 11 7.377 3.632 2.142 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.978 1.091 1.918 1.00 0.00 H ATOM 163 HB3 ASP A 11 8.032 1.699 0.566 1.00 0.00 H ATOM 164 N ARG A 12 6.198 0.711 3.096 1.00 0.00 N ATOM 165 CA ARG A 12 4.982 -0.094 3.157 1.00 0.00 C ATOM 166 C ARG A 12 3.924 0.611 3.999 1.00 0.00 C ATOM 167 O ARG A 12 2.740 0.596 3.668 1.00 0.00 O ATOM 168 CB ARG A 12 5.273 -1.484 3.727 1.00 0.00 C ATOM 169 CG ARG A 12 4.056 -2.396 3.738 1.00 0.00 C ATOM 170 CD ARG A 12 4.390 -3.774 4.286 1.00 0.00 C ATOM 171 NE ARG A 12 3.198 -4.615 4.413 1.00 0.00 N ATOM 172 CZ ARG A 12 2.474 -5.063 3.380 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.849 -4.817 2.126 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 1.378 -5.780 3.603 1.00 0.00 N ATOM 175 H ARG A 12 7.000 0.407 3.568 1.00 0.00 H ATOM 176 HA ARG A 12 4.608 -0.199 2.149 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.044 -1.951 3.132 1.00 0.00 H ATOM 178 HB3 ARG A 12 5.627 -1.377 4.742 1.00 0.00 H ATOM 179 HG2 ARG A 12 3.290 -1.951 4.355 1.00 0.00 H ATOM 180 HG3 ARG A 12 3.690 -2.499 2.727 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.087 -4.254 3.616 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.845 -3.661 5.259 1.00 0.00 H ATOM 183 HE ARG A 12 2.908 -4.847 5.321 1.00 0.00 H ATOM 184 HH11 ARG A 12 3.680 -4.293 1.942 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.297 -5.158 1.364 1.00 0.00 H ATOM 186 HH21 ARG A 12 1.094 -5.984 4.541 1.00 0.00 H ATOM 187 HH22 ARG A 12 0.831 -6.113 2.834 1.00 0.00 H ATOM 188 N LYS A 13 4.364 1.239 5.082 1.00 0.00 N ATOM 189 CA LYS A 13 3.462 1.968 5.970 1.00 0.00 C ATOM 190 C LYS A 13 2.699 3.045 5.197 1.00 0.00 C ATOM 191 O LYS A 13 1.480 3.163 5.323 1.00 0.00 O ATOM 192 CB LYS A 13 4.266 2.587 7.126 1.00 0.00 C ATOM 193 CG LYS A 13 3.474 3.507 8.052 1.00 0.00 C ATOM 194 CD LYS A 13 3.225 4.872 7.422 1.00 0.00 C ATOM 195 CE LYS A 13 2.763 5.896 8.450 1.00 0.00 C ATOM 196 NZ LYS A 13 3.836 6.235 9.430 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.323 1.220 5.287 1.00 0.00 H ATOM 198 HA LYS A 13 2.752 1.262 6.375 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.675 1.787 7.725 1.00 0.00 H ATOM 200 HB3 LYS A 13 5.085 3.157 6.709 1.00 0.00 H ATOM 201 HG2 LYS A 13 2.523 3.045 8.271 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.029 3.639 8.969 1.00 0.00 H ATOM 203 HD2 LYS A 13 4.141 5.222 6.971 1.00 0.00 H ATOM 204 HD3 LYS A 13 2.463 4.773 6.663 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.466 6.797 7.933 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.915 5.494 8.984 1.00 0.00 H ATOM 207 HZ1 LYS A 13 3.496 6.960 10.094 1.00 0.00 H ATOM 208 HZ2 LYS A 13 4.673 6.604 8.931 1.00 0.00 H ATOM 209 HZ3 LYS A 13 4.112 5.390 9.969 1.00 0.00 H ATOM 210 N LYS A 14 3.430 3.825 4.402 1.00 0.00 N ATOM 211 CA LYS A 14 2.841 4.902 3.602 1.00 0.00 C ATOM 212 C LYS A 14 2.053 4.353 2.406 1.00 0.00 C ATOM 213 O LYS A 14 0.939 4.798 2.129 1.00 0.00 O ATOM 214 CB LYS A 14 3.952 5.852 3.123 1.00 0.00 C ATOM 215 CG LYS A 14 3.487 7.032 2.268 1.00 0.00 C ATOM 216 CD LYS A 14 2.874 8.164 3.095 1.00 0.00 C ATOM 217 CE LYS A 14 1.523 7.791 3.695 1.00 0.00 C ATOM 218 NZ LYS A 14 0.593 7.284 2.687 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.397 3.674 4.352 1.00 0.00 H ATOM 220 HA LYS A 14 2.166 5.448 4.238 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.458 6.250 3.988 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.661 5.279 2.543 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.337 7.423 1.730 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.752 6.678 1.559 1.00 0.00 H ATOM 225 HD2 LYS A 14 3.552 8.410 3.899 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.748 9.029 2.459 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.671 7.034 4.448 1.00 0.00 H ATOM 228 HE3 LYS A 14 1.096 8.672 4.154 1.00 0.00 H ATOM 229 HZ1 LYS A 14 0.969 6.745 1.960 1.00 0.00 H ATOM 230 N LYS A 15 2.641 3.396 1.692 1.00 0.00 N ATOM 231 CA LYS A 15 1.999 2.806 0.516 1.00 0.00 C ATOM 232 C LYS A 15 0.702 2.074 0.871 1.00 0.00 C ATOM 233 O LYS A 15 -0.309 2.223 0.185 1.00 0.00 O ATOM 234 CB LYS A 15 2.962 1.839 -0.181 1.00 0.00 C ATOM 235 CG LYS A 15 2.410 1.237 -1.466 1.00 0.00 C ATOM 236 CD LYS A 15 3.352 0.193 -2.046 1.00 0.00 C ATOM 237 CE LYS A 15 4.671 0.805 -2.495 1.00 0.00 C ATOM 238 NZ LYS A 15 5.608 -0.227 -3.021 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.532 3.085 1.955 1.00 0.00 H ATOM 240 HA LYS A 15 1.764 3.608 -0.164 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.872 2.368 -0.420 1.00 0.00 H ATOM 242 HB3 LYS A 15 3.194 1.031 0.498 1.00 0.00 H ATOM 243 HG2 LYS A 15 1.460 0.768 -1.253 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.269 2.026 -2.190 1.00 0.00 H ATOM 245 HD2 LYS A 15 3.554 -0.551 -1.291 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.875 -0.274 -2.894 1.00 0.00 H ATOM 247 HE2 LYS A 15 4.472 1.527 -3.274 1.00 0.00 H ATOM 248 HE3 LYS A 15 5.130 1.301 -1.653 1.00 0.00 H ATOM 249 HZ1 LYS A 15 5.151 -0.775 -3.778 1.00 0.00 H ATOM 250 HZ2 LYS A 15 5.888 -0.877 -2.260 1.00 0.00 H ATOM 251 HZ3 LYS A 15 6.462 0.228 -3.404 1.00 0.00 H ATOM 252 N ASN A 16 0.748 1.268 1.927 1.00 0.00 N ATOM 253 CA ASN A 16 -0.414 0.488 2.357 1.00 0.00 C ATOM 254 C ASN A 16 -1.487 1.351 3.034 1.00 0.00 C ATOM 255 O ASN A 16 -2.678 1.175 2.774 1.00 0.00 O ATOM 256 CB ASN A 16 0.032 -0.639 3.295 1.00 0.00 C ATOM 257 CG ASN A 16 -1.091 -1.604 3.630 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.066 -1.238 4.289 1.00 0.00 O ATOM 259 ND2 ASN A 16 -0.968 -2.844 3.167 1.00 0.00 N ATOM 260 H ASN A 16 1.590 1.180 2.421 1.00 0.00 H ATOM 261 HA ASN A 16 -0.845 0.045 1.473 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.830 -1.196 2.825 1.00 0.00 H ATOM 263 HB3 ASN A 16 0.396 -0.206 4.216 1.00 0.00 H ATOM 264 HD21 ASN A 16 -0.170 -3.068 2.641 1.00 0.00 H ATOM 265 HD22 ASN A 16 -1.681 -3.484 3.369 1.00 0.00 H ATOM 266 N GLN A 17 -1.065 2.262 3.915 1.00 0.00 N ATOM 267 CA GLN A 17 -2.003 3.125 4.644 1.00 0.00 C ATOM 268 C GLN A 17 -2.729 4.096 3.709 1.00 0.00 C ATOM 269 O GLN A 17 -3.960 4.116 3.669 1.00 0.00 O ATOM 270 CB GLN A 17 -1.264 3.894 5.748 1.00 0.00 C ATOM 271 CG GLN A 17 -2.176 4.586 6.754 1.00 0.00 C ATOM 272 CD GLN A 17 -2.968 5.734 6.152 1.00 0.00 C ATOM 273 OE1 GLN A 17 -2.396 6.710 5.667 1.00 0.00 O ATOM 274 NE2 GLN A 17 -4.293 5.626 6.186 1.00 0.00 N ATOM 275 H GLN A 17 -0.105 2.344 4.092 1.00 0.00 H ATOM 276 HA GLN A 17 -2.738 2.486 5.105 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.635 3.204 6.288 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.639 4.646 5.287 1.00 0.00 H ATOM 279 HG2 GLN A 17 -2.871 3.859 7.147 1.00 0.00 H ATOM 280 HG3 GLN A 17 -1.569 4.969 7.562 1.00 0.00 H ATOM 281 HE21 GLN A 17 -4.684 4.822 6.588 1.00 0.00 H ATOM 282 HE22 GLN A 17 -4.825 6.358 5.812 1.00 0.00 H ATOM 283 N ASP A 18 -1.966 4.896 2.964 1.00 0.00 N ATOM 284 CA ASP A 18 -2.551 5.868 2.036 1.00 0.00 C ATOM 285 C ASP A 18 -3.182 5.165 0.835 1.00 0.00 C ATOM 286 O ASP A 18 -4.284 5.512 0.410 1.00 0.00 O ATOM 287 CB ASP A 18 -1.494 6.870 1.553 1.00 0.00 C ATOM 288 CG ASP A 18 -0.718 7.502 2.695 1.00 0.00 C ATOM 289 OD1 ASP A 18 -1.291 8.161 3.564 1.00 0.00 O ATOM 290 H ASP A 18 -0.992 4.833 3.042 1.00 0.00 H ATOM 291 HA ASP A 18 -3.325 6.406 2.566 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.796 6.362 0.906 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.984 7.658 0.998 1.00 0.00 H HETATM 294 N NH2 A 19 -2.487 4.169 0.288 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.615 3.942 0.675 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -2.877 3.702 -0.480 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 7 ATOM 1 N PHE A 1 21.757 -3.046 6.726 1.00 0.00 N ATOM 2 CA PHE A 1 21.004 -1.862 7.128 1.00 0.00 C ATOM 3 C PHE A 1 20.652 -1.009 5.912 1.00 0.00 C ATOM 4 O PHE A 1 19.481 -0.704 5.681 1.00 0.00 O ATOM 5 CB PHE A 1 21.802 -1.029 8.140 1.00 0.00 C ATOM 6 CG PHE A 1 22.114 -1.754 9.424 1.00 0.00 C ATOM 7 CD1 PHE A 1 22.808 -2.955 9.413 1.00 0.00 C ATOM 8 CD2 PHE A 1 21.718 -1.226 10.643 1.00 0.00 C ATOM 9 CE1 PHE A 1 23.097 -3.616 10.591 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.005 -1.884 11.824 1.00 0.00 C ATOM 11 CZ PHE A 1 22.696 -3.080 11.798 1.00 0.00 C ATOM 12 H1 PHE A 1 21.302 -3.913 6.692 1.00 0.00 H ATOM 13 HA PHE A 1 20.089 -2.196 7.593 1.00 0.00 H ATOM 14 HB2 PHE A 1 22.738 -0.733 7.692 1.00 0.00 H ATOM 15 HB3 PHE A 1 21.235 -0.144 8.389 1.00 0.00 H ATOM 16 HD1 PHE A 1 23.124 -3.376 8.471 1.00 0.00 H ATOM 17 HD2 PHE A 1 21.176 -0.292 10.665 1.00 0.00 H ATOM 18 HE1 PHE A 1 23.636 -4.551 10.568 1.00 0.00 H ATOM 19 HE2 PHE A 1 21.691 -1.461 12.767 1.00 0.00 H ATOM 20 HZ PHE A 1 22.921 -3.595 12.720 1.00 0.00 H ATOM 21 N GLY A 2 21.669 -0.639 5.128 1.00 0.00 N ATOM 22 CA GLY A 2 21.439 0.161 3.936 1.00 0.00 C ATOM 23 C GLY A 2 21.276 -0.685 2.681 1.00 0.00 C ATOM 24 O GLY A 2 21.410 -0.176 1.568 1.00 0.00 O ATOM 25 H GLY A 2 22.581 -0.921 5.356 1.00 0.00 H ATOM 26 HA2 GLY A 2 20.545 0.750 4.077 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.277 0.828 3.799 1.00 0.00 H ATOM 28 N GLY A 3 20.986 -1.979 2.861 1.00 0.00 N ATOM 29 CA GLY A 3 20.810 -2.874 1.732 1.00 0.00 C ATOM 30 C GLY A 3 19.417 -2.800 1.142 1.00 0.00 C ATOM 31 O GLY A 3 19.061 -1.816 0.491 1.00 0.00 O ATOM 32 H GLY A 3 20.890 -2.329 3.770 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.527 -2.616 0.967 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.999 -3.887 2.058 1.00 0.00 H ATOM 35 N PHE A 4 18.631 -3.850 1.370 1.00 0.00 N ATOM 36 CA PHE A 4 17.263 -3.921 0.861 1.00 0.00 C ATOM 37 C PHE A 4 16.406 -4.866 1.710 1.00 0.00 C ATOM 38 O PHE A 4 15.708 -5.737 1.187 1.00 0.00 O ATOM 39 CB PHE A 4 17.269 -4.354 -0.616 1.00 0.00 C ATOM 40 CG PHE A 4 18.217 -5.486 -0.933 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.081 -6.730 -0.332 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.247 -5.297 -1.841 1.00 0.00 C ATOM 43 CE1 PHE A 4 18.954 -7.759 -0.631 1.00 0.00 C ATOM 44 CE2 PHE A 4 20.122 -6.321 -2.143 1.00 0.00 C ATOM 45 CZ PHE A 4 19.976 -7.554 -1.537 1.00 0.00 C ATOM 46 H PHE A 4 18.982 -4.601 1.895 1.00 0.00 H ATOM 47 HA PHE A 4 16.842 -2.928 0.926 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.276 -4.671 -0.893 1.00 0.00 H ATOM 49 HB3 PHE A 4 17.550 -3.507 -1.226 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.283 -6.893 0.375 1.00 0.00 H ATOM 51 HD2 PHE A 4 19.365 -4.333 -2.315 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.838 -8.721 -0.158 1.00 0.00 H ATOM 53 HE2 PHE A 4 20.920 -6.159 -2.852 1.00 0.00 H ATOM 54 HZ PHE A 4 20.660 -8.356 -1.773 1.00 0.00 H ATOM 55 N THR A 5 16.462 -4.677 3.031 1.00 0.00 N ATOM 56 CA THR A 5 15.694 -5.507 3.963 1.00 0.00 C ATOM 57 C THR A 5 15.381 -4.771 5.273 1.00 0.00 C ATOM 58 O THR A 5 14.290 -4.919 5.824 1.00 0.00 O ATOM 59 CB THR A 5 16.431 -6.828 4.283 1.00 0.00 C ATOM 60 OG1 THR A 5 15.649 -7.623 5.183 1.00 0.00 O ATOM 61 CG2 THR A 5 17.800 -6.564 4.897 1.00 0.00 C ATOM 62 H THR A 5 17.033 -3.964 3.385 1.00 0.00 H ATOM 63 HA THR A 5 14.762 -5.757 3.480 1.00 0.00 H ATOM 64 HB THR A 5 16.569 -7.376 3.362 1.00 0.00 H ATOM 65 HG1 THR A 5 15.243 -8.347 4.702 1.00 0.00 H ATOM 66 HG21 THR A 5 17.679 -6.221 5.914 1.00 0.00 H ATOM 67 HG22 THR A 5 18.315 -5.810 4.321 1.00 0.00 H ATOM 68 HG23 THR A 5 18.378 -7.477 4.892 1.00 0.00 H ATOM 69 N GLY A 6 16.341 -3.991 5.771 1.00 0.00 N ATOM 70 CA GLY A 6 16.143 -3.257 7.011 1.00 0.00 C ATOM 71 C GLY A 6 14.993 -2.261 6.948 1.00 0.00 C ATOM 72 O GLY A 6 14.230 -2.131 7.907 1.00 0.00 O ATOM 73 H GLY A 6 17.194 -3.916 5.297 1.00 0.00 H ATOM 74 HA2 GLY A 6 15.947 -3.963 7.804 1.00 0.00 H ATOM 75 HA3 GLY A 6 17.052 -2.722 7.244 1.00 0.00 H ATOM 76 N LYS A 7 14.879 -1.547 5.825 1.00 0.00 N ATOM 77 CA LYS A 7 13.824 -0.541 5.645 1.00 0.00 C ATOM 78 C LYS A 7 12.520 -1.128 5.076 1.00 0.00 C ATOM 79 O LYS A 7 11.671 -0.380 4.595 1.00 0.00 O ATOM 80 CB LYS A 7 14.332 0.595 4.734 1.00 0.00 C ATOM 81 CG LYS A 7 14.887 0.137 3.381 1.00 0.00 C ATOM 82 CD LYS A 7 13.806 -0.442 2.475 1.00 0.00 C ATOM 83 CE LYS A 7 12.806 0.620 2.038 1.00 0.00 C ATOM 84 NZ LYS A 7 11.431 0.120 2.057 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.526 -1.691 5.103 1.00 0.00 H ATOM 86 HA LYS A 7 13.609 -0.124 6.617 1.00 0.00 H ATOM 87 HB2 LYS A 7 13.516 1.277 4.546 1.00 0.00 H ATOM 88 HB3 LYS A 7 15.114 1.129 5.254 1.00 0.00 H ATOM 89 HG2 LYS A 7 15.334 0.985 2.885 1.00 0.00 H ATOM 90 HG3 LYS A 7 15.642 -0.616 3.551 1.00 0.00 H ATOM 91 HD2 LYS A 7 14.276 -0.858 1.597 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.284 -1.222 3.005 1.00 0.00 H ATOM 93 HE2 LYS A 7 12.880 1.465 2.706 1.00 0.00 H ATOM 94 HE3 LYS A 7 13.050 0.933 1.034 1.00 0.00 H ATOM 95 HZ1 LYS A 7 11.292 -0.813 2.326 1.00 0.00 H ATOM 96 N ARG A 8 12.352 -2.452 5.132 1.00 0.00 N ATOM 97 CA ARG A 8 11.139 -3.089 4.603 1.00 0.00 C ATOM 98 C ARG A 8 9.880 -2.612 5.322 1.00 0.00 C ATOM 99 O ARG A 8 8.885 -2.282 4.679 1.00 0.00 O ATOM 100 CB ARG A 8 11.229 -4.613 4.706 1.00 0.00 C ATOM 101 CG ARG A 8 12.225 -5.243 3.746 1.00 0.00 C ATOM 102 CD ARG A 8 12.260 -6.758 3.901 1.00 0.00 C ATOM 103 NE ARG A 8 12.600 -7.171 5.266 1.00 0.00 N ATOM 104 CZ ARG A 8 12.640 -8.440 5.679 1.00 0.00 C ATOM 105 NH1 ARG A 8 12.361 -9.434 4.839 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 12.961 -8.715 6.939 1.00 0.00 N ATOM 107 H ARG A 8 13.048 -3.011 5.530 1.00 0.00 H ATOM 108 HA ARG A 8 11.059 -2.818 3.563 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.519 -4.875 5.713 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.254 -5.031 4.503 1.00 0.00 H ATOM 111 HG2 ARG A 8 11.935 -5.002 2.735 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.207 -4.844 3.946 1.00 0.00 H ATOM 113 HD2 ARG A 8 11.289 -7.154 3.648 1.00 0.00 H ATOM 114 HD3 ARG A 8 12.998 -7.157 3.221 1.00 0.00 H ATOM 115 HE ARG A 8 12.810 -6.463 5.911 1.00 0.00 H ATOM 116 HH11 ARG A 8 12.119 -9.236 3.889 1.00 0.00 H ATOM 117 HH12 ARG A 8 12.393 -10.382 5.157 1.00 0.00 H ATOM 118 HH21 ARG A 8 13.172 -7.972 7.574 1.00 0.00 H ATOM 119 HH22 ARG A 8 12.992 -9.665 7.253 1.00 0.00 H ATOM 120 N LYS A 9 9.924 -2.601 6.652 1.00 0.00 N ATOM 121 CA LYS A 9 8.769 -2.191 7.456 1.00 0.00 C ATOM 122 C LYS A 9 8.266 -0.792 7.086 1.00 0.00 C ATOM 123 O LYS A 9 7.056 -0.570 7.000 1.00 0.00 O ATOM 124 CB LYS A 9 9.094 -2.257 8.954 1.00 0.00 C ATOM 125 CG LYS A 9 10.234 -1.348 9.392 1.00 0.00 C ATOM 126 CD LYS A 9 10.470 -1.439 10.891 1.00 0.00 C ATOM 127 CE LYS A 9 11.613 -0.538 11.336 1.00 0.00 C ATOM 128 NZ LYS A 9 12.908 -0.915 10.701 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.745 -2.893 7.103 1.00 0.00 H ATOM 130 HA LYS A 9 7.977 -2.894 7.251 1.00 0.00 H ATOM 131 HB2 LYS A 9 8.212 -1.981 9.511 1.00 0.00 H ATOM 132 HB3 LYS A 9 9.360 -3.274 9.205 1.00 0.00 H ATOM 133 HG2 LYS A 9 11.135 -1.641 8.877 1.00 0.00 H ATOM 134 HG3 LYS A 9 9.986 -0.328 9.138 1.00 0.00 H ATOM 135 HD2 LYS A 9 9.569 -1.139 11.406 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.709 -2.462 11.147 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.375 0.480 11.067 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.713 -0.611 12.409 1.00 0.00 H ATOM 139 HZ1 LYS A 9 13.058 -1.942 10.774 1.00 0.00 H ATOM 140 HZ2 LYS A 9 13.694 -0.427 11.176 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.906 -0.646 9.696 1.00 0.00 H ATOM 142 N SER A 10 9.189 0.148 6.877 1.00 0.00 N ATOM 143 CA SER A 10 8.822 1.523 6.529 1.00 0.00 C ATOM 144 C SER A 10 8.126 1.599 5.167 1.00 0.00 C ATOM 145 O SER A 10 7.126 2.303 5.018 1.00 0.00 O ATOM 146 CB SER A 10 10.056 2.432 6.546 1.00 0.00 C ATOM 147 OG SER A 10 11.017 2.018 5.592 1.00 0.00 O ATOM 148 H SER A 10 10.137 -0.086 6.966 1.00 0.00 H ATOM 149 HA SER A 10 8.130 1.871 7.280 1.00 0.00 H ATOM 150 HB2 SER A 10 9.758 3.445 6.320 1.00 0.00 H ATOM 151 HB3 SER A 10 10.506 2.403 7.528 1.00 0.00 H ATOM 152 HG SER A 10 11.819 1.744 6.043 1.00 0.00 H ATOM 153 N ASP A 11 8.658 0.880 4.179 1.00 0.00 N ATOM 154 CA ASP A 11 8.082 0.878 2.831 1.00 0.00 C ATOM 155 C ASP A 11 6.698 0.228 2.809 1.00 0.00 C ATOM 156 O ASP A 11 5.787 0.729 2.151 1.00 0.00 O ATOM 157 CB ASP A 11 9.018 0.172 1.844 1.00 0.00 C ATOM 158 CG ASP A 11 10.369 0.861 1.747 1.00 0.00 C ATOM 159 OD1 ASP A 11 10.450 2.044 1.414 1.00 0.00 O ATOM 160 H ASP A 11 9.457 0.342 4.358 1.00 0.00 H ATOM 161 HA ASP A 11 7.975 1.907 2.527 1.00 0.00 H ATOM 162 HB2 ASP A 11 9.174 -0.846 2.168 1.00 0.00 H ATOM 163 HB3 ASP A 11 8.564 0.170 0.864 1.00 0.00 H ATOM 164 N ARG A 12 6.543 -0.885 3.532 1.00 0.00 N ATOM 165 CA ARG A 12 5.261 -1.591 3.589 1.00 0.00 C ATOM 166 C ARG A 12 4.169 -0.691 4.161 1.00 0.00 C ATOM 167 O ARG A 12 3.021 -0.732 3.723 1.00 0.00 O ATOM 168 CB ARG A 12 5.369 -2.863 4.437 1.00 0.00 C ATOM 169 CG ARG A 12 6.338 -3.899 3.887 1.00 0.00 C ATOM 170 CD ARG A 12 6.344 -5.158 4.741 1.00 0.00 C ATOM 171 NE ARG A 12 7.464 -6.044 4.416 1.00 0.00 N ATOM 172 CZ ARG A 12 7.670 -7.233 4.993 1.00 0.00 C ATOM 173 NH1 ARG A 12 6.803 -7.714 5.880 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 8.741 -7.950 4.668 1.00 0.00 N ATOM 175 H ARG A 12 7.306 -1.236 4.038 1.00 0.00 H ATOM 176 HA ARG A 12 4.990 -1.865 2.581 1.00 0.00 H ATOM 177 HB2 ARG A 12 5.698 -2.590 5.429 1.00 0.00 H ATOM 178 HB3 ARG A 12 4.392 -3.318 4.506 1.00 0.00 H ATOM 179 HG2 ARG A 12 6.039 -4.159 2.882 1.00 0.00 H ATOM 180 HG3 ARG A 12 7.332 -3.480 3.871 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.415 -4.871 5.780 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.417 -5.690 4.578 1.00 0.00 H ATOM 183 HE ARG A 12 8.108 -5.730 3.747 1.00 0.00 H ATOM 184 HH11 ARG A 12 5.988 -7.188 6.122 1.00 0.00 H ATOM 185 HH12 ARG A 12 6.966 -8.604 6.308 1.00 0.00 H ATOM 186 HH21 ARG A 12 9.391 -7.600 3.995 1.00 0.00 H ATOM 187 HH22 ARG A 12 8.899 -8.839 5.100 1.00 0.00 H ATOM 188 N LYS A 13 4.536 0.116 5.149 1.00 0.00 N ATOM 189 CA LYS A 13 3.587 1.023 5.786 1.00 0.00 C ATOM 190 C LYS A 13 3.337 2.263 4.921 1.00 0.00 C ATOM 191 O LYS A 13 2.194 2.682 4.741 1.00 0.00 O ATOM 192 CB LYS A 13 4.104 1.439 7.169 1.00 0.00 C ATOM 193 CG LYS A 13 3.155 2.333 7.960 1.00 0.00 C ATOM 194 CD LYS A 13 1.958 1.567 8.520 1.00 0.00 C ATOM 195 CE LYS A 13 0.879 1.320 7.474 1.00 0.00 C ATOM 196 NZ LYS A 13 0.342 2.590 6.910 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.465 0.099 5.460 1.00 0.00 H ATOM 198 HA LYS A 13 2.660 0.492 5.904 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.286 0.548 7.751 1.00 0.00 H ATOM 200 HB3 LYS A 13 5.037 1.968 7.042 1.00 0.00 H ATOM 201 HG2 LYS A 13 3.698 2.773 8.781 1.00 0.00 H ATOM 202 HG3 LYS A 13 2.795 3.117 7.308 1.00 0.00 H ATOM 203 HD2 LYS A 13 2.300 0.614 8.894 1.00 0.00 H ATOM 204 HD3 LYS A 13 1.532 2.138 9.333 1.00 0.00 H ATOM 205 HE2 LYS A 13 1.295 0.730 6.674 1.00 0.00 H ATOM 206 HE3 LYS A 13 0.070 0.774 7.936 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -0.640 2.455 6.598 1.00 0.00 H ATOM 208 HZ2 LYS A 13 0.914 2.889 6.095 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.366 3.341 7.630 1.00 0.00 H ATOM 210 N LYS A 14 4.418 2.848 4.400 1.00 0.00 N ATOM 211 CA LYS A 14 4.334 4.049 3.564 1.00 0.00 C ATOM 212 C LYS A 14 3.536 3.828 2.279 1.00 0.00 C ATOM 213 O LYS A 14 2.829 4.731 1.833 1.00 0.00 O ATOM 214 CB LYS A 14 5.734 4.569 3.226 1.00 0.00 C ATOM 215 CG LYS A 14 6.380 5.367 4.351 1.00 0.00 C ATOM 216 CD LYS A 14 5.529 6.562 4.786 1.00 0.00 C ATOM 217 CE LYS A 14 5.498 7.677 3.742 1.00 0.00 C ATOM 218 NZ LYS A 14 4.573 7.405 2.637 1.00 0.00 N1+ ATOM 219 H LYS A 14 5.300 2.466 4.592 1.00 0.00 H ATOM 220 HA LYS A 14 3.825 4.802 4.144 1.00 0.00 H ATOM 221 HB2 LYS A 14 6.371 3.723 3.007 1.00 0.00 H ATOM 222 HB3 LYS A 14 5.678 5.195 2.351 1.00 0.00 H ATOM 223 HG2 LYS A 14 6.522 4.717 5.200 1.00 0.00 H ATOM 224 HG3 LYS A 14 7.340 5.728 4.011 1.00 0.00 H ATOM 225 HD2 LYS A 14 4.520 6.225 4.960 1.00 0.00 H ATOM 226 HD3 LYS A 14 5.937 6.957 5.705 1.00 0.00 H ATOM 227 HE2 LYS A 14 5.196 8.593 4.228 1.00 0.00 H ATOM 228 HE3 LYS A 14 6.494 7.802 3.342 1.00 0.00 H ATOM 229 HZ1 LYS A 14 4.715 6.591 2.118 1.00 0.00 H ATOM 230 N LYS A 15 3.644 2.642 1.679 1.00 0.00 N ATOM 231 CA LYS A 15 2.912 2.359 0.442 1.00 0.00 C ATOM 232 C LYS A 15 1.412 2.587 0.633 1.00 0.00 C ATOM 233 O LYS A 15 0.745 3.141 -0.242 1.00 0.00 O ATOM 234 CB LYS A 15 3.166 0.927 -0.054 1.00 0.00 C ATOM 235 CG LYS A 15 2.797 -0.161 0.946 1.00 0.00 C ATOM 236 CD LYS A 15 2.034 -1.308 0.292 1.00 0.00 C ATOM 237 CE LYS A 15 2.912 -2.136 -0.638 1.00 0.00 C ATOM 238 NZ LYS A 15 3.285 -1.397 -1.877 1.00 0.00 N1+ ATOM 239 H LYS A 15 4.220 1.953 2.069 1.00 0.00 H ATOM 240 HA LYS A 15 3.268 3.051 -0.306 1.00 0.00 H ATOM 241 HB2 LYS A 15 2.588 0.767 -0.952 1.00 0.00 H ATOM 242 HB3 LYS A 15 4.215 0.824 -0.293 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.703 -0.554 1.382 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.184 0.268 1.721 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.645 -1.952 1.065 1.00 0.00 H ATOM 246 HD3 LYS A 15 1.213 -0.896 -0.278 1.00 0.00 H ATOM 247 HE2 LYS A 15 3.813 -2.410 -0.111 1.00 0.00 H ATOM 248 HE3 LYS A 15 2.373 -3.031 -0.914 1.00 0.00 H ATOM 249 HZ1 LYS A 15 4.121 -0.804 -1.703 1.00 0.00 H ATOM 250 HZ2 LYS A 15 2.499 -0.788 -2.183 1.00 0.00 H ATOM 251 HZ3 LYS A 15 3.503 -2.068 -2.641 1.00 0.00 H ATOM 252 N ASN A 16 0.894 2.158 1.786 1.00 0.00 N ATOM 253 CA ASN A 16 -0.524 2.307 2.105 1.00 0.00 C ATOM 254 C ASN A 16 -0.832 3.695 2.670 1.00 0.00 C ATOM 255 O ASN A 16 -1.808 4.330 2.266 1.00 0.00 O ATOM 256 CB ASN A 16 -0.952 1.225 3.103 1.00 0.00 C ATOM 257 CG ASN A 16 -2.444 1.238 3.376 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.255 1.093 2.460 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.816 1.406 4.641 1.00 0.00 N ATOM 260 H ASN A 16 1.485 1.731 2.441 1.00 0.00 H ATOM 261 HA ASN A 16 -1.082 2.177 1.191 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.687 0.255 2.707 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.431 1.381 4.037 1.00 0.00 H ATOM 264 HD21 ASN A 16 -2.118 1.511 5.322 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.776 1.418 4.842 1.00 0.00 H ATOM 266 N GLN A 17 -0.002 4.154 3.609 1.00 0.00 N ATOM 267 CA GLN A 17 -0.196 5.463 4.235 1.00 0.00 C ATOM 268 C GLN A 17 -0.110 6.583 3.202 1.00 0.00 C ATOM 269 O GLN A 17 -1.046 7.371 3.051 1.00 0.00 O ATOM 270 CB GLN A 17 0.839 5.691 5.346 1.00 0.00 C ATOM 271 CG GLN A 17 0.686 7.025 6.062 1.00 0.00 C ATOM 272 CD GLN A 17 -0.682 7.189 6.701 1.00 0.00 C ATOM 273 OE1 GLN A 17 -1.045 6.446 7.613 1.00 0.00 O ATOM 274 NE2 GLN A 17 -1.452 8.160 6.220 1.00 0.00 N ATOM 275 H GLN A 17 0.752 3.596 3.891 1.00 0.00 H ATOM 276 HA GLN A 17 -1.182 5.474 4.671 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.743 4.904 6.078 1.00 0.00 H ATOM 278 HB3 GLN A 17 1.829 5.651 4.915 1.00 0.00 H ATOM 279 HG2 GLN A 17 1.436 7.093 6.836 1.00 0.00 H ATOM 280 HG3 GLN A 17 0.833 7.823 5.349 1.00 0.00 H ATOM 281 HE21 GLN A 17 -1.103 8.711 5.487 1.00 0.00 H ATOM 282 HE22 GLN A 17 -2.339 8.285 6.616 1.00 0.00 H ATOM 283 N ASP A 18 1.015 6.641 2.493 1.00 0.00 N ATOM 284 CA ASP A 18 1.230 7.657 1.467 1.00 0.00 C ATOM 285 C ASP A 18 0.418 7.350 0.209 1.00 0.00 C ATOM 286 O ASP A 18 -0.242 8.230 -0.342 1.00 0.00 O ATOM 287 CB ASP A 18 2.718 7.768 1.117 1.00 0.00 C ATOM 288 CG ASP A 18 3.565 8.210 2.299 1.00 0.00 C ATOM 289 OD1 ASP A 18 3.321 9.265 2.887 1.00 0.00 O ATOM 290 H ASP A 18 1.717 5.979 2.664 1.00 0.00 H ATOM 291 HA ASP A 18 0.897 8.603 1.870 1.00 0.00 H ATOM 292 HB2 ASP A 18 3.076 6.806 0.782 1.00 0.00 H ATOM 293 HB3 ASP A 18 2.840 8.488 0.321 1.00 0.00 H HETATM 294 N NH2 A 19 0.466 6.099 -0.251 1.00 0.00 N HETATM 295 HN1 NH2 A 19 1.010 5.443 0.234 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -0.046 5.886 -1.059 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 8 ATOM 1 N PHE A 1 26.339 0.609 0.375 1.00 0.00 N ATOM 2 CA PHE A 1 27.000 0.296 1.638 1.00 0.00 C ATOM 3 C PHE A 1 26.016 -0.317 2.636 1.00 0.00 C ATOM 4 O PHE A 1 26.276 -1.385 3.194 1.00 0.00 O ATOM 5 CB PHE A 1 27.635 1.561 2.230 1.00 0.00 C ATOM 6 CG PHE A 1 28.317 1.345 3.556 1.00 0.00 C ATOM 7 CD1 PHE A 1 29.211 0.299 3.734 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.059 2.189 4.625 1.00 0.00 C ATOM 9 CE1 PHE A 1 29.834 0.101 4.951 1.00 0.00 C ATOM 10 CE2 PHE A 1 28.680 1.996 5.845 1.00 0.00 C ATOM 11 CZ PHE A 1 29.567 0.950 6.008 1.00 0.00 C ATOM 12 H1 PHE A 1 25.678 1.335 0.345 1.00 0.00 H ATOM 13 HA PHE A 1 27.779 -0.423 1.432 1.00 0.00 H ATOM 14 HB2 PHE A 1 28.374 1.939 1.538 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.867 2.307 2.368 1.00 0.00 H ATOM 16 HD1 PHE A 1 29.421 -0.365 2.908 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.365 3.008 4.498 1.00 0.00 H ATOM 18 HE1 PHE A 1 30.527 -0.716 5.077 1.00 0.00 H ATOM 19 HE2 PHE A 1 28.470 2.661 6.669 1.00 0.00 H ATOM 20 HZ PHE A 1 30.054 0.797 6.960 1.00 0.00 H ATOM 21 N GLY A 2 24.887 0.363 2.853 1.00 0.00 N ATOM 22 CA GLY A 2 23.884 -0.131 3.782 1.00 0.00 C ATOM 23 C GLY A 2 23.093 -1.299 3.219 1.00 0.00 C ATOM 24 O GLY A 2 22.246 -1.116 2.343 1.00 0.00 O ATOM 25 H GLY A 2 24.735 1.207 2.380 1.00 0.00 H ATOM 26 HA2 GLY A 2 24.374 -0.447 4.691 1.00 0.00 H ATOM 27 HA3 GLY A 2 23.201 0.670 4.015 1.00 0.00 H ATOM 28 N GLY A 3 23.366 -2.501 3.732 1.00 0.00 N ATOM 29 CA GLY A 3 22.664 -3.689 3.273 1.00 0.00 C ATOM 30 C GLY A 3 21.238 -3.754 3.791 1.00 0.00 C ATOM 31 O GLY A 3 20.996 -3.513 4.975 1.00 0.00 O ATOM 32 H GLY A 3 24.048 -2.581 4.431 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.644 -3.689 2.193 1.00 0.00 H ATOM 34 HA3 GLY A 3 23.198 -4.563 3.613 1.00 0.00 H ATOM 35 N PHE A 4 20.293 -4.077 2.900 1.00 0.00 N ATOM 36 CA PHE A 4 18.877 -4.171 3.263 1.00 0.00 C ATOM 37 C PHE A 4 18.366 -2.831 3.800 1.00 0.00 C ATOM 38 O PHE A 4 18.429 -2.563 5.002 1.00 0.00 O ATOM 39 CB PHE A 4 18.658 -5.284 4.298 1.00 0.00 C ATOM 40 CG PHE A 4 17.215 -5.485 4.675 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.242 -5.646 3.699 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.832 -5.514 6.007 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.918 -5.832 4.046 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.510 -5.700 6.360 1.00 0.00 C ATOM 45 CZ PHE A 4 14.551 -5.858 5.378 1.00 0.00 C ATOM 46 H PHE A 4 20.556 -4.254 1.973 1.00 0.00 H ATOM 47 HA PHE A 4 18.326 -4.414 2.367 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.027 -6.215 3.896 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.207 -5.043 5.197 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.528 -5.626 2.659 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.580 -5.390 6.776 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.171 -5.956 3.277 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.225 -5.721 7.401 1.00 0.00 H ATOM 54 HZ PHE A 4 13.516 -6.003 5.651 1.00 0.00 H ATOM 55 N THR A 5 17.872 -1.990 2.893 1.00 0.00 N ATOM 56 CA THR A 5 17.361 -0.670 3.258 1.00 0.00 C ATOM 57 C THR A 5 16.083 -0.769 4.095 1.00 0.00 C ATOM 58 O THR A 5 15.105 -1.401 3.685 1.00 0.00 O ATOM 59 CB THR A 5 17.084 0.185 2.002 1.00 0.00 C ATOM 60 OG1 THR A 5 18.267 0.270 1.198 1.00 0.00 O ATOM 61 CG2 THR A 5 16.629 1.586 2.382 1.00 0.00 C ATOM 62 H THR A 5 17.859 -2.260 1.950 1.00 0.00 H ATOM 63 HA THR A 5 18.122 -0.171 3.842 1.00 0.00 H ATOM 64 HB THR A 5 16.301 -0.290 1.428 1.00 0.00 H ATOM 65 HG1 THR A 5 18.208 -0.357 0.474 1.00 0.00 H ATOM 66 HG21 THR A 5 17.132 1.896 3.286 1.00 0.00 H ATOM 67 HG22 THR A 5 15.563 1.585 2.545 1.00 0.00 H ATOM 68 HG23 THR A 5 16.871 2.271 1.582 1.00 0.00 H ATOM 69 N GLY A 6 16.101 -0.123 5.265 1.00 0.00 N ATOM 70 CA GLY A 6 14.945 -0.125 6.152 1.00 0.00 C ATOM 71 C GLY A 6 13.716 0.507 5.518 1.00 0.00 C ATOM 72 O GLY A 6 12.586 0.142 5.848 1.00 0.00 O ATOM 73 H GLY A 6 16.907 0.371 5.526 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.713 -1.146 6.419 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.194 0.422 7.050 1.00 0.00 H ATOM 76 N LYS A 7 13.944 1.460 4.607 1.00 0.00 N ATOM 77 CA LYS A 7 12.862 2.160 3.908 1.00 0.00 C ATOM 78 C LYS A 7 11.824 1.188 3.338 1.00 0.00 C ATOM 79 O LYS A 7 10.641 1.519 3.267 1.00 0.00 O ATOM 80 CB LYS A 7 13.439 3.026 2.780 1.00 0.00 C ATOM 81 CG LYS A 7 12.377 3.723 1.942 1.00 0.00 C ATOM 82 CD LYS A 7 11.615 4.764 2.749 1.00 0.00 C ATOM 83 CE LYS A 7 10.326 5.180 2.054 1.00 0.00 C ATOM 84 NZ LYS A 7 9.336 4.100 2.043 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.868 1.701 4.398 1.00 0.00 H ATOM 86 HA LYS A 7 12.375 2.803 4.624 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.079 3.780 3.211 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.026 2.399 2.126 1.00 0.00 H ATOM 89 HG2 LYS A 7 12.857 4.213 1.108 1.00 0.00 H ATOM 90 HG3 LYS A 7 11.684 2.983 1.576 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.372 4.348 3.714 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.241 5.634 2.878 1.00 0.00 H ATOM 93 HE2 LYS A 7 9.912 6.030 2.573 1.00 0.00 H ATOM 94 HE3 LYS A 7 10.555 5.458 1.035 1.00 0.00 H ATOM 95 HZ1 LYS A 7 8.695 4.076 2.780 1.00 0.00 H ATOM 96 N ARG A 8 12.268 -0.004 2.927 1.00 0.00 N ATOM 97 CA ARG A 8 11.367 -1.009 2.358 1.00 0.00 C ATOM 98 C ARG A 8 10.191 -1.286 3.293 1.00 0.00 C ATOM 99 O ARG A 8 9.050 -1.432 2.853 1.00 0.00 O ATOM 100 CB ARG A 8 12.130 -2.310 2.085 1.00 0.00 C ATOM 101 CG ARG A 8 11.286 -3.391 1.425 1.00 0.00 C ATOM 102 CD ARG A 8 12.073 -4.680 1.245 1.00 