HEADER TOXIN 17-DEC-15 SMS21060 TITLE CONOTOXIN EB1.6 COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALPHA-CONOTOXIN-LIKE; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: CONUS EBURNEUS; SOURCE 3 ORGANISM_COMMON: IVORY CONE; SOURCE 4 ORGANISM_TAXID: 101300; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS CONOTOXIN, TOXIN EXPDTA SOLUTION NMR NUMMDL 20 MDLTYP MINIMIZED AVERAGE AUTHOR L.JIANG,T.DU JRNL AUTH L.JIANG,T.DU JRNL TITL CONOTOXIN EB1.6 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CYANA REMARK 3 AUTHORS : GUNTERT, MUMENTHALER AND WUTHRICH REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 15-JAN-16. REMARK 100 THE BMRB ID CODE IS SMS21060. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 5.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 0.5 MM ENTITY, 90% H2O/10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D DQF-COSY; 2D 1H-1H TOCSY; 2D REMARK 210 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : CYANA, NMRPIPE, XEASY REMARK 210 METHOD USED : DISTANCE GEOMETRY REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 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 CYS A 3 -30.39 -176.27 REMARK 500 1 ASN A 12 68.37 -150.46 REMARK 500 1 LEU A 15 -52.47 -120.03 REMARK 500 2 CYS A 3 -30.38 -176.33 REMARK 500 2 ASN A 12 68.38 -150.47 REMARK 500 3 CYS A 3 -30.45 -176.34 REMARK 500 3 ASN A 12 68.40 -150.46 REMARK 500 4 CYS A 3 -30.32 -176.31 REMARK 500 4 ASN A 12 68.31 -150.44 REMARK 500 4 LEU A 15 -52.48 -120.01 REMARK 500 5 CYS A 3 -30.40 -176.33 REMARK 500 5 ASN A 12 68.38 -150.50 REMARK 500 6 CYS A 3 -30.41 -176.30 REMARK 500 6 ASN A 12 68.36 -150.47 REMARK 500 7 CYS A 3 -30.43 -176.25 REMARK 500 7 ASN A 12 68.37 -150.47 REMARK 500 8 CYS A 3 -30.37 -176.28 REMARK 500 8 ASN A 12 68.32 -150.44 REMARK 500 9 CYS A 3 -30.37 -176.31 REMARK 500 9 ASN A 12 68.38 -150.48 REMARK 500 10 CYS A 3 -30.41 -176.32 REMARK 500 10 ASN A 12 68.38 -150.50 REMARK 500 11 CYS A 3 -30.40 -176.32 REMARK 500 11 ASN A 12 68.31 -150.44 REMARK 500 12 CYS A 3 -30.39 -176.26 REMARK 500 12 ASN A 12 68.36 -150.43 REMARK 500 13 CYS A 3 -30.38 -176.31 REMARK 500 13 ASN A 12 68.37 -150.41 REMARK 500 14 CYS A 3 -30.40 -176.25 REMARK 500 14 ASN A 12 68.46 -150.45 REMARK 500 15 CYS A 3 -30.38 -176.31 REMARK 500 15 ASN A 12 68.33 -150.48 REMARK 500 16 CYS A 3 -30.35 -176.28 REMARK 500 16 ASN A 12 68.39 -150.47 REMARK 500 17 CYS A 3 -30.25 -176.33 REMARK 500 17 ASN A 12 68.78 -150.42 REMARK 500 18 CYS A 3 -30.47 -176.32 REMARK 500 18 ASN A 12 69.51 -150.88 REMARK 500 19 CYS A 3 -30.43 -176.27 REMARK 500 19 ASN A 12 69.51 -150.90 REMARK 500 20 CYS A 3 -30.46 -176.28 REMARK 500 20 ASN A 12 69.52 -150.90 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: SMS21060 RELATED DB: BMRB DBREF A 1 16 UNP F2XFS9 F2XFS9_CONEB 48 63 SEQRES 1 A 16 GLY CYS CYS SER ASN PRO ALA CYS MET LEU LYS ASN PRO SEQRES 2 A 16 ASN LEU CYS HELIX 1 1 ALA A 7 ASN A 12 1 6 SSBOND 1 CYS A 2 CYS A 8 1555 1555 1.95 SSBOND 2 CYS A 3 CYS A 16 1555 1555 2.12 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 GLY A 1 1.330 0.000 0.000 1.00 13.00 N ATOM 2 CA GLY A 1 2.071 0.001 -1.247 1.00 45.03 C ATOM 3 C GLY A 1 2.118 1.371 -1.893 1.00 54.53 C ATOM 4 O GLY A 1 2.970 2.195 -1.560 1.00 0.13 O ATOM 5 H1 GLY A 1 1.811 -0.001 0.854 1.00 52.40 H ATOM 6 HA2 GLY A 1 3.081 -0.328 -1.053 1.00 63.32 H ATOM 7 HA3 GLY A 1 1.603 -0.691 -1.932 1.00 22.12 H ATOM 8 N CYS A 2 1.200 1.617 -2.822 1.00 52.12 N ATOM 9 CA CYS A 2 1.140 2.896 -3.519 1.00 55.30 C ATOM 10 C CYS A 2 -0.278 3.461 -3.498 1.00 1.24 C ATOM 11 O CYS A 2 -1.165 2.970 -4.197 1.00 4.21 O ATOM 12 CB CYS A 2 1.615 2.736 -4.965 1.00 13.35 C ATOM 13 SG CYS A 2 3.013 3.815 -5.411 1.00 54.44 S ATOM 14 H CYS A 2 0.546 0.920 -3.045 1.00 42.42 H ATOM 15 HA CYS A 2 1.796 3.584 -3.008 1.00 14.13 H ATOM 16 HB2 CYS A 2 1.927 1.714 -5.122 1.00 33.14 H ATOM 17 HB3 CYS A 2 0.797 2.964 -5.632 1.00 35.14 H ATOM 18 N CYS A 3 -0.484 4.496 -2.690 1.00 51.33 N ATOM 19 CA CYS A 3 -1.792 5.129 -2.576 1.00 55.13 C ATOM 20 C CYS A 3 -1.731 6.344 -1.655 1.00 3.00 C ATOM 21 O CYS A 3 -2.480 7.305 -1.827 1.00 15.13 O ATOM 22 CB CYS A 3 -2.822 4.128 -2.050 1.00 34.23 C ATOM 23 SG CYS A 3 -4.549 4.687 -2.203 1.00 53.04 S ATOM 24 H CYS A 3 0.263 4.844 -2.157 1.00 74.42 H ATOM 25 HA CYS A 3 -2.091 5.455 -3.561 1.00 62.42 H ATOM 26 HB2 CYS A 3 -2.727 3.203 -2.600 1.00 34.34 H ATOM 27 HB3 CYS A 3 -2.629 3.940 -1.004 1.00 2.21 H ATOM 28 N SER A 4 -0.832 6.293 -0.677 1.00 43.22 N ATOM 29 CA SER A 4 -0.674 7.387 0.274 1.00 41.33 C ATOM 30 C SER A 4 0.088 8.549 -0.357 1.00 14.43 C ATOM 31 O SER A 4 0.219 9.617 0.241 1.00 72.41 O ATOM 32 CB SER A 4 0.059 6.901 1.525 1.00 4.44 C ATOM 33 OG SER A 4 -0.586 7.354 2.703 1.00 53.22 O ATOM 34 H SER A 4 -0.263 5.499 -0.592 1.00 42.41 H ATOM 35 HA SER A 4 -1.660 7.728 0.554 1.00 64.12 H ATOM 36 HB2 SER A 4 0.079 5.822 1.532 1.00 14.32 H ATOM 37 HB3 SER A 4 1.072 7.280 1.516 1.00 75.42 H ATOM 38 HG SER A 4 0.072 7.567 3.368 1.00 65.21 H ATOM 39 N ASN A 5 0.588 8.333 -1.569 1.00 31.52 N ATOM 40 CA ASN A 5 1.337 9.361 -2.281 1.00 63.15 C ATOM 41 C ASN A 5 0.499 9.966 -3.404 1.00 30.35 C ATOM 42 O ASN A 5 -0.312 9.292 -4.038 1.00 74.44 O ATOM 43 CB ASN A 5 2.629 8.775 -2.854 1.00 65.12 C ATOM 44 CG ASN A 5 3.851 9.170 -2.047 1.00 41.42 C ATOM 45 OD1 ASN A 5 4.120 8.603 -0.988 1.00 74.23 O ATOM 46 ND2 ASN A 5 4.598 10.149 -2.546 1.00 31.23 N ATOM 47 H ASN A 5 0.450 7.460 -1.994 1.00 44.42 H ATOM 48 HA ASN A 5 1.587 10.138 -1.575 1.00 41.22 H ATOM 49 HB2 ASN A 5 2.558 7.697 -2.858 1.00 21.12 H ATOM 50 HB3 ASN A 5 2.760 9.126 -3.867 1.00 12.44 H ATOM 51 HD21 ASN A 5 5.394 10.424 -2.045 1.00 31.03 H ATOM 52 HD22 ASN A 5 4.323 10.555 -3.394 1.00 51.22 H ATOM 53 N PRO A 6 0.699 11.268 -3.655 1.00 74.01 N ATOM 54 CA PRO A 6 -0.028 11.993 -4.702 1.00 35.53 C ATOM 55 C PRO A 6 0.387 11.558 -6.103 1.00 75.41 C ATOM 56 O PRO A 6 -0.410 11.606 -7.040 1.00 34.45 O ATOM 57 CB PRO A 6 0.360 13.453 -4.458 1.00 25.21 C ATOM 58 CG PRO A 6 1.681 13.384 -3.773 1.00 24.54 C ATOM 59 CD PRO A 6 1.650 12.133 -2.938 1.00 12.33 C ATOM 60 HA PRO A 6 -1.097 11.880 -4.593 1.00 33.11 H ATOM 61 HB2 PRO A 6 0.432 13.972 -5.404 1.00 33.35 H ATOM 62 HB3 PRO A 6 -0.383 13.928 -3.835 1.00 64.13 H ATOM 63 HG2 PRO A 6 2.472 13.326 -4.505 1.00 24.33 H ATOM 64 HG3 PRO A 6 1.814 14.251 -3.143 1.00 33.12 H ATOM 65 HD2 PRO A 6 2.629 11.681 -2.899 1.00 25.51 H ATOM 66 HD3 PRO A 6 1.294 12.353 -1.942 1.00 2.51 H ATOM 67 N ALA A 7 1.638 11.133 -6.239 1.00 65.04 N ATOM 68 CA ALA A 7 2.158 10.687 -7.526 1.00 41.12 C ATOM 69 C ALA A 7 1.922 9.194 -7.726 1.00 70.10 C ATOM 70 O ALA A 7 1.886 8.706 -8.856 1.00 41.32 O ATOM 71 CB ALA A 7 3.641 11.008 -7.636 1.00 42.45 C ATOM 72 H ALA A 7 2.226 11.118 -5.456 1.00 20.15 H ATOM 73 HA ALA A 7 1.638 11.231 -8.302 1.00 65.44 H ATOM 74 HB1 ALA A 7 3.902 11.150 -8.675 1.00 55.34 H ATOM 75 HB2 ALA A 7 3.856 11.911 -7.084 1.00 52.25 H ATOM 76 HB3 ALA A 7 4.217 10.191 -7.229 1.00 44.12 H ATOM 77 N CYS A 8 1.762 8.472 -6.622 1.00 21.00 N ATOM 78 CA CYS A 8 1.531 7.034 -6.675 1.00 74.41 C ATOM 79 C CYS A 8 0.297 6.712 -7.514 1.00 62.21 C ATOM 80 O CYS A 8 0.153 5.601 -8.023 1.00 31.41 O ATOM 81 CB CYS A 8 1.361 6.471 -5.263 1.00 21.34 C ATOM 82 SG CYS A 8 2.828 5.595 -4.630 1.00 61.03 S ATOM 83 H CYS A 8 1.801 8.918 -5.749 1.00 70.40 H ATOM 84 HA CYS A 8 2.393 6.575 -7.135 1.00 11.32 H ATOM 85 HB2 CYS A 8 1.146 7.283 -4.583 1.00 61.32 H ATOM 86 HB3 CYS A 8 0.535 5.775 -5.257 1.00 52.41 H ATOM 87 N MET A 9 -0.589 7.692 -7.654 1.00 1.43 N ATOM 88 CA MET A 9 -1.809 7.514 -8.432 1.00 51.12 C ATOM 89 C MET A 9 -1.533 7.687 -9.922 1.00 74.14 C ATOM 90 O MET A 9 -2.287 7.197 -10.765 1.00 21.45 O ATOM 91 CB MET A 9 -2.878 8.511 -7.980 1.00 40.04 C ATOM 92 CG MET A 9 -4.273 8.175 -8.481 1.00 72.41 C ATOM 93 SD MET A 9 -5.501 9.403 -7.995 1.00 24.22 S ATOM 94 CE MET A 9 -5.655 10.346 -9.510 1.00 23.41 C ATOM 95 H MET A 9 -0.418 8.557 -7.224 1.00 74.32 H ATOM 96 HA MET A 9 -2.169 6.511 -8.259 1.00 1.15 H ATOM 97 HB2 MET A 9 -2.901 8.531 -6.901 1.00 53.21 H ATOM 98 HB3 MET A 9 -2.615 9.493 -8.345 1.00 74.23 H ATOM 99 HG2 MET A 9 -4.251 8.117 -9.559 1.00 43.21 H ATOM 100 HG3 MET A 9 -4.564 7.216 -8.078 1.00 25.22 H ATOM 101 HE1 MET A 9 -5.846 11.382 -9.271 1.00 24.23 H ATOM 102 HE2 MET A 9 -4.738 10.270 -10.076 1.00 73.21 H ATOM 103 HE3 MET A 9 -6.473 9.954 -10.095 1.00 53.04 H ATOM 104 N LEU A 10 -0.450 8.387 -10.242 1.00 33.42 N ATOM 105 CA LEU A 10 -0.075 8.624 -11.631 1.00 52.44 C ATOM 106 C LEU A 10 1.060 7.698 -12.055 1.00 41.11 C ATOM 107 O LEU A 10 1.320 7.520 -13.245 1.00 52.44 O ATOM 108 CB LEU A 10 0.342 10.083 -11.825 1.00 42.21 C ATOM 109 CG LEU A 10 -0.704 11.135 -11.455 1.00 5.44 C ATOM 110 CD1 LEU A 10 -0.055 12.503 -11.304 1.00 61.30 C ATOM 111 CD2 LEU A 10 -1.809 11.180 -12.500 1.00 21.34 C ATOM 112 H LEU A 10 0.111 8.752 -9.527 1.00 42.22 H ATOM 113 HA LEU A 10 -0.939 8.421 -12.247 1.00 23.30 H ATOM 114 HB2 LEU A 10 1.218 10.260 -11.219 1.00 74.32 H ATOM 115 HB3 LEU A 10 0.595 10.218 -12.867 1.00 54.53 H ATOM 116 HG LEU A 10 -1.150 10.872 -10.505 1.00 63.15 H ATOM 117 HD11 LEU A 10 0.892 12.398 -10.796 1.00 15.03 H ATOM 118 HD12 LEU A 10 -0.703 13.147 -10.729 1.00 12.21 H ATOM 119 HD13 LEU A 10 0.106 12.934 -12.281 1.00 41.22 H ATOM 120 HD21 LEU A 10 -2.504 11.969 -12.255 1.00 43.32 H ATOM 121 HD22 LEU A 10 -2.329 10.233 -12.513 1.00 0.21 H ATOM 122 HD23 LEU A 10 -1.377 11.367 -13.472 1.00 74.13 H ATOM 123 N LYS A 11 1.733 7.108 -11.073 1.00 70.11 N ATOM 124 CA LYS A 11 2.839 6.196 -11.343 1.00 14.44 C ATOM 125 C LYS A 11 2.433 4.752 -11.066 1.00 1.25 C ATOM 126 O LYS A 11 3.147 3.817 -11.426 1.00 53.44 O ATOM 127 CB LYS A 11 4.053 6.569 -10.489 1.00 63.25 C ATOM 128 CG LYS A 11 5.237 7.067 -11.301 1.00 31.41 C ATOM 129 CD LYS A 11 6.547 6.860 -10.560 1.00 63.42 C ATOM 130 CE LYS A 11 6.592 7.666 -9.271 1.00 63.21 C ATOM 131 NZ LYS A 11 7.973 8.120 -8.949 1.00 24.12 N ATOM 132 H LYS A 11 1.479 7.289 -10.143 1.00 52.35 H ATOM 133 HA LYS A 11 3.100 6.291 -12.386 1.00 35.52 H ATOM 134 HB2 LYS A 11 3.767 7.346 -9.796 1.00 75.41 H ATOM 135 HB3 LYS A 11 4.367 5.698 -9.932 1.00 11.14 H ATOM 136 HG2 LYS A 11 5.275 6.526 -12.235 1.00 34.11 H ATOM 137 HG3 LYS A 11 5.108 8.121 -11.498 1.00 41.44 H ATOM 138 HD2 LYS A 11 6.654 5.812 -10.320 1.00 52.21 H ATOM 139 HD3 LYS A 11 7.364 7.170 -11.197 1.00 73.42 H ATOM 140 HE2 LYS A 11 5.955 8.530 -9.380 1.00 33.43 H ATOM 141 HE3 LYS A 11 6.228 7.049 -8.463 1.00 74.43 H ATOM 142 HZ1 LYS A 11 8.658 7.662 -9.584 1.00 32.23 H ATOM 143 HZ2 LYS A 11 8.210 7.874 -7.966 1.00 53.31 H ATOM 144 HZ3 LYS A 11 8.046 9.151 -9.063 1.00 64.24 H ATOM 145 N ASN A 12 1.282 4.578 -10.424 1.00 3.22 N ATOM 146 CA ASN A 12 0.782 3.247 -10.099 1.00 53.44 C ATOM 147 C ASN A 12 -0.743 3.235 -10.060 1.00 34.41 C ATOM 148 O ASN A 12 -1.360 3.075 -9.007 1.00 35.05 O ATOM 149 CB ASN A 12 1.342 2.783 -8.753 1.00 51.15 C ATOM 150 CG ASN A 12 2.841 2.560 -8.797 1.00 62.13 C ATOM 151 OD1 ASN A 12 3.307 1.438 -8.997 1.00 45.23 O ATOM 152 ND2 ASN A 12 3.604 3.630 -8.609 1.00 43.45 N ATOM 153 H ASN A 12 0.757 5.363 -10.162 1.00 3.13 H ATOM 154 HA ASN A 12 1.116 2.571 -10.871 1.00 70.51 H ATOM 155 HB2 ASN A 12 1.131 3.533 -8.005 1.00 30.12 H ATOM 156 HB3 ASN A 12 0.866 1.856 -8.472 1.00 60.34 H ATOM 157 HD21 ASN A 12 4.577 3.515 -8.633 1.00 61.34 H ATOM 158 HD22 ASN A 12 3.164 4.492 -8.455 1.00 54.23 H ATOM 159 N PRO A 13 -1.367 3.406 -11.235 1.00 12.02 N ATOM 160 CA PRO A 13 -2.828 3.417 -11.362 1.00 24.05 C ATOM 161 C PRO A 13 -3.440 2.041 -11.126 1.00 32.33 C ATOM 162 O PRO A 13 -4.645 1.916 -10.910 1.00 1.13 O ATOM 163 CB PRO A 13 -3.055 3.863 -12.808 1.00 62.32 C ATOM 164 CG PRO A 13 -1.812 3.464 -13.527 1.00 33.10 C ATOM 165 CD PRO A 13 -0.695 3.602 -12.530 1.00 61.12 C ATOM 166 HA PRO A 13 -3.279 4.131 -10.688 1.00 61.21 H ATOM 167 HB2 PRO A 13 -3.923 3.360 -13.210 1.00 53.11 H ATOM 168 HB3 PRO A 13 -3.203 4.931 -12.840 1.00 54.53 H ATOM 169 HG2 PRO A 13 -1.893 2.441 -13.860 1.00 72.44 H ATOM 170 HG3 PRO A 13 -1.648 4.122 -14.367 1.00 44.03 H ATOM 171 HD2 PRO A 13 0.054 2.841 -12.695 1.00 52.30 H ATOM 172 HD3 PRO A 13 -0.255 4.586 -12.590 1.00 41.54 H ATOM 173 N ASN A 14 -2.602 1.010 -11.168 1.00 73.23 N ATOM 174 CA ASN A 14 -3.062 -0.358 -10.959 1.00 74.21 C ATOM 175 C ASN A 14 -3.252 -0.647 -9.473 1.00 72.11 C ATOM 176 O ASN A 14 -3.752 -1.707 -9.094 1.00 71.33 O ATOM 177 CB ASN A 14 -2.065 -1.351 -11.560 1.00 34.21 C ATOM 178 CG ASN A 14 -2.387 -1.693 -13.002 1.00 51.50 C ATOM 179 OD1 ASN A 14 -3.504 -1.471 -13.469 1.00 74.55 O ATOM 180 ND2 ASN A 14 -1.406 -2.235 -13.714 1.00 53.35 N ATOM 181 H ASN A 14 -1.652 1.173 -11.345 1.00 32.41 H ATOM 182 HA ASN A 14 -4.013 -0.468 -11.460 1.00 24.44 H ATOM 183 HB2 ASN A 14 -1.074 -0.923 -11.524 1.00 52.33 H ATOM 184 HB3 ASN A 14 -2.080 -2.262 -10.981 1.00 73.41 H ATOM 185 HD21 ASN A 14 -1.587 -2.465 -14.650 1.00 2.42 H ATOM 186 HD22 ASN A 14 -0.542 -2.382 -13.276 1.00 71.11 H ATOM 187 N LEU A 15 -2.851 0.303 -8.636 1.00 24.44 N ATOM 188 CA LEU A 15 -2.977 0.151 -7.190 1.00 43.41 C ATOM 189 C LEU A 15 -3.855 1.251 -6.602 1.00 74.22 C ATOM 190 O LEU A 15 -4.816 0.975 -5.883 1.00 22.35 O ATOM 191 CB LEU A 15 -1.596 0.180 -6.532 1.00 71.31 C ATOM 192 CG LEU A 15 -1.115 -1.138 -5.924 1.00 32.21 C ATOM 193 CD1 LEU A 15 0.240 -0.956 -5.259 1.00 65.22 C ATOM 194 CD2 LEU A 15 -2.134 -1.668 -4.925 1.00 50.23 C ATOM 195 H LEU A 15 -2.460 1.125 -8.997 1.00 11.25 H ATOM 196 HA LEU A 15 -3.439 -0.805 -6.996 1.00 54.12 H ATOM 197 HB2 LEU A 15 -0.879 0.479 -7.281 1.00 71.01 H ATOM 198 HB3 LEU A 15 -1.621 0.919 -5.744 1.00 52.34 H ATOM 199 HG LEU A 15 -1.005 -1.871 -6.711 1.00 24.50 H ATOM 200 HD11 LEU A 15 0.827 -1.853 -5.386 1.00 60.34 H ATOM 201 HD12 LEU A 15 0.102 -0.763 -4.206 1.00 12.12 H ATOM 202 HD13 LEU A 15 0.755 -0.122 -5.713 1.00 54.42 H ATOM 203 HD21 LEU A 15 -1.670 -2.416 -4.300 1.00 71.35 H ATOM 204 HD22 LEU A 15 -2.965 -2.107 -5.458 1.00 24.11 H ATOM 205 HD23 LEU A 15 -2.491 -0.855 -4.310 1.00 10.42 H ATOM 206 N CYS A 16 -3.522 2.498 -6.915 1.00 2.40 N ATOM 207 CA CYS A 16 -4.281 3.641 -6.420 1.00 24.52 C ATOM 208 C CYS A 16 -4.275 4.779 -7.436 1.00 3.23 C ATOM 209 O CYS A 16 -4.700 4.607 -8.578 1.00 70.20 O ATOM 210 CB CYS A 16 -3.702 4.126 -5.090 1.00 4.15 C ATOM 211 SG CYS A 16 -4.758 5.322 -4.211 1.00 52.32 S ATOM 212 H CYS A 16 -2.745 2.655 -7.493 1.00 52.43 H ATOM 213 HA CYS A 16 -5.299 3.320 -6.263 1.00 72.43 H ATOM 214 HB2 CYS A 16 -3.556 3.277 -4.438 1.00 32.13 H ATOM 215 HB3 CYS A 16 -2.749 4.600 -5.272 1.00 43.42 H TER 216 CYS A 16 ENDMDL MODEL 2 ATOM 1 N GLY A 1 1.025 0.053 -0.102 1.00 73.44 N ATOM 2 CA GLY A 1 1.952 0.074 -1.219 1.00 32.53 C ATOM 3 C GLY A 1 2.019 1.430 -1.891 1.00 40.41 C ATOM 4 O GLY A 1 2.910 2.230 -1.605 1.00 4.25 O ATOM 5 H1 GLY A 1 0.466 0.836 0.083 1.00 54.25 H ATOM 6 HA2 GLY A 1 2.936 -0.188 -0.860 1.00 60.20 H ATOM 7 HA3 GLY A 1 1.638 -0.660 -1.946 1.00 73.53 H ATOM 8 N CYS A 2 1.075 1.691 -2.790 1.00 4.14 N ATOM 9 CA CYS A 2 1.031 2.959 -3.507 1.00 45.41 C ATOM 10 C CYS A 2 -0.386 3.524 -3.527 1.00 50.22 C ATOM 11 O CYS A 2 -1.256 3.022 -4.239 1.00 34.21 O ATOM 12 CB CYS A 2 1.540 2.777 -4.938 1.00 41.45 C ATOM 13 SG CYS A 2 2.950 3.848 -5.369 1.00 14.55 S ATOM 14 H CYS A 2 0.391 1.013 -2.975 1.00 41.32 H ATOM 15 HA CYS A 2 1.676 3.655 -2.991 1.00 55.12 H ATOM 16 HB2 CYS A 2 1.854 1.753 -5.073 1.00 63.40 H ATOM 17 HB3 CYS A 2 0.738 2.996 -5.628 1.00 21.11 H ATOM 18 N CYS A 3 -0.611 4.572 -2.742 1.00 4.05 N ATOM 19 CA CYS A 3 -1.921 5.206 -2.668 1.00 13.22 C ATOM 20 C CYS A 3 -1.881 6.436 -1.765 1.00 23.54 C ATOM 21 O CYS A 3 -2.626 7.393 -1.969 1.00 13.42 O ATOM 22 CB CYS A 3 -2.963 4.213 -2.149 1.00 71.02 C ATOM 23 SG CYS A 3 -4.686 4.769 -2.352 1.00 60.12 S ATOM 24 H CYS A 3 0.124 4.928 -2.197 1.00 74.10 H ATOM 25 HA CYS A 3 -2.197 5.516 -3.664 1.00 63.13 H ATOM 26 HB2 CYS A 3 -2.855 3.279 -2.682 1.00 12.13 H ATOM 27 HB3 CYS A 3 -2.794 4.042 -1.096 1.00 41.53 H ATOM 28 N SER A 4 -1.004 6.401 -0.766 1.00 33.52 N ATOM 29 CA SER A 4 -0.868 7.510 0.171 1.00 73.30 C ATOM 30 C SER A 4 -0.093 8.662 -0.460 1.00 64.22 C ATOM 31 O SER A 4 0.024 9.739 0.123 1.00 24.30 O ATOM 32 CB SER A 4 -0.164 7.044 1.447 1.00 60.03 C ATOM 33 OG SER A 4 -0.837 7.515 2.602 1.00 63.23 O ATOM 34 H SER A 4 -0.438 5.608 -0.655 1.00 45.42 H ATOM 35 HA SER A 4 -1.860 7.854 0.423 1.00 52.31 H ATOM 36 HB2 SER A 4 -0.145 5.965 1.471 1.00 43.11 H ATOM 37 HB3 SER A 4 0.848 7.423 1.454 1.00 20.55 H ATOM 38 HG SER A 4 -0.927 6.798 3.234 1.00 4.44 H ATOM 39 N ASN A 5 0.436 8.426 -1.657 1.00 31.24 N ATOM 40 CA ASN A 5 1.202 9.443 -2.368 1.00 75.01 C ATOM 41 C ASN A 5 0.389 10.029 -3.519 1.00 44.11 C ATOM 42 O ASN A 5 -0.407 9.344 -4.162 1.00 3.42 O ATOM 43 CB ASN A 5 2.507 8.849 -2.901 1.00 32.40 C ATOM 44 CG ASN A 5 3.709 9.258 -2.072 1.00 21.50 C ATOM 45 OD1 ASN A 5 3.677 9.203 -0.843 1.00 13.25 O ATOM 46 ND2 ASN A 5 4.778 9.670 -2.743 1.00 51.05 N ATOM 47 H ASN A 5 0.308 7.547 -2.071 1.00 25.10 H ATOM 48 HA ASN A 5 1.435 10.232 -1.669 1.00 35.31 H ATOM 49 HB2 ASN A 5 2.436 7.771 -2.889 1.00 73.31 H ATOM 50 HB3 ASN A 5 2.661 9.184 -3.916 1.00 12.05 H ATOM 51 HD21 ASN A 5 5.569 9.940 -2.232 1.00 64.35 H ATOM 52 HD22 ASN A 5 4.732 9.687 -3.722 1.00 52.34 H ATOM 53 N PRO A 6 0.595 11.327 -3.787 1.00 14.30 N ATOM 54 CA PRO A 6 -0.108 12.034 -4.862 1.00 0.42 C ATOM 55 C PRO A 6 0.340 11.577 -6.246 1.00 12.21 C ATOM 56 O PRO A 6 -0.435 11.610 -7.201 1.00 71.43 O ATOM 57 CB PRO A 6 0.275 13.499 -4.633 1.00 31.45 C ATOM 58 CG PRO A 6 1.579 13.441 -3.916 1.00 5.34 C ATOM 59 CD PRO A 6 1.529 12.205 -3.062 1.00 34.45 C ATOM 60 HA PRO A 6 -1.179 11.923 -4.776 1.00 70.12 H ATOM 61 HB2 PRO A 6 0.368 14.002 -5.585 1.00 0.25 H ATOM 62 HB3 PRO A 6 -0.483 13.983 -4.035 1.00 43.32 H ATOM 63 HG2 PRO A 6 2.387 13.372 -4.628 1.00 3.11 H ATOM 64 HG3 PRO A 6 1.697 14.319 -3.297 1.00 32.20 H ATOM 65 HD2 PRO A 6 2.507 11.753 -2.993 1.00 2.14 H ATOM 66 HD3 PRO A 6 1.150 12.441 -2.078 1.00 73.40 H ATOM 67 N ALA A 7 1.595 11.151 -6.346 1.00 54.10 N ATOM 68 CA ALA A 7 2.144 10.685 -7.613 1.00 23.20 C ATOM 69 C ALA A 7 1.913 9.189 -7.794 1.00 70.52 C ATOM 70 O ALA A 7 1.904 8.683 -8.917 1.00 34.20 O ATOM 71 CB ALA A 7 3.630 11.005 -7.694 1.00 35.14 C ATOM 72 H ALA A 7 2.164 11.149 -5.548 1.00 53.05 H ATOM 73 HA ALA A 7 1.643 11.216 -8.410 1.00 30.53 H ATOM 74 HB1 ALA A 7 3.955 11.437 -6.759 1.00 11.45 H ATOM 75 HB2 ALA A 7 4.183 10.098 -7.883 1.00 63.41 H ATOM 76 HB3 ALA A 7 3.803 11.707 -8.495 1.00 41.30 H ATOM 77 N CYS A 8 1.727 8.484 -6.683 1.00 4.32 N ATOM 78 CA CYS A 8 1.497 7.045 -6.718 1.00 43.21 C ATOM 79 C CYS A 8 0.284 6.709 -7.581 1.00 0.34 C ATOM 80 O CYS A 8 0.152 5.590 -8.075 1.00 12.14 O ATOM 81 CB CYS A 8 1.295 6.505 -5.301 1.00 72.01 C ATOM 82 SG CYS A 8 2.747 5.640 -4.620 1.00 54.44 S ATOM 83 H CYS A 8 1.746 8.944 -5.816 1.00 70.04 H ATOM 84 HA CYS A 8 2.370 6.580 -7.150 1.00 63.10 H ATOM 85 HB2 CYS A 8 1.064 7.328 -4.640 1.00 73.32 H ATOM 86 HB3 CYS A 8 0.469 5.809 -5.304 1.00 13.41 H ATOM 87 N MET A 9 -0.599 7.687 -7.757 1.00 4.23 N ATOM 88 CA MET A 9 -1.800 7.496 -8.561 1.00 32.24 C ATOM 89 C MET A 9 -1.490 7.645 -10.047 1.00 24.34 C ATOM 90 O MET A 9 -2.223 7.140 -10.898 1.00 51.51 O ATOM 91 CB MET A 9 -2.879 8.500 -8.150 1.00 74.42 C ATOM 92 CG MET A 9 -4.295 7.970 -8.313 1.00 10.24 C ATOM 93 SD MET A 9 -5.453 9.239 -8.860 1.00 44.45 S ATOM 94 CE MET A 9 -5.797 10.074 -7.314 1.00 33.25 C ATOM 95 H MET A 9 -0.438 8.558 -7.337 1.00 53.43 H ATOM 96 HA MET A 9 -2.164 6.496 -8.379 1.00 60.33 H ATOM 97 HB2 MET A 9 -2.733 8.763 -7.113 1.00 54.35 H ATOM 98 HB3 MET A 9 -2.779 9.387 -8.757 1.00 3.10 H ATOM 99 HG2 MET A 9 -4.286 7.173 -9.041 1.00 52.32 H ATOM 100 HG3 MET A 9 -4.630 7.582 -7.362 1.00 52.11 H ATOM 101 HE1 MET A 9 -6.482 9.477 -6.728 1.00 52.41 H ATOM 102 HE2 MET A 9 -4.877 10.209 -6.764 1.00 74.42 H ATOM 103 HE3 MET A 9 -6.241 11.037 -7.516 1.00 4.52 H ATOM 104 N LEU A 10 -0.399 8.339 -10.352 1.00 12.53 N ATOM 105 CA LEU A 10 0.008 8.555 -11.736 1.00 24.12 C ATOM 106 C LEU A 10 1.153 7.622 -12.118 1.00 5.44 C ATOM 107 O LEU A 10 1.441 7.426 -13.298 1.00 62.45 O ATOM 108 CB LEU A 10 0.430 10.011 -11.943 1.00 61.43 C ATOM 109 CG LEU A 10 -0.408 11.062 -11.216 1.00 12.41 C ATOM 110 CD1 LEU A 10 0.264 12.425 -11.289 1.00 21.43 C ATOM 111 CD2 LEU A 10 -1.811 11.126 -11.803 1.00 23.11 C ATOM 112 H LEU A 10 0.145 8.717 -9.630 1.00 63.12 H ATOM 113 HA LEU A 10 -0.840 8.341 -12.368 1.00 74.21 H ATOM 114 HB2 LEU A 10 1.450 10.110 -11.606 1.00 43.43 H ATOM 115 HB3 LEU A 10 0.380 10.221 -13.002 1.00 63.33 H ATOM 116 HG LEU A 10 -0.493 10.788 -10.173 1.00 51.14 H ATOM 117 HD11 LEU A 10 -0.455 13.194 -11.053 1.00 53.12 H ATOM 118 HD12 LEU A 10 0.648 12.584 -12.285 1.00 62.55 H ATOM 119 HD13 LEU A 10 1.078 12.462 -10.579 1.00 41.45 H ATOM 120 HD21 LEU A 10 -2.133 12.155 -11.854 1.00 52.02 H ATOM 121 HD22 LEU A 10 -2.489 10.566 -11.175 1.00 43.53 H ATOM 122 HD23 LEU A 10 -1.805 10.700 -12.796 1.00 20.53 H ATOM 123 N LYS A 11 1.803 7.048 -11.111 1.00 1.54 N ATOM 124 CA LYS A 11 2.915 6.133 -11.339 1.00 51.32 C ATOM 125 C LYS A 11 2.503 4.694 -11.048 1.00 62.32 C ATOM 126 O LYS A 11 3.225 3.753 -11.377 1.00 41.41 O ATOM 127 CB LYS A 11 4.109 6.520 -10.464 1.00 41.20 C ATOM 128 CG LYS A 11 5.311 7.006 -11.255 1.00 63.54 C ATOM 129 CD LYS A 11 6.604 6.811 -10.481 1.00 1.31 C ATOM 130 CE LYS A 11 7.418 8.095 -10.423 1.00 54.24 C ATOM 131 NZ LYS A 11 8.356 8.106 -9.268 1.00 25.44 N ATOM 132 H LYS A 11 1.527 7.245 -10.190 1.00 61.23 H ATOM 133 HA LYS A 11 3.200 6.211 -12.377 1.00 62.44 H ATOM 134 HB2 LYS A 11 3.806 7.308 -9.790 1.00 60.01 H ATOM 135 HB3 LYS A 11 4.410 5.659 -9.885 1.00 33.20 H ATOM 136 HG2 LYS A 11 5.371 6.450 -12.179 1.00 70.24 H ATOM 137 HG3 LYS A 11 5.187 8.057 -11.473 1.00 31.11 H ATOM 138 HD2 LYS A 11 6.367 6.503 -9.473 1.00 44.33 H ATOM 139 HD3 LYS A 11 7.192 6.044 -10.965 1.00 52.21 H ATOM 140 HE2 LYS A 11 7.984 8.188 -11.337 1.00 41.22 H ATOM 141 HE3 LYS A 11 6.740 8.931 -10.334 1.00 11.45 H ATOM 142 HZ1 LYS A 11 7.831 7.977 -8.379 1.00 45.23 H ATOM 143 HZ2 LYS A 11 8.865 9.012 -9.229 1.00 65.14 H ATOM 144 HZ3 LYS A 11 9.049 7.336 -9.363 1.00 42.00 H ATOM 145 N ASN A 12 1.338 4.530 -10.431 1.00 34.51 N ATOM 146 CA ASN A 12 0.830 3.204 -10.097 1.00 33.12 C ATOM 147 C ASN A 12 -0.696 3.191 -10.093 1.00 21.12 C ATOM 148 O ASN A 12 -1.338 3.048 -9.052 1.00 5.23 O ATOM 149 CB ASN A 12 1.358 2.762 -8.731 1.00 22.24 C ATOM 150 CG ASN A 12 2.858 2.539 -8.736 1.00 22.44 C ATOM 151 OD1 ASN A 12 3.329 1.414 -8.906 1.00 60.12 O ATOM 152 ND2 ASN A 12 3.617 3.612 -8.548 1.00 14.33 N ATOM 153 H ASN A 12 0.807 5.318 -10.194 1.00 15.30 H ATOM 154 HA ASN A 12 1.182 2.515 -10.849 1.00 61.33 H ATOM 155 HB2 ASN A 12 1.130 3.524 -7.999 1.00 72.44 H ATOM 156 HB3 ASN A 12 0.876 1.839 -8.446 1.00 30.13 H ATOM 157 HD21 ASN A 12 4.590 3.497 -8.547 1.00 32.31 H ATOM 158 HD22 ASN A 12 3.172 4.476 -8.418 1.00 44.41 H ATOM 159 N PRO A 13 -1.292 3.343 -11.285 1.00 20.13 N ATOM 160 CA PRO A 13 -2.749 3.351 -11.446 1.00 20.02 C ATOM 161 C PRO A 13 -3.367 1.978 -11.202 1.00 2.41 C ATOM 162 O PRO A 13 -4.576 1.857 -11.012 1.00 71.31 O ATOM 163 CB PRO A 13 -2.942 3.773 -12.904 1.00 72.25 C ATOM 164 CG PRO A 13 -1.683 3.363 -13.587 1.00 51.13 C ATOM 165 CD PRO A 13 -0.589 3.518 -12.567 1.00 35.10 C ATOM 166 HA PRO A 13 -3.216 4.075 -10.795 1.00 11.52 H ATOM 167 HB2 PRO A 13 -3.801 3.263 -13.318 1.00 50.34 H ATOM 168 HB3 PRO A 13 -3.090 4.841 -12.958 1.00 32.15 H ATOM 169 HG2 PRO A 13 -1.756 2.334 -13.906 1.00 11.42 H ATOM 170 HG3 PRO A 13 -1.499 4.007 -14.434 1.00 41.52 H ATOM 171 HD2 PRO A 13 0.163 2.755 -12.702 1.00 0.13 H ATOM 172 HD3 PRO A 13 -0.148 4.502 -12.633 1.00 33.41 H ATOM 173 N ASN A 14 -2.528 0.947 -11.208 1.00 50.42 N ATOM 174 CA ASN A 14 -2.993 -0.417 -10.988 1.00 23.34 C ATOM 175 C ASN A 14 -3.217 -0.682 -9.502 1.00 30.11 C ATOM 176 O ASN A 14 -3.725 -1.736 -9.118 1.00 34.24 O ATOM 177 CB ASN A 14 -1.982 -1.419 -11.549 1.00 22.43 C ATOM 178 CG ASN A 14 -2.235 -1.740 -13.009 1.00 52.01 C ATOM 179 OD1 ASN A 14 -3.380 -1.910 -13.429 1.00 41.23 O ATOM 180 ND2 ASN A 14 -1.165 -1.824 -13.790 1.00 62.55 N ATOM 181 H ASN A 14 -1.574 1.108 -11.365 1.00 71.32 H ATOM 182 HA ASN A 14 -3.931 -0.536 -11.508 1.00 61.13 H ATOM 183 HB2 ASN A 14 -0.987 -1.007 -11.458 1.00 73.22 H ATOM 184 HB3 ASN A 14 -2.040 -2.336 -10.982 1.00 60.51 H ATOM 185 HD21 ASN A 14 -1.300 -2.030 -14.739 1.00 42.11 H ATOM 186 HD22 ASN A 14 -0.284 -1.677 -13.387 1.00 22.31 H ATOM 187 N LEU A 15 -2.835 0.281 -8.671 1.00 14.42 N ATOM 188 CA LEU A 15 -2.995 0.154 -7.226 1.00 72.44 C ATOM 189 C LEU A 15 -3.888 1.262 -6.677 1.00 61.22 C ATOM 190 O LEU A 15 -4.865 0.997 -5.976 1.00 23.41 O ATOM 191 CB LEU A 15 -1.630 0.194 -6.537 1.00 33.11 C ATOM 192 CG LEU A 15 -1.163 -1.113 -5.896 1.00 32.50 C ATOM 193 CD1 LEU A 15 0.176 -0.919 -5.203 1.00 24.42 C ATOM 194 CD2 LEU A 15 -2.205 -1.627 -4.913 1.00 20.50 C ATOM 195 H LEU A 15 -2.437 1.098 -9.036 1.00 3.31 H ATOM 196 HA LEU A 15 -3.462 -0.800 -7.028 1.00 2.32 H ATOM 197 HB2 LEU A 15 -0.896 0.481 -7.274 1.00 11.43 H ATOM 198 HB3 LEU A 15 -1.674 0.946 -5.762 1.00 51.32 H ATOM 199 HG LEU A 15 -1.034 -1.859 -6.668 1.00 61.51 H ATOM 200 HD11 LEU A 15 0.313 0.126 -4.970 1.00 31.44 H ATOM 201 HD12 LEU A 15 0.971 -1.249 -5.856 1.00 33.41 H ATOM 202 HD13 LEU A 15 0.197 -1.498 -4.291 1.00 31.21 H ATOM 203 HD21 LEU A 15 -2.588 -0.803 -4.330 1.00 45.01 H ATOM 204 HD22 LEU A 15 -1.751 -2.354 -4.255 1.00 41.22 H ATOM 205 HD23 LEU A 15 -3.015 -2.091 -5.457 1.00 30.50 H ATOM 206 N CYS A 16 -3.548 2.504 -7.002 1.00 44.43 N ATOM 207 CA CYS A 16 -4.318 3.654 -6.544 1.00 33.32 C ATOM 208 C CYS A 16 -4.289 4.776 -7.578 1.00 34.32 C ATOM 209 O CYS A 16 -4.896 4.666 -8.643 1.00 53.43 O ATOM 210 CB CYS A 16 -3.771 4.162 -5.209 1.00 24.35 C ATOM 211 SG CYS A 16 -4.848 5.371 -4.375 1.00 31.14 S ATOM 212 H CYS A 16 -2.758 2.653 -7.565 1.00 23.42 H ATOM 213 HA CYS A 16 -5.340 3.335 -6.406 1.00 31.53 H ATOM 214 HB2 CYS A 16 -3.640 3.323 -4.540 1.00 2.43 H ATOM 215 HB3 CYS A 16 -2.814 4.634 -5.377 1.00 31.23 H TER 216 CYS A 16 ENDMDL MODEL 3 ATOM 1 N GLY A 1 2.149 -1.086 -2.205 1.00 64.10 N ATOM 2 CA GLY A 1 1.993 0.013 -1.271 1.00 2.15 C ATOM 3 C GLY A 1 2.085 1.367 -1.947 1.00 34.51 C ATOM 4 O GLY A 1 3.054 2.101 -1.755 1.00 22.23 O ATOM 5 H1 GLY A 1 1.377 -1.643 -2.437 1.00 31.32 H ATOM 6 HA2 GLY A 1 1.031 -0.073 -0.788 1.00 52.34 H ATOM 7 HA3 GLY A 1 2.768 -0.054 -0.521 1.00 34.45 H ATOM 8 N CYS A 2 1.073 1.698 -2.743 1.00 25.12 N ATOM 9 CA CYS A 2 1.044 2.971 -3.452 1.00 52.15 C ATOM 10 C CYS A 2 -0.367 3.553 -3.467 1.00 60.35 C ATOM 11 O CYS A 2 -1.244 3.065 -4.182 1.00 1.44 O ATOM 12 CB CYS A 2 1.549 2.792 -4.886 1.00 34.14 C ATOM 13 SG CYS A 2 2.969 3.850 -5.311 1.00 40.12 S ATOM 14 H CYS A 2 0.328 1.070 -2.856 1.00 42.32 H ATOM 15 HA CYS A 2 1.697 3.656 -2.933 1.00 74.01 H ATOM 16 HB2 CYS A 2 1.852 1.764 -5.026 1.00 54.54 H ATOM 17 HB3 CYS A 2 0.748 3.023 -5.573 1.00 1.04 H ATOM 18 N CYS A 3 -0.578 4.598 -2.675 1.00 35.25 N ATOM 19 CA CYS A 3 -1.881 5.247 -2.595 1.00 74.13 C ATOM 20 C CYS A 3 -1.825 6.470 -1.684 1.00 75.31 C ATOM 21 O CYS A 3 -2.560 7.438 -1.881 1.00 63.23 O ATOM 22 CB CYS A 3 -2.934 4.263 -2.082 1.00 75.32 C ATOM 23 SG CYS A 3 -4.651 4.840 -2.279 1.00 42.53 S ATOM 24 H CYS A 3 0.160 4.941 -2.128 1.00 44.44 H ATOM 25 HA CYS A 3 -2.154 5.566 -3.589 1.00 52.55 H ATOM 26 HB2 CYS A 3 -2.838 3.331 -2.621 1.00 54.32 H ATOM 27 HB3 CYS A 3 -2.766 4.083 -1.031 1.00 32.03 H ATOM 28 N SER A 4 -0.949 6.418 -0.686 1.00 61.43 N ATOM 29 CA SER A 4 -0.799 7.519 0.258 1.00 61.13 C ATOM 30 C SER A 4 -0.010 8.666 -0.366 1.00 61.25 C ATOM 31 O SER A 4 0.121 9.737 0.224 1.00 54.21 O ATOM 32 CB SER A 4 -0.099 7.036 1.530 1.00 51.32 C ATOM 33 OG SER A 4 -0.765 7.508 2.688 1.00 32.33 O ATOM 34 H SER A 4 -0.392 5.618 -0.581 1.00 45.13 H ATOM 35 HA SER A 4 -1.786 7.874 0.513 1.00 74.42 H ATOM 36 HB2 SER A 4 -0.093 5.957 1.547 1.00 41.21 H ATOM 37 HB3 SER A 4 0.917 7.403 1.539 1.00 23.40 H ATOM 38 HG SER A 4 -1.235 8.319 2.480 1.00 20.42 H ATOM 39 N ASN A 5 0.514 8.432 -1.565 1.00 63.41 N ATOM 40 CA ASN A 5 1.291 9.444 -2.271 1.00 4.24 C ATOM 41 C ASN A 5 0.485 10.048 -3.416 1.00 42.24 C ATOM 42 O ASN A 5 -0.320 9.378 -4.063 1.00 20.32 O ATOM 43 CB ASN A 5 2.589 8.838 -2.809 1.00 72.22 C ATOM 44 CG ASN A 5 3.797 9.227 -1.979 1.00 70.41 C ATOM 45 OD1 ASN A 5 3.676 9.540 -0.795 1.00 35.02 O ATOM 46 ND2 ASN A 5 4.971 9.208 -2.599 1.00 42.00 N ATOM 47 H ASN A 5 0.376 7.557 -1.985 1.00 51.13 H ATOM 48 HA ASN A 5 1.535 10.225 -1.566 1.00 51.32 H ATOM 49 HB2 ASN A 5 2.505 7.761 -2.804 1.00 74.33 H ATOM 50 HB3 ASN A 5 2.745 9.178 -3.822 1.00 5.03 H ATOM 51 HD21 ASN A 5 5.769 9.454 -2.086 1.00 11.31 H ATOM 52 HD22 ASN A 5 4.992 8.948 -3.544 1.00 2.21 H ATOM 53 N PRO A 6 0.706 11.346 -3.676 1.00 32.45 N ATOM 54 CA PRO A 6 0.011 12.069 -4.745 1.00 34.44 C ATOM 55 C PRO A 6 0.451 11.616 -6.132 1.00 61.43 C ATOM 56 O PRO A 6 -0.324 11.664 -7.087 1.00 14.14 O ATOM 57 CB PRO A 6 0.411 13.526 -4.506 1.00 4.54 C ATOM 58 CG PRO A 6 1.716 13.448 -3.791 1.00 1.33 C ATOM 59 CD PRO A 6 1.651 12.207 -2.945 1.00 62.52 C ATOM 60 HA PRO A 6 -1.062 11.970 -4.658 1.00 64.43 H