HEADER TOXIN 04-AUG-10 SMS20126 TITLE ALPHA-CONOTOXIN VC1.2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALPHA-CONOTOXIN VC1.2; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: CONUS VICTORIAE; SOURCE 4 ORGANISM_COMMON: QUEEN VICTORIA CONE; SOURCE 5 ORGANISM_TAXID: 319920; SOURCE 6 OTHER_DETAILS: CHEMICAL SYNTHESIS KEYWDS CONOTOXIN, ALPHA-CONOTOXIN, ALPHA-HELIX, DISULFIDE BOND, TOXIN EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR Z.KUANG JRNL AUTH H.SAFAVI-HEMAMI,W.A.SIERO,Z.KUANG,N.A.WILLIAMSON,J.A.KARAS, JRNL AUTH 2 L.R.PAGE,D.MACMILLAN,D.J.ADAMS,R.S.NORTON,A.W.PURCELL JRNL TITL EMBRYONIC TOXIN EXPRESSION IN THE CONE SNAIL CONUS VICTORIAE JRNL TITL 2 - PRIMED TO KILL OR DIVERGENT FUNCTION? JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR_NIH REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 21-SEP-10. REMARK 100 THE BMRB ID CODE IS SMS20126. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 3.6 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 1.5MM ALPHA-CONOTOXIN VC1.2; 95% REMARK 210 H2O/5% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY; 2D 1H-1H TOCSY; REMARK 210 2D DQF-COSY; 2D 1H-15N HSQC; 2D REMARK 210 1H-13C HSQC REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ; 800 MHZ REMARK 210 SPECTROMETER MODEL : DRX; AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : TOPSPIN, XEASY, CYANA, X-PLOR_NIH REMARK 210 METHOD USED : DGSA-DISTANCE GEOMETRY SIMULATED REMARK 210 ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 200 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: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 H3 GLY A 1 OG SER A 4 1.51 REMARK 500 REMARK 500 REMARK: NULL 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 ASN A 12 79.07 -119.64 REMARK 500 4 ASN A 12 70.12 -119.20 REMARK 500 8 ASN A 12 66.73 -118.34 REMARK 500 12 ASN A 12 74.82 -114.63 REMARK 500 16 ASN A 12 73.17 -117.45 REMARK 500 17 ASN A 12 72.49 -111.34 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20126 RELATED DB: BMRB DBREF A 1 16 BMRB SMS20126 SMS20126 1 16 SEQADV NH2 A 17 BMRB SMS20126 AMIDATION SEQRES 1 A 17 GLY CYS CYS SER ASN PRO ALA CYS MET VAL ASN ASN PRO SEQRES 2 A 17 GLN ILE CYS NH2 HET NH2 A 17 3 HETNAM NH2 AMINO GROUP FORMUL 1 NH2 H2 N HELIX 1 1 ASN A 5 ASN A 12 1 8 SSBOND 1 CYS A 2 CYS A 8 1555 1555 2.02 SSBOND 2 CYS A 3 CYS A 16 1555 1555 2.02 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 -6.599 5.593 -2.497 1.00 0.00 N ATOM 2 CA GLY A 1 -5.127 5.777 -2.609 1.00 0.00 C ATOM 3 C GLY A 1 -4.429 4.444 -2.347 1.00 0.00 C ATOM 4 O GLY A 1 -5.053 3.397 -2.342 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.907 4.855 -3.162 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.079 6.486 -2.719 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.835 5.300 -1.522 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.880 6.122 -3.601 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.799 6.501 -1.882 1.00 0.00 H ATOM 10 N CYS A 2 -3.139 4.467 -2.134 1.00 0.00 N ATOM 11 CA CYS A 2 -2.401 3.191 -1.881 1.00 0.00 C ATOM 12 C CYS A 2 -2.858 2.566 -0.572 1.00 0.00 C ATOM 13 O CYS A 2 -3.331 1.450 -0.534 1.00 0.00 O ATOM 14 CB CYS A 2 -0.919 3.571 -1.792 1.00 0.00 C ATOM 15 SG CYS A 2 0.103 2.079 -1.951 1.00 0.00 S ATOM 16 H CYS A 2 -2.657 5.321 -2.143 1.00 0.00 H ATOM 17 HA CYS A 2 -2.556 2.507 -2.690 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.675 4.259 -2.581 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.725 4.038 -0.837 1.00 0.00 H ATOM 20 N CYS A 3 -2.712 3.290 0.497 1.00 0.00 N ATOM 21 CA CYS A 3 -3.121 2.763 1.836 1.00 0.00 C ATOM 22 C CYS A 3 -4.574 2.291 1.810 1.00 0.00 C ATOM 23 O CYS A 3 -4.932 1.348 2.489 1.00 0.00 O ATOM 24 CB CYS A 3 -2.946 3.929 2.815 1.00 0.00 C ATOM 25 SG CYS A 3 -1.189 4.379 2.939 1.00 0.00 S ATOM 26 H CYS A 3 -2.327 4.182 0.418 1.00 0.00 H ATOM 27 HA CYS A 3 -2.474 1.952 2.123 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.511 4.780 2.465 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.313 3.636 3.787 1.00 0.00 H ATOM 30 N SER A 4 -5.413 2.921 1.027 1.00 0.00 N ATOM 31 CA SER A 4 -6.838 2.480 0.956 1.00 0.00 C ATOM 32 C SER A 4 -6.911 1.071 0.353 1.00 0.00 C ATOM 33 O SER A 4 -7.845 0.330 0.600 1.00 0.00 O ATOM 34 CB SER A 4 -7.546 3.490 0.040 1.00 0.00 C ATOM 35 OG SER A 4 -6.716 4.632 -0.168 1.00 0.00 O ATOM 36 H SER A 4 -5.106 3.673 0.478 1.00 0.00 H ATOM 37 HA SER A 4 -7.285 2.495 1.937 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.752 3.027 -0.912 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.481 3.790 0.497 1.00 0.00 H ATOM 40 HG SER A 4 -6.724 5.156 0.644 1.00 0.00 H ATOM 41 N ASN A 5 -5.929 0.696 -0.430 1.00 0.00 N ATOM 42 CA ASN A 5 -5.924 -0.660 -1.050 1.00 0.00 C