0.00 C ATOM 103 NE ARG A 8 13.213 -4.514 0.340 1.00 0.00 N ATOM 104 CZ ARG A 8 14.091 -5.481 0.061 1.00 0.00 C ATOM 105 NH1 ARG A 8 13.980 -6.679 0.630 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 15.085 -5.244 -0.788 1.00 0.00 N ATOM 107 H ARG A 8 13.221 -0.211 3.005 1.00 0.00 H ATOM 108 HA ARG A 8 10.986 -0.623 1.425 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.967 -2.092 1.438 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.503 -2.698 3.022 1.00 0.00 H ATOM 111 HG2 ARG A 8 10.423 -3.591 2.043 1.00 0.00 H ATOM 112 HG3 ARG A 8 10.962 -3.039 0.456 1.00 0.00 H ATOM 113 HD2 ARG A 8 12.438 -5.000 2.210 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.413 -5.435 0.842 1.00 0.00 H ATOM 115 HE ARG A 8 13.326 -3.639 -0.088 1.00 0.00 H ATOM 116 HH11 ARG A 8 13.236 -6.863 1.272 1.00 0.00 H ATOM 117 HH12 ARG A 8 14.643 -7.397 0.416 1.00 0.00 H ATOM 118 HH21 ARG A 8 15.175 -4.345 -1.217 1.00 0.00 H ATOM 119 HH22 ARG A 8 15.745 -5.966 -1.000 1.00 0.00 H ATOM 120 N LYS A 9 10.483 -1.360 4.583 1.00 0.00 N ATOM 121 CA LYS A 9 9.460 -1.623 5.593 1.00 0.00 C ATOM 122 C LYS A 9 8.530 -0.417 5.764 1.00 0.00 C ATOM 123 O LYS A 9 7.304 -0.556 5.748 1.00 0.00 O ATOM 124 CB LYS A 9 10.132 -1.987 6.926 1.00 0.00 C ATOM 125 CG LYS A 9 9.187 -2.544 7.986 1.00 0.00 C ATOM 126 CD LYS A 9 8.297 -1.468 8.593 1.00 0.00 C ATOM 127 CE LYS A 9 9.112 -0.351 9.234 1.00 0.00 C ATOM 128 NZ LYS A 9 9.971 -0.848 10.345 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.414 -1.234 4.866 1.00 0.00 H ATOM 130 HA LYS A 9 8.875 -2.463 5.256 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.893 -2.730 6.736 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.603 -1.103 7.327 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.559 -3.295 7.532 1.00 0.00 H ATOM 134 HG3 LYS A 9 9.774 -2.996 8.772 1.00 0.00 H ATOM 135 HD2 LYS A 9 7.677 -1.048 7.819 1.00 0.00 H ATOM 136 HD3 LYS A 9 7.671 -1.919 9.349 1.00 0.00 H ATOM 137 HE2 LYS A 9 9.740 0.098 8.479 1.00 0.00 H ATOM 138 HE3 LYS A 9 8.433 0.395 9.623 1.00 0.00 H ATOM 139 HZ1 LYS A 9 10.366 -0.048 10.878 1.00 0.00 H ATOM 140 HZ2 LYS A 9 10.755 -1.416 9.965 1.00 0.00 H ATOM 141 HZ3 LYS A 9 9.412 -1.441 10.993 1.00 0.00 H ATOM 142 N SER A 10 9.116 0.767 5.930 1.00 0.00 N ATOM 143 CA SER A 10 8.334 1.992 6.108 1.00 0.00 C ATOM 144 C SER A 10 7.472 2.298 4.879 1.00 0.00 C ATOM 145 O SER A 10 6.356 2.801 5.014 1.00 0.00 O ATOM 146 CB SER A 10 9.251 3.180 6.416 1.00 0.00 C ATOM 147 OG SER A 10 10.140 3.435 5.345 1.00 0.00 O ATOM 148 H SER A 10 10.095 0.817 5.936 1.00 0.00 H ATOM 149 HA SER A 10 7.679 1.835 6.950 1.00 0.00 H ATOM 150 HB2 SER A 10 8.650 4.060 6.585 1.00 0.00 H ATOM 151 HB3 SER A 10 9.827 2.965 7.304 1.00 0.00 H ATOM 152 HG SER A 10 9.811 4.173 4.826 1.00 0.00 H ATOM 153 N ASP A 11 7.994 2.003 3.686 1.00 0.00 N ATOM 154 CA ASP A 11 7.264 2.261 2.442 1.00 0.00 C ATOM 155 C ASP A 11 6.045 1.347 2.297 1.00 0.00 C ATOM 156 O ASP A 11 4.964 1.811 1.934 1.00 0.00 O ATOM 157 CB ASP A 11 8.180 2.094 1.219 1.00 0.00 C ATOM 158 CG ASP A 11 9.270 3.160 1.092 1.00 0.00 C ATOM 159 OD1 ASP A 11 10.046 3.133 0.136 1.00 0.00 O ATOM 160 H ASP A 11 8.891 1.612 3.640 1.00 0.00 H ATOM 161 HA ASP A 11 6.918 3.281 2.475 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.664 1.131 1.277 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.574 2.124 0.325 1.00 0.00 H ATOM 164 N ARG A 12 6.222 0.048 2.570 1.00 0.00 N ATOM 165 CA ARG A 12 5.121 -0.917 2.450 1.00 0.00 C ATOM 166 C ARG A 12 3.947 -0.528 3.353 1.00 0.00 C ATOM 167 O ARG A 12 2.789 -0.623 2.940 1.00 0.00 O ATOM 168 CB ARG A 12 5.597 -2.351 2.747 1.00 0.00 C ATOM 169 CG ARG A 12 5.880 -2.635 4.215 1.00 0.00 C ATOM 170 CD ARG A 12 4.725 -3.362 4.892 1.00 0.00 C ATOM 171 NE ARG A 12 4.532 -4.713 4.361 1.00 0.00 N ATOM 172 CZ ARG A 12 3.618 -5.574 4.817 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.806 -5.235 5.815 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.520 -6.784 4.275 1.00 0.00 N ATOM 175 H ARG A 12 7.107 -0.267 2.847 1.00 0.00 H ATOM 176 HA ARG A 12 4.779 -0.876 1.427 1.00 0.00 H ATOM 177 HB2 ARG A 12 4.836 -3.042 2.413 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.502 -2.536 2.188 1.00 0.00 H ATOM 179 HG2 ARG A 12 6.766 -3.248 4.288 1.00 0.00 H ATOM 180 HG3 ARG A 12 6.046 -1.701 4.721 1.00 0.00 H ATOM 181 HD2 ARG A 12 4.931 -3.430 5.950 1.00 0.00 H ATOM 182 HD3 ARG A 12 3.819 -2.792 4.740 1.00 0.00 H ATOM 183 HE ARG A 12 5.116 -4.997 3.627 1.00 0.00 H ATOM 184 HH11 ARG A 12 2.873 -4.329 6.231 1.00 0.00 H ATOM 185 HH12 ARG A 12 2.125 -5.887 6.149 1.00 0.00 H ATOM 186 HH21 ARG A 12 4.129 -7.049 3.527 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.837 -7.431 4.616 1.00 0.00 H ATOM 188 N LYS A 13 4.247 -0.074 4.573 1.00 0.00 N ATOM 189 CA LYS A 13 3.199 0.345 5.506 1.00 0.00 C ATOM 190 C LYS A 13 2.609 1.699 5.094 1.00 0.00 C ATOM 191 O LYS A 13 1.410 1.937 5.256 1.00 0.00 O ATOM 192 CB LYS A 13 3.729 0.420 6.945 1.00 0.00 C ATOM 193 CG LYS A 13 4.813 1.466 7.155 1.00 0.00 C ATOM 194 CD LYS A 13 5.158 1.636 8.627 1.00 0.00 C ATOM 195 CE LYS A 13 5.687 0.346 9.234 1.00 0.00 C ATOM 196 NZ LYS A 13 6.057 0.512 10.668 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.187 -0.004 4.844 1.00 0.00 H ATOM 198 HA LYS A 13 2.414 -0.396 5.464 1.00 0.00 H ATOM 199 HB2 LYS A 13 2.907 0.650 7.606 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.134 -0.545 7.216 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.702 1.161 6.622 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.467 2.412 6.765 1.00 0.00 H ATOM 203 HD2 LYS A 13 5.914 2.401 8.724 1.00 0.00 H ATOM 204 HD3 LYS A 13 4.268 1.937 9.161 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.922 -0.414 9.157 1.00 0.00 H ATOM 206 HE3 LYS A 13 6.557 0.037 8.680 1.00 0.00 H ATOM 207 HZ1 LYS A 13 5.208 0.712 11.236 1.00 0.00 H ATOM 208 HZ2 LYS A 13 6.727 1.300 10.776 1.00 0.00 H ATOM 209 HZ3 LYS A 13 6.503 -0.358 11.024 1.00 0.00 H ATOM 210 N LYS A 14 3.466 2.583 4.570 1.00 0.00 N ATOM 211 CA LYS A 14 3.048 3.919 4.139 1.00 0.00 C ATOM 212 C LYS A 14 1.983 3.847 3.045 1.00 0.00 C ATOM 213 O LYS A 14 1.014 4.604 3.070 1.00 0.00 O ATOM 214 CB LYS A 14 4.263 4.723 3.650 1.00 0.00 C ATOM 215 CG LYS A 14 3.970 6.192 3.365 1.00 0.00 C ATOM 216 CD LYS A 14 3.387 6.403 1.973 1.00 0.00 C ATOM 217 CE LYS A 14 3.094 7.875 1.702 1.00 0.00 C ATOM 218 NZ LYS A 14 1.661 8.185 1.745 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.408 2.330 4.475 1.00 0.00 H ATOM 220 HA LYS A 14 2.624 4.418 4.995 1.00 0.00 H ATOM 221 HB2 LYS A 14 5.035 4.674 4.403 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.632 4.270 2.742 1.00 0.00 H ATOM 223 HG2 LYS A 14 3.264 6.554 4.096 1.00 0.00 H ATOM 224 HG3 LYS A 14 4.890 6.752 3.447 1.00 0.00 H ATOM 225 HD2 LYS A 14 4.098 6.050 1.240 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.470 5.842 1.885 1.00 0.00 H ATOM 227 HE2 LYS A 14 3.600 8.471 2.447 1.00 0.00 H ATOM 228 HE3 LYS A 14 3.476 8.127 0.724 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.278 8.642 0.966 1.00 0.00 H ATOM 230 N LYS A 15 2.165 2.932 2.090 1.00 0.00 N ATOM 231 CA LYS A 15 1.209 2.766 0.991 1.00 0.00 C ATOM 232 C LYS A 15 -0.204 2.530 1.521 1.00 0.00 C ATOM 233 O LYS A 15 -1.181 3.001 0.937 1.00 0.00 O ATOM 234 CB LYS A 15 1.629 1.609 0.077 1.00 0.00 C ATOM 235 CG LYS A 15 2.929 1.869 -0.669 1.00 0.00 C ATOM 236 CD LYS A 15 3.267 0.756 -1.655 1.00 0.00 C ATOM 237 CE LYS A 15 3.753 -0.513 -0.962 1.00 0.00 C ATOM 238 NZ LYS A 15 2.664 -1.232 -0.242 1.00 0.00 N1+ ATOM 239 H LYS A 15 2.955 2.354 2.128 1.00 0.00 H ATOM 240 HA LYS A 15 1.212 3.679 0.418 1.00 0.00 H ATOM 241 HB2 LYS A 15 1.751 0.722 0.677 1.00 0.00 H ATOM 242 HB3 LYS A 15 0.848 1.439 -0.649 1.00 0.00 H ATOM 243 HG2 LYS A 15 2.837 2.797 -1.212 1.00 0.00 H ATOM 244 HG3 LYS A 15 3.730 1.954 0.050 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.383 0.521 -2.227 1.00 0.00 H ATOM 246 HD3 LYS A 15 4.041 1.109 -2.321 1.00 0.00 H ATOM 247 HE2 LYS A 15 4.171 -1.173 -1.706 1.00 0.00 H ATOM 248 HE3 LYS A 15 4.524 -0.244 -0.253 1.00 0.00 H ATOM 249 HZ1 LYS A 15 1.748 -1.055 -0.704 1.00 0.00 H ATOM 250 HZ2 LYS A 15 2.611 -0.908 0.745 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.850 -2.256 -0.246 1.00 0.00 H ATOM 252 N ASN A 16 -0.307 1.804 2.632 1.00 0.00 N ATOM 253 CA ASN A 16 -1.603 1.516 3.244 1.00 0.00 C ATOM 254 C ASN A 16 -2.190 2.775 3.890 1.00 0.00 C ATOM 255 O ASN A 16 -3.371 3.079 3.718 1.00 0.00 O ATOM 256 CB ASN A 16 -1.460 0.404 4.292 1.00 0.00 C ATOM 257 CG ASN A 16 -2.791 -0.101 4.845 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.812 -0.830 5.837 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.908 0.249 4.204 1.00 0.00 N ATOM 260 H ASN A 16 0.509 1.458 3.055 1.00 0.00 H ATOM 261 HA ASN A 16 -2.268 1.183 2.464 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.945 -0.432 3.845 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.871 0.779 5.117 1.00 0.00 H ATOM 264 HD21 ASN A 16 -3.835 0.812 3.408 1.00 0.00 H ATOM 265 HD22 ASN A 16 -4.761 -0.074 4.560 1.00 0.00 H ATOM 266 N GLN A 17 -1.353 3.496 4.638 1.00 0.00 N ATOM 267 CA GLN A 17 -1.777 4.721 5.324 1.00 0.00 C ATOM 268 C GLN A 17 -2.140 5.836 4.339 1.00 0.00 C ATOM 269 O GLN A 17 -3.158 6.510 4.507 1.00 0.00 O ATOM 270 CB GLN A 17 -0.672 5.203 6.270 1.00 0.00 C ATOM 271 CG GLN A 17 -0.995 6.506 6.988 1.00 0.00 C ATOM 272 CD GLN A 17 -2.254 6.417 7.834 1.00 0.00 C ATOM 273 OE1 GLN A 17 -2.335 5.615 8.764 1.00 0.00 O ATOM 274 NE2 GLN A 17 -3.245 7.245 7.515 1.00 0.00 N ATOM 275 H GLN A 17 -0.426 3.194 4.737 1.00 0.00 H ATOM 276 HA GLN A 17 -2.651 4.481 5.906 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.497 4.441 7.016 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.234 5.347 5.700 1.00 0.00 H ATOM 279 HG2 GLN A 17 -0.167 6.762 7.630 1.00 0.00 H ATOM 280 HG3 GLN A 17 -1.129 7.283 6.249 1.00 0.00 H ATOM 281 HE21 GLN A 17 -3.113 7.858 6.761 1.00 0.00 H ATOM 282 HE22 GLN A 17 -4.066 7.209 8.047 1.00 0.00 H ATOM 283 N ASP A 18 -1.297 6.035 3.326 1.00 0.00 N ATOM 284 CA ASP A 18 -1.522 7.080 2.327 1.00 0.00 C ATOM 285 C ASP A 18 -1.290 6.558 0.905 1.00 0.00 C ATOM 286 O ASP A 18 -0.564 7.168 0.117 1.00 0.00 O ATOM 287 CB ASP A 18 -0.605 8.281 2.606 1.00 0.00 C ATOM 288 CG ASP A 18 0.854 7.881 2.763 1.00 0.00 C ATOM 289 OD1 ASP A 18 1.237 7.297 3.777 1.00 0.00 O ATOM 290 H ASP A 18 -0.499 5.471 3.254 1.00 0.00 H ATOM 291 HA ASP A 18 -2.549 7.401 2.412 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.681 8.981 1.788 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.926 8.765 3.517 1.00 0.00 H HETATM 294 N NH2 A 19 -1.923 5.441 0.568 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -2.483 5.001 1.241 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -1.802 5.099 -0.343 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 9 ATOM 1 N PHE A 1 19.743 7.701 -6.260 1.00 0.00 N ATOM 2 CA PHE A 1 19.730 8.229 -4.900 1.00 0.00 C ATOM 3 C PHE A 1 18.634 7.562 -4.065 1.00 0.00 C ATOM 4 O PHE A 1 17.778 8.237 -3.483 1.00 0.00 O ATOM 5 CB PHE A 1 19.545 9.754 -4.915 1.00 0.00 C ATOM 6 CG PHE A 1 20.738 10.508 -5.442 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.232 10.263 -6.715 1.00 0.00 C ATOM 8 CD2 PHE A 1 21.368 11.462 -4.656 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.329 10.954 -7.193 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.466 12.156 -5.130 1.00 0.00 C ATOM 11 CZ PHE A 1 22.947 11.901 -6.400 1.00 0.00 C ATOM 12 H1 PHE A 1 18.942 7.792 -6.818 1.00 0.00 H ATOM 13 HA PHE A 1 20.685 8.000 -4.452 1.00 0.00 H ATOM 14 HB2 PHE A 1 18.699 9.998 -5.539 1.00 0.00 H ATOM 15 HB3 PHE A 1 19.353 10.095 -3.909 1.00 0.00 H ATOM 16 HD1 PHE A 1 20.750 9.525 -7.339 1.00 0.00 H ATOM 17 HD2 PHE A 1 20.994 11.660 -3.664 1.00 0.00 H ATOM 18 HE1 PHE A 1 22.704 10.755 -8.186 1.00 0.00 H ATOM 19 HE2 PHE A 1 22.947 12.895 -4.508 1.00 0.00 H ATOM 20 HZ PHE A 1 23.805 12.442 -6.771 1.00 0.00 H ATOM 21 N GLY A 2 18.669 6.227 -4.009 1.00 0.00 N ATOM 22 CA GLY A 2 17.684 5.475 -3.245 1.00 0.00 C ATOM 23 C GLY A 2 17.724 5.798 -1.761 1.00 0.00 C ATOM 24 O GLY A 2 18.802 5.893 -1.171 1.00 0.00 O ATOM 25 H GLY A 2 19.376 5.747 -4.492 1.00 0.00 H ATOM 26 HA2 GLY A 2 16.699 5.705 -3.626 1.00 0.00 H ATOM 27 HA3 GLY A 2 17.870 4.420 -3.377 1.00 0.00 H ATOM 28 N GLY A 3 16.546 5.977 -1.162 1.00 0.00 N ATOM 29 CA GLY A 3 16.463 6.301 0.253 1.00 0.00 C ATOM 30 C GLY A 3 16.728 5.110 1.162 1.00 0.00 C ATOM 31 O GLY A 3 16.005 4.909 2.136 1.00 0.00 O ATOM 32 H GLY A 3 15.722 5.895 -1.689 1.00 0.00 H ATOM 33 HA2 GLY A 3 17.185 7.073 0.476 1.00 0.00 H ATOM 34 HA3 GLY A 3 15.474 6.682 0.463 1.00 0.00 H ATOM 35 N PHE A 4 17.773 4.333 0.852 1.00 0.00 N ATOM 36 CA PHE A 4 18.146 3.160 1.653 1.00 0.00 C ATOM 37 C PHE A 4 17.102 2.043 1.542 1.00 0.00 C ATOM 38 O PHE A 4 15.894 2.294 1.558 1.00 0.00 O ATOM 39 CB PHE A 4 18.342 3.558 3.123 1.00 0.00 C ATOM 40 CG PHE A 4 18.883 2.454 3.991 1.00 0.00 C ATOM 41 CD1 PHE A 4 20.020 1.752 3.618 1.00 0.00 C ATOM 42 CD2 PHE A 4 18.257 2.122 5.183 1.00 0.00 C ATOM 43 CE1 PHE A 4 20.519 0.741 4.417 1.00 0.00 C ATOM 44 CE2 PHE A 4 18.752 1.112 5.986 1.00 0.00 C ATOM 45 CZ PHE A 4 19.885 0.421 5.602 1.00 0.00 C ATOM 46 H PHE A 4 18.314 4.557 0.065 1.00 0.00 H ATOM 47 HA PHE A 4 19.083 2.791 1.266 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.033 4.385 3.174 1.00 0.00 H ATOM 49 HB3 PHE A 4 17.391 3.865 3.533 1.00 0.00 H ATOM 50 HD1 PHE A 4 20.516 2.002 2.693 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.371 2.662 5.482 1.00 0.00 H ATOM 52 HE1 PHE A 4 21.406 0.204 4.115 1.00 0.00 H ATOM 53 HE2 PHE A 4 18.254 0.863 6.912 1.00 0.00 H ATOM 54 HZ PHE A 4 20.275 -0.369 6.228 1.00 0.00 H ATOM 55 N THR A 5 17.584 0.804 1.431 1.00 0.00 N ATOM 56 CA THR A 5 16.706 -0.362 1.317 1.00 0.00 C ATOM 57 C THR A 5 15.850 -0.556 2.573 1.00 0.00 C ATOM 58 O THR A 5 14.678 -0.912 2.475 1.00 0.00 O ATOM 59 CB THR A 5 17.507 -1.656 1.035 1.00 0.00 C ATOM 60 OG1 THR A 5 16.611 -2.760 0.854 1.00 0.00 O ATOM 61 CG2 THR A 5 18.482 -1.967 2.166 1.00 0.00 C ATOM 62 H THR A 5 18.554 0.669 1.426 1.00 0.00 H ATOM 63 HA THR A 5 16.046 -0.190 0.480 1.00 0.00 H ATOM 64 HB THR A 5 18.072 -1.514 0.123 1.00 0.00 H ATOM 65 HG1 THR A 5 16.312 -3.081 1.708 1.00 0.00 H ATOM 66 HG21 THR A 5 19.125 -1.115 2.330 1.00 0.00 H ATOM 67 HG22 THR A 5 19.082 -2.824 1.898 1.00 0.00 H ATOM 68 HG23 THR A 5 17.929 -2.182 3.067 1.00 0.00 H ATOM 69 N GLY A 6 16.447 -0.321 3.746 1.00 0.00 N ATOM 70 CA GLY A 6 15.730 -0.476 5.008 1.00 0.00 C ATOM 71 C GLY A 6 14.431 0.316 5.060 1.00 0.00 C ATOM 72 O GLY A 6 13.453 -0.133 5.661 1.00 0.00 O ATOM 73 H GLY A 6 17.386 -0.043 3.756 1.00 0.00 H ATOM 74 HA2 GLY A 6 15.504 -1.521 5.152 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.371 -0.147 5.813 1.00 0.00 H ATOM 76 N LYS A 7 14.427 1.494 4.431 1.00 0.00 N ATOM 77 CA LYS A 7 13.249 2.369 4.397 1.00 0.00 C ATOM 78 C LYS A 7 12.022 1.645 3.808 1.00 0.00 C ATOM 79 O LYS A 7 10.888 2.041 4.066 1.00 0.00 O ATOM 80 CB LYS A 7 13.567 3.630 3.576 1.00 0.00 C ATOM 81 CG LYS A 7 12.858 4.900 4.049 1.00 0.00 C ATOM 82 CD LYS A 7 11.351 4.843 3.838 1.00 0.00 C ATOM 83 CE LYS A 7 10.994 4.704 2.364 1.00 0.00 C ATOM 84 NZ LYS A 7 9.753 3.956 2.174 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.243 1.789 3.976 1.00 0.00 H ATOM 86 HA LYS A 7 13.025 2.661 5.412 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.631 3.808 3.619 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.288 3.451 2.548 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.052 5.033 5.103 1.00 0.00 H ATOM 90 HG3 LYS A 7 13.256 5.743 3.502 1.00 0.00 H ATOM 91 HD2 LYS A 7 10.950 4.005 4.381 1.00 0.00 H ATOM 92 HD3 LYS A 7 10.914 5.757 4.217 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.875 5.692 1.941 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.795 4.190 1.856 1.00 0.00 H ATOM 95 HZ1 LYS A 7 8.975 4.234 2.697 1.00 0.00 H ATOM 96 N ARG A 8 12.254 0.586 3.019 1.00 0.00 N ATOM 97 CA ARG A 8 11.161 -0.176 2.398 1.00 0.00 C ATOM 98 C ARG A 8 10.049 -0.484 3.400 1.00 0.00 C ATOM 99 O ARG A 8 8.871 -0.476 3.046 1.00 0.00 O ATOM 100 CB ARG A 8 11.682 -1.486 1.794 1.00 0.00 C ATOM 101 CG ARG A 8 12.143 -2.506 2.827 1.00 0.00 C ATOM 102 CD ARG A 8 12.595 -3.802 2.169 1.00 0.00 C ATOM 103 NE ARG A 8 13.043 -4.797 3.145 1.00 0.00 N ATOM 104 CZ ARG A 8 14.141 -4.672 3.898 1.00 0.00 C ATOM 105 NH1 ARG A 8 14.939 -3.616 3.763 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 14.450 -5.617 4.781 1.00 0.00 N ATOM 107 H ARG A 8 13.174 0.311 2.850 1.00 0.00 H ATOM 108 HA ARG A 8 10.749 0.431 1.607 1.00 0.00 H ATOM 109 HB2 ARG A 8 10.893 -1.935 1.208 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.516 -1.264 1.144 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.966 -2.093 3.388 1.00 0.00 H ATOM 112 HG3 ARG A 8 11.322 -2.722 3.497 1.00 0.00 H ATOM 113 HD2 ARG A 8 11.768 -4.213 1.608 1.00 0.00 H ATOM 114 HD3 ARG A 8 13.410 -3.582 1.495 1.00 0.00 H ATOM 115 HE ARG A 8 12.489 -5.598 3.256 1.00 0.00 H ATOM 116 HH11 ARG A 8 14.724 -2.905 3.096 1.00 0.00 H ATOM 117 HH12 ARG A 8 15.759 -3.533 4.330 1.00 0.00 H ATOM 118 HH21 ARG A 8 13.860 -6.419 4.883 1.00 0.00 H ATOM 119 HH22 ARG A 8 15.271 -5.527 5.343 1.00 0.00 H ATOM 120 N LYS A 9 10.433 -0.756 4.649 1.00 0.00 N ATOM 121 CA LYS A 9 9.462 -1.070 5.700 1.00 0.00 C ATOM 122 C LYS A 9 8.443 0.059 5.853 1.00 0.00 C ATOM 123 O LYS A 9 7.234 -0.180 5.844 1.00 0.00 O ATOM 124 CB LYS A 9 10.177 -1.325 7.032 1.00 0.00 C ATOM 125 CG LYS A 9 9.238 -1.676 8.176 1.00 0.00 C ATOM 126 CD LYS A 9 8.411 -2.916 7.866 1.00 0.00 C ATOM 127 CE LYS A 9 7.589 -3.359 9.067 1.00 0.00 C ATOM 128 NZ LYS A 9 8.447 -3.754 10.218 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.392 -0.744 4.865 1.00 0.00 H ATOM 130 HA LYS A 9 8.940 -1.966 5.407 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.874 -2.140 6.903 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.726 -0.436 7.308 1.00 0.00 H ATOM 133 HG2 LYS A 9 9.823 -1.860 9.064 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.572 -0.844 8.348 1.00 0.00 H ATOM 135 HD2 LYS A 9 7.743 -2.694 7.050 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.076 -3.718 7.581 1.00 0.00 H ATOM 137 HE2 LYS A 9 6.949 -2.544 9.371 1.00 0.00 H ATOM 138 HE3 LYS A 9 6.979 -4.202 8.776 1.00 0.00 H ATOM 139 HZ1 LYS A 9 7.885 -4.275 10.922 1.00 0.00 H ATOM 140 HZ2 LYS A 9 8.850 -2.910 10.672 1.00 0.00 H ATOM 141 HZ3 LYS A 9 9.225 -4.364 9.892 1.00 0.00 H ATOM 142 N SER A 10 8.942 1.288 5.973 1.00 0.00 N ATOM 143 CA SER A 10 8.083 2.462 6.104 1.00 0.00 C ATOM 144 C SER A 10 7.301 2.707 4.812 1.00 0.00 C ATOM 145 O SER A 10 6.155 3.157 4.847 1.00 0.00 O ATOM 146 CB SER A 10 8.914 3.699 6.457 1.00 0.00 C ATOM 147 OG SER A 10 8.091 4.844 6.614 1.00 0.00 O ATOM 148 H SER A 10 9.915 1.409 5.958 1.00 0.00 H ATOM 149 HA SER A 10 7.382 2.271 6.901 1.00 0.00 H ATOM 150 HB2 SER A 10 9.441 3.523 7.382 1.00 0.00 H ATOM 151 HB3 SER A 10 9.627 3.889 5.668 1.00 0.00 H ATOM 152 HG SER A 10 7.942 5.252 5.758 1.00 0.00 H ATOM 153 N ASP A 11 7.933 2.409 3.673 1.00 0.00 N ATOM 154 CA ASP A 11 7.306 2.596 2.363 1.00 0.00 C ATOM 155 C ASP A 11 6.052 1.735 2.241 1.00 0.00 C ATOM 156 O ASP A 11 5.001 2.210 1.811 1.00 0.00 O ATOM 157 CB ASP A 11 8.283 2.232 1.234 1.00 0.00 C ATOM 158 CG ASP A 11 9.639 2.926 1.329 1.00 0.00 C ATOM 159 OD1 ASP A 11 10.580 2.536 0.634 1.00 0.00 O ATOM 160 H ASP A 11 8.846 2.055 3.714 1.00 0.00 H ATOM 161 HA ASP A 11 7.027 3.633 2.270 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.454 1.168 1.252 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.833 2.496 0.287 1.00 0.00 H ATOM 164 N ARG A 12 6.175 0.462 2.628 1.00 0.00 N ATOM 165 CA ARG A 12 5.055 -0.475 2.571 1.00 0.00 C ATOM 166 C ARG A 12 3.931 -0.029 3.497 1.00 0.00 C ATOM 167 O ARG A 12 2.762 -0.018 3.113 1.00 0.00 O ATOM 168 CB ARG A 12 5.510 -1.888 2.955 1.00 0.00 C ATOM 169 CG ARG A 12 6.597 -2.458 2.055 1.00 0.00 C ATOM 170 CD ARG A 12 6.136 -2.559 0.608 1.00 0.00 C ATOM 171 NE ARG A 12 7.181 -3.092 -0.266 1.00 0.00 N ATOM 172 CZ ARG A 12 8.326 -2.457 -0.545 1.00 0.00 C ATOM 173 NH1 ARG A 12 8.566 -1.240 -0.060 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 9.230 -3.041 -1.323 1.00 0.00 N ATOM 175 H ARG A 12 7.042 0.151 2.964 1.00 0.00 H ATOM 176 HA ARG A 12 4.686 -0.489 1.557 1.00 0.00 H ATOM 177 HB2 ARG A 12 5.887 -1.868 3.967 1.00 0.00 H ATOM 178 HB3 ARG A 12 4.658 -2.550 2.914 1.00 0.00 H ATOM 179 HG2 ARG A 12 7.462 -1.816 2.102 1.00 0.00 H ATOM 180 HG3 ARG A 12 6.861 -3.444 2.409 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.275 -3.211 0.562 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.859 -1.575 0.262 1.00 0.00 H ATOM 183 HE ARG A 12 7.029 -3.977 -0.660 1.00 0.00 H ATOM 184 HH11 ARG A 12 7.887 -0.786 0.517 1.00 0.00 H ATOM 185 HH12 ARG A 12 9.426 -0.779 -0.273 1.00 0.00 H ATOM 186 HH21 ARG A 12 9.054 -3.952 -1.700 1.00 0.00 H ATOM 187 HH22 ARG A 12 10.086 -2.571 -1.536 1.00 0.00 H ATOM 188 N LYS A 13 4.298 0.342 4.718 1.00 0.00 N ATOM 189 CA LYS A 13 3.324 0.797 5.706 1.00 0.00 C ATOM 190 C LYS A 13 2.570 2.021 5.188 1.00 0.00 C ATOM 191 O LYS A 13 1.341 2.081 5.269 1.00 0.00 O ATOM 192 CB LYS A 13 4.030 1.110 7.036 1.00 0.00 C ATOM 193 CG LYS A 13 3.096 1.527 8.169 1.00 0.00 C ATOM 194 CD LYS A 13 2.634 2.980 8.059 1.00 0.00 C ATOM 195 CE LYS A 13 3.723 3.970 8.467 1.00 0.00 C ATOM 196 NZ LYS A 13 4.851 4.023 7.494 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.249 0.313 4.959 1.00 0.00 H ATOM 198 HA LYS A 13 2.618 -0.002 5.862 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.567 0.229 7.355 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.740 1.905 6.870 1.00 0.00 H ATOM 201 HG2 LYS A 13 2.226 0.889 8.153 1.00 0.00 H ATOM 202 HG3 LYS A 13 3.615 1.398 9.108 1.00 0.00 H ATOM 203 HD2 LYS A 13 2.348 3.182 7.041 1.00 0.00 H ATOM 204 HD3 LYS A 13 1.779 3.118 8.705 1.00 0.00 H ATOM 205 HE2 LYS A 13 3.283 4.952 8.542 1.00 0.00 H ATOM 206 HE3 LYS A 13 4.108 3.678 9.433 1.00 0.00 H ATOM 207 HZ1 LYS A 13 4.515 3.786 6.541 1.00 0.00 H ATOM 208 HZ2 LYS A 13 5.593 3.349 7.766 1.00 0.00 H ATOM 209 HZ3 LYS A 13 5.260 4.979 7.475 1.00 0.00 H ATOM 210 N LYS A 14 3.315 2.991 4.654 1.00 0.00 N ATOM 211 CA LYS A 14 2.725 4.218 4.116 1.00 0.00 C ATOM 212 C LYS A 14 1.831 3.936 2.916 1.00 0.00 C ATOM 213 O LYS A 14 0.735 4.476 2.819 1.00 0.00 O ATOM 214 CB LYS A 14 3.819 5.213 3.716 1.00 0.00 C ATOM 215 CG LYS A 14 4.244 6.150 4.835 1.00 0.00 C ATOM 216 CD LYS A 14 3.112 7.073 5.277 1.00 0.00 C ATOM 217 CE LYS A 14 2.687 8.041 4.177 1.00 0.00 C ATOM 218 NZ LYS A 14 1.702 7.465 3.257 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.287 2.876 4.618 1.00 0.00 H ATOM 220 HA LYS A 14 2.122 4.657 4.896 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.688 4.658 3.397 1.00 0.00 H ATOM 222 HB3 LYS A 14 3.465 5.808 2.891 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.560 5.561 5.681 1.00 0.00 H ATOM 224 HG3 LYS A 14 5.070 6.752 4.487 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.261 6.471 5.553 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.444 7.642 6.133 1.00 0.00 H ATOM 227 HE2 LYS A 14 2.260 8.920 4.637 1.00 0.00 H ATOM 228 HE3 LYS A 14 3.564 8.327 3.613 1.00 0.00 H ATOM 229 HZ1 LYS A 14 2.005 6.757 2.653 1.00 0.00 H ATOM 230 N LYS A 15 2.300 3.089 2.004 1.00 0.00 N ATOM 231 CA LYS A 15 1.527 2.743 0.813 1.00 0.00 C ATOM 232 C LYS A 15 0.138 2.239 1.211 1.00 0.00 C ATOM 233 O LYS A 15 -0.857 2.541 0.550 1.00 0.00 O ATOM 234 CB LYS A 15 2.277 1.691 -0.018 1.00 0.00 C ATOM 235 CG LYS A 15 1.653 1.405 -1.379 1.00 0.00 C ATOM 236 CD LYS A 15 0.387 0.567 -1.264 1.00 0.00 C ATOM 237 CE LYS A 15 0.503 -0.735 -2.044 1.00 0.00 C ATOM 238 NZ LYS A 15 1.597 -1.603 -1.523 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.184 2.686 2.136 1.00 0.00 H ATOM 240 HA LYS A 15 1.413 3.641 0.223 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.288 2.035 -0.179 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.308 0.767 0.540 1.00 0.00 H ATOM 243 HG2 LYS A 15 1.406 2.343 -1.852 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.372 0.874 -1.986 1.00 0.00 H ATOM 245 HD2 LYS A 15 0.212 0.335 -0.225 1.00 0.00 H ATOM 246 HD3 LYS A 15 -0.445 1.136 -1.653 1.00 0.00 H ATOM 247 HE2 LYS A 15 -0.433 -1.268 -1.969 1.00 0.00 H ATOM 248 HE3 LYS A 15 0.702 -0.502 -3.080 1.00 0.00 H ATOM 249 HZ1 LYS A 15 1.514 -2.559 -1.922 1.00 0.00 H ATOM 250 HZ2 LYS A 15 1.542 -1.667 -0.486 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.524 -1.208 -1.786 1.00 0.00 H ATOM 252 N ASN A 16 0.087 1.475 2.304 1.00 0.00 N ATOM 253 CA ASN A 16 -1.167 0.927 2.811 1.00 0.00 C ATOM 254 C ASN A 16 -2.001 1.986 3.540 1.00 0.00 C ATOM 255 O ASN A 16 -3.200 2.115 3.287 1.00 0.00 O ATOM 256 CB ASN A 16 -0.884 -0.249 3.753 1.00 0.00 C ATOM 257 CG ASN A 16 -2.151 -0.861 4.323 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.001 -1.359 3.585 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.286 -0.826 5.646 1.00 0.00 N ATOM 260 H ASN A 16 0.919 1.280 2.786 1.00 0.00 H ATOM 261 HA ASN A 16 -1.731 0.566 1.966 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.349 -1.015 3.212 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.273 0.098 4.573 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.571 -0.414 6.175 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.096 -1.215 6.039 1.00 0.00 H ATOM 266 N GLN A 17 -1.371 2.721 4.461 1.00 0.00 N ATOM 267 CA GLN A 17 -2.075 3.742 5.244 1.00 0.00 C ATOM 268 C GLN A 17 -2.459 4.956 4.391 1.00 0.00 C ATOM 269 O GLN A 17 -3.601 5.415 4.441 1.00 0.00 O ATOM 270 CB GLN A 17 -1.240 4.170 6.462 1.00 0.00 C ATOM 271 CG GLN A 17 -0.263 5.312 6.208 1.00 0.00 C ATOM 272 CD GLN A 17 0.462 5.786 7.466 1.00 0.00 C ATOM 273 OE1 GLN A 17 1.180 6.784 7.431 1.00 0.00 O ATOM 274 NE2 GLN A 17 0.291 5.082 8.584 1.00 0.00 N ATOM 275 H GLN A 17 -0.420 2.558 4.632 1.00 0.00 H ATOM 276 HA GLN A 17 -2.987 3.288 5.601 1.00 0.00 H ATOM 277 HB2 GLN A 17 -1.911 4.474 7.252 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.670 3.317 6.801 1.00 0.00 H ATOM 279 HG2 GLN A 17 0.475 4.981 5.496 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.810 6.146 5.791 1.00 0.00 H ATOM 281 HE21 GLN A 17 -0.286 4.291 8.557 1.00 0.00 H ATOM 282 HE22 GLN A 17 0.752 5.384 9.393 1.00 0.00 H ATOM 283 N ASP A 18 -1.506 5.467 3.608 1.00 0.00 N ATOM 284 CA ASP A 18 -1.753 6.624 2.745 1.00 0.00 C ATOM 285 C ASP A 18 -2.716 6.265 1.612 1.00 0.00 C ATOM 286 O ASP A 18 -3.689 6.976 1.366 1.00 0.00 O ATOM 287 CB ASP A 18 -0.442 7.166 2.158 1.00 0.00 C ATOM 288 CG ASP A 18 0.431 7.865 3.189 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.027 8.764 3.894 1.00 0.00 O ATOM 290 H ASP A 18 -0.618 5.055 3.609 1.00 0.00 H ATOM 291 HA ASP A 18 -2.207 7.394 3.351 1.00 0.00 H ATOM 292 HB2 ASP A 18 0.120 6.346 1.737 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.675 7.872 1.374 1.00 0.00 H HETATM 294 N NH2 A 19 -2.445 5.159 0.924 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.653 4.637 1.172 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.051 4.909 0.196 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 10 ATOM 1 N PHE A 1 16.026 1.877 -7.828 1.00 0.00 N ATOM 2 CA PHE A 1 14.902 1.032 -7.434 1.00 0.00 C ATOM 3 C PHE A 1 15.338 -0.422 -7.215 1.00 0.00 C ATOM 4 O PHE A 1 14.583 -1.355 -7.497 1.00 0.00 O ATOM 5 CB PHE A 1 13.788 1.101 -8.492 1.00 0.00 C ATOM 6 CG PHE A 1 14.261 0.942 -9.917 1.00 0.00 C ATOM 7 CD1 PHE A 1 15.285 0.062 -10.244 1.00 0.00 C ATOM 8 CD2 PHE A 1 13.671 1.678 -10.933 1.00 0.00 C ATOM 9 CE1 PHE A 1 15.708 -0.077 -11.551 1.00 0.00 C ATOM 10 CE2 PHE A 1 14.091 1.541 -12.243 1.00 0.00 C ATOM 11 CZ PHE A 1 15.110 0.663 -12.552 1.00 0.00 C ATOM 12 H1 PHE A 1 16.349 2.562 -7.207 1.00 0.00 H ATOM 13 HA PHE A 1 14.517 1.417 -6.501 1.00 0.00 H ATOM 14 HB2 PHE A 1 13.072 0.317 -8.297 1.00 0.00 H ATOM 15 HB3 PHE A 1 13.291 2.058 -8.412 1.00 0.00 H ATOM 16 HD1 PHE A 1 15.755 -0.518 -9.464 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.873 2.366 -10.692 1.00 0.00 H ATOM 18 HE1 PHE A 1 16.507 -0.766 -11.790 1.00 0.00 H ATOM 19 HE2 PHE A 1 13.621 2.122 -13.023 1.00 0.00 H ATOM 20 HZ PHE A 1 15.440 0.555 -13.576 1.00 0.00 H ATOM 21 N GLY A 2 16.558 -0.606 -6.706 1.00 0.00 N ATOM 22 CA GLY A 2 17.069 -1.945 -6.456 1.00 0.00 C ATOM 23 C GLY A 2 16.643 -2.496 -5.106 1.00 0.00 C ATOM 24 O GLY A 2 15.474 -2.393 -4.728 1.00 0.00 O ATOM 25 H GLY A 2 17.115 0.172 -6.496 1.00 0.00 H ATOM 26 HA2 GLY A 2 16.708 -2.605 -7.230 1.00 0.00 H ATOM 27 HA3 GLY A 2 18.148 -1.918 -6.498 1.00 0.00 H ATOM 28 N GLY A 3 17.598 -3.086 -4.383 1.00 0.00 N ATOM 29 CA GLY A 3 17.315 -3.653 -3.074 1.00 0.00 C ATOM 30 C GLY A 3 17.103 -2.596 -2.003 1.00 0.00 C ATOM 31 O GLY A 3 17.735 -1.539 -2.032 1.00 0.00 O ATOM 32 H GLY A 3 18.509 -3.135 -4.744 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.425 -4.262 -3.143 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.143 -4.282 -2.782 1.00 0.00 H ATOM 35 N PHE A 4 16.211 -2.887 -1.053 1.00 0.00 N ATOM 36 CA PHE A 4 15.912 -1.959 0.039 1.00 0.00 C ATOM 37 C PHE A 4 15.159 -2.671 1.163 1.00 0.00 C ATOM 38 O PHE A 4 14.161 -3.351 0.919 1.00 0.00 O ATOM 39 CB PHE A 4 15.102 -0.758 -0.478 1.00 0.00 C ATOM 40 CG PHE A 4 13.757 -1.116 -1.061 1.00 0.00 C ATOM 41 CD1 PHE A 4 13.664 -1.872 -2.217 1.00 0.00 C ATOM 42 CD2 PHE A 4 12.589 -0.693 -0.447 1.00 0.00 C ATOM 43 CE1 PHE A 4 12.433 -2.200 -2.752 1.00 0.00 C ATOM 44 CE2 PHE A 4 11.355 -1.018 -0.979 1.00 0.00 C ATOM 45 CZ PHE A 4 11.278 -1.771 -2.132 1.00 0.00 C ATOM 46 H PHE A 4 15.743 -3.748 -1.087 1.00 0.00 H ATOM 47 HA PHE A 4 16.854 -1.600 0.430 1.00 0.00 H ATOM 48 HB2 PHE A 4 14.932 -0.073 0.338 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.672 -0.256 -1.247 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.568 -2.207 -2.703 1.00 0.00 H ATOM 51 HD2 PHE A 4 12.648 -0.102 0.455 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.377 -2.791 -3.655 1.00 0.00 H ATOM 53 HE2 PHE A 4 10.452 -0.682 -0.491 1.00 0.00 H ATOM 54 HZ PHE A 4 10.314 -2.026 -2.548 1.00 0.00 H ATOM 55 N THR A 5 15.652 -2.521 2.395 1.00 0.00 N ATOM 56 CA THR A 5 15.032 -3.161 3.555 1.00 0.00 C ATOM 57 C THR A 5 14.416 -2.129 4.499 1.00 0.00 C ATOM 58 O THR A 5 13.196 -2.084 4.662 1.00 0.00 O ATOM 59 CB THR A 5 16.052 -4.021 4.331 1.00 0.00 C ATOM 60 OG1 THR A 5 16.692 -4.943 3.441 1.00 0.00 O ATOM 61 CG2 THR A 5 15.374 -4.791 5.456 1.00 0.00 C ATOM 62 H THR A 5 16.456 -1.973 2.526 1.00 0.00 H ATOM 63 HA THR A 5 14.250 -3.809 3.196 1.00 0.00 H ATOM 64 HB THR A 5 16.799 -3.369 4.760 1.00 0.00 H ATOM 65 HG1 THR A 5 17.450 -4.519 3.031 1.00 0.00 H ATOM 66 HG21 THR A 5 15.571 -5.847 5.337 1.00 0.00 H ATOM 67 HG22 THR A 5 14.310 -4.618 5.421 1.00 0.00 H ATOM 68 HG23 THR A 5 15.763 -4.458 6.405 1.00 0.00 H ATOM 69 N GLY A 6 15.264 -1.299 5.110 1.00 0.00 N ATOM 70 CA GLY A 6 14.780 -0.273 6.024 1.00 0.00 C ATOM 71 C GLY A 6 13.804 0.670 5.347 1.00 0.00 C ATOM 72 O GLY A 6 12.751 0.993 5.900 1.00 0.00 O ATOM 73 H GLY A 6 16.224 -1.379 4.933 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.287 -0.750 6.858 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.621 0.297 6.390 1.00 0.00 H ATOM 76 N LYS A 7 14.157 1.091 4.136 1.00 0.00 N ATOM 77 CA LYS A 7 13.319 1.982 3.345 1.00 0.00 C ATOM 78 C LYS A 7 12.016 1.286 2.929 1.00 0.00 C ATOM 79 O LYS A 7 10.986 1.940 2.747 1.00 0.00 O ATOM 80 CB LYS A 7 14.091 2.453 2.105 1.00 0.00 C ATOM 81 CG LYS A 7 13.258 3.263 1.124 1.00 0.00 C ATOM 82 CD LYS A 7 12.665 4.508 1.773 1.00 0.00 C ATOM 83 CE LYS A 7 11.482 5.035 0.978 1.00 0.00 C ATOM 84 NZ LYS A 7 10.384 4.069 0.942 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.005 0.779 3.754 1.00 0.00 H ATOM 86 HA LYS A 7 13.077 2.838 3.955 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.922 3.064 2.426 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.475 1.588 1.587 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.888 3.566 0.301 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.456 2.642 0.754 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.335 4.261 2.771 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.425 5.273 1.823 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.132 5.948 1.437 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.803 5.240 -0.033 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.622 3.118 0.919 1.00 0.00 H ATOM 96 N ARG A 8 12.073 -0.040 2.776 1.00 0.00 N ATOM 97 CA ARG A 8 10.910 -0.830 2.374 1.00 0.00 C ATOM 98 C ARG A 8 9.788 -0.740 3.405 1.00 0.00 C ATOM 99 O ARG A 8 8.636 -0.497 3.054 1.00 0.00 O ATOM 100 CB ARG A 8 11.310 -2.298 2.189 1.00 0.00 C ATOM 101 CG ARG A 8 10.239 -3.151 1.530 1.00 0.00 C ATOM 102 CD ARG A 8 10.498 -4.638 1.740 1.00 0.00 C ATOM 103 NE ARG A 8 10.096 -5.082 3.078 1.00 0.00 N ATOM 104 CZ ARG A 8 8.825 -5.160 3.493 1.00 0.00 C ATOM 105 NH1 ARG A 8 7.822 -4.865 2.667 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 8.555 -5.552 4.735 1.00 0.00 N ATOM 107 H ARG A 8 12.923 -0.502 2.934 1.00 0.00 H ATOM 108 HA ARG A 8 10.551 -0.442 1.434 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.199 -2.340 1.578 1.00 0.00 H ATOM 110 HB3 ARG A 8 11.532 -2.723 3.157 1.00 0.00 H ATOM 111 HG2 ARG A 8 9.280 -2.899 1.955 1.00 0.00 H ATOM 112 HG3 ARG A 8 10.231 -2.944 0.470 1.00 0.00 H ATOM 113 HD2 ARG A 8 9.941 -5.197 1.004 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.554 -4.828 1.612 1.00 0.00 H ATOM 115 HE ARG A 8 10.808 -5.324 3.705 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.011 -4.583 1.727 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.876 -4.926 2.987 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.300 -5.789 5.359 1.00 0.00 H ATOM 119 HH22 ARG A 8 7.607 -5.608 5.048 1.00 0.00 H ATOM 120 N LYS A 9 10.132 -0.954 4.671 1.00 0.00 N ATOM 121 CA LYS A 9 9.148 -0.918 5.754 1.00 0.00 C ATOM 122 C LYS A 9 8.436 0.434 5.840 1.00 0.00 C ATOM 123 O LYS A 9 7.229 0.488 6.081 1.00 0.00 O ATOM 124 CB LYS A 9 9.817 -1.242 7.094 1.00 0.00 C ATOM 125 CG LYS A 9 8.830 -1.413 8.240 1.00 0.00 C ATOM 126 CD LYS A 9 9.530 -1.822 9.524 1.00 0.00 C ATOM 127 CE LYS A 9 8.537 -2.030 10.656 1.00 0.00 C ATOM 128 NZ LYS A 9 9.212 -2.444 11.918 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.069 -1.155 4.882 1.00 0.00 H ATOM 130 HA LYS A 9 8.410 -1.676 5.546 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.378 -2.157 6.992 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.493 -0.439 7.349 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.316 -0.478 8.406 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.113 -2.177 7.973 1.00 0.00 H ATOM 135 HD2 LYS A 9 10.063 -2.746 9.353 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.229 -1.047 9.806 1.00 0.00 H ATOM 137 HE2 LYS A 9 8.009 -1.105 10.829 1.00 0.00 H ATOM 138 HE3 LYS A 9 7.835 -2.797 10.364 1.00 0.00 H ATOM 139 HZ1 LYS A 9 9.826 -3.266 11.742 1.00 0.00 H ATOM 140 HZ2 LYS A 9 8.504 -2.702 12.633 1.00 0.00 H ATOM 141 HZ3 LYS A 9 9.793 -1.664 12.286 1.00 0.00 H ATOM 142 N SER A 10 9.188 1.519 5.660 1.00 0.00 N ATOM 143 CA SER A 10 8.623 2.867 5.738 1.00 0.00 C ATOM 144 C SER A 10 7.641 3.153 4.598 1.00 0.00 C ATOM 145 O SER A 10 6.514 3.587 4.839 1.00 0.00 O ATOM 146 CB SER A 10 9.744 3.912 5.736 1.00 0.00 C ATOM 147 OG SER A 10 9.220 5.224 5.861 1.00 0.00 O ATOM 148 H SER A 10 10.147 1.413 5.484 1.00 0.00 H ATOM 149 HA SER A 10 8.089 2.940 6.671 1.00 0.00 H ATOM 150 HB2 SER A 10 10.409 3.724 6.567 1.00 0.00 H ATOM 151 HB3 SER A 10 10.295 3.846 4.811 1.00 0.00 H ATOM 152 HG SER A 10 9.170 5.462 6.791 1.00 0.00 H ATOM 153 N ASP A 11 8.080 2.931 3.360 1.00 0.00 N ATOM 154 CA ASP A 11 7.246 3.193 2.182 1.00 0.00 C ATOM 155 C ASP A 11 6.129 2.162 2.003 1.00 0.00 C ATOM 156 O ASP A 11 4.983 2.530 1.745 1.00 0.00 O ATOM 157 CB ASP A 11 8.112 3.246 0.921 1.00 0.00 C ATOM 158 CG ASP A 11 9.096 4.401 0.949 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.700 5.567 0.987 1.00 0.00 O ATOM 160 H ASP A 11 8.993 2.601 3.233 1.00 0.00 H ATOM 161 HA ASP A 11 6.790 4.159 2.321 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.670 2.324 0.838 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.477 3.354 0.056 1.00 0.00 H ATOM 164 N ARG A 12 6.467 0.880 2.124 1.00 0.00 N ATOM 165 CA ARG A 12 5.485 -0.194 1.956 1.00 0.00 C ATOM 166 C ARG A 12 4.333 -0.043 2.949 1.00 0.00 C ATOM 167 O ARG A 12 3.164 -0.169 2.584 1.00 0.00 O ATOM 168 CB ARG A 12 6.152 -1.561 2.138 1.00 0.00 C ATOM 169 CG ARG A 12 5.389 -2.712 1.500 1.00 0.00 C ATOM 170 CD ARG A 12 5.568 -2.724 -0.012 1.00 0.00 C ATOM 171 NE ARG A 12 4.952 -3.898 -0.635 1.00 0.00 N ATOM 172 CZ ARG A 12 3.634 -4.105 -0.715 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.777 -3.198 -0.252 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.172 -5.219 -1.272 1.00 0.00 N ATOM 175 H ARG A 12 7.399 0.649 2.318 1.00 0.00 H ATOM 176 HA ARG A 12 5.090 -0.127 0.955 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.136 -1.526 1.698 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.247 -1.763 3.194 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.758 -3.643 1.904 1.00 0.00 H ATOM 180 HG3 ARG A 12 4.340 -2.607 1.730 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.114 -1.834 -0.422 1.00 0.00 H ATOM 182 HD3 ARG A 12 6.625 -2.723 -0.236 1.00 0.00 H ATOM 183 HE ARG A 12 5.555 -4.577 -1.004 1.00 0.00 H ATOM 184 HH11 ARG A 12 3.114 -2.352 0.160 1.00 0.00 H ATOM 185 HH12 ARG A 12 1.793 -3.362 -0.317 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.809 -5.902 -1.631 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.186 -5.377 -1.334 1.00 0.00 H ATOM 188 N LYS A 13 4.675 0.232 4.204 1.00 0.00 N ATOM 189 CA LYS A 13 3.670 0.406 5.250 1.00 0.00 C ATOM 190 C LYS A 13 2.891 1.706 5.053 1.00 0.00 C ATOM 191 O LYS A 13 1.674 1.740 5.246 1.00 0.00 O ATOM 192 CB LYS A 13 4.325 0.386 6.635 1.00 0.00 C ATOM 193 CG LYS A 13 3.333 0.503 7.785 1.00 0.00 C ATOM 194 CD LYS A 13 4.022 0.352 9.131 1.00 0.00 C ATOM 195 CE LYS A 13 3.029 0.432 10.280 1.00 0.00 C ATOM 196 NZ LYS A 13 3.685 0.225 11.604 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.624 0.324 4.430 1.00 0.00 H ATOM 198 HA LYS A 13 2.980 -0.420 5.180 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.866 -0.543 6.748 1.00 0.00 H ATOM 200 HB3 LYS A 13 5.022 1.207 6.703 1.00 0.00 H ATOM 201 HG2 LYS A 13 2.860 1.473 7.742 1.00 0.00 H ATOM 202 HG3 LYS A 13 2.586 -0.268 7.685 1.00 0.00 H ATOM 203 HD2 LYS A 13 4.520 -0.607 9.165 1.00 0.00 H ATOM 204 HD3 LYS A 13 4.750 1.142 9.242 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.563 1.407 10.268 1.00 0.00 H ATOM 206 HE3 LYS A 13 2.274 -0.327 10.139 1.00 0.00 H ATOM 207 HZ1 LYS A 13 4.190 1.088 11.893 1.00 0.00 H ATOM 208 HZ2 LYS A 13 4.367 -0.560 11.548 1.00 0.00 H ATOM 209 HZ3 LYS A 13 2.972 -0.004 12.326 1.00 0.00 H ATOM 210 N LYS A 14 3.597 2.773 4.668 1.00 0.00 N ATOM 211 CA LYS A 14 2.965 4.073 4.443 1.00 0.00 C ATOM 212 C LYS A 14 1.959 4.002 3.295 1.00 0.00 C ATOM 213 O LYS A 14 0.865 4.550 3.394 1.00 0.00 O ATOM 214 CB LYS A 14 4.020 5.148 4.151 1.00 0.00 C ATOM 215 CG LYS A 14 3.440 6.518 3.805 1.00 0.00 C ATOM 216 CD LYS A 14 3.161 7.374 5.042 1.00 0.00 C ATOM 217 CE LYS A 14 2.058 6.808 5.936 1.00 0.00 C ATOM 218 NZ LYS A 14 0.680 7.056 5.463 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.563 2.681 4.530 1.00 0.00 H ATOM 220 HA LYS A 14 2.437 4.336 5.343 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.650 5.260 5.021 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.627 4.820 3.321 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.147 7.041 3.178 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.519 6.377 3.262 1.00 0.00 H ATOM 225 HD2 LYS A 14 4.069 7.442 5.623 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.875 8.364 4.719 1.00 0.00 H ATOM 227 HE2 LYS A 14 2.201 5.746 6.021 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.166 7.250 6.917 1.00 0.00 H ATOM 229 HZ1 LYS A 14 -0.040 6.808 6.080 1.00 0.00 H ATOM 230 N LYS A 15 2.333 3.321 2.213 1.00 0.00 N ATOM 231 CA LYS A 15 1.454 3.174 1.051 1.00 0.00 C ATOM 232 C LYS A 15 0.161 2.441 1.414 1.00 0.00 C ATOM 233 O LYS A 15 -0.894 2.713 0.840 1.00 0.00 O ATOM 234 CB LYS A 15 2.173 2.438 -0.080 1.00 0.00 C ATOM 235 CG LYS A 15 3.196 3.295 -0.807 1.00 0.00 C ATOM 236 CD LYS A 15 3.881 2.521 -1.919 1.00 0.00 C ATOM 237 CE LYS A 15 4.882 3.394 -2.664 1.00 0.00 C ATOM 238 NZ LYS A 15 5.527 2.673 -3.799 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.219 2.901 2.196 1.00 0.00 H ATOM 240 HA LYS A 15 1.198 4.167 0.711 1.00 0.00 H ATOM 241 HB2 LYS A 15 2.685 1.579 0.332 1.00 0.00 H ATOM 242 HB3 LYS A 15 1.441 2.100 -0.798 1.00 0.00 H ATOM 243 HG2 LYS A 15 2.695 4.151 -1.234 1.00 0.00 H ATOM 244 HG3 LYS A 15 3.941 3.628 -0.099 1.00 0.00 H ATOM 245 HD2 LYS A 15 4.401 1.677 -1.489 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.132 2.170 -2.616 1.00 0.00 H ATOM 247 HE2 LYS A 15 4.366 4.262 -3.047 1.00 0.00 H ATOM 248 HE3 LYS A 15 5.646 3.711 -1.970 1.00 0.00 H ATOM 249 HZ1 LYS A 15 5.046 1.769 -3.974 1.00 0.00 H ATOM 250 HZ2 LYS A 15 6.526 2.484 -3.582 1.00 0.00 H ATOM 251 HZ3 LYS A 15 5.477 3.251 -4.662 1.00 0.00 H ATOM 252 N ASN A 16 0.247 1.509 2.364 1.00 0.00 N ATOM 253 CA ASN A 16 -0.919 0.743 2.798 1.00 0.00 C ATOM 254 C ASN A 16 -1.895 1.635 3.574 1.00 0.00 C ATOM 255 O ASN A 16 -3.105 1.588 3.350 1.00 0.00 O ATOM 256 CB ASN A 16 -0.478 -0.442 3.672 1.00 0.00 C ATOM 257 CG ASN A 16 -1.582 -1.462 3.943 1.00 0.00 C ATOM 258 OD1 ASN A 16 -1.405 -2.362 4.765 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.717 -1.355 3.247 1.00 0.00 N ATOM 260 H ASN A 16 1.115 1.333 2.784 1.00 0.00 H ATOM 261 HA ASN A 16 -1.414 0.367 1.917 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.334 -0.952 3.179 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.128 -0.062 4.621 1.00 0.00 H ATOM 264 HD21 ASN A 16 -2.800 -0.633 2.592 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.426 -2.008 3.422 1.00 0.00 H ATOM 266 N GLN A 17 -1.354 2.441 4.491 1.00 0.00 N ATOM 267 CA GLN A 17 -2.163 3.343 5.313 1.00 0.00 C ATOM 268 C GLN A 17 -2.546 4.617 4.555 1.00 0.00 C ATOM 269 O GLN A 17 -3.722 4.979 4.491 1.00 0.00 O ATOM 270 CB GLN A 17 -1.400 3.711 6.592 1.00 0.00 C ATOM 271 CG GLN A 17 -2.207 4.543 7.576 1.00 0.00 C ATOM 272 CD GLN A 17 -1.392 4.979 8.782 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.417 5.718 8.652 1.00 0.00 O ATOM 274 NE2 GLN A 17 -1.788 4.519 9.964 1.00 0.00 N ATOM 275 H GLN A 17 -0.382 2.424 4.621 1.00 0.00 H ATOM 276 HA GLN A 17 -3.065 2.821 5.585 1.00 0.00 H ATOM 277 HB2 GLN A 17 -1.098 2.801 7.089 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.517 4.270 6.321 1.00 0.00 H ATOM 279 HG2 GLN A 17 -2.568 5.425 7.070 1.00 0.00 H ATOM 280 HG3 GLN A 17 -3.046 3.958 7.920 1.00 0.00 H ATOM 281 HE21 GLN A 17 -2.572 3.933 9.997 1.00 0.00 H ATOM 282 HE22 GLN A 17 -1.276 4.784 10.757 1.00 0.00 H ATOM 283 N ASP A 18 -1.545 5.297 3.996 1.00 0.00 N ATOM 284 CA ASP A 18 -1.763 6.541 3.254 1.00 0.00 C ATOM 285 C ASP A 18 -1.158 6.471 1.847 1.00 0.00 C ATOM 286 O ASP A 18 -0.586 7.444 1.355 1.00 0.00 O ATOM 287 CB ASP A 18 -1.167 7.721 4.037 1.00 0.00 C ATOM 288 CG ASP A 18 0.330 7.578 4.277 1.00 0.00 C ATOM 289 OD1 ASP A 18 1.133 7.919 3.412 1.00 0.00 O ATOM 290 H ASP A 18 -0.631 4.957 4.093 1.00 0.00 H ATOM 291 HA ASP A 18 -2.829 6.687 3.163 1.00 0.00 H ATOM 292 HB2 ASP A 18 -1.335 8.631 3.481 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.662 7.795 4.994 1.00 0.00 H HETATM 294 N NH2 A 19 -1.294 5.324 1.192 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.760 4.586 1.638 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -0.922 5.261 0.288 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 11 ATOM 1 N PHE A 1 16.942 -12.034 3.291 1.00 0.00 N ATOM 2 CA PHE A 1 15.518 -12.221 3.025 1.00 0.00 C ATOM 3 C PHE A 1 14.851 -10.899 2.639 1.00 0.00 C ATOM 4 O PHE A 1 13.995 -10.867 1.752 1.00 0.00 O ATOM 5 CB PHE A 1 14.816 -12.822 4.247 1.00 0.00 C ATOM 6 CG PHE A 1 13.366 -13.150 4.012 1.00 0.00 C ATOM 7 CD1 PHE A 1 12.980 -13.901 2.910 1.00 0.00 C ATOM 8 CD2 PHE A 1 12.388 -12.706 4.889 1.00 0.00 C ATOM 9 CE1 PHE A 1 11.649 -14.204 2.691 1.00 0.00 C ATOM 10 CE2 PHE A 1 11.055 -13.006 4.673 1.00 0.00 C ATOM 11 CZ PHE A 1 10.686 -13.755 3.573 1.00 0.00 C ATOM 12 H1 PHE A 1 17.223 -11.660 4.153 1.00 0.00 H ATOM 13 HA PHE A 1 15.428 -12.907 2.197 1.00 0.00 H ATOM 14 HB2 PHE A 1 15.320 -13.734 4.530 1.00 0.00 H ATOM 15 HB3 PHE A 1 14.870 -12.117 5.066 1.00 0.00 H ATOM 16 HD1 PHE A 1 13.731 -14.253 2.219 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.674 -12.121 5.749 1.00 0.00 H ATOM 18 HE1 PHE A 1 11.363 -14.789 1.829 1.00 0.00 H ATOM 19 HE2 PHE A 1 10.303 -12.655 5.364 1.00 0.00 H ATOM 20 HZ PHE A 1 9.646 -13.989 3.401 1.00 0.00 H ATOM 21 N GLY A 2 15.244 -9.815 3.316 1.00 0.00 N ATOM 22 CA GLY A 2 14.675 -8.504 3.039 1.00 0.00 C ATOM 23 C GLY A 2 14.741 -8.130 1.568 1.00 0.00 C ATOM 24 O GLY A 2 15.755 -8.364 0.908 1.00 0.00 O ATOM 25 H GLY A 2 15.927 -9.906 4.014 1.00 0.00 H ATOM 26 HA2 GLY A 2 13.642 -8.502 3.353 1.00 0.00 H ATOM 27 HA3 GLY A 2 15.214 -7.765 3.613 1.00 0.00 H ATOM 28 N GLY A 3 13.651 -7.551 1.057 1.00 0.00 N ATOM 29 CA GLY A 3 13.591 -7.154 -0.342 1.00 0.00 C ATOM 30 C GLY A 3 14.719 -6.222 -0.744 1.00 0.00 C ATOM 31 O GLY A 3 15.359 -6.425 -1.779 1.00 0.00 O ATOM 32 H GLY A 3 12.875 -7.398 1.637 1.00 0.00 H ATOM 33 HA2 GLY A 3 13.638 -8.041 -0.957 1.00 0.00 H ATOM 34 HA3 GLY A 3 12.649 -6.658 -0.520 1.00 0.00 H ATOM 35 N PHE A 4 14.964 -5.199 0.075 1.00 0.00 N ATOM 36 CA PHE A 4 16.022 -4.229 -0.198 1.00 0.00 C ATOM 37 C PHE A 4 16.299 -3.390 1.049 1.00 0.00 C ATOM 38 O PHE A 4 16.044 -3.841 2.169 1.00 0.00 O ATOM 39 CB PHE A 4 15.616 -3.352 -1.399 1.00 0.00 C ATOM 40 CG PHE A 4 16.773 -2.776 -2.178 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.015 -3.396 -2.178 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.608 -1.618 -2.922 1.00 0.00 C ATOM 43 CE1 PHE A 4 19.067 -2.870 -2.904 1.00 0.00 C ATOM 44 CE2 PHE A 4 17.659 -1.088 -3.648 1.00 0.00 C ATOM 45 CZ PHE A 4 18.888 -1.715 -3.639 1.00 0.00 C ATOM 46 H PHE A 4 14.420 -5.093 0.884 1.00 0.00 H ATOM 47 HA PHE A 4 16.919 -4.768 -0.443 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.027 -3.946 -2.081 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.014 -2.529 -1.041 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.158 -4.298 -1.603 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.647 -1.126 -2.931 1.00 0.00 H ATOM 52 HE1 PHE A 4 20.028 -3.360 -2.894 1.00 0.00 H ATOM 53 HE2 PHE A 4 17.517 -0.185 -4.222 1.00 0.00 H ATOM 54 HZ PHE A 4 19.709 -1.304 -4.206 1.00 0.00 H ATOM 55 N THR A 5 16.829 -2.186 0.862 1.00 0.00 N ATOM 56 CA THR A 5 17.146 -1.303 1.982 1.00 0.00 C ATOM 57 C THR A 5 15.953 -1.155 2.929 1.00 0.00 C ATOM 58 O THR A 5 14.800 -1.120 2.491 1.00 0.00 O ATOM 59 CB THR A 5 17.587 0.093 1.491 1.00 0.00 C ATOM 60 OG1 THR A 5 18.649 -0.035 0.535 1.00 0.00 O ATOM 61 CG2 THR A 5 18.062 0.955 2.652 1.00 0.00 C ATOM 62 H THR A 5 17.022 -1.887 -0.045 1.00 0.00 H ATOM 63 HA THR A 5 17.970 -1.744 2.526 1.00 0.00 H ATOM 64 HB THR A 5 16.744 0.579 1.021 1.00 0.00 H ATOM 65 HG1 THR A 5 18.282 -0.071 -0.352 1.00 0.00 H ATOM 66 HG21 THR A 5 18.566 0.334 3.379 1.00 0.00 H ATOM 67 HG22 THR A 5 17.214 1.435 3.116 1.00 0.00 H ATOM 68 HG23 THR A 5 18.744 1.707 2.285 1.00 0.00 H ATOM 69 N GLY A 6 16.252 -1.078 4.230 1.00 0.00 N ATOM 70 CA GLY A 6 15.221 -0.942 5.258 1.00 0.00 C ATOM 71 C GLY A 6 14.131 0.068 4.909 1.00 0.00 C ATOM 72 O GLY A 6 12.991 -0.081 5.345 1.00 0.00 O ATOM 73 H GLY A 6 17.193 -1.124 4.497 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.760 -1.905 5.414 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.695 -0.635 6.181 1.00 0.00 H ATOM 76 N LYS A 7 14.489 1.088 4.119 1.00 0.00 N ATOM 77 CA LYS A 7 13.549 2.130 3.686 1.00 0.00 C ATOM 78 C LYS A 7 12.194 1.549 3.257 1.00 0.00 C ATOM 79 O LYS A 7 11.151 2.158 3.494 1.00 0.00 O ATOM 80 CB LYS A 7 14.176 2.926 2.529 1.00 0.00 C ATOM 81 CG LYS A 7 13.172 3.647 1.635 1.00 0.00 C ATOM 82 CD LYS A 7 12.421 4.745 2.375 1.00 0.00 C ATOM 83 CE LYS A 7 11.197 5.202 1.592 1.00 0.00 C ATOM 84 NZ LYS A 7 10.161 4.168 1.538 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.416 1.140 3.811 1.00 0.00 H ATOM 86 HA LYS A 7 13.391 2.798 4.519 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.849 3.665 2.940 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.746 2.245 1.911 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.705 4.093 0.808 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.462 2.927 1.258 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.102 4.369 3.336 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.082 5.588 2.515 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.788 6.081 2.068 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.501 5.447 0.585 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.456 3.233 1.512 1.00 0.00 H ATOM 96 N ARG A 8 12.222 0.375 2.620 1.00 0.00 N ATOM 97 CA ARG A 8 11.001 -0.283 2.149 1.00 0.00 C ATOM 98 C ARG A 8 9.980 -0.459 3.275 1.00 0.00 C ATOM 99 O ARG A 8 8.780 -0.429 3.027 1.00 0.00 O ATOM 100 CB ARG A 8 11.332 -1.647 1.521 1.00 0.00 C ATOM 101 CG ARG A 8 11.830 -2.694 2.513 1.00 0.00 C ATOM 102 CD ARG A 8 10.676 -3.404 3.216 1.00 0.00 C ATOM 103 NE ARG A 8 11.125 -4.212 4.353 1.00 0.00 N ATOM 104 CZ ARG A 8 10.308 -4.939 5.122 1.00 0.00 C ATOM 105 NH1 ARG A 8 9.000 -4.972 4.876 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.800 -5.632 6.145 1.00 0.00 N ATOM 107 H ARG A 8 13.083 -0.057 2.459 1.00 0.00 H ATOM 108 HA ARG A 8 10.565 0.349 1.391 1.00 0.00 H ATOM 109 HB2 ARG A 8 10.442 -2.033 1.044 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.096 -1.505 0.769 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.417 -3.427 1.982 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.445 -2.206 3.254 1.00 0.00 H ATOM 113 HD2 ARG A 8 9.975 -2.666 3.570 1.00 0.00 H ATOM 114 HD3 ARG A 8 10.183 -4.049 2.504 1.00 0.00 H ATOM 115 HE ARG A 8 12.083 -4.212 4.558 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.619 -4.450 4.111 1.00 0.00 H ATOM 117 HH12 ARG A 8 8.396 -5.518 5.455 1.00 0.00 H ATOM 118 HH21 ARG A 8 11.782 -5.611 6.337 1.00 0.00 H ATOM 119 HH22 ARG A 8 10.190 -6.178 6.719 1.00 0.00 H ATOM 120 N LYS A 9 10.464 -0.664 4.504 1.00 0.00 N ATOM 121 CA LYS A 9 9.581 -0.868 5.656 1.00 0.00 C ATOM 122 C LYS A 9 8.691 0.351 5.912 1.00 0.00 C ATOM 123 O LYS A 9 7.467 0.223 6.005 1.00 0.00 O ATOM 124 CB LYS A 9 10.401 -1.191 6.912 1.00 0.00 C ATOM 125 CG LYS A 9 9.548 -1.488 8.140 1.00 0.00 C ATOM 126 CD LYS A 9 10.396 -1.834 9.357 1.00 0.00 C ATOM 127 CE LYS A 9 11.180 -3.122 9.152 1.00 0.00 C ATOM 128 NZ LYS A 9 11.960 -3.502 10.362 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.436 -0.692 4.634 1.00 0.00 H ATOM 130 HA LYS A 9 8.946 -1.711 5.434 1.00 0.00 H ATOM 131 HB2 LYS A 9 11.019 -2.053 6.711 1.00 0.00 H ATOM 132 HB3 LYS A 9 11.037 -0.347 7.138 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.950 -0.619 8.369 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.899 -2.324 7.918 1.00 0.00 H ATOM 135 HD2 LYS A 9 11.091 -1.028 9.540 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.748 -1.950 10.213 1.00 0.00 H ATOM 137 HE2 LYS A 9 10.487 -3.916 8.918 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.861 -2.985 8.324 1.00 0.00 H ATOM 139 HZ1 LYS A 9 11.374 -3.391 11.215 1.00 0.00 H ATOM 140 HZ2 LYS A 9 12.799 -2.896 10.452 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.269 -4.493 10.292 1.00 0.00 H ATOM 142 N SER A 10 9.310 1.527 6.026 1.00 0.00 N ATOM 143 CA SER A 10 8.572 2.768 6.277 1.00 0.00 C ATOM 144 C SER A 10 7.552 3.039 5.170 1.00 0.00 C ATOM 145 O SER A 10 6.403 3.386 5.448 1.00 0.00 O ATOM 146 CB SER A 10 9.535 3.955 6.410 1.00 0.00 C ATOM 147 OG SER A 10 10.296 4.140 5.228 1.00 0.00 O ATOM 148 H SER A 10 10.285 1.559 5.944 1.00 0.00 H ATOM 149 HA SER A 10 8.040 2.647 7.208 1.00 0.00 H ATOM 150 HB2 SER A 10 8.971 4.855 6.601 1.00 0.00 H ATOM 151 HB3 SER A 10 10.211 3.774 7.233 1.00 0.00 H ATOM 152 HG SER A 10 11.049 3.545 5.233 1.00 0.00 H ATOM 153 N ASP A 11 7.979 2.874 3.920 1.00 0.00 N ATOM 154 CA ASP A 11 7.102 3.095 2.773 1.00 0.00 C ATOM 155 C ASP A 11 6.061 1.978 2.645 1.00 0.00 C ATOM 156 O ASP A 11 4.934 2.227 2.219 1.00 0.00 O ATOM 157 CB ASP A 11 7.926 3.225 1.490 1.00 0.00 C ATOM 158 CG ASP A 11 8.855 4.428 1.534 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.400 5.573 1.582 1.00 0.00 O ATOM 160 H ASP A 11 8.906 2.592 3.766 1.00 0.00 H ATOM 161 HA ASP A 11 6.579 4.025 2.943 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.522 2.334 1.356 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.258 3.339 0.649 1.00 0.00 H ATOM 164 N ARG A 12 6.442 0.753 3.026 1.00 0.00 N ATOM 165 CA ARG A 12 5.538 -0.399 2.964 1.00 0.00 C ATOM 166 C ARG A 12 4.245 -0.105 3.728 1.00 0.00 C ATOM 167 O ARG A 12 3.146 -0.278 3.199 1.00 0.00 O ATOM 168 CB ARG A 12 6.231 -1.645 3.548 1.00 0.00 C ATOM 169 CG ARG A 12 5.384 -2.915 3.537 1.00 0.00 C ATOM 170 CD ARG A 12 5.284 -3.529 2.144 1.00 0.00 C ATOM 171 NE ARG A 12 4.595 -2.658 1.190 1.00 0.00 N ATOM 172 CZ ARG A 12 3.293 -2.360 1.240 1.00 0.00 C ATOM 173 NH1 ARG A 12 2.505 -2.896 2.169 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 2.776 -1.526 0.345 1.00 0.00 N ATOM 175 H ARG A 12 7.352 0.624 3.363 1.00 0.00 H ATOM 176 HA ARG A 12 5.299 -0.579 1.930 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.124 -1.839 2.976 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.511 -1.437 4.571 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.837 -3.638 4.200 1.00 0.00 H ATOM 180 HG3 ARG A 12 4.392 -2.677 3.889 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.282 -3.723 1.780 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.745 -4.463 2.218 1.00 0.00 H ATOM 183 HE ARG A 12 5.137 -2.261 0.476 1.00 0.00 H ATOM 184 HH11 ARG A 12 2.882 -3.532 2.841 1.00 0.00 H ATOM 185 HH12 ARG A 12 1.532 -2.661 2.197 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.361 -1.127 -0.361 1.00 0.00 H ATOM 187 HH22 ARG A 12 1.802 -1.293 0.377 1.00 0.00 H ATOM 188 N LYS A 13 4.388 0.359 4.968 1.00 0.00 N ATOM 189 CA LYS A 13 3.234 0.695 5.801 1.00 0.00 C ATOM 190 C LYS A 13 2.528 1.958 5.296 1.00 0.00 C ATOM 191 O LYS A 13 1.302 2.055 5.365 1.00 0.00 O ATOM 192 CB LYS A 13 3.650 0.872 7.267 1.00 0.00 C ATOM 193 CG LYS A 13 4.737 1.915 7.485 1.00 0.00 C ATOM 194 CD LYS A 13 5.009 2.151 8.965 1.00 0.00 C ATOM 195 CE LYS A 13 3.760 2.617 9.705 1.00 0.00 C ATOM 196 NZ LYS A 13 3.172 3.844 9.095 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.291 0.487 5.327 1.00 0.00 H ATOM 198 HA LYS A 13 2.540 -0.130 5.737 1.00 0.00 H ATOM 199 HB2 LYS A 13 2.781 1.167 7.838 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.009 -0.075 7.642 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.647 1.573 7.016 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.427 2.845 7.032 1.00 0.00 H ATOM 203 HD2 LYS A 13 5.350 1.228 9.409 1.00 0.00 H ATOM 204 HD3 LYS A 13 5.776 2.904 9.064 1.00 0.00 H ATOM 205 HE2 LYS A 13 3.025 1.828 9.680 1.00 0.00 H ATOM 206 HE3 LYS A 13 4.025 2.829 10.732 1.00 0.00 H ATOM 207 HZ1 LYS A 13 3.902 4.579 8.996 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.407 4.210 9.696 1.00 0.00 H ATOM 209 HZ3 LYS A 13 2.783 3.627 8.154 1.00 0.00 H ATOM 210 N LYS A 14 3.308 2.925 4.799 1.00 0.00 N ATOM 211 CA LYS A 14 2.753 4.182 4.292 1.00 0.00 C ATOM 212 C LYS A 14 1.857 3.947 3.081 1.00 0.00 C ATOM 213 O LYS A 14 0.723 4.421 3.044 1.00 0.00 O ATOM 214 CB LYS A 14 3.878 5.156 3.923 1.00 0.00 C ATOM 215 CG LYS A 14 3.396 6.542 3.505 1.00 0.00 C ATOM 216 CD LYS A 14 3.548 6.782 2.004 1.00 0.00 C ATOM 217 CE LYS A 14 2.345 6.290 1.204 1.00 0.00 C ATOM 218 NZ LYS A 14 1.090 6.891 1.660 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.279 2.791 4.778 1.00 0.00 H ATOM 220 HA LYS A 14 2.157 4.617 5.081 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.529 5.272 4.777 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.447 4.735 3.106 1.00 0.00 H ATOM 223 HG2 LYS A 14 2.353 6.639 3.767 1.00 0.00 H ATOM 224 HG3 LYS A 14 3.971 7.285 4.037 1.00 0.00 H ATOM 225 HD2 LYS A 14 3.668 7.840 1.832 1.00 0.00 H ATOM 226 HD3 LYS A 14 4.430 6.262 1.659 1.00 0.00 H ATOM 227 HE2 LYS A 14 2.494 6.550 0.166 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.280 5.221 1.295 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.150 7.622 2.309 1.00 0.00 H ATOM 230 N LYS A 15 2.369 3.217 2.090 1.00 0.00 N ATOM 231 CA LYS A 15 1.606 2.928 0.875 1.00 0.00 C ATOM 232 C LYS A 15 0.251 2.320 1.229 1.00 0.00 C ATOM 233 O LYS A 15 -0.749 2.572 0.554 1.00 0.00 O ATOM 234 CB LYS A 15 2.390 1.988 -0.046 1.00 0.00 C ATOM 235 CG LYS A 15 1.708 1.741 -1.385 1.00 0.00 C ATOM 236 CD LYS A 15 2.494 0.761 -2.244 1.00 0.00 C ATOM 237 CE LYS A 15 1.805 0.506 -3.576 1.00 0.00 C ATOM 238 NZ LYS A 15 2.563 -0.460 -4.422 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.279 2.866 2.179 1.00 0.00 H ATOM 240 HA LYS A 15 1.439 3.865 0.364 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.362 2.419 -0.237 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.516 1.037 0.450 1.00 0.00 H ATOM 243 HG2 LYS A 15 0.723 1.339 -1.207 1.00 0.00 H ATOM 244 HG3 LYS A 15 1.625 2.682 -1.912 1.00 0.00 H ATOM 245 HD2 LYS A 15 3.476 1.167 -2.433 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.584 -0.174 -1.714 1.00 0.00 H ATOM 247 HE2 LYS A 15 0.821 0.106 -3.385 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.715 1.443 -4.106 1.00 0.00 H ATOM 249 HZ1 LYS A 15 3.500 -0.071 -4.657 1.00 0.00 H ATOM 250 HZ2 LYS A 15 2.046 -0.643 -5.305 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.688 -1.360 -3.915 1.00 0.00 H ATOM 252 N ASN A 16 0.231 1.527 2.297 1.00 0.00 N ATOM 253 CA ASN A 16 -0.989 0.884 2.761 1.00 0.00 C ATOM 254 C ASN A 16 -1.909 1.876 3.485 1.00 0.00 C ATOM 255 O ASN A 16 -3.127 1.850 3.290 1.00 0.00 O ATOM 256 CB ASN A 16 -0.636 -0.291 3.683 1.00 0.00 C ATOM 257 CG ASN A 16 -1.851 -1.093 4.113 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.741 -0.580 4.792 1.00 0.00 O ATOM 259 ND2 ASN A 16 -1.896 -2.363 3.719 1.00 0.00 N ATOM 260 H ASN A 16 1.064 1.375 2.793 1.00 0.00 H ATOM 261 HA ASN A 16 -1.507 0.503 1.896 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.042 -0.954 3.164 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.148 0.090 4.567 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.153 -2.710 3.180 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.673 -2.900 3.981 1.00 0.00 H ATOM 266 N GLN A 17 -1.330 2.731 4.336 1.00 0.00 N ATOM 267 CA GLN A 17 -2.117 3.703 5.103 1.00 0.00 C ATOM 268 C GLN A 17 -2.702 4.816 4.223 1.00 0.00 C ATOM 269 O GLN A 17 -3.862 5.189 4.399 