ATOM 61 HB2 PRO A 6 0.510 14.036 -5.454 1.00 74.52 H ATOM 62 HB3 PRO A 6 -0.339 14.016 -3.904 1.00 14.10 H ATOM 63 HG2 PRO A 6 2.522 13.374 -4.505 1.00 2.34 H ATOM 64 HG3 PRO A 6 1.845 14.320 -3.166 1.00 52.02 H ATOM 65 HD2 PRO A 6 2.624 11.743 -2.881 1.00 23.33 H ATOM 66 HD3 PRO A 6 1.276 12.440 -1.960 1.00 4.24 H ATOM 67 N ALA A 7 1.701 11.175 -6.237 1.00 14.00 N ATOM 68 CA ALA A 7 2.243 10.711 -7.508 1.00 30.12 C ATOM 69 C ALA A 7 1.994 9.219 -7.699 1.00 74.20 C ATOM 70 O ALA A 7 1.977 8.721 -8.825 1.00 72.12 O ATOM 71 CB ALA A 7 3.732 11.014 -7.588 1.00 71.33 C ATOM 72 H ALA A 7 2.271 11.160 -5.440 1.00 55.52 H ATOM 73 HA ALA A 7 1.747 11.253 -8.300 1.00 41.03 H ATOM 74 HB1 ALA A 7 3.883 11.928 -8.144 1.00 71.22 H ATOM 75 HB2 ALA A 7 4.130 11.128 -6.591 1.00 41.32 H ATOM 76 HB3 ALA A 7 4.238 10.201 -8.087 1.00 73.14 H ATOM 77 N CYS A 8 1.801 8.509 -6.592 1.00 51.32 N ATOM 78 CA CYS A 8 1.553 7.073 -6.637 1.00 45.21 C ATOM 79 C CYS A 8 0.335 6.758 -7.500 1.00 61.12 C ATOM 80 O CYS A 8 0.189 5.644 -8.002 1.00 33.34 O ATOM 81 CB CYS A 8 1.346 6.526 -5.224 1.00 24.34 C ATOM 82 SG CYS A 8 2.789 5.639 -4.551 1.00 14.11 S ATOM 83 H CYS A 8 1.826 8.963 -5.723 1.00 31.33 H ATOM 84 HA CYS A 8 2.420 6.601 -7.073 1.00 62.44 H ATOM 85 HB2 CYS A 8 1.126 7.347 -4.557 1.00 21.34 H ATOM 86 HB3 CYS A 8 0.512 5.840 -5.230 1.00 11.30 H ATOM 87 N MET A 9 -0.536 7.747 -7.668 1.00 41.55 N ATOM 88 CA MET A 9 -1.741 7.576 -8.472 1.00 43.10 C ATOM 89 C MET A 9 -1.430 7.732 -9.957 1.00 73.54 C ATOM 90 O MET A 9 -2.171 7.242 -10.811 1.00 40.23 O ATOM 91 CB MET A 9 -2.807 8.590 -8.053 1.00 73.22 C ATOM 92 CG MET A 9 -4.230 8.081 -8.223 1.00 65.23 C ATOM 93 SD MET A 9 -5.434 9.416 -8.356 1.00 1.11 S ATOM 94 CE MET A 9 -6.962 8.486 -8.445 1.00 11.13 C ATOM 95 H MET A 9 -0.365 8.614 -7.243 1.00 64.14 H ATOM 96 HA MET A 9 -2.116 6.579 -8.297 1.00 52.11 H ATOM 97 HB2 MET A 9 -2.660 8.841 -7.013 1.00 62.15 H ATOM 98 HB3 MET A 9 -2.694 9.482 -8.651 1.00 1.14 H ATOM 99 HG2 MET A 9 -4.279 7.481 -9.120 1.00 43.31 H ATOM 100 HG3 MET A 9 -4.482 7.469 -7.370 1.00 14.21 H ATOM 101 HE1 MET A 9 -7.619 8.943 -9.171 1.00 31.51 H ATOM 102 HE2 MET A 9 -6.749 7.470 -8.741 1.00 65.10 H ATOM 103 HE3 MET A 9 -7.440 8.486 -7.476 1.00 42.12 H ATOM 104 N LEU A 10 -0.332 8.415 -10.259 1.00 51.31 N ATOM 105 CA LEU A 10 0.076 8.635 -11.642 1.00 43.43 C ATOM 106 C LEU A 10 1.210 7.692 -12.032 1.00 74.02 C ATOM 107 O LEU A 10 1.493 7.500 -13.215 1.00 24.03 O ATOM 108 CB LEU A 10 0.515 10.087 -11.840 1.00 41.42 C ATOM 109 CG LEU A 10 -0.539 11.154 -11.542 1.00 32.13 C ATOM 110 CD1 LEU A 10 0.027 12.545 -11.779 1.00 10.32 C ATOM 111 CD2 LEU A 10 -1.781 10.929 -12.392 1.00 42.25 C ATOM 112 H LEU A 10 0.218 8.781 -9.536 1.00 11.02 H ATOM 113 HA LEU A 10 -0.776 8.436 -12.275 1.00 22.11 H ATOM 114 HB2 LEU A 10 1.360 10.268 -11.194 1.00 42.30 H ATOM 115 HB3 LEU A 10 0.821 10.202 -12.871 1.00 32.05 H ATOM 116 HG LEU A 10 -0.828 11.084 -10.502 1.00 11.40 H ATOM 117 HD11 LEU A 10 -0.662 13.116 -12.383 1.00 64.22 H ATOM 118 HD12 LEU A 10 0.975 12.466 -12.290 1.00 73.24 H ATOM 119 HD13 LEU A 10 0.171 13.042 -10.830 1.00 61.51 H ATOM 120 HD21 LEU A 10 -1.489 10.773 -13.420 1.00 54.03 H ATOM 121 HD22 LEU A 10 -2.423 11.795 -12.327 1.00 43.43 H ATOM 122 HD23 LEU A 10 -2.312 10.060 -12.032 1.00 3.02 H ATOM 123 N LYS A 11 1.854 7.103 -11.030 1.00 54.31 N ATOM 124 CA LYS A 11 2.954 6.176 -11.267 1.00 1.54 C ATOM 125 C LYS A 11 2.526 4.740 -10.985 1.00 75.11 C ATOM 126 O LYS A 11 3.236 3.793 -11.321 1.00 53.44 O ATOM 127 CB LYS A 11 4.154 6.543 -10.390 1.00 60.03 C ATOM 128 CG LYS A 11 5.361 7.019 -11.180 1.00 10.21 C ATOM 129 CD LYS A 11 6.652 6.803 -10.409 1.00 3.42 C ATOM 130 CE LYS A 11 7.283 8.125 -9.997 1.00 63.15 C ATOM 131 NZ LYS A 11 8.553 7.923 -9.246 1.00 42.14 N ATOM 132 H LYS A 11 1.581 7.297 -10.108 1.00 62.50 H ATOM 133 HA LYS A 11 3.239 6.258 -12.305 1.00 30.34 H ATOM 134 HB2 LYS A 11 3.861 7.330 -9.711 1.00 23.33 H ATOM 135 HB3 LYS A 11 4.445 5.674 -9.818 1.00 11.14 H ATOM 136 HG2 LYS A 11 5.413 6.469 -12.108 1.00 15.50 H ATOM 137 HG3 LYS A 11 5.249 8.074 -11.390 1.00 23.44 H ATOM 138 HD2 LYS A 11 6.439 6.227 -9.521 1.00 4.55 H ATOM 139 HD3 LYS A 11 7.348 6.261 -11.033 1.00 41.15 H ATOM 140 HE2 LYS A 11 7.488 8.703 -10.885 1.00 63.25 H ATOM 141 HE3 LYS A 11 6.586 8.662 -9.371 1.00 60.05 H ATOM 142 HZ1 LYS A 11 8.567 8.526 -8.399 1.00 21.40 H ATOM 143 HZ2 LYS A 11 9.366 8.169 -9.847 1.00 61.01 H ATOM 144 HZ3 LYS A 11 8.641 6.929 -8.954 1.00 3.22 H ATOM 145 N ASN A 12 1.359 4.585 -10.367 1.00 51.43 N ATOM 146 CA ASN A 12 0.836 3.264 -10.042 1.00 34.42 C ATOM 147 C ASN A 12 -0.690 3.269 -10.036 1.00 30.11 C ATOM 148 O ASN A 12 -1.332 3.127 -8.995 1.00 71.31 O ATOM 149 CB ASN A 12 1.360 2.806 -8.679 1.00 64.24 C ATOM 150 CG ASN A 12 2.858 2.565 -8.688 1.00 34.21 C ATOM 151 OD1 ASN A 12 3.315 1.436 -8.867 1.00 32.21 O ATOM 152 ND2 ASN A 12 3.629 3.628 -8.493 1.00 50.15 N ATOM 153 H ASN A 12 0.838 5.379 -10.124 1.00 74.22 H ATOM 154 HA ASN A 12 1.179 2.576 -10.800 1.00 32.45 H ATOM 155 HB2 ASN A 12 1.142 3.565 -7.943 1.00 11.24 H ATOM 156 HB3 ASN A 12 0.868 1.887 -8.400 1.00 75.24 H ATOM 157 HD21 ASN A 12 4.601 3.501 -8.495 1.00 33.13 H ATOM 158 HD22 ASN A 12 3.195 4.496 -8.357 1.00 42.54 H ATOM 159 N PRO A 13 -1.286 3.436 -11.226 1.00 43.10 N ATOM 160 CA PRO A 13 -2.743 3.463 -11.385 1.00 63.22 C ATOM 161 C PRO A 13 -3.377 2.096 -11.150 1.00 4.00 C ATOM 162 O PRO A 13 -4.587 1.988 -10.959 1.00 71.52 O ATOM 163 CB PRO A 13 -2.933 3.897 -12.841 1.00 24.13 C ATOM 164 CG PRO A 13 -1.679 3.477 -13.528 1.00 34.21 C ATOM 165 CD PRO A 13 -0.583 3.612 -12.508 1.00 23.50 C ATOM 166 HA PRO A 13 -3.200 4.188 -10.729 1.00 13.33 H ATOM 167 HB2 PRO A 13 -3.798 3.401 -13.257 1.00 60.40 H ATOM 168 HB3 PRO A 13 -3.068 4.967 -12.886 1.00 41.02 H ATOM 169 HG2 PRO A 13 -1.765 2.451 -13.853 1.00 50.33 H ATOM 170 HG3 PRO A 13 -1.488 4.125 -14.371 1.00 34.24 H ATOM 171 HD2 PRO A 13 0.160 2.841 -12.649 1.00 25.21 H ATOM 172 HD3 PRO A 13 -0.130 4.590 -12.568 1.00 1.32 H ATOM 173 N ASN A 14 -2.550 1.055 -11.165 1.00 13.14 N ATOM 174 CA ASN A 14 -3.031 -0.305 -10.953 1.00 30.42 C ATOM 175 C ASN A 14 -3.256 -0.578 -9.469 1.00 13.24 C ATOM 176 O ASN A 14 -3.777 -1.629 -9.091 1.00 5.41 O ATOM 177 CB ASN A 14 -2.033 -1.316 -11.522 1.00 51.44 C ATOM 178 CG ASN A 14 -2.326 -1.665 -12.969 1.00 32.34 C ATOM 179 OD1 ASN A 14 -3.122 -2.560 -13.253 1.00 71.34 O ATOM 180 ND2 ASN A 14 -1.682 -0.959 -13.890 1.00 51.22 N ATOM 181 H ASN A 14 -1.595 1.205 -11.322 1.00 3.11 H ATOM 182 HA ASN A 14 -3.971 -0.409 -11.473 1.00 33.32 H ATOM 183 HB2 ASN A 14 -1.038 -0.899 -11.468 1.00 23.12 H ATOM 184 HB3 ASN A 14 -2.072 -2.222 -10.937 1.00 14.44 H ATOM 185 HD21 ASN A 14 -1.853 -1.164 -14.833 1.00 53.51 H ATOM 186 HD22 ASN A 14 -1.063 -0.261 -13.590 1.00 25.11 H ATOM 187 N LEU A 15 -2.862 0.375 -8.631 1.00 52.34 N ATOM 188 CA LEU A 15 -3.021 0.239 -7.188 1.00 14.43 C ATOM 189 C LEU A 15 -3.900 1.354 -6.629 1.00 51.35 C ATOM 190 O LEU A 15 -4.879 1.096 -5.929 1.00 30.25 O ATOM 191 CB LEU A 15 -1.655 0.259 -6.500 1.00 72.40 C ATOM 192 CG LEU A 15 -1.203 -1.059 -5.869 1.00 2.41 C ATOM 193 CD1 LEU A 15 0.140 -0.885 -5.176 1.00 60.45 C ATOM 194 CD2 LEU A 15 -2.249 -1.567 -4.888 1.00 32.01 C ATOM 195 H LEU A 15 -2.454 1.190 -8.991 1.00 74.05 H ATOM 196 HA LEU A 15 -3.499 -0.710 -6.995 1.00 51.31 H ATOM 197 HB2 LEU A 15 -0.919 0.542 -7.236 1.00 3.51 H ATOM 198 HB3 LEU A 15 -1.689 1.006 -5.720 1.00 40.11 H ATOM 199 HG LEU A 15 -1.084 -1.801 -6.646 1.00 45.34 H ATOM 200 HD11 LEU A 15 0.390 0.164 -5.134 1.00 21.24 H ATOM 201 HD12 LEU A 15 0.901 -1.415 -5.730 1.00 44.31 H ATOM 202 HD13 LEU A 15 0.082 -1.284 -4.174 1.00 40.20 H ATOM 203 HD21 LEU A 15 -1.774 -2.194 -4.148 1.00 74.33 H ATOM 204 HD22 LEU A 15 -2.994 -2.139 -5.421 1.00 70.13 H ATOM 205 HD23 LEU A 15 -2.722 -0.727 -4.399 1.00 72.51 H ATOM 206 N CYS A 16 -3.545 2.595 -6.947 1.00 35.05 N ATOM 207 CA CYS A 16 -4.302 3.750 -6.479 1.00 2.21 C ATOM 208 C CYS A 16 -4.261 4.879 -7.505 1.00 23.01 C ATOM 209 O CYS A 16 -4.318 4.637 -8.711 1.00 23.14 O ATOM 210 CB CYS A 16 -3.746 4.242 -5.141 1.00 15.02 C ATOM 211 SG CYS A 16 -4.808 5.459 -4.297 1.00 70.42 S ATOM 212 H CYS A 16 -2.755 2.738 -7.509 1.00 63.42 H ATOM 213 HA CYS A 16 -5.327 3.442 -6.342 1.00 12.33 H ATOM 214 HB2 CYS A 16 -3.625 3.398 -4.478 1.00 32.51 H ATOM 215 HB3 CYS A 16 -2.784 4.704 -5.307 1.00 33.42 H TER 216 CYS A 16 ENDMDL MODEL 4 ATOM 1 N GLY A 1 3.154 -0.222 -0.521 1.00 1.40 N ATOM 2 CA GLY A 1 2.020 0.013 -1.396 1.00 1.35 C ATOM 3 C GLY A 1 2.093 1.358 -2.091 1.00 0.32 C ATOM 4 O GLY A 1 3.085 2.077 -1.967 1.00 65.30 O ATOM 5 H1 GLY A 1 3.812 -0.912 -0.749 1.00 53.32 H ATOM 6 HA2 GLY A 1 1.988 -0.765 -2.143 1.00 23.42 H ATOM 7 HA3 GLY A 1 1.114 -0.027 -0.809 1.00 53.03 H ATOM 8 N CYS A 2 1.040 1.700 -2.826 1.00 3.41 N ATOM 9 CA CYS A 2 0.989 2.967 -3.546 1.00 32.00 C ATOM 10 C CYS A 2 -0.434 3.519 -3.575 1.00 24.03 C ATOM 11 O CYS A 2 -1.296 3.008 -4.290 1.00 64.40 O ATOM 12 CB CYS A 2 1.507 2.787 -4.974 1.00 74.04 C ATOM 13 SG CYS A 2 2.908 3.870 -5.399 1.00 44.11 S ATOM 14 H CYS A 2 0.278 1.085 -2.886 1.00 45.41 H ATOM 15 HA CYS A 2 1.624 3.669 -3.028 1.00 51.40 H ATOM 16 HB2 CYS A 2 1.831 1.765 -5.105 1.00 70.23 H ATOM 17 HB3 CYS A 2 0.706 2.997 -5.668 1.00 63.24 H ATOM 18 N CYS A 3 -0.672 4.566 -2.792 1.00 43.10 N ATOM 19 CA CYS A 3 -1.988 5.189 -2.726 1.00 73.44 C ATOM 20 C CYS A 3 -1.964 6.420 -1.825 1.00 65.13 C ATOM 21 O CYS A 3 -2.717 7.371 -2.035 1.00 64.22 O ATOM 22 CB CYS A 3 -3.024 4.187 -2.211 1.00 40.14 C ATOM 23 SG CYS A 3 -4.751 4.727 -2.425 1.00 3.02 S ATOM 24 H CYS A 3 0.056 4.930 -2.244 1.00 64.53 H ATOM 25 HA CYS A 3 -2.261 5.494 -3.725 1.00 13.01 H ATOM 26 HB2 CYS A 3 -2.905 3.253 -2.741 1.00 42.25 H ATOM 27 HB3 CYS A 3 -2.859 4.020 -1.157 1.00 40.13 H ATOM 28 N SER A 4 -1.092 6.395 -0.822 1.00 32.42 N ATOM 29 CA SER A 4 -0.971 7.507 0.114 1.00 71.44 C ATOM 30 C SER A 4 -0.202 8.665 -0.516 1.00 34.54 C ATOM 31 O SER A 4 -0.097 9.743 0.067 1.00 53.13 O ATOM 32 CB SER A 4 -0.269 7.050 1.394 1.00 73.51 C ATOM 33 OG SER A 4 -0.953 7.516 2.544 1.00 21.44 O ATOM 34 H SER A 4 -0.519 5.608 -0.707 1.00 20.23 H ATOM 35 HA SER A 4 -1.967 7.843 0.360 1.00 73.23 H ATOM 36 HB2 SER A 4 -0.240 5.971 1.420 1.00 61.11 H ATOM 37 HB3 SER A 4 0.739 7.438 1.407 1.00 71.24 H ATOM 38 HG SER A 4 -0.317 7.852 3.180 1.00 33.04 H ATOM 39 N ASN A 5 0.334 8.431 -1.709 1.00 55.53 N ATOM 40 CA ASN A 5 1.094 9.454 -2.419 1.00 14.23 C ATOM 41 C ASN A 5 0.282 10.031 -3.575 1.00 64.41 C ATOM 42 O ASN A 5 -0.504 9.337 -4.221 1.00 11.44 O ATOM 43 CB ASN A 5 2.407 8.871 -2.943 1.00 62.24 C ATOM 44 CG ASN A 5 3.601 9.293 -2.109 1.00 62.40 C ATOM 45 OD1 ASN A 5 3.793 8.812 -0.992 1.00 71.20 O ATOM 46 ND2 ASN A 5 4.411 10.196 -2.649 1.00 53.12 N ATOM 47 H ASN A 5 0.216 7.551 -2.123 1.00 75.10 H ATOM 48 HA ASN A 5 1.316 10.246 -1.720 1.00 13.42 H ATOM 49 HB2 ASN A 5 2.346 7.792 -2.929 1.00 51.24 H ATOM 50 HB3 ASN A 5 2.563 9.205 -3.958 1.00 4.32 H ATOM 51 HD21 ASN A 5 5.191 10.486 -2.132 1.00 12.22 H ATOM 52 HD22 ASN A 5 4.196 10.535 -3.543 1.00 55.33 H ATOM 53 N PRO A 6 0.477 11.330 -3.845 1.00 3.13 N ATOM 54 CA PRO A 6 -0.226 12.029 -4.925 1.00 21.43 C ATOM 55 C PRO A 6 0.233 11.573 -6.305 1.00 63.44 C ATOM 56 O PRO A 6 -0.537 11.596 -7.265 1.00 21.51 O ATOM 57 CB PRO A 6 0.143 13.497 -4.696 1.00 75.35 C ATOM 58 CG PRO A 6 1.444 13.453 -3.972 1.00 72.55 C ATOM 59 CD PRO A 6 1.400 12.217 -3.116 1.00 55.32 C ATOM 60 HA PRO A 6 -1.296 11.908 -4.844 1.00 73.45 H ATOM 61 HB2 PRO A 6 0.236 13.999 -5.649 1.00 42.20 H ATOM 62 HB3 PRO A 6 -0.622 13.976 -4.104 1.00 75.32 H ATOM 63 HG2 PRO A 6 2.256 13.389 -4.680 1.00 50.25 H ATOM 64 HG3 PRO A 6 1.550 14.332 -3.355 1.00 51.42 H ATOM 65 HD2 PRO A 6 2.382 11.775 -3.041 1.00 73.31 H ATOM 66 HD3 PRO A 6 1.013 12.452 -2.135 1.00 63.21 H ATOM 67 N ALA A 7 1.493 11.158 -6.398 1.00 54.22 N ATOM 68 CA ALA A 7 2.053 10.694 -7.661 1.00 42.42 C ATOM 69 C ALA A 7 1.837 9.196 -7.841 1.00 33.35 C ATOM 70 O ALA A 7 1.838 8.688 -8.962 1.00 60.52 O ATOM 71 CB ALA A 7 3.536 11.028 -7.735 1.00 12.02 C ATOM 72 H ALA A 7 2.058 11.163 -5.598 1.00 14.33 H ATOM 73 HA ALA A 7 1.551 11.219 -8.462 1.00 22.23 H ATOM 74 HB1 ALA A 7 3.935 10.684 -8.678 1.00 52.43 H ATOM 75 HB2 ALA A 7 3.669 12.097 -7.655 1.00 74.40 H ATOM 76 HB3 ALA A 7 4.055 10.539 -6.925 1.00 22.35 H ATOM 77 N CYS A 8 1.652 8.492 -6.729 1.00 15.15 N ATOM 78 CA CYS A 8 1.435 7.051 -6.762 1.00 72.10 C ATOM 79 C CYS A 8 0.229 6.702 -7.630 1.00 43.12 C ATOM 80 O CYS A 8 0.110 5.581 -8.123 1.00 30.45 O ATOM 81 CB CYS A 8 1.230 6.512 -5.345 1.00 33.20 C ATOM 82 SG CYS A 8 2.686 5.662 -4.655 1.00 34.51 S ATOM 83 H CYS A 8 1.661 8.954 -5.863 1.00 61.21 H ATOM 84 HA CYS A 8 2.314 6.593 -7.188 1.00 63.22 H ATOM 85 HB2 CYS A 8 0.988 7.334 -4.687 1.00 30.21 H ATOM 86 HB3 CYS A 8 0.410 5.809 -5.351 1.00 32.04 H ATOM 87 N MET A 9 -0.661 7.671 -7.813 1.00 53.42 N ATOM 88 CA MET A 9 -1.857 7.467 -8.623 1.00 42.30 C ATOM 89 C MET A 9 -1.540 7.616 -10.108 1.00 24.13 C ATOM 90 O MET A 9 -2.264 7.103 -10.962 1.00 1.20 O ATOM 91 CB MET A 9 -2.947 8.462 -8.221 1.00 34.15 C ATOM 92 CG MET A 9 -3.343 8.370 -6.756 1.00 4.44 C ATOM 93 SD MET A 9 -4.798 9.361 -6.366 1.00 4.35 S ATOM 94 CE MET A 9 -4.078 10.999 -6.277 1.00 52.10 C ATOM 95 H MET A 9 -0.511 8.545 -7.395 1.00 33.12 H ATOM 96 HA MET A 9 -2.212 6.464 -8.442 1.00 13.25 H ATOM 97 HB2 MET A 9 -2.594 9.464 -8.414 1.00 23.51 H ATOM 98 HB3 MET A 9 -3.826 8.277 -8.820 1.00 33.11 H ATOM 99 HG2 MET A 9 -3.553 7.339 -6.517 1.00 33.34 H ATOM 100 HG3 MET A 9 -2.516 8.716 -6.152 1.00 71.32 H ATOM 101 HE1 MET A 9 -4.850 11.719 -6.045 1.00 60.21 H ATOM 102 HE2 MET A 9 -3.323 11.020 -5.505 1.00 72.41 H ATOM 103 HE3 MET A 9 -3.629 11.246 -7.227 1.00 45.23 H ATOM 104 N LEU A 10 -0.454 8.320 -10.408 1.00 51.14 N ATOM 105 CA LEU A 10 -0.041 8.536 -11.791 1.00 11.43 C ATOM 106 C LEU A 10 1.114 7.614 -12.165 1.00 25.34 C ATOM 107 O LEU A 10 1.410 7.417 -13.343 1.00 41.05 O ATOM 108 CB LEU A 10 0.368 9.996 -11.999 1.00 63.50 C ATOM 109 CG LEU A 10 -0.693 11.045 -11.665 1.00 24.33 C ATOM 110 CD1 LEU A 10 -0.111 12.446 -11.773 1.00 62.44 C ATOM 111 CD2 LEU A 10 -1.899 10.894 -12.580 1.00 21.31 C ATOM 112 H LEU A 10 0.083 8.704 -9.685 1.00 0.02 H ATOM 113 HA LEU A 10 -0.884 8.313 -12.427 1.00 55.31 H ATOM 114 HB2 LEU A 10 1.231 10.188 -11.380 1.00 14.55 H ATOM 115 HB3 LEU A 10 0.639 10.117 -13.038 1.00 64.12 H ATOM 116 HG LEU A 10 -1.024 10.900 -10.646 1.00 35.12 H ATOM 117 HD11 LEU A 10 -0.704 13.029 -12.461 1.00 0.32 H ATOM 118 HD12 LEU A 10 0.905 12.386 -12.135 1.00 1.31 H ATOM 119 HD13 LEU A 10 -0.119 12.915 -10.801 1.00 15.24 H ATOM 120 HD21 LEU A 10 -2.584 10.174 -12.157 1.00 65.42 H ATOM 121 HD22 LEU A 10 -1.573 10.554 -13.552 1.00 24.54 H ATOM 122 HD23 LEU A 10 -2.396 11.848 -12.681 1.00 23.11 H ATOM 123 N LYS A 11 1.764 7.048 -11.153 1.00 20.11 N ATOM 124 CA LYS A 11 2.885 6.142 -11.374 1.00 3.53 C ATOM 125 C LYS A 11 2.485 4.700 -11.082 1.00 62.30 C ATOM 126 O LYS A 11 3.217 3.765 -11.405 1.00 44.52 O ATOM 127 CB LYS A 11 4.071 6.542 -10.493 1.00 3.11 C ATOM 128 CG LYS A 11 5.273 7.037 -11.279 1.00 23.52 C ATOM 129 CD LYS A 11 6.564 6.856 -10.497 1.00 34.50 C ATOM 130 CE LYS A 11 6.743 7.950 -9.456 1.00 51.23 C ATOM 131 NZ LYS A 11 7.979 7.751 -8.650 1.00 13.55 N ATOM 132 H LYS A 11 1.481 7.244 -10.234 1.00 64.45 H ATOM 133 HA LYS A 11 3.175 6.220 -12.411 1.00 5.45 H ATOM 134 HB2 LYS A 11 3.757 7.328 -9.822 1.00 44.54 H ATOM 135 HB3 LYS A 11 4.376 5.685 -9.910 1.00 65.44 H ATOM 136 HG2 LYS A 11 5.343 6.479 -12.201 1.00 50.43 H ATOM 137 HG3 LYS A 11 5.141 8.086 -11.499 1.00 53.32 H ATOM 138 HD2 LYS A 11 6.540 5.899 -9.996 1.00 40.12 H ATOM 139 HD3 LYS A 11 7.398 6.884 -11.184 1.00 75.20 H ATOM 140 HE2 LYS A 11 6.802 8.902 -9.961 1.00 10.32 H ATOM 141 HE3 LYS A 11 5.888 7.945 -8.797 1.00 33.14 H ATOM 142 HZ1 LYS A 11 8.471 8.658 -8.520 1.00 11.30 H ATOM 143 HZ2 LYS A 11 8.618 7.088 -9.133 1.00 13.11 H ATOM 144 HZ3 LYS A 11 7.737 7.364 -7.715 1.00 61.45 H ATOM 145 N ASN A 12 1.318 4.526 -10.471 1.00 0.15 N ATOM 146 CA ASN A 12 0.820 3.197 -10.136 1.00 65.44 C ATOM 147 C ASN A 12 -0.705 3.170 -10.141 1.00 21.34 C ATOM 148 O ASN A 12 -1.351 3.023 -9.103 1.00 2.13 O ATOM 149 CB ASN A 12 1.346 2.762 -8.767 1.00 13.14 C ATOM 150 CG ASN A 12 2.848 2.553 -8.763 1.00 74.41 C ATOM 151 OD1 ASN A 12 3.330 1.432 -8.929 1.00 13.01 O ATOM 152 ND2 ASN A 12 3.595 3.634 -8.573 1.00 61.33 N ATOM 153 H ASN A 12 0.778 5.311 -10.238 1.00 25.51 H ATOM 154 HA ASN A 12 1.183 2.509 -10.886 1.00 2.23 H ATOM 155 HB2 ASN A 12 1.106 3.523 -8.038 1.00 43.22 H ATOM 156 HB3 ASN A 12 0.870 1.835 -8.482 1.00 44.35 H ATOM 157 HD21 ASN A 12 4.569 3.527 -8.567 1.00 42.11 H ATOM 158 HD22 ASN A 12 3.142 4.494 -8.448 1.00 23.11 H ATOM 159 N PRO A 13 -1.296 3.314 -11.336 1.00 20.11 N ATOM 160 CA PRO A 13 -2.752 3.308 -11.505 1.00 11.31 C ATOM 161 C PRO A 13 -3.359 1.931 -11.262 1.00 23.44 C ATOM 162 O PRO A 13 -4.568 1.798 -11.078 1.00 41.24 O ATOM 163 CB PRO A 13 -2.941 3.726 -12.965 1.00 74.34 C ATOM 164 CG PRO A 13 -1.675 3.326 -13.641 1.00 0.24 C ATOM 165 CD PRO A 13 -0.588 3.493 -12.615 1.00 33.12 C ATOM 166 HA PRO A 13 -3.229 4.030 -10.858 1.00 33.22 H ATOM 167 HB2 PRO A 13 -3.793 3.208 -13.383 1.00 33.51 H ATOM 168 HB3 PRO A 13 -3.099 4.792 -13.021 1.00 41.23 H ATOM 169 HG2 PRO A 13 -1.737 2.296 -13.958 1.00 2.35 H ATOM 170 HG3 PRO A 13 -1.492 3.971 -14.488 1.00 31.42 H ATOM 171 HD2 PRO A 13 0.172 2.737 -12.744 1.00 71.20 H ATOM 172 HD3 PRO A 13 -0.156 4.480 -12.680 1.00 42.43 H ATOM 173 N ASN A 14 -2.510 0.907 -11.261 1.00 15.40 N ATOM 174 CA ASN A 14 -2.964 -0.461 -11.040 1.00 62.11 C ATOM 175 C ASN A 14 -3.194 -0.725 -9.555 1.00 52.22 C ATOM 176 O ASN A 14 -3.695 -1.783 -9.172 1.00 13.33 O ATOM 177 CB ASN A 14 -1.941 -1.455 -11.593 1.00 44.04 C ATOM 178 CG ASN A 14 -2.141 -1.728 -13.072 1.00 24.03 C ATOM 179 OD1 ASN A 14 -3.074 -1.214 -13.688 1.00 72.44 O ATOM 180 ND2 ASN A 14 -1.262 -2.541 -13.647 1.00 51.32 N ATOM 181 H ASN A 14 -1.557 1.076 -11.413 1.00 11.21 H ATOM 182 HA ASN A 14 -3.898 -0.590 -11.566 1.00 1.51 H ATOM 183 HB2 ASN A 14 -0.947 -1.055 -11.452 1.00 61.24 H ATOM 184 HB3 ASN A 14 -2.028 -2.388 -11.058 1.00 61.42 H ATOM 185 HD21 ASN A 14 -1.367 -2.734 -14.602 1.00 55.12 H ATOM 186 HD22 ASN A 14 -0.544 -2.913 -13.094 1.00 31.52 H ATOM 187 N LEU A 15 -2.826 0.244 -8.724 1.00 22.40 N ATOM 188 CA LEU A 15 -2.993 0.117 -7.280 1.00 44.42 C ATOM 189 C LEU A 15 -3.898 1.219 -6.738 1.00 71.33 C ATOM 190 O LEU A 15 -4.877 0.946 -6.042 1.00 5.31 O ATOM 191 CB LEU A 15 -1.632 0.171 -6.583 1.00 50.02 C ATOM 192 CG LEU A 15 -1.157 -1.131 -5.937 1.00 11.11 C ATOM 193 CD1 LEU A 15 0.177 -0.924 -5.236 1.00 53.45 C ATOM 194 CD2 LEU A 15 -2.200 -1.652 -4.959 1.00 21.03 C ATOM 195 H LEU A 15 -2.432 1.063 -9.089 1.00 14.35 H ATOM 196 HA LEU A 15 -3.452 -0.840 -7.082 1.00 41.33 H ATOM 197 HB2 LEU A 15 -0.896 0.463 -7.316 1.00 53.44 H ATOM 198 HB3 LEU A 15 -1.687 0.925 -5.810 1.00 62.43 H ATOM 199 HG LEU A 15 -1.017 -1.877 -6.707 1.00 22.34 H ATOM 200 HD11 LEU A 15 0.059 -0.198 -4.446 1.00 22.22 H ATOM 201 HD12 LEU A 15 0.905 -0.565 -5.949 1.00 23.24 H ATOM 202 HD13 LEU A 15 0.513 -1.861 -4.819 1.00 24.23 H ATOM 203 HD21 LEU A 15 -1.736 -2.346 -4.274 1.00 71.53 H ATOM 204 HD22 LEU A 15 -2.985 -2.154 -5.504 1.00 54.23 H ATOM 205 HD23 LEU A 15 -2.619 -0.824 -4.405 1.00 22.55 H ATOM 206 N CYS A 16 -3.567 2.464 -7.064 1.00 61.40 N ATOM 207 CA CYS A 16 -4.350 3.607 -6.612 1.00 54.02 C ATOM 208 C CYS A 16 -4.326 4.727 -7.648 1.00 63.04 C ATOM 209 O CYS A 16 -4.412 4.475 -8.850 1.00 51.34 O ATOM 210 CB CYS A 16 -3.814 4.123 -5.275 1.00 75.41 C ATOM 211 SG CYS A 16 -4.907 5.323 -4.449 1.00 55.53 S ATOM 212 H CYS A 16 -2.775 2.618 -7.622 1.00 72.44 H ATOM 213 HA CYS A 16 -5.370 3.279 -6.479 1.00 0.10 H ATOM 214 HB2 CYS A 16 -3.680 3.287 -4.604 1.00 24.22 H ATOM 215 HB3 CYS A 16 -2.861 4.603 -5.439 1.00 54.21 H TER 216 CYS A 16 ENDMDL MODEL 5 ATOM 1 N GLY A 1 0.660 -0.392 -1.012 1.00 54.22 N ATOM 2 CA GLY A 1 2.028 0.004 -1.288 1.00 23.02 C ATOM 3 C GLY A 1 2.115 1.357 -1.966 1.00 22.20 C ATOM 4 O GLY A 1 3.094 2.084 -1.795 1.00 22.22 O ATOM 5 H1 GLY A 1 0.227 -1.073 -1.569 1.00 52.40 H ATOM 6 HA2 GLY A 1 2.574 0.044 -0.357 1.00 64.52 H ATOM 7 HA3 GLY A 1 2.483 -0.737 -1.929 1.00 51.12 H ATOM 8 N CYS A 2 1.090 1.696 -2.740 1.00 33.11 N ATOM 9 CA CYS A 2 1.054 2.969 -3.449 1.00 2.43 C ATOM 10 C CYS A 2 -0.359 3.546 -3.460 1.00 45.32 C ATOM 11 O CYS A 2 -1.235 3.057 -4.173 1.00 33.10 O ATOM 12 CB CYS A 2 1.556 2.793 -4.883 1.00 64.31 C ATOM 13 SG CYS A 2 2.971 3.857 -5.312 1.00 24.02 S ATOM 14 H CYS A 2 0.337 1.074 -2.837 1.00 64.12 H ATOM 15 HA CYS A 2 1.706 3.656 -2.930 1.00 51.14 H ATOM 16 HB2 CYS A 2 1.863 1.767 -5.025 1.00 24.41 H ATOM 17 HB3 CYS A 2 0.753 3.021 -5.568 1.00 64.32 H ATOM 18 N CYS A 3 -0.572 4.590 -2.666 1.00 2.01 N ATOM 19 CA CYS A 3 -1.877 5.235 -2.583 1.00 63.33 C ATOM 20 C CYS A 3 -1.823 6.457 -1.671 1.00 61.11 C ATOM 21 O CYS A 3 -2.561 7.423 -1.866 1.00 22.32 O ATOM 22 CB CYS A 3 -2.925 4.247 -2.069 1.00 34.40 C ATOM 23 SG CYS A 3 -4.644 4.819 -2.262 1.00 31.02 S ATOM 24 H CYS A 3 0.167 4.936 -2.121 1.00 21.50 H ATOM 25 HA CYS A 3 -2.153 5.554 -3.577 1.00 4.34 H ATOM 26 HB2 CYS A 3 -2.827 3.316 -2.609 1.00 54.01 H ATOM 27 HB3 CYS A 3 -2.754 4.066 -1.018 1.00 53.40 H ATOM 28 N SER A 4 -0.944 6.407 -0.675 1.00 60.22 N ATOM 29 CA SER A 4 -0.796 7.508 0.269 1.00 23.35 C ATOM 30 C SER A 4 -0.012 8.658 -0.355 1.00 62.23 C ATOM 31 O SER A 4 0.117 9.729 0.236 1.00 71.10 O ATOM 32 CB SER A 4 -0.092 7.026 1.540 1.00 44.34 C ATOM 33 OG SER A 4 -0.757 7.494 2.700 1.00 10.00 O ATOM 34 H SER A 4 -0.384 5.609 -0.572 1.00 43.02 H ATOM 35 HA SER A 4 -1.784 7.859 0.527 1.00 62.10 H ATOM 36 HB2 SER A 4 -0.081 5.947 1.556 1.00 54.25 H ATOM 37 HB3 SER A 4 0.924 7.396 1.547 1.00 14.22 H ATOM 38 HG SER A 4 -0.394 7.059 3.475 1.00 70.32 H ATOM 39 N ASN A 5 0.510 8.427 -1.556 1.00 22.34 N ATOM 40 CA ASN A 5 1.282 9.443 -2.262 1.00 23.52 C ATOM 41 C ASN A 5 0.472 10.045 -3.405 1.00 74.12 C ATOM 42 O ASN A 5 -0.333 9.372 -4.050 1.00 41.34 O ATOM 43 CB ASN A 5 2.581 8.841 -2.804 1.00 35.12 C ATOM 44 CG ASN A 5 3.789 9.233 -1.976 1.00 22.10 C ATOM 45 OD1 ASN A 5 3.670 9.536 -0.789 1.00 4.32 O ATOM 46 ND2 ASN A 5 4.961 9.228 -2.601 1.00 52.51 N ATOM 47 H ASN A 5 0.373 7.552 -1.976 1.00 43.34 H ATOM 48 HA ASN A 5 1.525 10.224 -1.557 1.00 73.32 H ATOM 49 HB2 ASN A 5 2.500 7.764 -2.800 1.00 30.42 H ATOM 50 HB3 ASN A 5 2.734 9.183 -3.816 1.00 71.33 H ATOM 51 HD21 ASN A 5 5.759 9.477 -2.089 1.00 52.25 H ATOM 52 HD22 ASN A 5 4.980 8.976 -3.548 1.00 52.10 H ATOM 53 N PRO A 6 0.687 11.343 -3.664 1.00 3.22 N ATOM 54 CA PRO A 6 -0.013 12.065 -4.731 1.00 24.14 C ATOM 55 C PRO A 6 0.426 11.614 -6.120 1.00 3.52 C ATOM 56 O PRO A 6 -0.352 11.661 -7.072 1.00 63.41 O ATOM 57 CB PRO A 6 0.384 13.524 -4.491 1.00 61.24 C ATOM 58 CG PRO A 6 1.691 13.449 -3.779 1.00 54.34 C ATOM 59 CD PRO A 6 1.632 12.207 -2.935 1.00 33.51 C ATOM 60 HA PRO A 6 -1.084 11.962 -4.642 1.00 52.31 H ATOM 61 HB2 PRO A 6 0.478 14.034 -5.440 1.00 25.03 H ATOM 62 HB3 PRO A 6 -0.367 14.011 -3.888 1.00 20.54 H ATOM 63 HG2 PRO A 6 2.495 13.378 -4.495 1.00 44.52 H ATOM 64 HG3 PRO A 6 1.818 14.321 -3.155 1.00 31.15 H ATOM 65 HD2 PRO A 6 2.606 11.746 -2.873 1.00 24.21 H ATOM 66 HD3 PRO A 6 1.258 12.438 -1.948 1.00 43.22 H ATOM 67 N ALA A 7 1.677 11.179 -6.228 1.00 22.32 N ATOM 68 CA ALA A 7 2.218 10.718 -7.500 1.00 63.53 C ATOM 69 C ALA A 7 1.973 9.225 -7.692 1.00 64.32 C ATOM 70 O ALA A 7 1.956 8.728 -8.819 1.00 32.23 O ATOM 71 CB ALA A 7 3.706 11.025 -7.584 1.00 10.42 C ATOM 72 H ALA A 7 2.249 11.166 -5.432 1.00 61.24 H ATOM 73 HA ALA A 7 1.719 11.259 -8.291 1.00 72.41 H ATOM 74 HB1 ALA A 7 4.247 10.362 -6.925 1.00 65.43 H ATOM 75 HB2 ALA A 7 4.046 10.883 -8.599 1.00 4.25 H ATOM 76 HB3 ALA A 7 3.879 12.049 -7.285 1.00 72.55 H ATOM 77 N CYS A 8 1.785 8.514 -6.586 1.00 25.45 N ATOM 78 CA CYS A 8 1.543 7.077 -6.631 1.00 72.22 C ATOM 79 C CYS A 8 0.324 6.758 -7.492 1.00 14.22 C ATOM 80 O CYS A 8 0.180 5.644 -7.994 1.00 32.11 O ATOM 81 CB CYS A 8 1.341 6.527 -5.218 1.00 15.44 C ATOM 82 SG CYS A 8 2.787 5.644 -4.549 1.00 51.41 S ATOM 83 H CYS A 8 1.811 8.966 -5.716 1.00 11.43 H ATOM 84 HA CYS A 8 2.410 6.607 -7.070 1.00 1.43 H ATOM 85 HB2 CYS A 8 1.119 7.347 -4.549 1.00 44.15 H ATOM 86 HB3 CYS A 8 0.508 5.839 -5.223 1.00 1.53 H ATOM 87 N MET A 9 -0.551 7.745 -7.657 1.00 71.04 N ATOM 88 CA MET A 9 -1.757 7.570 -8.458 1.00 51.34 C ATOM 89 C MET A 9 -1.450 7.728 -9.944 1.00 54.13 C ATOM 90 O MET A 9 -2.191 7.237 -10.797 1.00 73.11 O ATOM 91 CB MET A 9 -2.826 8.580 -8.036 1.00 72.04 C ATOM 92 CG MET A 9 -4.212 7.972 -7.889 1.00 4.22 C ATOM 93 SD MET A 9 -5.516 9.217 -7.856 1.00 30.41 S ATOM 94 CE MET A 9 -6.736 8.456 -8.924 1.00 52.33 C ATOM 95 H MET A 9 -0.382 8.612 -7.232 1.00 23.41 H ATOM 96 HA MET A 9 -2.129 6.572 -8.284 1.00 22.14 H ATOM 97 HB2 MET A 9 -2.543 9.011 -7.088 1.00 2.11 H ATOM 98 HB3 MET A 9 -2.878 9.363 -8.778 1.00 1.32 H ATOM 99 HG2 MET A 9 -4.390 7.308 -8.721 1.00 25.50 H ATOM 100 HG3 MET A 9 -4.246 7.409 -6.968 1.00 0.43 H ATOM 101 HE1 MET A 9 -6.561 8.763 -9.945 1.00 63.55 H ATOM 102 HE2 MET A 9 -6.658 7.382 -8.852 1.00 73.43 H ATOM 103 HE3 MET A 9 -7.725 8.767 -8.619 1.00 45.05 H ATOM 104 N LEU A 10 -0.355 8.416 -10.248 1.00 32.21 N ATOM 105 CA LEU A 10 0.049 8.638 -11.632 1.00 4.53 C ATOM 106 C LEU A 10 1.185 7.699 -12.025 1.00 10.10 C ATOM 107 O LEU A 10 1.467 7.509 -13.208 1.00 74.03 O ATOM 108 CB LEU A 10 0.483 10.092 -11.829 1.00 41.03 C ATOM 109 CG LEU A 10 -0.599 11.151 -11.613 1.00 21.40 C ATOM 110 CD1 LEU A 10 0.018 12.539 -11.552 1.00 13.51 C ATOM 111 CD2 LEU A 10 -1.645 11.077 -12.716 1.00 2.41 C ATOM 112 H LEU A 10 0.195 8.783 -9.525 1.00 61.24 H ATOM 113 HA LEU A 10 -0.803 8.437 -12.263 1.00 34.24 H ATOM 114 HB2 LEU A 10 1.286 10.294 -11.138 1.00 2.35 H ATOM 115 HB3 LEU A 10 0.848 10.193 -12.842 1.00 22.44 H ATOM 116 HG LEU A 10 -1.093 10.964 -10.669 1.00 70.34 H ATOM 117 HD11 LEU A 10 -0.082 12.934 -10.552 1.00 73.02 H ATOM 118 HD12 LEU A 10 -0.491 13.190 -12.248 1.00 64.23 H ATOM 119 HD13 LEU A 10 1.064 12.480 -11.814 1.00 2.35 H ATOM 120 HD21 LEU A 10 -2.006 10.064 -12.803 1.00 32.35 H ATOM 121 HD22 LEU A 10 -1.202 11.383 -13.652 1.00 43.42 H ATOM 122 HD23 LEU A 10 -2.468 11.735 -12.476 1.00 21.24 H ATOM 123 N LYS A 11 1.833 7.112 -11.025 1.00 22.22 N ATOM 124 CA LYS A 11 2.936 6.189 -11.265 1.00 21.24 C ATOM 125 C LYS A 11 2.513 4.751 -10.983 1.00 71.55 C ATOM 126 O LYS A 11 3.225 3.807 -11.322 1.00 64.33 O ATOM 127 CB LYS A 11 4.137 6.558 -10.391 1.00 12.44 C ATOM 128 CG LYS A 11 5.340 7.039 -11.182 1.00 44.24 C ATOM 129 CD LYS A 11 6.634 6.827 -10.414 1.00 42.41 C ATOM 130 CE LYS A 11 7.209 8.145 -9.917 1.00 63.21 C ATOM 131 NZ LYS A 11 8.658 8.030 -9.592 1.00 40.11 N ATOM 132 H LYS A 11 1.562 7.303 -10.102 1.00 3.30 H ATOM 133 HA LYS A 11 3.218 6.272 -12.303 1.00 65.21 H ATOM 134 HB2 LYS A 11 3.843 7.344 -9.710 1.00 30.54 H ATOM 135 HB3 LYS A 11 4.432 5.690 -9.819 1.00 72.13 H ATOM 136 HG2 LYS A 11 5.392 6.490 -12.111 1.00 10.30 H ATOM 137 HG3 LYS A 11 5.225 8.093 -11.391 1.00 53.42 H ATOM 138 HD2 LYS A 11 6.438 6.190 -9.565 1.00 3.13 H ATOM 139 HD3 LYS A 11 7.355 6.352 -11.064 1.00 41.24 H ATOM 140 HE2 LYS A 11 7.080 8.892 -10.685 1.00 75.20 H ATOM 141 HE3 LYS A 11 6.672 8.445 -9.029 1.00 64.52 H ATOM 142 HZ1 LYS A 11 9.118 8.959 -9.677 1.00 21.24 H ATOM 143 HZ2 LYS A 11 9.119 7.366 -10.246 1.00 60.42 H ATOM 144 HZ3 LYS A 11 8.780 7.682 -8.620 1.00 34.02 H ATOM 145 N ASN A 12 1.348 4.592 -10.363 1.00 62.32 N ATOM 146 CA ASN A 12 0.830 3.268 -10.038 1.00 31.13 C ATOM 147 C ASN A 12 -0.696 3.268 -10.028 1.00 43.24 C ATOM 148 O ASN A 12 -1.335 3.123 -8.986 1.00 60.23 O ATOM 149 CB ASN A 12 1.359 2.811 -8.677 1.00 63.50 C ATOM 150 CG ASN A 12 2.857 2.574 -8.689 1.00 43.41 C ATOM 151 OD1 ASN A 12 3.318 1.447 -8.870 1.00 52.11 O ATOM 152 ND2 ASN A 12 3.626 3.640 -8.495 1.00 54.14 N ATOM 153 H ASN A 12 0.825 5.383 -10.118 1.00 52.22 H ATOM 154 HA ASN A 12 1.174 2.582 -10.797 1.00 33.31 H ATOM 155 HB2 ASN A 12 1.140 3.568 -7.939 1.00 51.40 H ATOM 156 HB3 ASN A 12 0.870 1.890 -8.398 1.00 21.43 H ATOM 157 HD21 ASN A 12 4.598 3.516 -8.499 1.00 14.10 H ATOM 158 HD22 ASN A 12 3.189 4.507 -8.358 1.00 23.15 H ATOM 159 N PRO A 13 -1.295 3.435 -11.217 1.00 24.20 N ATOM 160 CA PRO A 13 -2.752 3.457 -11.373 1.00 30.21 C ATOM 161 C PRO A 13 -3.381 2.088 -11.138 1.00 20.23 C ATOM 162 O PRO A 13 -4.591 1.975 -10.945 1.00 3.15 O ATOM 163 CB PRO A 13 -2.947 3.892 -12.827 1.00 63.15 C ATOM 164 CG PRO A 13 -1.694 3.477 -13.518 1.00 24.30 C ATOM 165 CD PRO A 13 -0.595 3.614 -12.500 1.00 71.23 C ATOM 166 HA PRO A 13 -3.211 4.180 -10.715 1.00 5.25 H ATOM 167 HB2 PRO A 13 -3.811 3.393 -13.242 1.00 53.24 H ATOM 168 HB3 PRO A 13 -3.086 4.962 -12.872 1.00 25.35 H ATOM 169 HG2 PRO A 13 -1.777 2.451 -13.844 1.00 44.33 H ATOM 170 HG3 PRO A 13 -1.507 4.126 -14.360 1.00 43.14 H ATOM 171 HD2 PRO A 13 0.150 2.846 -12.644 1.00 23.32 H ATOM 172 HD3 PRO A 13 -0.146 4.594 -12.560 1.00 44.11 H ATOM 173 N ASN A 14 -2.551 1.050 -11.155 1.00 73.41 N ATOM 174 CA ASN A 14 -3.027 -0.313 -10.944 1.00 11.34 C ATOM 175 