ATOM 43 C ASN A 5 -4.929 -1.562 -0.315 1.00 0.00 C ATOM 44 O ASN A 5 -3.758 -1.235 -0.227 1.00 0.00 O ATOM 45 CB ASN A 5 -5.455 -0.437 -2.493 1.00 0.00 C ATOM 46 CG ASN A 5 -5.717 -1.689 -3.340 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.975 -2.757 -2.817 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.648 -1.606 -4.637 1.00 0.00 N ATOM 49 H ASN A 5 -5.183 1.309 -0.609 1.00 0.00 H ATOM 50 HA ASN A 5 -6.913 -1.088 -1.038 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.984 0.403 -2.921 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.394 -0.228 -2.493 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.428 -0.752 -5.064 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.814 -2.400 -5.188 1.00 0.00 H ATOM 55 N PRO A 6 -5.410 -2.679 0.171 1.00 0.00 N ATOM 56 CA PRO A 6 -4.530 -3.636 0.892 1.00 0.00 C ATOM 57 C PRO A 6 -3.433 -4.145 -0.050 1.00 0.00 C ATOM 58 O PRO A 6 -2.288 -4.281 0.341 1.00 0.00 O ATOM 59 CB PRO A 6 -5.490 -4.749 1.328 1.00 0.00 C ATOM 60 CG PRO A 6 -6.642 -4.641 0.379 1.00 0.00 C ATOM 61 CD PRO A 6 -6.791 -3.173 0.084 1.00 0.00 C ATOM 62 HA PRO A 6 -4.094 -3.164 1.758 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.010 -5.714 1.235 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.823 -4.588 2.344 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.431 -5.190 -0.530 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.544 -5.013 0.838 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.194 -3.024 -0.908 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.407 -2.694 0.829 1.00 0.00 H ATOM 69 N ALA A 7 -3.767 -4.387 -1.294 1.00 0.00 N ATOM 70 CA ALA A 7 -2.737 -4.847 -2.272 1.00 0.00 C ATOM 71 C ALA A 7 -1.634 -3.786 -2.366 1.00 0.00 C ATOM 72 O ALA A 7 -0.456 -4.095 -2.396 1.00 0.00 O ATOM 73 CB ALA A 7 -3.477 -4.974 -3.606 1.00 0.00 C ATOM 74 H ALA A 7 -4.690 -4.239 -1.586 1.00 0.00 H ATOM 75 HA ALA A 7 -2.327 -5.800 -1.974 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.098 -4.102 -3.759 1.00 0.00 H ATOM 77 HB2 ALA A 7 -4.097 -5.860 -3.594 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.759 -5.049 -4.410 1.00 0.00 H ATOM 79 N CYS A 8 -2.017 -2.533 -2.387 1.00 0.00 N ATOM 80 CA CYS A 8 -1.004 -1.440 -2.449 1.00 0.00 C ATOM 81 C CYS A 8 -0.284 -1.350 -1.103 1.00 0.00 C ATOM 82 O CYS A 8 0.922 -1.223 -1.048 1.00 0.00 O ATOM 83 CB CYS A 8 -1.793 -0.159 -2.731 1.00 0.00 C ATOM 84 SG CYS A 8 -0.703 1.069 -3.506 1.00 0.00 S ATOM 85 H CYS A 8 -2.971 -2.315 -2.340 1.00 0.00 H ATOM 86 HA CYS A 8 -0.303 -1.625 -3.243 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.612 -0.378 -3.398 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.181 0.235 -1.804 1.00 0.00 H ATOM 89 N MET A 9 -1.019 -1.429 -0.016 1.00 0.00 N ATOM 90 CA MET A 9 -0.392 -1.362 1.338 1.00 0.00 C ATOM 91 C MET A 9 0.752 -2.375 1.457 1.00 0.00 C ATOM 92 O MET A 9 1.860 -2.030 1.823 1.00 0.00 O ATOM 93 CB MET A 9 -1.520 -1.727 2.313 1.00 0.00 C ATOM 94 CG MET A 9 -2.291 -0.470 2.715 1.00 0.00 C ATOM 95 SD MET A 9 -2.799 -0.609 4.448 1.00 0.00 S ATOM 96 CE MET A 9 -3.846 -2.075 4.269 1.00 0.00 C ATOM 97 H MET A 9 -1.993 -1.539 -0.090 1.00 0.00 H ATOM 98 HA MET A 9 -0.036 -0.368 1.542 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.197 -2.428 1.841 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.097 -2.181 3.191 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.655 0.393 2.594 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.167 -0.366 2.090 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.013 -2.517 5.241 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.355 -2.793 3.624 1.00 0.00 H ATOM 105 HE3 MET A 9 -4.794 -1.792 3.837 1.00 0.00 H ATOM 106 N VAL A 10 0.483 -3.618 1.165 1.00 0.00 N ATOM 107 CA VAL A 10 1.545 -4.666 1.271 1.00 0.00 C ATOM 108 C VAL A 10 2.684 -4.384 0.282 1.00 0.00 C ATOM 109 O VAL A 10 3.847 -4.577 0.597 1.00 0.00 O ATOM 110 CB VAL A 10 0.843 -5.992 0.934 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.836 -7.157 1.018 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.294 -6.237 1.931 1.00 0.00 C ATOM 113 H VAL A 10 -0.427 -3.869 0.886 1.00 0.00 H ATOM 114 HA VAL A 10 1.928 -4.698 2.274 1.00 0.00 H ATOM 115 HB VAL A 10 0.439 -5.942 -0.068 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.431 -7.925 1.659 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.772 -6.808 1.426 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.002 -7.564 0.031 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.046 -5.788 2.885 1.00 0.00 H ATOM 120 HG22 VAL A 10 -0.434 -7.299 2.060 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.206 -5.797 1.554 1.00 0.00 H ATOM 122 N ASN A 11 2.365 -3.944 -0.907 1.00 0.00 N ATOM 123 CA ASN A 11 3.435 -3.663 -1.918 1.00 0.00 C ATOM 124 C ASN A 11 4.138 -2.332 -1.624 1.00 0.00 C ATOM 125 O ASN A 11 5.280 -2.143 -1.993 1.00 0.00 O ATOM 126 CB ASN A 11 2.716 -3.587 -3.267 1.00 0.00 C ATOM 127 CG ASN A 11 2.590 -4.996 -3.855 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.580 -5.650 -4.114 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.408 -5.494 -4.084 1.00 0.00 N ATOM 130 H ASN A 11 1.423 -3.804 -1.139 1.00 0.00 H ATOM 131 HA ASN A 11 4.154 -4.469 -1.937 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.732 -3.163 -3.129 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.283 -2.962 -3.944 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.605 -4.967 -3.882 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.322 -6.397 -4.450 1.00 0.00 H ATOM 136 N ASN A 12 3.469 -1.404 -0.986 1.00 0.00 N ATOM 137 CA ASN A 12 4.108 -0.085 -0.696 1.00 0.00 C ATOM 138 C ASN A 12 4.168 0.171 0.812 1.00 0.00 C ATOM 139 O ASN A 12 3.369 0.920 1.348 1.00 0.00 O ATOM 140 CB ASN A 12 3.215 0.955 -1.378 1.00 0.00 C ATOM 141 CG ASN A 12 3.691 1.166 -2.815 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.466 2.060 -3.083 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.255 0.384 -3.763 1.00 0.00 N ATOM 144 H ASN A 12 2.539 -1.568 -0.708 1.00 0.00 H ATOM 145 HA ASN A 12 5.098 -0.047 -1.121 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.192 0.608 -1.380 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.278 1.887 -0.840 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.617 -0.334 -3.559 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.575 0.503 -4.681 1.00 0.00 H ATOM 150 N PRO A 13 5.129 -0.444 1.454 1.00 0.00 N ATOM 151 CA PRO A 13 5.302 -0.262 2.917 1.00 0.00 C ATOM 152 C PRO A 13 5.762 1.172 3.218 1.00 0.00 C ATOM 153 O PRO A 13 5.448 1.730 4.251 1.00 0.00 O ATOM 154 CB PRO A 13 6.379 -1.283 3.284 1.00 0.00 C ATOM 155 CG PRO A 13 7.132 -1.519 2.015 1.00 0.00 C ATOM 156 CD PRO A 13 6.140 -1.355 0.893 1.00 0.00 C ATOM 157 HA PRO A 13 4.385 -0.487 3.436 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.033 -0.880 4.046 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.927 -2.201 3.622 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.930 -0.796 1.918 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.535 -2.522 2.002 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.621 -0.917 0.025 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.689 -2.302 0.642 1.00 0.00 H ATOM 164 N GLN A 14 6.491 1.775 2.308 1.00 0.00 N ATOM 165 CA GLN A 14 6.960 3.182 2.525 1.00 0.00 C ATOM 166 C GLN A 14 5.754 4.115 2.511 1.00 0.00 C ATOM 167 O GLN A 14 5.654 5.038 3.296 1.00 0.00 O ATOM 168 CB GLN A 14 7.902 3.528 1.353 1.00 0.00 C ATOM 169 CG GLN A 14 8.782 2.328 0.975 1.00 0.00 C ATOM 170 CD GLN A 14 8.217 1.668 -0.284 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.075 1.255 -0.299 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.957 1.557 -1.346 1.00 0.00 N ATOM 173 H GLN A 14 6.714 1.306 1.478 1.00 0.00 H ATOM 174 HA GLN A 14 7.480 3.262 3.457 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.310 3.817 0.495 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.533 4.357 1.640 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.793 2.666 0.786 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.786 1.611 1.783 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.878 1.892 -1.344 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.589 1.146 -2.157 1.00 0.00 H ATOM 181 N ILE A 15 4.836 3.865 1.622 1.00 0.00 N ATOM 182 CA ILE A 15 3.615 4.713 1.536 1.00 0.00 C ATOM 183 C ILE A 15 2.694 4.387 2.717 1.00 0.00 C ATOM 184 O ILE A 15 2.162 5.270 3.365 1.00 0.00 O ATOM 185 CB ILE A 15 2.950 4.344 0.198 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.942 4.538 -0.959 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.727 5.232 -0.036 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.216 6.031 -1.171 1.00 0.00 C ATOM 189 H ILE A 15 4.952 3.107 1.016 1.00 0.00 H ATOM 190 HA ILE A 15 3.882 5.759 1.544 1.00 0.00 H ATOM 191 HB ILE A 15 2.635 3.310 0.230 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.867 4.031 -0.728 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.525 4.119 -1.864 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.042 5.127 0.790 1.00 0.00 H ATOM 195 HG22 ILE A 15 1.238 4.932 -0.947 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.035 6.264 -0.119 1.00 0.00 H ATOM 197 HD11 ILE A 15 3.280 6.566 -1.243 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.779 6.168 -2.083 1.00 0.00 H ATOM 199 HD13 ILE A 15 4.785 6.412 -0.336 1.00 0.00 H ATOM 200 N CYS A 16 2.513 3.128 3.005 1.00 0.00 N ATOM 201 CA CYS A 16 1.638 2.738 4.145 1.00 0.00 C ATOM 202 C CYS A 16 