1.00 0.00 O ATOM 270 CB GLN A 17 -1.296 4.270 6.280 1.00 0.00 C ATOM 271 CG GLN A 17 -0.236 5.304 5.919 1.00 0.00 C ATOM 272 CD GLN A 17 -0.792 6.713 5.805 1.00 0.00 C ATOM 273 OE1 GLN A 17 -1.526 7.176 6.678 1.00 0.00 O ATOM 274 NE2 GLN A 17 -0.420 7.415 4.743 1.00 0.00 N ATOM 275 H GLN A 17 -0.359 2.694 4.464 1.00 0.00 H ATOM 276 HA GLN A 17 -2.950 3.157 5.517 1.00 0.00 H ATOM 277 HB2 GLN A 17 -1.976 4.729 6.982 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.798 3.447 6.771 1.00 0.00 H ATOM 279 HG2 GLN A 17 0.525 5.299 6.685 1.00 0.00 H ATOM 280 HG3 GLN A 17 0.207 5.031 4.976 1.00 0.00 H ATOM 281 HE21 GLN A 17 0.185 6.993 4.099 1.00 0.00 H ATOM 282 HE22 GLN A 17 -0.763 8.327 4.649 1.00 0.00 H ATOM 283 N ASP A 18 -1.922 5.334 3.268 1.00 0.00 N ATOM 284 CA ASP A 18 -2.425 6.389 2.377 1.00 0.00 C ATOM 285 C ASP A 18 -3.253 5.802 1.229 1.00 0.00 C ATOM 286 O ASP A 18 -4.249 6.391 0.810 1.00 0.00 O ATOM 287 CB ASP A 18 -1.294 7.279 1.826 1.00 0.00 C ATOM 288 CG ASP A 18 -0.119 6.512 1.236 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.294 5.618 0.406 1.00 0.00 O ATOM 290 H ASP A 18 -1.010 4.996 3.153 1.00 0.00 H ATOM 291 HA ASP A 18 -3.081 7.009 2.971 1.00 0.00 H ATOM 292 HB2 ASP A 18 -1.696 7.912 1.052 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.923 7.902 2.625 1.00 0.00 H HETATM 294 N NH2 A 19 -2.856 4.635 0.728 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -2.053 4.216 1.104 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.382 4.242 0.001 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 12 ATOM 1 N PHE A 1 17.452 2.270 11.489 1.00 0.00 N ATOM 2 CA PHE A 1 17.068 1.065 10.763 1.00 0.00 C ATOM 3 C PHE A 1 18.177 0.012 10.825 1.00 0.00 C ATOM 4 O PHE A 1 19.337 0.338 11.098 1.00 0.00 O ATOM 5 CB PHE A 1 16.710 1.406 9.307 1.00 0.00 C ATOM 6 CG PHE A 1 17.867 1.884 8.470 1.00 0.00 C ATOM 7 CD1 PHE A 1 18.769 0.984 7.923 1.00 0.00 C ATOM 8 CD2 PHE A 1 18.040 3.235 8.215 1.00 0.00 C ATOM 9 CE1 PHE A 1 19.823 1.423 7.144 1.00 0.00 C ATOM 10 CE2 PHE A 1 19.090 3.679 7.435 1.00 0.00 C ATOM 11 CZ PHE A 1 19.984 2.773 6.900 1.00 0.00 C ATOM 12 H1 PHE A 1 18.013 2.941 11.044 1.00 0.00 H ATOM 13 HA PHE A 1 16.191 0.664 11.250 1.00 0.00 H ATOM 14 HB2 PHE A 1 16.302 0.529 8.832 1.00 0.00 H ATOM 15 HB3 PHE A 1 15.960 2.186 9.308 1.00 0.00 H ATOM 16 HD1 PHE A 1 18.644 -0.072 8.112 1.00 0.00 H ATOM 17 HD2 PHE A 1 17.345 3.946 8.634 1.00 0.00 H ATOM 18 HE1 PHE A 1 20.520 0.711 6.725 1.00 0.00 H ATOM 19 HE2 PHE A 1 19.213 4.736 7.244 1.00 0.00 H ATOM 20 HZ PHE A 1 20.804 3.118 6.289 1.00 0.00 H ATOM 21 N GLY A 2 17.809 -1.252 10.589 1.00 0.00 N ATOM 22 CA GLY A 2 18.776 -2.342 10.632 1.00 0.00 C ATOM 23 C GLY A 2 19.824 -2.258 9.531 1.00 0.00 C ATOM 24 O GLY A 2 20.329 -1.179 9.228 1.00 0.00 O ATOM 25 H GLY A 2 16.868 -1.446 10.389 1.00 0.00 H ATOM 26 HA2 GLY A 2 19.277 -2.323 11.589 1.00 0.00 H ATOM 27 HA3 GLY A 2 18.247 -3.278 10.538 1.00 0.00 H ATOM 28 N GLY A 3 20.156 -3.403 8.930 1.00 0.00 N ATOM 29 CA GLY A 3 21.148 -3.423 7.864 1.00 0.00 C ATOM 30 C GLY A 3 20.609 -2.864 6.562 1.00 0.00 C ATOM 31 O GLY A 3 21.147 -1.896 6.021 1.00 0.00 O ATOM 32 H GLY A 3 19.725 -4.240 9.211 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.004 -2.838 8.167 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.463 -4.443 7.699 1.00 0.00 H ATOM 35 N PHE A 4 19.535 -3.477 6.070 1.00 0.00 N ATOM 36 CA PHE A 4 18.892 -3.056 4.828 1.00 0.00 C ATOM 37 C PHE A 4 17.515 -3.705 4.693 1.00 0.00 C ATOM 38 O PHE A 4 17.399 -4.929 4.631 1.00 0.00 O ATOM 39 CB PHE A 4 19.780 -3.385 3.615 1.00 0.00 C ATOM 40 CG PHE A 4 20.419 -4.750 3.655 1.00 0.00 C ATOM 41 CD1 PHE A 4 19.713 -5.890 3.294 1.00 0.00 C ATOM 42 CD2 PHE A 4 21.737 -4.889 4.063 1.00 0.00 C ATOM 43 CE1 PHE A 4 20.313 -7.136 3.335 1.00 0.00 C ATOM 44 CE2 PHE A 4 22.339 -6.131 4.107 1.00 0.00 C ATOM 45 CZ PHE A 4 21.627 -7.256 3.744 1.00 0.00 C ATOM 46 H PHE A 4 19.161 -4.237 6.562 1.00 0.00 H ATOM 47 HA PHE A 4 18.763 -1.982 4.881 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.180 -3.329 2.719 1.00 0.00 H ATOM 49 HB3 PHE A 4 20.572 -2.652 3.556 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.686 -5.800 2.973 1.00 0.00 H ATOM 51 HD2 PHE A 4 22.296 -4.011 4.350 1.00 0.00 H ATOM 52 HE1 PHE A 4 19.754 -8.016 3.052 1.00 0.00 H ATOM 53 HE2 PHE A 4 23.367 -6.221 4.427 1.00 0.00 H ATOM 54 HZ PHE A 4 22.098 -8.228 3.776 1.00 0.00 H ATOM 55 N THR A 5 16.477 -2.864 4.662 1.00 0.00 N ATOM 56 CA THR A 5 15.085 -3.323 4.549 1.00 0.00 C ATOM 57 C THR A 5 14.106 -2.197 4.891 1.00 0.00 C ATOM 58 O THR A 5 13.001 -2.141 4.343 1.00 0.00 O ATOM 59 CB THR A 5 14.780 -4.540 5.462 1.00 0.00 C ATOM 60 OG1 THR A 5 13.419 -4.957 5.294 1.00 0.00 O ATOM 61 CG2 THR A 5 15.030 -4.214 6.929 1.00 0.00 C ATOM 62 H THR A 5 16.652 -1.902 4.726 1.00 0.00 H ATOM 63 HA THR A 5 14.920 -3.623 3.523 1.00 0.00 H ATOM 64 HB THR A 5 15.429 -5.356 5.178 1.00 0.00 H ATOM 65 HG1 THR A 5 12.832 -4.311 5.697 1.00 0.00 H ATOM 66 HG21 THR A 5 16.018 -3.797 7.043 1.00 0.00 H ATOM 67 HG22 THR A 5 14.947 -5.117 7.516 1.00 0.00 H ATOM 68 HG23 THR A 5 14.296 -3.497 7.266 1.00 0.00 H ATOM 69 N GLY A 6 14.518 -1.314 5.813 1.00 0.00 N ATOM 70 CA GLY A 6 13.678 -0.201 6.238 1.00 0.00 C ATOM 71 C GLY A 6 12.970 0.485 5.084 1.00 0.00 C ATOM 72 O GLY A 6 11.792 0.816 5.196 1.00 0.00 O ATOM 73 H GLY A 6 15.402 -1.426 6.218 1.00 0.00 H ATOM 74 HA2 GLY A 6 12.934 -0.572 6.927 1.00 0.00 H ATOM 75 HA3 GLY A 6 14.295 0.523 6.750 1.00 0.00 H ATOM 76 N LYS A 7 13.679 0.687 3.971 1.00 0.00 N ATOM 77 CA LYS A 7 13.094 1.323 2.788 1.00 0.00 C ATOM 78 C LYS A 7 11.823 0.588 2.353 1.00 0.00 C ATOM 79 O LYS A 7 10.760 1.191 2.229 1.00 0.00 O ATOM 80 CB LYS A 7 14.117 1.337 1.642 1.00 0.00 C ATOM 81 CG LYS A 7 13.566 1.769 0.282 1.00 0.00 C ATOM 82 CD LYS A 7 13.491 3.288 0.124 1.00 0.00 C ATOM 83 CE LYS A 7 12.431 3.922 1.014 1.00 0.00 C ATOM 84 NZ LYS A 7 11.125 3.290 0.850 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.615 0.391 3.939 1.00 0.00 H ATOM 86 HA LYS A 7 12.838 2.340 3.047 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.917 2.010 1.904 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.524 0.342 1.537 1.00 0.00 H ATOM 89 HG2 LYS A 7 14.212 1.378 -0.489 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.575 1.355 0.161 1.00 0.00 H ATOM 91 HD2 LYS A 7 14.451 3.708 0.379 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.261 3.518 -0.907 1.00 0.00 H ATOM 93 HE2 LYS A 7 12.741 3.827 2.045 1.00 0.00 H ATOM 94 HE3 LYS A 7 12.347 4.969 0.760 1.00 0.00 H ATOM 95 HZ1 LYS A 7 11.112 2.336 0.638 1.00 0.00 H ATOM 96 N ARG A 8 11.939 -0.719 2.130 1.00 0.00 N ATOM 97 CA ARG A 8 10.798 -1.531 1.709 1.00 0.00 C ATOM 98 C ARG A 8 9.666 -1.447 2.727 1.00 0.00 C ATOM 99 O ARG A 8 8.493 -1.419 2.361 1.00 0.00 O ATOM 100 CB ARG A 8 11.218 -2.993 1.529 1.00 0.00 C ATOM 101 CG ARG A 8 10.234 -3.823 0.714 1.00 0.00 C ATOM 102 CD ARG A 8 10.629 -3.887 -0.756 1.00 0.00 C ATOM 103 NE ARG A 8 11.916 -4.566 -0.951 1.00 0.00 N ATOM 104 CZ ARG A 8 12.524 -4.696 -2.134 1.00 0.00 C ATOM 105 NH1 ARG A 8 11.976 -4.192 -3.236 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 13.689 -5.333 -2.214 1.00 0.00 N ATOM 107 H ARG A 8 12.813 -1.147 2.254 1.00 0.00 H ATOM 108 HA ARG A 8 10.446 -1.142 0.765 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.176 -3.021 1.035 1.00 0.00 H ATOM 110 HB3 ARG A 8 11.314 -3.447 2.506 1.00 0.00 H ATOM 111 HG2 ARG A 8 10.209 -4.826 1.112 1.00 0.00 H ATOM 112 HG3 ARG A 8 9.252 -3.378 0.794 1.00 0.00 H ATOM 113 HD2 ARG A 8 9.865 -4.423 -1.299 1.00 0.00 H ATOM 114 HD3 ARG A 8 10.702 -2.879 -1.142 1.00 0.00 H ATOM 115 HE ARG A 8 12.346 -4.947 -0.158 1.00 0.00 H ATOM 116 HH11 ARG A 8 11.101 -3.713 -3.186 1.00 0.00 H ATOM 117 HH12 ARG A 8 12.441 -4.292 -4.116 1.00 0.00 H ATOM 118 HH21 ARG A 8 14.108 -5.715 -1.391 1.00 0.00 H ATOM 119 HH22 ARG A 8 14.146 -5.429 -3.098 1.00 0.00 H ATOM 120 N LYS A 9 10.025 -1.422 4.004 1.00 0.00 N ATOM 121 CA LYS A 9 9.030 -1.357 5.072 1.00 0.00 C ATOM 122 C LYS A 9 8.378 0.019 5.174 1.00 0.00 C ATOM 123 O LYS A 9 7.169 0.144 5.018 1.00 0.00 O ATOM 124 CB LYS A 9 9.653 -1.730 6.419 1.00 0.00 C ATOM 125 CG LYS A 9 10.091 -3.183 6.504 1.00 0.00 C ATOM 126 CD LYS A 9 10.511 -3.568 7.917 1.00 0.00 C ATOM 127 CE LYS A 9 9.368 -3.402 8.911 1.00 0.00 C ATOM 128 NZ LYS A 9 9.669 -4.040 10.222 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.977 -1.455 4.234 1.00 0.00 H ATOM 130 HA LYS A 9 8.263 -2.077 4.840 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.518 -1.105 6.591 1.00 0.00 H ATOM 132 HB3 LYS A 9 8.928 -1.548 7.199 1.00 0.00 H ATOM 133 HG2 LYS A 9 9.269 -3.815 6.202 1.00 0.00 H ATOM 134 HG3 LYS A 9 10.927 -3.334 5.838 1.00 0.00 H ATOM 135 HD2 LYS A 9 10.826 -4.600 7.919 1.00 0.00 H ATOM 136 HD3 LYS A 9 11.334 -2.937 8.222 1.00 0.00 H ATOM 137 HE2 LYS A 9 9.196 -2.346 9.070 1.00 0.00 H ATOM 138 HE3 LYS A 9 8.478 -3.851 8.496 1.00 0.00 H ATOM 139 HZ1 LYS A 9 9.399 -3.403 10.999 1.00 0.00 H ATOM 140 HZ2 LYS A 9 10.686 -4.249 10.298 1.00 0.00 H ATOM 141 HZ3 LYS A 9 9.136 -4.928 10.319 1.00 0.00 H ATOM 142 N SER A 10 9.180 1.040 5.461 1.00 0.00 N ATOM 143 CA SER A 10 8.678 2.407 5.618 1.00 0.00 C ATOM 144 C SER A 10 7.884 2.892 4.401 1.00 0.00 C ATOM 145 O SER A 10 6.800 3.459 4.556 1.00 0.00 O ATOM 146 CB SER A 10 9.837 3.372 5.899 1.00 0.00 C ATOM 147 OG SER A 10 9.370 4.701 6.076 1.00 0.00 O ATOM 148 H SER A 10 10.135 0.868 5.590 1.00 0.00 H ATOM 149 HA SER A 10 8.021 2.410 6.471 1.00 0.00 H ATOM 150 HB2 SER A 10 10.350 3.062 6.797 1.00 0.00 H ATOM 151 HB3 SER A 10 10.528 3.354 5.067 1.00 0.00 H ATOM 152 HG SER A 10 8.965 4.786 6.943 1.00 0.00 H ATOM 153 N ASP A 11 8.429 2.691 3.202 1.00 0.00 N ATOM 154 CA ASP A 11 7.765 3.140 1.975 1.00 0.00 C ATOM 155 C ASP A 11 6.493 2.347 1.681 1.00 0.00 C ATOM 156 O ASP A 11 5.461 2.934 1.343 1.00 0.00 O ATOM 157 CB ASP A 11 8.722 3.065 0.780 1.00 0.00 C ATOM 158 CG ASP A 11 9.963 3.922 0.979 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.873 5.123 1.251 1.00 0.00 O ATOM 160 H ASP A 11 9.300 2.247 3.142 1.00 0.00 H ATOM 161 HA ASP A 11 7.486 4.170 2.122 1.00 0.00 H ATOM 162 HB2 ASP A 11 9.034 2.041 0.640 1.00 0.00 H ATOM 163 HB3 ASP A 11 8.211 3.403 -0.108 1.00 0.00 H ATOM 164 N ARG A 12 6.559 1.021 1.799 1.00 0.00 N ATOM 165 CA ARG A 12 5.391 0.182 1.529 1.00 0.00 C ATOM 166 C ARG A 12 4.328 0.345 2.620 1.00 0.00 C ATOM 167 O ARG A 12 3.142 0.483 2.317 1.00 0.00 O ATOM 168 CB ARG A 12 5.778 -1.297 1.396 1.00 0.00 C ATOM 169 CG ARG A 12 4.729 -2.125 0.669 1.00 0.00 C ATOM 170 CD ARG A 12 4.686 -1.786 -0.816 1.00 0.00 C ATOM 171 NE ARG A 12 3.541 -2.398 -1.495 1.00 0.00 N ATOM 172 CZ ARG A 12 3.296 -2.280 -2.804 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.137 -1.618 -3.597 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 2.207 -2.835 -3.328 1.00 0.00 N ATOM 175 H ARG A 12 7.405 0.602 2.067 1.00 0.00 H ATOM 176 HA ARG A 12 4.967 0.514 0.595 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.707 -1.370 0.850 1.00 0.00 H ATOM 178 HB3 ARG A 12 5.918 -1.714 2.382 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.966 -3.174 0.785 1.00 0.00 H ATOM 180 HG3 ARG A 12 3.762 -1.922 1.103 1.00 0.00 H ATOM 181 HD2 ARG A 12 4.624 -0.713 -0.924 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.596 -2.141 -1.277 1.00 0.00 H ATOM 183 HE ARG A 12 2.910 -2.911 -0.946 1.00 0.00 H ATOM 184 HH11 ARG A 12 4.962 -1.202 -3.219 1.00 0.00 H ATOM 185 HH12 ARG A 12 3.943 -1.536 -4.575 1.00 0.00 H ATOM 186 HH21 ARG A 12 1.572 -3.340 -2.743 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.020 -2.748 -4.307 1.00 0.00 H ATOM 188 N LYS A 13 4.759 0.333 3.885 1.00 0.00 N ATOM 189 CA LYS A 13 3.838 0.483 5.015 1.00 0.00 C ATOM 190 C LYS A 13 3.078 1.809 4.919 1.00 0.00 C ATOM 191 O LYS A 13 1.887 1.866 5.215 1.00 0.00 O ATOM 192 CB LYS A 13 4.590 0.413 6.354 1.00 0.00 C ATOM 193 CG LYS A 13 3.883 -0.408 7.424 1.00 0.00 C ATOM 194 CD LYS A 13 4.329 -1.865 7.391 1.00 0.00 C ATOM 195 CE LYS A 13 3.678 -2.685 8.498 1.00 0.00 C ATOM 196 NZ LYS A 13 2.219 -2.895 8.269 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.718 0.221 4.061 1.00 0.00 H ATOM 198 HA LYS A 13 3.126 -0.327 4.970 1.00 0.00 H ATOM 199 HB2 LYS A 13 5.557 -0.031 6.185 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.726 1.414 6.733 1.00 0.00 H ATOM 201 HG2 LYS A 13 4.112 0.006 8.395 1.00 0.00 H ATOM 202 HG3 LYS A 13 2.817 -0.363 7.253 1.00 0.00 H ATOM 203 HD2 LYS A 13 4.062 -2.292 6.437 1.00 0.00 H ATOM 204 HD3 LYS A 13 5.401 -1.901 7.514 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.164 -3.649 8.547 1.00 0.00 H ATOM 206 HE3 LYS A 13 3.814 -2.169 9.437 1.00 0.00 H ATOM 207 HZ1 LYS A 13 1.802 -2.066 7.800 1.00 0.00 H ATOM 208 HZ2 LYS A 13 1.733 -3.044 9.176 1.00 0.00 H ATOM 209 HZ3 LYS A 13 2.069 -3.731 7.669 1.00 0.00 H ATOM 210 N LYS A 14 3.780 2.867 4.499 1.00 0.00 N ATOM 211 CA LYS A 14 3.177 4.195 4.356 1.00 0.00 C ATOM 212 C LYS A 14 2.114 4.208 3.255 1.00 0.00 C ATOM 213 O LYS A 14 1.047 4.799 3.426 1.00 0.00 O ATOM 214 CB LYS A 14 4.258 5.246 4.061 1.00 0.00 C ATOM 215 CG LYS A 14 3.708 6.649 3.849 1.00 0.00 C ATOM 216 CD LYS A 14 3.044 7.191 5.108 1.00 0.00 C ATOM 217 CE LYS A 14 2.079 8.320 4.784 1.00 0.00 C ATOM 218 NZ LYS A 14 0.949 7.846 3.985 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.728 2.750 4.276 1.00 0.00 H ATOM 220 HA LYS A 14 2.704 4.440 5.294 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.950 5.277 4.891 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.794 4.954 3.168 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.521 7.306 3.574 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.981 6.624 3.051 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.498 6.394 5.590 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.808 7.561 5.777 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.708 8.738 5.711 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.607 9.081 4.230 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.153 7.375 3.147 1.00 0.00 H ATOM 230 N LYS A 15 2.410 3.547 2.130 1.00 0.00 N ATOM 231 CA LYS A 15 1.480 3.475 0.999 1.00 0.00 C ATOM 232 C LYS A 15 0.140 2.878 1.431 1.00 0.00 C ATOM 233 O LYS A 15 -0.921 3.394 1.078 1.00 0.00 O ATOM 234 CB LYS A 15 2.083 2.629 -0.132 1.00 0.00 C ATOM 235 CG LYS A 15 1.178 2.484 -1.351 1.00 0.00 C ATOM 236 CD LYS A 15 1.581 3.430 -2.477 1.00 0.00 C ATOM 237 CE LYS A 15 1.466 4.892 -2.068 1.00 0.00 C ATOM 238 NZ LYS A 15 1.834 5.809 -3.184 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.275 3.095 2.063 1.00 0.00 H ATOM 240 HA LYS A 15 1.316 4.478 0.640 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.007 3.086 -0.452 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.297 1.641 0.248 1.00 0.00 H ATOM 243 HG2 LYS A 15 1.240 1.469 -1.712 1.00 0.00 H ATOM 244 HG3 LYS A 15 0.161 2.701 -1.057 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.603 3.227 -2.755 1.00 0.00 H ATOM 246 HD3 LYS A 15 0.936 3.253 -3.326 1.00 0.00 H ATOM 247 HE2 LYS A 15 0.448 5.091 -1.770 1.00 0.00 H ATOM 248 HE3 LYS A 15 2.127 5.071 -1.233 1.00 0.00 H ATOM 249 HZ1 LYS A 15 2.836 5.686 -3.431 1.00 0.00 H ATOM 250 HZ2 LYS A 15 1.677 6.797 -2.902 1.00 0.00 H ATOM 251 HZ3 LYS A 15 1.252 5.604 -4.022 1.00 0.00 H ATOM 252 N ASN A 16 0.206 1.790 2.195 1.00 0.00 N ATOM 253 CA ASN A 16 -0.994 1.111 2.683 1.00 0.00 C ATOM 254 C ASN A 16 -1.614 1.877 3.852 1.00 0.00 C ATOM 255 O ASN A 16 -2.837 1.903 4.012 1.00 0.00 O ATOM 256 CB ASN A 16 -0.661 -0.323 3.112 1.00 0.00 C ATOM 257 CG ASN A 16 -1.904 -1.171 3.320 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.669 -1.406 2.383 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.114 -1.638 4.547 1.00 0.00 N ATOM 260 H ASN A 16 1.088 1.435 2.438 1.00 0.00 H ATOM 261 HA ASN A 16 -1.707 1.076 1.873 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.053 -0.789 2.349 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.108 -0.296 4.040 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.466 -1.415 5.246 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.911 -2.189 4.701 1.00 0.00 H ATOM 266 N GLN A 17 -0.755 2.489 4.671 1.00 0.00 N ATOM 267 CA GLN A 17 -1.188 3.250 5.842 1.00 0.00 C ATOM 268 C GLN A 17 -2.059 4.446 5.449 1.00 0.00 C ATOM 269 O GLN A 17 -3.160 4.615 5.977 1.00 0.00 O ATOM 270 CB GLN A 17 0.034 3.730 6.631 1.00 0.00 C ATOM 271 CG GLN A 17 -0.304 4.305 7.995 1.00 0.00 C ATOM 272 CD GLN A 17 0.907 4.890 8.697 1.00 0.00 C ATOM 273 OE1 GLN A 17 1.526 5.837 8.208 1.00 0.00 O ATOM 274 NE2 GLN A 17 1.255 4.327 9.848 1.00 0.00 N ATOM 275 H GLN A 17 0.205 2.417 4.486 1.00 0.00 H ATOM 276 HA GLN A 17 -1.769 2.590 6.466 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.704 2.897 6.775 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.540 4.494 6.060 1.00 0.00 H ATOM 279 HG2 GLN A 17 -1.043 5.082 7.874 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.709 3.517 8.613 1.00 0.00 H ATOM 281 HE21 GLN A 17 0.720 3.574 10.178 1.00 0.00 H ATOM 282 HE22 GLN A 17 2.032 4.687 10.321 1.00 0.00 H ATOM 283 N ASP A 18 -1.562 5.271 4.526 1.00 0.00 N ATOM 284 CA ASP A 18 -2.302 6.450 4.067 1.00 0.00 C ATOM 285 C ASP A 18 -3.445 6.057 3.130 1.00 0.00 C ATOM 286 O ASP A 18 -4.559 6.567 3.251 1.00 0.00 O ATOM 287 CB ASP A 18 -1.366 7.449 3.377 1.00 0.00 C ATOM 288 CG ASP A 18 -0.328 8.015 4.333 1.00 0.00 C ATOM 289 OD1 ASP A 18 -0.672 8.588 5.369 1.00 0.00 O ATOM 290 H ASP A 18 -0.678 5.082 4.143 1.00 0.00 H ATOM 291 HA ASP A 18 -2.726 6.923 4.940 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.855 6.953 2.562 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.952 8.268 2.984 1.00 0.00 H HETATM 294 N NH2 A 19 -3.175 5.144 2.199 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -2.267 4.778 2.157 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.897 4.874 1.596 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 13 ATOM 1 N PHE A 1 23.559 -8.200 7.982 1.00 0.00 N ATOM 2 CA PHE A 1 23.879 -7.412 6.797 1.00 0.00 C ATOM 3 C PHE A 1 22.619 -6.773 6.212 1.00 0.00 C ATOM 4 O PHE A 1 21.599 -7.441 6.032 1.00 0.00 O ATOM 5 CB PHE A 1 24.572 -8.285 5.741 1.00 0.00 C ATOM 6 CG PHE A 1 25.950 -8.750 6.142 1.00 0.00 C ATOM 7 CD1 PHE A 1 26.137 -9.496 7.297 1.00 0.00 C ATOM 8 CD2 PHE A 1 27.057 -8.434 5.368 1.00 0.00 C ATOM 9 CE1 PHE A 1 27.400 -9.917 7.672 1.00 0.00 C ATOM 10 CE2 PHE A 1 28.321 -8.855 5.738 1.00 0.00 C ATOM 11 CZ PHE A 1 28.492 -9.596 6.892 1.00 0.00 C ATOM 12 H1 PHE A 1 23.888 -7.903 8.857 1.00 0.00 H ATOM 13 HA PHE A 1 24.555 -6.627 7.100 1.00 0.00 H ATOM 14 HB2 PHE A 1 23.969 -9.161 5.557 1.00 0.00 H ATOM 15 HB3 PHE A 1 24.664 -7.720 4.824 1.00 0.00 H ATOM 16 HD1 PHE A 1 25.285 -9.750 7.909 1.00 0.00 H ATOM 17 HD2 PHE A 1 26.925 -7.856 4.466 1.00 0.00 H ATOM 18 HE1 PHE A 1 27.532 -10.496 8.573 1.00 0.00 H ATOM 19 HE2 PHE A 1 29.175 -8.602 5.127 1.00 0.00 H ATOM 20 HZ PHE A 1 29.480 -9.925 7.181 1.00 0.00 H ATOM 21 N GLY A 2 22.702 -5.472 5.922 1.00 0.00 N ATOM 22 CA GLY A 2 21.570 -4.744 5.362 1.00 0.00 C ATOM 23 C GLY A 2 21.276 -5.112 3.917 1.00 0.00 C ATOM 24 O GLY A 2 21.566 -4.333 3.008 1.00 0.00 O ATOM 25 H GLY A 2 23.543 -4.998 6.092 1.00 0.00 H ATOM 26 HA2 GLY A 2 20.694 -4.954 5.958 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.778 -3.686 5.416 1.00 0.00 H ATOM 28 N GLY A 3 20.701 -6.296 3.708 1.00 0.00 N ATOM 29 CA GLY A 3 20.374 -6.744 2.363 1.00 0.00 C ATOM 30 C GLY A 3 19.441 -5.791 1.635 1.00 0.00 C ATOM 31 O GLY A 3 19.674 -5.457 0.472 1.00 0.00 O ATOM 32 H GLY A 3 20.493 -6.870 4.475 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.287 -6.837 1.795 1.00 0.00 H ATOM 34 HA3 GLY A 3 19.901 -7.713 2.425 1.00 0.00 H ATOM 35 N PHE A 4 18.384 -5.352 2.321 1.00 0.00 N ATOM 36 CA PHE A 4 17.413 -4.430 1.735 1.00 0.00 C ATOM 37 C PHE A 4 17.421 -3.093 2.475 1.00 0.00 C ATOM 38 O PHE A 4 17.785 -3.028 3.651 1.00 0.00 O ATOM 39 CB PHE A 4 16.009 -5.041 1.752 1.00 0.00 C ATOM 40 CG PHE A 4 15.933 -6.394 1.097 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.324 -7.531 1.787 1.00 0.00 C ATOM 42 CD2 PHE A 4 15.480 -6.527 -0.206 1.00 0.00 C ATOM 43 CE1 PHE A 4 16.263 -8.775 1.190 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.416 -7.769 -0.808 1.00 0.00 C ATOM 45 CZ PHE A 4 15.808 -8.895 -0.109 1.00 0.00 C ATOM 46 H PHE A 4 18.256 -5.654 3.246 1.00 0.00 H ATOM 47 HA PHE A 4 17.705 -4.255 0.710 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.684 -5.149 2.775 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.331 -4.381 1.232 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.679 -7.439 2.803 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.175 -5.647 -0.753 1.00 0.00 H ATOM 52 HE1 PHE A 4 16.571 -9.654 1.738 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.061 -7.860 -1.823 1.00 0.00 H ATOM 54 HZ PHE A 4 15.757 -9.867 -0.577 1.00 0.00 H ATOM 55 N THR A 5 17.033 -2.027 1.771 1.00 0.00 N ATOM 56 CA THR A 5 17.008 -0.679 2.345 1.00 0.00 C ATOM 57 C THR A 5 16.211 -0.625 3.652 1.00 0.00 C ATOM 58 O THR A 5 15.107 -1.165 3.745 1.00 0.00 O ATOM 59 CB THR A 5 16.421 0.343 1.348 1.00 0.00 C ATOM 60 OG1 THR A 5 17.170 0.324 0.129 1.00 0.00 O ATOM 61 CG2 THR A 5 16.435 1.751 1.928 1.00 0.00 C ATOM 62 H THR A 5 16.767 -2.149 0.834 1.00 0.00 H ATOM 63 HA THR A 5 18.029 -0.394 2.553 1.00 0.00 H ATOM 64 HB THR A 5 15.398 0.069 1.136 1.00 0.00 H ATOM 65 HG1 THR A 5 16.565 0.318 -0.619 1.00 0.00 H ATOM 66 HG21 THR A 5 16.999 2.402 1.278 1.00 0.00 H ATOM 67 HG22 THR A 5 16.892 1.734 2.906 1.00 0.00 H ATOM 68 HG23 THR A 5 15.421 2.113 2.011 1.00 0.00 H ATOM 69 N GLY A 6 16.791 0.034 4.657 1.00 0.00 N ATOM 70 CA GLY A 6 16.151 0.164 5.959 1.00 0.00 C ATOM 71 C GLY A 6 14.800 0.862 5.905 1.00 0.00 C ATOM 72 O GLY A 6 13.908 0.549 6.694 1.00 0.00 O ATOM 73 H GLY A 6 17.672 0.438 4.514 1.00 0.00 H ATOM 74 HA2 GLY A 6 16.012 -0.821 6.379 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.804 0.726 6.610 1.00 0.00 H ATOM 76 N LYS A 7 14.653 1.814 4.979 1.00 0.00 N ATOM 77 CA LYS A 7 13.405 2.568 4.828 1.00 0.00 C ATOM 78 C LYS A 7 12.195 1.659 4.554 1.00 0.00 C ATOM 79 O LYS A 7 11.055 2.116 4.635 1.00 0.00 O ATOM 80 CB LYS A 7 13.529 3.590 3.697 1.00 0.00 C ATOM 81 CG LYS A 7 12.337 4.535 3.605 1.00 0.00 C ATOM 82 CD LYS A 7 12.235 5.185 2.234 1.00 0.00 C ATOM 83 CE LYS A 7 12.117 4.143 1.130 1.00 0.00 C ATOM 84 NZ LYS A 7 11.060 3.163 1.396 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.405 2.021 4.385 1.00 0.00 H ATOM 86 HA LYS A 7 13.233 3.099 5.752 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.419 4.180 3.854 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.617 3.062 2.758 1.00 0.00 H ATOM 89 HG2 LYS A 7 11.432 3.981 3.792 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.449 5.309 4.350 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.361 5.818 2.213 1.00 0.00 H ATOM 92 HD3 LYS A 7 13.119 5.781 2.063 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.901 4.646 0.199 1.00 0.00 H ATOM 94 HE3 LYS A 7 13.060 3.623 1.044 1.00 0.00 H ATOM 95 HZ1 LYS A 7 11.339 2.245 1.599 1.00 0.00 H ATOM 96 N ARG A 8 12.435 0.380 4.230 1.00 0.00 N ATOM 97 CA ARG A 8 11.349 -0.562 3.953 1.00 0.00 C ATOM 98 C ARG A 8 10.238 -0.456 4.995 1.00 0.00 C ATOM 99 O ARG A 8 9.061 -0.585 4.666 1.00 0.00 O ATOM 100 CB ARG A 8 11.873 -2.000 3.899 1.00 0.00 C ATOM 101 CG ARG A 8 12.404 -2.408 2.534 1.00 0.00 C ATOM 102 CD ARG A 8 11.319 -2.301 1.468 1.00 0.00 C ATOM 103 NE ARG A 8 11.291 -3.469 0.588 1.00 0.00 N ATOM 104 CZ ARG A 8 10.912 -4.691 0.978 1.00 0.00 C ATOM 105 NH1 ARG A 8 10.510 -4.905 2.230 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.927 -5.697 0.110 1.00 0.00 N ATOM 107 H ARG A 8 13.357 0.063 4.181 1.00 0.00 H ATOM 108 HA ARG A 8 10.938 -0.307 2.989 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.672 -2.107 4.618 1.00 0.00 H ATOM 110 HB3 ARG A 8 11.072 -2.674 4.166 1.00 0.00 H ATOM 111 HG2 ARG A 8 13.224 -1.758 2.267 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.750 -3.430 2.583 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.361 -2.207 1.956 1.00 0.00 H ATOM 114 HD3 ARG A 8 11.505 -1.419 0.873 1.00 0.00 H ATOM 115 HE ARG A 8 11.571 -3.339 -0.343 1.00 0.00 H ATOM 116 HH11 ARG A 8 10.486 -4.152 2.886 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.233 -5.823 2.516 1.00 0.00 H ATOM 118 HH21 ARG A 8 11.218 -5.538 -0.834 1.00 0.00 H ATOM 119 HH22 ARG A 8 10.645 -6.613 0.399 1.00 0.00 H ATOM 120 N LYS A 9 10.620 -0.215 6.245 1.00 0.00 N ATOM 121 CA LYS A 9 9.651 -0.084 7.334 1.00 0.00 C ATOM 122 C LYS A 9 8.644 1.041 7.066 1.00 0.00 C ATOM 123 O LYS A 9 7.433 0.847 7.206 1.00 0.00 O ATOM 124 CB LYS A 9 10.377 0.145 8.666 1.00 0.00 C ATOM 125 CG LYS A 9 11.448 1.228 8.615 1.00 0.00 C ATOM 126 CD LYS A 9 11.045 2.464 9.402 1.00 0.00 C ATOM 127 CE LYS A 9 12.140 3.520 9.374 1.00 0.00 C ATOM 128 NZ LYS A 9 12.221 4.220 8.059 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.578 -0.117 6.438 1.00 0.00 H ATOM 130 HA LYS A 9 9.108 -1.013 7.394 1.00 0.00 H ATOM 131 HB2 LYS A 9 9.650 0.425 9.414 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.848 -0.782 8.965 1.00 0.00 H ATOM 133 HG2 LYS A 9 12.361 0.835 9.033 1.00 0.00 H ATOM 134 HG3 LYS A 9 11.615 1.510 7.586 1.00 0.00 H ATOM 135 HD2 LYS A 9 10.147 2.880 8.968 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.854 2.183 10.427 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.944 4.246 10.148 1.00 0.00 H ATOM 138 HE3 LYS A 9 13.087 3.036 9.571 1.00 0.00 H ATOM 139 HZ1 LYS A 9 11.914 3.586 7.292 1.00 0.00 H ATOM 140 HZ2 LYS A 9 13.198 4.520 7.874 1.00 0.00 H ATOM 141 HZ3 LYS A 9 11.609 5.061 8.066 1.00 0.00 H ATOM 142 N SER A 10 9.150 2.211 6.676 1.00 0.00 N ATOM 143 CA SER A 10 8.298 3.362 6.386 1.00 0.00 C ATOM 144 C SER A 10 7.574 3.210 5.046 1.00 0.00 C ATOM 145 O SER A 10 6.376 3.475 4.955 1.00 0.00 O ATOM 146 CB SER A 10 9.124 4.653 6.396 1.00 0.00 C ATOM 147 OG SER A 10 8.335 5.771 6.025 1.00 0.00 O ATOM 148 H SER A 10 10.119 2.300 6.578 1.00 0.00 H ATOM 149 HA SER A 10 7.558 3.421 7.169 1.00 0.00 H ATOM 150 HB2 SER A 10 9.513 4.820 7.390 1.00 0.00 H ATOM 151 HB3 SER A 10 9.946 4.559 5.701 1.00 0.00 H ATOM 152 HG SER A 10 8.437 5.936 5.085 1.00 0.00 H ATOM 153 N ASP A 11 8.307 2.793 4.010 1.00 0.00 N ATOM 154 CA ASP A 11 7.728 2.619 2.673 1.00 0.00 C ATOM 155 C ASP A 11 6.652 1.532 2.655 1.00 0.00 C ATOM 156 O ASP A 11 5.585 1.721 2.073 1.00 0.00 O ATOM 157 CB ASP A 11 8.816 2.280 1.645 1.00 0.00 C ATOM 158 CG ASP A 11 9.756 3.442 1.360 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.315 4.561 1.091 1.00 0.00 O ATOM 160 H ASP A 11 9.259 2.603 4.147 1.00 0.00 H ATOM 161 HA ASP A 11 7.270 3.555 2.394 1.00 0.00 H ATOM 162 HB2 ASP A 11 9.404 1.453 2.016 1.00 0.00 H ATOM 163 HB3 ASP A 11 8.344 1.988 0.716 1.00 0.00 H ATOM 164 N ARG A 12 6.945 0.395 3.285 1.00 0.00 N ATOM 165 CA ARG A 12 6.009 -0.733 3.337 1.00 0.00 C ATOM 166 C ARG A 12 4.739 -0.369 4.103 1.00 0.00 C ATOM 167 O ARG A 12 3.631 -0.664 3.652 1.00 0.00 O ATOM 168 CB ARG A 12 6.693 -1.957 3.977 1.00 0.00 C ATOM 169 CG ARG A 12 5.804 -3.188 4.136 1.00 0.00 C ATOM 170 CD ARG A 12 4.855 -3.056 5.322 1.00 0.00 C ATOM 171 NE ARG A 12 4.213 -4.326 5.668 1.00 0.00 N ATOM 172 CZ ARG A 12 4.830 -5.341 6.288 1.00 0.00 C ATOM 173 NH1 ARG A 12 6.106 -5.240 6.654 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 4.159 -6.459 6.551 1.00 0.00 N ATOM 175 H ARG A 12 7.819 0.309 3.724 1.00 0.00 H ATOM 176 HA ARG A 12 5.738 -0.979 2.323 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.538 -2.236 3.366 1.00 0.00 H ATOM 178 HB3 ARG A 12 7.052 -1.676 4.955 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.220 -3.316 3.237 1.00 0.00 H ATOM 180 HG3 ARG A 12 6.433 -4.054 4.284 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.416 -2.705 6.174 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.090 -2.338 5.076 1.00 0.00 H ATOM 183 HE ARG A 12 3.269 -4.433 5.426 1.00 0.00 H ATOM 184 HH11 ARG A 12 6.618 -4.400 6.472 1.00 0.00 H ATOM 185 HH12 ARG A 12 6.555 -6.005 7.119 1.00 0.00 H ATOM 186 HH21 ARG A 12 3.197 -6.540 6.287 1.00 0.00 H ATOM 187 HH22 ARG A 12 4.615 -7.219 7.014 1.00 0.00 H ATOM 188 N LYS A 13 4.907 0.253 5.267 1.00 0.00 N ATOM 189 CA LYS A 13 3.771 0.634 6.107 1.00 0.00 C ATOM 190 C LYS A 13 2.980 1.805 5.508 1.00 0.00 C ATOM 191 O LYS A 13 1.750 1.803 5.535 1.00 0.00 O ATOM 192 CB LYS A 13 4.259 0.988 7.516 1.00 0.00 C ATOM 193 CG LYS A 13 3.177 0.953 8.589 1.00 0.00 C ATOM 194 CD LYS A 13 2.837 -0.473 9.014 1.00 0.00 C ATOM 195 CE LYS A 13 1.813 -1.123 8.094 1.00 0.00 C ATOM 196 NZ LYS A 13 1.680 -2.584 8.356 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.816 0.448 5.577 1.00 0.00 H ATOM 198 HA LYS A 13 3.120 -0.218 6.168 1.00 0.00 H ATOM 199 HB2 LYS A 13 5.031 0.287 7.797 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.682 1.981 7.495 1.00 0.00 H ATOM 201 HG2 LYS A 13 3.522 1.500 9.451 1.00 0.00 H ATOM 202 HG3 LYS A 13 2.286 1.421 8.199 1.00 0.00 H ATOM 203 HD2 LYS A 13 3.741 -1.065 9.000 1.00 0.00 H ATOM 204 HD3 LYS A 13 2.440 -0.449 10.018 1.00 0.00 H ATOM 205 HE2 LYS A 13 0.854 -0.652 8.255 1.00 0.00 H ATOM 206 HE3 LYS A 13 2.115 -0.978 7.071 1.00 0.00 H ATOM 207 HZ1 LYS A 13 1.527 -2.753 9.371 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.544 -3.079 8.060 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.874 -2.971 7.825 1.00 0.00 H ATOM 210 N LYS A 14 3.692 2.802 4.981 1.00 0.00 N ATOM 211 CA