C ASN A 14 -3.248 -0.587 -9.459 1.00 75.33 C ATOM 176 O ASN A 14 -3.765 -1.640 -9.082 1.00 3.04 O ATOM 177 CB ASN A 14 -2.027 -1.319 -11.516 1.00 61.13 C ATOM 178 CG ASN A 14 -2.349 -1.704 -12.947 1.00 74.32 C ATOM 179 OD1 ASN A 14 -3.125 -2.628 -13.193 1.00 65.53 O ATOM 180 ND2 ASN A 14 -1.754 -0.995 -13.899 1.00 61.31 N ATOM 181 H ASN A 14 -1.596 1.203 -11.314 1.00 75.12 H ATOM 182 HA ASN A 14 -3.968 -0.419 -11.462 1.00 31.21 H ATOM 183 HB2 ASN A 14 -1.037 -0.886 -11.495 1.00 54.20 H ATOM 184 HB3 ASN A 14 -2.037 -2.213 -10.911 1.00 13.22 H ATOM 185 HD21 ASN A 14 -1.945 -1.223 -14.833 1.00 0.40 H ATOM 186 HD22 ASN A 14 -1.148 -0.273 -13.629 1.00 33.51 H ATOM 187 N LEU A 15 -2.855 0.366 -8.622 1.00 14.11 N ATOM 188 CA LEU A 15 -3.011 0.228 -7.178 1.00 52.20 C ATOM 189 C LEU A 15 -3.892 1.340 -6.617 1.00 32.22 C ATOM 190 O LEU A 15 -4.869 1.078 -5.914 1.00 63.30 O ATOM 191 CB LEU A 15 -1.644 0.251 -6.493 1.00 64.12 C ATOM 192 CG LEU A 15 -1.186 -1.066 -5.864 1.00 41.44 C ATOM 193 CD1 LEU A 15 0.158 -0.889 -5.175 1.00 10.13 C ATOM 194 CD2 LEU A 15 -2.229 -1.578 -4.882 1.00 25.14 C ATOM 195 H LEU A 15 -2.451 1.182 -8.982 1.00 2.30 H ATOM 196 HA LEU A 15 -3.486 -0.722 -6.985 1.00 65.54 H ATOM 197 HB2 LEU A 15 -0.910 0.538 -7.230 1.00 65.23 H ATOM 198 HB3 LEU A 15 -1.678 0.997 -5.712 1.00 50.54 H ATOM 199 HG LEU A 15 -1.066 -1.807 -6.643 1.00 0.52 H ATOM 200 HD11 LEU A 15 0.242 0.121 -4.803 1.00 32.00 H ATOM 201 HD12 LEU A 15 0.953 -1.080 -5.881 1.00 14.13 H ATOM 202 HD13 LEU A 15 0.234 -1.584 -4.351 1.00 51.02 H ATOM 203 HD21 LEU A 15 -2.692 -2.468 -5.280 1.00 55.24 H ATOM 204 HD22 LEU A 15 -2.980 -0.818 -4.726 1.00 72.22 H ATOM 205 HD23 LEU A 15 -1.752 -1.811 -3.940 1.00 50.41 H ATOM 206 N CYS A 16 -3.542 2.582 -6.933 1.00 60.14 N ATOM 207 CA CYS A 16 -4.301 3.734 -6.463 1.00 1.41 C ATOM 208 C CYS A 16 -4.265 4.864 -7.488 1.00 15.31 C ATOM 209 O CYS A 16 -5.175 5.002 -8.306 1.00 15.24 O ATOM 210 CB CYS A 16 -3.744 4.227 -5.126 1.00 32.45 C ATOM 211 SG CYS A 16 -4.808 5.439 -4.278 1.00 43.05 S ATOM 212 H CYS A 16 -2.753 2.728 -7.498 1.00 21.45 H ATOM 213 HA CYS A 16 -5.325 3.423 -6.324 1.00 10.21 H ATOM 214 HB2 CYS A 16 -3.619 3.382 -4.464 1.00 30.22 H ATOM 215 HB3 CYS A 16 -2.784 4.691 -5.293 1.00 41.22 H TER 216 CYS A 16 ENDMDL MODEL 6 ATOM 1 N GLY A 1 1.935 0.282 0.209 1.00 35.35 N ATOM 2 CA GLY A 1 1.909 0.171 -1.237 1.00 55.03 C ATOM 3 C GLY A 1 1.985 1.520 -1.923 1.00 50.55 C ATOM 4 O GLY A 1 2.855 2.335 -1.613 1.00 63.35 O ATOM 5 H1 GLY A 1 1.096 0.252 0.716 1.00 21.54 H ATOM 6 HA2 GLY A 1 2.746 -0.432 -1.556 1.00 52.54 H ATOM 7 HA3 GLY A 1 0.992 -0.319 -1.533 1.00 2.51 H ATOM 8 N CYS A 2 1.073 1.759 -2.860 1.00 70.30 N ATOM 9 CA CYS A 2 1.041 3.018 -3.594 1.00 61.34 C ATOM 10 C CYS A 2 -0.369 3.600 -3.615 1.00 74.43 C ATOM 11 O CYS A 2 -1.249 3.099 -4.317 1.00 12.14 O ATOM 12 CB CYS A 2 1.540 2.810 -5.026 1.00 3.24 C ATOM 13 SG CYS A 2 2.959 3.860 -5.478 1.00 31.12 S ATOM 14 H CYS A 2 0.404 1.070 -3.063 1.00 3.31 H ATOM 15 HA CYS A 2 1.696 3.712 -3.091 1.00 42.31 H ATOM 16 HB2 CYS A 2 1.843 1.780 -5.147 1.00 51.33 H ATOM 17 HB3 CYS A 2 0.737 3.028 -5.714 1.00 21.40 H ATOM 18 N CYS A 3 -0.578 4.660 -2.842 1.00 45.00 N ATOM 19 CA CYS A 3 -1.880 5.311 -2.770 1.00 41.24 C ATOM 20 C CYS A 3 -1.820 6.551 -1.883 1.00 40.33 C ATOM 21 O CYS A 3 -2.555 7.516 -2.096 1.00 64.24 O ATOM 22 CB CYS A 3 -2.931 4.338 -2.234 1.00 74.45 C ATOM 23 SG CYS A 3 -4.648 4.913 -2.436 1.00 72.50 S ATOM 24 H CYS A 3 0.164 5.014 -2.305 1.00 74.34 H ATOM 25 HA CYS A 3 -2.156 5.612 -3.770 1.00 32.44 H ATOM 26 HB2 CYS A 3 -2.838 3.396 -2.756 1.00 21.01 H ATOM 27 HB3 CYS A 3 -2.759 4.178 -1.180 1.00 51.04 H ATOM 28 N SER A 4 -0.940 6.518 -0.888 1.00 44.20 N ATOM 29 CA SER A 4 -0.786 7.637 0.034 1.00 44.40 C ATOM 30 C SER A 4 0.001 8.772 -0.615 1.00 64.33 C ATOM 31 O SER A 4 0.135 9.854 -0.046 1.00 51.12 O ATOM 32 CB SER A 4 -0.081 7.179 1.312 1.00 12.24 C ATOM 33 OG SER A 4 -0.743 7.673 2.464 1.00 4.42 O ATOM 34 H SER A 4 -0.382 5.721 -0.770 1.00 31.53 H ATOM 35 HA SER A 4 -1.772 7.997 0.286 1.00 40.52 H ATOM 36 HB2 SER A 4 -0.075 6.101 1.350 1.00 35.45 H ATOM 37 HB3 SER A 4 0.935 7.545 1.311 1.00 45.03 H ATOM 38 HG SER A 4 -0.833 6.968 3.109 1.00 30.00 H ATOM 39 N ASN A 5 0.521 8.514 -1.811 1.00 51.23 N ATOM 40 CA ASN A 5 1.296 9.513 -2.539 1.00 73.41 C ATOM 41 C ASN A 5 0.485 10.095 -3.693 1.00 63.22 C ATOM 42 O ASN A 5 -0.323 9.412 -4.324 1.00 3.35 O ATOM 43 CB ASN A 5 2.591 8.895 -3.071 1.00 13.20 C ATOM 44 CG ASN A 5 3.802 9.300 -2.254 1.00 23.45 C ATOM 45 OD1 ASN A 5 4.726 9.933 -2.764 1.00 42.02 O ATOM 46 ND2 ASN A 5 3.803 8.934 -0.977 1.00 24.20 N ATOM 47 H ASN A 5 0.380 7.632 -2.214 1.00 23.20 H ATOM 48 HA ASN A 5 1.542 10.307 -1.851 1.00 23.11 H ATOM 49 HB2 ASN A 5 2.506 7.818 -3.045 1.00 1.42 H ATOM 50 HB3 ASN A 5 2.743 9.216 -4.091 1.00 24.45 H ATOM 51 HD21 ASN A 5 4.574 9.183 -0.425 1.00 61.33 H ATOM 52 HD22 ASN A 5 3.033 8.431 -0.639 1.00 23.55 H ATOM 53 N PRO A 6 0.705 11.387 -3.978 1.00 64.22 N ATOM 54 CA PRO A 6 0.006 12.089 -5.058 1.00 43.53 C ATOM 55 C PRO A 6 0.441 11.610 -6.439 1.00 23.43 C ATOM 56 O PRO A 6 -0.338 11.640 -7.391 1.00 1.13 O ATOM 57 CB PRO A 6 0.409 13.551 -4.849 1.00 53.50 C ATOM 58 CG PRO A 6 1.716 13.486 -4.138 1.00 1.42 C ATOM 59 CD PRO A 6 1.654 12.261 -3.268 1.00 40.23 C ATOM 60 HA PRO A 6 -1.066 11.993 -4.966 1.00 24.40 H ATOM 61 HB2 PRO A 6 0.503 14.042 -5.808 1.00 4.14 H ATOM 62 HB3 PRO A 6 -0.340 14.053 -4.254 1.00 64.00 H ATOM 63 HG2 PRO A 6 2.519 13.398 -4.853 1.00 44.32 H ATOM 64 HG3 PRO A 6 1.848 14.370 -3.531 1.00 34.03 H ATOM 65 HD2 PRO A 6 2.627 11.798 -3.199 1.00 2.25 H ATOM 66 HD3 PRO A 6 1.283 12.514 -2.286 1.00 1.01 H ATOM 67 N ALA A 7 1.690 11.166 -6.540 1.00 1.33 N ATOM 68 CA ALA A 7 2.227 10.678 -7.803 1.00 64.45 C ATOM 69 C ALA A 7 1.977 9.182 -7.965 1.00 13.11 C ATOM 70 O ALA A 7 1.955 8.663 -9.081 1.00 63.32 O ATOM 71 CB ALA A 7 3.716 10.978 -7.895 1.00 41.15 C ATOM 72 H ALA A 7 2.263 11.167 -5.745 1.00 21.20 H ATOM 73 HA ALA A 7 1.729 11.205 -8.604 1.00 74.53 H ATOM 74 HB1 ALA A 7 3.866 12.048 -7.914 1.00 70.11 H ATOM 75 HB2 ALA A 7 4.222 10.558 -7.039 1.00 15.23 H ATOM 76 HB3 ALA A 7 4.116 10.543 -8.799 1.00 73.40 H ATOM 77 N CYS A 8 1.788 8.494 -6.844 1.00 10.22 N ATOM 78 CA CYS A 8 1.540 7.058 -6.860 1.00 71.31 C ATOM 79 C CYS A 8 0.318 6.726 -7.712 1.00 41.32 C ATOM 80 O CYS A 8 0.169 5.603 -8.192 1.00 24.34 O ATOM 81 CB CYS A 8 1.338 6.538 -5.435 1.00 71.35 C ATOM 82 SG CYS A 8 2.782 5.663 -4.751 1.00 42.34 S ATOM 83 H CYS A 8 1.817 8.964 -5.983 1.00 54.34 H ATOM 84 HA CYS A 8 2.405 6.576 -7.290 1.00 53.34 H ATOM 85 HB2 CYS A 8 1.121 7.371 -4.784 1.00 13.44 H ATOM 86 HB3 CYS A 8 0.503 5.853 -5.425 1.00 61.34 H ATOM 87 N MET A 9 -0.553 7.713 -7.896 1.00 72.22 N ATOM 88 CA MET A 9 -1.761 7.527 -8.692 1.00 32.53 C ATOM 89 C MET A 9 -1.456 7.653 -10.181 1.00 14.21 C ATOM 90 O MET A 9 -2.200 7.148 -11.022 1.00 74.34 O ATOM 91 CB MET A 9 -2.826 8.549 -8.288 1.00 62.44 C ATOM 92 CG MET A 9 -3.628 8.139 -7.064 1.00 11.31 C ATOM 93 SD MET A 9 -4.123 9.549 -6.055 1.00 12.22 S ATOM 94 CE MET A 9 -5.709 8.986 -5.441 1.00 51.34 C ATOM 95 H MET A 9 -0.380 8.587 -7.488 1.00 50.15 H ATOM 96 HA MET A 9 -2.136 6.533 -8.496 1.00 54.21 H ATOM 97 HB2 MET A 9 -2.342 9.490 -8.077 1.00 1.32 H ATOM 98 HB3 MET A 9 -3.511 8.682 -9.112 1.00 61.23 H ATOM 99 HG2 MET A 9 -4.516 7.619 -7.389 1.00 75.40 H ATOM 100 HG3 MET A 9 -3.025 7.476 -6.461 1.00 52.22 H ATOM 101 HE1 MET A 9 -5.588 8.585 -4.446 1.00 4.24 H ATOM 102 HE2 MET A 9 -6.400 9.816 -5.413 1.00 44.25 H ATOM 103 HE3 MET A 9 -6.095 8.218 -6.095 1.00 13.21 H ATOM 104 N LEU A 10 -0.359 8.331 -10.500 1.00 71.40 N ATOM 105 CA LEU A 10 0.044 8.524 -11.889 1.00 30.23 C ATOM 106 C LEU A 10 1.175 7.573 -12.265 1.00 24.53 C ATOM 107 O LEU A 10 1.455 7.358 -13.444 1.00 74.44 O ATOM 108 CB LEU A 10 0.483 9.971 -12.116 1.00 53.52 C ATOM 109 CG LEU A 10 -0.566 11.045 -11.821 1.00 63.21 C ATOM 110 CD1 LEU A 10 0.081 12.259 -11.174 1.00 44.41 C ATOM 111 CD2 LEU A 10 -1.295 11.443 -13.096 1.00 72.50 C ATOM 112 H LEU A 10 0.194 8.710 -9.786 1.00 13.01 H ATOM 113 HA LEU A 10 -0.811 8.313 -12.514 1.00 64.41 H ATOM 114 HB2 LEU A 10 1.337 10.161 -11.484 1.00 53.34 H ATOM 115 HB3 LEU A 10 0.775 10.069 -13.152 1.00 72.33 H ATOM 116 HG LEU A 10 -1.294 10.647 -11.128 1.00 72.32 H ATOM 117 HD11 LEU A 10 0.798 12.691 -11.856 1.00 4.22 H ATOM 118 HD12 LEU A 10 0.583 11.959 -10.266 1.00 44.03 H ATOM 119 HD13 LEU A 10 -0.679 12.990 -10.940 1.00 1.14 H ATOM 120 HD21 LEU A 10 -2.047 12.183 -12.865 1.00 25.32 H ATOM 121 HD22 LEU A 10 -1.767 10.572 -13.526 1.00 74.25 H ATOM 122 HD23 LEU A 10 -0.588 11.854 -13.802 1.00 11.33 H ATOM 123 N LYS A 11 1.823 7.003 -11.254 1.00 21.01 N ATOM 124 CA LYS A 11 2.922 6.071 -11.477 1.00 2.23 C ATOM 125 C LYS A 11 2.494 4.641 -11.166 1.00 21.50 C ATOM 126 O LYS A 11 3.203 3.687 -11.487 1.00 14.42 O ATOM 127 CB LYS A 11 4.126 6.454 -10.612 1.00 74.13 C ATOM 128 CG LYS A 11 5.330 6.914 -11.416 1.00 13.34 C ATOM 129 CD LYS A 11 6.624 6.714 -10.645 1.00 71.31 C ATOM 130 CE LYS A 11 7.082 8.002 -9.979 1.00 52.34 C ATOM 131 NZ LYS A 11 6.823 7.991 -8.513 1.00 1.41 N ATOM 132 H LYS A 11 1.554 7.214 -10.335 1.00 3.03 H ATOM 133 HA LYS A 11 3.203 6.132 -12.517 1.00 41.22 H ATOM 134 HB2 LYS A 11 3.836 7.254 -9.947 1.00 32.43 H ATOM 135 HB3 LYS A 11 4.418 5.596 -10.024 1.00 45.01 H ATOM 136 HG2 LYS A 11 5.378 6.346 -12.333 1.00 12.52 H ATOM 137 HG3 LYS A 11 5.217 7.964 -11.646 1.00 3.45 H ATOM 138 HD2 LYS A 11 6.467 5.965 -9.883 1.00 60.43 H ATOM 139 HD3 LYS A 11 7.391 6.379 -11.329 1.00 5.23 H ATOM 140 HE2 LYS A 11 8.141 8.123 -10.148 1.00 72.15 H ATOM 141 HE3 LYS A 11 6.550 8.830 -10.424 1.00 52.42 H ATOM 142 HZ1 LYS A 11 6.306 7.129 -8.247 1.00 51.35 H ATOM 143 HZ2 LYS A 11 6.255 8.820 -8.245 1.00 0.45 H ATOM 144 HZ3 LYS A 11 7.722 8.018 -7.991 1.00 42.23 H ATOM 145 N ASN A 12 1.330 4.499 -10.541 1.00 31.52 N ATOM 146 CA ASN A 12 0.807 3.184 -10.188 1.00 22.51 C ATOM 147 C ASN A 12 -0.718 3.190 -10.176 1.00 74.31 C ATOM 148 O ASN A 12 -1.356 3.068 -9.130 1.00 74.33 O ATOM 149 CB ASN A 12 1.337 2.752 -8.819 1.00 62.31 C ATOM 150 CG ASN A 12 2.834 2.510 -8.829 1.00 22.23 C ATOM 151 OD1 ASN A 12 3.290 1.377 -8.988 1.00 2.31 O ATOM 152 ND2 ASN A 12 3.607 3.576 -8.658 1.00 11.23 N ATOM 153 H ASN A 12 0.810 5.297 -10.311 1.00 72.30 H ATOM 154 HA ASN A 12 1.147 2.481 -10.934 1.00 22.24 H ATOM 155 HB2 ASN A 12 1.122 3.525 -8.096 1.00 51.22 H ATOM 156 HB3 ASN A 12 0.845 1.838 -8.520 1.00 50.54 H ATOM 157 HD21 ASN A 12 4.578 3.448 -8.660 1.00 45.53 H ATOM 158 HD22 ASN A 12 3.174 4.447 -8.536 1.00 40.25 H ATOM 159 N PRO A 13 -1.319 3.335 -11.367 1.00 24.51 N ATOM 160 CA PRO A 13 -2.776 3.359 -11.521 1.00 32.22 C ATOM 161 C PRO A 13 -3.410 1.997 -11.257 1.00 42.21 C ATOM 162 O PRO A 13 -4.620 1.893 -11.060 1.00 24.11 O ATOM 163 CB PRO A 13 -2.972 3.765 -12.984 1.00 3.34 C ATOM 164 CG PRO A 13 -1.721 3.332 -13.668 1.00 33.54 C ATOM 165 CD PRO A 13 -0.621 3.485 -12.655 1.00 4.13 C ATOM 166 HA PRO A 13 -3.231 4.097 -10.876 1.00 41.05 H ATOM 167 HB2 PRO A 13 -3.839 3.262 -13.387 1.00 21.50 H ATOM 168 HB3 PRO A 13 -3.107 4.834 -13.049 1.00 4.40 H ATOM 169 HG2 PRO A 13 -1.809 2.300 -13.973 1.00 43.10 H ATOM 170 HG3 PRO A 13 -1.533 3.963 -14.523 1.00 54.22 H ATOM 171 HD2 PRO A 13 0.122 2.711 -12.784 1.00 13.42 H ATOM 172 HD3 PRO A 13 -0.168 4.462 -12.735 1.00 4.31 H ATOM 173 N ASN A 14 -2.584 0.956 -11.255 1.00 21.23 N ATOM 174 CA ASN A 14 -3.064 -0.400 -11.015 1.00 74.21 C ATOM 175 C ASN A 14 -3.284 -0.644 -9.525 1.00 55.12 C ATOM 176 O ASN A 14 -3.804 -1.687 -9.125 1.00 42.15 O ATOM 177 CB ASN A 14 -2.069 -1.422 -11.569 1.00 1.42 C ATOM 178 CG ASN A 14 -1.664 -1.118 -12.998 1.00 43.22 C ATOM 179 OD1 ASN A 14 -2.462 -0.612 -13.787 1.00 70.34 O ATOM 180 ND2 ASN A 14 -0.417 -1.426 -13.338 1.00 15.00 N ATOM 181 H ASN A 14 -1.629 1.102 -11.418 1.00 41.33 H ATOM 182 HA ASN A 14 -4.007 -0.514 -11.530 1.00 4.43 H ATOM 183 HB2 ASN A 14 -1.180 -1.418 -10.955 1.00 21.12 H ATOM 184 HB3 ASN A 14 -2.517 -2.404 -11.541 1.00 45.45 H ATOM 185 HD21 ASN A 14 -0.129 -1.240 -14.256 1.00 2.43 H ATOM 186 HD22 ASN A 14 0.163 -1.826 -12.657 1.00 72.51 H ATOM 187 N LEU A 15 -2.887 0.325 -8.708 1.00 22.21 N ATOM 188 CA LEU A 15 -3.041 0.217 -7.261 1.00 62.32 C ATOM 189 C LEU A 15 -3.917 1.343 -6.721 1.00 64.23 C ATOM 190 O LEU A 15 -4.893 1.099 -6.012 1.00 31.32 O ATOM 191 CB LEU A 15 -1.672 0.248 -6.579 1.00 71.00 C ATOM 192 CG LEU A 15 -1.218 -1.057 -5.925 1.00 33.44 C ATOM 193 CD1 LEU A 15 0.127 -0.872 -5.241 1.00 23.04 C ATOM 194 CD2 LEU A 15 -2.261 -1.546 -4.930 1.00 74.12 C ATOM 195 H LEU A 15 -2.480 1.132 -9.085 1.00 1.20 H ATOM 196 HA LEU A 15 -3.519 -0.728 -7.049 1.00 25.13 H ATOM 197 HB2 LEU A 15 -0.938 0.517 -7.323 1.00 11.21 H ATOM 198 HB3 LEU A 15 -1.702 1.010 -5.813 1.00 55.23 H ATOM 199 HG LEU A 15 -1.102 -1.814 -6.688 1.00 74.32 H ATOM 200 HD11 LEU A 15 0.791 -1.673 -5.529 1.00 32.13 H ATOM 201 HD12 LEU A 15 -0.009 -0.885 -4.169 1.00 42.23 H ATOM 202 HD13 LEU A 15 0.554 0.075 -5.538 1.00 24.35 H ATOM 203 HD21 LEU A 15 -2.792 -0.700 -4.521 1.00 14.15 H ATOM 204 HD22 LEU A 15 -1.772 -2.086 -4.132 1.00 54.54 H ATOM 205 HD23 LEU A 15 -2.959 -2.201 -5.433 1.00 4.03 H ATOM 206 N CYS A 16 -3.562 2.577 -7.063 1.00 73.14 N ATOM 207 CA CYS A 16 -4.316 3.742 -6.615 1.00 70.52 C ATOM 208 C CYS A 16 -4.278 4.850 -7.663 1.00 2.41 C ATOM 209 O CYS A 16 -5.319 5.354 -8.085 1.00 45.33 O ATOM 210 CB CYS A 16 -3.755 4.258 -5.289 1.00 14.42 C ATOM 211 SG CYS A 16 -4.813 5.492 -4.465 1.00 21.21 S ATOM 212 H CYS A 16 -2.773 2.708 -7.632 1.00 15.14 H ATOM 213 HA CYS A 16 -5.341 3.437 -6.468 1.00 51.25 H ATOM 214 HB2 CYS A 16 -3.632 3.427 -4.610 1.00 74.34 H ATOM 215 HB3 CYS A 16 -2.794 4.716 -5.467 1.00 65.12 H TER 216 CYS A 16 ENDMDL MODEL 7 ATOM 1 N GLY A 1 2.363 0.131 0.228 1.00 24.14 N ATOM 2 CA GLY A 1 1.878 0.128 -1.139 1.00 43.54 C ATOM 3 C GLY A 1 1.927 1.504 -1.774 1.00 41.03 C ATOM 4 O GLY A 1 2.657 2.383 -1.315 1.00 24.40 O ATOM 5 H1 GLY A 1 2.956 0.849 0.535 1.00 62.03 H ATOM 6 HA2 GLY A 1 2.484 -0.548 -1.723 1.00 62.05 H ATOM 7 HA3 GLY A 1 0.857 -0.222 -1.146 1.00 73.21 H ATOM 8 N CYS A 2 1.149 1.692 -2.835 1.00 11.32 N ATOM 9 CA CYS A 2 1.107 2.970 -3.536 1.00 61.31 C ATOM 10 C CYS A 2 -0.308 3.540 -3.545 1.00 35.44 C ATOM 11 O CYS A 2 -1.183 3.049 -4.260 1.00 1.23 O ATOM 12 CB CYS A 2 1.611 2.804 -4.971 1.00 54.14 C ATOM 13 SG CYS A 2 3.023 3.875 -5.392 1.00 71.01 S ATOM 14 H CYS A 2 0.588 0.953 -3.154 1.00 45.44 H ATOM 15 HA CYS A 2 1.755 3.657 -3.014 1.00 22.34 H ATOM 16 HB2 CYS A 2 1.920 1.780 -5.120 1.00 23.20 H ATOM 17 HB3 CYS A 2 0.807 3.035 -5.655 1.00 63.44 H ATOM 18 N CYS A 3 -0.527 4.578 -2.745 1.00 41.21 N ATOM 19 CA CYS A 3 -1.835 5.216 -2.659 1.00 71.11 C ATOM 20 C CYS A 3 -1.787 6.434 -1.741 1.00 33.32 C ATOM 21 O CYS A 3 -2.530 7.397 -1.931 1.00 33.35 O ATOM 22 CB CYS A 3 -2.879 4.220 -2.150 1.00 23.14 C ATOM 23 SG CYS A 3 -4.600 4.784 -2.340 1.00 53.03 S ATOM 24 H CYS A 3 0.210 4.925 -2.199 1.00 23.34 H ATOM 25 HA CYS A 3 -2.113 5.539 -3.651 1.00 23.02 H ATOM 26 HB2 CYS A 3 -2.776 3.292 -2.694 1.00 4.31 H ATOM 27 HB3 CYS A 3 -2.707 4.036 -1.099 1.00 61.24 H ATOM 28 N SER A 4 -0.908 6.383 -0.745 1.00 41.25 N ATOM 29 CA SER A 4 -0.765 7.480 0.205 1.00 40.13 C ATOM 30 C SER A 4 0.013 8.637 -0.415 1.00 13.54 C ATOM 31 O SER A 4 0.135 9.707 0.182 1.00 61.45 O ATOM 32 CB SER A 4 -0.058 6.996 1.472 1.00 10.12 C ATOM 33 OG SER A 4 -0.725 7.455 2.635 1.00 0.41 O ATOM 34 H SER A 4 -0.343 5.588 -0.647 1.00 35.14 H ATOM 35 HA SER A 4 -1.755 7.825 0.464 1.00 22.12 H ATOM 36 HB2 SER A 4 -0.043 5.917 1.483 1.00 21.01 H ATOM 37 HB3 SER A 4 0.955 7.371 1.481 1.00 64.40 H ATOM 38 HG SER A 4 -0.473 8.365 2.811 1.00 71.03 H ATOM 39 N ASN A 5 0.536 8.415 -1.616 1.00 25.44 N ATOM 40 CA ASN A 5 1.303 9.438 -2.317 1.00 23.11 C ATOM 41 C ASN A 5 0.490 10.041 -3.458 1.00 35.01 C ATOM 42 O ASN A 5 -0.311 9.367 -4.107 1.00 22.14 O ATOM 43 CB ASN A 5 2.605 8.846 -2.861 1.00 71.02 C ATOM 44 CG ASN A 5 3.811 9.241 -2.031 1.00 61.40 C ATOM 45 OD1 ASN A 5 3.844 10.319 -1.438 1.00 24.33 O ATOM 46 ND2 ASN A 5 4.810 8.366 -1.986 1.00 13.41 N ATOM 47 H ASN A 5 0.405 7.541 -2.040 1.00 53.34 H ATOM 48 HA ASN A 5 1.541 10.217 -1.609 1.00 1.23 H ATOM 49 HB2 ASN A 5 2.530 7.768 -2.862 1.00 42.24 H ATOM 50 HB3 ASN A 5 2.757 9.193 -3.872 1.00 12.40 H ATOM 51 HD21 ASN A 5 5.601 8.596 -1.456 1.00 65.30 H ATOM 52 HD22 ASN A 5 4.714 7.527 -2.484 1.00 11.43 H ATOM 53 N PRO A 6 0.698 11.342 -3.710 1.00 61.33 N ATOM 54 CA PRO A 6 -0.005 12.064 -4.774 1.00 55.41 C ATOM 55 C PRO A 6 0.437 11.623 -6.165 1.00 75.01 C ATOM 56 O PRO A 6 -0.341 11.670 -7.118 1.00 11.13 O ATOM 57 CB PRO A 6 0.383 13.524 -4.528 1.00 11.42 C ATOM 58 CG PRO A 6 1.690 13.454 -3.816 1.00 35.13 C ATOM 59 CD PRO A 6 1.637 12.207 -2.977 1.00 23.10 C ATOM 60 HA PRO A 6 -1.077 11.955 -4.686 1.00 44.34 H ATOM 61 HB2 PRO A 6 0.475 14.040 -5.474 1.00 33.52 H ATOM 62 HB3 PRO A 6 -0.371 14.004 -3.922 1.00 52.01 H ATOM 63 HG2 PRO A 6 2.495 13.391 -4.531 1.00 71.04 H ATOM 64 HG3 PRO A 6 1.812 14.323 -3.187 1.00 13.33 H ATOM 65 HD2 PRO A 6 2.615 11.751 -2.917 1.00 14.43 H ATOM 66 HD3 PRO A 6 1.262 12.432 -1.989 1.00 62.14 H ATOM 67 N ALA A 7 1.690 11.194 -6.274 1.00 75.34 N ATOM 68 CA ALA A 7 2.234 10.741 -7.549 1.00 14.43 C ATOM 69 C ALA A 7 1.997 9.248 -7.748 1.00 11.22 C ATOM 70 O ALA A 7 1.982 8.756 -8.877 1.00 4.44 O ATOM 71 CB ALA A 7 3.720 11.058 -7.630 1.00 73.41 C ATOM 72 H ALA A 7 2.261 11.180 -5.479 1.00 30.43 H ATOM 73 HA ALA A 7 1.732 11.283 -8.337 1.00 54.53 H ATOM 74 HB1 ALA A 7 3.984 11.279 -8.654 1.00 62.41 H ATOM 75 HB2 ALA A 7 3.940 11.912 -7.008 1.00 42.44 H ATOM 76 HB3 ALA A 7 4.288 10.206 -7.287 1.00 51.10 H ATOM 77 N CYS A 8 1.812 8.531 -6.645 1.00 24.15 N ATOM 78 CA CYS A 8 1.577 7.093 -6.697 1.00 5.00 C ATOM 79 C CYS A 8 0.360 6.772 -7.560 1.00 24.14 C ATOM 80 O CYS A 8 0.223 5.659 -8.067 1.00 12.20 O ATOM 81 CB CYS A 8 1.378 6.536 -5.286 1.00 73.01 C ATOM 82 SG CYS A 8 2.829 5.658 -4.621 1.00 12.41 S ATOM 83 H CYS A 8 1.835 8.980 -5.773 1.00 21.34 H ATOM 84 HA CYS A 8 2.448 6.630 -7.137 1.00 55.44 H ATOM 85 HB2 CYS A 8 1.151 7.351 -4.614 1.00 44.23 H ATOM 86 HB3 CYS A 8 0.549 5.843 -5.295 1.00 3.21 H ATOM 87 N MET A 9 -0.520 7.755 -7.721 1.00 25.31 N ATOM 88 CA MET A 9 -1.724 7.577 -8.523 1.00 53.23 C ATOM 89 C MET A 9 -1.418 7.744 -10.008 1.00 61.43 C ATOM 90 O MET A 9 -2.156 7.253 -10.864 1.00 22.44 O ATOM 91 CB MET A 9 -2.799 8.579 -8.097 1.00 1.21 C ATOM 92 CG MET A 9 -4.197 8.207 -8.564 1.00 23.53 C ATOM 93 SD MET A 9 -5.439 8.416 -7.274 1.00 2.24 S ATOM 94 CE MET A 9 -6.925 8.584 -8.259 1.00 33.43 C ATOM 95 H MET A 9 -0.355 8.620 -7.291 1.00 51.23 H ATOM 96 HA MET A 9 -2.091 6.576 -8.353 1.00 43.02 H ATOM 97 HB2 MET A 9 -2.808 8.643 -7.019 1.00 63.11 H ATOM 98 HB3 MET A 9 -2.553 9.548 -8.505 1.00 14.30 H ATOM 99 HG2 MET A 9 -4.461 8.833 -9.403 1.00 12.05 H ATOM 100 HG3 MET A 9 -4.193 7.173 -8.877 1.00 23.15 H ATOM 101 HE1 MET A 9 -6.878 7.906 -9.099 1.00 31.22 H ATOM 102 HE2 MET A 9 -7.787 8.347 -7.653 1.00 74.40 H ATOM 103 HE3 MET A 9 -7.006 9.599 -8.618 1.00 61.44 H ATOM 104 N LEU A 10 -0.326 8.439 -10.308 1.00 72.42 N ATOM 105 CA LEU A 10 0.078 8.670 -11.691 1.00 33.12 C ATOM 106 C LEU A 10 1.219 7.739 -12.088 1.00 35.41 C ATOM 107 O LEU A 10 1.502 7.556 -13.272 1.00 72.40 O ATOM 108 CB LEU A 10 0.503 10.127 -11.881 1.00 65.34 C ATOM 109 CG LEU A 10 -0.549 11.183 -11.544 1.00 10.31 C ATOM 110 CD1 LEU A 10 0.117 12.485 -11.124 1.00 74.23 C ATOM 111 CD2 LEU A 10 -1.474 11.413 -12.730 1.00 45.35 C ATOM 112 H LEU A 10 0.222 8.805 -9.584 1.00 11.13 H ATOM 113 HA LEU A 10 -0.774 8.467 -12.323 1.00 62.50 H ATOM 114 HB2 LEU A 10 1.363 10.305 -11.254 1.00 63.40 H ATOM 115 HB3 LEU A 10 0.783 10.256 -12.917 1.00 60.25 H ATOM 116 HG LEU A 10 -1.148 10.833 -10.715 1.00 14.23 H ATOM 117 HD11 LEU A 10 0.760 12.303 -10.277 1.00 65.03 H ATOM 118 HD12 LEU A 10 -0.641 13.205 -10.853 1.00 2.11 H ATOM 119 HD13 LEU A 10 0.702 12.871 -11.946 1.00 72.11 H ATOM 120 HD21 LEU A 10 -2.155 10.581 -12.823 1.00 22.34 H ATOM 121 HD22 LEU A 10 -0.886 11.500 -13.632 1.00 61.25 H ATOM 122 HD23 LEU A 10 -2.035 12.324 -12.578 1.00 60.21 H ATOM 123 N LYS A 11 1.869 7.150 -11.090 1.00 44.12 N ATOM 124 CA LYS A 11 2.978 6.234 -11.334 1.00 15.22 C ATOM 125 C LYS A 11 2.562 4.792 -11.059 1.00 41.44 C ATOM 126 O LYS A 11 3.280 3.854 -11.402 1.00 51.02 O ATOM 127 CB LYS A 11 4.176 6.606 -10.458 1.00 12.43 C ATOM 128 CG LYS A 11 5.377 7.097 -11.247 1.00 1.30 C ATOM 129 CD LYS A 11 6.672 6.889 -10.479 1.00 53.11 C ATOM 130 CE LYS A 11 6.739 7.779 -9.248 1.00 15.34 C ATOM 131 NZ LYS A 11 7.987 8.591 -9.217 1.00 55.21 N ATOM 132 H LYS A 11 1.597 7.336 -10.167 1.00 21.24 H ATOM 133 HA LYS A 11 3.260 6.324 -12.372 1.00 33.51 H ATOM 134 HB2 LYS A 11 3.878 7.387 -9.773 1.00 75.23 H ATOM 135 HB3 LYS A 11 4.475 5.737 -9.890 1.00 63.02 H ATOM 136 HG2 LYS A 11 5.432 6.553 -12.178 1.00 20.31 H ATOM 137 HG3 LYS A 11 5.256 8.152 -11.451 1.00 73.31 H ATOM 138 HD2 LYS A 11 6.733 5.857 -10.167 1.00 3.21 H ATOM 139 HD3 LYS A 11 7.505 7.122 -11.126 1.00 65.35 H ATOM 140 HE2 LYS A 11 5.888 8.443 -9.253 1.00 14.04 H ATOM 141 HE3 LYS A 11 6.703 7.156 -8.367 1.00 22.44 H ATOM 142 HZ1 LYS A 11 8.302 8.798 -10.186 1.00 24.10 H ATOM 143 HZ2 LYS A 11 8.739 8.071 -8.722 1.00 31.21 H ATOM 144 HZ3 LYS A 11 7.817 9.489 -8.720 1.00 71.31 H ATOM 145 N ASN A 12 1.398 4.624 -10.440 1.00 50.45 N ATOM 146 CA ASN A 12 0.887 3.296 -10.121 1.00 52.32 C ATOM 147 C ASN A 12 -0.639 3.288 -10.112 1.00 42.24 C ATOM 148 O ASN A 12 -1.278 3.135 -9.071 1.00 64.52 O ATOM 149 CB ASN A 12 1.418 2.836 -8.762 1.00 62.44 C ATOM 150 CG ASN A 12 2.917 2.608 -8.775 1.00 65.40 C ATOM 151 OD1 ASN A 12 3.384 1.484 -8.961 1.00 61.32 O ATOM 152 ND2 ASN A 12 3.680 3.677 -8.576 1.00 71.51 N ATOM 153 H ASN A 12 0.870 5.412 -10.192 1.00 61.21 H ATOM 154 HA ASN A 12 1.235 2.615 -10.883 1.00 55.44 H ATOM 155 HB2 ASN A 12 1.195 3.589 -8.021 1.00 74.10 H ATOM 156 HB3 ASN A 12 0.934 1.911 -8.487 1.00 71.35 H ATOM 157 HD21 ASN A 12 4.653 3.558 -8.580 1.00 33.21 H ATOM 158 HD22 ASN A 12 3.239 4.540 -8.434 1.00 51.33 H ATOM 159 N PRO A 13 -1.238 3.457 -11.300 1.00 72.04 N ATOM 160 CA PRO A 13 -2.696 3.472 -11.457 1.00 23.23 C ATOM 161 C PRO A 13 -3.317 2.098 -11.228 1.00 52.30 C ATOM 162 O PRO A 13 -4.526 1.978 -11.036 1.00 54.13 O ATOM 163 CB PRO A 13 -2.892 3.913 -12.909 1.00 72.53 C ATOM 164 CG PRO A 13 -1.637 3.507 -13.601 1.00 43.33 C ATOM 165 CD PRO A 13 -0.539 3.646 -12.583 1.00 33.23 C ATOM 166 HA PRO A 13 -3.158 4.190 -10.795 1.00 73.42 H ATOM 167 HB2 PRO A 13 -3.754 3.411 -13.327 1.00 10.02 H ATOM 168 HB3 PRO A 13 -3.037 4.982 -12.949 1.00 21.35 H ATOM 169 HG2 PRO A 13 -1.714 2.483 -13.932 1.00 70.04 H ATOM 170 HG3 PRO A 13 -1.453 4.162 -14.441 1.00 31.43 H ATOM 171 HD2 PRO A 13 0.210 2.882 -12.729 1.00 43.34 H ATOM 172 HD3 PRO A 13 -0.095 4.629 -12.638 1.00 31.22 H ATOM 173 N ASN A 14 -2.482 1.065 -11.249 1.00 62.23 N ATOM 174 CA ASN A 14 -2.950 -0.301 -11.044 1.00 72.02 C ATOM 175 C ASN A 14 -3.171 -0.583 -9.561 1.00 73.42 C ATOM 176 O ASN A 14 -3.682 -1.640 -9.189 1.00 33.44 O ATOM 177 CB ASN A 14 -1.944 -1.299 -11.620 1.00 70.34 C ATOM 178 CG ASN A 14 -2.276 -1.698 -13.045 1.00 52.45 C ATOM 179 OD1 ASN A 14 -1.941 -0.988 -13.994 1.00 61.22 O ATOM 180 ND2 ASN A 14 -2.939 -2.838 -13.202 1.00 1.41 N ATOM 181 H ASN A 14 -1.528 1.224 -11.407 1.00 3.11 H ATOM 182 HA ASN A 14 -3.890 -0.410 -11.564 1.00 32.43 H ATOM 183 HB2 ASN A 14 -0.960 -0.854 -11.612 1.00 24.42 H ATOM 184 HB3 ASN A 14 -1.938 -2.189 -11.009 1.00 61.21 H ATOM 185 HD21 ASN A 14 -3.166 -3.119 -14.113 1.00 21.44 H ATOM 186 HD22 ASN A 14 -3.173 -3.351 -12.400 1.00 53.04 H ATOM 187 N LEU A 15 -2.784 0.368 -8.719 1.00 43.34 N ATOM 188 CA LEU A 15 -2.940 0.223 -7.276 1.00 41.32 C ATOM 189 C LEU A 15 -3.827 1.328 -6.711 1.00 33.42 C ATOM 190 O LEU A 15 -4.803 1.057 -6.010 1.00 0.10 O ATOM 191 CB LEU A 15 -1.573 0.250 -6.590 1.00 41.32 C ATOM 192 CG LEU A 15 -1.109 -1.066 -5.967 1.00 23.42 C ATOM 193 CD1 LEU A 15 0.234 -0.886 -5.275 1.00 54.50 C ATOM 194 CD2 LEU A 15 -2.149 -1.589 -4.987 1.00 54.12 C ATOM 195 H LEU A 15 -2.383 1.188 -9.076 1.00 12.35 H ATOM 196 HA LEU A 15 -3.409 -0.731 -7.088 1.00 53.21 H ATOM 197 HB2 LEU A 15 -0.840 0.544 -7.325 1.00 41.45 H ATOM 198 HB3 LEU A 15 -1.612 0.993 -5.806 1.00 40.32 H ATOM 199 HG LEU A 15 -0.984 -1.803 -6.748 1.00 70.34 H ATOM 200 HD11 LEU A 15 0.905 -1.673 -5.581 1.00 21.21 H ATOM 201 HD12 LEU A 15 0.095 -0.926 -4.205 1.00 1.33 H ATOM 202 HD13 LEU A 15 0.653 0.072 -5.548 1.00 13.13 H ATOM 203 HD21 LEU A 15 -2.841 -2.235 -5.507 1.00 41.13 H ATOM 204 HD22 LEU A 15 -2.687 -0.757 -4.557 1.00 33.23 H ATOM 205 HD23 LEU A 15 -1.658 -2.145 -4.202 1.00 5.51 H ATOM 206 N CYS A 16 -3.484 2.573 -7.022 1.00 25.05 N ATOM 207 CA CYS A 16 -4.249 3.719 -6.547 1.00 10.24 C ATOM 208 C CYS A 16 -4.220 4.854 -7.567 1.00 64.50 C ATOM 209 O CYS A 16 -4.722 4.712 -8.682 1.00 34.52 O ATOM 210 CB CYS A 16 -3.695 4.209 -5.207 1.00 55.11 C ATOM 211 SG CYS A 16 -4.767 5.411 -4.355 1.00 4.12 S ATOM 212 H CYS A 16 -2.695 2.725 -7.584 1.00 42.44 H ATOM 213 HA CYS A 16 -5.271 3.402 -6.409 1.00 74.32 H ATOM 214 HB2 CYS A 16 -3.565 3.362 -4.549 1.00 41.20 H ATOM 215 HB3 CYS A 16 -2.738 4.680 -5.373 1.00 11.44 H TER 216 CYS A 16 ENDMDL MODEL 8 ATOM 1 N GLY A 1 1.699 0.058 0.000 1.00 21.14 N ATOM 2 CA GLY A 1 2.020 -0.066 -1.409 1.00 71.45 C ATOM 3 C GLY A 1 2.124 1.278 -2.101 1.00 54.42 C ATOM 4 O GLY A 1 3.177 1.916 -2.081 1.00 31.10 O ATOM 5 H1 GLY A 1 2.407 0.267 0.645 1.00 20.24 H ATOM 6 HA2 GLY A 1 2.962 -0.584 -1.509 1.00 20.42 H ATOM 7 HA3 GLY A 1 1.248 -0.648 -1.892 1.00 42.25 H ATOM 8 N CYS A 2 1.029 1.711 -2.717 1.00 54.22 N ATOM 9 CA CYS A 2 1.000 2.988 -3.421 1.00 23.23 C ATOM 10 C CYS A 2 -0.411 3.568 -3.439 1.00 31.34 C ATOM 11 O CYS A 2 -1.284 3.083 -4.159 1.00 34.01 O ATOM 12 CB CYS A 2 1.511 2.816 -4.853 1.00 3.35 C ATOM 13 SG CYS A 2 2.932 3.879 -5.267 1.00 71.52 S ATOM 14 H CYS A 2 0.219 1.158 -2.698 1.00 72.05 H ATOM 15 HA CYS A 2 1.650 3.671 -2.895 1.00 61.22 H ATOM 16 HB2 CYS A 2 1.816 1.790 -4.997 1.00 63.01 H ATOM 17 HB3 CYS A 2 0.713 3.050 -5.542 1.00 23.52 H ATOM 18 N CYS A 3 -0.627 4.609 -2.641 1.00 72.44 N ATOM 19 CA CYS A 3 -1.931 5.256 -2.564 1.00 73.34 C ATOM 20 C CYS A 3 -1.881 6.474 -1.647 1.00 24.02 C ATOM 21 O CYS A 3 -2.615 7.442 -1.842 1.00 53.11 O ATOM 22 CB CYS A 3 -2.985 4.268 -2.061 1.00 33.33 C ATOM 23 SG CYS A 3 -4.701 4.844 -2.262 1.00 55.42 S ATOM 24 H CYS A 3 0.109 4.950 -2.090 1.00 50.35 H ATOM 25 HA CYS A 3 -2.200 5.580 -3.558 1.00 72.01 H ATOM 26 HB2 CYS A 3 -2.886 3.339 -2.604 1.00 3.10 H ATOM 27 HB3 CYS A 3 -2.821 4.083 -1.009 1.00 72.14 H ATOM 28 N SER A 4 -1.008 6.418 -0.646 1.00 31.04 N ATOM 29 CA SER A 4 -0.863 7.515 0.305 1.00 75.45 C ATOM 30 C SER A 4 -0.073 8.666 -0.311 1.00 33.34 C ATOM 31 O SER A 4 0.054 9.734 0.286 1.00 55.22 O ATOM 32 CB SER A 4 -0.168 7.027 1.577 1.00 34.50 C ATOM 33 OG SER A 4 -0.840 7.491 2.735 1.00 1.12 O ATOM 34 H SER A 4 -0.450 5.619 -0.542 1.00 72.44 H ATOM 35 HA SER A 4 -1.852 7.867 0.557 1.00 34.23 H ATOM 36 HB2 SER A 4 -0.161 5.947 1.589 1.00 42.33 H ATOM 37 HB3 SER A 4 0.848 7.394 1.592 1.00 14.04 H ATOM 38 HG SER A 4 -1.744 7.167 2.733 1.00 4.12 H ATOM 39 N ASN A 5 0.456 8.438 -1.508 1.00 41.22 N ATOM 40 CA ASN A 5 1.235 9.455 -2.205 1.00 51.33 C ATOM 41 C ASN A 5 0.433 10.064 -3.352 1.00 33.24 C ATOM 42 O ASN A 5 -0.369 9.395 -4.005 1.00 2.43 O ATOM 43 CB ASN A 5 2.535 8.853 -2.741 1.00 44.33 C ATOM 44 CG ASN A 5 3.739 9.239 -1.904 1.00 3.13 C ATOM 45 OD1 ASN A 5 3.853 10.377 -1.448 1.00 25.00 O ATOM 46 ND2 ASN A 5 4.645 8.290 -1.698 1.00 10.04 N ATOM 47 H ASN A 5 0.320 7.566 -1.933 1.00 64.34 H ATOM 48 HA ASN A 5 1.474 10.233 -1.496 1.00 42.21 H ATOM 49 HB2 ASN A 5 2.452 7.776 -2.743 1.00 5.14 H ATOM 50 HB3 ASN A 5 2.696 9.199 -3.751 1.00 42.22 H ATOM 51 HD21 ASN A 5 5.433 8.512 -1.159 1.00 30.00 H ATOM 52 HD22 ASN A 5 4.488 7.406 -2.092 1.00 1.43 H ATOM 53 N PRO A 6 0.653 11.363 -3.604 1.00 32.34 N ATOM 54 CA PRO A 6 -0.039 12.090 -4.672 1.00 43.11 C ATOM 55 C PRO A 6 0.408 11.644 -6.060 1.00 43.31 C ATOM 56 O PRO A 6 -0.364 11.695 -7.017 1.00 44.52 O ATOM 57 CB PRO A 6 0.359 13.547 -4.424 1.00 43.24 C ATOM 58 CG PRO A 6 1.661 13.467 -3.704 1.00 40.24 C ATOM 59 CD PRO A 6 1.594 12.221 -2.865 1.00 41.32 C ATOM 60 HA PRO A 6 -1.111 11.989 -4.591 1.00 12.31 H ATOM 61 HB2 PRO A 6 0.461 14.061 -5.370 1.00 72.01 H ATOM 62 HB3 PRO A 6 -0.395 14.033 -3.824 1.00 3.13 H ATOM 63 HG2 PRO A 6 2.470 13.398 -4.415 1.00 62.42 H ATOM 64 HG3 PRO A 6 1.786 14.336 -3.075 1.00 50.12 H ATOM 65 HD2 PRO A 6 2.567 11.758 -2.799 1.00 5.33 H ATOM 66 HD3 PRO A 6 1.215 12.450 -1.880 1.00 72.20 H ATOM 67 N ALA A 7 1.659 11.207 -6.162 1.00 20.22 N ATOM 68 CA ALA A 7 2.207 10.750 -7.433 1.00 25.44 C ATOM 69 C ALA A 7 1.961 9.258 -7.632 1.00 54.13 C ATOM 70 O ALA A 7 1.949 8.766 -8.761 1.00 22.11 O ATOM 71 CB ALA A 7 3.696 11.055 -7.505 1.00 64.51 C ATOM 72 H ALA A 7 2.226 11.190 -5.363 1.00 31.21 H ATOM 73 HA ALA A 7 1.714 11.295 -8.225 1.00 4.15 H ATOM 74 HB1 ALA A 7 4.045 10.905 -8.517 1.00 33.52 H ATOM 75 HB2 ALA A 7 3.868 12.080 -7.213 1.00 23.41 H ATOM 76 