2.436 1.883 5.131 1.00 0.00 C ATOM 203 O CYS A 16 2.778 0.751 4.841 1.00 0.00 O ATOM 204 CB CYS A 16 0.501 1.923 3.524 1.00 0.00 C ATOM 205 SG CYS A 16 -0.196 2.824 2.116 1.00 0.00 S ATOM 206 H CYS A 16 2.958 2.434 2.472 1.00 0.00 H ATOM 207 HA CYS A 16 1.244 3.614 4.633 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.884 0.970 3.185 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.269 1.758 4.263 1.00 0.00 H HETATM 210 N NH2 A 17 2.752 2.371 6.296 1.00 0.00 N HETATM 211 HN1 NH2 A 17 2.482 3.283 6.538 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.255 1.825 6.935 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 2 ATOM 1 N GLY A 1 -6.626 5.962 -1.971 1.00 0.00 N ATOM 2 CA GLY A 1 -5.224 6.014 -2.449 1.00 0.00 C ATOM 3 C GLY A 1 -4.550 4.661 -2.201 1.00 0.00 C ATOM 4 O GLY A 1 -5.211 3.642 -2.085 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.107 5.149 -2.395 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.116 6.836 -2.245 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.638 5.860 -0.937 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.216 6.234 -3.507 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.691 6.784 -1.915 1.00 0.00 H ATOM 10 N CYS A 2 -3.242 4.642 -2.122 1.00 0.00 N ATOM 11 CA CYS A 2 -2.515 3.353 -1.889 1.00 0.00 C ATOM 12 C CYS A 2 -2.996 2.693 -0.606 1.00 0.00 C ATOM 13 O CYS A 2 -3.442 1.565 -0.606 1.00 0.00 O ATOM 14 CB CYS A 2 -1.039 3.737 -1.761 1.00 0.00 C ATOM 15 SG CYS A 2 -0.012 2.243 -1.773 1.00 0.00 S ATOM 16 H CYS A 2 -2.737 5.477 -2.220 1.00 0.00 H ATOM 17 HA CYS A 2 -2.651 2.692 -2.720 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.762 4.373 -2.579 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.888 4.264 -0.830 1.00 0.00 H ATOM 20 N CYS A 3 -2.893 3.392 0.481 1.00 0.00 N ATOM 21 CA CYS A 3 -3.328 2.821 1.800 1.00 0.00 C ATOM 22 C CYS A 3 -4.760 2.257 1.718 1.00 0.00 C ATOM 23 O CYS A 3 -5.078 1.272 2.354 1.00 0.00 O ATOM 24 CB CYS A 3 -3.256 3.978 2.794 1.00 0.00 C ATOM 25 SG CYS A 3 -1.550 4.599 2.885 1.00 0.00 S ATOM 26 H CYS A 3 -2.515 4.293 0.432 1.00 0.00 H ATOM 27 HA CYS A 3 -2.645 2.045 2.102 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.914 4.773 2.469 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.566 3.633 3.768 1.00 0.00 H ATOM 30 N SER A 4 -5.619 2.864 0.935 1.00 0.00 N ATOM 31 CA SER A 4 -7.020 2.340 0.810 1.00 0.00 C ATOM 32 C SER A 4 -7.011 0.949 0.148 1.00 0.00 C ATOM 33 O SER A 4 -7.983 0.219 0.201 1.00 0.00 O ATOM 34 CB SER A 4 -7.753 3.345 -0.083 1.00 0.00 C ATOM 35 OG SER A 4 -7.217 4.652 0.116 1.00 0.00 O ATOM 36 H SER A 4 -5.343 3.651 0.421 1.00 0.00 H ATOM 37 HA SER A 4 -7.494 2.296 1.778 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.629 3.067 -1.120 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.808 3.336 0.163 1.00 0.00 H ATOM 40 HG SER A 4 -7.775 5.107 0.766 1.00 0.00 H ATOM 41 N ASN A 5 -5.918 0.582 -0.480 1.00 0.00 N ATOM 42 CA ASN A 5 -5.826 -0.750 -1.148 1.00 0.00 C ATOM 43 C ASN A 5 -4.902 -1.665 -0.335 1.00 0.00 C ATOM 44 O ASN A 5 -3.773 -1.303 -0.048 1.00 0.00 O ATOM 45 CB ASN A 5 -5.219 -0.448 -2.522 1.00 0.00 C ATOM 46 CG ASN A 5 -5.185 -1.720 -3.376 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.160 -2.817 -2.859 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.172 -1.617 -4.673 1.00 0.00 N ATOM 49 H ASN A 5 -5.143 1.186 -0.513 1.00 0.00 H ATOM 50 HA ASN A 5 -6.804 -1.189 -1.259 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.813 0.305 -3.018 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.212 -0.077 -2.391 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.182 -0.733 -5.098 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.158 -2.428 -5.226 1.00 0.00 H ATOM 55 N PRO A 6 -5.398 -2.833 -0.003 1.00 0.00 N ATOM 56 CA PRO A 6 -4.586 -3.796 0.785 1.00 0.00 C ATOM 57 C PRO A 6 -3.369 -4.238 -0.038 1.00 0.00 C ATOM 58 O PRO A 6 -2.268 -4.327 0.478 1.00 0.00 O ATOM 59 CB PRO A 6 -5.552 -4.953 1.044 1.00 0.00 C ATOM 60 CG PRO A 6 -6.571 -4.846 -0.043 1.00 0.00 C ATOM 61 CD PRO A 6 -6.727 -3.375 -0.320 1.00 0.00 C ATOM 62 HA PRO A 6 -4.274 -3.358 1.722 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.026 -5.897 0.989 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.024 -4.840 2.006 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.227 -5.359 -0.928 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.516 -5.254 0.286 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.970 -3.212 -1.366 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.476 -2.940 0.319 1.00 0.00 H ATOM 69 N ALA A 7 -3.551 -4.489 -1.315 1.00 0.00 N ATOM 70 CA ALA A 7 -2.390 -4.895 -2.167 1.00 0.00 C ATOM 71 C ALA A 7 -1.361 -3.759 -2.174 1.00 0.00 C ATOM 72 O ALA A 7 -0.169 -3.984 -2.058 1.00 0.00 O ATOM 73 CB ALA A 7 -2.960 -5.111 -3.574 1.00 0.00 C ATOM 74 H ALA A 7 -4.447 -4.388 -1.711 1.00 0.00 H ATOM 75 HA ALA A 7 -1.948 -5.807 -1.792 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.156 -5.127 -4.297 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.641 -4.309 -3.812 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.489 -6.050 -3.606 1.00 0.00 H ATOM 79 N CYS A 8 -1.823 -2.537 -2.290 1.00 0.00 N ATOM 80 CA CYS A 8 -0.885 -1.374 -2.283 1.00 0.00 C ATOM 81 C CYS A 8 -0.198 -1.290 -0.920 1.00 0.00 C ATOM 82 O CYS A 8 0.997 -1.095 -0.835 1.00 0.00 O ATOM 83 CB CYS A 8 -1.741 -0.132 -2.531 1.00 0.00 C ATOM 84 SG CYS A 8 -0.730 1.150 -3.313 1.00 0.00 S ATOM 85 H CYS A 8 -2.788 -2.388 -2.364 1.00 0.00 H ATOM 86 HA CYS A 8 -0.154 -1.477 -3.066 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.565 -0.387 -3.183 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.124 0.236 -1.592 1.00 0.00 H ATOM 89 N MET A 9 -0.947 -1.463 0.146 1.00 0.00 N ATOM 90 CA MET A 9 -0.343 -1.421 1.517 1.00 0.00 C ATOM 91 C MET A 9 0.816 -2.418 1.594 1.00 0.00 C ATOM 92 O MET A 9 1.905 -2.089 2.029 1.00 0.00 O ATOM 93 CB MET A 9 -1.467 -1.859 2.471 1.00 0.00 C ATOM 94 CG MET A 9 -1.320 -1.146 3.822 1.00 0.00 C ATOM 95 SD MET A 9 -2.029 0.512 3.707 1.00 0.00 S ATOM 96 CE MET A 9 -3.188 0.370 5.086 1.00 0.00 C ATOM 97 H MET A 9 -1.911 -1.637 0.042 1.00 0.00 H ATOM 98 HA MET A 9 -0.011 -0.425 1.759 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.424 -1.615 2.038 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.413 -2.930 2.627 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.838 -1.708 4.587 1.00 0.00 H ATOM 102 HG3 MET A 9 -0.273 -1.073 4.078 1.00 0.00 H ATOM 103 HE1 MET A 9 -3.770 -0.535 4.975 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.848 1.228 5.089 1.00 0.00 H ATOM 105 HE3 MET A 9 -2.643 0.335 6.016 1.00 0.00 H ATOM 106 N VAL A 10 0.576 -3.633 1.175 1.00 0.00 N ATOM 107 CA VAL A 10 1.645 -4.681 1.215 1.00 0.00 C ATOM 108 C VAL A 10 2.727 -4.390 0.167 1.00 0.00 C ATOM 109 O VAL A 10 3.912 -4.489 0.444 1.00 0.00 O ATOM 110 CB VAL A 10 0.924 -6.002 0.902 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.942 -7.148 0.826 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.100 -6.307 2.004 1.00 0.00 C ATOM 113 H VAL A 10 -0.321 -3.857 0.835 1.00 0.00 H ATOM 114 HA VAL A 10 2.081 -4.728 2.199 1.00 0.00 H ATOM 115 HB VAL A 10 0.414 -5.917 -0.051 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.313 -7.230 -0.186 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.468 -8.076 1.110 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.769 -6.949 1.495 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.325 -5.400 2.552 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.311 -7.039 2.682 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.005 -6.692 1.561 1.00 0.00 H ATOM 122 N ASN A 11 2.335 -4.045 -1.034 1.00 0.00 N ATOM 123 CA ASN A 11 3.345 -3.760 -2.101 1.00 0.00 C ATOM 124 C ASN A 11 4.126 -2.482 -1.784 1.00 0.00 C ATOM 125 O ASN A 11 5.277 -2.352 -2.160 1.00 0.00 O ATOM 126 CB ASN A 11 2.550 -3.569 -3.395 1.00 0.00 C ATOM 127 CG ASN A 11 2.313 -4.926 -4.061 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.126 -5.382 -4.841 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.233 -5.597 -3.786 1.00 0.00 N ATOM 130 H ASN A 11 1.375 -3.984 -1.236 1.00 0.00 H ATOM 131 HA ASN A 11 4.020 -4.597 -2.207 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.602 -3.103 -3.173 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.110 -2.937 -4.068 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.579 -5.234 -3.152 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.072 -6.464 -4.216 1.00 0.00 H ATOM 136 N ASN A 12 3.518 -1.530 -1.123 1.00 0.00 N ATOM 137 CA ASN A 12 4.242 -0.262 -0.819 1.00 0.00 C ATOM 138 C ASN A 12 4.164 0.074 0.674 1.00 0.00 C ATOM 139 O ASN A 12 3.435 0.965 1.069 1.00 0.00 O ATOM 140 CB ASN A 12 3.520 0.805 -1.640 1.00 0.00 C ATOM 141 CG ASN A 12 4.221 0.974 -2.984 1.00 0.00 C ATOM 142 OD1 ASN A 12 5.311 1.513 -3.051 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.642 0.524 -4.059 1.00 0.00 N ATOM 144 H ASN A 12 2.582 -1.638 -0.838 1.00 0.00 H ATOM 145 HA ASN A 12 5.271 -0.333 -1.136 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.494 0.498 -1.798 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.536 1.741 -1.106 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.765 0.085 -3.996 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.081 0.618 -4.928 1.00 0.00 H ATOM 150 N PRO A 13 4.943 -0.625 1.465 1.00 0.00 N ATOM 151 CA PRO A 13 4.959 -0.359 2.927 1.00 0.00 C ATOM 152 C PRO A 13 5.558 1.029 3.180 1.00 0.00 C ATOM 153 O