LYS A 14 3.052 3.983 4.387 1.00 0.00 C ATOM 212 C LYS A 14 2.340 3.653 3.072 1.00 0.00 C ATOM 213 O LYS A 14 1.221 4.117 2.844 1.00 0.00 O ATOM 214 CB LYS A 14 4.088 5.092 4.161 1.00 0.00 C ATOM 215 CG LYS A 14 3.553 6.280 3.376 1.00 0.00 C ATOM 216 CD LYS A 14 2.403 6.965 4.098 1.00 0.00 C ATOM 217 CE LYS A 14 1.610 7.858 3.158 1.00 0.00 C ATOM 218 NZ LYS A 14 0.875 7.073 2.165 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.670 2.748 4.997 1.00 0.00 H ATOM 220 HA LYS A 14 2.311 4.340 5.089 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.431 5.448 5.121 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.927 4.681 3.619 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.351 6.994 3.238 1.00 0.00 H ATOM 224 HG3 LYS A 14 3.207 5.935 2.413 1.00 0.00 H ATOM 225 HD2 LYS A 14 1.745 6.210 4.502 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.801 7.565 4.903 1.00 0.00 H ATOM 227 HE2 LYS A 14 0.908 8.437 3.739 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.291 8.522 2.648 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.360 6.351 1.710 1.00 0.00 H ATOM 230 N LYS A 15 2.987 2.863 2.210 1.00 0.00 N ATOM 231 CA LYS A 15 2.394 2.493 0.922 1.00 0.00 C ATOM 232 C LYS A 15 1.045 1.811 1.133 1.00 0.00 C ATOM 233 O LYS A 15 0.069 2.121 0.451 1.00 0.00 O ATOM 234 CB LYS A 15 3.330 1.569 0.134 1.00 0.00 C ATOM 235 CG LYS A 15 2.895 1.340 -1.307 1.00 0.00 C ATOM 236 CD LYS A 15 3.086 2.590 -2.153 1.00 0.00 C ATOM 237 CE LYS A 15 2.582 2.385 -3.574 1.00 0.00 C ATOM 238 NZ LYS A 15 3.389 1.372 -4.314 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.875 2.526 2.444 1.00 0.00 H ATOM 240 HA LYS A 15 2.239 3.399 0.359 1.00 0.00 H ATOM 241 HB2 LYS A 15 4.319 2.003 0.121 1.00 0.00 H ATOM 242 HB3 LYS A 15 3.374 0.612 0.630 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.481 0.538 -1.729 1.00 0.00 H ATOM 244 HG3 LYS A 15 1.849 1.067 -1.317 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.541 3.407 -1.704 1.00 0.00 H ATOM 246 HD3 LYS A 15 4.138 2.831 -2.187 1.00 0.00 H ATOM 247 HE2 LYS A 15 1.556 2.052 -3.534 1.00 0.00 H ATOM 248 HE3 LYS A 15 2.633 3.327 -4.099 1.00 0.00 H ATOM 249 HZ1 LYS A 15 3.633 0.578 -3.689 1.00 0.00 H ATOM 250 HZ2 LYS A 15 4.267 1.804 -4.667 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.847 1.007 -5.124 1.00 0.00 H ATOM 252 N ASN A 16 1.001 0.893 2.096 1.00 0.00 N ATOM 253 CA ASN A 16 -0.231 0.173 2.423 1.00 0.00 C ATOM 254 C ASN A 16 -1.284 1.137 2.967 1.00 0.00 C ATOM 255 O ASN A 16 -2.473 1.003 2.676 1.00 0.00 O ATOM 256 CB ASN A 16 0.049 -0.927 3.456 1.00 0.00 C ATOM 257 CG ASN A 16 1.003 -2.009 2.958 1.00 0.00 C ATOM 258 OD1 ASN A 16 1.485 -2.824 3.745 1.00 0.00 O ATOM 259 ND2 ASN A 16 1.273 -2.042 1.652 1.00 0.00 N ATOM 260 H ASN A 16 1.815 0.704 2.609 1.00 0.00 H ATOM 261 HA ASN A 16 -0.606 -0.278 1.517 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.482 -0.479 4.337 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.886 -1.397 3.726 1.00 0.00 H ATOM 264 HD21 ASN A 16 0.853 -1.378 1.069 1.00 0.00 H ATOM 265 HD22 ASN A 16 1.881 -2.738 1.327 1.00 0.00 H ATOM 266 N GLN A 17 -0.830 2.104 3.765 1.00 0.00 N ATOM 267 CA GLN A 17 -1.711 3.102 4.369 1.00 0.00 C ATOM 268 C GLN A 17 -2.377 4.002 3.328 1.00 0.00 C ATOM 269 O GLN A 17 -3.596 4.177 3.347 1.00 0.00 O ATOM 270 CB GLN A 17 -0.927 3.948 5.375 1.00 0.00 C ATOM 271 CG GLN A 17 -0.914 3.354 6.773 1.00 0.00 C ATOM 272 CD GLN A 17 -0.193 4.231 7.776 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.632 5.342 8.075 1.00 0.00 O ATOM 274 NE2 GLN A 17 0.926 3.742 8.292 1.00 0.00 N ATOM 275 H GLN A 17 0.131 2.146 3.955 1.00 0.00 H ATOM 276 HA GLN A 17 -2.482 2.569 4.899 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.096 4.029 5.033 1.00 0.00 H ATOM 278 HB3 GLN A 17 -1.356 4.932 5.425 1.00 0.00 H ATOM 279 HG2 GLN A 17 -1.934 3.224 7.102 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.425 2.393 6.737 1.00 0.00 H ATOM 281 HE21 GLN A 17 1.223 2.856 7.997 1.00 0.00 H ATOM 282 HE22 GLN A 17 1.409 4.286 8.948 1.00 0.00 H ATOM 283 N ASP A 18 -1.579 4.576 2.427 1.00 0.00 N ATOM 284 CA ASP A 18 -2.109 5.462 1.391 1.00 0.00 C ATOM 285 C ASP A 18 -2.790 4.664 0.280 1.00 0.00 C ATOM 286 O ASP A 18 -3.993 4.796 0.056 1.00 0.00 O ATOM 287 CB ASP A 18 -0.997 6.345 0.813 1.00 0.00 C ATOM 288 CG ASP A 18 -0.405 7.274 1.858 1.00 0.00 C ATOM 289 OD1 ASP A 18 -1.094 8.146 2.389 1.00 0.00 O ATOM 290 H ASP A 18 -0.615 4.403 2.464 1.00 0.00 H ATOM 291 HA ASP A 18 -2.849 6.098 1.855 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.210 5.717 0.428 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.402 6.945 0.011 1.00 0.00 H HETATM 294 N NH2 A 19 -2.024 3.826 -0.412 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.072 3.769 -0.182 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -2.443 3.298 -1.123 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 14 ATOM 1 N PHE A 1 19.871 9.205 -2.091 1.00 0.00 N ATOM 2 CA PHE A 1 19.280 8.196 -2.966 1.00 0.00 C ATOM 3 C PHE A 1 17.923 7.720 -2.432 1.00 0.00 C ATOM 4 O PHE A 1 17.489 8.129 -1.352 1.00 0.00 O ATOM 5 CB PHE A 1 20.240 7.010 -3.150 1.00 0.00 C ATOM 6 CG PHE A 1 20.777 6.426 -1.868 1.00 0.00 C ATOM 7 CD1 PHE A 1 19.934 6.146 -0.803 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.130 6.151 -1.733 1.00 0.00 C ATOM 9 CE1 PHE A 1 20.429 5.608 0.367 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.630 5.612 -0.563 1.00 0.00 C ATOM 11 CZ PHE A 1 21.778 5.339 0.487 1.00 0.00 C ATOM 12 H1 PHE A 1 19.740 10.153 -2.298 1.00 0.00 H ATOM 13 HA PHE A 1 19.120 8.661 -3.929 1.00 0.00 H ATOM 14 HB2 PHE A 1 19.724 6.221 -3.675 1.00 0.00 H ATOM 15 HB3 PHE A 1 21.084 7.332 -3.745 1.00 0.00 H ATOM 16 HD1 PHE A 1 18.879 6.353 -0.893 1.00 0.00 H ATOM 17 HD2 PHE A 1 22.798 6.365 -2.555 1.00 0.00 H ATOM 18 HE1 PHE A 1 19.764 5.398 1.188 1.00 0.00 H ATOM 19 HE2 PHE A 1 23.685 5.403 -0.472 1.00 0.00 H ATOM 20 HZ PHE A 1 22.165 4.917 1.402 1.00 0.00 H ATOM 21 N GLY A 2 17.255 6.860 -3.208 1.00 0.00 N ATOM 22 CA GLY A 2 15.952 6.342 -2.818 1.00 0.00 C ATOM 23 C GLY A 2 16.014 5.276 -1.735 1.00 0.00 C ATOM 24 O GLY A 2 16.304 5.574 -0.575 1.00 0.00 O ATOM 25 H GLY A 2 17.651 6.580 -4.058 1.00 0.00 H ATOM 26 HA2 GLY A 2 15.350 7.163 -2.456 1.00 0.00 H ATOM 27 HA3 GLY A 2 15.475 5.922 -3.689 1.00 0.00 H ATOM 28 N GLY A 3 15.713 4.033 -2.125 1.00 0.00 N ATOM 29 CA GLY A 3 15.706 2.908 -1.194 1.00 0.00 C ATOM 30 C GLY A 3 16.951 2.813 -0.323 1.00 0.00 C ATOM 31 O GLY A 3 18.052 3.162 -0.757 1.00 0.00 O ATOM 32 H GLY A 3 15.474 3.878 -3.063 1.00 0.00 H ATOM 33 HA2 GLY A 3 14.844 3.002 -0.550 1.00 0.00 H ATOM 34 HA3 GLY A 3 15.612 1.994 -1.762 1.00 0.00 H ATOM 35 N PHE A 4 16.763 2.336 0.912 1.00 0.00 N ATOM 36 CA PHE A 4 17.860 2.185 1.872 1.00 0.00 C ATOM 37 C PHE A 4 17.489 1.213 3.008 1.00 0.00 C ATOM 38 O PHE A 4 17.413 1.609 4.171 1.00 0.00 O ATOM 39 CB PHE A 4 18.280 3.554 2.441 1.00 0.00 C ATOM 40 CG PHE A 4 17.142 4.516 2.678 1.00 0.00 C ATOM 41 CD1 PHE A 4 15.972 4.097 3.293 1.00 0.00 C ATOM 42 CD2 PHE A 4 17.250 5.842 2.288 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.935 4.982 3.512 1.00 0.00 C ATOM 44 CE2 PHE A 4 16.216 6.731 2.508 1.00 0.00 C ATOM 45 CZ PHE A 4 15.056 6.299 3.119 1.00 0.00 C ATOM 46 H PHE A 4 15.859 2.080 1.188 1.00 0.00 H ATOM 47 HA PHE A 4 18.699 1.769 1.332 1.00 0.00 H ATOM 48 HB2 PHE A 4 18.777 3.401 3.386 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.971 4.020 1.754 1.00 0.00 H ATOM 50 HD1 PHE A 4 15.873 3.067 3.598 1.00 0.00 H ATOM 51 HD2 PHE A 4 18.156 6.180 1.806 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.030 4.643 3.990 1.00 0.00 H ATOM 53 HE2 PHE A 4 16.314 7.762 2.198 1.00 0.00 H ATOM 54 HZ PHE A 4 14.246 6.992 3.291 1.00 0.00 H ATOM 55 N THR A 5 17.266 -0.062 2.639 1.00 0.00 N ATOM 56 CA THR A 5 16.902 -1.148 3.576 1.00 0.00 C ATOM 57 C THR A 5 15.583 -0.876 4.308 1.00 0.00 C ATOM 58 O THR A 5 14.566 -1.503 4.007 1.00 0.00 O ATOM 59 CB THR A 5 18.018 -1.464 4.609 1.00 0.00 C ATOM 60 OG1 THR A 5 18.267 -0.342 5.462 1.00 0.00 O ATOM 61 CG2 THR A 5 19.312 -1.871 3.914 1.00 0.00 C ATOM 62 H THR A 5 17.353 -0.289 1.689 1.00 0.00 H ATOM 63 HA THR A 5 16.762 -2.036 2.978 1.00 0.00 H ATOM 64 HB THR A 5 17.687 -2.294 5.220 1.00 0.00 H ATOM 65 HG1 THR A 5 18.422 -0.648 6.361 1.00 0.00 H ATOM 66 HG21 THR A 5 19.288 -2.930 3.699 1.00 0.00 H ATOM 67 HG22 THR A 5 20.150 -1.655 4.559 1.00 0.00 H ATOM 68 HG23 THR A 5 19.417 -1.319 2.991 1.00 0.00 H ATOM 69 N GLY A 6 15.600 0.057 5.260 1.00 0.00 N ATOM 70 CA GLY A 6 14.396 0.395 6.010 1.00 0.00 C ATOM 71 C GLY A 6 13.266 0.892 5.124 1.00 0.00 C ATOM 72 O GLY A 6 12.095 0.799 5.497 1.00 0.00 O ATOM 73 H GLY A 6 16.439 0.527 5.452 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.058 -0.483 6.540 1.00 0.00 H ATOM 75 HA3 GLY A 6 14.639 1.163 6.728 1.00 0.00 H ATOM 76 N LYS A 7 13.623 1.428 3.956 1.00 0.00 N ATOM 77 CA LYS A 7 12.651 1.958 3.002 1.00 0.00 C ATOM 78 C LYS A 7 11.561 0.938 2.648 1.00 0.00 C ATOM 79 O LYS A 7 10.409 1.317 2.439 1.00 0.00 O ATOM 80 CB LYS A 7 13.373 2.420 1.727 1.00 0.00 C ATOM 81 CG LYS A 7 12.441 2.914 0.630 1.00 0.00 C ATOM 82 CD LYS A 7 11.667 4.150 1.060 1.00 0.00 C ATOM 83 CE LYS A 7 10.390 4.307 0.253 1.00 0.00 C ATOM 84 NZ LYS A 7 9.472 3.194 0.490 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.573 1.476 3.730 1.00 0.00 H ATOM 86 HA LYS A 7 12.182 2.814 3.460 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.045 3.224 1.982 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.948 1.594 1.336 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.030 3.161 -0.241 1.00 0.00 H ATOM 90 HG3 LYS A 7 11.743 2.129 0.382 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.413 4.060 2.106 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.288 5.021 0.912 1.00 0.00 H ATOM 93 HE2 LYS A 7 9.907 5.232 0.539 1.00 0.00 H ATOM 94 HE3 LYS A 7 10.641 4.339 -0.796 1.00 0.00 H ATOM 95 HZ1 LYS A 7 9.848 2.289 0.467 1.00 0.00 H ATOM 96 N ARG A 8 11.925 -0.347 2.566 1.00 0.00 N ATOM 97 CA ARG A 8 10.958 -1.391 2.212 1.00 0.00 C ATOM 98 C ARG A 8 9.818 -1.466 3.216 1.00 0.00 C ATOM 99 O ARG A 8 8.650 -1.366 2.846 1.00 0.00 O ATOM 100 CB ARG A 8 11.632 -2.762 2.108 1.00 0.00 C ATOM 101 CG ARG A 8 12.646 -2.862 0.984 1.00 0.00 C ATOM 102 CD ARG A 8 13.091 -4.302 0.760 1.00 0.00 C ATOM 103 NE ARG A 8 11.967 -5.188 0.432 1.00 0.00 N ATOM 104 CZ ARG A 8 11.195 -5.064 -0.654 1.00 0.00 C ATOM 105 NH1 ARG A 8 11.454 -4.137 -1.574 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.166 -5.889 -0.829 1.00 0.00 N ATOM 107 H ARG A 8 12.857 -0.596 2.738 1.00 0.00 H ATOM 108 HA ARG A 8 10.544 -1.136 1.250 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.133 -2.977 3.039 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.869 -3.510 1.940 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.200 -2.485 0.077 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.509 -2.263 1.237 1.00 0.00 H ATOM 113 HD2 ARG A 8 13.804 -4.323 -0.053 1.00 0.00 H ATOM 114 HD3 ARG A 8 13.567 -4.662 1.661 1.00 0.00 H ATOM 115 HE ARG A 8 11.764 -5.906 1.069 1.00 0.00 H ATOM 116 HH11 ARG A 8 12.233 -3.522 -1.462 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.866 -4.053 -2.379 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.972 -6.597 -0.150 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.583 -5.800 -1.637 1.00 0.00 H ATOM 120 N LYS A 9 10.158 -1.650 4.482 1.00 0.00 N ATOM 121 CA LYS A 9 9.141 -1.743 5.527 1.00 0.00 C ATOM 122 C LYS A 9 8.363 -0.435 5.647 1.00 0.00 C ATOM 123 O LYS A 9 7.133 -0.442 5.763 1.00 0.00 O ATOM 124 CB LYS A 9 9.770 -2.112 6.875 1.00 0.00 C ATOM 125 CG LYS A 9 8.752 -2.264 7.996 1.00 0.00 C ATOM 126 CD LYS A 9 9.375 -2.842 9.258 1.00 0.00 C ATOM 127 CE LYS A 9 10.472 -1.947 9.819 1.00 0.00 C ATOM 128 NZ LYS A 9 11.175 -2.593 10.963 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.110 -1.725 4.716 1.00 0.00 H ATOM 130 HA LYS A 9 8.452 -2.525 5.242 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.302 -3.046 6.770 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.471 -1.339 7.157 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.338 -1.294 8.224 1.00 0.00 H ATOM 134 HG3 LYS A 9 7.964 -2.924 7.662 1.00 0.00 H ATOM 135 HD2 LYS A 9 8.604 -2.954 10.004 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.797 -3.811 9.027 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.188 -1.737 9.038 1.00 0.00 H ATOM 138 HE3 LYS A 9 10.026 -1.023 10.157 1.00 0.00 H ATOM 139 HZ1 LYS A 9 11.381 -3.588 10.739 1.00 0.00 H ATOM 140 HZ2 LYS A 9 10.582 -2.557 11.815 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.071 -2.100 11.156 1.00 0.00 H ATOM 142 N SER A 10 9.090 0.684 5.615 1.00 0.00 N ATOM 143 CA SER A 10 8.476 2.004 5.718 1.00 0.00 C ATOM 144 C SER A 10 7.360 2.176 4.686 1.00 0.00 C ATOM 145 O SER A 10 6.236 2.530 5.038 1.00 0.00 O ATOM 146 CB SER A 10 9.534 3.097 5.536 1.00 0.00 C ATOM 147 OG SER A 10 8.964 4.390 5.661 1.00 0.00 O ATOM 148 H SER A 10 10.064 0.617 5.520 1.00 0.00 H ATOM 149 HA SER A 10 8.052 2.091 6.704 1.00 0.00 H ATOM 150 HB2 SER A 10 10.301 2.981 6.289 1.00 0.00 H ATOM 151 HB3 SER A 10 9.979 3.006 4.555 1.00 0.00 H ATOM 152 HG SER A 10 9.509 4.922 6.244 1.00 0.00 H ATOM 153 N ASP A 11 7.676 1.918 3.416 1.00 0.00 N ATOM 154 CA ASP A 11 6.698 2.043 2.331 1.00 0.00 C ATOM 155 C ASP A 11 5.645 0.936 2.367 1.00 0.00 C ATOM 156 O ASP A 11 4.498 1.164 1.987 1.00 0.00 O ATOM 157 CB ASP A 11 7.397 2.056 0.970 1.00 0.00 C ATOM 158 CG ASP A 11 8.174 3.338 0.740 1.00 0.00 C ATOM 159 OD1 ASP A 11 7.612 4.435 0.796 1.00 0.00 O ATOM 160 H ASP A 11 8.590 1.635 3.202 1.00 0.00 H ATOM 161 HA ASP A 11 6.195 2.988 2.464 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.085 1.225 0.918 1.00 0.00 H ATOM 163 HB3 ASP A 11 6.658 1.956 0.190 1.00 0.00 H ATOM 164 N ARG A 12 6.032 -0.261 2.809 1.00 0.00 N ATOM 165 CA ARG A 12 5.101 -1.388 2.874 1.00 0.00 C ATOM 166 C ARG A 12 3.828 -0.999 3.626 1.00 0.00 C ATOM 167 O ARG A 12 2.719 -1.285 3.172 1.00 0.00 O ATOM 168 CB ARG A 12 5.768 -2.598 3.534 1.00 0.00 C ATOM 169 CG ARG A 12 5.016 -3.894 3.298 1.00 0.00 C ATOM 170 CD ARG A 12 5.917 -5.102 3.489 1.00 0.00 C ATOM 171 NE ARG A 12 5.643 -6.143 2.498 1.00 0.00 N ATOM 172 CZ ARG A 12 5.824 -5.991 1.180 1.00 0.00 C ATOM 173 NH1 ARG A 12 6.321 -4.856 0.688 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 5.515 -6.981 0.351 1.00 0.00 N ATOM 175 H ARG A 12 6.962 -0.392 3.091 1.00 0.00 H ATOM 176 HA ARG A 12 4.833 -1.649 1.862 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.767 -2.707 3.138 1.00 0.00 H ATOM 178 HB3 ARG A 12 5.827 -2.428 4.597 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.198 -3.955 3.999 1.00 0.00 H ATOM 180 HG3 ARG A 12 4.629 -3.898 2.289 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.947 -4.788 3.396 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.752 -5.505 4.476 1.00 0.00 H ATOM 183 HE ARG A 12 5.295 -6.998 2.828 1.00 0.00 H ATOM 184 HH11 ARG A 12 6.564 -4.106 1.300 1.00 0.00 H ATOM 185 HH12 ARG A 12 6.450 -4.755 -0.298 1.00 0.00 H ATOM 186 HH21 ARG A 12 5.147 -7.838 0.711 1.00 0.00 H ATOM 187 HH22 ARG A 12 5.649 -6.869 -0.634 1.00 0.00 H ATOM 188 N LYS A 13 3.997 -0.326 4.766 1.00 0.00 N ATOM 189 CA LYS A 13 2.859 0.128 5.569 1.00 0.00 C ATOM 190 C LYS A 13 2.375 1.519 5.128 1.00 0.00 C ATOM 191 O LYS A 13 1.176 1.794 5.138 1.00 0.00 O ATOM 192 CB LYS A 13 3.216 0.140 7.062 1.00 0.00 C ATOM 193 CG LYS A 13 4.490 0.908 7.391 1.00 0.00 C ATOM 194 CD LYS A 13 4.710 1.024 8.893 1.00 0.00 C ATOM 195 CE LYS A 13 4.713 -0.337 9.578 1.00 0.00 C ATOM 196 NZ LYS A 13 5.714 -1.266 8.987 1.00 0.00 N1+ ATOM 197 H LYS A 13 4.908 -0.115 5.062 1.00 0.00 H ATOM 198 HA LYS A 13 2.055 -0.574 5.412 1.00 0.00 H ATOM 199 HB2 LYS A 13 2.399 0.589 7.609 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.340 -0.879 7.395 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.331 0.391 6.955 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.421 1.900 6.969 1.00 0.00 H ATOM 203 HD2 LYS A 13 5.662 1.505 9.072 1.00 0.00 H ATOM 204 HD3 LYS A 13 3.919 1.626 9.315 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.943 -0.196 10.624 1.00 0.00 H ATOM 206 HE3 LYS A 13 3.729 -0.771 9.485 1.00 0.00 H ATOM 207 HZ1 LYS A 13 5.831 -2.098 9.600 1.00 0.00 H ATOM 208 HZ2 LYS A 13 6.631 -0.790 8.890 1.00 0.00 H ATOM 209 HZ3 LYS A 13 5.398 -1.582 8.048 1.00 0.00 H ATOM 210 N LYS A 14 3.316 2.391 4.755 1.00 0.00 N ATOM 211 CA LYS A 14 2.999 3.759 4.326 1.00 0.00 C ATOM 212 C LYS A 14 2.183 3.801 3.031 1.00 0.00 C ATOM 213 O LYS A 14 1.352 4.687 2.843 1.00 0.00 O ATOM 214 CB LYS A 14 4.289 4.565 4.144 1.00 0.00 C ATOM 215 CG LYS A 14 4.904 5.050 5.450 1.00 0.00 C ATOM 216 CD LYS A 14 4.440 6.456 5.829 1.00 0.00 C ATOM 217 CE LYS A 14 2.933 6.550 6.065 1.00 0.00 C ATOM 218 NZ LYS A 14 2.177 6.696 4.817 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.256 2.110 4.778 1.00 0.00 H ATOM 220 HA LYS A 14 2.417 4.217 5.110 1.00 0.00 H ATOM 221 HB2 LYS A 14 5.016 3.943 3.645 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.083 5.426 3.526 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.627 4.369 6.240 1.00 0.00 H ATOM 224 HG3 LYS A 14 5.979 5.057 5.344 1.00 0.00 H ATOM 225 HD2 LYS A 14 4.947 6.754 6.734 1.00 0.00 H ATOM 226 HD3 LYS A 14 4.709 7.132 5.030 1.00 0.00 H ATOM 227 HE2 LYS A 14 2.604 5.653 6.571 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.738 7.405 6.694 1.00 0.00 H ATOM 229 HZ1 LYS A 14 2.375 6.073 4.091 1.00 0.00 H ATOM 230 N LYS A 15 2.436 2.857 2.138 1.00 0.00 N ATOM 231 CA LYS A 15 1.739 2.808 0.856 1.00 0.00 C ATOM 232 C LYS A 15 0.225 2.882 1.051 1.00 0.00 C ATOM 233 O LYS A 15 -0.461 3.658 0.380 1.00 0.00 O ATOM 234 CB LYS A 15 2.126 1.530 0.100 1.00 0.00 C ATOM 235 CG LYS A 15 1.621 1.481 -1.332 1.00 0.00 C ATOM 236 CD LYS A 15 2.079 0.214 -2.044 1.00 0.00 C ATOM 237 CE LYS A 15 1.509 -1.040 -1.390 1.00 0.00 C ATOM 238 NZ LYS A 15 1.875 -2.281 -2.134 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.112 2.181 2.337 1.00 0.00 H ATOM 240 HA LYS A 15 2.054 3.662 0.278 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.203 1.455 0.078 1.00 0.00 H ATOM 242 HB3 LYS A 15 1.727 0.678 0.630 1.00 0.00 H ATOM 243 HG2 LYS A 15 0.542 1.508 -1.325 1.00 0.00 H ATOM 244 HG3 LYS A 15 2.002 2.340 -1.866 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.752 0.251 -3.073 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.158 0.167 -2.010 1.00 0.00 H ATOM 247 HE2 LYS A 15 1.895 -1.111 -0.384 1.00 0.00 H ATOM 248 HE3 LYS A 15 0.433 -0.955 -1.356 1.00 0.00 H ATOM 249 HZ1 LYS A 15 1.016 -2.762 -2.470 1.00 0.00 H ATOM 250 HZ2 LYS A 15 2.400 -2.929 -1.513 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.471 -2.048 -2.954 1.00 0.00 H ATOM 252 N ASN A 16 -0.286 2.075 1.977 1.00 0.00 N ATOM 253 CA ASN A 16 -1.720 2.042 2.273 1.00 0.00 C ATOM 254 C ASN A 16 -2.103 3.070 3.340 1.00 0.00 C ATOM 255 O ASN A 16 -3.168 3.688 3.263 1.00 0.00 O ATOM 256 CB ASN A 16 -2.149 0.641 2.727 1.00 0.00 C ATOM 257 CG ASN A 16 -1.503 0.225 4.038 1.00 0.00 C ATOM 258 OD1 ASN A 16 -0.283 0.083 4.126 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.320 0.032 5.070 1.00 0.00 N ATOM 260 H ASN A 16 0.321 1.487 2.478 1.00 0.00 H ATOM 261 HA ASN A 16 -2.246 2.282 1.362 1.00 0.00 H ATOM 262 HB2 ASN A 16 -3.222 0.624 2.854 1.00 0.00 H ATOM 263 HB3 ASN A 16 -1.873 -0.076 1.967 1.00 0.00 H ATOM 264 HD21 ASN A 16 -3.281 0.165 4.932 1.00 0.00 H ATOM 265 HD22 ASN A 16 -1.927 -0.230 5.927 1.00 0.00 H ATOM 266 N GLN A 17 -1.237 3.231 4.345 1.00 0.00 N ATOM 267 CA GLN A 17 -1.478 4.160 5.452 1.00 0.00 C ATOM 268 C GLN A 17 -1.163 5.627 5.082 1.00 0.00 C ATOM 269 O GLN A 17 -0.910 6.448 5.965 1.00 0.00 O ATOM 270 CB GLN A 17 -0.629 3.721 6.655 1.00 0.00 C ATOM 271 CG GLN A 17 -1.026 4.352 7.982 1.00 0.00 C ATOM 272 CD GLN A 17 -2.428 3.967 8.424 1.00 0.00 C ATOM 273 OE1 GLN A 17 -3.407 4.232 7.723 1.00 0.00 O ATOM 274 NE2 GLN A 17 -2.534 3.344 9.595 1.00 0.00 N ATOM 275 H GLN A 17 -0.419 2.694 4.352 1.00 0.00 H ATOM 276 HA GLN A 17 -2.520 4.088 5.720 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.708 2.649 6.759 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.402 3.974 6.457 1.00 0.00 H ATOM 279 HG2 GLN A 17 -0.326 4.027 8.740 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.975 5.425 7.886 1.00 0.00 H ATOM 281 HE21 GLN A 17 -1.715 3.169 10.104 1.00 0.00 H ATOM 282 HE22 GLN A 17 -3.429 3.083 9.900 1.00 0.00 H ATOM 283 N ASP A 18 -1.201 5.955 3.783 1.00 0.00 N ATOM 284 CA ASP A 18 -0.938 7.320 3.311 1.00 0.00 C ATOM 285 C ASP A 18 -1.546 7.539 1.923 1.00 0.00 C ATOM 286 O ASP A 18 -2.257 8.519 1.694 1.00 0.00 O ATOM 287 CB ASP A 18 0.571 7.614 3.253 1.00 0.00 C ATOM 288 CG ASP A 18 1.241 7.625 4.617 1.00 0.00 C ATOM 289 OD1 ASP A 18 0.921 8.455 5.471 1.00 0.00 O ATOM 290 H ASP A 18 -1.424 5.267 3.125 1.00 0.00 H ATOM 291 HA ASP A 18 -1.403 8.006 4.004 1.00 0.00 H ATOM 292 HB2 ASP A 18 1.053 6.865 2.646 1.00 0.00 H ATOM 293 HB3 ASP A 18 0.719 8.583 2.796 1.00 0.00 H HETATM 294 N NH2 A 19 -1.270 6.627 0.991 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.698 5.866 1.233 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -1.650 6.754 0.097 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 15 ATOM 1 N PHE A 1 22.731 3.084 5.081 1.00 0.00 N ATOM 2 CA PHE A 1 23.435 2.828 3.827 1.00 0.00 C ATOM 3 C PHE A 1 23.026 1.485 3.211 1.00 0.00 C ATOM 4 O PHE A 1 23.165 1.289 2.003 1.00 0.00 O ATOM 5 CB PHE A 1 24.958 2.881 4.040 1.00 0.00 C ATOM 6 CG PHE A 1 25.494 1.863 5.015 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.432 0.505 4.736 1.00 0.00 C ATOM 8 CD2 PHE A 1 26.071 2.270 6.207 1.00 0.00 C ATOM 9 CE1 PHE A 1 25.931 -0.424 5.629 1.00 0.00 C ATOM 10 CE2 PHE A 1 26.574 1.345 7.102 1.00 0.00 C ATOM 11 CZ PHE A 1 26.502 -0.003 6.813 1.00 0.00 C ATOM 12 H1 PHE A 1 21.956 3.684 5.081 1.00 0.00 H ATOM 13 HA PHE A 1 23.159 3.613 3.139 1.00 0.00 H ATOM 14 HB2 PHE A 1 25.449 2.718 3.093 1.00 0.00 H ATOM 15 HB3 PHE A 1 25.224 3.862 4.407 1.00 0.00 H ATOM 16 HD1 PHE A 1 24.987 0.173 3.809 1.00 0.00 H ATOM 17 HD2 PHE A 1 26.126 3.324 6.437 1.00 0.00 H ATOM 18 HE1 PHE A 1 25.874 -1.479 5.400 1.00 0.00 H ATOM 19 HE2 PHE A 1 27.022 1.677 8.027 1.00 0.00 H ATOM 20 HZ PHE A 1 26.895 -0.727 7.512 1.00 0.00 H ATOM 21 N GLY A 2 22.534 0.560 4.048 1.00 0.00 N ATOM 22 CA GLY A 2 22.127 -0.754 3.565 1.00 0.00 C ATOM 23 C GLY A 2 21.165 -0.690 2.389 1.00 0.00 C ATOM 24 O GLY A 2 20.163 0.025 2.436 1.00 0.00 O ATOM 25 H GLY A 2 22.455 0.768 5.002 1.00 0.00 H ATOM 26 HA2 GLY A 2 23.008 -1.300 3.264 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.650 -1.287 4.376 1.00 0.00 H ATOM 28 N GLY A 3 21.480 -1.445 1.335 1.00 0.00 N ATOM 29 CA GLY A 3 20.645 -1.474 0.146 1.00 0.00 C ATOM 30 C GLY A 3 19.300 -2.143 0.379 1.00 0.00 C ATOM 31 O GLY A 3 19.064 -3.248 -0.111 1.00 0.00 O ATOM 32 H GLY A 3 22.295 -1.991 1.365 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.473 -0.458 -0.182 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.167 -2.006 -0.636 1.00 0.00 H ATOM 35 N PHE A 4 18.425 -1.465 1.133 1.00 0.00 N ATOM 36 CA PHE A 4 17.085 -1.978 1.447 1.00 0.00 C ATOM 37 C PHE A 4 17.149 -3.145 2.434 1.00 0.00 C ATOM 38 O PHE A 4 17.708 -4.200 2.124 1.00 0.00 O ATOM 39 CB PHE A 4 16.368 -2.418 0.161 1.00 0.00 C ATOM 40 CG PHE A 4 14.962 -2.911 0.377 1.00 0.00 C ATOM 41 CD1 PHE A 4 13.907 -2.018 0.504 1.00 0.00 C ATOM 42 CD2 PHE A 4 14.695 -4.272 0.435 1.00 0.00 C ATOM 43 CE1 PHE A 4 12.615 -2.473 0.689 1.00 0.00 C ATOM 44 CE2 PHE A 4 13.405 -4.732 0.619 1.00 0.00 C ATOM 45 CZ PHE A 4 12.364 -3.831 0.746 1.00 0.00 C ATOM 46 H PHE A 4 18.686 -0.590 1.487 1.00 0.00 H ATOM 47 HA PHE A 4 16.525 -1.173 1.899 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.320 -1.579 -0.518 1.00 0.00 H ATOM 49 HB3 PHE A 4 16.931 -3.213 -0.303 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.103 -0.956 0.459 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.510 -4.977 0.338 1.00 0.00 H ATOM 52 HE1 PHE A 4 11.803 -1.768 0.789 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.211 -5.794 0.662 1.00 0.00 H ATOM 54 HZ PHE A 4 11.354 -4.189 0.889 1.00 0.00 H ATOM 55 N THR A 5 16.560 -2.950 3.621 1.00 0.00 N ATOM 56 CA THR A 5 16.539 -3.986 4.656 1.00 0.00 C ATOM 57 C THR A 5 15.484 -3.684 5.728 1.00 0.00 C ATOM 58 O THR A 5 14.378 -4.221 5.688 1.00 0.00 O ATOM 59 CB THR A 5 17.923 -4.146 5.337 1.00 0.00 C ATOM 60 OG1 THR A 5 18.918 -4.506 4.372 1.00 0.00 O ATOM 61 CG2 THR A 5 17.874 -5.208 6.429 1.00 0.00 C ATOM 62 H THR A 5 16.124 -2.091 3.800 1.00 0.00 H ATOM 63 HA THR A 5 16.288 -4.923 4.182 1.00 0.00 H ATOM 64 HB THR A 5 18.198 -3.204 5.786 1.00 0.00 H ATOM 65 HG1 THR A 5 19.397 -3.720 4.096 1.00 0.00 H ATOM 66 HG21 THR A 5 18.877 -5.534 6.661 1.00 0.00 H ATOM 67 HG22 THR A 5 17.292 -6.051 6.087 1.00 0.00 H ATOM 68 HG23 THR A 5 17.416 -4.792 7.315 1.00 0.00 H ATOM 69 N GLY A 6 15.836 -2.824 6.686 1.00 0.00 N ATOM 70 CA GLY A 6 14.915 -2.472 7.756 1.00 0.00 C ATOM 71 C GLY A 6 13.684 -1.728 7.270 1.00 0.00 C ATOM 72 O GLY A 6 12.608 -1.854 7.857 1.00 0.00 O ATOM 73 H GLY A 6 16.730 -2.426 6.669 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.598 -3.378 8.250 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.436 -1.853 8.472 1.00 0.00 H ATOM 76 N LYS A 7 13.845 -0.938 6.205 1.00 0.00 N ATOM 77 CA LYS A 7 12.742 -0.156 5.648 1.00 0.00 C ATOM 78 C LYS A 7 11.580 -1.033 5.151 1.00 0.00 C ATOM 79 O LYS A 7 10.493 -0.518 4.902 1.00 0.00 O ATOM 80 CB LYS A 7 13.231 0.737 4.503 1.00 0.00 C ATOM 81 CG LYS A 7 12.180 1.736 4.045 1.00 0.00 C ATOM 82 CD LYS A 7 12.395 2.177 2.607 1.00 0.00 C ATOM 83 CE LYS A 7 11.134 2.816 2.044 1.00 0.00 C ATOM 84 NZ LYS A 7 9.952 1.985 2.289 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.730 -0.872 5.789 1.00 0.00 H ATOM 86 HA LYS A 7 12.370 0.479 6.439 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.102 1.284 4.833 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.501 0.115 3.663 1.00 0.00 H ATOM 89 HG2 LYS A 7 11.207 1.280 4.124 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.222 2.604 4.687 1.00 0.00 H ATOM 91 HD2 LYS A 7 13.199 2.896 2.575 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.650 1.315 2.008 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.991 3.778 2.513 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.257 2.949 0.980 1.00 0.00 H ATOM 95 HZ1 LYS A 7 9.250 2.364 2.854 1.00 0.00 H ATOM 96 N ARG A 8 11.798 -2.350 5.008 1.00 0.00 N ATOM 97 CA ARG A 8 10.737 -3.253 4.541 1.00 0.00 C ATOM 98 C ARG A 8 9.423 -2.968 5.264 1.00 0.00 C ATOM 99 O ARG A 8 8.360 -2.909 4.644 1.00 0.00 O ATOM 100 CB ARG A 8 11.133 -4.714 4.759 1.00 0.00 C ATOM 101 CG ARG A 8 12.218 -5.211 3.818 1.00 0.00 C ATOM 102 CD ARG A 8 12.623 -6.649 4.128 1.00 0.00 C ATOM 103 NE ARG A 8 13.223 -6.785 5.459 1.00 0.00 N ATOM 104 CZ ARG A 8 12.530 -6.864 6.603 1.00 0.00 C ATOM 105 NH1 ARG A 8 11.202 -6.965 6.593 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 13.176 -6.877 7.765 1.00 0.00 N ATOM 107 H ARG A 8 12.676 -2.720 5.222 1.00 0.00 H ATOM 108 HA ARG A 8 10.596 -3.081 3.485 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.489 -4.826 5.772 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.259 -5.334 4.624 1.00 0.00 H ATOM 111 HG2 ARG A 8 11.848 -5.165 2.805 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.084 -4.574 3.916 1.00 0.00 H ATOM 113 HD2 ARG A 8 11.744 -7.274 4.076 1.00 0.00 H ATOM 114 HD3 ARG A 8 13.337 -6.973 3.386 1.00 0.00 H ATOM 115 HE ARG A 8 14.202 -6.779 5.509 1.00 0.00 H ATOM 116 HH11 ARG A 8 10.706 -6.986 5.727 1.00 0.00 H ATOM 117 HH12 ARG A 8 10.699 -7.018 7.457 1.00 0.00 H ATOM 118 HH21 ARG A 8 14.175 -6.829 7.784 1.00 0.00 H ATOM 119 HH22 ARG A 8 12.662 -6.934 8.622 1.00 0.00 H ATOM 120 N LYS A 9 9.516 -2.777 6.578 1.00 0.00 N ATOM 121 CA LYS A 9 8.343 -2.475 7.399 1.00 0.00 C ATOM 122 C LYS A 9 7.820 -1.072 7.096 1.00 0.00 C ATOM 123 O LYS A 9 6.625 -0.879 6.858 1.00 0.00 O ATOM 124 CB LYS A 9 8.691 -2.587 8.885 1.00 0.00 C ATOM 125 CG LYS A 9 9.182 -3.966 9.298 1.00 0.00 C ATOM 126 CD LYS A 9 9.536 -4.029 10.779 1.00 0.00 C ATOM 127 CE LYS A 9 10.788 -3.221 11.112 1.00 0.00 C ATOM 128 NZ LYS A 9 10.562 -1.747 11.037 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.400 -2.825 7.003 1.00 0.00 H ATOM 130 HA LYS A 9 7.575 -3.195 7.162 1.00 0.00 H ATOM 131 HB2 LYS A 9 9.465 -1.870 9.110 1.00 0.00 H ATOM 132 HB3 LYS A 9 7.813 -2.351 9.469 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.406 -4.686 9.096 1.00 0.00 H ATOM 134 HG3 LYS A 9 10.060 -4.210 8.717 1.00 0.00 H ATOM 135 HD2 LYS A 9 8.709 -3.638 11.352 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.704 -5.061 11.050 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.105 -3.474 12.112 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.567 -3.492 10.412 1.00 0.00 H ATOM 139 HZ1 LYS A 9 10.928 -1.374 10.137 1.00 0.00 H ATOM 140 HZ2 LYS A 9 11.055 -1.272 11.819 1.00 0.00 H ATOM 141 HZ3 LYS A 9 9.547 -1.534 11.104 1.00 0.00 H ATOM 142 N SER A 10 8.734 -0.099 7.108 1.00 0.00 N ATOM 143 CA SER A 10 8.394 1.298 6.837 1.00 0.00 C ATOM 144 C SER A 10 7.714 1.455 5.477 1.00 0.00 C ATOM 145 O SER A 10 6.787 2.252 5.331 1.00 0.00 O ATOM 146 CB SER A 10 9.650 2.173 6.895 1.00 0.00 C ATOM 147 OG SER A 10 10.317 2.032 8.139 1.00 0.00 O ATOM 148 H SER A 10 9.666 -0.330 7.306 1.00 0.00 H ATOM 149 HA SER A 10 7.709 1.624 7.604 1.00 0.00 H ATOM 