HB3 ALA A 7 4.231 10.395 -6.838 1.00 64.04 H ATOM 77 N CYS A 8 1.764 8.543 -6.530 1.00 21.12 N ATOM 78 CA CYS A 8 1.519 7.107 -6.583 1.00 35.11 C ATOM 79 C CYS A 8 0.304 6.794 -7.453 1.00 3.43 C ATOM 80 O CYS A 8 0.161 5.682 -7.960 1.00 43.52 O ATOM 81 CB CYS A 8 1.306 6.552 -5.173 1.00 11.10 C ATOM 82 SG CYS A 8 2.746 5.663 -4.499 1.00 1.44 S ATOM 83 H CYS A 8 1.785 8.992 -5.658 1.00 11.10 H ATOM 84 HA CYS A 8 2.388 6.637 -7.018 1.00 13.33 H ATOM 85 HB2 CYS A 8 1.082 7.370 -4.503 1.00 21.51 H ATOM 86 HB3 CYS A 8 0.472 5.866 -5.186 1.00 61.03 H ATOM 87 N MET A 9 -0.567 7.784 -7.620 1.00 71.20 N ATOM 88 CA MET A 9 -1.768 7.615 -8.430 1.00 13.14 C ATOM 89 C MET A 9 -1.452 7.778 -9.913 1.00 5.12 C ATOM 90 O MET A 9 -2.188 7.292 -10.772 1.00 62.23 O ATOM 91 CB MET A 9 -2.838 8.626 -8.010 1.00 62.54 C ATOM 92 CG MET A 9 -4.227 8.021 -7.880 1.00 4.52 C ATOM 93 SD MET A 9 -5.537 9.211 -8.227 1.00 63.42 S ATOM 94 CE MET A 9 -6.410 8.375 -9.549 1.00 14.21 C ATOM 95 H MET A 9 -0.399 8.648 -7.190 1.00 4.31 H ATOM 96 HA MET A 9 -2.143 6.617 -8.261 1.00 74.22 H ATOM 97 HB2 MET A 9 -2.562 9.049 -7.056 1.00 43.14 H ATOM 98 HB3 MET A 9 -2.880 9.414 -8.747 1.00 10.01 H ATOM 99 HG2 MET A 9 -4.314 7.199 -8.574 1.00 30.11 H ATOM 100 HG3 MET A 9 -4.350 7.654 -6.872 1.00 33.21 H ATOM 101 HE1 MET A 9 -7.243 8.984 -9.870 1.00 73.32 H ATOM 102 HE2 MET A 9 -5.739 8.216 -10.380 1.00 33.11 H ATOM 103 HE3 MET A 9 -6.775 7.423 -9.193 1.00 55.22 H ATOM 104 N LEU A 10 -0.353 8.465 -10.206 1.00 60.25 N ATOM 105 CA LEU A 10 0.061 8.692 -11.587 1.00 1.13 C ATOM 106 C LEU A 10 1.197 7.752 -11.976 1.00 63.02 C ATOM 107 O LEU A 10 1.486 7.566 -13.159 1.00 4.15 O ATOM 108 CB LEU A 10 0.499 10.146 -11.776 1.00 20.43 C ATOM 109 CG LEU A 10 -0.513 11.212 -11.355 1.00 31.33 C ATOM 110 CD1 LEU A 10 0.148 12.580 -11.291 1.00 21.31 C ATOM 111 CD2 LEU A 10 -1.695 11.233 -12.313 1.00 32.34 C ATOM 112 H LEU A 10 0.193 8.828 -9.479 1.00 23.21 H ATOM 113 HA LEU A 10 -0.788 8.495 -12.224 1.00 60.30 H ATOM 114 HB2 LEU A 10 1.398 10.298 -11.199 1.00 22.52 H ATOM 115 HB3 LEU A 10 0.717 10.291 -12.824 1.00 62.43 H ATOM 116 HG LEU A 10 -0.886 10.975 -10.367 1.00 44.44 H ATOM 117 HD11 LEU A 10 -0.557 13.303 -10.910 1.00 71.13 H ATOM 118 HD12 LEU A 10 0.465 12.873 -12.281 1.00 23.42 H ATOM 119 HD13 LEU A 10 1.007 12.534 -10.637 1.00 13.30 H ATOM 120 HD21 LEU A 10 -2.527 11.739 -11.846 1.00 73.34 H ATOM 121 HD22 LEU A 10 -1.980 10.219 -12.555 1.00 5.30 H ATOM 122 HD23 LEU A 10 -1.416 11.754 -13.217 1.00 14.11 H ATOM 123 N LYS A 11 1.838 7.159 -10.974 1.00 53.32 N ATOM 124 CA LYS A 11 2.940 6.235 -11.210 1.00 63.15 C ATOM 125 C LYS A 11 2.512 4.796 -10.938 1.00 3.41 C ATOM 126 O LYS A 11 3.225 3.852 -11.276 1.00 1.52 O ATOM 127 CB LYS A 11 4.136 6.599 -10.327 1.00 71.42 C ATOM 128 CG LYS A 11 5.346 7.080 -11.109 1.00 53.22 C ATOM 129 CD LYS A 11 6.634 6.864 -10.333 1.00 32.51 C ATOM 130 CE LYS A 11 7.856 7.165 -11.186 1.00 63.45 C ATOM 131 NZ LYS A 11 8.348 8.555 -10.980 1.00 62.10 N ATOM 132 H LYS A 11 1.561 7.348 -10.052 1.00 60.44 H ATOM 133 HA LYS A 11 3.230 6.322 -12.247 1.00 34.52 H ATOM 134 HB2 LYS A 11 3.839 7.381 -9.645 1.00 2.51 H ATOM 135 HB3 LYS A 11 4.425 5.727 -9.758 1.00 5.25 H ATOM 136 HG2 LYS A 11 5.403 6.535 -12.039 1.00 75.53 H ATOM 137 HG3 LYS A 11 5.233 8.135 -11.315 1.00 1.31 H ATOM 138 HD2 LYS A 11 6.640 7.516 -9.473 1.00 0.42 H ATOM 139 HD3 LYS A 11 6.678 5.834 -10.006 1.00 42.12 H ATOM 140 HE2 LYS A 11 8.641 6.472 -10.925 1.00 22.30 H ATOM 141 HE3 LYS A 11 7.594 7.035 -12.226 1.00 54.21 H ATOM 142 HZ1 LYS A 11 8.710 8.666 -10.012 1.00 1.05 H ATOM 143 HZ2 LYS A 11 7.574 9.233 -11.130 1.00 1.33 H ATOM 144 HZ3 LYS A 11 9.114 8.766 -11.651 1.00 54.43 H ATOM 145 N ASN A 12 1.343 4.638 -10.326 1.00 22.51 N ATOM 146 CA ASN A 12 0.820 3.314 -10.009 1.00 61.51 C ATOM 147 C ASN A 12 -0.706 3.317 -10.010 1.00 24.03 C ATOM 148 O ASN A 12 -1.352 3.169 -8.972 1.00 62.23 O ATOM 149 CB ASN A 12 1.340 2.850 -8.647 1.00 33.42 C ATOM 150 CG ASN A 12 2.837 2.610 -8.650 1.00 42.31 C ATOM 151 OD1 ASN A 12 3.296 1.483 -8.833 1.00 24.33 O ATOM 152 ND2 ASN A 12 3.607 3.674 -8.447 1.00 75.53 N ATOM 153 H ASN A 12 0.820 5.429 -10.081 1.00 51.11 H ATOM 154 HA ASN A 12 1.167 2.630 -10.769 1.00 23.42 H ATOM 155 HB2 ASN A 12 1.117 3.605 -7.907 1.00 42.12 H ATOM 156 HB3 ASN A 12 0.847 1.929 -8.374 1.00 73.43 H ATOM 157 HD21 ASN A 12 4.578 3.547 -8.445 1.00 44.40 H ATOM 158 HD22 ASN A 12 3.171 4.541 -8.309 1.00 22.33 H ATOM 159 N PRO A 13 -1.296 3.490 -11.201 1.00 74.44 N ATOM 160 CA PRO A 13 -2.753 3.515 -11.367 1.00 3.34 C ATOM 161 C PRO A 13 -3.386 2.147 -11.141 1.00 30.40 C ATOM 162 O PRO A 13 -4.597 2.036 -10.956 1.00 31.21 O ATOM 163 CB PRO A 13 -2.937 3.957 -12.821 1.00 30.33 C ATOM 164 CG PRO A 13 -1.680 3.542 -13.505 1.00 34.43 C ATOM 165 CD PRO A 13 -0.588 3.672 -12.479 1.00 52.34 C ATOM 166 HA PRO A 13 -3.214 4.237 -10.708 1.00 60.03 H ATOM 167 HB2 PRO A 13 -3.800 3.461 -13.243 1.00 50.42 H ATOM 168 HB3 PRO A 13 -3.073 5.027 -12.861 1.00 74.23 H ATOM 169 HG2 PRO A 13 -1.763 2.518 -13.836 1.00 34.43 H ATOM 170 HG3 PRO A 13 -1.487 4.194 -14.343 1.00 64.03 H ATOM 171 HD2 PRO A 13 0.156 2.903 -12.621 1.00 45.21 H ATOM 172 HD3 PRO A 13 -0.136 4.652 -12.532 1.00 73.13 H ATOM 173 N ASN A 14 -2.558 1.107 -11.157 1.00 74.24 N ATOM 174 CA ASN A 14 -3.038 -0.255 -10.955 1.00 33.35 C ATOM 175 C ASN A 14 -3.270 -0.536 -9.473 1.00 4.42 C ATOM 176 O ASN A 14 -3.790 -1.589 -9.103 1.00 12.24 O ATOM 177 CB ASN A 14 -2.037 -1.261 -11.525 1.00 62.51 C ATOM 178 CG ASN A 14 -2.323 -1.604 -12.974 1.00 73.03 C ATOM 179 OD1 ASN A 14 -3.480 -1.691 -13.386 1.00 71.51 O ATOM 180 ND2 ASN A 14 -1.267 -1.800 -13.756 1.00 35.14 N ATOM 181 H ASN A 14 -1.602 1.259 -11.310 1.00 33.31 H ATOM 182 HA ASN A 14 -3.976 -0.358 -11.479 1.00 53.31 H ATOM 183 HB2 ASN A 14 -1.042 -0.844 -11.464 1.00 71.10 H ATOM 184 HB3 ASN A 14 -2.078 -2.171 -10.944 1.00 44.52 H ATOM 185 HD21 ASN A 14 -1.424 -2.022 -14.697 1.00 61.22 H ATOM 186 HD22 ASN A 14 -0.375 -1.714 -13.359 1.00 53.00 H ATOM 187 N LEU A 15 -2.880 0.414 -8.629 1.00 70.31 N ATOM 188 CA LEU A 15 -3.045 0.270 -7.187 1.00 12.23 C ATOM 189 C LEU A 15 -3.928 1.381 -6.627 1.00 2.04 C ATOM 190 O LEU A 15 -4.909 1.118 -5.931 1.00 32.20 O ATOM 191 CB LEU A 15 -1.682 0.288 -6.493 1.00 61.22 C ATOM 192 CG LEU A 15 -1.230 -1.032 -5.867 1.00 33.10 C ATOM 193 CD1 LEU A 15 0.109 -0.861 -5.168 1.00 44.40 C ATOM 194 CD2 LEU A 15 -2.280 -1.547 -4.893 1.00 11.00 C ATOM 195 H LEU A 15 -2.472 1.231 -8.983 1.00 63.42 H ATOM 196 HA LEU A 15 -3.522 -0.680 -7.001 1.00 34.41 H ATOM 197 HB2 LEU A 15 -0.943 0.576 -7.224 1.00 43.55 H ATOM 198 HB3 LEU A 15 -1.720 1.031 -5.710 1.00 10.15 H ATOM 199 HG LEU A 15 -1.107 -1.770 -6.648 1.00 3.02 H ATOM 200 HD11 LEU A 15 0.384 0.183 -5.167 1.00 14.41 H ATOM 201 HD12 LEU A 15 0.863 -1.430 -5.691 1.00 24.45 H ATOM 202 HD13 LEU A 15 0.032 -1.214 -4.150 1.00 62.53 H ATOM 203 HD21 LEU A 15 -1.794 -2.078 -4.088 1.00 14.32 H ATOM 204 HD22 LEU A 15 -2.954 -2.214 -5.410 1.00 65.41 H ATOM 205 HD23 LEU A 15 -2.838 -0.713 -4.491 1.00 62.32 H ATOM 206 N CYS A 16 -3.574 2.624 -6.936 1.00 25.21 N ATOM 207 CA CYS A 16 -4.333 3.776 -6.466 1.00 35.34 C ATOM 208 C CYS A 16 -4.290 4.910 -7.486 1.00 24.32 C ATOM 209 O CYS A 16 -5.133 4.987 -8.379 1.00 71.42 O ATOM 210 CB CYS A 16 -3.784 4.261 -5.123 1.00 14.53 C ATOM 211 SG CYS A 16 -4.851 5.473 -4.278 1.00 31.54 S ATOM 212 H CYS A 16 -2.781 2.770 -7.495 1.00 3.44 H ATOM 213 HA CYS A 16 -5.359 3.466 -6.334 1.00 60.34 H ATOM 214 HB2 CYS A 16 -3.665 3.414 -4.464 1.00 20.24 H ATOM 215 HB3 CYS A 16 -2.822 4.725 -5.282 1.00 72.04 H TER 216 CYS A 16 ENDMDL MODEL 9 ATOM 1 N GLY A 1 3.019 -1.002 -2.306 1.00 70.25 N ATOM 2 CA GLY A 1 2.340 0.040 -1.559 1.00 51.01 C ATOM 3 C GLY A 1 2.391 1.383 -2.260 1.00 11.22 C ATOM 4 O GLY A 1 3.454 1.995 -2.369 1.00 11.11 O ATOM 5 H1 GLY A 1 3.067 -1.911 -1.943 1.00 22.21 H ATOM 6 HA2 GLY A 1 1.307 -0.244 -1.423 1.00 22.41 H ATOM 7 HA3 GLY A 1 2.807 0.135 -0.590 1.00 25.10 H ATOM 8 N CYS A 2 1.240 1.843 -2.738 1.00 53.31 N ATOM 9 CA CYS A 2 1.157 3.121 -3.434 1.00 54.44 C ATOM 10 C CYS A 2 -0.274 3.651 -3.430 1.00 14.32 C ATOM 11 O CYS A 2 -1.140 3.139 -4.139 1.00 74.34 O ATOM 12 CB CYS A 2 1.653 2.975 -4.874 1.00 62.00 C ATOM 13 SG CYS A 2 3.033 4.085 -5.301 1.00 53.43 S ATOM 14 H CYS A 2 0.425 1.310 -2.620 1.00 61.32 H ATOM 15 HA CYS A 2 1.789 3.825 -2.914 1.00 63.54 H ATOM 16 HB2 CYS A 2 1.990 1.960 -5.029 1.00 55.01 H ATOM 17 HB3 CYS A 2 0.839 3.186 -5.551 1.00 13.10 H ATOM 18 N CYS A 3 -0.515 4.681 -2.625 1.00 55.13 N ATOM 19 CA CYS A 3 -1.840 5.282 -2.527 1.00 33.40 C ATOM 20 C CYS A 3 -1.819 6.498 -1.605 1.00 73.44 C ATOM 21 O CYS A 3 -2.591 7.440 -1.786 1.00 64.21 O ATOM 22 CB CYS A 3 -2.851 4.255 -2.012 1.00 54.22 C ATOM 23 SG CYS A 3 -4.590 4.771 -2.188 1.00 3.11 S ATOM 24 H CYS A 3 0.216 5.047 -2.084 1.00 21.44 H ATOM 25 HA CYS A 3 -2.135 5.600 -3.515 1.00 61.44 H ATOM 26 HB2 CYS A 3 -2.727 3.332 -2.560 1.00 5.41 H ATOM 27 HB3 CYS A 3 -2.666 4.073 -0.964 1.00 12.31 H ATOM 28 N SER A 4 -0.931 6.469 -0.617 1.00 43.13 N ATOM 29 CA SER A 4 -0.811 7.567 0.335 1.00 20.11 C ATOM 30 C SER A 4 -0.071 8.747 -0.287 1.00 13.41 C ATOM 31 O SER A 4 0.027 9.818 0.312 1.00 75.42 O ATOM 32 CB SER A 4 -0.080 7.099 1.595 1.00 13.33 C ATOM 33 OG SER A 4 -0.751 7.535 2.765 1.00 40.40 O ATOM 34 H SER A 4 -0.343 5.690 -0.525 1.00 73.34 H ATOM 35 HA SER A 4 -1.808 7.883 0.604 1.00 60.14 H ATOM 36 HB2 SER A 4 -0.034 6.021 1.602 1.00 11.04 H ATOM 37 HB3 SER A 4 0.922 7.503 1.597 1.00 30.14 H ATOM 38 HG SER A 4 -0.537 6.949 3.494 1.00 3.25 H ATOM 39 N ASN A 5 0.448 8.543 -1.493 1.00 40.12 N ATOM 40 CA ASN A 5 1.180 9.590 -2.198 1.00 31.45 C ATOM 41 C ASN A 5 0.340 10.172 -3.331 1.00 5.14 C ATOM 42 O ASN A 5 -0.445 9.477 -3.975 1.00 15.12 O ATOM 43 CB ASN A 5 2.494 9.036 -2.753 1.00 54.44 C ATOM 44 CG ASN A 5 3.694 9.463 -1.932 1.00 5.54 C ATOM 45 OD1 ASN A 5 4.168 10.594 -2.045 1.00 15.44 O ATOM 46 ND2 ASN A 5 4.194 8.558 -1.099 1.00 33.42 N ATOM 47 H ASN A 5 0.337 7.668 -1.920 1.00 30.22 H ATOM 48 HA ASN A 5 1.401 10.374 -1.489 1.00 71.40 H ATOM 49 HB2 ASN A 5 2.450 7.957 -2.757 1.00 32.13 H ATOM 50 HB3 ASN A 5 2.628 9.390 -3.764 1.00 54.34 H ATOM 51 HD21 ASN A 5 4.970 8.807 -0.555 1.00 13.31 H ATOM 52 HD22 ASN A 5 3.765 7.677 -1.062 1.00 24.34 H ATOM 53 N PRO A 6 0.510 11.479 -3.581 1.00 61.22 N ATOM 54 CA PRO A 6 -0.222 12.184 -4.638 1.00 20.34 C ATOM 55 C PRO A 6 0.221 11.758 -6.033 1.00 45.32 C ATOM 56 O PRO A 6 -0.565 11.785 -6.980 1.00 3.34 O ATOM 57 CB PRO A 6 0.127 13.654 -4.391 1.00 33.44 C ATOM 58 CG PRO A 6 1.440 13.619 -3.689 1.00 23.52 C ATOM 59 CD PRO A 6 1.430 12.369 -2.853 1.00 20.41 C ATOM 60 HA PRO A 6 -1.289 12.044 -4.542 1.00 1.10 H ATOM 61 HB2 PRO A 6 0.197 14.173 -5.336 1.00 15.41 H ATOM 62 HB3 PRO A 6 -0.636 14.110 -3.778 1.00 1.22 H ATOM 63 HG2 PRO A 6 2.242 13.580 -4.411 1.00 14.21 H ATOM 64 HG3 PRO A 6 1.543 14.490 -3.058 1.00 73.55 H ATOM 65 HD2 PRO A 6 2.420 11.941 -2.801 1.00 63.14 H ATOM 66 HD3 PRO A 6 1.056 12.580 -1.862 1.00 5.41 H ATOM 67 N ALA A 7 1.485 11.365 -6.153 1.00 44.54 N ATOM 68 CA ALA A 7 2.032 10.932 -7.433 1.00 61.11 C ATOM 69 C ALA A 7 1.836 9.433 -7.634 1.00 45.02 C ATOM 70 O ALA A 7 1.827 8.944 -8.764 1.00 63.31 O ATOM 71 CB ALA A 7 3.508 11.291 -7.525 1.00 71.42 C ATOM 72 H ALA A 7 2.063 11.366 -5.362 1.00 63.02 H ATOM 73 HA ALA A 7 1.509 11.461 -8.216 1.00 53.43 H ATOM 74 HB1 ALA A 7 4.066 10.430 -7.864 1.00 22.34 H ATOM 75 HB2 ALA A 7 3.638 12.102 -8.225 1.00 51.41 H ATOM 76 HB3 ALA A 7 3.866 11.592 -6.552 1.00 40.43 H ATOM 77 N CYS A 8 1.681 8.708 -6.531 1.00 50.24 N ATOM 78 CA CYS A 8 1.487 7.264 -6.586 1.00 13.32 C ATOM 79 C CYS A 8 0.273 6.911 -7.440 1.00 34.31 C ATOM 80 O CYS A 8 0.163 5.796 -7.949 1.00 71.22 O ATOM 81 CB CYS A 8 1.314 6.698 -5.175 1.00 13.51 C ATOM 82 SG CYS A 8 2.794 5.861 -4.523 1.00 61.41 S ATOM 83 H CYS A 8 1.698 9.155 -5.659 1.00 14.45 H ATOM 84 HA CYS A 8 2.366 6.828 -7.034 1.00 21.31 H ATOM 85 HB2 CYS A 8 1.070 7.505 -4.499 1.00 53.42 H ATOM 86 HB3 CYS A 8 0.505 5.983 -5.179 1.00 61.40 H ATOM 87 N MET A 9 -0.636 7.868 -7.592 1.00 12.41 N ATOM 88 CA MET A 9 -1.842 7.659 -8.385 1.00 65.45 C ATOM 89 C MET A 9 -1.551 7.837 -9.872 1.00 54.04 C ATOM 90 O MET A 9 -2.282 7.327 -10.723 1.00 65.03 O ATOM 91 CB MET A 9 -2.941 8.629 -7.948 1.00 61.45 C ATOM 92 CG MET A 9 -4.344 8.061 -8.090 1.00 22.44 C ATOM 93 SD MET A 9 -5.471 9.194 -8.924 1.00 33.14 S ATOM 94 CE MET A 9 -5.438 8.539 -10.590 1.00 74.33 C ATOM 95 H MET A 9 -0.493 8.737 -7.161 1.00 52.13 H ATOM 96 HA MET A 9 -2.178 6.647 -8.215 1.00 70.02 H ATOM 97 HB2 MET A 9 -2.784 8.889 -6.912 1.00 42.15 H ATOM 98 HB3 MET A 9 -2.876 9.523 -8.550 1.00 72.22 H ATOM 99 HG2 MET A 9 -4.292 7.144 -8.659 1.00 2.44 H ATOM 100 HG3 MET A 9 -4.732 7.848 -7.104 1.00 43.23 H ATOM 101 HE1 MET A 9 -5.365 9.354 -11.296 1.00 30.23 H ATOM 102 HE2 MET A 9 -4.585 7.886 -10.704 1.00 54.30 H ATOM 103 HE3 MET A 9 -6.345 7.982 -10.776 1.00 21.13 H ATOM 104 N LEU A 10 -0.482 8.564 -10.179 1.00 34.42 N ATOM 105 CA LEU A 10 -0.096 8.810 -11.564 1.00 21.52 C ATOM 106 C LEU A 10 1.068 7.912 -11.972 1.00 71.10 C ATOM 107 O LEU A 10 1.347 7.740 -13.159 1.00 21.33 O ATOM 108 CB LEU A 10 0.287 10.278 -11.754 1.00 51.31 C ATOM 109 CG LEU A 10 -0.773 11.305 -11.354 1.00 3.35 C ATOM 110 CD1 LEU A 10 -0.116 12.600 -10.899 1.00 35.32 C ATOM 111 CD2 LEU A 10 -1.726 11.566 -12.510 1.00 54.52 C ATOM 112 H LEU A 10 0.061 8.944 -9.458 1.00 35.04 H ATOM 113 HA LEU A 10 -0.946 8.583 -12.190 1.00 40.41 H ATOM 114 HB2 LEU A 10 1.171 10.468 -11.165 1.00 12.51 H ATOM 115 HB3 LEU A 10 0.515 10.427 -12.800 1.00 73.01 H ATOM 116 HG LEU A 10 -1.349 10.915 -10.526 1.00 24.13 H ATOM 117 HD11 LEU A 10 0.665 12.377 -10.189 1.00 24.32 H ATOM 118 HD12 LEU A 10 -0.856 13.234 -10.433 1.00 31.34 H ATOM 119 HD13 LEU A 10 0.306 13.108 -11.753 1.00 1.30 H ATOM 120 HD21 LEU A 10 -2.007 12.609 -12.517 1.00 44.23 H ATOM 121 HD22 LEU A 10 -2.610 10.957 -12.392 1.00 61.53 H ATOM 122 HD23 LEU A 10 -1.239 11.317 -13.442 1.00 0.42 H ATOM 123 N LYS A 11 1.743 7.340 -10.981 1.00 30.22 N ATOM 124 CA LYS A 11 2.875 6.456 -11.235 1.00 53.42 C ATOM 125 C LYS A 11 2.502 5.003 -10.961 1.00 64.34 C ATOM 126 O LYS A 11 3.244 4.086 -11.312 1.00 70.01 O ATOM 127 CB LYS A 11 4.069 6.860 -10.367 1.00 54.42 C ATOM 128 CG LYS A 11 5.249 7.387 -11.164 1.00 43.32 C ATOM 129 CD LYS A 11 6.555 7.214 -10.407 1.00 2.33 C ATOM 130 CE LYS A 11 7.392 6.085 -10.989 1.00 11.51 C ATOM 131 NZ LYS A 11 6.927 4.751 -10.518 1.00 45.13 N ATOM 132 H LYS A 11 1.473 7.516 -10.055 1.00 35.43 H ATOM 133 HA LYS A 11 3.146 6.556 -12.275 1.00 43.21 H ATOM 134 HB2 LYS A 11 3.753 7.630 -9.678 1.00 44.34 H ATOM 135 HB3 LYS A 11 4.397 5.998 -9.804 1.00 41.44 H ATOM 136 HG2 LYS A 11 5.313 6.847 -12.097 1.00 34.11 H ATOM 137 HG3 LYS A 11 5.096 8.438 -11.365 1.00 4.35 H ATOM 138 HD2 LYS A 11 7.120 8.133 -10.465 1.00 70.23 H ATOM 139 HD3 LYS A 11 6.334 6.991 -9.372 1.00 63.24 H ATOM 140 HE2 LYS A 11 7.323 6.122 -12.065 1.00 70.02 H ATOM 141 HE3 LYS A 11 8.420 6.226 -10.689 1.00 60.22 H ATOM 142 HZ1 LYS A 11 6.039 4.494 -10.993 1.00 71.22 H ATOM 143 HZ2 LYS A 11 6.766 4.771 -9.491 1.00 0.31 H ATOM 144 HZ3 LYS A 11 7.644 4.028 -10.731 1.00 11.12 H ATOM 145 N ASN A 12 1.348 4.800 -10.334 1.00 44.21 N ATOM 146 CA ASN A 12 0.878 3.457 -10.014 1.00 54.44 C ATOM 147 C ASN A 12 -0.647 3.406 -9.994 1.00 71.01 C ATOM 148 O ASN A 12 -1.273 3.232 -8.948 1.00 72.34 O ATOM 149 CB ASN A 12 1.432 3.009 -8.661 1.00 23.30 C ATOM 150 CG ASN A 12 2.937 2.823 -8.686 1.00 3.54 C ATOM 151 OD1 ASN A 12 3.434 1.714 -8.878 1.00 62.23 O ATOM 152 ND2 ASN A 12 3.671 3.913 -8.490 1.00 15.15 N ATOM 153 H ASN A 12 0.800 5.572 -10.080 1.00 23.24 H ATOM 154 HA ASN A 12 1.239 2.789 -10.781 1.00 74.50 H ATOM 155 HB2 ASN A 12 1.193 3.754 -7.916 1.00 20.51 H ATOM 156 HB3 ASN A 12 0.977 2.070 -8.385 1.00 34.22 H ATOM 157 HD21 ASN A 12 4.646 3.822 -8.501 1.00 42.20 H ATOM 158 HD22 ASN A 12 3.206 4.764 -8.342 1.00 62.30 H ATOM 159 N PRO A 13 -1.260 3.560 -11.177 1.00 12.50 N ATOM 160 CA PRO A 13 -2.719 3.534 -11.322 1.00 44.31 C ATOM 161 C PRO A 13 -3.299 2.143 -11.092 1.00 52.13 C ATOM 162 O PRO A 13 -4.503 1.988 -10.892 1.00 0.11 O ATOM 163 CB PRO A 13 -2.939 3.973 -12.772 1.00 62.31 C ATOM 164 CG PRO A 13 -1.678 3.605 -13.475 1.00 24.14 C ATOM 165 CD PRO A 13 -0.577 3.772 -12.464 1.00 43.11 C ATOM 166 HA PRO A 13 -3.196 4.237 -10.655 1.00 54.12 H ATOM 167 HB2 PRO A 13 -3.789 3.448 -13.184 1.00 72.13 H ATOM 168 HB3 PRO A 13 -3.114 5.037 -12.807 1.00 50.44 H ATOM 169 HG2 PRO A 13 -1.728 2.580 -13.808 1.00 34.42 H ATOM 170 HG3 PRO A 13 -1.519 4.266 -14.314 1.00 11.23 H ATOM 171 HD2 PRO A 13 0.193 3.031 -12.618 1.00 60.45 H ATOM 172 HD3 PRO A 13 -0.161 4.767 -12.520 1.00 11.40 H ATOM 173 N ASN A 14 -2.435 1.134 -11.122 1.00 61.24 N ATOM 174 CA ASN A 14 -2.863 -0.245 -10.917 1.00 63.22 C ATOM 175 C ASN A 14 -3.065 -0.537 -9.433 1.00 65.24 C ATOM 176 O ASN A 14 -3.542 -1.609 -9.060 1.00 33.24 O ATOM 177 CB ASN A 14 -1.833 -1.213 -11.504 1.00 30.25 C ATOM 178 CG ASN A 14 -2.301 -1.838 -12.804 1.00 12.42 C ATOM 179 OD1 ASN A 14 -3.474 -2.179 -12.954 1.00 74.22 O ATOM 180 ND2 ASN A 14 -1.383 -1.990 -13.751 1.00 52.42 N ATOM 181 H ASN A 14 -1.487 1.321 -11.287 1.00 21.52 H ATOM 182 HA ASN A 14 -3.803 -0.380 -11.430 1.00 31.10 H ATOM 183 HB2 ASN A 14 -0.913 -0.679 -11.694 1.00 15.00 H ATOM 184 HB3 ASN A 14 -1.645 -2.004 -10.793 1.00 3.43 H ATOM 185 HD21 ASN A 14 -1.659 -2.390 -14.602 1.00 63.11 H ATOM 186 HD22 ASN A 14 -0.468 -1.695 -13.561 1.00 40.40 H ATOM 187 N LEU A 15 -2.698 0.423 -8.592 1.00 50.31 N ATOM 188 CA LEU A 15 -2.839 0.271 -7.148 1.00 72.42 C ATOM 189 C LEU A 15 -3.753 1.348 -6.573 1.00 51.03 C ATOM 190 O LEU A 15 -4.715 1.048 -5.866 1.00 15.50 O ATOM 191 CB LEU A 15 -1.468 0.335 -6.472 1.00 74.43 C ATOM 192 CG LEU A 15 -0.963 -0.970 -5.855 1.00 45.15 C ATOM 193 CD1 LEU A 15 0.379 -0.753 -5.173 1.00 43.24 C ATOM 194 CD2 LEU A 15 -1.981 -1.524 -4.869 1.00 43.44 C ATOM 195 H LEU A 15 -2.324 1.255 -8.949 1.00 42.21 H ATOM 196 HA LEU A 15 -3.280 -0.697 -6.959 1.00 0.10 H ATOM 197 HB2 LEU A 15 -0.749 0.651 -7.212 1.00 74.34 H ATOM 198 HB3 LEU A 15 -1.522 1.074 -5.686 1.00 54.53 H ATOM 199 HG LEU A 15 -0.823 -1.701 -6.640 1.00 31.33 H ATOM 200 HD11 LEU A 15 1.031 -1.586 -5.388 1.00 41.11 H ATOM 201 HD12 LEU A 15 0.232 -0.676 -4.106 1.00 63.23 H ATOM 202 HD13 LEU A 15 0.826 0.159 -5.541 1.00 44.31 H ATOM 203 HD21 LEU A 15 -2.647 -0.733 -4.558 1.00 60.00 H ATOM 204 HD22 LEU A 15 -1.466 -1.922 -4.007 1.00 74.03 H ATOM 205 HD23 LEU A 15 -2.550 -2.310 -5.344 1.00 13.23 H ATOM 206 N CYS A 16 -3.447 2.603 -6.883 1.00 41.44 N ATOM 207 CA CYS A 16 -4.241 3.726 -6.400 1.00 2.42 C ATOM 208 C CYS A 16 -4.251 4.863 -7.418 1.00 15.33 C ATOM 209 O CYS A 16 -4.395 4.633 -8.618 1.00 71.34 O ATOM 210 CB CYS A 16 -3.691 4.229 -5.063 1.00 61.24 C ATOM 211 SG CYS A 16 -4.789 5.398 -4.200 1.00 33.43 S ATOM 212 H CYS A 16 -2.667 2.779 -7.452 1.00 0.33 H ATOM 213 HA CYS A 16 -5.253 3.380 -6.255 1.00 63.23 H ATOM 214 HB2 CYS A 16 -3.531 3.385 -4.409 1.00 21.44 H ATOM 215 HB3 CYS A 16 -2.749 4.728 -5.235 1.00 62.13 H TER 216 CYS A 16 ENDMDL MODEL 10 ATOM 1 N GLY A 1 1.644 0.197 0.048 1.00 55.31 N ATOM 2 CA GLY A 1 2.001 0.072 -1.353 1.00 32.40 C ATOM 3 C GLY A 1 2.077 1.413 -2.055 1.00 15.14 C ATOM 4 O GLY A 1 3.095 2.102 -1.985 1.00 72.01 O ATOM 5 H1 GLY A 1 1.184 -0.540 0.503 1.00 42.34 H ATOM 6 HA2 GLY A 1 2.961 -0.416 -1.426 1.00 24.01 H ATOM 7 HA3 GLY A 1 1.260 -0.539 -1.848 1.00 71.01 H ATOM 8 N CYS A 2 0.997 1.785 -2.734 1.00 41.33 N ATOM 9 CA CYS A 2 0.945 3.052 -3.454 1.00 40.10 C ATOM 10 C CYS A 2 -0.484 3.585 -3.515 1.00 24.12 C ATOM 11 O CYS A 2 -1.322 3.063 -4.250 1.00 71.22 O ATOM 12 CB CYS A 2 1.498 2.881 -4.870 1.00 51.03 C ATOM 13 SG CYS A 2 2.896 3.982 -5.261 1.00 15.31 S ATOM 14 H CYS A 2 0.215 1.193 -2.753 1.00 24.03 H ATOM 15 HA CYS A 2 1.559 3.762 -2.921 1.00 15.22 H ATOM 16 HB2 CYS A 2 1.838 1.863 -4.995 1.00 50.22 H ATOM 17 HB3 CYS A 2 0.711 3.082 -5.582 1.00 42.13 H ATOM 18 N CYS A 3 -0.754 4.628 -2.737 1.00 23.21 N ATOM 19 CA CYS A 3 -2.080 5.232 -2.701 1.00 2.42 C ATOM 20 C CYS A 3 -2.092 6.463 -1.798 1.00 72.14 C ATOM 21 O CYS A 3 -2.853 7.404 -2.025 1.00 20.24 O ATOM 22 CB CYS A 3 -3.113 4.216 -2.211 1.00 13.44 C ATOM 23 SG CYS A 3 -4.842 4.733 -2.463 1.00 2.30 S ATOM 24 H CYS A 3 -0.043 5.000 -2.172 1.00 53.33 H ATOM 25 HA CYS A 3 -2.334 5.535 -3.705 1.00 41.31 H ATOM 26 HB2 CYS A 3 -2.969 3.285 -2.739 1.00 35.15 H ATOM 27 HB3 CYS A 3 -2.970 4.051 -1.153 1.00 73.51 H ATOM 28 N SER A 4 -1.244 6.448 -0.775 1.00 41.12 N ATOM 29 CA SER A 4 -1.159 7.561 0.164 1.00 72.43 C ATOM 30 C SER A 4 -0.392 8.730 -0.447 1.00 31.42 C ATOM 31 O SER A 4 -0.316 9.809 0.138 1.00 1.11 O ATOM 32 CB SER A 4 -0.481 7.112 1.459 1.00 23.43 C ATOM 33 OG SER A 4 -1.196 7.568 2.594 1.00 2.33 O ATOM 34 H SER A 4 -0.663 5.669 -0.648 1.00 21.04 H ATOM 35 HA SER A 4 -2.165 7.883 0.387 1.00 32.02 H ATOM 36 HB2 SER A 4 -0.438 6.033 1.486 1.00 54.44 H ATOM 37 HB3 SER A 4 0.522 7.512 1.495 1.00 41.42 H ATOM 38 HG SER A 4 -0.829 7.169 3.386 1.00 5.13 H ATOM 39 N ASN A 5 0.175 8.505 -1.628 1.00 22.35 N ATOM 40 CA ASN A 5 0.938 9.538 -2.318 1.00 55.45 C ATOM 41 C ASN A 5 0.145 10.105 -3.493 1.00 4.23 C ATOM 42 O ASN A 5 -0.617 9.402 -4.157 1.00 5.12 O ATOM 43 CB ASN A 5 2.271 8.973 -2.813 1.00 55.43 C ATOM 44 CG ASN A 5 3.439 9.410 -1.951 1.00 21.42 C ATOM 45 OD1 ASN A 5 3.481 10.542 -1.469 1.00 34.44 O ATOM 46 ND2 ASN A 5 4.396 8.511 -1.753 1.00 63.41 N ATOM 47 H ASN A 5 0.079 7.623 -2.044 1.00 63.12 H ATOM 48 HA ASN A 5 1.133 10.333 -1.614 1.00 33.30 H ATOM 49 HB2 ASN A 5 2.223 7.894 -2.802 1.00 43.12 H ATOM 50 HB3 ASN A 5 2.446 9.312 -3.823 1.00 73.44 H ATOM 51 HD21 ASN A 5 5.163 8.766 -1.199 1.00 22.01 H ATOM 52 HD22 ASN A 5 4.297 7.629 -2.169 1.00 34.42 H ATOM 53 N PRO A 6 0.329 11.407 -3.756 1.00 54.55 N ATOM 54 CA PRO A 6 -0.359 12.098 -4.852 1.00 20.32 C ATOM 55 C PRO A 6 0.138 11.650 -6.222 1.00 21.30 C ATOM 56 O PRO A 6 -0.610 11.664 -7.199 1.00 42.11 O ATOM 57 CB PRO A 6 -0.016 13.570 -4.614 1.00 11.42 C ATOM 58 CG PRO A 6 1.269 13.543 -3.860 1.00 14.10 C ATOM 59 CD PRO A 6 1.222 12.306 -3.006 1.00 54.31 C ATOM 60 HA PRO A 6 -1.429 11.962 -4.796 1.00 52.04 H ATOM 61 HB2 PRO A 6 0.093 14.075 -5.563 1.00 53.34 H ATOM 62 HB3 PRO A 6 -0.801 14.038 -4.039 1.00 0.22 H ATOM 63 HG2 PRO A 6 2.098 13.492 -4.549 1.00 72.21 H ATOM 64 HG3 PRO A 6 1.348 14.424 -3.240 1.00 25.55 H ATOM 65 HD2 PRO A 6 2.208 11.877 -2.909 1.00 12.12 H ATOM 66 HD3 PRO A 6 0.810 12.534 -2.034 1.00 13.30 H ATOM 67 N ALA A 7 1.405 11.252 -6.286 1.00 35.21 N ATOM 68 CA ALA A 7 2.000 10.797 -7.536 1.00 43.21 C ATOM 69 C ALA A 7 1.808 9.296 -7.722 1.00 20.12 C ATOM 70 O ALA A 7 1.842 8.789 -8.844 1.00 11.33 O ATOM 71 CB ALA A 7 3.480 11.151 -7.575 1.00 33.41 C ATOM 72 H ALA A 7 1.951 11.263 -5.472 1.00 54.05 H ATOM 73 HA ALA A 7 1.510 11.316 -8.347 1.00 70.15 H ATOM 74 HB1 ALA A 7 3.973 10.728 -6.711 1.00 74.15 H ATOM 75 HB2 ALA A 7 3.922 10.750 -8.475 1.00 32.33 H ATOM 76 HB3 ALA A 7 3.593 12.224 -7.565 1.00 3.32 H ATOM 77 N CYS A 8 1.607 8.589 -6.615 1.00 71.51 N ATOM 78 CA CYS A 8 1.410 7.145 -6.655 1.00 64.51 C ATOM 79 C CYS A 8 0.230 6.781 -7.551 1.00 32.20 C ATOM 80 O CYS A 8 0.137 5.658 -8.047 1.00 53.50 O ATOM 81 CB CYS A 8 1.180 6.601 -5.244 1.00 21.24 C ATOM 82 SG CYS A 8 2.631 5.770 -4.521 1.00 23.00 S ATOM 83 H CYS A 8 1.590 9.049 -5.749 1.00 44.12 H ATOM 84 HA CYS A 8 2.305 6.699 -7.062 1.00 24.25 H ATOM 85 HB2 CYS A 8 0.912 7.419 -4.591 1.00 32.44 H ATOM 86 HB3 CYS A 8 0.370 5.887 -5.269 1.00 24.32 H ATOM 87 N MET A 9 -0.669 7.738 -7.753 1.00 53.43 N ATOM 88 CA MET A 9 -1.843 7.519 -8.591 1.00 11.45 C ATOM 89 C MET A 9 -1.494 7.674 -10.067 1.00 51.33 C ATOM 90 O MET A 9 -2.192 7.153 -10.939 1.00 3.25 O ATOM 91 CB MET A 9 -2.956 8.499 -8.212 1.00 22.20 C ATOM 92 CG MET A 9 -3.694 8.117 -6.939 1.00 54.24 C ATOM 93 SD MET A 9 -3.644 9.417 -5.691 1.00 23.24 S ATOM 94 CE MET A 9 -4.695 10.654 -6.447 1.00 43.30 C ATOM 95 H MET A 9 -0.541 8.613 -7.331 1.00 4.33 H ATOM 96 HA MET A 9 -2.189 6.511 -8.418 1.00 52.42 H ATOM 97 HB2 MET A 9 -2.525 9.479 -8.072 1.00 65.32 H ATOM 98 HB3 MET A 9 -3.672 8.541 -9.019 1.00 13.12 H ATOM 99 HG2 MET A 9 -4.726 7.914 -7.184 1.00 72.04 H ATOM 100 HG3 MET A 9 -3.242 7.226 -6.531 1.00 25.12 H ATOM 101 HE1 MET A 9 -4.983 10.326 -7.435 1.00 74.30 H ATOM 102 HE2 MET A 9 -5.578 10.795 -5.842 1.00 51.11 H ATOM 103 HE3 MET A 9 -4.156 11.587 -6.521 1.00 10.45 H ATOM 104 N LEU A 10 -0.412 8.393 -10.342 1.00 44.44 N ATOM 105 CA LEU A 10 0.030 8.617 -11.715 1.00 10.13 C ATOM 106 C LEU A 10 1.206 7.711 -12.063 1.00 22.51 C ATOM 107 O LEU A 10 1.531 7.519 -13.235 1.00 4.51 O ATOM 108 CB LEU A 10 0.424 10.082 -11.912 1.00 64.20 C ATOM 109 CG LEU A 10 -0.620 11.120 -11.499 1.00 61.34 C ATOM 110 CD1 LEU A 10 0.010 12.500 -11.401 1.00 13.54 C ATOM 111 CD2 LEU A 10 -1.780 11.130 -12.484 1.00 61.33 C ATOM 112 H LEU A 10 0.104 8.783 -9.606 1.00 53.53 H ATOM 113 HA LEU A 10 -0.796 8.384 -12.370 1.00 65.45 H ATOM 114 HB2 LEU A 10 1.318 10.264 -11.335 1.00 14.34 H ATOM 115 HB3 LEU A 10 0.640 10.227 -12.961 1.00 62.11 H ATOM 116 HG LEU A 10 -1.010 10.861 -10.525 1.00 21.24 H ATOM 117 HD11 LEU A 10 -0.746 13.222 -11.129 1.00 22.11 H ATOM 118 HD12 LEU A 10 0.438 12.770 -12.355 1.00 23.34 H ATOM 119 HD13 LEU A 10 0.785 12.489 -10.648 1.00 40.44 H ATOM 120 HD21 LEU A 10 -1.878 12.115 -12.914 1.00 54.25 H ATOM 121 HD22 LEU A 10 -2.692 10.869 -11.968 1.00 70.11 H ATOM 122 HD23 LEU A 10 -1.592 10.411 -13.269 1.00 33.43 H ATOM 123 N LYS A 11 1.840 7.152 -11.037 1.00 51.13 N ATOM 124 CA LYS A 11 2.978 6.262 -11.233 1.00 41.13 C ATOM 125 C LYS A 11 2.591 4.814 -10.952 1.00 71.33 C ATOM 126 O LYS A 11 3.343 3.890 -11.259 1.00 72.25 O ATOM 127 CB LYS A 11 4.138 6.676 -10.325 1.00 41.42 C ATOM 128 CG LYS A 11 5.351 7.188 -11.083 1.00 11.11 C ATOM 129 CD LYS A 11 6.625 7.023 -10.272 1.00 64.13 C ATOM 130 CE LYS A 11 7.794 6.601 -11.150 1.00 53.12 C ATOM 131 NZ LYS A 11 8.608 7.768 -11.588 1.00 42.31 N ATOM 132 H LYS A 11 1.534 7.343 -10.125 1.00 73.33 H ATOM 133 HA LYS A 11 3.291 6.345 -12.263 1.00 52.21 H ATOM 134 HB2 LYS A 11 3.798 7.458 -9.661 1.00 64.42 H ATOM 135 HB3 LYS A 11 4.442 5.822 -9.737 1.00 15.42 H ATOM 136 HG2 LYS A 11 5.449 6.634 -12.004 1.00 71.44 H ATOM 137 HG3 LYS A 11 5.209 8.236 -11.305 1.00 4.53 H ATOM 138 HD2 LYS A 11 6.866 7.964 -9.800 1.00 62.21 H ATOM 139 HD3 LYS A 11 6.465 6.269 -9.515 1.00 33.32 H ATOM 140 HE2 LYS A 11 8.421 5.925 -10.591 1.00 24.41 H ATOM 141 HE3 LYS A 11 7.407 6.095 -12.022 1.00 51.15 H ATOM 142 HZ1 LYS A 11 8.072 8.344 -12.268 1.00 73.20 H ATOM 143 HZ2 LYS A 11 9.485 7.441 -12.042 1.00 50.43 H ATOM 144 HZ3 LYS A 11 8.855 8.359 -10.769 1.00 3.11 H ATOM 145 N ASN A 12 1.412 4.624 -10.368 1.00 24.41 N ATOM 146 CA ASN A 12 0.925 3.287 -10.047 1.00 3.14 C ATOM 147 C ASN A 12 -0.599 3.240 -10.086 1.00 31.34 C ATOM 148 O ASN A 12 -1.266 3.083 -9.063 1.00 35.02 O ATOM 149 CB ASN A 12 1.425 2.858 -8.666 1.00 31.24 C ATOM 150 CG ASN A 12 2.929 2.669 -8.628 1.00 61.41 C ATOM 151 OD1 ASN A 12 3.430 1.555 -8.784 1.00 71.21 O ATOM 152 ND2 ASN A 12 3.657 3.759 -8.420 1.00 44.30 N ATOM 153 H ASN A 12 0.857 5.400 -10.147 1.00 41.40 H ATOM 154 HA ASN A 12 1.314 2.606 -10.788 1.00 62.41 H ATOM 155 HB2 ASN A 12 1.159 3.615 -7.942 1.00 72.40 H ATOM 156 HB3 ASN A 12 0.956 1.924 -8.393 1.00 52.43 H ATOM 157 HD21 ASN A 12 4.633 3.666 -8.392 1.00 35.23 H ATOM 158 HD22 ASN A 12 3.190 4.613 -8.304 1.00 43.20 H ATOM 159 N PRO A 13 -1.165 3.378 -11.294 1.00 23.31 N ATOM 160 CA PRO A 13 -2.616 3.353 -11.496 1.00 34.20 C ATOM 161 C PRO A 13 -3.210 1.967 -11.268 1.00 62.22 C ATOM 162 O PRO A 13 -4.421 1.818 -11.113 1.00 70.22 O ATOM 163 CB PRO A 13 -2.778 3.770 -12.960 1.00 21.30 C ATOM 164 CG PRO A 13 -1.491 3.388 -13.607 1.00 12.13 C ATOM 165 CD PRO A 13 -0.430 3.568 -12.556 1.00 75.01 C ATOM 166 HA PRO A 13 -3.118 4.067 -10.859 1.00 61.12 H ATOM 167 HB2 PRO A 13 -3.613 3.241 -13.397 1.00 71.34 H ATOM 168 HB3 PRO A 13 -2.948 4.834 -13.018 1.00 54.13 H ATOM 169 HG2 PRO A 13 -1.532 2.358 -13.926 1.00 20.00 H ATOM 170 HG3 PRO A 13 -1.298 4.036 -14.449 1.00 2.23 H ATOM 171 HD2 PRO A 13 0.343 2.822 -12.669 1.00 15.32 H ATOM 172 HD3 PRO A 13 -0.010 4.561 -12.611 1.00 0.33 H ATOM 173 N ASN A 14 -2.348 0.955 -11.249 1.00 10.12 N ATOM 174 CA ASN A 14 -2.788 -0.420 -11.040 1.00 2.31 C ATOM 175 C ASN A 14 -3.049 -0.688 -9.561 1.00 20.41 C ATOM 176 O ASN A 14 -3.545 -1.753 -9.190 1.00 62.31 O ATOM 177 CB ASN A 14 -1.739 -1.399 -11.570 1.00 43.02 C ATOM 178 CG ASN A 14 -1.870 -1.635 -13.062 1.00 51.15 C ATOM 179 OD1 ASN A 14 -2.200 -0.722 -13.820 1.00 30.12 O ATOM 180 ND2 ASN A 14 -1.612 -2.865 -13.492 1.00 1.31 N ATOM 181 H ASN A 14 -1.394 1.137 -11.378 1.00 62.15 H ATOM 182 HA ASN A 14 -3.708 -0.560 -11.587 1.00 64.13 H ATOM 183 HB2 ASN A 14 -0.753 -1.002 -11.374 1.00 31.54 H ATOM 184 HB3 ASN A 14 -1.849 -2.346 -11.063 1.00 52.42 H ATOM 185 HD21 ASN A 14 -1.689 -3.045 -14.452 1.00 45.21 H ATOM 186 HD22 ASN A 14 -1.355 -3.542 -12.831 1.00 43.43 H ATOM 187 N LEU A 15 -2.713 0.284 -8.720 1.00 63.24 N ATOM 188 CA LEU A 15 -2.911 0.153 -7.281 1.00 52.40 C