PRO A 13 5.184 1.714 4.107 1.00 0.00 O ATOM 154 CB PRO A 13 5.843 -1.475 3.488 1.00 0.00 C ATOM 155 CG PRO A 13 6.702 -1.899 2.339 1.00 0.00 C ATOM 156 CD PRO A 13 5.871 -1.708 1.095 1.00 0.00 C ATOM 157 HA PRO A 13 3.963 -0.427 3.334 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.448 -1.101 4.305 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.235 -2.303 3.819 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.591 -1.287 2.298 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.972 -2.939 2.440 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.501 -1.416 0.263 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.324 -2.609 0.861 1.00 0.00 H ATOM 164 N GLN A 14 6.472 1.454 2.343 1.00 0.00 N ATOM 165 CA GLN A 14 7.087 2.811 2.511 1.00 0.00 C ATOM 166 C GLN A 14 6.029 3.905 2.325 1.00 0.00 C ATOM 167 O GLN A 14 6.194 5.022 2.780 1.00 0.00 O ATOM 168 CB GLN A 14 8.170 2.924 1.423 1.00 0.00 C ATOM 169 CG GLN A 14 7.598 2.511 0.059 1.00 0.00 C ATOM 170 CD GLN A 14 8.325 3.259 -1.062 1.00 0.00 C ATOM 171 OE1 GLN A 14 9.389 3.811 -0.855 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.794 3.307 -2.254 1.00 0.00 N ATOM 173 H GLN A 14 6.744 0.881 1.594 1.00 0.00 H ATOM 174 HA GLN A 14 7.534 2.896 3.484 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.513 3.947 1.372 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.000 2.281 1.675 1.00 0.00 H ATOM 177 HG2 GLN A 14 7.726 1.445 -0.080 1.00 0.00 H ATOM 178 HG3 GLN A 14 6.548 2.752 0.023 1.00 0.00 H ATOM 179 HE21 GLN A 14 6.933 2.869 -2.431 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.260 3.774 -2.979 1.00 0.00 H ATOM 181 N ILE A 15 4.949 3.598 1.661 1.00 0.00 N ATOM 182 CA ILE A 15 3.883 4.624 1.448 1.00 0.00 C ATOM 183 C ILE A 15 2.905 4.615 2.627 1.00 0.00 C ATOM 184 O ILE A 15 2.560 5.653 3.164 1.00 0.00 O ATOM 185 CB ILE A 15 3.173 4.208 0.150 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.183 4.152 -1.011 1.00 0.00 C ATOM 187 CG2 ILE A 15 2.078 5.224 -0.184 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.680 5.558 -1.346 1.00 0.00 C ATOM 189 H ILE A 15 4.835 2.694 1.302 1.00 0.00 H ATOM 190 HA ILE A 15 4.321 5.603 1.330 1.00 0.00 H ATOM 191 HB ILE A 15 2.728 3.235 0.285 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.020 3.533 -0.731 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.704 3.731 -1.881 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.134 4.871 0.202 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.011 5.339 -1.255 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.315 6.179 0.264 1.00 0.00 H ATOM 197 HD11 ILE A 15 5.748 5.602 -1.199 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.195 6.276 -0.701 1.00 0.00 H ATOM 199 HD13 ILE A 15 4.446 5.779 -2.378 1.00 0.00 H ATOM 200 N CYS A 16 2.457 3.460 3.037 1.00 0.00 N ATOM 201 CA CYS A 16 1.498 3.398 4.181 1.00 0.00 C ATOM 202 C CYS A 16 2.194 2.879 5.442 1.00 0.00 C ATOM 203 O CYS A 16 1.558 2.328 6.320 1.00 0.00 O ATOM 204 CB CYS A 16 0.401 2.428 3.737 1.00 0.00 C ATOM 205 SG CYS A 16 -0.402 3.062 2.239 1.00 0.00 S ATOM 206 H CYS A 16 2.748 2.636 2.592 1.00 0.00 H ATOM 207 HA CYS A 16 1.074 4.373 4.365 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.837 1.462 3.530 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.330 2.331 4.526 1.00 0.00 H HETATM 210 N NH2 A 17 3.477 3.042 5.586 1.00 0.00 N HETATM 211 HN1 NH2 A 17 4.000 3.485 4.886 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.923 2.714 6.395 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 3 ATOM 1 N GLY A 1 -7.074 6.201 -1.537 1.00 0.00 N ATOM 2 CA GLY A 1 -5.710 6.364 -2.113 1.00 0.00 C ATOM 3 C GLY A 1 -4.993 5.014 -2.115 1.00 0.00 C ATOM 4 O GLY A 1 -5.611 3.967 -2.008 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.775 6.208 -2.299 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.265 6.979 -0.880 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.132 5.292 -1.024 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.788 6.734 -3.127 1.00 0.00 H ATOM 9 HA3 GLY A 1 -5.151 7.066 -1.515 1.00 0.00 H ATOM 10 N CYS A 2 -3.693 5.021 -2.242 1.00 0.00 N ATOM 11 CA CYS A 2 -2.936 3.734 -2.258 1.00 0.00 C ATOM 12 C CYS A 2 -3.131 2.982 -0.943 1.00 0.00 C ATOM 13 O CYS A 2 -3.386 1.793 -0.929 1.00 0.00 O ATOM 14 CB CYS A 2 -1.466 4.109 -2.443 1.00 0.00 C ATOM 15 SG CYS A 2 -0.647 2.810 -3.394 1.00 0.00 S ATOM 16 H CYS A 2 -3.216 5.872 -2.332 1.00 0.00 H ATOM 17 HA CYS A 2 -3.261 3.129 -3.078 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.396 5.048 -2.969 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.991 4.200 -1.477 1.00 0.00 H ATOM 20 N CYS A 3 -3.016 3.670 0.156 1.00 0.00 N ATOM 21 CA CYS A 3 -3.198 3.009 1.490 1.00 0.00 C ATOM 22 C CYS A 3 -4.564 