150 HB2 SER A 10 10.326 1.884 6.104 1.00 0.00 H ATOM 151 HB3 SER A 10 9.370 3.209 6.767 1.00 0.00 H ATOM 152 HG SER A 10 9.863 2.550 8.807 1.00 0.00 H ATOM 153 N ASP A 11 8.178 0.694 4.486 1.00 0.00 N ATOM 154 CA ASP A 11 7.608 0.749 3.143 1.00 0.00 C ATOM 155 C ASP A 11 6.191 0.182 3.120 1.00 0.00 C ATOM 156 O ASP A 11 5.312 0.752 2.478 1.00 0.00 O ATOM 157 CB ASP A 11 8.498 0.009 2.135 1.00 0.00 C ATOM 158 CG ASP A 11 9.789 0.752 1.787 1.00 0.00 C ATOM 159 OD1 ASP A 11 10.632 0.218 1.066 1.00 0.00 O ATOM 160 H ASP A 11 8.920 0.079 4.664 1.00 0.00 H ATOM 161 HA ASP A 11 7.556 1.788 2.858 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.766 -0.952 2.547 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.939 -0.144 1.223 1.00 0.00 H ATOM 164 N ARG A 12 5.967 -0.932 3.828 1.00 0.00 N ATOM 165 CA ARG A 12 4.636 -1.547 3.877 1.00 0.00 C ATOM 166 C ARG A 12 3.597 -0.524 4.330 1.00 0.00 C ATOM 167 O ARG A 12 2.546 -0.378 3.703 1.00 0.00 O ATOM 168 CB ARG A 12 4.620 -2.764 4.811 1.00 0.00 C ATOM 169 CG ARG A 12 5.564 -3.879 4.380 1.00 0.00 C ATOM 170 CD ARG A 12 5.467 -5.093 5.298 1.00 0.00 C ATOM 171 NE ARG A 12 4.175 -5.776 5.187 1.00 0.00 N ATOM 172 CZ ARG A 12 3.827 -6.845 5.912 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.657 -7.344 6.827 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 2.641 -7.417 5.723 1.00 0.00 N ATOM 175 H ARG A 12 6.705 -1.338 4.329 1.00 0.00 H ATOM 176 HA ARG A 12 4.387 -1.868 2.878 1.00 0.00 H ATOM 177 HB2 ARG A 12 4.901 -2.447 5.805 1.00 0.00 H ATOM 178 HB3 ARG A 12 3.617 -3.166 4.842 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.312 -4.182 3.376 1.00 0.00 H ATOM 180 HG3 ARG A 12 6.578 -3.506 4.401 1.00 0.00 H ATOM 181 HD2 ARG A 12 6.251 -5.788 5.035 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.605 -4.768 6.318 1.00 0.00 H ATOM 183 HE ARG A 12 3.536 -5.428 4.531 1.00 0.00 H ATOM 184 HH11 ARG A 12 5.551 -6.921 6.979 1.00 0.00 H ATOM 185 HH12 ARG A 12 4.385 -8.143 7.364 1.00 0.00 H ATOM 186 HH21 ARG A 12 2.010 -7.047 5.040 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.379 -8.216 6.264 1.00 0.00 H ATOM 188 N LYS A 13 3.912 0.202 5.404 1.00 0.00 N ATOM 189 CA LYS A 13 3.017 1.237 5.921 1.00 0.00 C ATOM 190 C LYS A 13 2.990 2.444 4.976 1.00 0.00 C ATOM 191 O LYS A 13 1.958 3.097 4.822 1.00 0.00 O ATOM 192 CB LYS A 13 3.431 1.668 7.337 1.00 0.00 C ATOM 193 CG LYS A 13 4.831 2.263 7.427 1.00 0.00 C ATOM 194 CD LYS A 13 5.168 2.702 8.847 1.00 0.00 C ATOM 195 CE LYS A 13 5.152 1.535 9.827 1.00 0.00 C ATOM 196 NZ LYS A 13 6.186 0.510 9.505 1.00 0.00 N1+ ATOM 197 H LYS A 13 4.774 0.051 5.846 1.00 0.00 H ATOM 198 HA LYS A 13 2.023 0.815 5.963 1.00 0.00 H ATOM 199 HB2 LYS A 13 2.729 2.406 7.693 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.389 0.805 7.985 1.00 0.00 H ATOM 201 HG2 LYS A 13 5.548 1.520 7.113 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.889 3.120 6.772 1.00 0.00 H ATOM 203 HD2 LYS A 13 6.154 3.143 8.850 1.00 0.00 H ATOM 204 HD3 LYS A 13 4.443 3.437 9.165 1.00 0.00 H ATOM 205 HE2 LYS A 13 5.337 1.915 10.820 1.00 0.00 H ATOM 206 HE3 LYS A 13 4.177 1.071 9.798 1.00 0.00 H ATOM 207 HZ1 LYS A 13 6.057 0.164 8.533 1.00 0.00 H ATOM 208 HZ2 LYS A 13 6.107 -0.294 10.159 1.00 0.00 H ATOM 209 HZ3 LYS A 13 7.137 0.921 9.593 1.00 0.00 H ATOM 210 N LYS A 14 4.136 2.724 4.345 1.00 0.00 N ATOM 211 CA LYS A 14 4.266 3.841 3.406 1.00 0.00 C ATOM 212 C LYS A 14 3.349 3.674 2.190 1.00 0.00 C ATOM 213 O LYS A 14 2.732 4.637 1.745 1.00 0.00 O ATOM 214 CB LYS A 14 5.727 3.976 2.946 1.00 0.00 C ATOM 215 CG LYS A 14 5.927 4.893 1.740 1.00 0.00 C ATOM 216 CD LYS A 14 6.296 6.323 2.137 1.00 0.00 C ATOM 217 CE LYS A 14 5.288 6.953 3.093 1.00 0.00 C ATOM 218 NZ LYS A 14 4.145 7.618 2.437 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.919 2.160 4.514 1.00 0.00 H ATOM 220 HA LYS A 14 3.978 4.738 3.931 1.00 0.00 H ATOM 221 HB2 LYS A 14 6.314 4.366 3.764 1.00 0.00 H ATOM 222 HB3 LYS A 14 6.100 2.995 2.688 1.00 0.00 H ATOM 223 HG2 LYS A 14 6.722 4.492 1.130 1.00 0.00 H ATOM 224 HG3 LYS A 14 5.016 4.912 1.166 1.00 0.00 H ATOM 225 HD2 LYS A 14 7.262 6.308 2.618 1.00 0.00 H ATOM 226 HD3 LYS A 14 6.354 6.927 1.243 1.00 0.00 H ATOM 227 HE2 LYS A 14 4.906 6.181 3.739 1.00 0.00 H ATOM 228 HE3 LYS A 14 5.809 7.683 3.696 1.00 0.00 H ATOM 229 HZ1 LYS A 14 3.665 8.283 2.974 1.00 0.00 H ATOM 230 N LYS A 15 3.275 2.459 1.646 1.00 0.00 N ATOM 231 CA LYS A 15 2.438 2.196 0.469 1.00 0.00 C ATOM 232 C LYS A 15 0.976 2.546 0.738 1.00 0.00 C ATOM 233 O LYS A 15 0.282 3.063 -0.138 1.00 0.00 O ATOM 234 CB LYS A 15 2.538 0.729 0.034 1.00 0.00 C ATOM 235 CG LYS A 15 3.953 0.259 -0.264 1.00 0.00 C ATOM 236 CD LYS A 15 3.953 -1.128 -0.884 1.00 0.00 C ATOM 237 CE LYS A 15 5.357 -1.704 -0.976 1.00 0.00 C ATOM 238 NZ LYS A 15 5.365 -3.046 -1.623 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.796 1.727 2.037 1.00 0.00 H ATOM 240 HA LYS A 15 2.798 2.826 -0.332 1.00 0.00 H ATOM 241 HB2 LYS A 15 2.138 0.108 0.820 1.00 0.00 H ATOM 242 HB3 LYS A 15 1.943 0.591 -0.857 1.00 0.00 H ATOM 243 HG2 LYS A 15 4.419 0.950 -0.949 1.00 0.00 H ATOM 244 HG3 LYS A 15 4.511 0.229 0.656 1.00 0.00 H ATOM 245 HD2 LYS A 15 3.345 -1.783 -0.278 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.535 -1.065 -1.879 1.00 0.00 H ATOM 247 HE2 LYS A 15 5.974 -1.032 -1.553 1.00 0.00 H ATOM 248 HE3 LYS A 15 5.761 -1.794 0.022 1.00 0.00 H ATOM 249 HZ1 LYS A 15 4.654 -3.661 -1.177 1.00 0.00 H ATOM 250 HZ2 LYS A 15 6.302 -3.488 -1.524 1.00 0.00 H ATOM 251 HZ3 LYS A 15 5.143 -2.956 -2.636 1.00 0.00 H ATOM 252 N ASN A 16 0.512 2.254 1.949 1.00 0.00 N ATOM 253 CA ASN A 16 -0.869 2.536 2.332 1.00 0.00 C ATOM 254 C ASN A 16 -1.058 4.025 2.640 1.00 0.00 C ATOM 255 O ASN A 16 -2.035 4.638 2.205 1.00 0.00 O ATOM 256 CB ASN A 16 -1.259 1.691 3.552 1.00 0.00 C ATOM 257 CG ASN A 16 -2.745 1.750 3.900 1.00 0.00 C ATOM 258 OD1 ASN A 16 -3.144 1.334 4.988 1.00 0.00 O ATOM 259 ND2 ASN A 16 -3.581 2.234 2.981 1.00 0.00 N ATOM 260 H ASN A 16 1.114 1.837 2.602 1.00 0.00 H ATOM 261 HA ASN A 16 -1.501 2.268 1.501 1.00 0.00 H ATOM 262 HB2 ASN A 16 -1.002 0.661 3.359 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.697 2.036 4.410 1.00 0.00 H ATOM 264 HD21 ASN A 16 -3.215 2.530 2.124 1.00 0.00 H ATOM 265 HD22 ASN A 16 -4.535 2.273 3.203 1.00 0.00 H ATOM 266 N GLN A 17 -0.122 4.589 3.407 1.00 0.00 N ATOM 267 CA GLN A 17 -0.181 5.999 3.801 1.00 0.00 C ATOM 268 C GLN A 17 0.056 6.944 2.611 1.00 0.00 C ATOM 269 O GLN A 17 -0.547 8.016 2.540 1.00 0.00 O ATOM 270 CB GLN A 17 0.830 6.275 4.924 1.00 0.00 C ATOM 271 CG GLN A 17 2.268 6.387 4.459 1.00 0.00 C ATOM 272 CD GLN A 17 3.249 6.448 5.616 1.00 0.00 C ATOM 273 OE1 GLN A 17 3.374 5.496 6.386 1.00 0.00 O ATOM 274 NE2 GLN A 17 3.949 7.571 5.750 1.00 0.00 N ATOM 275 H GLN A 17 0.622 4.039 3.726 1.00 0.00 H ATOM 276 HA GLN A 17 -1.173 6.184 4.183 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.562 7.196 5.418 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.778 5.466 5.638 1.00 0.00 H ATOM 279 HG2 GLN A 17 2.502 5.528 3.850 1.00 0.00 H ATOM 280 HG3 GLN A 17 2.370 7.285 3.869 1.00 0.00 H ATOM 281 HE21 GLN A 17 3.797 8.293 5.104 1.00 0.00 H ATOM 282 HE22 GLN A 17 4.590 7.631 6.489 1.00 0.00 H ATOM 283 N ASP A 18 0.936 6.545 1.685 1.00 0.00 N ATOM 284 CA ASP A 18 1.246 7.363 0.509 1.00 0.00 C ATOM 285 C ASP A 18 1.436 6.500 -0.746 1.00 0.00 C ATOM 286 O ASP A 18 2.346 6.733 -1.543 1.00 0.00 O ATOM 287 CB ASP A 18 2.501 8.216 0.764 1.00 0.00 C ATOM 288 CG ASP A 18 3.708 7.395 1.191 1.00 0.00 C ATOM 289 OD1 ASP A 18 4.220 6.590 0.418 1.00 0.00 O ATOM 290 H ASP A 18 1.388 5.683 1.797 1.00 0.00 H ATOM 291 HA ASP A 18 0.408 8.024 0.341 1.00 0.00 H ATOM 292 HB2 ASP A 18 2.756 8.742 -0.143 1.00 0.00 H ATOM 293 HB3 ASP A 18 2.283 8.931 1.541 1.00 0.00 H HETATM 294 N NH2 A 19 0.564 5.515 -0.933 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.138 5.381 -0.262 1.00 0.00 H HETATM 296 HN2 NH2 A 19 0.658 4.963 -1.736 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 16 ATOM 1 N PHE A 1 25.176 -3.939 4.219 1.00 0.00 N ATOM 2 CA PHE A 1 25.170 -5.318 3.728 1.00 0.00 C ATOM 3 C PHE A 1 23.800 -5.975 3.919 1.00 0.00 C ATOM 4 O PHE A 1 23.422 -6.855 3.143 1.00 0.00 O ATOM 5 CB PHE A 1 26.254 -6.158 4.421 1.00 0.00 C ATOM 6 CG PHE A 1 27.653 -5.914 3.912 1.00 0.00 C ATOM 7 CD1 PHE A 1 28.215 -4.645 3.938 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.409 -6.964 3.411 1.00 0.00 C ATOM 9 CE1 PHE A 1 29.499 -4.431 3.474 1.00 0.00 C ATOM 10 CE2 PHE A 1 29.694 -6.755 2.948 1.00 0.00 C ATOM 11 CZ PHE A 1 30.240 -5.486 2.978 1.00 0.00 C ATOM 12 H1 PHE A 1 25.938 -3.357 4.020 1.00 0.00 H ATOM 13 HA PHE A 1 25.386 -5.283 2.669 1.00 0.00 H ATOM 14 HB2 PHE A 1 26.245 -5.941 5.477 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.027 -7.206 4.275 1.00 0.00 H ATOM 16 HD1 PHE A 1 27.641 -3.819 4.328 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.983 -7.957 3.384 1.00 0.00 H ATOM 18 HE1 PHE A 1 29.923 -3.438 3.498 1.00 0.00 H ATOM 19 HE2 PHE A 1 30.270 -7.584 2.561 1.00 0.00 H ATOM 20 HZ PHE A 1 31.244 -5.322 2.618 1.00 0.00 H ATOM 21 N GLY A 2 23.061 -5.549 4.954 1.00 0.00 N ATOM 22 CA GLY A 2 21.742 -6.112 5.226 1.00 0.00 C ATOM 23 C GLY A 2 20.841 -6.122 3.999 1.00 0.00 C ATOM 24 O GLY A 2 20.798 -5.145 3.249 1.00 0.00 O ATOM 25 H GLY A 2 23.416 -4.848 5.541 1.00 0.00 H ATOM 26 HA2 GLY A 2 21.860 -7.127 5.579 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.266 -5.529 6.003 1.00 0.00 H ATOM 28 N GLY A 3 20.130 -7.237 3.793 1.00 0.00 N ATOM 29 CA GLY A 3 19.244 -7.365 2.645 1.00 0.00 C ATOM 30 C GLY A 3 18.173 -6.292 2.591 1.00 0.00 C ATOM 31 O GLY A 3 18.231 -5.399 1.743 1.00 0.00 O ATOM 32 H GLY A 3 20.215 -7.982 4.424 1.00 0.00 H ATOM 33 HA2 GLY A 3 19.835 -7.313 1.741 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.762 -8.332 2.689 1.00 0.00 H ATOM 35 N PHE A 4 17.195 -6.377 3.492 1.00 0.00 N ATOM 36 CA PHE A 4 16.111 -5.400 3.531 1.00 0.00 C ATOM 37 C PHE A 4 16.532 -4.154 4.296 1.00 0.00 C ATOM 38 O PHE A 4 16.848 -4.215 5.486 1.00 0.00 O ATOM 39 CB PHE A 4 14.845 -6.011 4.145 1.00 0.00 C ATOM 40 CG PHE A 4 14.325 -7.191 3.370 1.00 0.00 C ATOM 41 CD1 PHE A 4 14.176 -7.118 1.992 1.00 0.00 C ATOM 42 CD2 PHE A 4 13.998 -8.373 4.014 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.710 -8.202 1.274 1.00 0.00 C ATOM 44 CE2 PHE A 4 13.533 -9.461 3.299 1.00 0.00 C ATOM 45 CZ PHE A 4 13.389 -9.375 1.928 1.00 0.00 C ATOM 46 H PHE A 4 17.203 -7.113 4.141 1.00 0.00 H ATOM 47 HA PHE A 4 15.896 -5.111 2.513 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.062 -6.342 5.150 1.00 0.00 H ATOM 49 HB3 PHE A 4 14.068 -5.262 4.176 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.426 -6.202 1.481 1.00 0.00 H ATOM 51 HD2 PHE A 4 14.109 -8.440 5.087 1.00 0.00 H ATOM 52 HE1 PHE A 4 13.601 -8.132 0.202 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.283 -10.378 3.812 1.00 0.00 H ATOM 54 HZ PHE A 4 13.028 -10.225 1.367 1.00 0.00 H ATOM 55 N THR A 5 16.539 -3.023 3.596 1.00 0.00 N ATOM 56 CA THR A 5 16.925 -1.750 4.190 1.00 0.00 C ATOM 57 C THR A 5 15.846 -1.229 5.137 1.00 0.00 C ATOM 58 O THR A 5 14.653 -1.290 4.829 1.00 0.00 O ATOM 59 CB THR A 5 17.223 -0.691 3.108 1.00 0.00 C ATOM 60 OG1 THR A 5 16.094 -0.536 2.240 1.00 0.00 O ATOM 61 CG2 THR A 5 18.447 -1.086 2.293 1.00 0.00 C ATOM 62 H THR A 5 16.278 -3.045 2.650 1.00 0.00 H ATOM 63 HA THR A 5 17.830 -1.914 4.757 1.00 0.00 H ATOM 64 HB THR A 5 17.424 0.253 3.593 1.00 0.00 H ATOM 65 HG1 THR A 5 15.827 0.386 2.221 1.00 0.00 H ATOM 66 HG21 THR A 5 18.185 -1.885 1.614 1.00 0.00 H ATOM 67 HG22 THR A 5 19.227 -1.422 2.958 1.00 0.00 H ATOM 68 HG23 THR A 5 18.796 -0.234 1.730 1.00 0.00 H ATOM 69 N GLY A 6 16.284 -0.717 6.290 1.00 0.00 N ATOM 70 CA GLY A 6 15.365 -0.182 7.285 1.00 0.00 C ATOM 71 C GLY A 6 14.416 0.857 6.713 1.00 0.00 C ATOM 72 O GLY A 6 13.249 0.908 7.090 1.00 0.00 O ATOM 73 H GLY A 6 17.246 -0.702 6.467 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.785 -0.994 7.698 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.940 0.276 8.078 1.00 0.00 H ATOM 76 N LYS A 7 14.929 1.680 5.796 1.00 0.00 N ATOM 77 CA LYS A 7 14.144 2.734 5.147 1.00 0.00 C ATOM 78 C LYS A 7 12.782 2.233 4.641 1.00 0.00 C ATOM 79 O LYS A 7 11.784 2.952 4.728 1.00 0.00 O ATOM 80 CB LYS A 7 14.958 3.326 3.984 1.00 0.00 C ATOM 81 CG LYS A 7 14.125 4.039 2.926 1.00 0.00 C ATOM 82 CD LYS A 7 13.342 5.209 3.504 1.00 0.00 C ATOM 83 CE LYS A 7 12.237 5.648 2.556 1.00 0.00 C ATOM 84 NZ LYS A 7 11.217 4.613 2.404 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.872 1.577 5.544 1.00 0.00 H ATOM 86 HA LYS A 7 13.973 3.509 5.876 1.00 0.00 H ATOM 87 HB2 LYS A 7 15.667 4.033 4.386 1.00 0.00 H ATOM 88 HB3 LYS A 7 15.500 2.525 3.503 1.00 0.00 H ATOM 89 HG2 LYS A 7 14.786 4.411 2.157 1.00 0.00 H ATOM 90 HG3 LYS A 7 13.432 3.331 2.493 1.00 0.00 H ATOM 91 HD2 LYS A 7 12.903 4.911 4.444 1.00 0.00 H ATOM 92 HD3 LYS A 7 14.015 6.039 3.665 1.00 0.00 H ATOM 93 HE2 LYS A 7 11.775 6.543 2.948 1.00 0.00 H ATOM 94 HE3 LYS A 7 12.670 5.859 1.590 1.00 0.00 H ATOM 95 HZ1 LYS A 7 11.415 3.723 2.765 1.00 0.00 H ATOM 96 N ARG A 8 12.753 1.011 4.106 1.00 0.00 N ATOM 97 CA ARG A 8 11.523 0.422 3.567 1.00 0.00 C ATOM 98 C ARG A 8 10.395 0.383 4.599 1.00 0.00 C ATOM 99 O ARG A 8 9.222 0.491 4.246 1.00 0.00 O ATOM 100 CB ARG A 8 11.787 -0.995 3.048 1.00 0.00 C ATOM 101 CG ARG A 8 12.802 -1.059 1.920 1.00 0.00 C ATOM 102 CD ARG A 8 13.017 -2.491 1.450 1.00 0.00 C ATOM 103 NE ARG A 8 13.932 -2.570 0.311 1.00 0.00 N ATOM 104 CZ ARG A 8 13.679 -2.057 -0.903 1.00 0.00 C ATOM 105 NH1 ARG A 8 12.522 -1.447 -1.155 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 14.588 -2.159 -1.865 1.00 0.00 N ATOM 107 H ARG A 8 13.584 0.495 4.060 1.00 0.00 H ATOM 108 HA ARG A 8 11.203 1.037 2.738 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.152 -1.600 3.864 1.00 0.00 H ATOM 110 HB3 ARG A 8 10.858 -1.414 2.689 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.446 -0.465 1.092 1.00 0.00 H ATOM 112 HG3 ARG A 8 13.742 -0.663 2.272 1.00 0.00 H ATOM 113 HD2 ARG A 8 13.430 -3.061 2.268 1.00 0.00 H ATOM 114 HD3 ARG A 8 12.063 -2.911 1.166 1.00 0.00 H ATOM 115 HE ARG A 8 14.789 -3.022 0.457 1.00 0.00 H ATOM 116 HH11 ARG A 8 11.829 -1.365 -0.440 1.00 0.00 H ATOM 117 HH12 ARG A 8 12.345 -1.070 -2.064 1.00 0.00 H ATOM 118 HH21 ARG A 8 15.460 -2.615 -1.686 1.00 0.00 H ATOM 119 HH22 ARG A 8 14.399 -1.783 -2.772 1.00 0.00 H ATOM 120 N LYS A 9 10.745 0.206 5.866 1.00 0.00 N ATOM 121 CA LYS A 9 9.735 0.130 6.921 1.00 0.00 C ATOM 122 C LYS A 9 8.745 1.295 6.834 1.00 0.00 C ATOM 123 O LYS A 9 7.533 1.090 6.914 1.00 0.00 O ATOM 124 CB LYS A 9 10.383 0.095 8.316 1.00 0.00 C ATOM 125 CG LYS A 9 10.890 1.443 8.809 1.00 0.00 C ATOM 126 CD LYS A 9 11.545 1.325 10.176 1.00 0.00 C ATOM 127 CE LYS A 9 12.020 2.678 10.688 1.00 0.00 C ATOM 128 NZ LYS A 9 10.900 3.656 10.811 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.695 0.109 6.093 1.00 0.00 H ATOM 130 HA LYS A 9 9.189 -0.790 6.774 1.00 0.00 H ATOM 131 HB2 LYS A 9 9.655 -0.267 9.025 1.00 0.00 H ATOM 132 HB3 LYS A 9 11.217 -0.591 8.294 1.00 0.00 H ATOM 133 HG2 LYS A 9 11.613 1.827 8.105 1.00 0.00 H ATOM 134 HG3 LYS A 9 10.055 2.125 8.878 1.00 0.00 H ATOM 135 HD2 LYS A 9 10.825 0.921 10.874 1.00 0.00 H ATOM 136 HD3 LYS A 9 12.390 0.657 10.103 1.00 0.00 H ATOM 137 HE2 LYS A 9 12.473 2.541 11.658 1.00 0.00 H ATOM 138 HE3 LYS A 9 12.756 3.069 10.000 1.00 0.00 H ATOM 139 HZ1 LYS A 9 10.598 3.970 9.867 1.00 0.00 H ATOM 140 HZ2 LYS A 9 11.207 4.485 11.358 1.00 0.00 H ATOM 141 HZ3 LYS A 9 10.091 3.215 11.294 1.00 0.00 H ATOM 142 N SER A 10 9.267 2.512 6.679 1.00 0.00 N ATOM 143 CA SER A 10 8.426 3.707 6.594 1.00 0.00 C ATOM 144 C SER A 10 7.744 3.826 5.232 1.00 0.00 C ATOM 145 O SER A 10 6.539 4.077 5.155 1.00 0.00 O ATOM 146 CB SER A 10 9.253 4.961 6.881 1.00 0.00 C ATOM 147 OG SER A 10 9.722 4.963 8.218 1.00 0.00 O ATOM 148 H SER A 10 10.240 2.611 6.627 1.00 0.00 H ATOM 149 HA SER A 10 7.661 3.619 7.348 1.00 0.00 H ATOM 150 HB2 SER A 10 10.104 4.989 6.216 1.00 0.00 H ATOM 151 HB3 SER A 10 8.645 5.839 6.724 1.00 0.00 H ATOM 152 HG SER A 10 10.565 5.421 8.260 1.00 0.00 H ATOM 153 N ASP A 11 8.518 3.642 4.162 1.00 0.00 N ATOM 154 CA ASP A 11 7.981 3.728 2.804 1.00 0.00 C ATOM 155 C ASP A 11 6.922 2.654 2.563 1.00 0.00 C ATOM 156 O ASP A 11 5.876 2.935 1.979 1.00 0.00 O ATOM 157 CB ASP A 11 9.105 3.618 1.771 1.00 0.00 C ATOM 158 CG ASP A 11 10.039 4.815 1.818 1.00 0.00 C ATOM 159 OD1 ASP A 11 9.692 5.904 1.355 1.00 0.00 O ATOM 160 H ASP A 11 9.470 3.444 4.289 1.00 0.00 H ATOM 161 HA ASP A 11 7.512 4.693 2.702 1.00 0.00 H ATOM 162 HB2 ASP A 11 9.680 2.726 1.963 1.00 0.00 H ATOM 163 HB3 ASP A 11 8.677 3.560 0.783 1.00 0.00 H ATOM 164 N ARG A 12 7.191 1.431 3.030 1.00 0.00 N ATOM 165 CA ARG A 12 6.241 0.330 2.873 1.00 0.00 C ATOM 166 C ARG A 12 4.999 0.558 3.744 1.00 0.00 C ATOM 167 O ARG A 12 3.898 0.150 3.371 1.00 0.00 O ATOM 168 CB ARG A 12 6.897 -1.020 3.195 1.00 0.00 C ATOM 169 CG ARG A 12 6.096 -2.216 2.689 1.00 0.00 C ATOM 170 CD ARG A 12 5.233 -2.845 3.775 1.00 0.00 C ATOM 171 NE ARG A 12 6.032 -3.569 4.768 1.00 0.00 N ATOM 172 CZ ARG A 12 5.513 -4.349 5.721 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.195 -4.499 5.829 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 6.316 -4.978 6.574 1.00 0.00 N ATOM 175 H ARG A 12 8.038 1.272 3.497 1.00 0.00 H ATOM 176 HA ARG A 12 5.927 0.323 1.839 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.875 -1.049 2.735 1.00 0.00 H ATOM 178 HB3 ARG A 12 7.008 -1.111 4.265 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.452 -1.886 1.887 1.00 0.00 H ATOM 180 HG3 ARG A 12 6.783 -2.960 2.312 1.00 0.00 H ATOM 181 HD2 ARG A 12 4.678 -2.064 4.274 1.00 0.00 H ATOM 182 HD3 ARG A 12 4.542 -3.532 3.310 1.00 0.00 H ATOM 183 HE ARG A 12 7.006 -3.475 4.720 1.00 0.00 H ATOM 184 HH11 ARG A 12 3.582 -4.028 5.196 1.00 0.00 H ATOM 185 HH12 ARG A 12 3.817 -5.090 6.543 1.00 0.00 H ATOM 186 HH21 ARG A 12 7.307 -4.867 6.502 1.00 0.00 H ATOM 187 HH22 ARG A 12 5.930 -5.567 7.285 1.00 0.00 H ATOM 188 N LYS A 13 5.175 1.233 4.894 1.00 0.00 N ATOM 189 CA LYS A 13 4.053 1.534 5.789 1.00 0.00 C ATOM 190 C LYS A 13 2.996 2.343 5.040 1.00 0.00 C ATOM 191 O LYS A 13 1.821 1.976 5.010 1.00 0.00 O ATOM 192 CB LYS A 13 4.525 2.319 7.021 1.00 0.00 C ATOM 193 CG LYS A 13 3.403 2.673 7.986 1.00 0.00 C ATOM 194 CD LYS A 13 3.886 3.586 9.104 1.00 0.00 C ATOM 195 CE LYS A 13 4.366 4.929 8.569 1.00 0.00 C ATOM 196 NZ LYS A 13 3.278 5.673 7.872 1.00 0.00 N1+ ATOM 197 H LYS A 13 6.074 1.550 5.132 1.00 0.00 H ATOM 198 HA LYS A 13 3.619 0.598 6.106 1.00 0.00 H ATOM 199 HB2 LYS A 13 5.255 1.729 7.554 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.989 3.237 6.692 1.00 0.00 H ATOM 201 HG2 LYS A 13 2.619 3.175 7.440 1.00 0.00 H ATOM 202 HG3 LYS A 13 3.015 1.764 8.420 1.00 0.00 H ATOM 203 HD2 LYS A 13 3.073 3.758 9.792 1.00 0.00 H ATOM 204 HD3 LYS A 13 4.701 3.105 9.623 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.721 5.524 9.398 1.00 0.00 H ATOM 206 HE3 LYS A 13 5.177 4.758 7.877 1.00 0.00 H ATOM 207 HZ1 LYS A 13 3.537 6.674 7.767 1.00 0.00 H ATOM 208 HZ2 LYS A 13 2.396 5.612 8.419 1.00 0.00 H ATOM 209 HZ3 LYS A 13 3.116 5.268 6.927 1.00 0.00 H ATOM 210 N LYS A 14 3.445 3.432 4.407 1.00 0.00 N ATOM 211 CA LYS A 14 2.571 4.296 3.612 1.00 0.00 C ATOM 212 C LYS A 14 2.078 3.565 2.359 1.00 0.00 C ATOM 213 O LYS A 14 0.981 3.831 1.872 1.00 0.00 O ATOM 214 CB LYS A 14 3.319 5.580 3.216 1.00 0.00 C ATOM 215 CG LYS A 14 3.371 6.635 4.314 1.00 0.00 C ATOM 216 CD LYS A 14 2.337 7.742 4.107 1.00 0.00 C ATOM 217 CE LYS A 14 0.903 7.244 4.239 1.00 0.00 C ATOM 218 NZ LYS A 14 0.407 6.635 3.004 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.402 3.644 4.458 1.00 0.00 H ATOM 220 HA LYS A 14 1.711 4.557 4.223 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.334 5.317 2.959 1.00 0.00 H ATOM 222 HB3 LYS A 14 2.841 6.012 2.351 1.00 0.00 H ATOM 223 HG2 LYS A 14 3.180 6.158 5.263 1.00 0.00 H ATOM 224 HG3 LYS A 14 4.357 7.076 4.326 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.502 8.515 4.840 1.00 0.00 H ATOM 226 HD3 LYS A 14 2.471 8.154 3.116 1.00 0.00 H ATOM 227 HE2 LYS A 14 0.864 6.509 5.029 1.00 0.00 H ATOM 228 HE3 LYS A 14 0.270 8.080 4.498 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.038 6.112 2.471 1.00 0.00 H ATOM 230 N LYS A 15 2.898 2.638 1.847 1.00 0.00 N ATOM 231 CA LYS A 15 2.547 1.859 0.658 1.00 0.00 C ATOM 232 C LYS A 15 1.277 1.046 0.923 1.00 0.00 C ATOM 233 O LYS A 15 0.317 1.097 0.152 1.00 0.00 O ATOM 234 CB LYS A 15 3.706 0.915 0.294 1.00 0.00 C ATOM 235 CG LYS A 15 3.839 0.589 -1.191 1.00 0.00 C ATOM 236 CD LYS A 15 2.556 0.024 -1.789 1.00 0.00 C ATOM 237 CE LYS A 15 1.659 1.121 -2.350 1.00 0.00 C ATOM 238 NZ LYS A 15 2.315 1.871 -3.459 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.758 2.468 2.285 1.00 0.00 H ATOM 240 HA LYS A 15 2.370 2.544 -0.157 1.00 0.00 H ATOM 241 HB2 LYS A 15 4.630 1.369 0.616 1.00 0.00 H ATOM 242 HB3 LYS A 15 3.573 -0.014 0.832 1.00 0.00 H ATOM 243 HG2 LYS A 15 4.102 1.490 -1.723 1.00 0.00 H ATOM 244 HG3 LYS A 15 4.629 -0.139 -1.313 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.814 -0.656 -2.588 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.018 -0.511 -1.020 1.00 0.00 H ATOM 247 HE2 LYS A 15 0.752 0.671 -2.724 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.415 1.812 -1.558 1.00 0.00 H ATOM 249 HZ1 LYS A 15 1.597 2.345 -4.043 1.00 0.00 H ATOM 250 HZ2 LYS A 15 2.859 1.219 -4.060 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.961 2.589 -3.073 1.00 0.00 H ATOM 252 N ASN A 16 1.283 0.306 2.031 1.00 0.00 N ATOM 253 CA ASN A 16 0.143 -0.522 2.425 1.00 0.00 C ATOM 254 C ASN A 16 -1.043 0.340 2.849 1.00 0.00 C ATOM 255 O ASN A 16 -2.177 0.104 2.428 1.00 0.00 O ATOM 256 CB ASN A 16 0.530 -1.446 3.588 1.00 0.00 C ATOM 257 CG ASN A 16 1.644 -2.439 3.258 1.00 0.00 C ATOM 258 OD1 ASN A 16 2.110 -3.158 4.142 1.00 0.00 O ATOM 259 ND2 ASN A 16 2.076 -2.502 1.997 1.00 0.00 N ATOM 260 H ASN A 16 2.079 0.321 2.603 1.00 0.00 H ATOM 261 HA ASN A 16 -0.145 -1.122 1.578 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.859 -0.838 4.418 1.00 0.00 H ATOM 263 HB3 ASN A 16 -0.342 -2.005 3.891 1.00 0.00 H ATOM 264 HD21 ASN A 16 1.667 -1.915 1.329 1.00 0.00 H ATOM 265 HD22 ASN A 16 2.792 -3.139 1.787 1.00 0.00 H ATOM 266 N GLN A 17 -0.769 1.327 3.699 1.00 0.00 N ATOM 267 CA GLN A 17 -1.800 2.221 4.209 1.00 0.00 C ATOM 268 C GLN A 17 -2.428 3.075 3.107 1.00 0.00 C ATOM 269 O GLN A 17 -3.608 2.916 2.790 1.00 0.00 O ATOM 270 CB GLN A 17 -1.215 3.104 5.310 1.00 0.00 C ATOM 271 CG GLN A 17 -1.196 2.426 6.671 1.00 0.00 C ATOM 272 CD GLN A 17 -1.531 3.376 7.807 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.855 4.383 8.010 1.00 0.00 O ATOM 274 NE2 GLN A 17 -2.585 3.057 8.557 1.00 0.00 N ATOM 275 H GLN A 17 0.156 1.448 4.001 1.00 0.00 H ATOM 276 HA GLN A 17 -2.573 1.605 4.640 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.198 3.354 5.046 1.00 0.00 H ATOM 278 HB3 GLN A 17 -1.787 4.014 5.383 1.00 0.00 H ATOM 279 HG2 GLN A 17 -1.920 1.623 6.668 1.00 0.00 H ATOM 280 HG3 GLN A 17 -0.211 2.017 6.841 1.00 0.00 H ATOM 281 HE21 GLN A 17 -3.080 2.238 8.342 1.00 0.00 H ATOM 282 HE22 GLN A 17 -2.825 3.655 9.296 1.00 0.00 H ATOM 283 N ASP A 18 -1.638 3.976 2.531 1.00 0.00 N ATOM 284 CA ASP A 18 -2.119 4.858 1.465 1.00 0.00 C ATOM 285 C ASP A 18 -2.279 4.094 0.150 1.00 0.00 C ATOM 286 O ASP A 18 -3.319 4.174 -0.502 1.00 0.00 O ATOM 287 CB ASP A 18 -1.159 6.035 1.268 1.00 0.00 C ATOM 288 CG ASP A 18 -0.846 6.748 2.569 1.00 0.00 C ATOM 289 OD1 ASP A 18 -1.718 7.377 3.172 1.00 0.00 O ATOM 290 H ASP A 18 -0.708 4.053 2.830 1.00 0.00 H ATOM 291 HA ASP A 18 -3.084 5.239 1.762 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.234 5.673 0.847 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.603 6.746 0.589 1.00 0.00 H HETATM 294 N NH2 A 19 -1.248 3.347 -0.240 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.448 3.323 0.326 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -1.332 2.846 -1.079 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 17 ATOM 1 N PHE A 1 19.612 7.987 -2.366 1.00 0.00 N ATOM 2 CA PHE A 1 20.302 7.007 -3.199 1.00 0.00 C ATOM 3 C PHE A 1 20.072 5.591 -2.665 1.00 0.00 C ATOM 4 O PHE A 1 19.619 5.415 -1.533 1.00 0.00 O ATOM 5 CB PHE A 1 21.803 7.316 -3.249 1.00 0.00 C ATOM 6 CG PHE A 1 22.475 6.840 -4.509 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.980 7.208 -5.751 1.00 0.00 C ATOM 8 CD2 PHE A 1 23.601 6.031 -4.454 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.592 6.779 -6.913 1.00 0.00 C ATOM 10 CE2 PHE A 1 24.219 5.600 -5.613 1.00 0.00 C ATOM 11 CZ PHE A 1 23.712 5.974 -6.844 1.00 0.00 C ATOM 12 H1 PHE A 1 19.817 8.033 -1.409 1.00 0.00 H ATOM 13 HA PHE A 1 19.894 7.075 -4.196 1.00 0.00 H ATOM 14 HB2 PHE A 1 21.948 8.384 -3.181 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.290 6.838 -2.411 1.00 0.00 H ATOM 16 HD1 PHE A 1 21.104 7.836 -5.807 1.00 0.00 H ATOM 17 HD2 PHE A 1 23.997 5.737 -3.493 1.00 0.00 H ATOM 18 HE1 PHE A 1 22.195 7.073 -7.874 1.00 0.00 H ATOM 19 HE2 PHE A 1 25.096 4.972 -5.559 1.00 0.00 H ATOM 20 HZ PHE A 1 24.194 5.639 -7.753 1.00 0.00 H ATOM 21 N GLY A 2 20.380 4.585 -3.491 1.00 0.00 N ATOM 22 CA GLY A 2 20.197 3.195 -3.092 1.00 0.00 C ATOM 23 C GLY A 2 21.213 2.730 -2.057 1.00 0.00 C ATOM 24 O GLY A 2 21.970 1.790 -2.308 1.00 0.00 O ATOM 25 H GLY A 2 20.731 4.790 -4.383 1.00 0.00 H ATOM 26 HA2 GLY A 2 19.206 3.079 -2.679 1.00 0.00 H ATOM 27 HA3 GLY A 2 20.282 2.570 -3.968 1.00 0.00 H ATOM 28 N GLY A 3 21.222 3.385 -0.894 1.00 0.00 N ATOM 29 CA GLY A 3 22.145 3.028 0.171 1.00 0.00 C ATOM 30 C GLY A 3 21.760 1.736 0.872 1.00 0.00 C ATOM 31 O GLY A 3 22.621 0.906 1.169 1.00 0.00 O ATOM 32 H GLY A 3 20.590 4.120 -0.756 1.00 0.00 H ATOM 33 HA2 GLY A 3 23.135 2.918 -0.246 1.00 0.00 H ATOM 34 HA3 GLY A 3 22.160 3.825 0.898 1.00 0.00 H ATOM 35 N PHE A 4 20.464 1.574 1.141 1.00 0.00 N ATOM 36 CA PHE A 4 19.954 0.382 1.816 1.00 0.00 C ATOM 37 C PHE A 4 18.451 0.245 1.584 1.00 0.00 C ATOM 38 O PHE A 4 17.736 1.247 1.518 1.00 0.00 O ATOM 39 CB PHE A 4 20.229 0.470 3.322 1.00 0.00 C ATOM 40 CG PHE A 4 20.491 -0.861 3.975 1.00 0.00 C ATOM 41 CD1 PHE A 4 19.451 -1.615 4.503 1.00 0.00 C ATOM 42 CD2 PHE A 4 21.784 -1.357 4.063 1.00 0.00 C ATOM 43 CE1 PHE A 4 19.697 -2.837 5.102 1.00 0.00 C ATOM 44 CE2 PHE A 4 22.035 -2.576 4.661 1.00 0.00 C ATOM 45 CZ PHE A 4 20.991 -3.317 5.183 1.00 0.00 C ATOM 46 H PHE A 4 19.832 2.278 0.880 1.00 0.00 H ATOM 47 HA PHE A 4 20.459 -0.481 1.411 1.00 0.00 H ATOM 48 HB2 PHE A 4 21.095 1.095 3.486 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.374 0.918 3.808 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.439 -1.243 4.439 1.00 0.00 H ATOM 51 HD2 PHE A 4 22.601 -0.779 3.657 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.880 -3.414 5.509 1.00 0.00 H ATOM 53 HE2 PHE A 4 23.048 -2.949 4.723 1.00 0.00 H ATOM 54 HZ PHE A 4 21.188 -4.270 5.653 1.00 0.00 H ATOM 55 N THR A 5 17.969 -0.994 1.468 1.00 0.00 N ATOM 56 CA THR A 5 16.540 -1.238 1.254 1.00 0.00 C ATOM 57 C THR A 5 15.762 -1.249 2.585 1.00 0.00 C ATOM 58 O THR A 5 14.685 -1.844 2.682 1.00 0.00 O ATOM 59 CB THR A 5 16.308 -2.569 0.499 1.00 0.00 C ATOM 60 OG1 THR A 5 14.916 -2.735 0.199 1.00 0.00 O ATOM 61 CG2 THR A 5 16.800 -3.758 1.314 1.00 0.00 C ATOM 62 H THR A 5 18.583 -1.756 1.537 1.00 0.00 H ATOM 63 HA THR A 5 16.159 -0.434 0.639 1.00 0.00 H ATOM 64 HB THR A 5 16.862 -2.538 -0.427 1.00 0.00 H ATOM 65 HG1 THR A 5 14.797 -2.787 -0.753 1.00 0.00 H ATOM 66 HG21 THR A 5 16.411 -3.694 2.320 1.00 0.00 H ATOM 67 HG22 THR A 5 17.879 -3.752 1.342 1.00 0.00 H ATOM 68 HG23 THR A 5 16.458 -4.674 0.855 1.00 0.00 H ATOM 69 N GLY A 6 16.310 -0.573 3.602 1.00 0.00 N ATOM 70 CA GLY A 6 15.666 -0.505 4.902 1.00 0.00 C ATOM 71 C GLY A 6 14.363 0.273 4.883 1.00 0.00 C ATOM 72 O GLY A 6 13.457 -0.016 5.667 1.00 0.00 O ATOM 73 H GLY A 6 17.158 -0.109 3.467 1.00 0.00 H ATOM 74 HA2 GLY A 6 15.465 -1.510 5.242 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.342 -0.034 5.599 1.00 0.00 H ATOM 76 N LYS A 7 14.266 1.268 3.994 1.00 0.00 N ATOM 77 CA LYS A 7 13.060 2.092 3.894 1.00 0.00 C ATOM 78 C LYS A 7 11.819 1.256 3.546 1.00 0.00 C ATOM 79 O LYS A 7 10.699 1.753 3.651 1.00 0.00 O ATOM 80 CB LYS A 7 13.235 3.215 2.861 1.00 0.00 C ATOM 81 CG LYS A 7 12.798 2.835 1.455 1.00 0.00 C ATOM 82 CD LYS A 7 12.044 3.976 0.791 1.00 0.00 C ATOM 83 CE LYS A 7 11.139 3.473 -0.324 1.00 0.00 C ATOM 84 NZ LYS A 7 10.104 2.560 0.171 1.00 0.00 N1+ ATOM 85 H LYS A 7 15.024 1.458 3.400 1.00 0.00 H ATOM 86 HA LYS A 7 12.901 2.542 4.863 1.00 0.00 H ATOM 87 HB2 LYS A 7 12.654 4.069 3.175 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.278 3.495 2.827 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.673 2.604 0.866 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.156 1.969 1.503 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.437 4.474 1.533 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.756 4.673 0.377 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.661 4.323 -0.791 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.743 2.955 -1.056 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.375 1.644 0.391 1.00 0.00 H ATOM 96 N ARG A 8 12.012 -0.005 3.127 1.00 0.00 N ATOM 97 CA ARG A 8 10.887 -0.873 2.775 1.00 0.00 C ATOM 98 C ARG A 8 9.797 -0.778 3.844 1.00 0.00 C ATOM 99 O ARG A 8 