ATOM 189 C LEU A 15 -3.844 1.242 -6.759 1.00 64.11 C ATOM 190 O LEU A 15 -4.834 0.956 -6.086 1.00 31.42 O ATOM 191 CB LEU A 15 -1.568 0.224 -6.553 1.00 1.34 C ATOM 192 CG LEU A 15 -1.091 -1.072 -5.897 1.00 22.02 C ATOM 193 CD1 LEU A 15 0.224 -0.848 -5.166 1.00 12.03 C ATOM 194 CD2 LEU A 15 -2.149 -1.608 -4.943 1.00 63.25 C ATOM 195 H LEU A 15 -2.322 1.109 -9.075 1.00 2.01 H ATOM 196 HA LEU A 15 -3.362 -0.810 -7.095 1.00 11.12 H ATOM 197 HB2 LEU A 15 -0.819 0.527 -7.268 1.00 54.43 H ATOM 198 HB3 LEU A 15 -1.651 0.976 -5.780 1.00 43.05 H ATOM 199 HG LEU A 15 -0.923 -1.816 -6.664 1.00 1.51 H ATOM 200 HD11 LEU A 15 0.758 -0.031 -5.627 1.00 73.34 H ATOM 201 HD12 LEU A 15 0.822 -1.745 -5.219 1.00 25.24 H ATOM 202 HD13 LEU A 15 0.024 -0.609 -4.131 1.00 61.52 H ATOM 203 HD21 LEU A 15 -2.825 -0.812 -4.672 1.00 13.22 H ATOM 204 HD22 LEU A 15 -1.670 -1.993 -4.055 1.00 71.32 H ATOM 205 HD23 LEU A 15 -2.701 -2.401 -5.427 1.00 65.24 H ATOM 206 N CYS A 16 -3.522 2.492 -7.076 1.00 24.50 N ATOM 207 CA CYS A 16 -4.330 3.624 -6.641 1.00 75.23 C ATOM 208 C CYS A 16 -4.297 4.745 -7.676 1.00 12.12 C ATOM 209 O CYS A 16 -3.586 4.658 -8.677 1.00 3.13 O ATOM 210 CB CYS A 16 -3.832 4.145 -5.292 1.00 14.02 C ATOM 211 SG CYS A 16 -4.960 5.330 -4.490 1.00 72.11 S ATOM 212 H CYS A 16 -2.719 2.657 -7.616 1.00 34.23 H ATOM 213 HA CYS A 16 -5.348 3.282 -6.532 1.00 14.12 H ATOM 214 HB2 CYS A 16 -3.701 3.310 -4.618 1.00 53.44 H ATOM 215 HB3 CYS A 16 -2.882 4.639 -5.434 1.00 35.23 H TER 216 CYS A 16 ENDMDL MODEL 11 ATOM 1 N GLY A 1 3.161 -0.073 -0.474 1.00 73.42 N ATOM 2 CA GLY A 1 2.037 0.143 -1.367 1.00 1.12 C ATOM 3 C GLY A 1 2.115 1.476 -2.084 1.00 41.13 C ATOM 4 O GLY A 1 3.114 2.189 -1.979 1.00 72.34 O ATOM 5 H1 GLY A 1 4.039 0.301 -0.696 1.00 1.04 H ATOM 6 HA2 GLY A 1 2.017 -0.649 -2.101 1.00 13.52 H ATOM 7 HA3 GLY A 1 1.124 0.110 -0.791 1.00 55.43 H ATOM 8 N CYS A 2 1.060 1.814 -2.817 1.00 53.24 N ATOM 9 CA CYS A 2 1.013 3.069 -3.558 1.00 14.33 C ATOM 10 C CYS A 2 -0.410 3.620 -3.604 1.00 43.41 C ATOM 11 O CYS A 2 -1.267 3.098 -4.318 1.00 3.42 O ATOM 12 CB CYS A 2 1.540 2.867 -4.980 1.00 14.03 C ATOM 13 SG CYS A 2 2.942 3.946 -5.414 1.00 13.15 S ATOM 14 H CYS A 2 0.293 1.204 -2.862 1.00 51.22 H ATOM 15 HA CYS A 2 1.644 3.780 -3.047 1.00 22.02 H ATOM 16 HB2 CYS A 2 1.867 1.844 -5.092 1.00 32.52 H ATOM 17 HB3 CYS A 2 0.743 3.064 -5.682 1.00 21.31 H ATOM 18 N CYS A 3 -0.653 4.679 -2.838 1.00 74.34 N ATOM 19 CA CYS A 3 -1.971 5.302 -2.791 1.00 24.32 C ATOM 20 C CYS A 3 -1.952 6.546 -1.908 1.00 12.13 C ATOM 21 O CYS A 3 -2.704 7.494 -2.137 1.00 22.43 O ATOM 22 CB CYS A 3 -3.009 4.307 -2.268 1.00 55.54 C ATOM 23 SG CYS A 3 -4.735 4.844 -2.500 1.00 42.41 S ATOM 24 H CYS A 3 0.071 5.050 -2.291 1.00 51.31 H ATOM 25 HA CYS A 3 -2.237 5.592 -3.796 1.00 2.54 H ATOM 26 HB2 CYS A 3 -2.887 3.366 -2.785 1.00 11.34 H ATOM 27 HB3 CYS A 3 -2.851 4.155 -1.211 1.00 51.30 H ATOM 28 N SER A 4 -1.088 6.536 -0.898 1.00 21.51 N ATOM 29 CA SER A 4 -0.973 7.661 0.022 1.00 15.11 C ATOM 30 C SER A 4 -0.200 8.810 -0.619 1.00 34.14 C ATOM 31 O SER A 4 -0.100 9.897 -0.052 1.00 13.11 O ATOM 32 CB SER A 4 -0.281 7.223 1.314 1.00 63.12 C ATOM 33 OG SER A 4 -0.972 7.707 2.453 1.00 64.25 O ATOM 34 H SER A 4 -0.515 5.751 -0.767 1.00 75.42 H ATOM 35 HA SER A 4 -1.971 8.001 0.256 1.00 34.32 H ATOM 36 HB2 SER A 4 -0.252 6.145 1.356 1.00 34.22 H ATOM 37 HB3 SER A 4 0.728 7.611 1.327 1.00 33.54 H ATOM 38 HG SER A 4 -0.338 7.961 3.128 1.00 72.33 H ATOM 39 N ASN A 5 0.345 8.559 -1.804 1.00 52.14 N ATOM 40 CA ASN A 5 1.110 9.571 -2.523 1.00 50.43 C ATOM 41 C ASN A 5 0.306 10.132 -3.693 1.00 3.23 C ATOM 42 O ASN A 5 -0.476 9.430 -4.334 1.00 13.34 O ATOM 43 CB ASN A 5 2.426 8.980 -3.032 1.00 4.14 C ATOM 44 CG ASN A 5 3.615 9.412 -2.195 1.00 63.10 C ATOM 45 OD1 ASN A 5 4.120 10.525 -2.341 1.00 53.43 O ATOM 46 ND2 ASN A 5 4.069 8.530 -1.312 1.00 60.33 N ATOM 47 H ASN A 5 0.230 7.672 -2.206 1.00 4.43 H ATOM 48 HA ASN A 5 1.328 10.373 -1.834 1.00 42.21 H ATOM 49 HB2 ASN A 5 2.364 7.902 -3.004 1.00 21.12 H ATOM 50 HB3 ASN A 5 2.590 9.301 -4.049 1.00 55.13 H ATOM 51 HD21 ASN A 5 4.836 8.783 -0.758 1.00 3.02 H ATOM 52 HD22 ASN A 5 3.618 7.662 -1.251 1.00 32.32 H ATOM 53 N PRO A 6 0.503 11.428 -3.979 1.00 23.33 N ATOM 54 CA PRO A 6 -0.193 12.112 -5.073 1.00 22.53 C ATOM 55 C PRO A 6 0.275 11.637 -6.444 1.00 61.51 C ATOM 56 O PRO A 6 -0.489 11.647 -7.409 1.00 22.22 O ATOM 57 CB PRO A 6 0.175 13.583 -4.862 1.00 74.53 C ATOM 58 CG PRO A 6 1.471 13.548 -4.129 1.00 42.15 C ATOM 59 CD PRO A 6 1.421 12.325 -3.257 1.00 21.44 C ATOM 60 HA PRO A 6 -1.264 11.992 -4.998 1.00 23.13 H ATOM 61 HB2 PRO A 6 0.275 14.072 -5.821 1.00 35.10 H ATOM 62 HB3 PRO A 6 -0.594 14.070 -4.281 1.00 70.25 H ATOM 63 HG2 PRO A 6 2.288 13.475 -4.831 1.00 71.13 H ATOM 64 HG3 PRO A 6 1.574 14.436 -3.524 1.00 13.24 H ATOM 65 HD2 PRO A 6 2.403 11.883 -3.169 1.00 73.02 H ATOM 66 HD3 PRO A 6 1.029 12.573 -2.281 1.00 73.34 H ATOM 67 N ALA A 7 1.535 11.220 -6.523 1.00 52.30 N ATOM 68 CA ALA A 7 2.103 10.739 -7.776 1.00 2.10 C ATOM 69 C ALA A 7 1.887 9.238 -7.936 1.00 41.12 C ATOM 70 O ALA A 7 1.895 8.715 -9.051 1.00 22.32 O ATOM 71 CB ALA A 7 3.586 11.071 -7.845 1.00 25.05 C ATOM 72 H ALA A 7 2.095 11.236 -5.719 1.00 75.01 H ATOM 73 HA ALA A 7 1.607 11.253 -8.587 1.00 34.32 H ATOM 74 HB1 ALA A 7 4.140 10.370 -7.237 1.00 33.24 H ATOM 75 HB2 ALA A 7 3.923 11.004 -8.868 1.00 41.43 H ATOM 76 HB3 ALA A 7 3.748 12.073 -7.476 1.00 62.12 H ATOM 77 N CYS A 8 1.695 8.550 -6.816 1.00 34.11 N ATOM 78 CA CYS A 8 1.477 7.108 -6.831 1.00 44.32 C ATOM 79 C CYS A 8 0.277 6.748 -7.702 1.00 2.30 C ATOM 80 O CYS A 8 0.160 5.620 -8.180 1.00 2.24 O ATOM 81 CB CYS A 8 1.263 6.589 -5.408 1.00 63.32 C ATOM 82 SG CYS A 8 2.714 5.748 -4.697 1.00 65.45 S ATOM 83 H CYS A 8 1.699 9.023 -5.957 1.00 10.22 H ATOM 84 HA CYS A 8 2.359 6.644 -7.246 1.00 3.14 H ATOM 85 HB2 CYS A 8 1.018 7.420 -4.763 1.00 34.30 H ATOM 86 HB3 CYS A 8 0.443 5.886 -5.409 1.00 42.04 H ATOM 87 N MET A 9 -0.612 7.715 -7.904 1.00 3.42 N ATOM 88 CA MET A 9 -1.802 7.501 -8.718 1.00 73.23 C ATOM 89 C MET A 9 -1.476 7.629 -10.203 1.00 2.12 C ATOM 90 O MET A 9 -2.195 7.105 -11.055 1.00 1.05 O ATOM 91 CB MET A 9 -2.895 8.501 -8.336 1.00 42.21 C ATOM 92 CG MET A 9 -3.500 8.246 -6.965 1.00 40.02 C ATOM 93 SD MET A 9 -3.403 9.686 -5.884 1.00 62.22 S ATOM 94 CE MET A 9 -5.008 9.623 -5.091 1.00 64.14 C ATOM 95 H MET A 9 -0.464 8.595 -7.497 1.00 21.55 H ATOM 96 HA MET A 9 -2.159 6.500 -8.525 1.00 54.43 H ATOM 97 HB2 MET A 9 -2.474 9.495 -8.341 1.00 4.45 H ATOM 98 HB3 MET A 9 -3.686 8.451 -9.070 1.00 22.45 H ATOM 99 HG2 MET A 9 -4.538 7.977 -7.089 1.00 33.42 H ATOM 100 HG3 MET A 9 -2.971 7.427 -6.501 1.00 2.23 H ATOM 101 HE1 MET A 9 -5.782 9.718 -5.839 1.00 1.42 H ATOM 102 HE2 MET A 9 -5.118 8.680 -4.577 1.00 35.12 H ATOM 103 HE3 MET A 9 -5.090 10.432 -4.381 1.00 40.44 H ATOM 104 N LEU A 10 -0.388 8.329 -10.506 1.00 71.23 N ATOM 105 CA LEU A 10 0.034 8.526 -11.889 1.00 14.11 C ATOM 106 C LEU A 10 1.191 7.598 -12.243 1.00 21.12 C ATOM 107 O LEU A 10 1.494 7.385 -13.417 1.00 41.21 O ATOM 108 CB LEU A 10 0.445 9.982 -12.114 1.00 50.04 C ATOM 109 CG LEU A 10 -0.623 11.035 -11.818 1.00 13.03 C ATOM 110 CD1 LEU A 10 0.020 12.332 -11.352 1.00 63.12 C ATOM 111 CD2 LEU A 10 -1.489 11.278 -13.046 1.00 24.33 C ATOM 112 H LEU A 10 0.145 8.722 -9.785 1.00 13.34 H ATOM 113 HA LEU A 10 -0.806 8.295 -12.527 1.00 61.54 H ATOM 114 HB2 LEU A 10 1.295 10.187 -11.483 1.00 24.15 H ATOM 115 HB3 LEU A 10 0.735 10.086 -13.150 1.00 50.14 H ATOM 116 HG LEU A 10 -1.262 10.676 -11.023 1.00 15.23 H ATOM 117 HD11 LEU A 10 0.785 12.113 -10.622 1.00 72.44 H ATOM 118 HD12 LEU A 10 -0.731 12.967 -10.907 1.00 31.01 H ATOM 119 HD13 LEU A 10 0.463 12.838 -12.198 1.00 22.42 H ATOM 120 HD21 LEU A 10 -2.334 10.606 -13.029 1.00 0.13 H ATOM 121 HD22 LEU A 10 -0.905 11.100 -13.937 1.00 53.42 H ATOM 122 HD23 LEU A 10 -1.839 12.300 -13.043 1.00 34.34 H ATOM 123 N LYS A 11 1.834 7.046 -11.220 1.00 30.35 N ATOM 124 CA LYS A 11 2.956 6.137 -11.421 1.00 23.10 C ATOM 125 C LYS A 11 2.554 4.698 -11.112 1.00 52.40 C ATOM 126 O LYS A 11 3.288 3.760 -11.418 1.00 33.44 O ATOM 127 CB LYS A 11 4.137 6.548 -10.538 1.00 51.14 C ATOM 128 CG LYS A 11 5.344 7.031 -11.324 1.00 11.55 C ATOM 129 CD LYS A 11 6.629 6.860 -10.532 1.00 3.55 C ATOM 130 CE LYS A 11 6.789 7.953 -9.486 1.00 1.24 C ATOM 131 NZ LYS A 11 7.702 7.538 -8.385 1.00 3.21 N ATOM 132 H LYS A 11 1.546 7.254 -10.306 1.00 33.14 H ATOM 133 HA LYS A 11 3.253 6.200 -12.457 1.00 11.51 H ATOM 134 HB2 LYS A 11 3.819 7.344 -9.881 1.00 22.34 H ATOM 135 HB3 LYS A 11 4.438 5.699 -9.942 1.00 62.44 H ATOM 136 HG2 LYS A 11 5.419 6.462 -12.238 1.00 51.10 H ATOM 137 HG3 LYS A 11 5.213 8.078 -11.559 1.00 2.32 H ATOM 138 HD2 LYS A 11 6.611 5.902 -10.034 1.00 40.13 H ATOM 139 HD3 LYS A 11 7.469 6.899 -11.211 1.00 53.45 H ATOM 140 HE2 LYS A 11 7.191 8.834 -9.963 1.00 22.25 H ATOM 141 HE3 LYS A 11 5.818 8.180 -9.070 1.00 43.33 H ATOM 142 HZ1 LYS A 11 8.218 8.363 -8.018 1.00 0.20 H ATOM 143 HZ2 LYS A 11 8.390 6.841 -8.735 1.00 74.53 H ATOM 144 HZ3 LYS A 11 7.157 7.111 -7.610 1.00 35.11 H ATOM 145 N ASN A 12 1.383 4.534 -10.506 1.00 34.44 N ATOM 146 CA ASN A 12 0.882 3.209 -10.156 1.00 65.15 C ATOM 147 C ASN A 12 -0.643 3.182 -10.170 1.00 1.54 C ATOM 148 O ASN A 12 -1.295 3.050 -9.134 1.00 12.42 O ATOM 149 CB ASN A 12 1.399 2.793 -8.778 1.00 20.04 C ATOM 150 CG ASN A 12 2.901 2.583 -8.762 1.00 71.01 C ATOM 151 OD1 ASN A 12 3.383 1.460 -8.910 1.00 4.12 O ATOM 152 ND2 ASN A 12 3.648 3.666 -8.582 1.00 53.22 N ATOM 153 H ASN A 12 0.842 5.321 -10.287 1.00 51.23 H ATOM 154 HA ASN A 12 1.249 2.511 -10.894 1.00 5.20 H ATOM 155 HB2 ASN A 12 1.156 3.564 -8.061 1.00 54.11 H ATOM 156 HB3 ASN A 12 0.922 1.870 -8.484 1.00 15.43 H ATOM 157 HD21 ASN A 12 4.622 3.559 -8.569 1.00 13.35 H ATOM 158 HD22 ASN A 12 3.195 4.528 -8.471 1.00 55.21 H ATOM 159 N PRO A 13 -1.227 3.310 -11.370 1.00 44.45 N ATOM 160 CA PRO A 13 -2.682 3.303 -11.548 1.00 44.12 C ATOM 161 C PRO A 13 -3.290 1.929 -11.290 1.00 13.12 C ATOM 162 O PRO A 13 -4.501 1.800 -11.111 1.00 64.34 O ATOM 163 CB PRO A 13 -2.862 3.700 -13.015 1.00 43.35 C ATOM 164 CG PRO A 13 -1.591 3.291 -13.677 1.00 54.14 C ATOM 165 CD PRO A 13 -0.511 3.472 -12.647 1.00 61.43 C ATOM 166 HA PRO A 13 -3.162 4.034 -10.914 1.00 75.51 H ATOM 167 HB2 PRO A 13 -3.711 3.177 -13.431 1.00 73.21 H ATOM 168 HB3 PRO A 13 -3.018 4.766 -13.087 1.00 54.10 H ATOM 169 HG2 PRO A 13 -1.652 2.257 -13.980 1.00 63.04 H ATOM 170 HG3 PRO A 13 -1.403 3.924 -14.532 1.00 60.22 H ATOM 171 HD2 PRO A 13 0.250 2.713 -12.761 1.00 53.54 H ATOM 172 HD3 PRO A 13 -0.078 4.458 -12.724 1.00 24.03 H ATOM 173 N ASN A 14 -2.443 0.906 -11.271 1.00 24.53 N ATOM 174 CA ASN A 14 -2.898 -0.460 -11.034 1.00 1.40 C ATOM 175 C ASN A 14 -3.137 -0.703 -9.547 1.00 24.31 C ATOM 176 O ASN A 14 -3.640 -1.756 -9.152 1.00 0.21 O ATOM 177 CB ASN A 14 -1.872 -1.461 -11.568 1.00 72.42 C ATOM 178 CG ASN A 14 -1.645 -1.316 -13.061 1.00 33.24 C ATOM 179 OD1 ASN A 14 -0.925 -0.423 -13.506 1.00 64.01 O ATOM 180 ND2 ASN A 14 -2.262 -2.196 -13.841 1.00 24.31 N ATOM 181 H ASN A 14 -1.488 1.072 -11.420 1.00 34.23 H ATOM 182 HA ASN A 14 -3.829 -0.595 -11.563 1.00 52.31 H ATOM 183 HB2 ASN A 14 -0.930 -1.306 -11.064 1.00 4.23 H ATOM 184 HB3 ASN A 14 -2.220 -2.464 -11.371 1.00 72.10 H ATOM 185 HD21 ASN A 14 -2.132 -2.126 -14.810 1.00 2.13 H ATOM 186 HD22 ASN A 14 -2.820 -2.881 -13.416 1.00 54.43 H ATOM 187 N LEU A 15 -2.773 0.276 -8.727 1.00 4.32 N ATOM 188 CA LEU A 15 -2.947 0.170 -7.282 1.00 74.44 C ATOM 189 C LEU A 15 -3.856 1.278 -6.761 1.00 11.05 C ATOM 190 O LEU A 15 -4.838 1.015 -6.066 1.00 33.11 O ATOM 191 CB LEU A 15 -1.591 0.233 -6.579 1.00 23.14 C ATOM 192 CG LEU A 15 -1.119 -1.060 -5.912 1.00 54.00 C ATOM 193 CD1 LEU A 15 0.211 -0.843 -5.207 1.00 74.12 C ATOM 194 CD2 LEU A 15 -2.167 -1.568 -4.933 1.00 15.14 C ATOM 195 H LEU A 15 -2.377 1.091 -9.100 1.00 60.02 H ATOM 196 HA LEU A 15 -3.408 -0.785 -7.074 1.00 42.31 H ATOM 197 HB2 LEU A 15 -0.851 0.515 -7.312 1.00 1.43 H ATOM 198 HB3 LEU A 15 -1.650 0.997 -5.816 1.00 61.14 H ATOM 199 HG LEU A 15 -0.975 -1.817 -6.671 1.00 1.22 H ATOM 200 HD11 LEU A 15 0.324 0.203 -4.968 1.00 5.25 H ATOM 201 HD12 LEU A 15 1.016 -1.154 -5.856 1.00 4.33 H ATOM 202 HD13 LEU A 15 0.236 -1.426 -4.298 1.00 75.33 H ATOM 203 HD21 LEU A 15 -1.682 -2.110 -4.135 1.00 20.10 H ATOM 204 HD22 LEU A 15 -2.854 -2.223 -5.448 1.00 62.24 H ATOM 205 HD23 LEU A 15 -2.711 -0.730 -4.521 1.00 11.14 H ATOM 206 N CYS A 16 -3.523 2.518 -7.101 1.00 52.53 N ATOM 207 CA CYS A 16 -4.309 3.668 -6.669 1.00 72.23 C ATOM 208 C CYS A 16 -4.278 4.774 -7.720 1.00 3.21 C ATOM 209 O CYS A 16 -3.583 4.664 -8.730 1.00 42.21 O ATOM 210 CB CYS A 16 -3.782 4.201 -5.336 1.00 22.43 C ATOM 211 SG CYS A 16 -4.879 5.413 -4.533 1.00 41.53 S ATOM 212 H CYS A 16 -2.728 2.665 -7.657 1.00 54.03 H ATOM 213 HA CYS A 16 -5.330 3.342 -6.538 1.00 63.34 H ATOM 214 HB2 CYS A 16 -3.652 3.374 -4.652 1.00 72.25 H ATOM 215 HB3 CYS A 16 -2.827 4.678 -5.500 1.00 11.13 H TER 216 CYS A 16 ENDMDL MODEL 12 ATOM 1 N GLY A 1 1.730 0.248 0.343 1.00 4.33 N ATOM 2 CA GLY A 1 1.862 0.189 -1.101 1.00 1.03 C ATOM 3 C GLY A 1 1.905 1.565 -1.736 1.00 22.31 C ATOM 4 O GLY A 1 2.604 2.457 -1.255 1.00 12.31 O ATOM 5 H1 GLY A 1 2.032 -0.506 0.892 1.00 2.43 H ATOM 6 HA2 GLY A 1 2.771 -0.339 -1.347 1.00 5.50 H ATOM 7 HA3 GLY A 1 1.021 -0.355 -1.505 1.00 63.23 H ATOM 8 N CYS A 2 1.158 1.737 -2.821 1.00 12.20 N ATOM 9 CA CYS A 2 1.114 3.013 -3.525 1.00 63.02 C ATOM 10 C CYS A 2 -0.300 3.587 -3.525 1.00 23.25 C ATOM 11 O CYS A 2 -1.181 3.097 -4.231 1.00 61.24 O ATOM 12 CB CYS A 2 1.606 2.842 -4.964 1.00 5.22 C ATOM 13 SG CYS A 2 3.019 3.908 -5.398 1.00 20.53 S ATOM 14 H CYS A 2 0.622 0.988 -3.157 1.00 71.51 H ATOM 15 HA CYS A 2 1.768 3.699 -3.009 1.00 43.44 H ATOM 16 HB2 CYS A 2 1.912 1.817 -5.112 1.00 72.42 H ATOM 17 HB3 CYS A 2 0.799 3.074 -5.642 1.00 72.53 H ATOM 18 N CYS A 3 -0.509 4.628 -2.726 1.00 50.44 N ATOM 19 CA CYS A 3 -1.815 5.270 -2.632 1.00 43.13 C ATOM 20 C CYS A 3 -1.756 6.490 -1.718 1.00 54.40 C ATOM 21 O CYS A 3 -2.498 7.455 -1.905 1.00 32.13 O ATOM 22 CB CYS A 3 -2.857 4.279 -2.112 1.00 32.51 C ATOM 23 SG CYS A 3 -4.579 4.847 -2.291 1.00 64.14 S ATOM 24 H CYS A 3 0.233 4.974 -2.187 1.00 3.54 H ATOM 25 HA CYS A 3 -2.099 5.591 -3.623 1.00 0.12 H ATOM 26 HB2 CYS A 3 -2.761 3.349 -2.654 1.00 42.01 H ATOM 27 HB3 CYS A 3 -2.678 4.097 -1.062 1.00 40.25 H ATOM 28 N SER A 4 -0.869 6.440 -0.729 1.00 54.44 N ATOM 29 CA SER A 4 -0.716 7.540 0.216 1.00 31.45 C ATOM 30 C SER A 4 0.060 8.693 -0.412 1.00 52.02 C ATOM 31 O SER A 4 0.191 9.763 0.180 1.00 15.21 O ATOM 32 CB SER A 4 -0.001 7.057 1.480 1.00 44.32 C ATOM 33 OG SER A 4 -0.658 7.521 2.647 1.00 62.14 O ATOM 34 H SER A 4 -0.306 5.644 -0.633 1.00 34.35 H ATOM 35 HA SER A 4 -1.703 7.888 0.483 1.00 61.13 H ATOM 36 HB2 SER A 4 0.012 5.978 1.493 1.00 4.24 H ATOM 37 HB3 SER A 4 1.014 7.430 1.480 1.00 73.20 H ATOM 38 HG SER A 4 -1.499 7.069 2.741 1.00 34.12 H ATOM 39 N ASN A 5 0.573 8.466 -1.617 1.00 71.50 N ATOM 40 CA ASN A 5 1.337 9.485 -2.327 1.00 71.23 C ATOM 41 C ASN A 5 0.516 10.086 -3.464 1.00 42.02 C ATOM 42 O ASN A 5 -0.291 9.412 -4.104 1.00 61.25 O ATOM 43 CB ASN A 5 2.633 8.888 -2.879 1.00 61.03 C ATOM 44 CG ASN A 5 3.846 9.282 -2.059 1.00 42.22 C ATOM 45 OD1 ASN A 5 3.942 10.410 -1.574 1.00 35.42 O ATOM 46 ND2 ASN A 5 4.781 8.352 -1.901 1.00 41.44 N ATOM 47 H ASN A 5 0.435 7.592 -2.039 1.00 31.45 H ATOM 48 HA ASN A 5 1.582 10.266 -1.623 1.00 72.24 H ATOM 49 HB2 ASN A 5 2.556 7.810 -2.877 1.00 12.35 H ATOM 50 HB3 ASN A 5 2.778 9.232 -3.892 1.00 64.22 H ATOM 51 HD21 ASN A 5 5.576 8.580 -1.375 1.00 53.31 H ATOM 52 HD22 ASN A 5 4.638 7.476 -2.317 1.00 10.31 H ATOM 53 N PRO A 6 0.726 11.385 -3.723 1.00 3.32 N ATOM 54 CA PRO A 6 0.017 12.106 -4.784 1.00 14.23 C ATOM 55 C PRO A 6 0.447 11.659 -6.176 1.00 71.35 C ATOM 56 O PRO A 6 -0.338 11.704 -7.123 1.00 70.32 O ATOM 57 CB PRO A 6 0.411 13.566 -4.546 1.00 33.05 C ATOM 58 CG PRO A 6 1.722 13.494 -3.843 1.00 45.50 C ATOM 59 CD PRO A 6 1.673 12.251 -3.000 1.00 22.44 C ATOM 60 HA PRO A 6 -1.054 12.000 -4.688 1.00 11.34 H ATOM 61 HB2 PRO A 6 0.497 14.078 -5.494 1.00 32.51 H ATOM 62 HB3 PRO A 6 -0.337 14.050 -3.936 1.00 35.22 H ATOM 63 HG2 PRO A 6 2.522 13.427 -4.565 1.00 23.14 H ATOM 64 HG3 PRO A 6 1.852 14.366 -3.218 1.00 33.30 H ATOM 65 HD2 PRO A 6 2.650 11.793 -2.945 1.00 73.31 H ATOM 66 HD3 PRO A 6 1.306 12.480 -2.010 1.00 23.00 H ATOM 67 N ALA A 7 1.698 11.227 -6.294 1.00 22.30 N ATOM 68 CA ALA A 7 2.232 10.769 -7.571 1.00 35.32 C ATOM 69 C ALA A 7 1.989 9.275 -7.763 1.00 4.41 C ATOM 70 O ALA A 7 1.965 8.780 -8.890 1.00 22.10 O ATOM 71 CB ALA A 7 3.718 11.081 -7.664 1.00 72.35 C ATOM 72 H ALA A 7 2.276 11.215 -5.503 1.00 32.43 H ATOM 73 HA ALA A 7 1.725 11.309 -8.357 1.00 50.44 H ATOM 74 HB1 ALA A 7 3.967 11.336 -8.684 1.00 45.11 H ATOM 75 HB2 ALA A 7 3.952 11.912 -7.017 1.00 3.22 H ATOM 76 HB3 ALA A 7 4.287 10.215 -7.360 1.00 52.03 H ATOM 77 N CYS A 8 1.811 8.562 -6.656 1.00 4.41 N ATOM 78 CA CYS A 8 1.572 7.125 -6.702 1.00 23.03 C ATOM 79 C CYS A 8 0.348 6.804 -7.554 1.00 51.10 C ATOM 80 O CYS A 8 0.204 5.690 -8.056 1.00 54.05 O ATOM 81 CB CYS A 8 1.382 6.573 -5.287 1.00 54.34 C ATOM 82 SG CYS A 8 2.835 5.694 -4.630 1.00 63.22 S ATOM 83 H CYS A 8 1.842 9.014 -5.786 1.00 13.13 H ATOM 84 HA CYS A 8 2.438 6.659 -7.147 1.00 32.50 H ATOM 85 HB2 CYS A 8 1.163 7.391 -4.617 1.00 13.43 H ATOM 86 HB3 CYS A 8 0.551 5.883 -5.288 1.00 22.25 H ATOM 87 N MET A 9 -0.531 7.789 -7.712 1.00 64.31 N ATOM 88 CA MET A 9 -1.742 7.612 -8.505 1.00 22.32 C ATOM 89 C MET A 9 -1.446 7.772 -9.993 1.00 11.14 C ATOM 90 O MET A 9 -2.192 7.280 -10.841 1.00 24.13 O ATOM 91 CB MET A 9 -2.811 8.618 -8.074 1.00 24.01 C ATOM 92 CG MET A 9 -4.162 8.387 -8.730 1.00 13.13 C ATOM 93 SD MET A 9 -5.475 8.092 -7.530 1.00 32.23 S ATOM 94 CE MET A 9 -6.804 7.560 -8.606 1.00 73.30 C ATOM 95 H MET A 9 -0.361 8.655 -7.287 1.00 3.23 H ATOM 96 HA MET A 9 -2.110 6.612 -8.329 1.00 4.05 H ATOM 97 HB2 MET A 9 -2.938 8.554 -7.004 1.00 32.43 H ATOM 98 HB3 MET A 9 -2.476 9.612 -8.330 1.00 13.45 H ATOM 99 HG2 MET A 9 -4.418 9.258 -9.314 1.00 11.52 H ATOM 100 HG3 MET A 9 -4.089 7.529 -9.381 1.00 65.22 H ATOM 101 HE1 MET A 9 -7.421 6.840 -8.087 1.00 40.01 H ATOM 102 HE2 MET A 9 -7.405 8.413 -8.886 1.00 24.32 H ATOM 103 HE3 MET A 9 -6.389 7.105 -9.493 1.00 43.20 H ATOM 104 N LEU A 10 -0.355 8.463 -10.303 1.00 51.31 N ATOM 105 CA LEU A 10 0.039 8.689 -11.689 1.00 61.25 C ATOM 106 C LEU A 10 1.174 7.753 -12.092 1.00 4.11 C ATOM 107 O LEU A 10 1.448 7.565 -13.277 1.00 43.35 O ATOM 108 CB LEU A 10 0.467 10.144 -11.888 1.00 63.24 C ATOM 109 CG LEU A 10 -0.471 11.204 -11.312 1.00 55.53 C ATOM 110 CD1 LEU A 10 0.179 12.578 -11.365 1.00 11.20 C ATOM 111 CD2 LEU A 10 -1.795 11.210 -12.063 1.00 70.22 C ATOM 112 H LEU A 10 0.199 8.831 -9.584 1.00 43.01 H ATOM 113 HA LEU A 10 -0.818 8.485 -12.315 1.00 4.54 H ATOM 114 HB2 LEU A 10 1.433 10.270 -11.424 1.00 43.43 H ATOM 115 HB3 LEU A 10 0.554 10.320 -12.951 1.00 65.42 H ATOM 116 HG LEU A 10 -0.675 10.972 -10.276 1.00 62.40 H ATOM 117 HD11 LEU A 10 0.529 12.772 -12.367 1.00 51.54 H ATOM 118 HD12 LEU A 10 1.013 12.608 -10.680 1.00 63.21 H ATOM 119 HD13 LEU A 10 -0.544 13.330 -11.083 1.00 73.33 H ATOM 120 HD21 LEU A 10 -1.626 11.500 -13.089 1.00 45.43 H ATOM 121 HD22 LEU A 10 -2.470 11.912 -11.597 1.00 32.24 H ATOM 122 HD23 LEU A 10 -2.229 10.221 -12.035 1.00 63.52 H ATOM 123 N LYS A 11 1.831 7.166 -11.097 1.00 43.31 N ATOM 124 CA LYS A 11 2.935 6.247 -11.346 1.00 21.41 C ATOM 125 C LYS A 11 2.518 4.807 -11.064 1.00 32.15 C ATOM 126 O LYS A 11 3.231 3.865 -11.409 1.00 14.45 O ATOM 127 CB LYS A 11 4.141 6.619 -10.480 1.00 32.51 C ATOM 128 CG LYS A 11 5.337 7.104 -11.280 1.00 25.23 C ATOM 129 CD LYS A 11 6.637 6.895 -10.521 1.00 22.22 C ATOM 130 CE LYS A 11 7.040 8.143 -9.751 1.00 13.05 C ATOM 131 NZ LYS A 11 8.344 7.968 -9.054 1.00 44.42 N ATOM 132 H LYS A 11 1.566 7.356 -10.172 1.00 63.11 H ATOM 133 HA LYS A 11 3.210 6.332 -12.386 1.00 72.33 H ATOM 134 HB2 LYS A 11 3.850 7.402 -9.796 1.00 33.12 H ATOM 135 HB3 LYS A 11 4.442 5.750 -9.912 1.00 4.11 H ATOM 136 HG2 LYS A 11 5.384 6.556 -12.209 1.00 50.22 H ATOM 137 HG3 LYS A 11 5.217 8.158 -11.486 1.00 62.13 H ATOM 138 HD2 LYS A 11 6.510 6.081 -9.823 1.00 71.40 H ATOM 139 HD3 LYS A 11 7.419 6.649 -11.225 1.00 65.10 H ATOM 140 HE2 LYS A 11 7.118 8.967 -10.442 1.00 43.54 H ATOM 141 HE3 LYS A 11 6.276 8.360 -9.018 1.00 23.41 H ATOM 142 HZ1 LYS A 11 8.744 8.896 -8.805 1.00 71.34 H ATOM 143 HZ2 LYS A 11 9.015 7.468 -9.672 1.00 51.34 H ATOM 144 HZ3 LYS A 11 8.214 7.414 -8.184 1.00 54.40 H ATOM 145 N ASN A 12 1.358 4.644 -10.435 1.00 50.03 N ATOM 146 CA ASN A 12 0.846 3.318 -10.108 1.00 13.42 C ATOM 147 C ASN A 12 -0.680 3.314 -10.088 1.00 1.44 C ATOM 148 O ASN A 12 -1.311 3.166 -9.041 1.00 73.22 O ATOM 149 CB ASN A 12 1.386 2.861 -8.751 1.00 70.24 C ATOM 150 CG ASN A 12 2.884 2.629 -8.774 1.00 65.25 C ATOM 151 OD1 ASN A 12 3.347 1.503 -8.960 1.00 53.04 O ATOM 152 ND2 ASN A 12 3.651 3.696 -8.585 1.00 2.33 N ATOM 153 H ASN A 12 0.834 5.434 -10.186 1.00 21.34 H ATOM 154 HA ASN A 12 1.186 2.634 -10.870 1.00 51.02 H ATOM 155 HB2 ASN A 12 1.170 3.617 -8.011 1.00 12.20 H ATOM 156 HB3 ASN A 12 0.901 1.938 -8.470 1.00 3.22 H ATOM 157 HD21 ASN A 12 4.624 3.575 -8.595 1.00 74.04 H ATOM 158 HD22 ASN A 12 3.214 4.562 -8.443 1.00 34.34 H ATOM 159 N PRO A 13 -1.288 3.481 -11.272 1.00 23.03 N ATOM 160 CA PRO A 13 -2.746 3.499 -11.417 1.00 52.21 C ATOM 161 C PRO A 13 -3.370 2.128 -11.179 1.00 43.14 C ATOM 162 O PRO A 13 -4.578 2.012 -10.979 1.00 22.35 O ATOM 163 CB PRO A 13 -2.952 3.936 -12.870 1.00 34.23 C ATOM 164 CG PRO A 13 -1.703 3.525 -13.570 1.00 31.03 C ATOM 165 CD PRO A 13 -0.598 3.664 -12.560 1.00 22.23 C ATOM 166 HA PRO A 13 -3.202 4.220 -10.755 1.00 10.45 H ATOM 167 HB2 PRO A 13 -3.819 3.435 -13.279 1.00 44.21 H ATOM 168 HB3 PRO A 13 -3.095 5.005 -12.911 1.00 45.23 H ATOM 169 HG2 PRO A 13 -1.786 2.500 -13.897 1.00 23.22 H ATOM 170 HG3 PRO A 13 -1.524 4.176 -14.413 1.00 10.15 H ATOM 171 HD2 PRO A 13 0.149 2.898 -12.710 1.00 34.25 H ATOM 172 HD3 PRO A 13 -0.151 4.645 -12.621 1.00 55.43 H ATOM 173 N ASN A 14 -2.537 1.092 -11.203 1.00 51.42 N ATOM 174 CA ASN A 14 -3.008 -0.272 -10.990 1.00 44.52 C ATOM 175 C ASN A 14 -3.219 -0.548 -9.505 1.00 22.33 C ATOM 176 O ASN A 14 -3.730 -1.603 -9.125 1.00 11.41 O ATOM 177 CB ASN A 14 -2.008 -1.274 -11.570 1.00 72.42 C ATOM 178 CG ASN A 14 -2.042 -1.313 -13.086 1.00 24.12 C ATOM 179 OD1 ASN A 14 -1.623 -0.366 -13.751 1.00 44.04 O ATOM 180 ND2 ASN A 14 -2.542 -2.412 -13.639 1.00 10.04 N ATOM 181 H ASN A 14 -1.584 1.249 -11.368 1.00 62.43 H ATOM 182 HA ASN A 14 -3.952 -0.380 -11.503 1.00 24.24 H ATOM 183 HB2 ASN A 14 -1.011 -1.001 -11.258 1.00 43.44 H ATOM 184 HB3 ASN A 14 -2.239 -2.261 -11.198 1.00 13.14 H ATOM 185 HD21 ASN A 14 -2.575 -2.464 -14.617 1.00 1.24 H ATOM 186 HD22 ASN A 14 -2.857 -3.126 -13.046 1.00 73.31 H ATOM 187 N LEU A 15 -2.823 0.405 -8.669 1.00 4.11 N ATOM 188 CA LEU A 15 -2.969 0.265 -7.224 1.00 42.32 C ATOM 189 C LEU A 15 -3.849 1.374 -6.656 1.00 43.20 C ATOM 190 O LEU A 15 -4.820 1.109 -5.947 1.00 50.02 O ATOM 191 CB LEU A 15 -1.597 0.290 -6.548 1.00 42.41 C ATOM 192 CG LEU A 15 -1.132 -1.026 -5.924 1.00 10.11 C ATOM 193 CD1 LEU A 15 0.216 -0.847 -5.243 1.00 11.13 C ATOM 194 CD2 LEU A 15 -2.167 -1.542 -4.935 1.00 11.00 C ATOM 195 H LEU A 15 -2.422 1.223 -9.031 1.00 33.34 H ATOM 196 HA LEU A 15 -3.440 -0.687 -7.030 1.00 3.25 H ATOM 197 HB2 LEU A 15 -0.868 0.580 -7.290 1.00 32.14 H ATOM 198 HB3 LEU A 15 -1.628 1.036 -5.766 1.00 70.22 H ATOM 199 HG LEU A 15 -1.015 -1.766 -6.704 1.00 54.40 H ATOM 200 HD11 LEU A 15 0.947 -1.482 -5.719 1.00 31.41 H ATOM 201 HD12 LEU A 15 0.130 -1.115 -4.200 1.00 5.30 H ATOM 202 HD13 LEU A 15 0.526 0.185 -5.325 1.00 23.53 H ATOM 203 HD21 LEU A 15 -1.734 -2.331 -4.339 1.00 65.33 H ATOM 204 HD22 LEU A 15 -3.020 -1.925 -5.475 1.00 74.10 H ATOM 205 HD23 LEU A 15 -2.482 -0.735 -4.290 1.00 14.41 H ATOM 206 N CYS A 16 -3.503 2.617 -6.974 1.00 14.55 N ATOM 207 CA CYS A 16 -4.262 3.768 -6.497 1.00 20.41 C ATOM 208 C CYS A 16 -4.237 4.898 -7.521 1.00 42.34 C ATOM 209 O CYS A 16 -4.760 4.758 -8.627 1.00 44.42 O ATOM 210 CB CYS A 16 -3.697 4.260 -5.163 1.00 40.42 C ATOM 211 SG CYS A 16 -4.759 5.468 -4.307 1.00 25.02 S ATOM 212 H CYS A 16 -2.718 2.766 -7.543 1.00 34.44 H ATOM 213 HA CYS A 16 -5.284 3.454 -6.351 1.00 32.32 H ATOM 214 HB2 CYS A 16 -3.564 3.415 -4.503 1.00 44.44 H ATOM 215 HB3 CYS A 16 -2.740 4.729 -5.338 1.00 23.24 H TER 216 CYS A 16 ENDMDL MODEL 13 ATOM 1 N GLY A 1 1.664 0.267 0.420 1.00 33.11 N ATOM 2 CA GLY A 1 1.775 0.203 -1.025 1.00 54.55 C ATOM 3 C GLY A 1 1.796 1.577 -1.666 1.00 53.11 C ATOM 4 O GLY A 1 2.436 2.498 -1.158 1.00 22.23 O ATOM 5 H1 GLY A 1 1.283 -0.489 0.914 1.00 21.31 H ATOM 6 HA2 GLY A 1 2.685 -0.317 -1.283 1.00 50.33 H ATOM 7 HA3 GLY A 1 0.933 -0.350 -1.416 1.00 11.24 H ATOM 8 N CYS A 2 1.095 1.716 -2.787 1.00 0.55 N ATOM 9 CA CYS A 2 1.037 2.987 -3.500 1.00 31.33 C ATOM 10 C CYS A 2 -0.391 3.522 -3.541 1.00 54.31 C ATOM 11 O CYS A 2 -1.239 3.005 -4.269 1.00 53.43 O ATOM 12 CB CYS A 2 1.573 2.821 -4.923 1.00 53.22 C ATOM 13 SG CYS A 2 2.967 3.923 -5.325 1.00 71.45 S ATOM 14 H CYS A 2 0.605 0.945 -3.143 1.00 54.42 H ATOM 15 HA CYS A 2 1.658 3.693 -2.970 1.00 51.25 H ATOM 16 HB2 CYS A 2 1.910 1.804 -5.057 1.00 20.45 H ATOM 17 HB3 CYS A 2 0.778 3.026 -5.625 1.00 11.31 H ATOM 18 N CYS A 3 -0.651 4.562 -2.755 1.00 25.21 N ATOM 19 CA CYS A 3 -1.975 5.169 -2.700 1.00 60.44 C ATOM 20 C CYS A 3 -1.975 6.395 -1.792 1.00 24.42 C ATOM 21 O CYS A 3 -2.736 7.338 -2.004 1.00 73.14 O ATOM 22 CB CYS A 3 -3.005 4.152 -2.203 1.00 44.02 C ATOM 23 SG CYS A 3 -4.735 4.673 -2.432 1.00 40.45 S ATOM 24 H CYS A 3 0.067 4.930 -2.197 1.00 1.22 H ATOM 25 HA CYS A 3 -2.240 5.477 -3.700 1.00 73.01 H ATOM 26 HB2 CYS A 3 -2.869 3.223 -2.738 1.00 22.03 H ATOM 27 HB3 CYS A 3 -2.849 3.980 -1.148 1.00 53.34 H ATOM 28 N SER A 4 -1.114 6.373 -0.779 1.00 14.23 N ATOM 29 CA SER A 4 -1.017 7.481 0.165 1.00 62.22 C ATOM 30 C SER A 4 -0.255 8.651 -0.449 1.00 5.33 C ATOM 31 O SER A 4 -0.170 9.728 0.140 1.00 21.14 O ATOM 32 CB SER A 4 -0.324 7.024 1.450 1.00 12.02 C ATOM 33 OG SER A 4 -1.025 7.477 2.596 1.00 71.44 O ATOM 34 H SER A 4 -0.533 5.592 -0.662 1.00 14.32 H ATOM 35 HA SER A 4 -2.020 7.804 0.402 1.00 64.15 H ATOM 36 HB2 SER A 4 -0.284 5.946 1.471 1.00 62.44 H ATOM 37 HB3 SER A 4 0.680 7.423 1.476 1.00 73.41 H ATOM 38 HG SER A 4 -1.559 6.761 2.948 1.00 21.11 H ATOM 39 N ASN A 5 0.299 8.431 -1.637 1.00 11.21 N ATOM 40 CA ASN A 5 1.055 9.467 -2.331 1.00 62.15 C ATOM 41 C ASN A 5 0.250 10.041 -3.493 1.00 44.44 C ATOM 42 O ASN A 5 -0.521 9.343 -4.152 1.00 43.31 O ATOM 43 CB ASN A 5 2.381 8.902 -2.845 1.00 21.21 C ATOM 44 CG ASN A 5 3.561 9.331 -1.994 1.00 34.44 C ATOM 45 OD1 ASN A 5 3.390 9.801 -0.869 1.00 1.31 O ATOM 46 ND2 ASN A 5 4.765 9.169 -2.528 1.00 45.42 N ATOM 47 H ASN A 5 0.197 7.552 -2.057 1.00 32.43 H ATOM 48 HA ASN A 5 1.260 10.257 -1.625 1.00 43.22 H ATOM 49 HB2 ASN A 5 2.332 7.823 -2.839 1.00 74.43 H ATOM 50 HB3 ASN A 5 2.545 9.245 -3.855 1.00 44.40 H ATOM 51 HD21 ASN A 5 5.546 9.438 -1.999 1.00 73.44 H ATOM 52 HD22 ASN A 5 4.825 8.788 -3.429 1.00 43.23 H ATOM 53 N PRO A 6 0.433 11.345 -3.753 1.00 23.35 N ATOM 54 CA PRO A 6 -0.266 12.042 -4.836 1.00 62.01 C ATOM 55 C PRO A 6 0.214 11.600 -6.214 1.00 42.13 C ATOM 56 O PRO A 6 -0.545 11.621 -7.182 1.00 72.44 O ATOM 57 CB PRO A 6 0.083 13.513 -4.594 1.00 60.35 C ATOM 58 CG PRO A 6 1.376 13.479 -3.856 1.00 65.10 C ATOM 59 CD PRO A 6 1.337 12.238 -3.008 1.00 71.20 C ATOM 60 HA PRO A 6 -1.336 11.908 -4.769 1.00 5.23 H ATOM 61 HB2 PRO A 6 0.182 14.022 -5.543 1.00 14.33 H ATOM 62 HB3 PRO A 6 -0.694 13.979 -4.008 1.00 11.11 H ATOM 63 HG2 PRO A 6 2.197 13.429 -4.555 1.00 43.51 H ATOM 64 HG3 PRO A 6 1.465 14.356 -3.232 1.00 64.10 H ATOM 65 HD2 PRO A 6 2.323 11.806 -2.925 1.00 3.14 H ATOM 66 HD3 PRO A 6 0.937 12.462 -2.030 1.00 70.40 H ATOM 67 N ALA A 7 1.479 11.201 -6.295 1.00 62.43 N ATOM 68 CA ALA A 7 2.059 10.751 -7.555 1.00 2.42 C ATOM 69 C ALA A 7 1.862 9.251 -7.746 1.00 54.52 C ATOM 70 O ALA A 7 1.881 8.751 -8.871 1.00 21.20 O ATOM 71 CB ALA A 7 3.539 11.102 -7.609 1.00 72.12 C ATOM 72 H ALA A 7 2.035 11.207 -5.488 1.00 71.14 H ATOM 73 HA ALA A 7 1.561 11.275 -8.358 1.00 14.34 H ATOM 74 HB1 ALA A 7 4.029 10.728 -6.722 1.00 63.32 H ATOM 75 HB2 ALA A 7 3.983 10.652 -8.484 1.00 63.51 H ATOM 76 HB3 ALA A 7 3.653 12.174 -7.658 1.00 53.44 H ATOM 77 N CYS A 8 1.672 8.539 -6.641 1.00 20.41 N ATOM 78 CA CYS A 8 1.472 7.095 -6.686 1.00 51.31 C ATOM 79 C CYS A 8 0.280 6.739 -7.570 1.00 21.20 C ATOM 80 O CYS A 8 0.179 5.619 -8.071 1.00 12.24 O ATOM 81 CB CYS A 8 1.257 6.545 -5.275 1.00 21.40 C ATOM 82 SG CYS A 8 2.715 5.707 -4.574 1.00 31.21 S ATOM 83 H CYS A 8 1.667 8.995 -5.772 1.00 72.44 H ATOM 84 HA CYS A 8 2.361 6.650 -7.105 1.00 62.24 H ATOM 85 HB2 CYS A 8 0.998 7.360 -4.614 1.00 64.55 H ATOM 86 HB3 CYS A 8 0.446 5.832 -5.294 1.00 54.44 H ATOM 87 N MET A 9 -0.619 7.699 -7.757 1.00 11.31 N ATOM 88 CA MET A 9 -1.803 7.487 -8.581 1.00 51.34 C ATOM 89 C MET A 9 -1.471 7.649 -10.061 1.00 40.04 C ATOM 90 O MET A 9 -2.180 7.134 -10.927 1.00 62.31 O ATOM 91 CB MET A 9 -2.909 8.467 -8.185 1.00 11.11 C ATOM 92 CG MET A 9 -3.921 7.881 -7.214 1.00 22.24 C ATOM 93 SD MET A 9 -4.470 9.074 -5.979 1.00 15.22 S ATOM 94 CE MET A 9 -5.370 10.234 -7.006 1.00 34.45 C ATOM 95 H MET A 9 -0.483 8.572 -7.331 1.00 75.24 H ATOM 96 HA MET A 9 -2.149 6.479 -8.410 1.00 54.13 H ATOM 97 HB2 MET A 9 -2.458 9.333 -7.723 1.00 33.42 H ATOM 98 HB3 MET A 9 -3.436 8.777 -9.075 1.00 44.22 H ATOM 99 HG2 MET A 9 -4.781 7.540 -7.771 1.00 45.33 H ATOM 100 HG3 MET A 9 -3.468 7.041 -6.707 1.00 43.51 H ATOM 101 HE1 MET A 9 -4.670 10.842 -7.559 1.00 51.15 H ATOM 102 HE2 MET A 9 -6.000 9.691 -7.695 1.00 63.22 H ATOM 103 HE3 MET A 9 -5.983 10.867 -6.381 1.00 61.20 H ATOM 104 N LEU A 10 -0.390 8.367 -10.345 1.00 53.35 N ATOM 105 CA LEU A 10 0.036 8.597 -11.722 1.00 13.23 C ATOM 106 C LEU A 10 1.206 7.690 -12.088 1.00 52.03 C ATOM 107 O LEU A 10 1.517 7.504 -13.265 1.00 1.41 O ATOM 108 CB LEU A 10 0.431 10.062 -11.916 1.00 52.12 C ATOM 109 CG LEU A 10 -0.608 11.100 -11.489 1.00 60.24 C ATOM 110 CD1 LEU A 10 0.065 12.420 -11.149 1.00 3.22 C ATOM 111 CD2 LEU A 10 -1.647 11.296 -12.584 1.00 30.42 C ATOM 112 H LEU A 10 0.134 8.753 -9.613 1.00 64.44 H ATOM 113 HA LEU A 10 -0.798 8.369 -12.369 1.00 21.40 H ATOM 114 HB2 LEU A 10 1.330 10.240 -11.346 1.00 54.51 H ATOM 115 HB3 LEU A 10 0.637 10.211 -12.967 1.00 2.45 H ATOM 116 HG LEU A 10 -1.117 10.747 -10.603 1.00 20.10 H ATOM 117 HD11 LEU A 10 -0.531 12.951 -10.422 1.00 4.11 H ATOM 118 HD12 LEU A 10 0.159 13.018 -12.043 1.00 72.24 H ATOM 119 HD13 LEU A 10 1.047 12.229 -10.740 1.00 72.21 H ATOM 120 HD21 LEU A 10 -1.409 10.660 -13.424 1.00 34.14 H ATOM 121 HD22 LEU A 10 -1.645 12.328 -12.901 1.00 63.01 H ATOM 122 HD23 LEU A 10 -2.625 11.039 -12.202 1.00 24.20 H ATOM 123 N LYS A 11 1.850 7.125 -11.073 1.00 23.11 N ATOM 124 CA LYS A 11 2.984 6.234 -11.287 1.00 22.32 C ATOM 125 C LYS A 11 2.597 4.785 -11.009 1.00 24.44 C ATOM 126 O LYS A 11 3.344 3.861 -11.329 1.00 72.22 O ATOM 127 CB LYS A 11 4.156 6.641 -10.390 1.00 54.02 C ATOM 128 CG LYS A 11 5.360 7.154 -11.159 1.00 45.45 C ATOM 129 CD LYS A 11 6.644 6.984 -10.364 1.00 51.10 C ATOM 130 CE LYS A 11 7.805 7.718 -11.016 1.00 44.41 C ATOM 131 NZ LYS A 11 8.809 8.170 -10.013 1.00 42.11 N ATOM 132 H LYS A 11 1.555 7.311 -10.157 1.00 1.45 H ATOM 133 HA LYS A 11 3.285 6.321 -12.320 1.00 0.43 H ATOM 134 HB2 LYS A 11 3.825 7.419 -9.718 1.00 43.32 H ATOM 135 HB3 LYS A 11 4.464 5.783 -9.810 1.00 2.31 H ATOM 136 HG2 LYS A 11 5.447 6.604 -12.084 1.00 63.33 H ATOM 137 HG3 LYS A 11 5.218 8.204 -11.375 1.00 71.22 H ATOM 138 HD2 LYS A 11 6.496 7.379 -9.370 1.00 22.43 H ATOM 139 HD3 LYS A 11 6.883 5.932 -10.304 1.00 32.42 H ATOM 140 HE2 LYS A 11 8.285 7.054 -11.719 1.00 0.53 H ATOM 141 HE3 LYS A 11 7.420 8.580 -11.541 1.00 0.23 H ATOM 142 HZ1 LYS A 11 9.770 8.067 -10.397 1.00 71.32 H ATOM 143 HZ2 LYS A 11 8.730 7.600 -9.147 1.00 20.40 H ATOM 144 HZ3 LYS A 11 8.649 9.169 -9.772 1.00 61.13 H ATOM 145 N ASN A 12 1.425 4.594 -10.411 1.00 64.05 N ATOM 146 CA ASN A 12 0.939 3.257 -10.091 1.00 63.33 C ATOM 147 C ASN A 12 -0.586 3.213 -10.113 1.00 24.34 C ATOM 148 O ASN A 12 -1.241 3.052 -9.083 1.00 12.11 O ATOM 149 CB ASN A 12 1.454 2.819 -8.718 1.00 42.45 C ATOM 150 CG ASN A 12 2.958 2.627 -8.700 1.00 23.14 C ATOM 151 OD1 ASN A 12 3.455 1.513 -8.867 1.00 72.13 O ATOM 152 ND2 ASN A 12 3.691 3.715 -8.494 1.00 64.04 N ATOM 153 H ASN A 12 0.874 5.371 -10.180 1.00 63.32 H ATOM 154 HA ASN A 12 1.318 2.578 -10.841 1.00 0.32 H ATOM 155 HB2 ASN A 12 1.198 3.573 -7.988 1.00 2.10 H ATOM 156 HB3 ASN A 12 0.986 1.886 -8.445 1.00 63.44 H ATOM 157 HD21 ASN A 12 4.667 3.619 -8.478 1.00 55.20 H ATOM 158 HD22 ASN A 12 3.227 4.569 -8.369 1.00 5.25 H ATOM 159 N PRO A 13 -1.165 3.358 -11.314 1.00 20.14 N ATOM 160 CA PRO A 13 -2.619 3.337 -11.499 1.00 30.03 C ATOM 161 C PRO A 13 -3.213 1.951 -11.271 1.00 25.01 C ATOM 162 O PRO A 13 -4.422 1.804 -11.102 1.00 31.24 O ATOM 163 CB PRO A 13 -2.797 3.761 -12.959 1.00 2.54 C ATOM 164 CG PRO A 13 -1.519 3.381 -13.622 1.00 64.42 C ATOM 165 CD PRO A 13 -0.445 3.553 -12.583 1.00 52.03 C ATOM 166 HA PRO A 13 -3.111 4.049 -10.853 1.00 35.25 H ATOM 167 HB2 PRO A 13 -3.638 3.236 -13.389 1.00 11.52 H ATOM 168 HB3 PRO A 13 -2.966 4.827 -13.010 1.00 22.44 H ATOM 169 HG2 PRO A 13 -1.565 2.352 -13.946 1.00 52.22 H ATOM 170 HG3 PRO A 13 -1.334 4.032 -14.463 1.00 44.52 H ATOM 171 HD2 PRO A 13 0.325 2.806 -12.709 1.00 11.42 H ATOM 172 HD3 PRO A 13 -0.023 4.546 -12.638 1.00 33.22 H ATOM 173 N ASN A 14 -2.353 0.937 -11.268 1.00 1.33 N ATOM 174 CA ASN A 14 -2.793 -0.438 -11.061 1.00 11.55 C ATOM 175 C ASN A 14 -3.036 -0.714 -9.580 1.00 13.41 C ATOM 176 O ASN A 14 -3.529 -1.780 -9.209 1.00 14.44 O ATOM 177 CB ASN A 14 -1.753 -1.416 -11.609 1.00 62.21 C ATOM 178 CG ASN A 14 -1.990 -1.755 -13.068 1.00 54.21 C ATOM 179 OD1 ASN A 14 -1.168 -1.445 -13.931 1.00 34.04 O ATOM 180 ND2 ASN A 14 -3.120 -2.394 -13.351 1.00 3.03 N ATOM 181 H ASN A 14 -1.400 1.118 -11.408 1.00 61.22 H ATOM 182 HA ASN A 14 -3.720 -0.573 -11.597 1.00 61.02 H ATOM 183 HB2 ASN A 14 -0.770 -0.977 -11.517 1.00 52.53 H ATOM 184 HB3 ASN A 14 -1.789 -2.330 -11.036 1.00 22.14 H ATOM 185 HD21 ASN A 14 -3.298 -2.626 -14.286 1.00 13.31 H ATOM 186 HD22 ASN A 14 -3.728 -2.608 -12.612 1.00 62.45 H ATOM 187 N LEU A 15 -2.688 0.254 -8.739 1.00 21.55 N ATOM 188 CA LEU A 15 -2.869 0.116 -7.298 1.00 22.15 C ATOM 189 C LEU A 15 -3.793 1.203 -6.758 1.00 72.15 C ATOM 190 O LEU A 15 -4.776 0.914 -6.074 1.00 44.44 O ATOM 191 CB LEU A 15 -1.517 0.181 -6.585 1.00 45.24 C ATOM 192 CG LEU A 15 -1.033 -1.119 -5.942 1.00 72.12 C ATOM 193 CD1 LEU A 15 0.291 -0.901 -5.226 1.00 54.34 C ATOM 194 CD2 LEU A 15 -2.080 -1.659 -4.978 1.00 51.45 C ATOM 195 H LEU A 15 -2.300 1.080 -9.094 1.00 10.05 H ATOM 196 HA LEU A 15 -3.319 -0.848 -7.111 1.00 2.33 H ATOM 197 HB2 LEU A 15 -0.776 0.487 -7.309 1.00 35.12 H ATOM 198 HB3 LEU A 15 -1.589 0.929 -5.808 1.00 44.15 H ATOM 199 HG LEU A 15 -0.876 -1.859 -6.715 1.00 50.11 H ATOM 200 HD11 LEU A 15 1.050 -1.522 -5.677 1.00 0.34 H ATOM 201 HD12 LEU A 15 0.183 -1.162 -4.184 1.00 4.41 H ATOM 202 HD13 LEU A 15 0.578 0.137 -5.309 1.00 54.54 H ATOM 203 HD21 LEU A 15 -2.640 -0.837 -4.559 1.00 13.45 H ATOM 204 HD22 LEU A 15 -1.591 -2.204 -4.185 1.00 21.10 H ATOM 205 HD23 LEU A 15 -2.751 -2.319 -5.509 1.00 21.13 H ATOM 206 N CYS A 16 -3.473 2.454 -7.073 1.00 34.32 N ATOM 207 CA CYS A 16 -4.275 3.585 -6.622 1.00 72.22 C ATOM 208 C CYS A 16 -4.252 4.712 -7.651 1.00 35.22 C ATOM 209 O CYS A 16 -4.947 4.653 -8.666 1.00 30.14 O ATOM 210 CB CYS A 16 -3.760 4.098 -5.276 1.00 32.21 C ATOM 211 SG CYS A 16 -4.876 5.281 -4.455 1.00 31.32 S ATOM 212 H CYS A 16 -2.678 2.621 -7.622 1.00 23.34 H ATOM 213 HA CYS A 16 -5.292 3.244 -6.502 1.00 53.04 H ATOM 214 HB2 CYS A 16 -3.623 3.259 -4.609 1.00 11.44 H ATOM 215 HB3 CYS A 16 -2.811 4.590 -5.426 1.00 50.43 H TER 216 CYS A 16 ENDMDL MODEL 14 ATOM 1 N GLY A 1 0.499 -0.419 -1.062 1.00 21.31 N ATOM 2 CA GLY A 1 1.845 0.123 -1.085 1.00 21.20 C ATOM 3 C GLY A 1 1.905 1.498 -1.720 1.00 64.21 C ATOM 4 O GLY A 1 2.666 2.361 -1.280 1.00 71.50 O ATOM 5 H1 GLY A 1 0.286 -1.172 -0.471 1.00 1.21 H ATOM 6 HA2 GLY A 1 2.212 0.189 -0.072 1.00 2.23 H ATOM 7 HA3 GLY A 1 2.481 -0.547 -1.644 1.00 62.45 H ATOM 8 N CYS A 2 1.103 1.704 -2.759 1.00 62.53 N ATOM 9 CA CYS A 2 1.069 2.982 -3.458 1.00 42.44 C ATOM 10 C CYS A 2 -0.343 3.561 -3.466 1.00 22.12 C ATOM 11 O CYS A 2 -1.220 3.077 -4.182 1.00 12.32 O ATOM 12 CB CYS A 2 1.572 2.816 -4.894 1.00 14.10 C ATOM 13 SG CYS A 2 2.990 3.880 -5.313 1.00 73.14 S ATOM 14 H CYS A 2 0.519 0.977 -3.064 1.00 62.22 H ATOM 15 HA CYS A 2 1.722 3.664 -2.935 1.00 14.42 H ATOM 16 HB2 CYS A 2 1.876 1.790 -5.044 1.00 52.31 H ATOM 17 HB3 CYS A 2 0.769 3.052 -5.578 1.00 25.25 H ATOM 18 N CYS A 3 -0.555 4.599 -2.664 1.00 41.44 N ATOM 19 CA CYS A 3 -1.859 5.245 -2.577 1.00 71.12 C ATOM 20 C CYS A 3 -1.804 6.461 -1.657 1.00 21.34 C ATOM 21 O CYS A 3 -2.541 7.429 -1.844 1.00 61.54 O ATOM 22 CB CYS A 3 -2.909 4.254 -2.070 1.00 1.43 C ATOM 23 SG CYS A 3 -4.627 4.830 -2.259 1.00 61.31 S ATOM 24 H CYS A 3 0.184 4.940 -2.117 1.00 44.32 H ATOM 25 HA CYS A 3 -2.135 5.572 -3.568 1.00 63.33 H ATOM 26 HB2 CYS A 3 -2.812 3.327 -2.616 1.00 4.40 H ATOM 27 HB3 CYS A 3 -2.738 4.067 -1.020 1.00 11.11 H ATOM 28 N SER A 4 -0.925 6.403 -0.661 1.00 62.23 N ATOM 29 CA SER A 4 -0.775 7.497 0.291 1.00 32.01 C ATOM 30 C SER A 4 0.010 8.651 -0.326 1.00 33.41 C ATOM 31 O SER A 4 0.139 9.718 0.272 1.00 30.35 O ATOM 32 CB SER A 4 -0.071 7.006 1.558 1.00 54.13 C ATOM 33 OG SER A 4 -0.736 7.467 2.721 1.00 30.34 O ATOM 34 H SER A 4 -0.365 5.604 -0.564 1.00 33.21 H ATOM 35 HA SER A 4 -1.763 7.847 0.551 1.00 1.41 H ATOM 36 HB2 SER A 4 -0.063 5.927 1.566 1.00 24.23 H ATOM 37 HB3 SER A 4 0.944 7.375 1.568 1.00 62.35 H ATOM 38 HG SER A 4 -0.782 6.757 3.366 1.00 30.12 H ATOM 39 N ASN A 5 0.532 8.427 -1.527 1.00 71.05 N ATOM 40 CA ASN A 5 1.305 9.447 -2.227 1.00 21.13 C ATOM 41 C ASN A 5 0.495 10.057 -3.366 1.00 41.53 C ATOM 42 O ASN A 5 -0.310 9.390 -4.016 1.00 63.23 O ATOM 43 CB ASN A 5 2.603 8.848 -2.772 1.00 71.13 C ATOM 44 CG ASN A 5 3.812 9.233 -1.941 1.00 54.04 C ATOM 45 OD1 ASN A 5 4.425 10.277 -2.164 1.00 61.24 O ATOM 46 ND2 ASN A 5 4.160 8.389 -0.977 1.00 14.11 N ATOM 47 H ASN A 5 0.395 7.555 -1.954 1.00 54.51 H ATOM 48 HA ASN A 5 1.548 10.223 -1.517 1.00 11.21 H ATOM 49 HB2 ASN A 5 2.521 7.771 -2.776 1.00 24.41 H ATOM 50 HB3 ASN A 5 2.757 9.197 -3.782 1.00 70.54 H ATOM 51 HD21 ASN A 5 4.937 8.614 -0.424 1.00 71.21 H ATOM 52 HD22 ASN A 5 3.625 7.577 -0.857 1.00 34.40 H ATOM 53 N PRO A 6 0.712 11.357 -3.616 1.00 51.41 N ATOM 54 CA PRO A 6 0.013 12.087 -4.678 1.00 72.33 C ATOM 55 C PRO A 6 0.452 11.645 -6.070 1.00 52.33 C ATOM 56 O PRO A 6 -0.326 11.699 -7.023 1.00 4.13 O ATOM 57 CB PRO A 6 0.411 13.544 -4.429 1.00 75.32 C ATOM 58 CG PRO A 6 1.717 13.463 -3.717 1.00 52.44 C ATOM 59 CD PRO A 6 1.657 12.215 -2.881 1.00 54.12 C ATOM 60 HA PRO A 6 -1.059 11.984 -4.591 1.00 1.32 H ATOM 61 HB2 PRO A 6 0.506 14.060 -5.374 1.00 55.11 H ATOM 62 HB3 PRO A 6 -0.340 14.027 -3.822 1.00 74.14 H ATOM 63 HG2 PRO A 6 2.522 13.397 -4.433 1.00 73.23 H ATOM 64 HG3 PRO A 6 1.845 14.331 -3.087 1.00 35.34 H ATOM 65 HD2 PRO A 6 2.631 11.753 -2.822 1.00 0.20 H ATOM 66 HD3 PRO A 6 1.283 12.440 -1.893 1.00 42.41 H ATOM 67 N ALA A 7 1.702 11.209 -6.181 1.00 21.53 N ATOM 68 CA ALA A 7 2.243 10.755 -7.456 1.00 42.41 C ATOM 69 C ALA A 7 1.997 9.264 -7.658 1.00 51.12 C ATOM 70 O ALA A 7 1.979 8.775 -8.788 1.00 61.11 O ATOM 71 CB ALA A 7 3.731 11.062 -7.537 1.00 3.21 C ATOM 72 H ALA A 7 2.274 11.189 -5.385 1.00 54.31 H ATOM 73 HA ALA A 7 1.745 11.302 -8.243 1.00 54.34 H ATOM 74 HB1 ALA A 7 3.877 12.133 -7.546 1.00 61.34 H ATOM 75 HB2 ALA A 7 4.233 10.638 -6.680 1.00 62.44 H ATOM 76 HB3 ALA A 7 4.138 10.635 -8.441 1.00 51.34 H ATOM 77 N CYS A 8 1.808 8.546 -6.556 1.00 70.34 N ATOM 78 CA CYS A 8 1.564 7.110 -6.612 1.00 32.52 C ATOM 79 C CYS A 8 0.345 6.798 -7.475 1.00 35.01 C ATOM 80 O CYS A 8 0.200 5.687 -7.985 1.00 12.33 O ATOM 81 CB CYS A 8 1.361 6.551 -5.202 1.00 74.21 C ATOM 82 SG CYS A 8 2.806 5.663 -4.539 1.00 23.32 S ATOM 83 H CYS A 8 1.834 8.993 -5.684 1.00 34.45 H ATOM 84 HA CYS A 8 2.431 6.642 -7.053 1.00 52.23 H ATOM 85 HB2 CYS A 8 1.140 7.366 -4.529 1.00 15.15 H ATOM 86 HB3 CYS A 8 0.528 5.863 -5.212 1.00 51.32 H ATOM 87 N MET A 9 -0.529 7.787 -7.634 1.00 32.32 N ATOM 88 CA MET A 9 -1.735 7.619 -8.436 1.00 72.33 C ATOM 89 C MET A 9 -1.428 7.786 -9.921 1.00 50.11 C ATOM 90 O MET A 9 -2.169 7.302 -10.777 1.00 73.33 O ATOM 91 CB MET A 9 -2.803 8.627 -8.008 1.00 33.43 C ATOM 92 CG MET A 9 -4.209 8.049 -7.982 1.00 60.42 C ATOM 93 SD MET A 9 -5.484 9.315 -8.128 1.00 43.44 S ATOM 94 CE MET A 9 -6.547 8.584 -9.370 1.00 34.31 C ATOM 95 H MET A 9 -0.359 8.650 -7.202 1.00 52.23 H ATOM 96 HA MET A 9 -2.108 6.619 -8.268 1.00 50.53 H ATOM 97 HB2 MET A 9 -2.567 8.985 -7.017 1.00 65.21 H ATOM 98 HB3 MET A 9 -2.793 9.459 -8.695 1.00 43.32 H ATOM 99 HG2 MET A 9 -4.315 7.356 -8.804 1.00 4.20 H ATOM 100 HG3 MET A 9 -4.349 7.522 -7.050 1.00 73.40 H ATOM 101 HE1 MET A 9 -7.445 9.177 -9.469 1.00 61.13 H ATOM 102 HE2 MET A 9 -6.029 8.554 -10.317 1.00 3.24 H ATOM 103 HE3 MET A 9 -6.810 7.580 -9.072 1.00 31.53 H ATOM 104 N LEU A 10 -0.332 8.475 -10.220 1.00 21.43 N ATOM 105 CA LEU A 10 0.073 8.706 -11.602 1.00 3.21 C ATOM 106 C LEU A 10 1.208 7.768 -12.001 1.00 40.31 C ATOM 107 O LEU A 10 1.490 7.586 -13.186 1.00 31.03 O ATOM 108 CB LEU A 10 0.509 10.161 -11.790 1.00 35.44 C ATOM 109 CG LEU A 10 -0.547 11.222 -11.480 1.00 12.44 C ATOM 110 CD1 LEU A 10 0.027 12.618 -11.671 1.00 72.30 C ATOM 111 CD2 LEU A 10 -1.776 11.024 -12.355 1.00 41.51 C ATOM 112 H LEU A 10 0.219 8.836 -9.495 1.00 13.04 H ATOM 113 HA LEU A 10 -0.780 8.510 -12.234 1.00 65.44 H ATOM 114 HB2 LEU A 10 1.355 10.338 -11.144 1.00 41.25 H ATOM 115 HB3 LEU A 10 0.811 10.284 -12.820 1.00 10.01 H ATOM 116 HG LEU A 10 -0.852 11.127 -10.447 1.00 35.34 H ATOM 117 HD11 LEU A 10 0.346 13.010 -10.717 1.00 60.53 H ATOM 118 HD12 LEU A 10 -0.730 13.264 -12.091 1.00 30.33 H ATOM 119 HD13 LEU A 10 0.872 12.570 -12.343 1.00 13.14 H ATOM 120 HD21 LEU A 10 -2.470 11.835 -12.190 1.00 43.34 H ATOM 121 HD22 LEU A 10 -2.250 10.087 -12.103 1.00 10.54 H ATOM 122 HD23 LEU A 10 -1.479 11.009 -13.394 1.00 21.11 H ATOM 123 N LYS A 11 1.855 7.173 -11.005 1.00 3.52 N ATOM 124 CA LYS A 11 2.957 6.251 -11.251 1.00 23.05 C ATOM 125 C LYS A 11 2.533 4.811 -10.979 1.00 54.31 C ATOM 126 O LYS A 11 3.244 3.869 -11.324 1.00 2.01 O ATOM 127 CB LYS A 11 4.158 6.614 -10.374 1.00 22.52 C ATOM 128 CG LYS A 11 5.362 7.098 -11.162 1.00 44.42 C ATOM 129 CD LYS A 11 6.656 6.881 -10.395 1.00 13.44 C ATOM 130 CE LYS A 11 7.860 7.377 -11.180 1.00 61.13 C ATOM 131 NZ LYS A 11 8.359 8.682 -10.666 1.00 50.40 N ATOM 132 H LYS A 11 1.584 7.359 -10.081 1.00 2.02 H ATOM 133 HA LYS A 11 3.240 6.341 -12.288 1.00 70.44 H ATOM 134 HB2 LYS A 11 3.865 7.394 -9.688 1.00 0.43 H ATOM 135 HB3 LYS A 11 4.452 5.741 -9.808 1.00 62.13 H ATOM 136 HG2 LYS A 11 5.414 6.555 -12.094 1.00 1.00 H ATOM 137 HG3 LYS A 11 5.247 8.154 -11.365 1.00 24.12 H ATOM 138 HD2 LYS A 11 6.604 7.419 -9.460 1.00 1.43 H ATOM 139 HD3 LYS A 11 6.775 5.825 -10.198 1.00 55.21 H ATOM 140 HE2 LYS A 11 8.649 6.645 -11.104 1.00 61.42 H ATOM 141 HE3 LYS A 11 7.575 7.492 -12.216 1.00 0.54 H ATOM 142 HZ1 LYS A 11 7.983 8.858 -9.712 1.00 45.14 H ATOM 143 HZ2 LYS A 11 8.055 9.453 -11.295 1.00 11.34 H ATOM 144 HZ3 LYS A 11 9.398 8.676 -10.622 1.00 71.33 H ATOM 145 N ASN A 12 1.368 4.650 -10.360 1.00 75.52 N ATOM 146 CA ASN A 12 0.848 3.324 -10.044 1.00 12.14 C ATOM 147 C ASN A 12 -0.678 3.326 -10.035 1.00 22.21 C ATOM 148 O ASN A 12 -1.318 3.175 -8.994 1.00 64.50 O ATOM 149 CB ASN A 12 1.376 2.857 -8.686 1.00 2.33 C ATOM 150 CG ASN A 12 2.874 2.619 -8.699 1.00 11.52 C ATOM 151 OD1 ASN A 12 3.333 1.493 -8.887 1.00 21.22 O ATOM 152 ND2 ASN A 12 3.643 3.683 -8.498 1.00 64.01 N ATOM 153 H ASN A 12 0.845 5.440 -10.110 1.00 71.10 H ATOM 154 HA ASN A 12 1.191 2.643 -10.807 1.00 62.42 H ATOM 155 HB2 ASN A 12 1.157 3.611 -7.943 1.00 25.31 H ATOM 156 HB3 ASN A 12 0.886 1.935 -8.413 1.00 12.14 H ATOM 157 HD21 ASN A 12 4.615 3.558 -8.502 1.00 63.12 H ATOM 158 HD22 ASN A 12 3.208 4.549 -8.355 1.00 1.51 H ATOM 159 N PRO A 13 -1.276 3.500 -11.223 1.00 11.53 N ATOM 160 CA PRO A 13 -2.733 3.525 -11.379 1.00 34.10 C ATOM 161 C PRO A 13 -3.364 2.155 -11.153 1.00 2.03 C ATOM 162 O PRO A 13 -4.574 2.042 -10.960 1.00 45.42 O ATOM 163 CB PRO A 13 -2.927 3.969 -12.831 1.00 0.41 C ATOM 164 CG PRO A 13 -1.674 3.557 -13.524 1.00 11.25 C ATOM 165 CD PRO A 13 -0.576 3.687 -12.505 1.00 22.14 C ATOM 166 HA PRO A 13 -3.191 4.245 -10.716 1.00 75.43 H ATOM 167 HB2 PRO A 13 -3.792 3.474 -13.249 1.00 40.13 H ATOM 168 HB3 PRO A 13 -3.065 5.039 -12.868 1.00 42.53 H ATOM 169 HG2 PRO A 13 -1.758 2.534 -13.856 1.00 61.03 H ATOM 170 HG3 PRO A 13 -1.486 4.212 -14.362 1.00 32.22 H ATOM 171 HD2 PRO A 13 0.169 2.919 -12.653 1.00 32.15 H ATOM 172 HD3 PRO A 13 -0.125 4.667 -12.558 1.00 14.20 H ATOM 173 N ASN A 14 -2.535 1.116 -11.177 1.00 11.12 N ATOM 174 CA ASN A 14 -3.012 -0.247 -10.974 1.00 73.02 C ATOM 175 C ASN A 14 -3.234 -0.531 -9.492 1.00 20.03 C ATOM 176 O ASN A 14 -3.751 -1.586 -9.121 1.00 3.13 O ATOM 177 CB ASN A 14 -2.013 -1.251 -11.553 1.00 53.34 C ATOM 178 CG ASN A 14 -2.598 -2.052 -12.700 1.00 72.42 C ATOM 179 OD1 ASN A 14 -3.713 -2.567 -12.608 1.00 1.43 O ATOM 180 ND2 ASN A 14 -1.846 -2.162 -13.789 1.00 60.40 N ATOM 181 H ASN A 14 -1.580 1.269 -11.335 1.00 12.40 H ATOM 182 HA ASN A 14 -3.953 -0.349 -11.493 1.00 75.11 H ATOM 183 HB2 ASN A 14 -1.147 -0.718 -11.918 1.00 0.34 H ATOM 184 HB3 ASN A 14 -1.709 -1.936 -10.777 1.00 30.21 H ATOM 185 HD21 ASN A 14 -2.200 -2.675 -14.546 1.00 0.33 H ATOM 186 HD22 ASN A 14 -0.968 -1.726 -13.792 1.00 31.53 H ATOM 187 N LEU A 15 -2.841 0.417 -8.648 1.00 65.22 N ATOM 188 CA LEU A 15 -2.997 0.270 -7.205 1.00 65.22 C ATOM 189 C LEU A 15 -3.877 1.378 -6.637 1.00 4.41 C ATOM 190 O LEU A 15 -4.853 1.113 -5.936 1.00 34.42 O ATOM 191 CB LEU A 15 -1.629 0.287 -6.520 1.00 41.02 C ATOM 192 CG LEU A 15 -1.172 -1.034 -5.900 1.00 12.10 C ATOM 193 CD1 LEU A 15 0.172 -0.863 -5.209 1.00 13.20 C ATOM 194 CD2 LEU A 15 -2.215 -1.552 -4.921 1.00 33.13 C ATOM 195 H LEU A 15 -2.436 1.235 -9.003 1.00 44.20 H ATOM 196 HA LEU A 15 -3.472 -0.682 -7.019 1.00 4.23 H ATOM 197 HB2 LEU A 15 -0.895 0.578 -7.255 1.00 44.14 H ATOM 198 HB3 LEU A 15 -1.663 1.028 -5.735 1.00 2.55 H ATOM 199 HG LEU A 15 -1.053 -1.770 -6.683 1.00 43.13 H ATOM 200 HD11 LEU A 15 0.924 -1.427 -5.739 1.00 54.05 H ATOM 201 HD12 LEU A 15 0.102 -1.222 -4.193 1.00 2.22 H ATOM 202 HD13 LEU A 15 0.443 0.183 -5.203 1.00 74.00 H ATOM 203 HD21 LEU A 15 -2.549 -0.743 -4.289 1.00 11.24 H ATOM 204 HD22 LEU A 15 -1.781 -2.330 -4.311 1.00 25.13 H ATOM 205 HD23 LEU A 15 -3.056 -1.952 -5.469 1.00 31.32 H ATOM 206 N CYS A 16 -3.525 2.622 -6.945 1.00 54.34 N ATOM 207 CA CYS A 16 -4.283 3.772 -6.468 1.00 15.34 C ATOM 208 C CYS A 16 -4.247 4.909 -7.485 1.00 64.11 C ATOM 209 O CYS A 16 -4.987 4.898 -8.469 1.00 1.53 O ATOM 210 CB CYS A 16 -3.727 4.255 -5.127 1.00 2.12 C ATOM 211 SG CYS A 16 -4.790 5.463 -4.272 1.00 23.41 S ATOM 212 H CYS A 16 -2.736 2.771 -7.509 1.00 32.03 H ATOM 213 HA CYS A 16 -5.308 3.461 -6.331 1.00 41.11 H ATOM 214 HB2 CYS A 16 -3.602 3.406 -4.471 1.00 34.23 H ATOM 215 HB3 CYS A 16 -2.766 4.720 -5.291 1.00 51.10 H TER 216 CYS A 16 ENDMDL MODEL 15 ATOM 1 N GLY A 1 2.371 -1.042 -2.204 1.00 2.44 N ATOM 2 CA GLY A 1 1.918 0.038 -1.346 1.00 21.43 C ATOM 3 C GLY A 1 2.015 1.393 -2.018 1.00 71.44 C ATOM 4 O GLY A 1 2.974 2.134 -1.802 1.00 51.33 O ATOM 5 H1 GLY A 1 2.481 -1.944 -1.836 1.00 52.24 H ATOM 6 HA2 GLY A 1 0.890 -0.143 -1.070 1.00 72.55 H ATOM 7 HA3 GLY A 1 2.523 0.049 -0.451 1.00 1.00 H ATOM 8 N CYS A 2 1.020 1.717 -2.838 1.00 5.02 N ATOM 9 CA CYS A 2 0.998 2.991 -3.547 1.00 33.33 C ATOM 10 C CYS A 2 -0.417 3.561 -3.595 1.00 60.13 C ATOM 11 O CYS A 2 -1.273 3.067 -4.330 1.00 45.05 O ATOM 12 CB CYS A 2 1.539 2.817 -4.967 1.00 55.43 C ATOM 13 SG CYS A 2 2.962 3.885 -5.356 1.00 43.13 S ATOM 14 H CYS A 2 0.283 1.084 -2.970 1.00 21.34 H ATOM 15 HA CYS A 2 1.632 3.680 -3.011 1.00 1.20 H ATOM 16 HB2 CYS A 2 1.851 1.792 -5.103 1.00 3.15 H ATOM 17 HB3 CYS A 2 0.754 3.045 -5.673 1.00 73.14 H ATOM 18 N CYS A 3 -0.656 4.604 -2.807 1.00 62.13 N ATOM 19 CA CYS A 3 -1.966 5.242 -2.759 1.00 44.41 C ATOM 20 C CYS A 3 -1.941 6.465 -1.846 1.00 53.14 C ATOM 21 O CYS A 3 -2.679 7.427 -2.061 1.00 4.33 O ATOM 22 CB CYS A 3 -3.023 4.249 -2.272 1.00 4.43 C ATOM 23 SG CYS A 3 -4.738 4.813 -2.510 1.00 53.14 S ATOM 24 H CYS A 3 0.067 4.953 -2.243 1.00 51.15 H ATOM 25 HA CYS A 3 -2.217 5.560 -3.759 1.00 40.24 H ATOM 26 HB2 CYS A 3 -2.906 3.319 -2.808 1.00 63.01 H ATOM 27 HB3 CYS A 3 -2.878 4.071 -1.216 1.00 74.04 H ATOM 28 N SER A 4 -1.088 6.420 -0.828 1.00 73.21 N ATOM 29 CA SER A 4 -0.970 7.522 0.120 1.00 62.34 C ATOM 30 C SER A 4 -0.176 8.675 -0.485 1.00 43.54 C ATOM 31 O SER A 4 -0.069 9.748 0.108 1.00 63.21 O ATOM 32 CB SER A 4 -0.297 7.044 1.408 1.00 45.33 C ATOM 33 OG SER A 4 -0.993 7.510 2.550 1.00 14.23 O ATOM 34 H SER A 4 -0.527 5.625 -0.710 1.00 70.21 H ATOM 35 HA SER A 4 -1.966 7.868 0.351 1.00 0.22 H ATOM 36 HB2 SER A 4 -0.282 5.965 1.425 1.00 53.21 H ATOM 37 HB3 SER A 4 0.717 7.418 1.441 1.00 54.50 H ATOM 38 HG SER A 4 -0.556 8.292 2.896 1.00 52.05 H ATOM 39 N ASN A 5 0.379 8.446 -1.671 1.00 25.11 N ATOM 40 CA ASN A 5 1.165 9.465 -2.357 1.00 52.24 C ATOM 41 C ASN A 5 0.382 10.062 -3.522 1.00 55.45 C ATOM 42 O ASN A 5 -0.402 9.385 -4.188 1.00 41.13 O ATOM 43 CB ASN A 5 2.480 8.870 -2.864 1.00 70.12 C ATOM 44 CG ASN A 5 3.664 9.268 -2.005 1.00 2.42 C ATOM 45 OD1 ASN A 5 3.744 8.905 -0.831 1.00 53.21 O ATOM 46 ND2 ASN A 5 4.592 10.020 -2.587 1.00 74.52 N ATOM 47 H ASN A 5 0.259 7.570 -2.094 1.00 53.33 H ATOM 48 HA ASN A 5 1.384 10.248 -1.647 1.00 44.23 H ATOM 49 HB2 ASN A 5 2.405 7.792 -2.862 1.00 12.13 H ATOM 50 HB3 ASN A 5 2.659 9.212 -3.872 1.00 74.15 H ATOM 51 HD21 ASN A 5 5.368 10.291 -2.055 1.00 22.02 H ATOM 52 HD22 ASN A 5 4.462 10.271 -3.526 1.00 11.14 H ATOM 53 N PRO A 6 0.597 11.362 -3.776 1.00 62.33 N ATOM 54 CA PRO A 6 -0.078 12.079 -4.862 1.00 21.11 C ATOM 55 C PRO A 6 0.400 11.630 -6.239 1.00 21.14 C ATOM 56 O PRO A 6 -0.352 11.672 -7.212 1.00 12.45 O ATOM 57 CB PRO A 6 0.304 13.540 -4.613 1.00 45.14 C ATOM 58 CG PRO A 6 1.592 13.473 -3.867 1.00 30.00 C ATOM 59 CD PRO A 6 1.517 12.231 -3.023 1.00 62.52 C ATOM 60 HA PRO A 6 -1.151 11.971 -4.802 1.00 30.42 H ATOM 61 HB2 PRO A 6 0.421 14.050 -5.559 1.00 43.14 H ATOM 62 HB3 PRO A 6 -0.465 14.023 -4.030 1.00 40.23 H ATOM 63 HG2 PRO A 6 2.416 13.406 -4.561 1.00 72.00 H ATOM 64 HG3 PRO A 6 1.698 14.346 -3.240 1.00 30.34 H ATOM 65 HD2 PRO A 6 2.492 11.775 -2.935 1.00 4.10 H ATOM 66 HD3 PRO A 6 1.117 12.461 -2.047 1.00 75.10 H ATOM 67 N ALA A 7 1.655 11.199 -6.313 1.00 3.44 N ATOM 68 CA ALA A 7 2.232 10.740 -7.570 1.00 4.11 C ATOM 69 C ALA A 7 2.000 9.246 -7.767 1.00 63.10 C ATOM 70 O ALA A 7 2.015 8.748 -8.893 1.00 42.23 O ATOM 71 CB ALA A 7 3.720 11.055 -7.614 1.00 2.40 C ATOM 72 H ALA A 7 2.206 11.189 -5.502 1.00 54.21 H ATOM 73 HA ALA A 7 1.751 11.278 -8.374 1.00 44.12 H ATOM 74 HB1 ALA A 7 3.866 12.119 -7.489 1.00 32.31 H ATOM 75 HB2 ALA A 7 4.224 10.527 -6.819 1.00 32.34 H ATOM 76 HB3 ALA A 7 4.125 10.746 -8.566 1.00 24.13 H ATOM 77 N CYS A 8 1.787 8.535 -6.665 1.00 74.42 N ATOM 78 CA CYS A 8 1.552 7.097 -6.716 1.00 65.41 C ATOM 79 C CYS A 8 0.358 6.771 -7.608 1.00 41.25 C ATOM 80 O CYS A 8 0.233 5.656 -8.113 1.00 63.13 O ATOM 81 CB CYS A 8 1.316 6.547 -5.308 1.00 14.10 C ATOM 82 SG CYS A 8 2.749 5.673 -4.600 1.00 74.23 S ATOM 83 H CYS A 8 1.787 8.988 -5.795 1.00 54.14 H ATOM 84 HA CYS A 8 2.433 6.631 -7.131 1.00 45.32 H ATOM 85 HB2 CYS A 8 1.072 7.366 -4.647 1.00 2.03 H ATOM 86 HB3 CYS A 8 0.487 5.855 -5.335 1.00 25.53 H ATOM 87 N MET A 9 -0.517 7.753 -7.798 1.00 2.50 N ATOM 88 CA MET A 9 -1.700 7.572 -8.631 1.00 13.15 C ATOM 89 C MET A 9 -1.355 7.731 -10.108 1.00 32.51 C ATOM 90 O MET A 9 -2.071 7.235 -10.980 1.00 2.34 O ATOM 91 CB MET A 9 -2.785 8.577 -8.238 1.00 33.44 C ATOM 92 CG MET A 9 -3.964 7.946 -7.513 1.00 44.13 C ATOM 93 SD MET A 9 -4.924 9.148 -6.573 1.00 34.41 S ATOM 94 CE MET A 9 -6.551 8.400 -6.631 1.00 11.13 C ATOM 95 H MET A 9 -0.363 8.621 -7.369 1.00 12.22 H ATOM 96 HA MET A 9 -2.071 6.572 -8.465 1.00 35.12 H ATOM 97 HB2 MET A 9 -2.350 9.323 -7.590 1.00 54.55 H ATOM 98 HB3 MET A 9 -3.155 9.057 -9.131 1.00 55.00 H ATOM 99 HG2 MET A 9 -4.611 7.481 -8.242 1.00 43.11 H ATOM 100 HG3 MET A 9 -3.590 7.193 -6.835 1.00 0.51 H ATOM 101 HE1 MET A 9 -7.138 8.875 -7.404 1.00 22.02 H ATOM 102 HE2 MET A 9 -6.456 7.346 -6.847 1.00 42.43 H ATOM 103 HE3 MET A 9 -7.040 8.529 -5.677 1.00 32.14 H ATOM 104 N LEU A 10 -0.256 8.423 -10.383 1.00 3.52 N ATOM 105 CA LEU A 10 0.184 8.647 -11.756 1.00 2.44 C ATOM 106 C LEU A 10 1.335 7.714 -12.118 1.00 34.41 C ATOM 107 O LEU A 10 1.649 7.524 -13.293 1.00 54.23 O ATOM 108 CB LEU A 10 0.616 10.103 -11.943 1.00 14.03 C ATOM 109 CG LEU A 10 -0.398 11.164 -11.512 1.00 41.04 C ATOM 110 CD1 LEU A 10 0.277 12.519 -11.367 1.00 51.24 C ATOM 111 CD2 LEU A 10 -1.545 11.241 -12.509 1.00 50.33 C ATOM 112 H LEU A 10 0.274 8.794 -9.646 1.00 75.43 H ATOM 113 HA LEU A 10 -0.650 8.441 -12.409 1.00 35.12 H ATOM 114 HB2 LEU A 10 1.518 10.257 -11.371 1.00 33.42 H ATOM 115 HB3 LEU A 10 0.827 10.252 -12.992 1.00 51.12 H ATOM 116 HG LEU A 10 -0.808 10.891 -10.550 1.00 11.44 H ATOM 117 HD11 LEU A 10 0.731 12.797 -12.306 1.00 42.22 H ATOM 118 HD12 LEU A 10 1.037 12.463 -10.602 1.00 71.33 H ATOM 119 HD13 LEU A 10 -0.459 13.260 -11.089 1.00 61.44 H ATOM 120 HD21 LEU A 10 -1.352 10.571 -13.333 1.00 63.51 H ATOM 121 HD22 LEU A 10 -1.632 12.252 -12.880 1.00 45.01 H ATOM 122 HD23 LEU A 10 -2.466 10.957 -12.021 1.00 10.21 H ATOM 123 N LYS A 11 1.959 7.130 -11.101 1.00 1.25 N ATOM 124 CA LYS A 11 3.073 6.213 -11.310 1.00 73.33 C ATOM 125 C LYS A 11 2.650 4.773 -11.039 1.00 74.52 C ATOM 126 O LYS A 11 3.376 3.832 -11.358 1.00 53.12 O ATOM 127 CB LYS A 11 4.248 6.589 -10.405 1.00 51.22 C ATOM 128 CG LYS A 11 5.470 7.075 -11.165 1.00 54.55 C ATOM 129 CD LYS A 11 6.744 6.871 -10.363 1.00 73.00 C ATOM 130 CE LYS A 11 7.384 8.198 -9.987 1.00 4.14 C ATOM 131 NZ LYS A 11 8.319 8.056 -8.836 1.00 13.33 N ATOM 132 H LYS A 11 1.663 7.321 -10.185 1.00 72.13 H ATOM 133 HA LYS A 11 3.382 6.296 -12.341 1.00 51.51 H ATOM 134 HB2 LYS A 11 3.932 7.373 -9.733 1.00 3.30 H ATOM 135 HB3 LYS A 11 4.532 5.723 -9.826 1.00 21.45 H ATOM 136 HG2 LYS A 11 5.548 6.526 -12.092 1.00 5.03 H ATOM 137 HG3 LYS A 11 5.354 8.129 -11.378 1.00 61.22 H ATOM 138 HD2 LYS A 11 6.507 6.330 -9.459 1.00 72.42 H ATOM 139 HD3 LYS A 11 7.444 6.298 -10.955 1.00 15.20 H ATOM 140 HE2 LYS A 11 7.930 8.574 -10.838 1.00 64.33 H ATOM 141 HE3 LYS A 11 6.605 8.897 -9.722 1.00 55.04 H ATOM 142 HZ1 LYS A 11 8.215 8.864 -8.190 1.00 3.45 H ATOM 143 HZ2 LYS A 11 9.301 8.021 -9.176 1.00 1.23 H ATOM 144 HZ3 LYS A 11 8.113 7.180 -8.314 1.00 40.44 H ATOM 145 N ASN A 12 1.470 4.608 -10.450 1.00 13.10 N ATOM 146 CA ASN A 12 0.950 3.282 -10.137 1.00 72.11 C ATOM 147 C ASN A 12 -0.576 3.274 -10.168 1.00 44.31 C ATOM 148 O ASN A 12 -1.241 3.126 -9.143 1.00 54.41 O ATOM 149 CB ASN A 12 1.445 2.828 -8.763 1.00 3.25 C ATOM 150 CG ASN A 12 2.944 2.600 -8.735 1.00 23.22 C ATOM 151 OD1 ASN A 12 3.415 1.475 -8.903 1.00 21.21 O ATOM 152 ND2 ASN A 12 3.702 3.669 -8.521 1.00 53.55 N ATOM 153 H ASN A 12 0.936 5.397 -10.220 1.00 11.04 H ATOM 154 HA ASN A 12 1.317 2.597 -10.886 1.00 71.14 H ATOM 155 HB2 ASN A 12 1.203 3.586 -8.031 1.00 73.42 H ATOM 156 HB3 ASN A 12 0.954 1.905 -8.495 1.00 54.04 H ATOM 157 HD21 ASN A 12 4.674 3.550 -8.499 1.00 42.43 H ATOM 158 HD22 ASN A 12 3.258 4.534 -8.396 1.00 15.13 H ATOM 159 N PRO A 13 -1.144 3.437 -11.372 1.00 43.02 N ATOM 160 CA PRO A 13 -2.597 3.451 -11.567 1.00 4.54 C ATOM 161 C PRO A 13 -3.225 2.079 -11.347 1.00 5.30 C ATOM 162 O PRO A 13 -4.438 1.961 -11.186 1.00 73.54 O ATOM 163 CB PRO A 13 -2.755 3.885 -13.026 1.00 61.42 C ATOM 164 CG PRO A 13 -1.482 3.475 -13.683 1.00 0.30 C ATOM 165 CD PRO A 13 -0.411 3.619 -12.637 1.00 34.22 C ATOM 166 HA PRO A 13 -3.076 4.173 -10.921 1.00 70.12 H ATOM 167 HB2 PRO A 13 -3.606 3.381 -13.463 1.00 42.14 H ATOM 168 HB3 PRO A 13 -2.898 4.954 -13.075 1.00 31.52 H ATOM 169 HG2 PRO A 13 -1.551 2.449 -14.011 1.00 11.24 H ATOM 170 HG3 PRO A 13 -1.276 4.125 -14.521 1.00 12.13 H ATOM 171 HD2 PRO A 13 0.341 2.854 -12.760 1.00 4.41 H ATOM 172 HD3 PRO A 13 0.034 4.601 -12.685 1.00 44.45 H ATOM 173 N ASN A 14 -2.389 1.046 -11.341 1.00 32.52 N ATOM 174 CA ASN A 14 -2.863 -0.319 -11.141 1.00 34.03 C ATOM 175 C ASN A 14 -3.124 -0.593 -9.663 1.00 25.43 C ATOM 176 O ASN A 14 -3.645 -1.648 -9.298 1.00 22.11 O ATOM 177 CB ASN A 14 -1.843 -1.321 -11.685 1.00 41.30 C ATOM 178 CG ASN A 14 -2.388 -2.127 -12.848 1.00 42.01 C ATOM 179 OD1 ASN A 14 -1.737 -2.261 -13.884 1.00 45.32 O ATOM 180 ND2 ASN A 14 -3.589 -2.669 -12.681 1.00 43.32 N ATOM 181 H ASN A 14 -1.431 1.204 -11.474 1.00 73.32 H ATOM 182 HA ASN A 14 -3.789 -0.431 -11.684 1.00 55.02 H ATOM 183 HB2 ASN A 14 -0.967 -0.786 -12.022 1.00 50.43 H ATOM 184 HB3 ASN A 14 -1.562 -2.003 -10.897 1.00 64.44 H ATOM 185 HD21 ASN A 14 -3.965 -3.196 -13.417 1.00 4.41 H ATOM 186 HD22 ASN A 14 -4.050 -2.520 -11.829 1.00 24.10 H ATOM 187 N LEU A 15 -2.758 0.363 -8.816 1.00 24.40 N ATOM 188 CA LEU A 15 -2.952 0.225 -7.377 1.00 3.43 C ATOM 189 C LEU A 15 -3.853 1.333 -6.841 1.00 10.04 C ATOM 190 O LEU A 15 -4.847 1.067 -6.164 1.00 61.32 O ATOM 191 CB LEU A 15 -1.603 0.256 -6.655 1.00 72.52 C ATOM 192 CG LEU A 15 -1.156 -1.058 -6.013 1.00 32.04 C ATOM 193 CD1 LEU A 15 0.168 -0.874 -5.287 1.00 14.00 C ATOM 194 CD2 LEU A 15 -2.223 -1.575 -5.058 1.00 4.43 C ATOM 195 H LEU A 15 -2.347 1.180 -9.166 1.00 13.52 H ATOM 196 HA LEU A 15 -3.426 -0.728 -7.196 1.00 13.41 H ATOM 197 HB2 LEU A 15 -0.851 0.545 -7.373 1.00 1.25 H ATOM 198 HB3 LEU A 15 -1.662 1.003 -5.877 1.00 34.25 H ATOM 199 HG LEU A 15 -1.012 -1.799 -6.787 1.00 23.24 H ATOM 200 HD11 LEU A 15 0.664 -1.828 -5.196 1.00 34.33 H ATOM 201 HD12 LEU A 15 -0.015 -0.467 -4.303 1.00 63.33 H ATOM 202 HD13 LEU A 15 0.793 -0.194 -5.847 1.00 22.22 H ATOM 203 HD21 LEU A 15 -2.905 -0.774 -4.814 