8.609 -0.718 3.529 1.00 0.00 O ATOM 100 CB ARG A 8 11.365 -2.325 2.616 1.00 0.00 C ATOM 101 CG ARG A 8 10.306 -3.286 2.078 1.00 0.00 C ATOM 102 CD ARG A 8 9.301 -3.703 3.146 1.00 0.00 C ATOM 103 NE ARG A 8 9.945 -4.355 4.289 1.00 0.00 N ATOM 104 CZ ARG A 8 9.301 -4.745 5.393 1.00 0.00 C ATOM 105 NH1 ARG A 8 7.990 -4.547 5.521 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 9.974 -5.335 6.376 1.00 0.00 N ATOM 107 H ARG A 8 12.920 -0.355 3.057 1.00 0.00 H ATOM 108 HA ARG A 8 10.483 -0.527 1.836 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.206 -2.340 1.939 1.00 0.00 H ATOM 110 HB3 ARG A 8 11.690 -2.687 3.580 1.00 0.00 H ATOM 111 HG2 ARG A 8 9.775 -2.801 1.273 1.00 0.00 H ATOM 112 HG3 ARG A 8 10.801 -4.170 1.699 1.00 0.00 H ATOM 113 HD2 ARG A 8 8.775 -2.829 3.494 1.00 0.00 H ATOM 114 HD3 ARG A 8 8.595 -4.392 2.704 1.00 0.00 H ATOM 115 HE ARG A 8 10.911 -4.514 4.232 1.00 0.00 H ATOM 116 HH11 ARG A 8 7.476 -4.102 4.788 1.00 0.00 H ATOM 117 HH12 ARG A 8 7.518 -4.843 6.352 1.00 0.00 H ATOM 118 HH21 ARG A 8 10.958 -5.486 6.288 1.00 0.00 H ATOM 119 HH22 ARG A 8 9.495 -5.628 7.205 1.00 0.00 H ATOM 120 N LYS A 9 10.225 -0.739 5.107 1.00 0.00 N ATOM 121 CA LYS A 9 9.308 -0.626 6.244 1.00 0.00 C ATOM 122 C LYS A 9 8.380 0.585 6.091 1.00 0.00 C ATOM 123 O LYS A 9 7.167 0.471 6.273 1.00 0.00 O ATOM 124 CB LYS A 9 10.108 -0.505 7.547 1.00 0.00 C ATOM 125 CG LYS A 9 9.252 -0.451 8.804 1.00 0.00 C ATOM 126 CD LYS A 9 10.102 -0.382 10.069 1.00 0.00 C ATOM 127 CE LYS A 9 10.879 0.928 10.177 1.00 0.00 C ATOM 128 NZ LYS A 9 12.214 0.861 9.510 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.193 -0.774 5.278 1.00 0.00 H ATOM 130 HA LYS A 9 8.711 -1.522 6.279 1.00 0.00 H ATOM 131 HB2 LYS A 9 10.771 -1.352 7.627 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.697 0.398 7.501 1.00 0.00 H ATOM 133 HG2 LYS A 9 8.622 0.425 8.761 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.635 -1.337 8.844 1.00 0.00 H ATOM 135 HD2 LYS A 9 9.455 -0.472 10.928 1.00 0.00 H ATOM 136 HD3 LYS A 9 10.803 -1.204 10.061 1.00 0.00 H ATOM 137 HE2 LYS A 9 10.299 1.712 9.714 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.020 1.159 11.222 1.00 0.00 H ATOM 139 HZ1 LYS A 9 12.637 1.811 9.464 1.00 0.00 H ATOM 140 HZ2 LYS A 9 12.120 0.492 8.545 1.00 0.00 H ATOM 141 HZ3 LYS A 9 12.851 0.238 10.046 1.00 0.00 H ATOM 142 N SER A 10 8.959 1.741 5.757 1.00 0.00 N ATOM 143 CA SER A 10 8.182 2.971 5.581 1.00 0.00 C ATOM 144 C SER A 10 7.259 2.882 4.361 1.00 0.00 C ATOM 145 O SER A 10 6.081 3.222 4.448 1.00 0.00 O ATOM 146 CB SER A 10 9.109 4.189 5.463 1.00 0.00 C ATOM 147 OG SER A 10 9.924 4.117 4.306 1.00 0.00 O ATOM 148 H SER A 10 9.930 1.766 5.626 1.00 0.00 H ATOM 149 HA SER A 10 7.567 3.090 6.460 1.00 0.00 H ATOM 150 HB2 SER A 10 8.514 5.089 5.411 1.00 0.00 H ATOM 151 HB3 SER A 10 9.749 4.233 6.333 1.00 0.00 H ATOM 152 HG SER A 10 9.466 4.521 3.565 1.00 0.00 H ATOM 153 N ASP A 11 7.797 2.420 3.229 1.00 0.00 N ATOM 154 CA ASP A 11 7.008 2.284 2.001 1.00 0.00 C ATOM 155 C ASP A 11 5.843 1.309 2.190 1.00 0.00 C ATOM 156 O ASP A 11 4.741 1.543 1.695 1.00 0.00 O ATOM 157 CB ASP A 11 7.886 1.818 0.832 1.00 0.00 C ATOM 158 CG ASP A 11 8.822 2.903 0.323 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.392 4.025 0.050 1.00 0.00 O ATOM 160 H ASP A 11 8.741 2.160 3.221 1.00 0.00 H ATOM 161 HA ASP A 11 6.604 3.257 1.765 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.483 0.980 1.155 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.250 1.505 0.017 1.00 0.00 H ATOM 164 N ARG A 12 6.100 0.213 2.902 1.00 0.00 N ATOM 165 CA ARG A 12 5.084 -0.810 3.153 1.00 0.00 C ATOM 166 C ARG A 12 3.937 -0.268 4.016 1.00 0.00 C ATOM 167 O ARG A 12 2.774 -0.607 3.794 1.00 0.00 O ATOM 168 CB ARG A 12 5.718 -2.025 3.841 1.00 0.00 C ATOM 169 CG ARG A 12 4.882 -3.292 3.734 1.00 0.00 C ATOM 170 CD ARG A 12 4.832 -3.797 2.300 1.00 0.00 C ATOM 171 NE ARG A 12 4.017 -5.005 2.163 1.00 0.00 N ATOM 172 CZ ARG A 12 3.753 -5.600 0.996 1.00 0.00 C ATOM 173 NH1 ARG A 12 4.230 -5.098 -0.141 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 3.009 -6.702 0.968 1.00 0.00 N ATOM 175 H ARG A 12 7.002 0.083 3.265 1.00 0.00 H ATOM 176 HA ARG A 12 4.685 -1.117 2.202 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.680 -2.218 3.391 1.00 0.00 H ATOM 178 HB3 ARG A 12 5.858 -1.799 4.888 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.317 -4.055 4.362 1.00 0.00 H ATOM 180 HG3 ARG A 12 3.878 -3.078 4.067 1.00 0.00 H ATOM 181 HD2 ARG A 12 4.418 -3.021 1.673 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.840 -4.018 1.977 1.00 0.00 H ATOM 183 HE ARG A 12 3.648 -5.394 2.983 1.00 0.00 H ATOM 184 HH11 ARG A 12 4.790 -4.268 -0.130 1.00 0.00 H ATOM 185 HH12 ARG A 12 4.028 -5.550 -1.010 1.00 0.00 H ATOM 186 HH21 ARG A 12 2.647 -7.083 1.818 1.00 0.00 H ATOM 187 HH22 ARG A 12 2.809 -7.148 0.095 1.00 0.00 H ATOM 188 N LYS A 13 4.277 0.554 5.010 1.00 0.00 N ATOM 189 CA LYS A 13 3.281 1.122 5.921 1.00 0.00 C ATOM 190 C LYS A 13 2.614 2.385 5.368 1.00 0.00 C ATOM 191 O LYS A 13 1.391 2.450 5.268 1.00 0.00 O ATOM 192 CB LYS A 13 3.931 1.443 7.272 1.00 0.00 C ATOM 193 CG LYS A 13 4.193 0.221 8.140 1.00 0.00 C ATOM 194 CD LYS A 13 2.896 -0.417 8.619 1.00 0.00 C ATOM 195 CE LYS A 13 2.069 0.554 9.451 1.00 0.00 C ATOM 196 NZ LYS A 13 0.806 -0.062 9.943 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.222 0.772 5.145 1.00 0.00 H ATOM 198 HA LYS A 13 2.520 0.377 6.076 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.875 1.937 7.093 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.284 2.115 7.818 1.00 0.00 H ATOM 201 HG2 LYS A 13 4.749 -0.504 7.567 1.00 0.00 H ATOM 202 HG3 LYS A 13 4.774 0.523 9.001 1.00 0.00 H ATOM 203 HD2 LYS A 13 2.317 -0.723 7.761 1.00 0.00 H ATOM 204 HD3 LYS A 13 3.133 -1.281 9.223 1.00 0.00 H ATOM 205 HE2 LYS A 13 2.658 0.870 10.300 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.828 1.414 8.843 1.00 0.00 H ATOM 207 HZ1 LYS A 13 0.227 0.652 10.431 1.00 0.00 H ATOM 208 HZ2 LYS A 13 1.019 -0.833 10.608 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.261 -0.447 9.145 1.00 0.00 H ATOM 210 N LYS A 14 3.422 3.393 5.052 1.00 0.00 N ATOM 211 CA LYS A 14 2.919 4.680 4.558 1.00 0.00 C ATOM 212 C LYS A 14 2.151 4.568 3.234 1.00 0.00 C ATOM 213 O LYS A 14 1.080 5.152 3.088 1.00 0.00 O ATOM 214 CB LYS A 14 4.090 5.667 4.415 1.00 0.00 C ATOM 215 CG LYS A 14 3.704 7.067 3.943 1.00 0.00 C ATOM 216 CD LYS A 14 3.128 7.940 5.062 1.00 0.00 C ATOM 217 CE LYS A 14 1.742 7.493 5.512 1.00 0.00 C ATOM 218 NZ LYS A 14 0.817 7.336 4.390 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.386 3.282 5.186 1.00 0.00 H ATOM 220 HA LYS A 14 2.244 5.062 5.302 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.576 5.764 5.374 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.799 5.258 3.709 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.585 7.552 3.552 1.00 0.00 H ATOM 224 HG3 LYS A 14 2.970 6.978 3.155 1.00 0.00 H ATOM 225 HD2 LYS A 14 3.794 7.898 5.911 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.067 8.959 4.708 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.831 6.549 6.028 1.00 0.00 H ATOM 228 HE3 LYS A 14 1.346 8.233 6.191 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.178 6.973 3.557 1.00 0.00 H ATOM 230 N LYS A 15 2.700 3.845 2.264 1.00 0.00 N ATOM 231 CA LYS A 15 2.052 3.714 0.956 1.00 0.00 C ATOM 232 C LYS A 15 0.702 2.995 1.049 1.00 0.00 C ATOM 233 O LYS A 15 -0.312 3.500 0.563 1.00 0.00 O ATOM 234 CB LYS A 15 2.985 2.980 -0.011 1.00 0.00 C ATOM 235 CG LYS A 15 2.629 3.143 -1.483 1.00 0.00 C ATOM 236 CD LYS A 15 1.273 2.536 -1.817 1.00 0.00 C ATOM 237 CE LYS A 15 1.028 2.498 -3.319 1.00 0.00 C ATOM 238 NZ LYS A 15 2.047 1.676 -4.037 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.561 3.406 2.420 1.00 0.00 H ATOM 240 HA LYS A 15 1.881 4.710 0.580 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.989 3.350 0.131 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.967 1.925 0.224 1.00 0.00 H ATOM 243 HG2 LYS A 15 2.607 4.195 -1.720 1.00 0.00 H ATOM 244 HG3 LYS A 15 3.388 2.657 -2.078 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.232 1.530 -1.430 1.00 0.00 H ATOM 246 HD3 LYS A 15 0.502 3.135 -1.355 1.00 0.00 H ATOM 247 HE2 LYS A 15 0.050 2.074 -3.497 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.056 3.508 -3.702 1.00 0.00 H ATOM 249 HZ1 LYS A 15 2.228 2.076 -4.981 1.00 0.00 H ATOM 250 HZ2 LYS A 15 1.707 0.699 -4.148 1.00 0.00 H ATOM 251 HZ3 LYS A 15 2.941 1.659 -3.505 1.00 0.00 H ATOM 252 N ASN A 16 0.698 1.815 1.659 1.00 0.00 N ATOM 253 CA ASN A 16 -0.527 1.015 1.792 1.00 0.00 C ATOM 254 C ASN A 16 -1.537 1.629 2.771 1.00 0.00 C ATOM 255 O ASN A 16 -2.748 1.511 2.568 1.00 0.00 O ATOM 256 CB ASN A 16 -0.185 -0.419 2.217 1.00 0.00 C ATOM 257 CG ASN A 16 0.702 -1.128 1.206 1.00 0.00 C ATOM 258 OD1 ASN A 16 1.821 -0.694 0.933 1.00 0.00 O ATOM 259 ND2 ASN A 16 0.207 -2.226 0.639 1.00 0.00 N ATOM 260 H ASN A 16 1.543 1.464 2.016 1.00 0.00 H ATOM 261 HA ASN A 16 -0.988 0.977 0.819 1.00 0.00 H ATOM 262 HB2 ASN A 16 0.330 -0.395 3.166 1.00 0.00 H ATOM 263 HB3 ASN A 16 -1.100 -0.983 2.324 1.00 0.00 H ATOM 264 HD21 ASN A 16 -0.691 -2.519 0.899 1.00 0.00 H ATOM 265 HD22 ASN A 16 0.763 -2.697 -0.017 1.00 0.00 H ATOM 266 N GLN A 17 -1.047 2.259 3.839 1.00 0.00 N ATOM 267 CA GLN A 17 -1.922 2.862 4.852 1.00 0.00 C ATOM 268 C GLN A 17 -2.607 4.139 4.352 1.00 0.00 C ATOM 269 O GLN A 17 -3.828 4.269 4.453 1.00 0.00 O ATOM 270 CB GLN A 17 -1.126 3.159 6.127 1.00 0.00 C ATOM 271 CG GLN A 17 -1.967 3.701 7.271 1.00 0.00 C ATOM 272 CD GLN A 17 -1.154 3.934 8.531 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.214 4.730 8.540 1.00 0.00 O ATOM 274 NE2 GLN A 17 -1.505 3.229 9.603 1.00 0.00 N ATOM 275 H GLN A 17 -0.075 2.309 3.959 1.00 0.00 H ATOM 276 HA GLN A 17 -2.686 2.141 5.087 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.655 2.248 6.461 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.360 3.885 5.896 1.00 0.00 H ATOM 279 HG2 GLN A 17 -2.406 4.641 6.966 1.00 0.00 H ATOM 280 HG3 GLN A 17 -2.752 2.993 7.492 1.00 0.00 H ATOM 281 HE21 GLN A 17 -2.259 2.607 9.524 1.00 0.00 H ATOM 282 HE22 GLN A 17 -0.996 3.361 10.431 1.00 0.00 H ATOM 283 N ASP A 18 -1.821 5.085 3.835 1.00 0.00 N ATOM 284 CA ASP A 18 -2.370 6.354 3.343 1.00 0.00 C ATOM 285 C ASP A 18 -3.138 6.162 2.035 1.00 0.00 C ATOM 286 O ASP A 18 -4.287 6.587 1.913 1.00 0.00 O ATOM 287 CB ASP A 18 -1.255 7.388 3.153 1.00 0.00 C ATOM 288 CG ASP A 18 -0.476 7.644 4.432 1.00 0.00 C ATOM 289 OD1 ASP A 18 -1.032 8.097 5.433 1.00 0.00 O ATOM 290 H ASP A 18 -0.856 4.930 3.790 1.00 0.00 H ATOM 291 HA ASP A 18 -3.057 6.720 4.092 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.567 7.031 2.400 1.00 0.00 H ATOM 293 HB3 ASP A 18 -1.690 8.321 2.824 1.00 0.00 H HETATM 294 N NH2 A 19 -2.505 5.518 1.058 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.590 5.208 1.222 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -2.982 5.378 0.213 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 18 ATOM 1 N PHE A 1 15.061 3.660 -7.453 1.00 0.00 N ATOM 2 CA PHE A 1 14.952 4.146 -6.078 1.00 0.00 C ATOM 3 C PHE A 1 14.580 3.032 -5.096 1.00 0.00 C ATOM 4 O PHE A 1 14.954 3.093 -3.924 1.00 0.00 O ATOM 5 CB PHE A 1 13.949 5.308 -5.977 1.00 0.00 C ATOM 6 CG PHE A 1 12.667 5.124 -6.753 1.00 0.00 C ATOM 7 CD1 PHE A 1 11.825 4.044 -6.520 1.00 0.00 C ATOM 8 CD2 PHE A 1 12.306 6.048 -7.718 1.00 0.00 C ATOM 9 CE1 PHE A 1 10.652 3.893 -7.239 1.00 0.00 C ATOM 10 CE2 PHE A 1 11.138 5.903 -8.437 1.00 0.00 C ATOM 11 CZ PHE A 1 10.309 4.825 -8.198 1.00 0.00 C ATOM 12 H1 PHE A 1 15.685 2.933 -7.657 1.00 0.00 H ATOM 13 HA PHE A 1 15.925 4.520 -5.799 1.00 0.00 H ATOM 14 HB2 PHE A 1 13.685 5.449 -4.939 1.00 0.00 H ATOM 15 HB3 PHE A 1 14.427 6.207 -6.340 1.00 0.00 H ATOM 16 HD1 PHE A 1 12.090 3.316 -5.768 1.00 0.00 H ATOM 17 HD2 PHE A 1 12.954 6.893 -7.909 1.00 0.00 H ATOM 18 HE1 PHE A 1 10.006 3.048 -7.051 1.00 0.00 H ATOM 19 HE2 PHE A 1 10.873 6.633 -9.187 1.00 0.00 H ATOM 20 HZ PHE A 1 9.396 4.711 -8.760 1.00 0.00 H ATOM 21 N GLY A 2 13.840 2.022 -5.562 1.00 0.00 N ATOM 22 CA GLY A 2 13.442 0.934 -4.680 1.00 0.00 C ATOM 23 C GLY A 2 14.466 -0.189 -4.603 1.00 0.00 C ATOM 24 O GLY A 2 14.094 -1.363 -4.559 1.00 0.00 O ATOM 25 H GLY A 2 13.560 2.015 -6.501 1.00 0.00 H ATOM 26 HA2 GLY A 2 13.296 1.334 -3.687 1.00 0.00 H ATOM 27 HA3 GLY A 2 12.504 0.527 -5.029 1.00 0.00 H ATOM 28 N GLY A 3 15.753 0.166 -4.576 1.00 0.00 N ATOM 29 CA GLY A 3 16.804 -0.836 -4.491 1.00 0.00 C ATOM 30 C GLY A 3 17.140 -1.196 -3.055 1.00 0.00 C ATOM 31 O GLY A 3 17.169 -2.376 -2.693 1.00 0.00 O ATOM 32 H GLY A 3 15.991 1.115 -4.603 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.483 -1.726 -5.011 1.00 0.00 H ATOM 34 HA3 GLY A 3 17.692 -0.451 -4.973 1.00 0.00 H ATOM 35 N PHE A 4 17.392 -0.170 -2.237 1.00 0.00 N ATOM 36 CA PHE A 4 17.730 -0.358 -0.824 1.00 0.00 C ATOM 37 C PHE A 4 16.510 -0.796 -0.004 1.00 0.00 C ATOM 38 O PHE A 4 15.391 -0.333 -0.233 1.00 0.00 O ATOM 39 CB PHE A 4 18.338 0.929 -0.245 1.00 0.00 C ATOM 40 CG PHE A 4 17.513 2.169 -0.480 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.294 2.351 0.159 1.00 0.00 C ATOM 42 CD2 PHE A 4 17.962 3.153 -1.346 1.00 0.00 C ATOM 43 CE1 PHE A 4 15.542 3.489 -0.064 1.00 0.00 C ATOM 44 CE2 PHE A 4 17.215 4.292 -1.573 1.00 0.00 C ATOM 45 CZ PHE A 4 16.004 4.461 -0.931 1.00 0.00 C ATOM 46 H PHE A 4 17.350 0.742 -2.595 1.00 0.00 H ATOM 47 HA PHE A 4 18.472 -1.141 -0.770 1.00 0.00 H ATOM 48 HB2 PHE A 4 18.460 0.810 0.822 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.308 1.088 -0.694 1.00 0.00 H ATOM 50 HD1 PHE A 4 15.933 1.593 0.840 1.00 0.00 H ATOM 51 HD2 PHE A 4 18.908 3.022 -1.849 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.595 3.618 0.438 1.00 0.00 H ATOM 53 HE2 PHE A 4 17.577 5.049 -2.251 1.00 0.00 H ATOM 54 HZ PHE A 4 15.419 5.351 -1.106 1.00 0.00 H ATOM 55 N THR A 5 16.745 -1.703 0.951 1.00 0.00 N ATOM 56 CA THR A 5 15.684 -2.226 1.817 1.00 0.00 C ATOM 57 C THR A 5 15.638 -1.490 3.169 1.00 0.00 C ATOM 58 O THR A 5 14.955 -1.931 4.098 1.00 0.00 O ATOM 59 CB THR A 5 15.896 -3.741 2.063 1.00 0.00 C ATOM 60 OG1 THR A 5 16.034 -4.425 0.812 1.00 0.00 O ATOM 61 CG2 THR A 5 14.742 -4.359 2.844 1.00 0.00 C ATOM 62 H THR A 5 17.660 -2.034 1.076 1.00 0.00 H ATOM 63 HA THR A 5 14.738 -2.092 1.311 1.00 0.00 H ATOM 64 HB THR A 5 16.804 -3.871 2.635 1.00 0.00 H ATOM 65 HG1 THR A 5 16.961 -4.628 0.659 1.00 0.00 H ATOM 66 HG21 THR A 5 13.805 -3.977 2.468 1.00 0.00 H ATOM 67 HG22 THR A 5 14.839 -4.110 3.890 1.00 0.00 H ATOM 68 HG23 THR A 5 14.764 -5.432 2.728 1.00 0.00 H ATOM 69 N GLY A 6 16.359 -0.368 3.278 1.00 0.00 N ATOM 70 CA GLY A 6 16.382 0.387 4.522 1.00 0.00 C ATOM 71 C GLY A 6 14.996 0.736 5.031 1.00 0.00 C ATOM 72 O GLY A 6 14.608 0.309 6.120 1.00 0.00 O ATOM 73 H GLY A 6 16.883 -0.053 2.512 1.00 0.00 H ATOM 74 HA2 GLY A 6 16.889 -0.198 5.273 1.00 0.00 H ATOM 75 HA3 GLY A 6 16.934 1.303 4.361 1.00 0.00 H ATOM 76 N LYS A 7 14.250 1.506 4.243 1.00 0.00 N ATOM 77 CA LYS A 7 12.897 1.913 4.619 1.00 0.00 C ATOM 78 C LYS A 7 11.843 0.986 3.993 1.00 0.00 C ATOM 79 O LYS A 7 10.776 1.447 3.575 1.00 0.00 O ATOM 80 CB LYS A 7 12.640 3.354 4.159 1.00 0.00 C ATOM 81 CG LYS A 7 12.597 3.491 2.643 1.00 0.00 C ATOM 82 CD LYS A 7 11.885 4.757 2.198 1.00 0.00 C ATOM 83 CE LYS A 7 11.048 4.500 0.953 1.00 0.00 C ATOM 84 NZ LYS A 7 10.079 3.422 1.163 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.619 1.810 3.385 1.00 0.00 H ATOM 86 HA LYS A 7 12.815 1.863 5.693 1.00 0.00 H ATOM 87 HB2 LYS A 7 11.694 3.689 4.560 1.00 0.00 H ATOM 88 HB3 LYS A 7 13.428 3.989 4.534 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.608 3.510 2.267 1.00 0.00 H ATOM 90 HG3 LYS A 7 12.081 2.636 2.232 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.241 5.103 2.992 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.622 5.515 1.972 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.517 5.405 0.699 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.705 4.229 0.139 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.435 2.520 1.315 1.00 0.00 H ATOM 96 N ARG A 8 12.141 -0.312 3.907 1.00 0.00 N ATOM 97 CA ARG A 8 11.207 -1.256 3.298 1.00 0.00 C ATOM 98 C ARG A 8 9.899 -1.342 4.082 1.00 0.00 C ATOM 99 O ARG A 8 8.823 -1.305 3.487 1.00 0.00 O ATOM 100 CB ARG A 8 11.853 -2.640 3.133 1.00 0.00 C ATOM 101 CG ARG A 8 12.014 -3.442 4.421 1.00 0.00 C ATOM 102 CD ARG A 8 10.755 -4.235 4.757 1.00 0.00 C ATOM 103 NE ARG A 8 10.329 -5.094 3.649 1.00 0.00 N ATOM 104 CZ ARG A 8 11.032 -6.135 3.180 1.00 0.00 C ATOM 105 NH1 ARG A 8 12.184 -6.492 3.745 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 10.573 -6.826 2.143 1.00 0.00 N ATOM 107 H ARG A 8 13.005 -0.636 4.240 1.00 0.00 H ATOM 108 HA ARG A 8 10.972 -0.872 2.316 1.00 0.00 H ATOM 109 HB2 ARG A 8 11.249 -3.221 2.453 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.831 -2.507 2.697 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.838 -4.131 4.300 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.230 -2.764 5.233 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.953 -4.852 5.621 1.00 0.00 H ATOM 114 HD3 ARG A 8 9.958 -3.545 4.988 1.00 0.00 H ATOM 115 HE ARG A 8 9.474 -4.876 3.218 1.00 0.00 H ATOM 116 HH11 ARG A 8 12.537 -5.987 4.532 1.00 0.00 H ATOM 117 HH12 ARG A 8 12.698 -7.267 3.380 1.00 0.00 H ATOM 118 HH21 ARG A 8 9.708 -6.571 1.715 1.00 0.00 H ATOM 119 HH22 ARG A 8 11.095 -7.604 1.792 1.00 0.00 H ATOM 120 N LYS A 9 9.986 -1.442 5.407 1.00 0.00 N ATOM 121 CA LYS A 9 8.778 -1.515 6.232 1.00 0.00 C ATOM 122 C LYS A 9 8.082 -0.155 6.296 1.00 0.00 C ATOM 123 O LYS A 9 6.856 -0.086 6.395 1.00 0.00 O ATOM 124 CB LYS A 9 9.070 -2.036 7.648 1.00 0.00 C ATOM 125 CG LYS A 9 9.988 -1.153 8.481 1.00 0.00 C ATOM 126 CD LYS A 9 11.441 -1.598 8.397 1.00 0.00 C ATOM 127 CE LYS A 9 12.319 -0.813 9.362 1.00 0.00 C ATOM 128 NZ LYS A 9 11.871 -0.963 10.777 1.00 0.00 N1+ ATOM 129 H LYS A 9 10.869 -1.453 5.832 1.00 0.00 H ATOM 130 HA LYS A 9 8.107 -2.209 5.745 1.00 0.00 H ATOM 131 HB2 LYS A 9 8.134 -2.134 8.176 1.00 0.00 H ATOM 132 HB3 LYS A 9 9.524 -3.012 7.569 1.00 0.00 H ATOM 133 HG2 LYS A 9 9.914 -0.138 8.124 1.00 0.00 H ATOM 134 HG3 LYS A 9 9.665 -1.195 9.512 1.00 0.00 H ATOM 135 HD2 LYS A 9 11.501 -2.647 8.645 1.00 0.00 H ATOM 136 HD3 LYS A 9 11.800 -1.443 7.390 1.00 0.00 H ATOM 137 HE2 LYS A 9 13.334 -1.172 9.275 1.00 0.00 H ATOM 138 HE3 LYS A 9 12.284 0.232 9.089 1.00 0.00 H ATOM 139 HZ1 LYS A 9 12.675 -0.828 11.421 1.00 0.00 H ATOM 140 HZ2 LYS A 9 11.476 -1.913 10.929 1.00 0.00 H ATOM 141 HZ3 LYS A 9 11.141 -0.256 10.997 1.00 0.00 H ATOM 142 N SER A 10 8.872 0.922 6.224 1.00 0.00 N ATOM 143 CA SER A 10 8.333 2.281 6.257 1.00 0.00 C ATOM 144 C SER A 10 7.384 2.528 5.081 1.00 0.00 C ATOM 145 O SER A 10 6.242 2.942 5.278 1.00 0.00 O ATOM 146 CB SER A 10 9.474 3.308 6.240 1.00 0.00 C ATOM 147 OG SER A 10 10.132 3.371 7.499 1.00 0.00 O ATOM 148 H SER A 10 9.841 0.797 6.137 1.00 0.00 H ATOM 149 HA SER A 10 7.781 2.389 7.176 1.00 0.00 H ATOM 150 HB2 SER A 10 10.197 3.023 5.491 1.00 0.00 H ATOM 151 HB3 SER A 10 9.075 4.284 6.003 1.00 0.00 H ATOM 152 HG SER A 10 9.492 3.244 8.207 1.00 0.00 H ATOM 153 N ASP A 11 7.863 2.267 3.863 1.00 0.00 N ATOM 154 CA ASP A 11 7.052 2.457 2.656 1.00 0.00 C ATOM 155 C ASP A 11 5.903 1.450 2.585 1.00 0.00 C ATOM 156 O ASP A 11 4.774 1.818 2.266 1.00 0.00 O ATOM 157 CB ASP A 11 7.920 2.350 1.396 1.00 0.00 C ATOM 158 CG ASP A 11 8.759 3.594 1.157 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.225 4.689 0.971 1.00 0.00 O ATOM 160 H ASP A 11 8.782 1.936 3.776 1.00 0.00 H ATOM 161 HA ASP A 11 6.631 3.449 2.702 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.585 1.507 1.497 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.283 2.196 0.541 1.00 0.00 H ATOM 164 N ARG A 12 6.203 0.181 2.876 1.00 0.00 N ATOM 165 CA ARG A 12 5.197 -0.886 2.838 1.00 0.00 C ATOM 166 C ARG A 12 3.963 -0.534 3.664 1.00 0.00 C ATOM 167 O ARG A 12 2.832 -0.707 3.212 1.00 0.00 O ATOM 168 CB ARG A 12 5.802 -2.202 3.338 1.00 0.00 C ATOM 169 CG ARG A 12 6.651 -2.914 2.294 1.00 0.00 C ATOM 170 CD ARG A 12 5.786 -3.567 1.223 1.00 0.00 C ATOM 171 NE ARG A 12 5.177 -4.816 1.688 1.00 0.00 N ATOM 172 CZ ARG A 12 5.848 -5.965 1.840 1.00 0.00 C ATOM 173 NH1 ARG A 12 7.137 -6.045 1.514 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 5.225 -7.043 2.307 1.00 0.00 N ATOM 175 H ARG A 12 7.126 -0.043 3.116 1.00 0.00 H ATOM 176 HA ARG A 12 4.896 -1.011 1.811 1.00 0.00 H ATOM 177 HB2 ARG A 12 6.424 -1.994 4.196 1.00 0.00 H ATOM 178 HB3 ARG A 12 5.003 -2.864 3.635 1.00 0.00 H ATOM 179 HG2 ARG A 12 7.307 -2.195 1.826 1.00 0.00 H ATOM 180 HG3 ARG A 12 7.239 -3.674 2.784 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.002 -2.880 0.945 1.00 0.00 H ATOM 182 HD3 ARG A 12 6.401 -3.775 0.359 1.00 0.00 H ATOM 183 HE ARG A 12 4.222 -4.795 1.914 1.00 0.00 H ATOM 184 HH11 ARG A 12 7.615 -5.244 1.153 1.00 0.00 H ATOM 185 HH12 ARG A 12 7.628 -6.908 1.629 1.00 0.00 H ATOM 186 HH21 ARG A 12 4.255 -6.997 2.547 1.00 0.00 H ATOM 187 HH22 ARG A 12 5.726 -7.902 2.418 1.00 0.00 H ATOM 188 N LYS A 13 4.183 -0.036 4.872 1.00 0.00 N ATOM 189 CA LYS A 13 3.077 0.338 5.748 1.00 0.00 C ATOM 190 C LYS A 13 2.473 1.689 5.329 1.00 0.00 C ATOM 191 O LYS A 13 1.265 1.914 5.475 1.00 0.00 O ATOM 192 CB LYS A 13 3.546 0.374 7.210 1.00 0.00 C ATOM 193 CG LYS A 13 2.411 0.522 8.210 1.00 0.00 C ATOM 194 CD LYS A 13 2.848 0.150 9.620 1.00 0.00 C ATOM 195 CE LYS A 13 1.674 0.174 10.589 1.00 0.00 C ATOM 196 NZ LYS A 13 0.913 1.454 10.520 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.104 0.083 5.180 1.00 0.00 H ATOM 198 HA LYS A 13 2.316 -0.421 5.648 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.071 -0.545 7.429 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.226 1.205 7.341 1.00 0.00 H ATOM 201 HG2 LYS A 13 2.081 1.550 8.210 1.00 0.00 H ATOM 202 HG3 LYS A 13 1.596 -0.120 7.913 1.00 0.00 H ATOM 203 HD2 LYS A 13 3.265 -0.846 9.605 1.00 0.00 H ATOM 204 HD3 LYS A 13 3.597 0.852 9.955 1.00 0.00 H ATOM 205 HE2 LYS A 13 1.010 -0.642 10.348 1.00 0.00 H ATOM 206 HE3 LYS A 13 2.051 0.043 11.593 1.00 0.00 H ATOM 207 HZ1 LYS A 13 1.566 2.262 10.533 1.00 0.00 H ATOM 208 HZ2 LYS A 13 0.268 1.531 11.332 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.352 1.490 9.644 1.00 0.00 H ATOM 210 N LYS A 14 3.321 2.582 4.805 1.00 0.00 N ATOM 211 CA LYS A 14 2.872 3.905 4.372 1.00 0.00 C ATOM 212 C LYS A 14 1.905 3.825 3.191 1.00 0.00 C ATOM 213 O LYS A 14 0.839 4.437 3.231 1.00 0.00 O ATOM 214 CB LYS A 14 4.058 4.805 4.008 1.00 0.00 C ATOM 215 CG LYS A 14 3.632 6.181 3.515 1.00 0.00 C ATOM 216 CD LYS A 14 2.780 6.909 4.551 1.00 0.00 C ATOM 217 CE LYS A 14 2.051 8.109 3.953 1.00 0.00 C ATOM 218 NZ LYS A 14 0.921 7.703 3.113 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.267 2.347 4.714 1.00 0.00 H ATOM 220 HA LYS A 14 2.348 4.350 5.201 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.685 4.931 4.878 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.632 4.329 3.226 1.00 0.00 H ATOM 223 HG2 LYS A 14 4.514 6.769 3.310 1.00 0.00 H ATOM 224 HG3 LYS A 14 3.061 6.061 2.610 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.046 6.222 4.944 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.419 7.250 5.352 1.00 0.00 H ATOM 227 HE2 LYS A 14 1.685 8.727 4.759 1.00 0.00 H ATOM 228 HE3 LYS A 14 2.748 8.677 3.354 1.00 0.00 H ATOM 229 HZ1 LYS A 14 0.031 7.732 3.517 1.00 0.00 H ATOM 230 N LYS A 15 2.274 3.078 2.144 1.00 0.00 N ATOM 231 CA LYS A 15 1.410 2.941 0.965 1.00 0.00 C ATOM 232 C LYS A 15 -0.005 2.546 1.386 1.00 0.00 C ATOM 233 O LYS A 15 -0.984 3.028 0.814 1.00 0.00 O ATOM 234 CB LYS A 15 1.980 1.929 -0.044 1.00 0.00 C ATOM 235 CG LYS A 15 2.299 0.572 0.554 1.00 0.00 C ATOM 236 CD LYS A 15 2.646 -0.457 -0.515 1.00 0.00 C ATOM 237 CE LYS A 15 2.837 -1.834 0.104 1.00 0.00 C ATOM 238 NZ LYS A 15 2.981 -2.907 -0.921 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.133 2.612 2.167 1.00 0.00 H ATOM 240 HA LYS A 15 1.362 3.912 0.493 1.00 0.00 H ATOM 241 HB2 LYS A 15 1.261 1.787 -0.838 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.888 2.334 -0.466 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.142 0.676 1.218 1.00 0.00 H ATOM 244 HG3 LYS A 15 1.443 0.222 1.110 1.00 0.00 H ATOM 245 HD2 LYS A 15 1.845 -0.501 -1.240 1.00 0.00 H ATOM 246 HD3 LYS A 15 3.564 -0.160 -1.006 1.00 0.00 H ATOM 247 HE2 LYS A 15 3.725 -1.815 0.716 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.981 -2.054 0.726 1.00 0.00 H ATOM 249 HZ1 LYS A 15 2.048 -3.165 -1.302 1.00 0.00 H ATOM 250 HZ2 LYS A 15 3.413 -3.752 -0.494 1.00 0.00 H ATOM 251 HZ3 LYS A 15 3.586 -2.581 -1.702 1.00 0.00 H ATOM 252 N ASN A 16 -0.103 1.693 2.411 1.00 0.00 N ATOM 253 CA ASN A 16 -1.401 1.267 2.931 1.00 0.00 C ATOM 254 C ASN A 16 -2.189 2.466 3.446 1.00 0.00 C ATOM 255 O ASN A 16 -3.356 2.648 3.094 1.00 0.00 O ATOM 256 CB ASN A 16 -1.238 0.234 4.054 1.00 0.00 C ATOM 257 CG ASN A 16 -1.377 -1.191 3.559 1.00 0.00 C ATOM 258 OD1 ASN A 16 -0.539 -1.685 2.804 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.451 -1.858 3.975 1.00 0.00 N ATOM 260 H ASN A 16 0.716 1.366 2.842 1.00 0.00 H ATOM 261 HA ASN A 16 -1.950 0.818 2.117 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.257 0.344 4.495 1.00 0.00 H ATOM 263 HB3 ASN A 16 -1.989 0.410 4.811 1.00 0.00 H ATOM 264 HD21 ASN A 16 -3.083 -1.398 4.569 1.00 0.00 H ATOM 265 HD22 ASN A 16 -2.571 -2.781 3.669 1.00 0.00 H ATOM 266 N GLN A 17 -1.544 3.283 4.282 1.00 0.00 N ATOM 267 CA GLN A 17 -2.201 4.464 4.844 1.00 0.00 C ATOM 268 C GLN A 17 -2.444 5.536 3.776 1.00 0.00 C ATOM 269 O GLN A 17 -3.553 6.063 3.665 1.00 0.00 O ATOM 270 CB GLN A 17 -1.383 5.058 5.994 1.00 0.00 C ATOM 271 CG GLN A 17 -2.251 5.600 7.118 1.00 0.00 C ATOM 272 CD GLN A 17 -1.478 6.450 8.109 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.567 5.965 8.785 1.00 0.00 O ATOM 274 NE2 GLN A 17 -1.838 7.729 8.195 1.00 0.00 N ATOM 275 H GLN A 17 -0.614 3.082 4.527 1.00 0.00 H ATOM 276 HA GLN A 17 -3.158 4.148 5.230 1.00 0.00 H ATOM 277 HB2 GLN A 17 -0.737 4.293 6.400 1.00 0.00 H ATOM 278 HB3 GLN A 17 -0.778 5.868 5.615 1.00 0.00 H ATOM 279 HG2 GLN A 17 -3.039 6.200 6.691 1.00 0.00 H ATOM 280 HG3 GLN A 17 -2.687 4.763 7.647 1.00 0.00 H ATOM 281 HE21 GLN A 17 -2.571 8.047 7.623 1.00 0.00 H ATOM 282 HE22 GLN A 17 -1.358 8.303 8.824 1.00 0.00 H ATOM 283 N ASP A 18 -1.402 5.859 2.997 1.00 0.00 N ATOM 284 CA ASP A 18 -1.502 6.876 1.938 1.00 0.00 C ATOM 285 C ASP A 18 -2.702 6.608 1.027 1.00 0.00 C ATOM 286 O ASP A 18 -3.605 7.437 0.911 1.00 0.00 O ATOM 287 CB ASP A 18 -0.222 6.914 1.085 1.00 0.00 C ATOM 288 CG ASP A 18 1.047 7.307 1.840 1.00 0.00 C ATOM 289 OD1 ASP A 18 2.139 7.260 1.265 1.00 0.00 O ATOM 290 H ASP A 18 -0.545 5.405 3.143 1.00 0.00 H ATOM 291 HA ASP A 18 -1.637 7.836 2.414 1.00 0.00 H ATOM 292 HB2 ASP A 18 -0.062 5.936 0.657 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.367 7.623 0.282 1.00 0.00 H HETATM 294 N NH2 A 19 -2.712 5.449 0.373 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -1.962 4.831 0.509 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -3.467 5.259 -0.222 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 19 ATOM 1 N PHE A 1 17.877 -7.498 9.004 1.00 0.00 N ATOM 2 CA PHE A 1 18.970 -6.530 8.927 1.00 0.00 C ATOM 3 C PHE A 1 19.929 -6.853 7.769 1.00 0.00 C ATOM 4 O PHE A 1 21.139 -6.625 7.869 1.00 0.00 O ATOM 5 CB PHE A 1 19.722 -6.477 10.271 1.00 0.00 C ATOM 6 CG PHE A 1 20.257 -7.807 10.744 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.519 -8.240 10.369 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.492 -8.623 11.566 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.009 -9.456 10.806 1.00 0.00 C ATOM 10 CE2 PHE A 1 19.978 -9.841 12.004 1.00 0.00 C ATOM 11 CZ PHE A 1 21.237 -10.259 11.623 1.00 0.00 C ATOM 12 H1 PHE A 1 18.077 -8.456 8.965 1.00 0.00 H ATOM 13 HA PHE A 1 18.530 -5.560 8.742 1.00 0.00 H ATOM 14 HB2 PHE A 1 20.559 -5.800 10.179 1.00 0.00 H ATOM 15 HB3 PHE A 1 19.051 -6.101 11.031 1.00 0.00 H ATOM 16 HD1 PHE A 1 22.128 -7.614 9.733 1.00 0.00 H ATOM 17 HD2 PHE A 1 18.505 -8.300 11.864 1.00 0.00 H ATOM 18 HE1 PHE A 1 22.997 -9.782 10.504 1.00 0.00 H ATOM 19 HE2 PHE A 1 19.371 -10.468 12.640 1.00 0.00 H ATOM 20 HZ PHE A 1 21.620 -11.209 11.966 1.00 0.00 H ATOM 21 N GLY A 2 19.377 -7.370 6.662 1.00 0.00 N ATOM 22 CA GLY A 2 20.188 -7.704 5.497 1.00 0.00 C ATOM 23 C GLY A 2 20.371 -6.527 4.553 1.00 0.00 C ATOM 24 O GLY A 2 21.493 -6.068 4.346 1.00 0.00 O ATOM 25 H GLY A 2 18.410 -7.519 6.634 1.00 0.00 H ATOM 26 HA2 GLY A 2 21.161 -8.035 5.832 1.00 0.00 H ATOM 27 HA3 GLY A 2 19.712 -8.512 4.961 1.00 0.00 H ATOM 28 N GLY A 3 19.264 -6.034 3.985 1.00 0.00 N ATOM 29 CA GLY A 3 19.329 -4.902 3.071 1.00 0.00 C ATOM 30 C GLY A 3 19.503 -3.584 3.803 1.00 0.00 C ATOM 31 O GLY A 3 18.723 -3.261 4.699 1.00 0.00 O ATOM 32 H GLY A 3 18.396 -6.439 4.191 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.163 -5.040 2.397 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.415 -4.865 2.496 1.00 0.00 H ATOM 35 N PHE A 4 20.527 -2.822 3.417 1.00 0.00 N ATOM 36 CA PHE A 4 20.805 -1.530 4.043 1.00 0.00 C ATOM 37 C PHE A 4 19.991 -0.413 3.379 1.00 0.00 C ATOM 38 O PHE A 4 20.553 0.492 2.757 1.00 0.00 O ATOM 39 CB PHE A 4 22.303 -1.217 3.979 1.00 0.00 C ATOM 40 CG PHE A 4 22.709 -0.031 4.811 1.00 0.00 C ATOM 41 CD1 PHE A 4 22.300 0.081 6.132 1.00 0.00 C ATOM 42 CD2 PHE A 4 23.500 0.970 4.272 1.00 0.00 C ATOM 43 CE1 PHE A 4 22.673 1.170 6.897 1.00 0.00 C ATOM 44 CE2 PHE A 4 23.876 2.061 5.032 1.00 0.00 C ATOM 45 CZ PHE A 4 23.463 2.161 6.346 1.00 0.00 C ATOM 46 H PHE A 4 21.111 -3.136 2.695 1.00 0.00 H ATOM 47 HA PHE A 4 20.509 -1.600 5.080 1.00 0.00 H ATOM 48 HB2 PHE A 4 22.860 -2.073 4.328 1.00 0.00 H ATOM 49 HB3 PHE A 4 22.577 -1.014 2.953 1.00 0.00 H ATOM 50 HD1 PHE A 4 21.683 -0.693 6.564 1.00 0.00 H ATOM 51 HD2 PHE A 4 23.823 0.895 3.245 1.00 0.00 H ATOM 52 HE1 PHE A 4 22.348 1.246 7.924 1.00 0.00 H ATOM 53 HE2 PHE A 4 24.494 2.834 4.599 1.00 0.00 H ATOM 54 HZ PHE A 4 23.755 3.012 6.942 1.00 0.00 H ATOM 55 N THR A 5 18.666 -0.489 3.513 1.00 0.00 N ATOM 56 CA THR A 5 17.770 0.508 2.925 1.00 0.00 C ATOM 57 C THR A 5 16.442 0.583 3.678 1.00 0.00 C ATOM 58 O THR A 5 15.582 -0.288 3.539 1.00 0.00 O ATOM 59 CB THR A 5 17.491 0.210 1.436 1.00 0.00 C ATOM 60 OG1 THR A 5 17.207 -1.185 1.253 1.00 0.00 O ATOM 61 CG2 THR A 5 18.669 0.626 0.561 1.00 0.00 C ATOM 62 H THR A 5 18.280 -1.237 4.016 1.00 0.00 H ATOM 63 HA THR A 5 18.259 1.469 2.988 1.00 0.00 H ATOM 64 HB THR A 5 16.623 0.781 1.136 1.00 0.00 H ATOM 65 HG1 THR A 5 18.023 -1.691 1.291 1.00 0.00 H ATOM 66 HG21 THR A 5 18.314 0.869 -0.430 1.00 0.00 H ATOM 67 HG22 THR A 5 19.381 -0.183 0.498 1.00 0.00 H ATOM 68 HG23 THR A 5 19.150 1.494 0.994 1.00 0.00 H ATOM 69 N GLY A 6 16.294 1.638 4.479 1.00 0.00 N ATOM 70 CA GLY A 6 15.083 1.834 5.260 1.00 0.00 C ATOM 71 C GLY A 6 13.842 2.065 4.413 1.00 0.00 C ATOM 72 O GLY A 6 12.742 1.682 4.813 1.00 0.00 O ATOM 73 H GLY A 6 17.022 2.292 4.545 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.922 0.958 5.871 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.224 2.687 5.910 1.00 0.00 H ATOM 76 N LYS A 7 14.013 2.696 3.248 1.00 0.00 N ATOM 77 CA LYS A 7 12.891 2.981 2.349 1.00 0.00 C ATOM 78 C LYS A 7 12.240 1.713 1.792 1.00 0.00 C ATOM 79 O LYS A 7 11.199 1.792 1.149 1.00 0.00 O ATOM 80 CB LYS A 7 13.336 3.873 1.187 1.00 0.00 C ATOM 81 CG LYS A 7 13.351 5.357 1.515 1.00 0.00 C ATOM 82 CD LYS A 7 11.956 5.900 1.823 1.00 0.00 C ATOM 83 CE LYS A 7 10.984 5.719 0.658 1.00 0.00 C ATOM 84 NZ LYS A 7 10.311 4.416 0.680 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.914 2.979 2.985 1.00 0.00 H ATOM 86 HA LYS A 7 12.149 3.515 2.925 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.332 3.588 0.890 1.00 0.00 H ATOM 88 HB3 LYS A 7 12.669 3.720 0.353 1.00 0.00 H ATOM 89 HG2 LYS A 7 13.982 5.518 2.375 1.00 0.00 H ATOM 90 HG3 LYS A 7 13.755 5.895 0.669 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.565 5.381 2.683 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.036 6.954 2.046 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.240 6.496 0.707 1.00 0.00 H ATOM 94 HE3 LYS A 7 11.535 5.809 -0.267 1.00 0.00 H ATOM 95 HZ1 LYS A 7 10.870 3.616 0.611 1.00 0.00 H ATOM 96 N ARG A 8 12.849 0.548 2.007 1.00 0.00 N ATOM 97 CA ARG A 8 12.284 -0.690 1.482 1.00 0.00 C ATOM 98 C ARG A 8 11.113 -1.170 2.320 1.00 0.00 C ATOM 99 O ARG A 8 9.998 -1.305 1.818 1.00 0.00 O ATOM 100 CB ARG A 8 13.355 -1.778 1.383 1.00 0.00 C ATOM 101 CG ARG A 8 14.485 -1.411 0.438 1.00 0.00 C ATOM 102 CD ARG A 8 13.955 -0.997 -0.928 1.00 0.00 C ATOM 103 NE ARG A 8 13.232 -2.078 -1.597 1.00 0.00 N ATOM 104 CZ ARG A 8 12.619 -1.947 -2.778 1.00 0.00 C ATOM 105 NH1 ARG A 8 12.601 -0.771 -3.406 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 12.017 -2.994 -3.329 1.00 0.00 N ATOM 107 H ARG A 8 13.688 0.521 2.508 1.00 0.00 H ATOM 108 HA ARG A 8 11.912 -0.477 0.489 1.00 0.00 H ATOM 109 HB2 ARG A 8 13.771 -1.952 2.364 1.00 0.00 H ATOM 110 HB3 ARG A 8 12.897 -2.689 1.027 1.00 0.00 H ATOM 111 HG2 ARG A 8 15.037 -0.584 0.861 1.00 0.00 H ATOM 112 HG3 ARG A 8 15.139 -2.264 0.321 1.00 0.00 H ATOM 113 HD2 ARG A 8 13.286 -0.162 -0.795 1.00 0.00 H ATOM 114 HD3 ARG A 8 14.788 -0.696 -1.546 1.00 0.00 H ATOM 115 HE ARG A 8 13.211 -2.951 -1.151 1.00 0.00 H ATOM 116 HH11 ARG A 8 13.043 0.025 -2.997 1.00 0.00 H ATOM 117 HH12 ARG A 8 12.139 -0.685 -4.288 1.00 0.00 H ATOM 118 HH21 ARG A 8 12.020 -3.878 -2.859 1.00 0.00 H ATOM 119 HH22 ARG A 8 11.559 -2.900 -4.212 1.00 0.00 H ATOM 120 N LYS A 9 11.361 -1.428 3.593 1.00 0.00 N ATOM 121 CA LYS A 9 10.301 -1.897 4.474 1.00 0.00 C ATOM 122 C LYS A 9 9.377 -0.746 4.875 1.00 0.00 C ATOM 123 O LYS A 9 8.164 -0.932 4.981 1.00 0.00 O ATOM 124 CB LYS A 9 10.882 -2.590 5.710 1.00 0.00 C ATOM 125 CG LYS A 9 9.879 -3.496 6.415 1.00 0.00 C ATOM 126 CD LYS A 9 10.508 -4.279 7.560 1.00 0.00 C ATOM 127 CE LYS A 9 10.640 -3.444 8.825 1.00 0.00 C ATOM 128 NZ LYS A 9 11.562 -2.287 8.650 1.00 0.00 N1+ ATOM 129 H LYS A 9 12.268 -1.306 3.944 1.00 0.00 H ATOM 130 HA LYS A 9 9.721 -2.617 3.919 1.00 0.00 H ATOM 131 HB2 LYS A 9 11.731 -3.190 5.408 1.00 0.00 H ATOM 132 HB3 LYS A 9 11.214 -1.838 6.411 1.00 0.00 H ATOM 133 HG2 LYS A 9 9.080 -2.887 6.810 1.00 0.00 H ATOM 134 HG3 LYS A 9 9.476 -4.193 5.693 1.00 0.00 H ATOM 135 HD2 LYS A 9 9.891 -5.140 7.774 1.00 0.00 H ATOM 136 HD3 LYS A 9 11.490 -4.609 7.256 1.00 0.00 H ATOM 137 HE2 LYS A 9 9.664 -3.071 9.094 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.013 -4.076 9.618 1.00 0.00 H ATOM 139 HZ1 LYS A 9 12.326 -2.533 7.987 1.00 0.00 H ATOM 140 HZ2 LYS A 9 11.985 -2.027 9.565 1.00 0.00 H ATOM 141 HZ3 LYS A 9 11.042 -1.469 8.276 1.00 0.00 H ATOM 142 N SER A 10 9.954 0.441 5.089 1.00 0.00 N ATOM 143 CA SER A 10 9.174 1.621 5.473 1.00 0.00 C ATOM 144 C SER A 10 8.137 1.974 4.404 1.00 0.00 C ATOM 145 O SER A 10 6.950 2.071 4.702 1.00 0.00 O ATOM 146 CB SER A 10 10.092 2.822 5.739 1.00 0.00 C ATOM 147 OG SER A 10 9.342 3.968 6.109 1.00 0.00 O ATOM 148 H SER A 10 10.925 0.523 4.985 1.00 0.00 H ATOM 149 HA SER A 10 8.649 1.380 6.384 1.00 0.00 H ATOM 150 HB2 SER A 10 10.774 2.581 6.543 1.00 0.00 H ATOM 151 HB3 SER A 10 10.655 3.050 4.846 1.00 0.00 H ATOM 152 HG SER A 10 9.030 4.416 5.319 1.00 0.00 H ATOM 153 N ASP A 11 8.585 2.157 3.158 1.00 0.00 N ATOM 154 CA ASP A 11 7.674 2.492 2.055 1.00 0.00 C ATOM 155 C ASP A 11 6.667 1.364 1.795 1.00 0.00 C ATOM 156 O ASP A 11 5.486 1.625 1.556 1.00 0.00 O ATOM 157 CB ASP A 11 8.462 2.833 0.779 1.00 0.00 C ATOM 158 CG ASP A 11 8.988 4.265 0.778 1.00 0.00 C ATOM 159 OD1 ASP A 11 8.214 5.220 0.860 1.00 0.00 O ATOM 160 H ASP A 11 9.544 2.060 2.978 1.00 0.00 H ATOM 161 HA ASP A 11 7.117 3.367 2.356 1.00 0.00 H ATOM 162 HB2 ASP A 11 9.299 2.164 0.694 1.00 0.00 H ATOM 163 HB3 ASP A 11 7.825 2.704 -0.081 1.00 0.00 H ATOM 164 N ARG A 12 7.133 0.113 1.858 1.00 0.00 N ATOM 165 CA ARG A 12 6.262 -1.050 1.643 1.00 0.00 C ATOM 166 C ARG A 12 5.114 -1.084 2.668 1.00 0.00 C ATOM 167 O ARG A 12 3.985 -1.435 2.330 1.00 0.00 O ATOM 168 CB ARG A 12 7.088 -2.342 1.702 1.00 0.00 C ATOM 169 CG ARG A 12 6.263 -3.619 1.615 1.00 0.00 C ATOM 170 CD ARG A 12 7.143 -4.860 1.664 1.00 0.00 C ATOM 171 NE ARG A 12 6.606 -5.875 2.570 1.00 0.00 N ATOM 172 CZ ARG A 12 6.554 -5.743 3.903 1.00 0.00 C ATOM 173 NH1 ARG A 12 7.039 -4.654 4.502 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 6.015 -6.708 4.641 1.00 0.00 N ATOM 175 H ARG A 12 8.081 -0.032 2.062 1.00 0.00 H ATOM 176 HA ARG A 12 5.835 -0.957 0.657 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.787 -2.340 0.878 1.00 0.00 H ATOM 178 HB3 ARG A 12 7.641 -2.359 2.630 1.00 0.00 H ATOM 179 HG2 ARG A 12 5.570 -3.648 2.444 1.00 0.00 H ATOM 180 HG3 ARG A 12 5.713 -3.618 0.685 1.00 0.00 H ATOM 181 HD2 ARG A 12 7.210 -5.280 0.672 1.00 0.00 H ATOM 182 HD3 ARG A 12 8.130 -4.576 2.000 1.00 0.00 H ATOM 183 HE ARG A 12 6.253 -6.695 2.168 1.00 0.00 H ATOM 184 HH11 ARG A 12 7.448 -3.923 3.960 1.00 0.00 H ATOM 185 HH12 ARG A 12 6.998 -4.571 5.496 1.00 0.00 H ATOM 186 HH21 ARG A 12 5.651 -7.528 4.203 1.00 0.00 H ATOM 187 HH22 ARG A 12 5.975 -6.614 5.636 1.00 0.00 H ATOM 188 N LYS A 13 5.411 -0.704 3.913 1.00 0.00 N ATOM 189 CA LYS A 13 4.408 -0.670 4.983 1.00 0.00 C ATOM 190 C LYS A 13 3.558 0.605 4.884 1.00 0.00 C ATOM 191 O LYS A 13 2.345 0.582 5.104 1.00 0.00 O ATOM 192 CB LYS A 13 5.109 -0.724 6.346 1.00 0.00 C ATOM 193 CG LYS A 13 5.909 -2.002 6.581 1.00 0.00 C ATOM 194 CD LYS A 13 5.024 -3.209 6.875 1.00 0.00 C ATOM 195 CE LYS A 13 4.420 -3.154 8.273 1.00 0.00 C ATOM 196 NZ LYS A 13 3.293 -2.182 8.363 1.00 0.00 N1+ ATOM 197 H LYS A 13 6.328 -0.427 4.116 1.00 0.00 H ATOM 198 HA LYS A 13 3.766 -1.531 4.876 1.00 0.00 H ATOM 199 HB2 LYS A 13 5.789 0.114 6.414 1.00 0.00 H ATOM 200 HB3 LYS A 13 4.370 -0.635 7.126 1.00 0.00 H ATOM 201 HG2 LYS A 13 6.488 -2.213 5.697 1.00 0.00 H ATOM 202 HG3 LYS A 13 6.576 -1.847 7.416 1.00 0.00 H ATOM 203 HD2 LYS A 13 4.222 -3.238 6.154 1.00 0.00 H ATOM 204 HD3 LYS A 13 5.619 -4.104 6.787 1.00 0.00 H ATOM 205 HE2 LYS A 13 4.057 -4.138 8.535 1.00 0.00 H ATOM 206 HE3 LYS A 13 5.191 -2.861 8.974 1.00 0.00 H ATOM 207 HZ1 LYS A 13 2.468 -2.629 8.813 1.00 0.00 H ATOM 208 HZ2 LYS A 13 3.020 -1.865 7.413 1.00 0.00 H ATOM 209 HZ3 LYS A 13 3.578 -1.354 8.926 1.00 0.00 H ATOM 210 N LYS A 14 4.227 1.713 4.558 1.00 0.00 N ATOM 211 CA LYS A 14 3.593 3.028 4.430 1.00 0.00 C ATOM 212 C LYS A 14 2.450 3.049 3.429 1.00 0.00 C ATOM 213 O LYS A 14 1.434 3.698 3.669 1.00 0.00 O ATOM 214 CB LYS A 14 4.638 4.065 4.011 1.00 0.00 C ATOM 215 CG LYS A 14 5.436 4.623 5.172 1.00 0.00 C ATOM 216 CD LYS A 14 4.552 5.378 6.156 1.00 0.00 C ATOM 217 CE LYS A 14 3.994 6.671 5.570 1.00 0.00 C ATOM 218 NZ LYS A 14 2.803 6.472 4.738 1.00 0.00 N1+ ATOM 219 H LYS A 14 5.195 1.646 4.412 1.00 0.00 H ATOM 220 HA LYS A 14 3.203 3.303 5.401 1.00 0.00 H ATOM 221 HB2 LYS A 14 5.329 3.601 3.323 1.00 0.00 H ATOM 222 HB3 LYS A 14 4.147 4.882 3.511 1.00 0.00 H ATOM 223 HG2 LYS A 14 5.913 3.806 5.689 1.00 0.00 H ATOM 224 HG3 LYS A 14 6.188 5.295 4.787 1.00 0.00 H ATOM 225 HD2 LYS A 14 3.730 4.741 6.441 1.00 0.00 H ATOM 226 HD3 LYS A 14 5.138 5.616 7.031 1.00 0.00 H ATOM 227 HE2 LYS A 14 3.737 7.330 6.383 1.00 0.00 H ATOM 228 HE3 LYS A 14 4.762 7.135 4.967 1.00 0.00 H ATOM 229 HZ1 LYS A 14 2.894 5.927 3.933 1.00 0.00 H ATOM 230 N LYS A 15 2.613 2.368 2.302 1.00 0.00 N ATOM 231 CA LYS A 15 1.568 2.355 1.281 1.00 0.00 C ATOM 232 C LYS A 15 0.232 1.930 1.884 1.00 0.00 C ATOM 233 O LYS A 15 -0.824 2.439 1.499 1.00 0.00 O ATOM 234 CB LYS A 15 1.934 1.431 0.118 1.00 0.00 C ATOM 235 CG LYS A 15 2.120 -0.024 0.519 1.00 0.00 C ATOM 236 CD LYS A 15 1.689 -0.977 -0.584 1.00 0.00 C ATOM 237 CE LYS A 15 0.173 -1.001 -0.753 1.00 0.00 C ATOM 238 NZ LYS A 15 -0.301 -0.040 -1.792 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.449 1.876 2.152 1.00 0.00 H ATOM 240 HA LYS A 15 1.470 3.363 0.906 1.00 0.00 H ATOM 241 HB2 LYS A 15 1.156 1.482 -0.624 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.859 1.777 -0.320 1.00 0.00 H ATOM 243 HG2 LYS A 15 3.162 -0.191 0.735 1.00 0.00 H ATOM 244 HG3 LYS A 15 1.533 -0.223 1.402 1.00 0.00 H ATOM 245 HD2 LYS A 15 2.138 -0.657 -1.513 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.033 -1.970 -0.341 1.00 0.00 H ATOM 247 HE2 LYS A 15 -0.130 -1.997 -1.032 1.00 0.00 H ATOM 248 HE3 LYS A 15 -0.283 -0.741 0.193 1.00 0.00 H ATOM 249 HZ1 LYS A 15 -1.215 -0.357 -2.178 1.00 0.00 H ATOM 250 HZ2 LYS A 15 0.388 0.017 -2.569 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -0.423 0.907 -1.379 1.00 0.00 H ATOM 252 N ASN A 16 0.293 1.000 2.838 1.00 0.00 N ATOM 253 CA ASN A 16 -0.897 0.492 3.510 1.00 0.00 C ATOM 254 C ASN A 16 -1.345 1.435 4.628 1.00 0.00 C ATOM 255 O ASN A 16 -2.525 1.773 4.728 1.00 0.00 O ATOM 256 CB ASN A 16 -0.614 -0.905 4.068 1.00 0.00 C ATOM 257 CG ASN A 16 -1.844 -1.565 4.667 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.422 -1.068 5.633 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.253 -2.690 4.085 1.00 0.00 N ATOM 260 H ASN A 16 1.172 0.645 3.097 1.00 0.00 H ATOM 261 HA ASN A 16 -1.686 0.423 2.779 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.247 -1.534 3.271 1.00 0.00 H ATOM 263 HB3 ASN A 16 0.142 -0.833 4.836 1.00 0.00 H ATOM 264 HD21 ASN A 16 -1.747 -3.022 3.313 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.041 -3.143 4.454 1.00 0.00 H ATOM 266 N GLN A 17 -0.392 1.855 5.461 1.00 0.00 N ATOM 267 CA GLN A 17 -0.681 2.760 6.573 1.00 0.00 C ATOM 268 C GLN A 17 -1.185 4.112 6.070 1.00 0.00 C ATOM 269 O GLN A 17 -2.292 4.534 6.405 1.00 0.00 O ATOM 270 CB GLN A 17 0.567 2.937 7.441 1.00 0.00 C ATOM 271 CG GLN A 17 0.677 1.906 8.556 1.00 0.00 C ATOM 272 CD GLN A 17 1.903 2.084 9.446 1.00 0.00 C ATOM 273 OE1 GLN A 17 1.970 1.511 10.534 1.00 0.00 O ATOM 274 NE2 GLN A 17 2.888 2.855 8.992 1.00 0.00 N ATOM 275 H GLN A 17 0.529 1.550 5.322 1.00 0.00 H ATOM 276 HA GLN A 17 -1.454 2.308 7.172 1.00 0.00 H ATOM 277 HB2 GLN A 17 1.442 2.850 6.814 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.551 3.918 7.882 1.00 0.00 H ATOM 279 HG2 GLN A 17 -0.208 1.974 9.173 1.00 0.00 H ATOM 280 HG3 GLN A 17 0.721 0.925 8.110 1.00 0.00 H ATOM 281 HE21 GLN A 17 2.788 3.271 8.115 1.00 0.00 H ATOM 282 HE22 GLN A 17 3.679 2.974 9.559 1.00 0.00 H ATOM 283 N ASP A 18 -0.369 4.773 5.258 1.00 0.00 N ATOM 284 CA ASP A 18 -0.723 6.071 4.692 1.00 0.00 C ATOM 285 C ASP A 18 -1.870 5.942 3.684 1.00 0.00 C ATOM 286 O ASP A 18 -2.852 6.682 3.752 1.00 0.00 O ATOM 287 CB ASP A 18 0.500 6.706 4.024 1.00 0.00 C ATOM 288 CG ASP A 18 1.617 7.008 5.009 1.00 0.00 C ATOM 289 OD1 ASP A 18 1.416 7.725 5.988 1.00 0.00 O ATOM 290 H ASP A 18 0.494 4.374 5.028 1.00 0.00 H ATOM 291 HA ASP A 18 -1.045 6.707 5.503 1.00 0.00 H ATOM 292 HB2 ASP A 18 0.883 6.028 3.277 1.00 0.00 H ATOM 293 HB3 ASP A 18 0.204 7.628 3.550 1.00 0.00 H HETATM 294 N NH2 A 19 -1.753 4.998 2.749 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.947 4.441 2.747 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -2.481 4.896 2.101 1.00 0.00 H TER 297 NH2 A 19 ENDMDL MODEL 20 ATOM 1 N PHE A 1 25.583 -6.138 9.473 1.00 0.00 N ATOM 2 CA PHE A 1 25.364 -6.390 8.050 1.00 0.00 C ATOM 3 C PHE A 1 24.103 -5.684 7.538 1.00 0.00 C ATOM 4 O PHE A 1 23.002 -5.895 8.050 1.00 0.00 O ATOM 5 CB PHE A 1 25.289 -7.899 7.782 1.00 0.00 C ATOM 6 CG PHE A 1 24.490 -8.671 8.803 1.00 0.00 C ATOM 7 CD1 PHE A 1 23.104 -8.610 8.820 1.00 0.00 C ATOM 8 CD2 PHE A 1 25.134 -9.445 9.759 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.378 -9.307 9.768 1.00 0.00 C ATOM 10 CE2 PHE A 1 24.410 -10.143 10.707 1.00 0.00 C ATOM 11 CZ PHE A 1 23.030 -10.075 10.710 1.00 0.00 C ATOM 12 H1 PHE A 1 26.464 -5.823 9.775 1.00 0.00 H ATOM 13 HA PHE A 1 26.214 -5.989 7.518 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.832 -8.058 6.816 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.291 -8.302 7.768 1.00 0.00 H ATOM 16 HD1 PHE A 1 22.590 -8.014 8.081 1.00 0.00 H ATOM 17 HD2 PHE A 1 26.212 -9.497 9.757 1.00 0.00 H ATOM 18 HE1 PHE A 1 21.298 -9.251 9.770 1.00 0.00 H ATOM 19 HE2 PHE A 1 24.921 -10.745 11.442 1.00 0.00 H ATOM 20 HZ PHE A 1 22.463 -10.620 11.451 1.00 0.00 H ATOM 21 N GLY A 2 24.285 -4.839 6.522 1.00 0.00 N ATOM 22 CA GLY A 2 23.173 -4.098 5.940 1.00 0.00 C ATOM 23 C GLY A 2 22.643 -4.711 4.653 1.00 0.00 C ATOM 24 O GLY A 2 22.649 -4.057 3.608 1.00 0.00 O ATOM 25 H GLY A 2 25.189 -4.715 6.162 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.368 -4.060 6.656 1.00 0.00 H ATOM 27 HA3 GLY A 2 23.500 -3.088 5.734 1.00 0.00 H ATOM 28 N GLY A 3 22.185 -5.960 4.715 1.00 0.00 N ATOM 29 CA GLY A 3 21.663 -6.612 3.524 1.00 0.00 C ATOM 30 C GLY A 3 20.166 -6.409 3.319 1.00 0.00 C ATOM 31 O GLY A 3 19.507 -7.260 2.717 1.00 0.00 O ATOM 32 H GLY A 3 22.204 -6.441 5.568 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.183 -6.223 2.663 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.863 -7.670 3.598 1.00 0.00 H ATOM 35 N PHE A 4 19.625 -5.285 3.806 1.00 0.00 N ATOM 36 CA PHE A 4 18.196 -4.985 3.661 1.00 0.00 C ATOM 37 C PHE A 4 17.951 -3.480 3.547 1.00 0.00 C ATOM 38 O PHE A 4 18.615 -2.682 4.212 1.00 0.00 O ATOM 39 CB PHE A 4 17.395 -5.518 4.854 1.00 0.00 C ATOM 40 CG PHE A 4 17.233 -7.010 4.884 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.299 -7.831 5.211 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.013 -7.590 4.581 1.00 0.00 C ATOM 43 CE1 PHE A 4 18.152 -9.203 5.232 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.857 -8.961 4.602 1.00 0.00 C ATOM 45 CZ PHE A 4 16.928 -9.769 4.928 1.00 0.00 C ATOM 46 H PHE A 4 20.200 -4.641 4.270 1.00 0.00 H ATOM 47 HA PHE A 4 17.848 -5.467 2.759 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.894 -5.225 5.764 1.00 0.00 H ATOM 49 HB3 PHE A 4 16.409 -5.077 4.836 1.00 0.00 H ATOM 50 HD1 PHE A 4 19.254 -7.389 5.452 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.175 -6.957 4.327 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.991 -9.830 5.488 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.900 -9.401 4.364 1.00 0.00 H ATOM 54 HZ PHE A 4 16.811 -10.842 4.943 1.00 0.00 H ATOM 55 N THR A 5 16.975 -3.104 2.715 1.00 0.00 N ATOM 56 CA THR A 5 16.620 -1.696 2.524 1.00 0.00 C ATOM 57 C THR A 5 15.511 -1.271 3.491 1.00 0.00 C ATOM 58 O THR A 5 14.381 -1.763 3.413 1.00 0.00 O ATOM 59 CB THR A 5 16.156 -1.411 1.076 1.00 0.00 C ATOM 60 OG1 THR A 5 15.069 -2.277 0.722 1.00 0.00 O ATOM 61 CG2 THR A 5 17.300 -1.597 0.087 1.00 0.00 C ATOM 62 H THR A 5 16.476 -3.793 2.227 1.00 0.00 H ATOM 63 HA THR A 5 17.499 -1.100 2.720 1.00 0.00 H ATOM 64 HB THR A 5 15.818 -0.384 1.021 1.00 0.00 H ATOM 65 HG1 THR A 5 14.460 -1.810 0.146 1.00 0.00 H ATOM 66 HG21 THR A 5 18.162 -1.043 0.425 1.00 0.00 H ATOM 67 HG22 THR A 5 16.997 -1.232 -0.883 1.00 0.00 H ATOM 68 HG23 THR A 5 17.552 -2.646 0.018 1.00 0.00 H ATOM 69 N GLY A 6 15.841 -0.345 4.395 1.00 0.00 N ATOM 70 CA GLY A 6 14.867 0.147 5.365 1.00 0.00 C ATOM 71 C GLY A 6 13.668 0.819 4.707 1.00 0.00 C ATOM 72 O GLY A 6 12.530 0.627 5.139 1.00 0.00 O ATOM 73 H GLY A 6 16.754 0.015 4.401 1.00 0.00 H ATOM 74 HA2 GLY A 6 14.518 -0.685 5.963 1.00 0.00 H ATOM 75 HA3 GLY A 6 15.354 0.860 6.016 1.00 0.00 H ATOM 76 N LYS A 7 13.934 1.602 3.657 1.00 0.00 N ATOM 77 CA LYS A 7 12.886 2.312 2.913 1.00 0.00 C ATOM 78 C LYS A 7 11.775 1.367 2.425 1.00 0.00 C ATOM 79 O LYS A 7 10.618 1.774 2.308 1.00 0.00 O ATOM 80 CB LYS A 7 13.501 3.037 1.709 1.00 0.00 C ATOM 81 CG LYS A 7 12.471 3.690 0.808 1.00 0.00 C ATOM 82 CD LYS A 7 11.765 4.848 1.498 1.00 0.00 C ATOM 83 CE LYS A 7 10.477 5.184 0.778 1.00 0.00 C ATOM 84 NZ LYS A 7 9.559 4.050 0.808 1.00 0.00 N1+ ATOM 85 H LYS A 7 14.865 1.706 3.368 1.00 0.00 H ATOM 86 HA LYS A 7 12.451 3.042 3.573 1.00 0.00 H ATOM 87 HB2 LYS A 7 14.176 3.803 2.065 1.00 0.00 H ATOM 88 HB3 LYS A 7 14.059 2.322 1.120 1.00 0.00 H ATOM 89 HG2 LYS A 7 12.958 4.055 -0.083 1.00 0.00 H ATOM 90 HG3 LYS A 7 11.734 2.947 0.536 1.00 0.00 H ATOM 91 HD2 LYS A 7 11.534 4.566 2.517 1.00 0.00 H ATOM 92 HD3 LYS A 7 12.411 5.714 1.493 1.00 0.00 H ATOM 93 HE2 LYS A 7 10.014 6.031 1.259 1.00 0.00 H ATOM 94 HE3 LYS A 7 10.705 5.429 -0.250 1.00 0.00 H ATOM 95 HZ1 LYS A 7 9.882 3.197 0.449 1.00 0.00 H ATOM 96 N ARG A 8 12.135 0.116 2.126 1.00 0.00 N ATOM 97 CA ARG A 8 11.171 -0.873 1.637 1.00 0.00 C ATOM 98 C ARG A 8 10.087 -1.146 2.672 1.00 0.00 C ATOM 99 O ARG A 8 8.894 -1.047 2.382 1.00 0.00 O ATOM 100 CB ARG A 8 11.895 -2.188 1.318 1.00 0.00 C ATOM 101 CG ARG A 8 11.808 -2.648 -0.134 1.00 0.00 C ATOM 102 CD ARG A 8 10.371 -2.748 -0.628 1.00 0.00 C ATOM 103 NE ARG A 8 9.877 -1.486 -1.188 1.00 0.00 N ATOM 104 CZ ARG A 8 8.659 -1.333 -1.720 1.00 0.00 C ATOM 105 NH1 ARG A 8 7.838 -2.375 -1.836 1.00 0.00 N1+ ATOM 106 NH2 ARG A 8 8.268 -0.140 -2.159 1.00 0.00 N ATOM 107 H ARG A 8 13.071 -0.148 2.233 1.00 0.00 H ATOM 108 HA ARG A 8 10.712 -0.486 0.739 1.00 0.00 H ATOM 109 HB2 ARG A 8 12.937 -2.074 1.566 1.00 0.00 H ATOM 110 HB3 ARG A 8 11.476 -2.968 1.940 1.00 0.00 H ATOM 111 HG2 ARG A 8 12.342 -1.948 -0.755 1.00 0.00 H ATOM 112 HG3 ARG A 8 12.269 -3.624 -0.210 1.00 0.00 H ATOM 113 HD2 ARG A 8 10.319 -3.512 -1.387 1.00 0.00 H ATOM 114 HD3 ARG A 8 9.740 -3.027 0.203 1.00 0.00 H ATOM 115 HE ARG A 8 10.475 -0.709 -1.148 1.00 0.00 H ATOM 116 HH11 ARG A 8 8.127 -3.278 -1.523 1.00 0.00 H ATOM 117 HH12 ARG A 8 6.929 -2.253 -2.234 1.00 0.00 H ATOM 118 HH21 ARG A 8 8.882 0.647 -2.090 1.00 0.00 H ATOM 119 HH22 ARG A 8 7.354 -0.025 -2.553 1.00 0.00 H ATOM 120 N LYS A 9 10.521 -1.507 3.876 1.00 0.00 N ATOM 121 CA LYS A 9 9.610 -1.825 4.976 1.00 0.00 C ATOM 122 C LYS A 9 8.692 -0.641 5.307 1.00 0.00 C ATOM 123 O LYS A 9 7.462 -0.785 5.370 1.00 0.00 O ATOM 124 CB LYS A 9 10.429 -2.211 6.212 1.00 0.00 C ATOM 125 CG LYS A 9 9.607 -2.830 7.331 1.00 0.00 C ATOM 126 CD LYS A 9 9.681 -4.349 7.291 1.00 0.00 C ATOM 127 CE LYS A 9 11.064 -4.845 7.701 1.00 0.00 C ATOM 128 NZ LYS A 9 11.309 -6.253 7.274 1.00 0.00 N1+ ATOM 129 H LYS A 9 11.490 -1.573 4.025 1.00 0.00 H ATOM 130 HA LYS A 9 9.007 -2.666 4.678 1.00 0.00 H ATOM 131 HB2 LYS A 9 11.183 -2.927 5.914 1.00 0.00 H ATOM 132 HB3 LYS A 9 10.919 -1.330 6.596 1.00 0.00 H ATOM 133 HG2 LYS A 9 9.991 -2.483 8.279 1.00 0.00 H ATOM 134 HG3 LYS A 9 8.575 -2.523 7.223 1.00 0.00 H ATOM 135 HD2 LYS A 9 8.946 -4.753 7.971 1.00 0.00 H ATOM 136 HD3 LYS A 9 9.469 -4.684 6.286 1.00 0.00 H ATOM 137 HE2 LYS A 9 11.811 -4.206 7.254 1.00 0.00 H ATOM 138 HE3 LYS A 9 11.142 -4.787 8.778 1.00 0.00 H ATOM 139 HZ1 LYS A 9 12.318 -6.391 7.057 1.00 0.00 H ATOM 140 HZ2 LYS A 9 10.752 -6.471 6.422 1.00 0.00 H ATOM 141 HZ3 LYS A 9 11.035 -6.912 8.032 1.00 0.00 H ATOM 142 N SER A 10 9.310 0.523 5.525 1.00 0.00 N ATOM 143 CA SER A 10 8.585 1.749 5.871 1.00 0.00 C ATOM 144 C SER A 10 7.463 2.059 4.880 1.00 0.00 C ATOM 145 O SER A 10 6.305 2.189 5.275 1.00 0.00 O ATOM 146 CB SER A 10 9.560 2.932 5.928 1.00 0.00 C ATOM 147 OG SER A 10 8.895 4.140 6.267 1.00 0.00 O ATOM 148 H SER A 10 10.286 0.556 5.464 1.00 0.00 H ATOM 149 HA SER A 10 8.155 1.609 6.847 1.00 0.00 H ATOM 150 HB2 SER A 10 10.319 2.732 6.670 1.00 0.00 H ATOM 151 HB3 SER A 10 10.030 3.051 4.960 1.00 0.00 H ATOM 152 HG SER A 10 9.195 4.846 5.688 1.00 0.00 H ATOM 153 N ASP A 11 7.816 2.187 3.604 1.00 0.00 N ATOM 154 CA ASP A 11 6.840 2.500 2.560 1.00 0.00 C ATOM 155 C ASP A 11 5.829 1.373 2.363 1.00 0.00 C ATOM 156 O ASP A 11 4.669 1.630 2.041 1.00 0.00 O ATOM 157 CB ASP A 11 7.539 2.809 1.235 1.00 0.00 C ATOM 158 CG ASP A 11 8.328 4.104 1.292 1.00 0.00 C ATOM 159 OD1 ASP A 11 7.832 5.128 1.756 1.00 0.00 O ATOM 160 H ASP A 11 8.758 2.080 3.360 1.00 0.00 H ATOM 161 HA ASP A 11 6.304 3.381 2.876 1.00 0.00 H ATOM 162 HB2 ASP A 11 8.224 2.006 1.004 1.00 0.00 H ATOM 163 HB3 ASP A 11 6.805 2.882 0.449 1.00 0.00 H ATOM 164 N ARG A 12 6.273 0.130 2.554 1.00 0.00 N ATOM 165 CA ARG A 12 5.400 -1.030 2.394 1.00 0.00 C ATOM 166 C ARG A 12 4.129 -0.856 3.212 1.00 0.00 C ATOM 167 O ARG A 12 3.033 -1.179 2.752 1.00 0.00 O ATOM 168 CB ARG A 12 6.117 -2.307 2.823 1.00 0.00 C ATOM 169 CG ARG A 12 5.349 -3.575 2.488 1.00 0.00 C ATOM 170 CD ARG A 12 6.012 -4.808 3.083 1.00 0.00 C ATOM 171 NE ARG A 12 7.475 -4.719 3.047 1.00 0.00 N ATOM 172 CZ ARG A 12 8.214 -4.741 1.934 1.00 0.00 C ATOM 173 NH1 ARG A 12 7.641 -4.898 0.743 1.00 0.00 N1+ ATOM 174 NH2 ARG A 12 9.535 -4.613 2.019 1.00 0.00 N ATOM 175 H ARG A 12 7.209 -0.011 2.806 1.00 0.00 H ATOM 176 HA ARG A 12 5.137 -1.108 1.352 1.00 0.00 H ATOM 177 HB2 ARG A 12 7.074 -2.352 2.323 1.00 0.00 H ATOM 178 HB3 ARG A 12 6.274 -2.279 3.891 1.00 0.00 H ATOM 179 HG2 ARG A 12 4.349 -3.491 2.890 1.00 0.00 H ATOM 180 HG3 ARG A 12 5.300 -3.682 1.413 1.00 0.00 H ATOM 181 HD2 ARG A 12 5.690 -4.914 4.109 1.00 0.00 H ATOM 182 HD3 ARG A 12 5.700 -5.675 2.517 1.00 0.00 H ATOM 183 HE ARG A 12 7.933 -4.616 3.906 1.00 0.00 H ATOM 184 HH11 ARG A 12 6.650 -4.998 0.672 1.00 0.00 H ATOM 185 HH12 ARG A 12 8.204 -4.916 -0.084 1.00 0.00 H ATOM 186 HH21 ARG A 12 9.970 -4.497 2.913 1.00 0.00 H ATOM 187 HH22 ARG A 12 10.096 -4.637 1.192 1.00 0.00 H ATOM 188 N LYS A 13 4.278 -0.338 4.425 1.00 0.00 N ATOM 189 CA LYS A 13 3.122 -0.112 5.290 1.00 0.00 C ATOM 190 C LYS A 13 2.604 1.322 5.146 1.00 0.00 C ATOM 191 O LYS A 13 1.395 1.557 5.150 1.00 0.00 O ATOM 192 CB LYS A 13 3.472 -0.396 6.751 1.00 0.00 C ATOM 193 CG LYS A 13 2.262 -0.745 7.601 1.00 0.00 C ATOM 194 CD LYS A 13 2.643 -0.944 9.059 1.00 0.00 C ATOM 195 CE LYS A 13 1.487 -1.513 9.867 1.00 0.00 C ATOM 196 NZ LYS A 13 0.287 -0.631 9.824 1.00 0.00 N1+ ATOM 197 H LYS A 13 5.179 -0.095 4.740 1.00 0.00 H ATOM 198 HA LYS A 13 2.340 -0.792 4.979 1.00 0.00 H ATOM 199 HB2 LYS A 13 4.166 -1.223 6.789 1.00 0.00 H ATOM 200 HB3 LYS A 13 3.942 0.480 7.174 1.00 0.00 H ATOM 201 HG2 LYS A 13 1.542 0.058 7.535 1.00 0.00 H ATOM 202 HG3 LYS A 13 1.823 -1.658 7.226 1.00 0.00 H ATOM 203 HD2 LYS A 13 3.477 -1.630 9.114 1.00 0.00 H ATOM 204 HD3 LYS A 13 2.928 0.009 9.478 1.00 0.00 H ATOM 205 HE2 LYS A 13 1.227 -2.480 9.462 1.00 0.00 H ATOM 206 HE3 LYS A 13 1.806 -1.626 10.893 1.00 0.00 H ATOM 207 HZ1 LYS A 13 -0.393 -0.917 10.557 1.00 0.00 H ATOM 208 HZ2 LYS A 13 -0.174 -0.700 8.894 1.00 0.00 H ATOM 209 HZ3 LYS A 13 0.564 0.359 9.989 1.00 0.00 H ATOM 210 N LYS A 14 3.537 2.273 5.029 1.00 0.00 N ATOM 211 CA LYS A 14 3.203 3.696 4.890 1.00 0.00 C ATOM 212 C LYS A 14 2.328 3.971 3.660 1.00 0.00 C ATOM 213 O LYS A 14 1.341 4.703 3.749 1.00 0.00 O ATOM 214 CB LYS A 14 4.491 4.535 4.826 1.00 0.00 C ATOM 215 CG LYS A 14 4.308 5.925 4.222 1.00 0.00 C ATOM 216 CD LYS A 14 3.229 6.722 4.941 1.00 0.00 C ATOM 217 CE LYS A 14 2.860 7.985 4.174 1.00 0.00 C ATOM 218 NZ LYS A 14 1.444 8.316 4.336 1.00 0.00 N1+ ATOM 219 H LYS A 14 4.479 2.010 5.044 1.00 0.00 H ATOM 220 HA LYS A 14 2.653 3.982 5.770 1.00 0.00 H ATOM 221 HB2 LYS A 14 4.879 4.652 5.828 1.00 0.00 H ATOM 222 HB3 LYS A 14 5.221 4.004 4.233 1.00 0.00 H ATOM 223 HG2 LYS A 14 5.241 6.461 4.290 1.00 0.00 H ATOM 224 HG3 LYS A 14 4.028 5.818 3.184 1.00 0.00 H ATOM 225 HD2 LYS A 14 2.348 6.109 5.047 1.00 0.00 H ATOM 226 HD3 LYS A 14 3.595 7.000 5.920 1.00 0.00 H ATOM 227 HE2 LYS A 14 3.456 8.806 4.548 1.00 0.00 H ATOM 228 HE3 LYS A 14 3.071 7.837 3.124 1.00 0.00 H ATOM 229 HZ1 LYS A 14 1.190 8.833 5.127 1.00 0.00 H ATOM 230 N LYS A 15 2.695 3.383 2.520 1.00 0.00 N ATOM 231 CA LYS A 15 1.945 3.564 1.272 1.00 0.00 C ATOM 232 C LYS A 15 0.482 3.185 1.459 1.00 0.00 C ATOM 233 O LYS A 15 -0.413 3.842 0.926 1.00 0.00 O ATOM 234 CB LYS A 15 2.569 2.718 0.152 1.00 0.00 C ATOM 235 CG LYS A 15 1.977 2.954 -1.234 1.00 0.00 C ATOM 236 CD LYS A 15 2.344 4.327 -1.778 1.00 0.00 C ATOM 237 CE LYS A 15 1.343 5.396 -1.359 1.00 0.00 C ATOM 238 NZ LYS A 15 0.018 5.217 -2.019 1.00 0.00 N1+ ATOM 239 H LYS A 15 3.488 2.807 2.517 1.00 0.00 H ATOM 240 HA LYS A 15 2.000 4.610 0.999 1.00 0.00 H ATOM 241 HB2 LYS A 15 3.626 2.935 0.103 1.00 0.00 H ATOM 242 HB3 LYS A 15 2.441 1.676 0.397 1.00 0.00 H ATOM 243 HG2 LYS A 15 2.358 2.199 -1.908 1.00 0.00 H ATOM 244 HG3 LYS A 15 0.901 2.874 -1.174 1.00 0.00 H ATOM 245 HD2 LYS A 15 3.319 4.602 -1.403 1.00 0.00 H ATOM 246 HD3 LYS A 15 2.375 4.277 -2.857 1.00 0.00 H ATOM 247 HE2 LYS A 15 1.210 5.346 -0.289 1.00 0.00 H ATOM 248 HE3 LYS A 15 1.740 6.366 -1.623 1.00 0.00 H ATOM 249 HZ1 LYS A 15 0.120 4.644 -2.881 1.00 0.00 H ATOM 250 HZ2 LYS A 15 -0.379 6.143 -2.279 1.00 0.00 H ATOM 251 HZ3 LYS A 15 -0.642 4.740 -1.373 1.00 0.00 H ATOM 252 N ASN A 16 0.249 2.123 2.223 1.00 0.00 N ATOM 253 CA ASN A 16 -1.107 1.656 2.488 1.00 0.00 C ATOM 254 C ASN A 16 -1.801 2.557 3.513 1.00 0.00 C ATOM 255 O ASN A 16 -3.002 2.809 3.409 1.00 0.00 O ATOM 256 CB ASN A 16 -1.078 0.205 2.985 1.00 0.00 C ATOM 257 CG ASN A 16 -2.307 -0.615 2.592 1.00 0.00 C ATOM 258 OD1 ASN A 16 -2.622 -1.605 3.250 1.00 0.00 O ATOM 259 ND2 ASN A 16 -2.985 -0.248 1.500 1.00 0.00 N ATOM 260 H ASN A 16 1.007 1.643 2.621 1.00 0.00 H ATOM 261 HA ASN A 16 -1.653 1.705 1.564 1.00 0.00 H ATOM 262 HB2 ASN A 16 -0.205 -0.285 2.580 1.00 0.00 H ATOM 263 HB3 ASN A 16 -1.008 0.207 4.064 1.00 0.00 H ATOM 264 HD21 ASN A 16 -2.673 0.521 0.989 1.00 0.00 H ATOM 265 HD22 ASN A 16 -3.773 -0.774 1.253 1.00 0.00 H ATOM 266 N GLN A 17 -1.035 3.034 4.506 1.00 0.00 N ATOM 267 CA GLN A 17 -1.570 3.905 5.560 1.00 0.00 C ATOM 268 C GLN A 17 -2.255 5.139 4.959 1.00 0.00 C ATOM 269 O GLN A 17 -3.480 5.269 5.019 1.00 0.00 O ATOM 270 CB GLN A 17 -0.437 4.350 6.500 1.00 0.00 C ATOM 271 CG GLN A 17 -0.902 5.075 7.756 1.00 0.00 C ATOM 272 CD GLN A 17 -1.527 4.140 8.777 1.00 0.00 C ATOM 273 OE1 GLN A 17 -0.933 3.131 9.155 1.00 0.00 O ATOM 274 NE2 GLN A 17 -2.726 4.473 9.241 1.00 0.00 N ATOM 275 H GLN A 17 -0.085 2.790 4.533 1.00 0.00 H ATOM 276 HA GLN A 17 -2.295 3.340 6.123 1.00 0.00 H ATOM 277 HB2 GLN A 17 0.119 3.479 6.808 1.00 0.00 H ATOM 278 HB3 GLN A 17 0.223 5.009 5.956 1.00 0.00 H ATOM 279 HG2 GLN A 17 -0.049 5.564 8.210 1.00 0.00 H ATOM 280 HG3 GLN A 17 -1.634 5.817 7.475 1.00 0.00 H ATOM 281 HE21 GLN A 17 -3.140 5.296 8.910 1.00 0.00 H ATOM 282 HE22 GLN A 17 -3.149 3.879 9.896 1.00 0.00 H ATOM 283 N ASP A 18 -1.454 6.035 4.376 1.00 0.00 N ATOM 284 CA ASP A 18 -1.969 7.261 3.755 1.00 0.00 C ATOM 285 C ASP A 18 -2.411 7.017 2.309 1.00 0.00 C ATOM 286 O ASP A 18 -3.426 7.553 1.862 1.00 0.00 O ATOM 287 CB ASP A 18 -0.928 8.395 3.816 1.00 0.00 C ATOM 288 CG ASP A 18 0.490 7.954 3.470 1.00 0.00 C ATOM 289 OD1 ASP A 18 0.721 7.311 2.445 1.00 0.00 O ATOM 290 H ASP A 18 -0.494 5.863 4.355 1.00 0.00 H ATOM 291 HA ASP A 18 -2.836 7.566 4.322 1.00 0.00 H ATOM 292 HB2 ASP A 18 -1.216 9.167 3.119 1.00 0.00 H ATOM 293 HB3 ASP A 18 -0.922 8.809 4.814 1.00 0.00 H HETATM 294 N NH2 A 19 -1.655 6.201 1.584 1.00 0.00 N HETATM 295 HN1 NH2 A 19 -0.861 5.812 2.003 1.00 0.00 H HETATM 296 HN2 NH2 A 19 -1.924 6.021 0.659 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 109 0 1 1 0 0 0 6 146 1 7 2 END