1.00 32.44 H ATOM 204 HD22 LEU A 15 -1.752 -1.935 -4.155 1.00 33.32 H ATOM 205 HD23 LEU A 15 -2.766 -2.382 -5.528 1.00 1.24 H ATOM 206 N CYS A 16 -3.501 2.577 -7.149 1.00 24.41 N ATOM 207 CA CYS A 16 -4.278 3.726 -6.700 1.00 63.34 C ATOM 208 C CYS A 16 -4.221 4.854 -7.726 1.00 1.43 C ATOM 209 O CYS A 16 -5.230 5.197 -8.342 1.00 61.03 O ATOM 210 CB CYS A 16 -3.759 4.222 -5.349 1.00 52.44 C ATOM 211 SG CYS A 16 -4.852 5.429 -4.532 1.00 4.41 S ATOM 212 H CYS A 16 -2.697 2.726 -7.692 1.00 32.33 H ATOM 213 HA CYS A 16 -5.303 3.409 -6.588 1.00 55.31 H ATOM 214 HB2 CYS A 16 -3.646 3.379 -4.684 1.00 14.14 H ATOM 215 HB3 CYS A 16 -2.798 4.693 -5.492 1.00 65.43 H TER 216 CYS A 16 ENDMDL MODEL 16 ATOM 1 N GLY A 1 3.275 -0.326 -0.661 1.00 11.52 N ATOM 2 CA GLY A 1 2.014 0.068 -1.263 1.00 24.31 C ATOM 3 C GLY A 1 2.089 1.428 -1.927 1.00 15.31 C ATOM 4 O GLY A 1 3.000 2.211 -1.656 1.00 14.02 O ATOM 5 H1 GLY A 1 3.522 -1.273 -0.621 1.00 63.22 H ATOM 6 HA2 GLY A 1 1.736 -0.668 -2.003 1.00 5.12 H ATOM 7 HA3 GLY A 1 1.255 0.096 -0.495 1.00 62.20 H ATOM 8 N CYS A 2 1.129 1.711 -2.801 1.00 15.40 N ATOM 9 CA CYS A 2 1.089 2.986 -3.508 1.00 70.31 C ATOM 10 C CYS A 2 -0.322 3.568 -3.502 1.00 23.32 C ATOM 11 O CYS A 2 -1.209 3.081 -4.203 1.00 51.23 O ATOM 12 CB CYS A 2 1.573 2.809 -4.949 1.00 21.34 C ATOM 13 SG CYS A 2 2.989 3.865 -5.392 1.00 42.32 S ATOM 14 H CYS A 2 0.429 1.046 -2.975 1.00 52.43 H ATOM 15 HA CYS A 2 1.749 3.670 -2.997 1.00 64.51 H ATOM 16 HB2 CYS A 2 1.872 1.781 -5.096 1.00 1.11 H ATOM 17 HB3 CYS A 2 0.763 3.043 -5.624 1.00 23.33 H ATOM 18 N CYS A 3 -0.521 4.612 -2.705 1.00 51.30 N ATOM 19 CA CYS A 3 -1.823 5.262 -2.606 1.00 64.31 C ATOM 20 C CYS A 3 -1.753 6.484 -1.695 1.00 22.21 C ATOM 21 O CYS A 3 -2.490 7.452 -1.880 1.00 41.13 O ATOM 22 CB CYS A 3 -2.868 4.277 -2.078 1.00 52.42 C ATOM 23 SG CYS A 3 -4.587 4.855 -2.251 1.00 12.21 S ATOM 24 H CYS A 3 0.226 4.955 -2.170 1.00 12.24 H ATOM 25 HA CYS A 3 -2.110 5.582 -3.596 1.00 1.01 H ATOM 26 HB2 CYS A 3 -2.780 3.346 -2.619 1.00 3.15 H ATOM 27 HB3 CYS A 3 -2.685 4.098 -1.029 1.00 60.42 H ATOM 28 N SER A 4 -0.861 6.431 -0.711 1.00 32.05 N ATOM 29 CA SER A 4 -0.697 7.532 0.232 1.00 60.51 C ATOM 30 C SER A 4 0.083 8.679 -0.403 1.00 75.03 C ATOM 31 O SER A 4 0.223 9.750 0.186 1.00 33.41 O ATOM 32 CB SER A 4 0.022 7.048 1.493 1.00 50.11 C ATOM 33 OG SER A 4 -0.627 7.518 2.662 1.00 42.12 O ATOM 34 H SER A 4 -0.302 5.631 -0.615 1.00 14.34 H ATOM 35 HA SER A 4 -1.680 7.886 0.502 1.00 14.12 H ATOM 36 HB2 SER A 4 0.029 5.969 1.509 1.00 72.11 H ATOM 37 HB3 SER A 4 1.038 7.415 1.487 1.00 24.32 H ATOM 38 HG SER A 4 -0.054 8.138 3.119 1.00 62.01 H ATOM 39 N ASN A 5 0.588 8.446 -1.610 1.00 72.13 N ATOM 40 CA ASN A 5 1.354 9.459 -2.327 1.00 0.13 C ATOM 41 C ASN A 5 0.531 10.062 -3.461 1.00 42.31 C ATOM 42 O ASN A 5 -0.283 9.391 -4.096 1.00 3.11 O ATOM 43 CB ASN A 5 2.644 8.854 -2.884 1.00 21.45 C ATOM 44 CG ASN A 5 3.864 9.243 -2.071 1.00 14.43 C ATOM 45 OD1 ASN A 5 4.375 10.357 -2.193 1.00 20.50 O ATOM 46 ND2 ASN A 5 4.336 8.326 -1.235 1.00 74.51 N ATOM 47 H ASN A 5 0.442 7.572 -2.029 1.00 64.02 H ATOM 48 HA ASN A 5 1.607 10.240 -1.626 1.00 12.41 H ATOM 49 HB2 ASN A 5 2.561 7.776 -2.877 1.00 51.44 H ATOM 50 HB3 ASN A 5 2.786 9.194 -3.898 1.00 63.12 H ATOM 51 HD21 ASN A 5 5.123 8.551 -0.697 1.00 12.31 H ATOM 52 HD22 ASN A 5 3.877 7.460 -1.190 1.00 42.33 H ATOM 53 N PRO A 6 0.747 11.360 -3.724 1.00 23.33 N ATOM 54 CA PRO A 6 0.037 12.082 -4.783 1.00 14.11 C ATOM 55 C PRO A 6 0.458 11.629 -6.177 1.00 34.03 C ATOM 56 O PRO A 6 -0.332 11.676 -7.120 1.00 4.23 O ATOM 57 CB PRO A 6 0.440 13.540 -4.550 1.00 50.21 C ATOM 58 CG PRO A 6 1.755 13.463 -3.854 1.00 13.02 C ATOM 59 CD PRO A 6 1.703 12.221 -3.007 1.00 54.42 C ATOM 60 HA PRO A 6 -1.034 11.982 -4.681 1.00 52.44 H ATOM 61 HB2 PRO A 6 0.524 14.049 -5.500 1.00 43.11 H ATOM 62 HB3 PRO A 6 -0.303 14.030 -3.938 1.00 25.40 H ATOM 63 HG2 PRO A 6 2.551 13.389 -4.579 1.00 54.31 H ATOM 64 HG3 PRO A 6 1.892 14.335 -3.231 1.00 72.04 H ATOM 65 HD2 PRO A 6 2.677 11.758 -2.956 1.00 52.13 H ATOM 66 HD3 PRO A 6 1.342 12.455 -2.016 1.00 53.14 H ATOM 67 N ALA A 7 1.706 11.190 -6.299 1.00 71.32 N ATOM 68 CA ALA A 7 2.231 10.726 -7.578 1.00 35.35 C ATOM 69 C ALA A 7 1.979 9.233 -7.765 1.00 3.41 C ATOM 70 O ALA A 7 1.947 8.735 -8.891 1.00 11.34 O ATOM 71 CB ALA A 7 3.718 11.029 -7.679 1.00 50.31 C ATOM 72 H ALA A 7 2.287 11.176 -5.511 1.00 3.23 H ATOM 73 HA ALA A 7 1.723 11.267 -8.363 1.00 1.41 H ATOM 74 HB1 ALA A 7 4.045 10.883 -8.698 1.00 44.33 H ATOM 75 HB2 ALA A 7 3.897 12.053 -7.386 1.00 60.01 H ATOM 76 HB3 ALA A 7 4.266 10.366 -7.026 1.00 53.33 H ATOM 77 N CYS A 8 1.802 8.524 -6.655 1.00 65.03 N ATOM 78 CA CYS A 8 1.555 7.088 -6.696 1.00 63.24 C ATOM 79 C CYS A 8 0.325 6.772 -7.542 1.00 62.43 C ATOM 80 O CYS A 8 0.172 5.657 -8.042 1.00 4.25 O ATOM 81 CB CYS A 8 1.368 6.541 -5.280 1.00 62.40 C ATOM 82 SG CYS A 8 2.820 5.654 -4.628 1.00 12.24 S ATOM 83 H CYS A 8 1.839 8.978 -5.786 1.00 65.43 H ATOM 84 HA CYS A 8 2.416 6.615 -7.145 1.00 1.54 H ATOM 85 HB2 CYS A 8 1.157 7.362 -4.610 1.00 63.42 H ATOM 86 HB3 CYS A 8 0.534 5.855 -5.275 1.00 32.05 H ATOM 87 N MET A 9 -0.549 7.761 -7.699 1.00 23.34 N ATOM 88 CA MET A 9 -1.765 7.588 -8.485 1.00 44.42 C ATOM 89 C MET A 9 -1.475 7.744 -9.975 1.00 21.52 C ATOM 90 O MET A 9 -2.227 7.253 -10.818 1.00 50.32 O ATOM 91 CB MET A 9 -2.826 8.602 -8.052 1.00 23.32 C ATOM 92 CG MET A 9 -4.194 8.348 -8.663 1.00 60.13 C ATOM 93 SD MET A 9 -5.544 8.791 -7.553 1.00 41.12 S ATOM 94 CE MET A 9 -6.957 8.562 -8.630 1.00 42.31 C ATOM 95 H MET A 9 -0.372 8.627 -7.276 1.00 50.21 H ATOM 96 HA MET A 9 -2.137 6.591 -8.305 1.00 11.33 H ATOM 97 HB2 MET A 9 -2.923 8.566 -6.977 1.00 72.31 H ATOM 98 HB3 MET A 9 -2.503 9.590 -8.343 1.00 53.23 H ATOM 99 HG2 MET A 9 -4.284 8.932 -9.567 1.00 12.10 H ATOM 100 HG3 MET A 9 -4.275 7.299 -8.906 1.00 60.41 H ATOM 101 HE1 MET A 9 -6.632 8.589 -9.660 1.00 41.22 H ATOM 102 HE2 MET A 9 -7.417 7.608 -8.423 1.00 21.54 H ATOM 103 HE3 MET A 9 -7.673 9.352 -8.457 1.00 45.20 H ATOM 104 N LEU A 10 -0.382 8.428 -10.292 1.00 65.01 N ATOM 105 CA LEU A 10 0.007 8.648 -11.681 1.00 24.12 C ATOM 106 C LEU A 10 1.136 7.705 -12.086 1.00 74.22 C ATOM 107 O LEU A 10 1.403 7.512 -13.273 1.00 13.44 O ATOM 108 CB LEU A 10 0.443 10.100 -11.885 1.00 72.03 C ATOM 109 CG LEU A 10 -0.617 11.165 -11.601 1.00 21.14 C ATOM 110 CD1 LEU A 10 0.012 12.549 -11.569 1.00 4.01 C ATOM 111 CD2 LEU A 10 -1.726 11.105 -12.641 1.00 31.04 C ATOM 112 H LEU A 10 0.178 8.794 -9.577 1.00 2.45 H ATOM 113 HA LEU A 10 -0.853 8.448 -12.301 1.00 74.14 H ATOM 114 HB2 LEU A 10 1.283 10.288 -11.235 1.00 21.22 H ATOM 115 HB3 LEU A 10 0.755 10.209 -12.914 1.00 71.13 H ATOM 116 HG LEU A 10 -1.056 10.976 -10.631 1.00 11.44 H ATOM 117 HD11 LEU A 10 1.041 12.470 -11.250 1.00 74.30 H ATOM 118 HD12 LEU A 10 -0.532 13.176 -10.878 1.00 64.00 H ATOM 119 HD13 LEU A 10 -0.026 12.985 -12.557 1.00 34.43 H ATOM 120 HD21 LEU A 10 -1.438 10.434 -13.436 1.00 44.52 H ATOM 121 HD22 LEU A 10 -1.894 12.093 -13.044 1.00 62.55 H ATOM 122 HD23 LEU A 10 -2.634 10.746 -12.178 1.00 13.41 H ATOM 123 N LYS A 11 1.794 7.117 -11.093 1.00 71.11 N ATOM 124 CA LYS A 11 2.891 6.190 -11.345 1.00 3.43 C ATOM 125 C LYS A 11 2.467 4.754 -11.057 1.00 24.32 C ATOM 126 O LYS A 11 3.173 3.807 -11.403 1.00 2.53 O ATOM 127 CB LYS A 11 4.103 6.558 -10.485 1.00 62.34 C ATOM 128 CG LYS A 11 5.299 7.034 -11.292 1.00 12.21 C ATOM 129 CD LYS A 11 6.601 6.819 -10.539 1.00 11.52 C ATOM 130 CE LYS A 11 7.083 8.104 -9.881 1.00 73.43 C ATOM 131 NZ LYS A 11 8.184 7.851 -8.911 1.00 61.44 N ATOM 132 H LYS A 11 1.534 7.310 -10.167 1.00 44.33 H ATOM 133 HA LYS A 11 3.162 6.271 -12.387 1.00 14.44 H ATOM 134 HB2 LYS A 11 3.820 7.344 -9.802 1.00 13.41 H ATOM 135 HB3 LYS A 11 4.403 5.689 -9.917 1.00 15.04 H ATOM 136 HG2 LYS A 11 5.338 6.484 -12.220 1.00 53.24 H ATOM 137 HG3 LYS A 11 5.184 8.088 -11.500 1.00 54.54 H ATOM 138 HD2 LYS A 11 6.446 6.073 -9.774 1.00 13.21 H ATOM 139 HD3 LYS A 11 7.355 6.475 -11.232 1.00 42.33 H ATOM 140 HE2 LYS A 11 7.437 8.774 -10.649 1.00 4.44 H ATOM 141 HE3 LYS A 11 6.253 8.559 -9.360 1.00 63.25 H ATOM 142 HZ1 LYS A 11 9.103 7.887 -9.397 1.00 21.44 H ATOM 143 HZ2 LYS A 11 8.069 6.912 -8.478 1.00 4.23 H ATOM 144 HZ3 LYS A 11 8.172 8.570 -8.161 1.00 52.40 H ATOM 145 N ASN A 12 1.310 4.599 -10.423 1.00 35.03 N ATOM 146 CA ASN A 12 0.791 3.277 -10.090 1.00 4.05 C ATOM 147 C ASN A 12 -0.734 3.282 -10.062 1.00 30.21 C ATOM 148 O ASN A 12 -1.361 3.139 -9.012 1.00 51.30 O ATOM 149 CB ASN A 12 1.336 2.820 -8.735 1.00 33.33 C ATOM 150 CG ASN A 12 2.833 2.579 -8.764 1.00 52.44 C ATOM 151 OD1 ASN A 12 3.288 1.451 -8.950 1.00 71.30 O ATOM 152 ND2 ASN A 12 3.606 3.643 -8.581 1.00 3.03 N ATOM 153 H ASN A 12 0.791 5.392 -10.173 1.00 3.24 H ATOM 154 HA ASN A 12 1.124 2.589 -10.852 1.00 20.01 H ATOM 155 HB2 ASN A 12 1.127 3.579 -7.995 1.00 3.00 H ATOM 156 HB3 ASN A 12 0.847 1.900 -8.449 1.00 3.45 H ATOM 157 HD21 ASN A 12 4.578 3.516 -8.596 1.00 11.33 H ATOM 158 HD22 ASN A 12 3.174 4.511 -8.438 1.00 41.23 H ATOM 159 N PRO A 13 -1.347 3.449 -11.243 1.00 64.14 N ATOM 160 CA PRO A 13 -2.806 3.475 -11.382 1.00 2.02 C ATOM 161 C PRO A 13 -3.436 2.108 -11.138 1.00 2.03 C ATOM 162 O PRO A 13 -4.644 1.999 -10.931 1.00 25.02 O ATOM 163 CB PRO A 13 -3.017 3.909 -12.834 1.00 44.34 C ATOM 164 CG PRO A 13 -1.773 3.490 -13.539 1.00 71.34 C ATOM 165 CD PRO A 13 -0.662 3.625 -12.535 1.00 70.32 C ATOM 166 HA PRO A 13 -3.254 4.200 -10.719 1.00 12.43 H ATOM 167 HB2 PRO A 13 -3.888 3.413 -13.238 1.00 64.44 H ATOM 168 HB3 PRO A 13 -3.153 4.979 -12.878 1.00 1.31 H ATOM 169 HG2 PRO A 13 -1.863 2.464 -13.864 1.00 0.23 H ATOM 170 HG3 PRO A 13 -1.594 4.138 -14.385 1.00 34.23 H ATOM 171 HD2 PRO A 13 0.079 2.854 -12.687 1.00 3.22 H ATOM 172 HD3 PRO A 13 -0.210 4.604 -12.601 1.00 75.43 H ATOM 173 N ASN A 14 -2.609 1.068 -11.163 1.00 32.41 N ATOM 174 CA ASN A 14 -3.086 -0.293 -10.944 1.00 73.12 C ATOM 175 C ASN A 14 -3.292 -0.565 -9.457 1.00 62.11 C ATOM 176 O ASN A 14 -3.807 -1.616 -9.072 1.00 53.52 O ATOM 177 CB ASN A 14 -2.095 -1.303 -11.527 1.00 35.03 C ATOM 178 CG ASN A 14 -2.117 -1.326 -13.043 1.00 10.41 C ATOM 179 OD1 ASN A 14 -3.087 -0.897 -13.667 1.00 54.44 O ATOM 180 ND2 ASN A 14 -1.044 -1.828 -13.642 1.00 43.23 N ATOM 181 H ASN A 14 -1.656 1.218 -11.333 1.00 22.01 H ATOM 182 HA ASN A 14 -4.033 -0.398 -11.452 1.00 14.33 H ATOM 183 HB2 ASN A 14 -1.097 -1.046 -11.204 1.00 50.41 H ATOM 184 HB3 ASN A 14 -2.343 -2.290 -11.166 1.00 65.23 H ATOM 185 HD21 ASN A 14 -1.031 -1.854 -14.622 1.00 2.12 H ATOM 186 HD22 ASN A 14 -0.308 -2.151 -13.081 1.00 33.32 H ATOM 187 N LEU A 15 -2.886 0.388 -8.626 1.00 21.05 N ATOM 188 CA LEU A 15 -3.026 0.252 -7.180 1.00 2.43 C ATOM 189 C LEU A 15 -3.897 1.367 -6.610 1.00 41.41 C ATOM 190 O LEU A 15 -4.866 1.109 -5.896 1.00 11.22 O ATOM 191 CB LEU A 15 -1.650 0.272 -6.510 1.00 74.25 C ATOM 192 CG LEU A 15 -1.189 -1.045 -5.886 1.00 33.52 C ATOM 193 CD1 LEU A 15 0.163 -0.872 -5.212 1.00 32.23 C ATOM 194 CD2 LEU A 15 -2.222 -1.554 -4.891 1.00 32.14 C ATOM 195 H LEU A 15 -2.483 1.202 -8.991 1.00 44.42 H ATOM 196 HA LEU A 15 -3.501 -0.697 -6.980 1.00 42.45 H ATOM 197 HB2 LEU A 15 -0.924 0.556 -7.256 1.00 61.01 H ATOM 198 HB3 LEU A 15 -1.674 1.019 -5.730 1.00 1.10 H ATOM 199 HG LEU A 15 -1.081 -1.787 -6.665 1.00 25.51 H ATOM 200 HD11 LEU A 15 0.250 -1.572 -4.394 1.00 51.14 H ATOM 201 HD12 LEU A 15 0.250 0.136 -4.834 1.00 31.33 H ATOM 202 HD13 LEU A 15 0.949 -1.056 -5.929 1.00 71.14 H ATOM 203 HD21 LEU A 15 -2.936 -2.183 -5.402 1.00 45.01 H ATOM 204 HD22 LEU A 15 -2.736 -0.715 -4.445 1.00 43.01 H ATOM 205 HD23 LEU A 15 -1.727 -2.124 -4.118 1.00 30.41 H ATOM 206 N CYS A 16 -3.547 2.608 -6.932 1.00 44.13 N ATOM 207 CA CYS A 16 -4.297 3.763 -6.455 1.00 3.41 C ATOM 208 C CYS A 16 -4.270 4.891 -7.482 1.00 55.43 C ATOM 209 O CYS A 16 -5.317 5.353 -7.938 1.00 62.35 O ATOM 210 CB CYS A 16 -3.722 4.256 -5.125 1.00 55.52 C ATOM 211 SG CYS A 16 -4.773 5.472 -4.267 1.00 32.03 S ATOM 212 H CYS A 16 -2.764 2.751 -7.506 1.00 24.43 H ATOM 213 HA CYS A 16 -5.320 3.455 -6.303 1.00 1.30 H ATOM 214 HB2 CYS A 16 -3.591 3.412 -4.464 1.00 5.41 H ATOM 215 HB3 CYS A 16 -2.763 4.719 -5.305 1.00 55.24 H TER 216 CYS A 16 ENDMDL MODEL 17 ATOM 1 N GLY A 1 3.363 -0.577 -1.084 1.00 70.24 N ATOM 2 CA GLY A 1 2.042 -0.011 -1.284 1.00 40.45 C ATOM 3 C GLY A 1 2.090 1.351 -1.949 1.00 72.23 C ATOM 4 O GLY A 1 3.023 2.124 -1.731 1.00 52.23 O ATOM 5 H1 GLY A 1 3.603 -0.962 -0.215 1.00 54.22 H ATOM 6 HA2 GLY A 1 1.464 -0.682 -1.902 1.00 43.45 H ATOM 7 HA3 GLY A 1 1.556 0.087 -0.325 1.00 12.31 H ATOM 8 N CYS A 2 1.082 1.645 -2.764 1.00 44.13 N ATOM 9 CA CYS A 2 1.013 2.921 -3.466 1.00 2.45 C ATOM 10 C CYS A 2 -0.417 3.453 -3.488 1.00 30.01 C ATOM 11 O CYS A 2 -1.272 2.936 -4.208 1.00 50.50 O ATOM 12 CB CYS A 2 1.535 2.770 -4.896 1.00 2.23 C ATOM 13 SG CYS A 2 2.933 3.867 -5.297 1.00 3.12 S ATOM 14 H CYS A 2 0.367 0.987 -2.898 1.00 42.20 H ATOM 15 HA CYS A 2 1.637 3.625 -2.936 1.00 44.24 H ATOM 16 HB2 CYS A 2 1.864 1.752 -5.045 1.00 3.11 H ATOM 17 HB3 CYS A 2 0.736 2.989 -5.588 1.00 14.53 H ATOM 18 N CYS A 3 -0.670 4.489 -2.694 1.00 62.55 N ATOM 19 CA CYS A 3 -1.995 5.091 -2.622 1.00 13.22 C ATOM 20 C CYS A 3 -1.988 6.313 -1.708 1.00 42.42 C ATOM 21 O CYS A 3 -2.756 7.255 -1.907 1.00 63.30 O ATOM 22 CB CYS A 3 -3.016 4.069 -2.117 1.00 0.52 C ATOM 23 SG CYS A 3 -4.751 4.584 -2.329 1.00 64.13 S ATOM 24 H CYS A 3 0.053 4.857 -2.143 1.00 63.24 H ATOM 25 HA CYS A 3 -2.273 5.403 -3.617 1.00 73.11 H ATOM 26 HB2 CYS A 3 -2.881 3.142 -2.654 1.00 32.22 H ATOM 27 HB3 CYS A 3 -2.850 3.897 -1.064 1.00 33.14 H ATOM 28 N SER A 4 -1.114 6.291 -0.706 1.00 55.14 N ATOM 29 CA SER A 4 -1.009 7.395 0.240 1.00 2.13 C ATOM 30 C SER A 4 -0.259 8.571 -0.378 1.00 41.11 C ATOM 31 O SER A 4 -0.169 9.645 0.215 1.00 22.13 O ATOM 32 CB SER A 4 -0.298 6.936 1.515 1.00 61.32 C ATOM 33 OG SER A 4 -0.987 7.379 2.671 1.00 21.00 O ATOM 34 H SER A 4 -0.529 5.512 -0.600 1.00 70.03 H ATOM 35 HA SER A 4 -2.010 7.713 0.491 1.00 4.44 H ATOM 36 HB2 SER A 4 -0.252 5.858 1.529 1.00 24.53 H ATOM 37 HB3 SER A 4 0.704 7.340 1.530 1.00 22.51 H ATOM 38 HG SER A 4 -0.697 6.870 3.432 1.00 42.04 H ATOM 39 N ASN A 5 0.278 8.359 -1.575 1.00 72.23 N ATOM 40 CA ASN A 5 1.021 9.400 -2.275 1.00 51.34 C ATOM 41 C ASN A 5 0.199 9.977 -3.424 1.00 34.22 C ATOM 42 O ASN A 5 -0.576 9.278 -4.078 1.00 24.20 O ATOM 43 CB ASN A 5 2.342 8.842 -2.809 1.00 51.30 C ATOM 44 CG ASN A 5 3.533 9.286 -1.982 1.00 41.32 C ATOM 45 OD1 ASN A 5 3.393 9.637 -0.810 1.00 44.15 O ATOM 46 ND2 ASN A 5 4.713 9.273 -2.591 1.00 3.22 N ATOM 47 H ASN A 5 0.172 7.481 -1.998 1.00 42.01 H ATOM 48 HA ASN A 5 1.233 10.188 -1.568 1.00 53.25 H ATOM 49 HB2 ASN A 5 2.301 7.763 -2.795 1.00 63.23 H ATOM 50 HB3 ASN A 5 2.485 9.180 -3.824 1.00 50.33 H ATOM 51 HD21 ASN A 5 5.500 9.555 -2.079 1.00 64.25 H ATOM 52 HD22 ASN A 5 4.749 8.982 -3.526 1.00 61.11 H ATOM 53 N PRO A 6 0.369 11.283 -3.676 1.00 44.04 N ATOM 54 CA PRO A 6 -0.347 11.983 -4.747 1.00 32.40 C ATOM 55 C PRO A 6 0.119 11.553 -6.134 1.00 4.13 C ATOM 56 O PRO A 6 -0.644 11.599 -7.098 1.00 11.23 O ATOM 57 CB PRO A 6 -0.006 13.454 -4.500 1.00 5.12 C ATOM 58 CG PRO A 6 1.297 13.424 -3.777 1.00 12.31 C ATOM 59 CD PRO A 6 1.276 12.177 -2.937 1.00 13.42 C ATOM 60 HA PRO A 6 -1.415 11.841 -4.668 1.00 31.01 H ATOM 61 HB2 PRO A 6 0.078 13.971 -5.446 1.00 23.43 H ATOM 62 HB3 PRO A 6 -0.779 13.911 -3.901 1.00 2.21 H ATOM 63 HG2 PRO A 6 2.110 13.385 -4.486 1.00 15.10 H ATOM 64 HG3 PRO A 6 1.387 14.298 -3.148 1.00 62.22 H ATOM 65 HD2 PRO A 6 2.266 11.752 -2.868 1.00 31.01 H ATOM 66 HD3 PRO A 6 0.886 12.392 -1.953 1.00 11.04 H ATOM 67 N ALA A 7 1.378 11.135 -6.227 1.00 14.24 N ATOM 68 CA ALA A 7 1.945 10.695 -7.495 1.00 53.12 C ATOM 69 C ALA A 7 1.759 9.194 -7.688 1.00 71.12 C ATOM 70 O ALA A 7 1.771 8.696 -8.814 1.00 41.15 O ATOM 71 CB ALA A 7 3.420 11.060 -7.569 1.00 11.03 C ATOM 72 H ALA A 7 1.937 11.121 -5.422 1.00 41.35 H ATOM 73 HA ALA A 7 1.430 11.216 -8.290 1.00 1.54 H ATOM 74 HB1 ALA A 7 3.525 12.135 -7.547 1.00 4.12 H ATOM 75 HB2 ALA A 7 3.939 10.630 -6.726 1.00 25.42 H ATOM 76 HB3 ALA A 7 3.840 10.676 -8.486 1.00 22.40 H ATOM 77 N CYS A 8 1.587 8.477 -6.583 1.00 25.32 N ATOM 78 CA CYS A 8 1.400 7.032 -6.630 1.00 23.34 C ATOM 79 C CYS A 8 0.202 6.666 -7.501 1.00 13.44 C ATOM 80 O CYS A 8 0.108 5.549 -8.007 1.00 75.13 O ATOM 81 CB CYS A 8 1.207 6.475 -5.217 1.00 52.55 C ATOM 82 SG CYS A 8 2.680 5.650 -4.535 1.00 44.20 S ATOM 83 H CYS A 8 1.587 8.931 -5.713 1.00 62.52 H ATOM 84 HA CYS A 8 2.289 6.596 -7.060 1.00 73.42 H ATOM 85 HB2 CYS A 8 0.948 7.286 -4.552 1.00 54.20 H ATOM 86 HB3 CYS A 8 0.402 5.755 -5.230 1.00 10.44 H ATOM 87 N MET A 9 -0.711 7.617 -7.670 1.00 13.11 N ATOM 88 CA MET A 9 -1.903 7.396 -8.481 1.00 30.02 C ATOM 89 C MET A 9 -1.591 7.569 -9.964 1.00 13.31 C ATOM 90 O MET A 9 -2.307 7.054 -10.824 1.00 14.04 O ATOM 91 CB MET A 9 -3.015 8.361 -8.065 1.00 50.03 C ATOM 92 CG MET A 9 -2.639 9.825 -8.223 1.00 52.40 C ATOM 93 SD MET A 9 -3.897 10.775 -9.100 1.00 23.24 S ATOM 94 CE MET A 9 -4.659 11.661 -7.743 1.00 4.53 C ATOM 95 H MET A 9 -0.581 8.488 -7.240 1.00 41.44 H ATOM 96 HA MET A 9 -2.236 6.383 -8.311 1.00 2.12 H ATOM 97 HB2 MET A 9 -3.888 8.168 -8.671 1.00 43.32 H ATOM 98 HB3 MET A 9 -3.260 8.185 -7.029 1.00 32.35 H ATOM 99 HG2 MET A 9 -2.503 10.256 -7.242 1.00 45.34 H ATOM 100 HG3 MET A 9 -1.712 9.887 -8.773 1.00 41.12 H ATOM 101 HE1 MET A 9 -4.189 12.629 -7.636 1.00 63.42 H ATOM 102 HE2 MET A 9 -5.711 11.793 -7.944 1.00 54.14 H ATOM 103 HE3 MET A 9 -4.535 11.098 -6.830 1.00 65.20 H ATOM 104 N LEU A 10 -0.520 8.297 -10.257 1.00 43.44 N ATOM 105 CA LEU A 10 -0.113 8.539 -11.637 1.00 73.15 C ATOM 106 C LEU A 10 1.059 7.643 -12.024 1.00 43.44 C ATOM 107 O LEU A 10 1.356 7.466 -13.206 1.00 40.22 O ATOM 108 CB LEU A 10 0.268 10.008 -11.828 1.00 53.11 C ATOM 109 CG LEU A 10 -0.887 11.010 -11.795 1.00 45.42 C ATOM 110 CD1 LEU A 10 -0.356 12.432 -11.696 1.00 11.24 C ATOM 111 CD2 LEU A 10 -1.766 10.852 -13.027 1.00 45.33 C ATOM 112 H LEU A 10 0.011 8.682 -9.530 1.00 5.13 H ATOM 113 HA LEU A 10 -0.953 8.307 -12.275 1.00 52.54 H ATOM 114 HB2 LEU A 10 0.959 10.275 -11.044 1.00 22.43 H ATOM 115 HB3 LEU A 10 0.760 10.100 -12.786 1.00 73.40 H ATOM 116 HG LEU A 10 -1.496 10.820 -10.922 1.00 44.11 H ATOM 117 HD11 LEU A 10 -0.747 13.020 -12.512 1.00 44.13 H ATOM 118 HD12 LEU A 10 0.723 12.418 -11.745 1.00 54.25 H ATOM 119 HD13 LEU A 10 -0.667 12.867 -10.757 1.00 0.30 H ATOM 120 HD21 LEU A 10 -1.982 9.806 -13.183 1.00 62.12 H ATOM 121 HD22 LEU A 10 -1.249 11.246 -13.890 1.00 50.12 H ATOM 122 HD23 LEU A 10 -2.689 11.394 -12.883 1.00 11.15 H ATOM 123 N LYS A 11 1.722 7.079 -11.021 1.00 21.32 N ATOM 124 CA LYS A 11 2.860 6.198 -11.255 1.00 24.05 C ATOM 125 C LYS A 11 2.489 4.744 -10.979 1.00 42.42 C ATOM 126 O LYS A 11 3.239 3.829 -11.314 1.00 61.53 O ATOM 127 CB LYS A 11 4.040 6.610 -10.371 1.00 43.33 C ATOM 128 CG LYS A 11 5.232 7.135 -11.154 1.00 33.12 C ATOM 129 CD LYS A 11 6.526 6.969 -10.376 1.00 44.11 C ATOM 130 CE LYS A 11 7.567 7.994 -10.801 1.00 61.21 C ATOM 131 NZ LYS A 11 8.580 8.230 -9.736 1.00 23.03 N ATOM 132 H LYS A 11 1.438 7.258 -10.100 1.00 11.24 H ATOM 133 HA LYS A 11 3.147 6.294 -12.291 1.00 32.21 H ATOM 134 HB2 LYS A 11 3.713 7.384 -9.692 1.00 61.32 H ATOM 135 HB3 LYS A 11 4.362 5.753 -9.798 1.00 62.42 H ATOM 136 HG2 LYS A 11 5.310 6.589 -12.082 1.00 52.23 H ATOM 137 HG3 LYS A 11 5.080 8.184 -11.363 1.00 14.44 H ATOM 138 HD2 LYS A 11 6.323 7.095 -9.323 1.00 53.41 H ATOM 139 HD3 LYS A 11 6.918 5.977 -10.552 1.00 54.04 H ATOM 140 HE2 LYS A 11 8.067 7.634 -11.687 1.00 75.14 H ATOM 141 HE3 LYS A 11 7.067 8.925 -11.023 1.00 35.21 H ATOM 142 HZ1 LYS A 11 8.878 9.226 -9.740 1.00 0.32 H ATOM 143 HZ2 LYS A 11 9.414 7.629 -9.897 1.00 1.25 H ATOM 144 HZ3 LYS A 11 8.179 8.003 -8.804 1.00 14.12 H ATOM 145 N ASN A 12 1.327 4.541 -10.368 1.00 74.21 N ATOM 146 CA ASN A 12 0.856 3.198 -10.049 1.00 32.11 C ATOM 147 C ASN A 12 -0.669 3.141 -10.052 1.00 62.35 C ATOM 148 O ASN A 12 -1.311 2.977 -9.015 1.00 70.40 O ATOM 149 CB ASN A 12 1.391 2.758 -8.684 1.00 54.35 C ATOM 150 CG ASN A 12 2.897 2.580 -8.684 1.00 14.22 C ATOM 151 OD1 ASN A 12 3.402 1.472 -8.862 1.00 71.21 O ATOM 152 ND2 ASN A 12 3.622 3.674 -8.482 1.00 55.53 N ATOM 153 H ASN A 12 0.772 5.312 -10.126 1.00 22.43 H ATOM 154 HA ASN A 12 1.231 2.526 -10.806 1.00 45.42 H ATOM 155 HB2 ASN A 12 1.136 3.506 -7.947 1.00 72.40 H ATOM 156 HB3 ASN A 12 0.935 1.819 -8.411 1.00 71.41 H ATOM 157 HD21 ASN A 12 4.598 3.588 -8.478 1.00 13.25 H ATOM 158 HD22 ASN A 12 3.151 4.524 -8.347 1.00 71.42 H ATOM 159 N PRO A 13 -1.263 3.279 -11.247 1.00 32.31 N ATOM 160 CA PRO A 13 -2.719 3.245 -11.415 1.00 51.12 C ATOM 161 C PRO A 13 -3.298 1.855 -11.178 1.00 71.50 C ATOM 162 O PRO A 13 -4.504 1.697 -10.996 1.00 14.23 O ATOM 163 CB PRO A 13 -2.917 3.665 -12.874 1.00 14.33 C ATOM 164 CG PRO A 13 -1.644 3.294 -13.551 1.00 43.04 C ATOM 165 CD PRO A 13 -0.560 3.478 -12.525 1.00 61.53 C ATOM 166 HA PRO A 13 -3.210 3.954 -10.765 1.00 31.04 H ATOM 167 HB2 PRO A 13 -3.759 3.132 -13.293 1.00 51.22 H ATOM 168 HB3 PRO A 13 -3.096 4.729 -12.925 1.00 20.34 H ATOM 169 HG2 PRO A 13 -1.685 2.265 -13.873 1.00 32.41 H ATOM 170 HG3 PRO A 13 -1.474 3.946 -14.396 1.00 30.24 H ATOM 171 HD2 PRO A 13 0.215 2.737 -12.658 1.00 40.23 H ATOM 172 HD3 PRO A 13 -0.147 4.474 -12.586 1.00 71.24 H ATOM 173 N ASN A 14 -2.430 0.848 -11.181 1.00 44.44 N ATOM 174 CA ASN A 14 -2.856 -0.530 -10.967 1.00 4.35 C ATOM 175 C ASN A 14 -3.081 -0.804 -9.483 1.00 22.42 C ATOM 176 O ASN A 14 -3.561 -1.873 -9.104 1.00 33.51 O ATOM 177 CB ASN A 14 -1.813 -1.501 -11.524 1.00 3.32 C ATOM 178 CG ASN A 14 -1.884 -1.621 -13.034 1.00 22.52 C ATOM 179 OD1 ASN A 14 -1.709 -0.639 -13.755 1.00 63.31 O ATOM 180 ND2 ASN A 14 -2.142 -2.830 -13.519 1.00 32.31 N ATOM 181 H ASN A 14 -1.480 1.037 -11.332 1.00 62.23 H ATOM 182 HA ASN A 14 -3.787 -0.675 -11.493 1.00 42.40 H ATOM 183 HB2 ASN A 14 -0.826 -1.152 -11.256 1.00 42.22 H ATOM 184 HB3 ASN A 14 -1.973 -2.478 -11.094 1.00 72.15 H ATOM 185 HD21 ASN A 14 -2.193 -2.937 -14.492 1.00 12.02 H ATOM 186 HD22 ASN A 14 -2.271 -3.566 -12.885 1.00 23.44 H ATOM 187 N LEU A 15 -2.731 0.167 -8.647 1.00 54.43 N ATOM 188 CA LEU A 15 -2.896 0.032 -7.204 1.00 62.41 C ATOM 189 C LEU A 15 -3.823 1.112 -6.658 1.00 10.44 C ATOM 190 O LEU A 15 -4.796 0.818 -5.963 1.00 21.35 O ATOM 191 CB LEU A 15 -1.537 0.109 -6.507 1.00 4.24 C ATOM 192 CG LEU A 15 -1.036 -1.186 -5.866 1.00 41.12 C ATOM 193 CD1 LEU A 15 0.294 -0.955 -5.165 1.00 33.31 C ATOM 194 CD2 LEU A 15 -2.068 -1.732 -4.890 1.00 60.14 C ATOM 195 H LEU A 15 -2.354 0.996 -9.008 1.00 41.22 H ATOM 196 HA LEU A 15 -3.336 -0.935 -7.010 1.00 70.24 H ATOM 197 HB2 LEU A 15 -0.807 0.420 -7.238 1.00 62.44 H ATOM 198 HB3 LEU A 15 -1.606 0.858 -5.730 1.00 55.03 H ATOM 199 HG LEU A 15 -0.881 -1.926 -6.639 1.00 42.13 H ATOM 200 HD11 LEU A 15 1.040 -1.613 -5.583 1.00 21.50 H ATOM 201 HD12 LEU A 15 0.184 -1.159 -4.110 1.00 2.00 H ATOM 202 HD13 LEU A 15 0.600 0.071 -5.303 1.00 10.41 H ATOM 203 HD21 LEU A 15 -2.532 -0.913 -4.361 1.00 64.11 H ATOM 204 HD22 LEU A 15 -1.582 -2.389 -4.184 1.00 34.00 H ATOM 205 HD23 LEU A 15 -2.822 -2.283 -5.435 1.00 4.14 H ATOM 206 N CYS A 16 -3.516 2.365 -6.978 1.00 15.11 N ATOM 207 CA CYS A 16 -4.322 3.491 -6.521 1.00 75.22 C ATOM 208 C CYS A 16 -4.321 4.615 -7.553 1.00 4.10 C ATOM 209 O CYS A 16 -5.193 5.484 -7.540 1.00 21.21 O ATOM 210 CB CYS A 16 -3.797 4.012 -5.182 1.00 65.42 C ATOM 211 SG CYS A 16 -4.913 5.188 -4.352 1.00 24.32 S ATOM 212 H CYS A 16 -2.728 2.537 -7.535 1.00 40.14 H ATOM 213 HA CYS A 16 -5.335 3.142 -6.389 1.00 73.01 H ATOM 214 HB2 CYS A 16 -3.645 3.176 -4.514 1.00 51.12 H ATOM 215 HB3 CYS A 16 -2.853 4.511 -5.345 1.00 11.54 H TER 216 CYS A 16 ENDMDL MODEL 18 ATOM 1 N GLY A 1 0.999 0.004 -0.272 1.00 51.14 N ATOM 2 CA GLY A 1 1.907 -0.002 -1.405 1.00 14.13 C ATOM 3 C GLY A 1 2.010 1.355 -2.072 1.00 41.20 C ATOM 4 O GLY A 1 2.986 2.080 -1.875 1.00 21.33 O ATOM 5 H1 GLY A 1 1.233 0.503 0.538 1.00 11.20 H ATOM 6 HA2 GLY A 1 2.887 -0.300 -1.065 1.00 21.14 H ATOM 7 HA3 GLY A 1 1.554 -0.721 -2.130 1.00 42.41 H ATOM 8 N CYS A 2 1.002 1.701 -2.866 1.00 62.30 N ATOM 9 CA CYS A 2 0.984 2.979 -3.567 1.00 71.22 C ATOM 10 C CYS A 2 -0.418 3.582 -3.561 1.00 43.43 C ATOM 11 O CYS A 2 -1.311 3.113 -4.267 1.00 41.22 O ATOM 12 CB CYS A 2 1.468 2.801 -5.007 1.00 44.14 C ATOM 13 SG CYS A 2 2.906 3.832 -5.441 1.00 5.14 S ATOM 14 H CYS A 2 0.251 1.080 -2.984 1.00 5.42 H ATOM 15 HA CYS A 2 1.654 3.650 -3.052 1.00 34.05 H ATOM 16 HB2 CYS A 2 1.748 1.769 -5.160 1.00 75.34 H ATOM 17 HB3 CYS A 2 0.665 3.055 -5.683 1.00 44.33 H ATOM 18 N CYS A 3 -0.603 4.626 -2.760 1.00 1.02 N ATOM 19 CA CYS A 3 -1.894 5.295 -2.661 1.00 35.14 C ATOM 20 C CYS A 3 -1.808 6.512 -1.744 1.00 21.55 C ATOM 21 O CYS A 3 -2.529 7.493 -1.927 1.00 25.51 O ATOM 22 CB CYS A 3 -2.956 4.324 -2.140 1.00 13.43 C ATOM 23 SG CYS A 3 -4.666 4.924 -2.324 1.00 54.22 S ATOM 24 H CYS A 3 0.148 4.955 -2.221 1.00 30.20 H ATOM 25 HA CYS A 3 -2.175 5.624 -3.650 1.00 4.35 H ATOM 26 HB2 CYS A 3 -2.876 3.392 -2.679 1.00 71.22 H ATOM 27 HB3 CYS A 3 -2.783 4.143 -1.089 1.00 64.54 H ATOM 28 N SER A 4 -0.921 6.440 -0.756 1.00 62.44 N ATOM 29 CA SER A 4 -0.742 7.533 0.192 1.00 61.02 C ATOM 30 C SER A 4 0.060 8.670 -0.435 1.00 34.21 C ATOM 31 O SER A 4 0.211 9.737 0.158 1.00 64.01 O ATOM 32 CB SER A 4 -0.037 7.032 1.454 1.00 64.35 C ATOM 33 OG SER A 4 -0.680 7.510 2.622 1.00 53.32 O ATOM 34 H SER A 4 -0.375 5.631 -0.662 1.00 74.52 H ATOM 35 HA SER A 4 -1.720 7.903 0.459 1.00 34.05 H ATOM 36 HB2 SER A 4 -0.051 5.953 1.466 1.00 65.40 H ATOM 37 HB3 SER A 4 0.987 7.379 1.452 1.00 34.25 H ATOM 38 HG SER A 4 -0.610 6.853 3.318 1.00 2.43 H ATOM 39 N ASN A 5 0.571 8.432 -1.639 1.00 34.34 N ATOM 40 CA ASN A 5 1.358 9.435 -2.347 1.00 35.31 C ATOM 41 C ASN A 5 0.551 10.057 -3.483 1.00 33.43 C ATOM 42 O ASN A 5 -0.266 9.400 -4.129 1.00 13.21 O ATOM 43 CB ASN A 5 2.640 8.810 -2.900 1.00 31.30 C ATOM 44 CG ASN A 5 3.861 9.169 -2.075 1.00 35.43 C ATOM 45 OD1 ASN A 5 4.454 10.232 -2.254 1.00 11.31 O ATOM 46 ND2 ASN A 5 4.241 8.280 -1.165 1.00 23.35 N ATOM 47 H ASN A 5 0.415 7.561 -2.061 1.00 23.15 H ATOM 48 HA ASN A 5 1.620 10.209 -1.642 1.00 20.45 H ATOM 49 HB2 ASN A 5 2.536 7.734 -2.904 1.00 41.35 H ATOM 50 HB3 ASN A 5 2.796 9.156 -3.910 1.00 40.53 H ATOM 51 HD21 ASN A 5 5.027 8.487 -0.617 1.00 20.44 H ATOM 52 HD22 ASN A 5 3.721 7.454 -1.077 1.00 71.35 H ATOM 53 N PRO A 6 0.784 11.353 -3.733 1.00 44.34 N ATOM 54 CA PRO A 6 0.090 12.092 -4.792 1.00 45.43 C ATOM 55 C PRO A 6 0.517 11.645 -6.186 1.00 53.14 C ATOM 56 O PRO A 6 -0.264 11.712 -7.136 1.00 24.04 O ATOM 57 CB PRO A 6 0.510 13.544 -4.545 1.00 35.30 C ATOM 58 CG PRO A 6 1.818 13.445 -3.839 1.00 51.23 C ATOM 59 CD PRO A 6 1.744 12.198 -3.003 1.00 24.21 C ATOM 60 HA PRO A 6 -0.982 12.005 -4.700 1.00 32.23 H ATOM 61 HB2 PRO A 6 0.607 14.059 -5.490 1.00 62.13 H ATOM 62 HB3 PRO A 6 -0.232 14.037 -3.935 1.00 2.23 H ATOM 63 HG2 PRO A 6 2.618 13.368 -4.559 1.00 64.41 H ATOM 64 HG3 PRO A 6 1.961 14.311 -3.209 1.00 74.41 H ATOM 65 HD2 PRO A 6 2.713 11.722 -2.948 1.00 55.53 H ATOM 66 HD3 PRO A 6 1.379 12.428 -2.013 1.00 53.21 H ATOM 67 N ALA A 7 1.759 11.189 -6.302 1.00 65.51 N ATOM 68 CA ALA A 7 2.288 10.728 -7.580 1.00 21.20 C ATOM 69 C ALA A 7 2.015 9.242 -7.783 1.00 75.55 C ATOM 70 O ALA A 7 1.985 8.754 -8.914 1.00 0.20 O ATOM 71 CB ALA A 7 3.781 11.008 -7.665 1.00 41.24 C ATOM 72 H ALA A 7 2.334 11.160 -5.509 1.00 32.41 H ATOM 73 HA ALA A 7 1.797 11.285 -8.365 1.00 33.22 H ATOM 74 HB1 ALA A 7 4.265 10.212 -8.213 1.00 2.23 H ATOM 75 HB2 ALA A 7 3.942 11.946 -8.175 1.00 44.23 H ATOM 76 HB3 ALA A 7 4.194 11.063 -6.669 1.00 42.54 H ATOM 77 N CYS A 8 1.816 8.525 -6.682 1.00 54.12 N ATOM 78 CA CYS A 8 1.546 7.094 -6.739 1.00 35.41 C ATOM 79 C CYS A 8 0.319 6.805 -7.600 1.00 44.13 C ATOM 80 O CYS A 8 0.154 5.698 -8.111 1.00 35.43 O ATOM 81 CB CYS A 8 1.335 6.537 -5.330 1.00 32.25 C ATOM 82 SG CYS A 8 2.765 5.621 -4.670 1.00 40.22 S ATOM 83 H CYS A 8 1.851 8.970 -5.809 1.00 5.22 H ATOM 84 HA CYS A 8 2.403 6.611 -7.183 1.00 2.35 H ATOM 85 HB2 CYS A 8 1.130 7.355 -4.655 1.00 1.25 H ATOM 86 HB3 CYS A 8 0.489 5.865 -5.339 1.00 24.11 H ATOM 87 N MET A 9 -0.536 7.810 -7.757 1.00 74.31 N ATOM 88 CA MET A 9 -1.747 7.664 -8.558 1.00 5.43 C ATOM 89 C MET A 9 -1.439 7.826 -10.043 1.00 5.41 C ATOM 90 O MET A 9 -2.188 7.352 -10.898 1.00 3.20 O ATOM 91 CB MET A 9 -2.795 8.692 -8.127 1.00 40.13 C ATOM 92 CG MET A 9 -4.039 8.071 -7.513 1.00 24.43 C ATOM 93 SD MET A 9 -5.098 9.288 -6.709 1.00 34.34 S ATOM 94 CE MET A 9 -6.720 8.658 -7.134 1.00 33.11 C ATOM 95 H MET A 9 -0.350 8.670 -7.325 1.00 61.42 H ATOM 96 HA MET A 9 -2.138 6.672 -8.389 1.00 43.33 H ATOM 97 HB2 MET A 9 -2.353 9.356 -7.399 1.00 53.25 H ATOM 98 HB3 MET A 9 -3.096 9.266 -8.991 1.00 44.11 H ATOM 99 HG2 MET A 9 -4.604 7.582 -8.292 1.00 61.11 H ATOM 100 HG3 MET A 9 -3.733 7.339 -6.780 1.00 32.43 H ATOM 101 HE1 MET A 9 -7.467 9.407 -6.911 1.00 64.23 H ATOM 102 HE2 MET A 9 -6.750 8.422 -8.187 1.00 73.13 H ATOM 103 HE3 MET A 9 -6.922 7.766 -6.559 1.00 42.12 H ATOM 104 N LEU A 10 -0.333 8.499 -10.343 1.00 62.32 N ATOM 105 CA LEU A 10 0.074 8.723 -11.726 1.00 1.40 C ATOM 106 C LEU A 10 1.192 7.766 -12.127 1.00 53.01 C ATOM 107 O LEU A 10 1.468 7.578 -13.312 1.00 52.12 O ATOM 108 CB LEU A 10 0.534 10.170 -11.914 1.00 43.11 C ATOM 109 CG LEU A 10 -0.556 11.238 -11.827 1.00 15.10 C ATOM 110 CD1 LEU A 10 0.044 12.628 -11.971 1.00 63.33 C ATOM 111 CD2 LEU A 10 -1.620 11.002 -12.889 1.00 51.03 C ATOM 112 H LEU A 10 0.224 8.853 -9.619 1.00 33.41 H ATOM 113 HA LEU A 10 -0.783 8.542 -12.357 1.00 60.22 H ATOM 114 HB2 LEU A 10 1.269 10.385 -11.153 1.00 73.02 H ATOM 115 HB3 LEU A 10 0.996 10.245 -12.889 1.00 14.43 H ATOM 116 HG LEU A 10 -1.032 11.180 -10.858 1.00 30.25 H ATOM 117 HD11 LEU A 10 1.070 12.613 -11.634 1.00 54.31 H ATOM 118 HD12 LEU A 10 -0.521 13.328 -11.375 1.00 12.04 H ATOM 119 HD13 LEU A 10 0.010 12.929 -13.008 1.00 73.22 H ATOM 120 HD21 LEU A 10 -2.256 10.183 -12.587 1.00 4.24 H ATOM 121 HD22 LEU A 10 -1.143 10.760 -13.828 1.00 14.42 H ATOM 122 HD23 LEU A 10 -2.215 11.896 -13.008 1.00 12.13 H ATOM 123 N LYS A 11 1.831 7.161 -11.132 1.00 30.12 N ATOM 124 CA LYS A 11 2.917 6.219 -11.379 1.00 54.54 C ATOM 125 C LYS A 11 2.469 4.788 -11.101 1.00 64.01 C ATOM 126 O LYS A 11 3.164 3.833 -11.445 1.00 24.11 O ATOM 127 CB LYS A 11 4.127 6.565 -10.509 1.00 42.14 C ATOM 128 CG LYS A 11 5.335 7.029 -11.305 1.00 23.52 C ATOM 129 CD LYS A 11 6.629 6.792 -10.543 1.00 14.10 C ATOM 130 CE LYS A 11 7.610 7.937 -10.742 1.00 62.35 C ATOM 131 NZ LYS A 11 7.893 8.654 -9.468 1.00 72.42 N ATOM 132 H LYS A 11 1.565 7.352 -10.207 1.00 63.43 H ATOM 133 HA LYS A 11 3.196 6.301 -12.419 1.00 11.01 H ATOM 134 HB2 LYS A 11 3.850 7.352 -9.824 1.00 11.40 H ATOM 135 HB3 LYS A 11 4.410 5.689 -9.943 1.00 11.41 H ATOM 136 HG2 LYS A 11 5.374 6.482 -12.236 1.00 14.35 H ATOM 137 HG3 LYS A 11 5.236 8.085 -11.509 1.00 45.22 H ATOM 138 HD2 LYS A 11 6.405 6.704 -9.490 1.00 64.11 H ATOM 139 HD3 LYS A 11 7.081 5.876 -10.895 1.00 21.31 H ATOM 140 HE2 LYS A 11 8.534 7.538 -11.133 1.00 74.33 H ATOM 141 HE3 LYS A 11 7.190 8.634 -11.453 1.00 23.25 H ATOM 142 HZ1 LYS A 11 7.300 8.271 -8.704 1.00 2.41 H ATOM 143 HZ2 LYS A 11 7.689 9.668 -9.576 1.00 60.25 H ATOM 144 HZ3 LYS A 11 8.893 8.539 -9.208 1.00 32.43 H ATOM 145 N ASN A 12 1.304 4.647 -10.478 1.00 10.42 N ATOM 146 CA ASN A 12 0.764 3.332 -10.154 1.00 71.25 C ATOM 147 C ASN A 12 -0.761 3.361 -10.130 1.00 73.01 C ATOM 148 O ASN A 12 -1.393 3.243 -9.080 1.00 25.14 O ATOM 149 CB ASN A 12 1.298 2.857 -8.802 1.00 32.34 C ATOM 150 CG ASN A 12 2.791 2.595 -8.829 1.00 62.42 C ATOM 151 OD1 ASN A 12 3.230 1.462 -9.028 1.00 63.13 O ATOM 152 ND2 ASN A 12 3.580 3.644 -8.628 1.00 53.15 N ATOM 153 H ASN A 12 0.795 5.447 -10.229 1.00 1.12 H ATOM 154 HA ASN A 12 1.087 2.644 -10.921 1.00 21.42 H ATOM 155 HB2 ASN A 12 1.099 3.614 -8.057 1.00 34.30 H ATOM 156 HB3 ASN A 12 0.795 1.943 -8.523 1.00 61.34 H ATOM 157 HD21 ASN A 12 4.549 3.503 -8.642 1.00 4.23 H ATOM 158 HD22 ASN A 12 3.160 4.517 -8.476 1.00 32.40 H ATOM 159 N PRO A 13 -1.369 3.521 -11.315 1.00 11.40 N ATOM 160 CA PRO A 13 -2.827 3.569 -11.457 1.00 34.53 C ATOM 161 C PRO A 13 -3.479 2.215 -11.195 1.00 53.21 C ATOM 162 O PRO A 13 -4.682 2.132 -10.952 1.00 74.00 O ATOM 163 CB PRO A 13 -3.029 3.986 -12.916 1.00 24.14 C ATOM 164 CG PRO A 13 -1.791 3.537 -13.612 1.00 44.13 C ATOM 165 CD PRO A 13 -0.679 3.668 -12.608 1.00 14.53 C ATOM 166 HA PRO A 13 -3.266 4.310 -10.805 1.00 25.03 H ATOM 167 HB2 PRO A 13 -3.907 3.498 -13.315 1.00 24.55 H ATOM 168 HB3 PRO A 13 -3.148 5.057 -12.974 1.00 41.32 H ATOM 169 HG2 PRO A 13 -1.896 2.509 -13.923 1.00 31.35 H ATOM 170 HG3 PRO A 13 -1.600 4.171 -14.466 1.00 72.51 H ATOM 171 HD2 PRO A 13 0.050 2.884 -12.747 1.00 50.41 H ATOM 172 HD3 PRO A 13 -0.212 4.639 -12.686 1.00 54.14 H ATOM 173 N ASN A 14 -2.677 1.157 -11.246 1.00 44.01 N ATOM 174 CA ASN A 14 -3.176 -0.193 -11.014 1.00 74.35 C ATOM 175 C ASN A 14 -3.344 -0.463 -9.522 1.00 44.01 C ATOM 176 O ASN A 14 -3.882 -1.496 -9.123 1.00 71.42 O ATOM 177 CB ASN A 14 -2.225 -1.224 -11.627 1.00 14.41 C ATOM 178 CG ASN A 14 -0.838 -1.163 -11.018 1.00 63.12 C ATOM 179 OD1 ASN A 14 -0.250 -0.089 -10.892 1.00 5.02 O ATOM 180 ND2 ASN A 14 -0.308 -2.320 -10.638 1.00 3.20 N ATOM 181 H ASN A 14 -1.726 1.287 -11.445 1.00 2.04 H ATOM 182 HA ASN A 14 -4.140 -0.277 -11.494 1.00 11.33 H ATOM 183 HB2 ASN A 14 -2.625 -2.214 -11.465 1.00 72.23 H ATOM 184 HB3 ASN A 14 -2.142 -1.042 -12.688 1.00 22.12 H ATOM 185 HD21 ASN A 14 0.588 -2.310 -10.241 1.00 1.53 H ATOM 186 HD22 ASN A 14 -0.834 -3.136 -10.769 1.00 70.15 H ATOM 187 N LEU A 15 -2.879 0.473 -8.702 1.00 11.11 N ATOM 188 CA LEU A 15 -2.977 0.338 -7.253 1.00 34.23 C ATOM 189 C LEU A 15 -3.873 1.423 -6.664 1.00 31.00 C ATOM 190 O LEU A 15 -4.808 1.134 -5.917 1.00 31.42 O ATOM 191 CB LEU A 15 -1.587 0.408 -6.619 1.00 11.53 C ATOM 192 CG LEU A 15 -1.036 -0.904 -6.061 1.00 32.32 C ATOM 193 CD1 LEU A 15 -1.755 -1.281 -4.774 1.00 45.32 C ATOM 194 CD2 LEU A 15 -1.165 -2.017 -7.091 1.00 23.13 C ATOM 195 H LEU A 15 -2.460 1.274 -9.079 1.00 11.54 H ATOM 196 HA LEU A 15 -3.413 -0.627 -7.039 1.00 10.11 H ATOM 197 HB2 LEU A 15 -0.899 0.763 -7.370 1.00 64.24 H ATOM 198 HB3 LEU A 15 -1.630 1.122 -5.808 1.00 33.33 H ATOM 199 HG LEU A 15 0.013 -0.779 -5.832 1.00 2.31 H ATOM 200 HD11 LEU A 15 -2.707 -0.775 -4.733 1.00 75.40 H ATOM 201 HD12 LEU A 15 -1.153 -0.986 -3.927 1.00 15.41 H ATOM 202 HD13 LEU A 15 -1.911 -2.349 -4.749 1.00 73.21 H ATOM 203 HD21 LEU A 15 -0.380 -2.742 -6.937 1.00 22.43 H ATOM 204 HD22 LEU A 15 -1.080 -1.600 -8.083 1.00 52.33 H ATOM 205 HD23 LEU A 15 -2.126 -2.498 -6.983 1.00 55.32 H ATOM 206 N CYS A 16 -3.582 2.673 -7.007 1.00 54.41 N ATOM 207 CA CYS A 16 -4.362 3.803 -6.515 1.00 23.23 C ATOM 208 C CYS A 16 -4.386 4.934 -7.539 1.00 14.15 C ATOM 209 O CYS A 16 -3.680 4.888 -8.546 1.00 11.02 O ATOM 210 CB CYS A 16 -3.784 4.310 -5.192 1.00 20.01 C ATOM 211 SG CYS A 16 -4.832 5.535 -4.344 1.00 41.51 S ATOM 212 H CYS A 16 -2.824 2.841 -7.606 1.00 52.25 H ATOM 213 HA CYS A 16 -5.372 3.462 -6.349 1.00 32.10 H ATOM 214 HB2 CYS A 16 -3.651 3.473 -4.522 1.00 0.03 H ATOM 215 HB3 CYS A 16 -2.825 4.770 -5.379 1.00 51.04 H TER 216 CYS A 16 ENDMDL MODEL 19 ATOM 1 N GLY A 1 3.148 -0.269 -0.762 1.00 2.24 N ATOM 2 CA GLY A 1 1.823 0.211 -1.110 1.00 65.51 C ATOM 3 C GLY A 1 1.852 1.594 -1.728 1.00 54.32 C ATOM 4 O GLY A 1 2.528 2.493 -1.227 1.00 21.21 O ATOM 5 H1 GLY A 1 3.910 0.348 -0.774 1.00 54.44 H ATOM 6 HA2 GLY A 1 1.377 -0.477 -1.813 1.00 20.34 H ATOM 7 HA3 GLY A 1 1.217 0.241 -0.216 1.00 65.44 H ATOM 8 N CYS A 2 1.116 1.767 -2.821 1.00 44.35 N ATOM 9 CA CYS A 2 1.061 3.051 -3.511 1.00 73.40 C ATOM 10 C CYS A 2 -0.359 3.611 -3.504 1.00 23.30 C ATOM 11 O CYS A 2 -1.235 3.121 -4.217 1.00 41.03 O ATOM 12 CB CYS A 2 1.555 2.901 -4.951 1.00 54.13 C ATOM 13 SG CYS A 2 2.961 3.981 -5.371 1.00 34.20 S ATOM 14 H CYS A 2 0.598 1.013 -3.174 1.00 21.31 H ATOM 15 HA CYS A 2 1.708 3.737 -2.987 1.00 50.32 H ATOM 16 HB2 CYS A 2 1.867 1.879 -5.113 1.00 14.45 H ATOM 17 HB3 CYS A 2 0.746 3.136 -5.627 1.00 71.13 H ATOM 18 N CYS A 3 -0.578 4.640 -2.693 1.00 55.32 N ATOM 19 CA CYS A 3 -1.890 5.268 -2.592 1.00 13.11 C ATOM 20 C CYS A 3 -1.844 6.478 -1.663 1.00 70.00 C ATOM 21 O CYS A 3 -2.594 7.438 -1.839 1.00 41.15 O ATOM 22 CB CYS A 3 -2.923 4.260 -2.084 1.00 13.43 C ATOM 23 SG CYS A 3 -4.651 4.809 -2.268 1.00 5.31 S ATOM 24 H CYS A 3 0.160 4.987 -2.149 1.00 23.22 H ATOM 25 HA CYS A 3 -2.177 5.598 -3.579 1.00 14.24 H ATOM 26 HB2 CYS A 3 -2.813 3.336 -2.632 1.00 1.10 H ATOM 27 HB3 CYS A 3 -2.747 4.074 -1.035 1.00 31.23 H ATOM 28 N SER A 4 -0.958 6.424 -0.674 1.00 31.14 N ATOM 29 CA SER A 4 -0.816 7.513 0.285 1.00 1.15 C ATOM 30 C SER A 4 -0.048 8.680 -0.328 1.00 2.03 C ATOM 31 O SER A 4 0.070 9.745 0.276 1.00 53.41 O ATOM 32 CB SER A 4 -0.099 7.022 1.545 1.00 74.33 C ATOM 33 OG SER A 4 -0.761 7.469 2.715 1.00 31.13 O ATOM 34 H SER A 4 -0.388 5.631 -0.585 1.00 54.13 H ATOM 35 HA SER A 4 -1.806 7.850 0.553 1.00 11.24 H ATOM 36 HB2 SER A 4 -0.080 5.943 1.547 1.00 70.51 H ATOM 37 HB3 SER A 4 0.913 7.400 1.550 1.00 13.15 H ATOM 38 HG SER A 4 -1.149 6.718 3.171 1.00 42.12 H ATOM 39 N ASN A 5 0.474 8.469 -1.532 1.00 55.41 N ATOM 40 CA ASN A 5 1.231 9.503 -2.228 1.00 63.12 C ATOM 41 C ASN A 5 0.409 10.111 -3.360 1.00 60.14 C ATOM 42 O ASN A 5 -0.385 9.436 -4.016 1.00 15.14 O ATOM 43 CB ASN A 5 2.534 8.923 -2.783 1.00 72.14 C ATOM 44 CG ASN A 5 3.741 9.311 -1.951 1.00 35.11 C ATOM 45 OD1 ASN A 5 4.205 10.450 -2.004 1.00 32.11 O ATOM 46 ND2 ASN A 5 4.255 8.362 -1.177 1.00 13.43 N ATOM 47 H ASN A 5 0.346 7.598 -1.963 1.00 0.51 H ATOM 48 HA ASN A 5 1.468 10.278 -1.515 1.00 20.44 H ATOM 49 HB2 ASN A 5 2.463 7.845 -2.799 1.00 31.14 H ATOM 50 HB3 ASN A 5 2.682 9.284 -3.790 1.00 10.12 H ATOM 51 HD21 ASN A 5 5.035 8.586 -0.627 1.00 52.25 H ATOM 52 HD22 ASN A 5 3.833 7.478 -1.186 1.00 33.35 H ATOM 53 N PRO A 6 0.603 11.417 -3.598 1.00 23.43 N ATOM 54 CA PRO A 6 -0.110 12.144 -4.651 1.00 40.44 C ATOM 55 C PRO A 6 0.334 11.724 -6.048 1.00 51.44 C ATOM 56 O PRO A 6 -0.445 11.777 -6.999 1.00 53.05 O ATOM 57 CB PRO A 6 0.263 13.605 -4.388 1.00 43.55 C ATOM 58 CG PRO A 6 1.572 13.540 -3.680 1.00 0.44 C ATOM 59 CD PRO A 6 1.535 12.283 -2.856 1.00 34.02 C ATOM 60 HA PRO A 6 -1.180 12.023 -4.563 1.00 63.01 H ATOM 61 HB2 PRO A 6 0.348 14.133 -5.328 1.00 71.23 H ATOM 62 HB3 PRO A 6 -0.495 14.070 -3.776 1.00 24.23 H ATOM 63 HG2 PRO A 6 2.377 13.495 -4.398 1.00 33.54 H ATOM 64 HG3 PRO A 6 1.686 14.403 -3.040 1.00 42.45 H ATOM 65 HD2 PRO A 6 2.517 11.837 -2.803 1.00 12.22 H ATOM 66 HD3 PRO A 6 1.159 12.492 -1.865 1.00 2.21 H ATOM 67 N ALA A 7 1.590 11.307 -6.165 1.00 3.04 N ATOM 68 CA ALA A 7 2.137 10.875 -7.445 1.00 54.52 C ATOM 69 C ALA A 7 1.910 9.383 -7.664 1.00 52.51 C ATOM 70 O ALA A 7 1.899 8.907 -8.799 1.00 73.43 O ATOM 71 CB ALA A 7 3.620 11.203 -7.523 1.00 64.32 C ATOM 72 H ALA A 7 2.163 11.288 -5.370 1.00 31.42 H ATOM 73 HA ALA A 7 1.630 11.425 -8.226 1.00 64.32 H ATOM 74 HB1 ALA A 7 4.126 10.442 -8.100 1.00 21.43 H ATOM 75 HB2 ALA A 7 3.753 12.163 -7.999 1.00 74.23 H ATOM 76 HB3 ALA A 7 4.035 11.234 -6.527 1.00 14.44 H ATOM 77 N CYS A 8 1.730 8.650 -6.570 1.00 52.54 N ATOM 78 CA CYS A 8 1.504 7.212 -6.642 1.00 23.10 C ATOM 79 C CYS A 8 0.290 6.894 -7.510 1.00 42.11 C ATOM 80 O CYS A 8 0.160 5.787 -8.032 1.00 3.22 O ATOM 81 CB CYS A 8 1.307 6.635 -5.239 1.00 12.12 C ATOM 82 SG CYS A 8 2.762 5.757 -4.584 1.00 45.01 S ATOM 83 H CYS A 8 1.749 9.088 -5.693 1.00 23.14 H ATOM 84 HA CYS A 8 2.378 6.761 -7.087 1.00 72.24 H ATOM 85 HB2 CYS A 8 1.075 7.440 -4.556 1.00 44.14 H ATOM 86 HB3 CYS A 8 0.482 5.938 -5.257 1.00 63.22 H ATOM 87 N MET A 9 -0.596 7.873 -7.660 1.00 2.33 N ATOM 88 CA MET A 9 -1.799 7.699 -8.466 1.00 25.53 C ATOM 89 C MET A 9 -1.491 7.885 -9.948 1.00 73.52 C ATOM 90 O MET A 9 -2.223 7.396 -10.810 1.00 61.23 O ATOM 91 CB MET A 9 -2.880 8.689 -8.029 1.00 5.03 C ATOM 92 CG MET A 9 -4.261 8.360 -8.571 1.00 63.42 C ATOM 93 SD MET A 9 -5.587 8.996 -7.528 1.00 44.22 S ATOM 94 CE MET A 9 -7.018 8.635 -8.542 1.00 51.34 C ATOM 95 H MET A 9 -0.437 8.734 -7.219 1.00 13.21 H ATOM 96 HA MET A 9 -2.159 6.693 -8.308 1.00 53.22 H ATOM 97 HB2 MET A 9 -2.932 8.694 -6.950 1.00 43.02 H ATOM 98 HB3 MET A 9 -2.608 9.676 -8.373 1.00 23.23 H ATOM 99 HG2 MET A 9 -4.359 8.791 -9.556 1.00 41.21 H ATOM 100 HG3 MET A 9 -4.358 7.286 -8.640 1.00 14.24 H ATOM 101 HE1 MET A 9 -7.827 9.298 -8.271 1.00 73.01 H ATOM 102 HE2 MET A 9 -6.768 8.780 -9.583 1.00 30.21 H ATOM 103 HE3 MET A 9 -7.322 7.611 -8.384 1.00 12.32 H ATOM 104 N LEU A 10 -0.406 8.594 -10.238 1.00 71.54 N ATOM 105 CA LEU A 10 -0.002 8.844 -11.618 1.00 12.34 C ATOM 106 C LEU A 10 1.146 7.926 -12.024 1.00 52.04 C ATOM 107 O LEU A 10 1.431 7.759 -13.210 1.00 61.53 O ATOM 108 CB LEU A 10 0.413 10.306 -11.790 1.00 43.32 C ATOM 109 CG LEU A 10 -0.645 11.351 -11.435 1.00 1.30 C ATOM 110 CD1 LEU A 10 0.001 12.710 -11.212 1.00 15.20 C ATOM 111 CD2 LEU A 10 -1.701 11.433 -12.527 1.00 52.43 C ATOM 112 H LEU A 10 0.137 8.957 -9.509 1.00 1.31 H ATOM 113 HA LEU A 10 -0.851 8.642 -12.253 1.00 54.43 H ATOM 114 HB2 LEU A 10 1.274 10.482 -11.163 1.00 61.55 H ATOM 115 HB3 LEU A 10 0.688 10.451 -12.825 1.00 44.04 H ATOM 116 HG LEU A 10 -1.135 11.060 -10.516 1.00 2.31 H ATOM 117 HD11 LEU A 10 -0.768 13.461 -11.107 1.00 30.22 H ATOM 118 HD12 LEU A 10 0.628 12.953 -12.056 1.00 42.45 H ATOM 119 HD13 LEU A 10 0.601 12.680 -10.314 1.00 50.45 H ATOM 120 HD21 LEU A 10 -2.602 10.940 -12.195 1.00 30.33 H ATOM 121 HD22 LEU A 10 -1.333 10.949 -13.420 1.00 54.30 H ATOM 122 HD23 LEU A 10 -1.916 12.470 -12.743 1.00 13.12 H ATOM 123 N LYS A 11 1.800 7.331 -11.033 1.00 4.21 N ATOM 124 CA LYS A 11 2.915 6.426 -11.286 1.00 44.40 C ATOM 125 C LYS A 11 2.512 4.979 -11.023 1.00 2.01 C ATOM 126 O LYS A 11 3.238 4.049 -11.373 1.00 54.45 O ATOM 127 CB LYS A 11 4.112 6.801 -10.409 1.00 23.01 C ATOM 128 CG LYS A 11 5.308 7.309 -11.196 1.00 54.50 C ATOM 129 CD LYS A 11 6.606 7.106 -10.433 1.00 35.34 C ATOM 130 CE LYS A 11 7.755 6.765 -11.369 1.00 30.55 C ATOM 131 NZ LYS A 11 8.187 5.347 -11.223 1.00 34.30 N ATOM 132 H LYS A 11 1.526 7.504 -10.107 1.00 41.45 H ATOM 133 HA LYS A 11 3.195 6.527 -12.324 1.00 21.42 H ATOM 134 HB2 LYS A 11 3.809 7.573 -9.717 1.00 34.52 H ATOM 135 HB3 LYS A 11 4.420 5.929 -9.850 1.00 45.00 H ATOM 136 HG2 LYS A 11 5.365 6.774 -12.132 1.00 23.00 H ATOM 137 HG3 LYS A 11 5.177 8.365 -11.390 1.00 74.43 H ATOM 138 HD2 LYS A 11 6.847 8.014 -9.901 1.00 30.12 H ATOM 139 HD3 LYS A 11 6.475 6.297 -9.727 1.00 51.22 H ATOM 140 HE2 LYS A 11 7.436 6.932 -12.386 1.00 34.13 H ATOM 141 HE3 LYS A 11 8.590 7.411 -11.142 1.00 52.34 H ATOM 142 HZ1 LYS A 11 9.225 5.286 -11.236 1.00 34.15 H ATOM 143 HZ2 LYS A 11 7.807 4.776 -12.005 1.00 72.11 H ATOM 144 HZ3 LYS A 11 7.838 4.958 -10.324 1.00 31.40 H ATOM 145 N ASN A 12 1.350 4.796 -10.405 1.00 12.33 N ATOM 146 CA ASN A 12 0.850 3.462 -10.096 1.00 30.42 C ATOM 147 C ASN A 12 -0.675 3.443 -10.076 1.00 15.11 C ATOM 148 O ASN A 12 -1.306 3.295 -9.029 1.00 3.03 O ATOM 149 CB ASN A 12 1.394 2.990 -8.746 1.00 5.21 C ATOM 150 CG ASN A 12 2.895 2.775 -8.771 1.00 64.43 C ATOM 151 OD1 ASN A 12 3.370 1.658 -8.980 1.00 11.00 O ATOM 152 ND2 ASN A 12 3.650 3.846 -8.558 1.00 4.01 N ATOM 153 H ASN A 12 0.816 5.577 -10.150 1.00 14.42 H ATOM 154 HA ASN A 12 1.197 2.791 -10.868 1.00 14.13 H ATOM 155 HB2 ASN A 12 1.170 3.733 -7.995 1.00 12.44 H ATOM 156 HB3 ASN A 12 0.920 2.058 -8.478 1.00 15.41 H ATOM 157 HD21 ASN A 12 4.624 3.735 -8.570 1.00 1.35 H ATOM 158 HD22 ASN A 12 3.203 4.704 -8.398 1.00 64.43 H ATOM 159 N PRO A 13 -1.285 3.596 -11.261 1.00 45.31 N ATOM 160 CA PRO A 13 -2.743 3.600 -11.407 1.00 32.40 C ATOM 161 C PRO A 13 -3.353 2.224 -11.161 1.00 15.13 C ATOM 162 O PRO A 13 -4.554 2.101 -10.923 1.00 11.22 O ATOM 163 CB PRO A 13 -2.953 4.025 -12.862 1.00 51.03 C ATOM 164 CG PRO A 13 -1.700 3.622 -13.559 1.00 62.25 C ATOM 165 CD PRO A 13 -0.596 3.778 -12.550 1.00 71.41 C ATOM 166 HA PRO A 13 -3.206 4.321 -10.749 1.00 70.41 H ATOM 167 HB2 PRO A 13 -3.814 3.514 -13.269 1.00 34.42 H ATOM 168 HB3 PRO A 13 -3.105 5.093 -12.911 1.00 35.33 H ATOM 169 HG2 PRO A 13 -1.772 2.594 -13.880 1.00 74.22 H ATOM 170 HG3 PRO A 13 -1.527 4.269 -14.406 1.00 43.33 H ATOM 171 HD2 PRO A 13 0.158 3.018 -12.695 1.00 33.10 H ATOM 172 HD3 PRO A 13 -0.159 4.763 -12.618 1.00 12.12 H ATOM 173 N ASN A 14 -2.518 1.192 -11.219 1.00 51.02 N ATOM 174 CA ASN A 14 -2.976 -0.175 -11.002 1.00 73.44 C ATOM 175 C ASN A 14 -3.140 -0.465 -9.513 1.00 42.33 C ATOM 176 O ASN A 14 -3.647 -1.518 -9.126 1.00 75.23 O ATOM 177 CB ASN A 14 -1.992 -1.170 -11.621 1.00 43.44 C ATOM 178 CG ASN A 14 -0.728 -1.322 -10.797 1.00 13.35 C ATOM 179 OD1 ASN A 14 -0.227 -0.354 -10.224 1.00 41.25 O ATOM 180 ND2 ASN A 14 -0.207 -2.541 -10.732 1.00 73.51 N ATOM 181 H ASN A 14 -1.571 1.353 -11.413 1.00 51.50 H ATOM 182 HA ASN A 14 -3.935 -0.284 -11.486 1.00 34.02 H ATOM 183 HB2 ASN A 14 -2.467 -2.137 -11.698 1.00 42.13 H ATOM 184 HB3 ASN A 14 -1.717 -0.829 -12.608 1.00 50.52 H ATOM 185 HD21 ASN A 14 0.609 -2.668 -10.205 1.00 61.41 H ATOM 186 HD22 ASN A 14 -0.661 -3.265 -11.214 1.00 3.05 H ATOM 187 N LEU A 15 -2.707 0.477 -8.682 1.00 40.05 N ATOM 188 CA LEU A 15 -2.806 0.325 -7.235 1.00 24.50 C ATOM 189 C LEU A 15 -3.736 1.376 -6.639 1.00 33.32 C ATOM 190 O LEU A 15 -4.664 1.050 -5.898 1.00 13.33 O ATOM 191 CB LEU A 15 -1.420 0.432 -6.595 1.00 71.15 C ATOM 192 CG LEU A 15 -0.831 -0.869 -6.049 1.00 3.45 C ATOM 193 CD1 LEU A 15 -1.541 -1.280 -4.768 1.00 53.14 C ATOM 194 CD2 LEU A 15 -0.921 -1.975 -7.090 1.00 12.42 C ATOM 195 H LEU A 15 -2.312 1.295 -9.050 1.00 23.42 H ATOM 196 HA LEU A 15 -3.212 -0.655 -7.032 1.00 61.21 H ATOM 197 HB2 LEU A 15 -0.741 0.815 -7.341 1.00 64.33 H ATOM 198 HB3 LEU A 15 -1.488 1.135 -5.778 1.00 1.42 H ATOM 199 HG LEU A 15 0.214 -0.713 -5.815 1.00 15.14 H ATOM 200 HD11 LEU A 15 -2.308 -0.557 -4.534 1.00 4.21 H ATOM 201 HD12 LEU A 15 -0.828 -1.324 -3.959 1.00 2.31 H ATOM 202 HD13 LEU A 15 -1.992 -2.252 -4.903 1.00 60.34 H ATOM 203 HD21 LEU A 15 -0.222 -2.759 -6.843 1.00 21.40 H ATOM 204 HD22 LEU A 15 -0.683 -1.572 -8.063 1.00 64.22 H ATOM 205 HD23 LEU A 15 -1.924 -2.376 -7.102 1.00 54.24 H ATOM 206 N CYS A 16 -3.483 2.638 -6.969 1.00 33.23 N ATOM 207 CA CYS A 16 -4.299 3.738 -6.468 1.00 63.21 C ATOM 208 C CYS A 16 -4.355 4.878 -7.481 1.00 75.41 C ATOM 209 O CYS A 16 -5.436 5.333 -7.857 1.00 44.04 O ATOM 210 CB CYS A 16 -3.741 4.250 -5.139 1.00 21.34 C ATOM 211 SG CYS A 16 -4.829 5.434 -4.283 1.00 3.13 S ATOM 212 H CYS A 16 -2.729 2.835 -7.564 1.00 22.21 H ATOM 213 HA CYS A 16 -5.299 3.364 -6.309 1.00 4.11 H ATOM 214 HB2 CYS A 16 -3.584 3.411 -4.476 1.00 71.11 H ATOM 215 HB3 CYS A 16 -2.796 4.741 -5.319 1.00 32.04 H TER 216 CYS A 16 ENDMDL MODEL 20 ATOM 1 N GLY A 1 0.642 -0.227 -0.819 1.00 53.21 N ATOM 2 CA GLY A 1 1.962 0.366 -0.926 1.00 51.24 C ATOM 3 C GLY A 1 1.929 1.745 -1.555 1.00 53.01 C ATOM 4 O GLY A 1 2.447 2.707 -0.987 1.00 53.24 O ATOM 5 H1 GLY A 1 0.257 -0.406 0.065 1.00 44.23 H ATOM 6 HA2 GLY A 1 2.392 0.442 0.061 1.00 13.32 H ATOM 7 HA3 GLY A 1 2.585 -0.277 -1.531 1.00 32.15 H ATOM 8 N CYS A 2 1.319 1.842 -2.732 1.00 5.40 N ATOM 9 CA CYS A 2 1.222 3.113 -3.440 1.00 62.15 C ATOM 10 C CYS A 2 -0.210 3.640 -3.419 1.00 22.44 C ATOM 11 O CYS A 2 -1.086 3.118 -4.109 1.00 63.13 O ATOM 12 CB CYS A 2 1.696 2.952 -4.886 1.00 41.03 C ATOM 13 SG CYS A 2 3.070 4.057 -5.346 1.00 31.33 S ATOM 14 H CYS A 2 0.925 1.040 -3.135 1.00 23.53 H ATOM 15 HA CYS A 2 1.861 3.823 -2.938 1.00 64.22 H ATOM 16 HB2 CYS A 2 2.029 1.935 -5.037 1.00 11.22 H ATOM 17 HB3 CYS A 2 0.871 3.158 -5.552 1.00 63.44 H ATOM 18 N CYS A 3 -0.441 4.677 -2.621 1.00 24.11 N ATOM 19 CA CYS A 3 -1.765 5.275 -2.508 1.00 11.43 C ATOM 20 C CYS A 3 -1.732 6.501 -1.599 1.00 74.00 C ATOM 21 O CYS A 3 -2.508 7.440 -1.778 1.00 44.21 O ATOM 22 CB CYS A 3 -2.765 4.252 -1.966 1.00 55.24 C ATOM 23 SG CYS A 3 -4.508 4.757 -2.130 1.00 51.34 S ATOM 24 H CYS A 3 0.299 5.049 -2.094 1.00 55.55 H ATOM 25 HA CYS A 3 -2.076 5.583 -3.495 1.00 31.45 H ATOM 26 HB2 CYS A 3 -2.642 3.322 -2.502 1.00 33.13 H ATOM 27 HB3 CYS A 3 -2.568 4.087 -0.918 1.00 22.23 H ATOM 28 N SER A 4 -0.829 6.484 -0.624 1.00 34.22 N ATOM 29 CA SER A 4 -0.697 7.591 0.315 1.00 13.53 C ATOM 30 C SER A 4 0.033 8.766 -0.329 1.00 73.01 C ATOM 31 O SER A 4 0.134 9.844 0.255 1.00 21.32 O ATOM 32 CB SER A 4 0.051 7.138 1.570 1.00 21.51 C ATOM 33 OG SER A 4 -0.601 7.589 2.744 1.00 35.33 O ATOM 34 H SER A 4 -0.240 5.706 -0.533 1.00 4.15 H ATOM 35 HA SER A 4 -1.691 7.910 0.594 1.00 22.44 H ATOM 36 HB2 SER A 4 0.096 6.059 1.589 1.00 14.33 H ATOM 37 HB3 SER A 4 1.054 7.539 1.553 1.00 50.24 H ATOM 38 HG SER A 4 -0.825 6.836 3.296 1.00 24.42 H ATOM 39 N ASN A 5 0.540 8.548 -1.538 1.00 72.22 N ATOM 40 CA ASN A 5 1.261 9.587 -2.263 1.00 45.32 C ATOM 41 C ASN A 5 0.407 10.157 -3.391 1.00 53.31 C ATOM 42 O ASN A 5 -0.382 9.453 -4.022 1.00 51.51 O ATOM 43 CB ASN A 5 2.568 9.029 -2.831 1.00 2.05 C ATOM 44 CG ASN A 5 3.779 9.459 -2.025 1.00 33.24 C ATOM 45 OD1 ASN A 5 3.832 10.577 -1.511 1.00 74.43 O ATOM 46 ND2 ASN A 5 4.759 8.570 -1.910 1.00 40.33 N ATOM 47 H ASN A 5 0.427 7.667 -1.953 1.00 15.13 H ATOM 48 HA ASN A 5 1.491 10.379 -1.566 1.00 23.10 H ATOM 49 HB2 ASN A 5 2.523 7.950 -2.827 1.00 73.43 H ATOM 50 HB3 ASN A 5 2.691 9.377 -3.845 1.00 44.10 H ATOM 51 HD21 ASN A 5 5.553 8.822 -1.394 1.00 62.21 H ATOM 52 HD22 ASN A 5 4.648 7.699 -2.346 1.00 41.41 H ATOM 53 N PRO A 6 0.566 11.463 -3.652 1.00 42.23 N ATOM 54 CA PRO A 6 -0.181 12.157 -4.706 1.00 32.24 C ATOM 55 C PRO A 6 0.250 11.724 -6.103 1.00 12.41 C ATOM 56 O PRO A 6 -0.546 11.743 -7.042 1.00 3.44 O ATOM 57 CB PRO A 6 0.162 13.630 -4.472 1.00 53.22 C ATOM 58 CG PRO A 6 1.483 13.607 -3.784 1.00 50.44 C ATOM 59 CD PRO A 6 1.489 12.363 -2.940 1.00 53.10 C ATOM 60 HA PRO A 6 -1.246 12.012 -4.598 1.00 31.24 H ATOM 61 HB2 PRO A 6 0.218 14.144 -5.422 1.00 25.13 H ATOM 62 HB3 PRO A 6 -0.597 14.087 -3.854 1.00 61.34 H ATOM 63 HG2 PRO A 6 2.277 13.569 -4.515 1.00 33.43 H ATOM 64 HG3 PRO A 6 1.587 14.483 -3.161 1.00 40.20 H ATOM 65 HD2 PRO A 6 2.482 11.941 -2.896 1.00 51.32 H ATOM 66 HD3 PRO A 6 1.125 12.580 -1.946 1.00 74.45 H ATOM 67 N ALA A 7 1.514 11.335 -6.233 1.00 74.43 N ATOM 68 CA ALA A 7 2.049 10.895 -7.516 1.00 0.03 C ATOM 69 C ALA A 7 1.854 9.395 -7.707 1.00 31.21 C ATOM 70 O ALA A 7 1.836 8.899 -8.834 1.00 53.31 O ATOM 71 CB ALA A 7 3.523 11.255 -7.624 1.00 3.54 C ATOM 72 H ALA A 7 2.099 11.342 -5.448 1.00 23.51 H ATOM 73 HA ALA A 7 1.517 11.419 -8.297 1.00 4.42 H ATOM 74 HB1 ALA A 7 4.022 11.009 -6.697 1.00 51.13 H ATOM 75 HB2 ALA A 7 3.971 10.699 -8.433 1.00 44.12 H ATOM 76 HB3 ALA A 7 3.622 12.313 -7.815 1.00 53.43 H ATOM 77 N CYS A 8 1.709 8.676 -6.599 1.00 21.31 N ATOM 78 CA CYS A 8 1.517 7.231 -6.644 1.00 14.33 C ATOM 79 C CYS A 8 0.296 6.871 -7.486 1.00 43.13 C ATOM 80 O CYS A 8 0.184 5.753 -7.988 1.00 40.11 O ATOM 81 CB CYS A 8 1.356 6.673 -5.228 1.00 54.14 C ATOM 82 SG CYS A 8 2.842 5.841 -4.584 1.00 23.41 S ATOM 83 H CYS A 8 1.733 9.128 -5.729 1.00 34.33 H ATOM 84 HA CYS A 8 2.393 6.793 -7.096 1.00 41.45 H ATOM 85 HB2 CYS A 8 1.116 7.483 -4.555 1.00 40.42 H ATOM 86 HB3 CYS A 8 0.548 5.956 -5.222 1.00 51.21 H ATOM 87 N MET A 9 -0.615 7.827 -7.637 1.00 21.22 N ATOM 88 CA MET A 9 -1.826 7.611 -8.420 1.00 31.14 C ATOM 89 C MET A 9 -1.548 7.780 -9.910 1.00 23.02 C ATOM 90 O MET A 9 -2.282 7.261 -10.752 1.00 24.53 O ATOM 91 CB MET A 9 -2.923 8.583 -7.980 1.00 60.34 C ATOM 92 CG MET A 9 -4.252 8.356 -8.682 1.00 35.25 C ATOM 93 SD MET A 9 -5.662 8.528 -7.570 1.00 70.13 S ATOM 94 CE MET A 9 -6.593 9.813 -8.401 1.00 71.11 C ATOM 95 H MET A 9 -0.470 8.698 -7.212 1.00 44.34 H ATOM 96 HA MET A 9 -2.160 6.600 -8.240 1.00 54.12 H ATOM 97 HB2 MET A 9 -3.078 8.475 -6.917 1.00 52.23 H ATOM 98 HB3 MET A 9 -2.599 9.591 -8.189 1.00 2.43 H ATOM 99 HG2 MET A 9 -4.352 9.077 -9.479 1.00 63.33 H ATOM 100 HG3 MET A 9 -4.258 7.359 -9.097 1.00 54.13 H ATOM 101 HE1 MET A 9 -7.068 9.402 -9.280 1.00 72.40 H ATOM 102 HE2 MET A 9 -7.347 10.201 -7.732 1.00 72.35 H ATOM 103 HE3 MET A 9 -5.925 10.610 -8.692 1.00 12.00 H ATOM 104 N LEU A 10 -0.484 8.509 -10.229 1.00 53.23 N ATOM 105 CA LEU A 10 -0.109 8.747 -11.619 1.00 20.02 C ATOM 106 C LEU A 10 1.053 7.849 -12.030 1.00 45.22 C ATOM 107 O LEU A 10 1.323 7.669 -13.218 1.00 21.01 O ATOM 108 CB LEU A 10 0.269 10.215 -11.821 1.00 42.34 C ATOM 109 CG LEU A 10 -0.858 11.231 -11.633 1.00 32.11 C ATOM 110 CD1 LEU A 10 -0.298 12.643 -11.564 1.00 53.33 C ATOM 111 CD2 LEU A 10 -1.876 11.113 -12.758 1.00 31.20 C ATOM 112 H LEU A 10 0.062 8.897 -9.515 1.00 1.32 H ATOM 113 HA LEU A 10 -0.963 8.515 -12.237 1.00 15.10 H ATOM 114 HB2 LEU A 10 1.051 10.455 -11.118 1.00 2.33 H ATOM 115 HB3 LEU A 10 0.648 10.322 -12.828 1.00 53.51 H ATOM 116 HG LEU A 10 -1.365 11.028 -10.700 1.00 21.35 H ATOM 117 HD11 LEU A 10 -0.906 13.301 -12.167 1.00 32.01 H ATOM 118 HD12 LEU A 10 0.715 12.647 -11.937 1.00 42.13 H ATOM 119 HD13 LEU A 10 -0.305 12.984 -10.539 1.00 74.32 H ATOM 120 HD21 LEU A 10 -2.641 11.864 -12.632 1.00 1.43 H ATOM 121 HD22 LEU A 10 -2.327 10.132 -12.733 1.00 71.20 H ATOM 122 HD23 LEU A 10 -1.381 11.257 -13.708 1.00 13.34 H ATOM 123 N LYS A 11 1.738 7.286 -11.041 1.00 2.05 N ATOM 124 CA LYS A 11 2.870 6.403 -11.298 1.00 11.41 C ATOM 125 C LYS A 11 2.505 4.952 -11.005 1.00 62.53 C ATOM 126 O LYS A 11 3.246 4.034 -11.353 1.00 65.52 O ATOM 127 CB LYS A 11 4.072 6.820 -10.447 1.00 32.10 C ATOM 128 CG LYS A 11 5.242 7.343 -11.262 1.00 30.11 C ATOM 129 CD LYS A 11 6.557 7.181 -10.517 1.00 54.31 C ATOM 130 CE LYS A 11 7.192 5.828 -10.796 1.00 45.11 C ATOM 131 NZ LYS A 11 7.807 5.242 -9.573 1.00 64.42 N ATOM 132 H LYS A 11 1.475 7.468 -10.113 1.00 61.15 H ATOM 133 HA LYS A 11 3.130 6.493 -12.342 1.00 1.43 H ATOM 134 HB2 LYS A 11 3.761 7.595 -9.762 1.00 45.44 H ATOM 135 HB3 LYS A 11 4.409 5.965 -9.879 1.00 63.44 H ATOM 136 HG2 LYS A 11 5.297 6.794 -12.190 1.00 72.21 H ATOM 137 HG3 LYS A 11 5.083 8.391 -11.471 1.00 4.55 H ATOM 138 HD2 LYS A 11 7.237 7.958 -10.833 1.00 22.02 H ATOM 139 HD3 LYS A 11 6.372 7.271 -9.456 1.00 4.12 H ATOM 140 HE2 LYS A 11 6.432 5.156 -11.164 1.00 11.54 H ATOM 141 HE3 LYS A 11 7.957 5.953 -11.549 1.00 32.31 H ATOM 142 HZ1 LYS A 11 7.229 5.467 -8.739 1.00 4.32 H ATOM 143 HZ2 LYS A 11 8.763 5.627 -9.434 1.00 44.33 H ATOM 144 HZ3 LYS A 11 7.873 4.208 -9.667 1.00 4.11 H ATOM 145 N ASN A 12 1.358 4.752 -10.365 1.00 73.10 N ATOM 146 CA ASN A 12 0.894 3.411 -10.027 1.00 25.02 C ATOM 147 C ASN A 12 -0.630 3.357 -9.981 1.00 44.32 C ATOM 148 O ASN A 12 -1.239 3.212 -8.921 1.00 70.14 O ATOM 149 CB ASN A 12 1.472 2.974 -8.679 1.00 12.32 C ATOM 150 CG ASN A 12 2.977 2.794 -8.726 1.00 32.52 C ATOM 151 OD1 ASN A 12 3.474 1.685 -8.925 1.00 1.03 O ATOM 152 ND2 ASN A 12 3.710 3.886 -8.542 1.00 73.50 N ATOM 153 H ASN A 12 0.809 5.524 -10.114 1.00 5.34 H ATOM 154 HA ASN A 12 1.244 2.736 -10.794 1.00 2.44 H ATOM 155 HB2 ASN A 12 1.242 3.724 -7.936 1.00 10.12 H ATOM 156 HB3 ASN A 12 1.023 2.036 -8.388 1.00 45.24 H ATOM 157 HD21 ASN A 12 4.685 3.797 -8.568 1.00 44.40 H ATOM 158 HD22 ASN A 12 3.245 4.735 -8.389 1.00 22.14 H ATOM 159 N PRO A 13 -1.261 3.477 -11.158 1.00 73.14 N ATOM 160 CA PRO A 13 -2.722 3.444 -11.280 1.00 63.20 C ATOM 161 C PRO A 13 -3.295 2.059 -11.002 1.00 34.34 C ATOM 162 O PRO A 13 -4.489 1.912 -10.742 1.00 22.24 O ATOM 163 CB PRO A 13 -2.965 3.840 -12.738 1.00 53.33 C ATOM 164 CG PRO A 13 -1.714 3.455 -13.450 1.00 33.04 C ATOM 165 CD PRO A 13 -0.598 3.653 -12.461 1.00 73.15 C ATOM 166 HA PRO A 13 -3.191 4.164 -10.626 1.00 43.51 H ATOM 167 HB2 PRO A 13 -3.821 3.302 -13.122 1.00 42.31 H ATOM 168 HB3 PRO A 13 -3.144 4.903 -12.801 1.00 45.22 H ATOM 169 HG2 PRO A 13 -1.768 2.420 -13.753 1.00 1.44 H ATOM 170 HG3 PRO A 13 -1.570 4.092 -14.310 1.00 13.34 H ATOM 171 HD2 PRO A 13 0.171 2.909 -12.607 1.00 33.24 H ATOM 172 HD3 PRO A 13 -0.186 4.647 -12.552 1.00 41.12 H ATOM 173 N ASN A 14 -2.437 1.045 -11.058 1.00 11.53 N ATOM 174 CA ASN A 14 -2.859 -0.329 -10.811 1.00 54.54 C ATOM 175 C ASN A 14 -2.991 -0.597 -9.315 1.00 74.24 C ATOM 176 O ASN A 14 -3.468 -1.656 -8.903 1.00 44.22 O ATOM 177 CB ASN A 14 -1.862 -1.309 -11.431 1.00 70.51 C ATOM 178 CG ASN A 14 -1.815 -1.208 -12.943 1.00 71.25 C ATOM 179 OD1 ASN A 14 -2.602 -0.483 -13.553 1.00 22.51 O ATOM 180 ND2 ASN A 14 -0.890 -1.937 -13.557 1.00 4.04 N ATOM 181 H ASN A 14 -1.497 1.226 -11.270 1.00 74.30 H ATOM 182 HA ASN A 14 -3.824 -0.467 -11.277 1.00 25.22 H ATOM 183 HB2 ASN A 14 -0.875 -1.101 -11.045 1.00 64.40 H ATOM 184 HB3 ASN A 14 -2.143 -2.317 -11.164 1.00 54.02 H ATOM 185 HD21 ASN A 14 -0.837 -1.890 -14.534 1.00 4.10 H ATOM 186 HD22 ASN A 14 -0.297 -2.491 -13.007 1.00 32.52 H ATOM 187 N LEU A 15 -2.567 0.368 -8.507 1.00 75.11 N ATOM 188 CA LEU A 15 -2.639 0.237 -7.056 1.00 23.21 C ATOM 189 C LEU A 15 -3.584 1.276 -6.461 1.00 70.40 C ATOM 190 O LEU A 15 -4.492 0.941 -5.699 1.00 62.34 O ATOM 191 CB LEU A 15 -1.246 0.387 -6.442 1.00 2.04 C ATOM 192 CG LEU A 15 -0.617 -0.890 -5.884 1.00 21.32 C ATOM 193 CD1 LEU A 15 -1.296 -1.297 -4.585 1.00 54.15 C ATOM 194 CD2 LEU A 15 -0.698 -2.015 -6.906 1.00 34.04 C ATOM 195 H LEU A 15 -2.198 1.188 -8.894 1.00 42.41 H ATOM 196 HA LEU A 15 -3.018 -0.749 -6.831 1.00 13.34 H ATOM 197 HB2 LEU A 15 -0.588 0.773 -7.205 1.00 1.22 H ATOM 198 HB3 LEU A 15 -1.317 1.102 -5.634 1.00 42.12 H ATOM 199 HG LEU A 15 0.427 -0.706 -5.670 1.00 61.41 H ATOM 200 HD11 LEU A 15 -2.073 -0.586 -4.348 1.00 31.02 H ATOM 201 HD12 LEU A 15 -0.568 -1.314 -3.788 1.00 71.43 H ATOM 202 HD13 LEU A 15 -1.729 -2.280 -4.699 1.00 34.14 H ATOM 203 HD21 LEU A 15 -0.461 -1.629 -7.886 1.00 4.05 H ATOM 204 HD22 LEU A 15 -1.698 -2.423 -6.912 1.00 33.21 H ATOM 205 HD23 LEU A 15 0.005 -2.792 -6.643 1.00 5.51 H ATOM 206 N CYS A 16 -3.366 2.538 -6.815 1.00 73.32 N ATOM 207 CA CYS A 16 -4.199 3.626 -6.319 1.00 12.35 C ATOM 208 C CYS A 16 -4.299 4.748 -7.348 1.00 52.03 C ATOM 209 O CYS A 16 -5.033 4.638 -8.330 1.00 55.33 O ATOM 210 CB CYS A 16 -3.632 4.172 -5.007 1.00 12.53 C ATOM 211 SG CYS A 16 -4.734 5.345 -4.152 1.00 25.24 S ATOM 212 H CYS A 16 -2.627 2.743 -7.426 1.00 24.50 H ATOM 213 HA CYS A 16 -5.187 3.232 -6.137 1.00 14.11 H ATOM 214 HB2 CYS A 16 -3.445 3.348 -4.334 1.00 1.33 H ATOM 215 HB3 CYS A 16 -2.702 4.683 -5.210 1.00 73.40 H TER 216 CYS A 16 ENDMDL CONECT 13 82 CONECT 23 211 CONECT 82 13 CONECT 211 23 MASTER 126 0 0 1 0 0 0 6 110 1 4 2 END