2.320 1.567 1.00 0.00 C ATOM 23 O CYS A 3 -4.714 1.317 2.238 1.00 0.00 O ATOM 24 CB CYS A 3 -3.094 4.129 2.531 1.00 0.00 C ATOM 25 SG CYS A 3 -1.386 4.741 2.596 1.00 0.00 S ATOM 26 H CYS A 3 -2.811 4.623 0.104 1.00 0.00 H ATOM 27 HA CYS A 3 -2.411 2.287 1.653 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.760 4.936 2.261 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.373 3.746 3.501 1.00 0.00 H ATOM 30 N SER A 4 -5.557 2.832 0.881 1.00 0.00 N ATOM 31 CA SER A 4 -6.904 2.178 0.916 1.00 0.00 C ATOM 32 C SER A 4 -6.841 0.798 0.238 1.00 0.00 C ATOM 33 O SER A 4 -7.719 -0.031 0.414 1.00 0.00 O ATOM 34 CB SER A 4 -7.837 3.108 0.133 1.00 0.00 C ATOM 35 OG SER A 4 -7.370 4.453 0.233 1.00 0.00 O ATOM 36 H SER A 4 -5.421 3.638 0.336 1.00 0.00 H ATOM 37 HA SER A 4 -7.249 2.080 1.933 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.854 2.813 -0.902 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.836 3.035 0.538 1.00 0.00 H ATOM 40 HG SER A 4 -7.443 4.721 1.159 1.00 0.00 H ATOM 41 N ASN A 5 -5.812 0.542 -0.531 1.00 0.00 N ATOM 42 CA ASN A 5 -5.685 -0.776 -1.211 1.00 0.00 C ATOM 43 C ASN A 5 -4.742 -1.678 -0.411 1.00 0.00 C ATOM 44 O ASN A 5 -3.596 -1.322 -0.195 1.00 0.00 O ATOM 45 CB ASN A 5 -5.072 -0.469 -2.588 1.00 0.00 C ATOM 46 CG ASN A 5 -5.150 -1.711 -3.477 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.342 -2.812 -2.999 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.997 -1.585 -4.763 1.00 0.00 N ATOM 49 H ASN A 5 -5.113 1.218 -0.656 1.00 0.00 H ATOM 50 HA ASN A 5 -6.652 -1.237 -1.330 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.619 0.341 -3.054 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.035 -0.183 -2.466 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.836 -0.702 -5.155 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.040 -2.375 -5.341 1.00 0.00 H ATOM 55 N PRO A 6 -5.233 -2.831 -0.021 1.00 0.00 N ATOM 56 CA PRO A 6 -4.393 -3.790 0.736 1.00 0.00 C ATOM 57 C PRO A 6 -3.224 -4.225 -0.146 1.00 0.00 C ATOM 58 O PRO A 6 -2.118 -4.405 0.328 1.00 0.00 O ATOM 59 CB PRO A 6 -5.348 -4.946 1.049 1.00 0.00 C ATOM 60 CG PRO A 6 -6.415 -4.838 0.008 1.00 0.00 C ATOM 61 CD PRO A 6 -6.582 -3.363 -0.256 1.00 0.00 C ATOM 62 HA PRO A 6 -4.036 -3.341 1.650 1.00 0.00 H ATOM 63 HB2 PRO A 6 -4.830 -5.894 0.970 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.778 -4.831 2.031 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.107 -5.349 -0.894 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.341 -5.252 0.377 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.892 -3.190 -1.279 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.284 -2.925 0.438 1.00 0.00 H ATOM 69 N ALA A 7 -3.450 -4.349 -1.438 1.00 0.00 N ATOM 70 CA ALA A 7 -2.337 -4.722 -2.353 1.00 0.00 C ATOM 71 C ALA A 7 -1.256 -3.655 -2.236 1.00 0.00 C ATOM 72 O ALA A 7 -0.100 -3.953 -2.026 1.00 0.00 O ATOM 73 CB ALA A 7 -2.940 -4.738 -3.764 1.00 0.00 C ATOM 74 H ALA A 7 -4.344 -4.162 -1.803 1.00 0.00 H ATOM 75 HA ALA A 7 -1.946 -5.697 -2.099 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.003 -4.916 -3.703 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.480 -5.525 -4.345 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.762 -3.788 -4.246 1.00 0.00 H ATOM 79 N CYS A 8 -1.630 -2.402 -2.336 1.00 0.00 N ATOM 80 CA CYS A 8 -0.611 -1.317 -2.199 1.00 0.00 C ATOM 81 C CYS A 8 -0.017 -1.350 -0.789 1.00 0.00 C ATOM 82 O CYS A 8 1.180 -1.267 -0.611 1.00 0.00 O ATOM 83 CB CYS A 8 -1.347 0.005 -2.444 1.00 0.00 C ATOM 84 SG CYS A 8 -0.250 1.387 -2.017 1.00 0.00 S ATOM 85 H CYS A 8 -2.573 -2.181 -2.477 1.00 0.00 H ATOM 86 HA CYS A 8 0.162 -1.445 -2.934 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.621 0.074 -3.485 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.233 0.048 -1.831 1.00 0.00 H ATOM 89 N MET A 9 -0.847 -1.476 0.214 1.00 0.00 N ATOM 90 CA MET A 9 -0.343 -1.512 1.622 1.00 0.00 C ATOM 91 C MET A 9 0.761 -2.568 1.790 1.00 0.00 C ATOM 92 O MET A 9 1.806 -2.301 2.359 1.00 0.00 O ATOM 93 CB MET A 9 -1.570 -1.881 2.464 1.00 0.00 C ATOM 94 CG MET A 9 -2.210 -0.617 3.042 1.00 0.00 C ATOM 95 SD MET A 9 -3.786 -1.043 3.824 1.00 0.00 S ATOM 96 CE MET A 9 -3.115 -1.668 5.384 1.00 0.00 C ATOM 97 H MET A 9 -1.813 -1.547 0.043 1.00 0.00 H ATOM 98 HA MET A 9 0.022 -0.542 1.910 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.289 -2.393 1.843 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.268 -2.532 3.270 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.549 -0.181 3.777 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.386 0.094 2.248 1.00 0.00 H ATOM 103 HE1 MET A 9 -2.960 -2.737 5.308 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.811 -1.457 6.186 1.00 0.00 H ATOM 105 HE3 MET A 9 -2.173 -1.186 5.593 1.00 0.00 H ATOM 106 N VAL A 10 0.537 -3.764 1.318 1.00 0.00 N ATOM 107 CA VAL A 10 1.574 -4.830 1.476 1.00 0.00 C ATOM 108 C VAL A 10 2.656 -4.725 0.388 1.00 0.00 C ATOM 109 O VAL A 10 3.796 -5.097 0.609 1.00 0.00 O ATOM 110 CB VAL A 10 0.802 -6.160 1.398 1.00 0.00 C ATOM 111 CG1 VAL A 10 0.331 -6.422 -0.036 1.00 0.00 C ATOM 112 CG2 VAL A 10 1.709 -7.306 1.851 1.00 0.00 C ATOM 113 H VAL A 10 -0.317 -3.964 0.874 1.00 0.00 H ATOM 114 HA VAL A 10 2.032 -4.739 2.447 1.00 0.00 H ATOM 115 HB VAL A 10 -0.059 -6.110 2.050 1.00 0.00 H ATOM 116 HG11 VAL A 10 -0.544 -7.057 -0.019 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.119 -6.910 -0.592 1.00 0.00 H ATOM 118 HG13 VAL A 10 0.087 -5.484 -0.505 1.00 0.00 H ATOM 119 HG21 VAL A 10 2.617 -7.294 1.270 1.00 0.00 H ATOM 120 HG22 VAL A 10 1.200 -8.249 1.707 1.00 0.00 H ATOM 121 HG23 VAL A 10 1.947 -7.182 2.897 1.00 0.00 H ATOM 122 N ASN A 11 2.328 -4.224 -0.774 1.00 0.00 N ATOM 123 CA ASN A 11 3.361 -4.106 -1.851 1.00 0.00 C ATOM 124 C ASN A 11 4.202 -2.844 -1.643 1.00 0.00 C ATOM 125 O ASN A 11 5.362 -2.800 -2.005 1.00 0.00 O ATOM 126 CB ASN A 11 2.586 -4.017 -3.170 1.00 0.00 C ATOM 127 CG ASN A 11 2.190 -5.422 -3.632 1.00 0.00 C ATOM 128 OD1 ASN A 11 2.894 -6.040 -4.402 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.088 -5.961 -3.196 1.00 0.00 N ATOM 130 H ASN A 11 1.406 -3.925 -0.941 1.00 0.00 H ATOM 131 HA ASN A 11 3.997 -4.979 -1.855 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.701 -3.415 -3.030 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.211 -3.559 -3.920 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.512 -5.470 -2.572 1.00 0.00 H ATOM 135 HD22 ASN A 11 0.830 -6.860 -3.491 1.00 0.00 H ATOM 136 N ASN A 12 3.635 -1.815 -1.068 1.00 0.00 N ATOM 137 CA ASN A 12 4.405 -0.561 -0.849 1.00 0.00 C ATOM 138 C ASN A 12 4.258 -0.095 0.606 1.00 0.00 C ATOM 139 O ASN A 12 3.490 0.802 0.896 1.00 0.00 O ATOM 140 CB ASN A 12 3.780 0.456 -1.808 1.00 0.00 C ATOM 141 CG ASN A 12 4.553 0.464 -3.125 1.00 0.00 C ATOM 142 OD1 ASN A 12 5.636 1.011 -3.205 1.00 0.00 O ATOM 143 ND2 ASN A 12 4.041 -0.122 -4.172 1.00 0.00 N ATOM 144 H ASN A 12 2.695 -1.863 -0.782 1.00 0.00 H ATOM 145 HA ASN A 12 5.443 -0.707 -1.095 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.749 0.191 -1.999 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.817 1.437 -1.364 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.166 -0.561 -4.112 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.529 -0.126 -5.021 1.00 0.00 H ATOM 150 N PRO A 13 5.011 -0.719 1.480 1.00 0.00 N ATOM 151 CA PRO A 13 4.968 -0.356 2.923 1.00 0.00 C ATOM 152 C PRO A 13 5.514 1.059 3.146 1.00 0.00 C ATOM 153 O PRO A 13 5.091 1.752 4.044 1.00 0.00 O ATOM 154 CB PRO A 13 5.855 -1.412 3.586 1.00 0.00 C ATOM 155 CG PRO A 13 6.763 -1.885 2.498 1.00 0.00 C ATOM 156 CD PRO A 13 5.968 -1.807 1.222 1.00 0.00 C ATOM 157 HA PRO A 13 3.960 -0.434 3.301 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.429 -0.967 4.389 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.256 -2.231 3.954 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.634 -1.245 2.439 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.062 -2.905 2.680 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.613 -1.566 0.388 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.442 -2.732 1.045 1.00 0.00 H ATOM 164 N GLN A 14 6.440 1.496 2.330 1.00 0.00 N ATOM 165 CA GLN A 14 6.995 2.880 2.500 1.00 0.00 C ATOM 166 C GLN A 14 5.876 3.921 2.385 1.00 0.00 C ATOM 167 O GLN A 14 5.889 4.944 3.042 1.00 0.00 O ATOM 168 CB GLN A 14 7.991 3.076 1.351 1.00 0.00 C ATOM 169 CG GLN A 14 9.112 2.037 1.424 1.00 0.00 C ATOM 170 CD GLN A 14 9.556 1.704 -0.003 1.00 0.00 C ATOM 171 OE1 GLN A 14 10.536 2.238 -0.484 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.867 0.855 -0.714 1.00 0.00 N ATOM 173 H GLN A 14 6.764 0.921 1.607 1.00 0.00 H ATOM 174 HA GLN A 14 7.494 2.975 3.442 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.474 2.975 0.406 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.420 4.065 1.414 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.946 2.443 1.981 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.755 1.145 1.913 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.073 0.426 -0.337 1.00 0.00 H ATOM 180 HE22 GLN A 14 9.141 0.653 -1.634 1.00 0.00 H ATOM 181 N ILE A 15 4.922 3.667 1.541 1.00 0.00 N ATOM 182 CA ILE A 15 3.801 4.636 1.350 1.00 0.00 C ATOM 183 C ILE A 15 2.849 4.602 2.550 1.00 0.00 C ATOM 184 O ILE A 15 2.454 5.635 3.060 1.00 0.00 O ATOM 185 CB ILE A 15 3.089 4.176 0.068 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.085 4.151 -1.104 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.949 5.143 -0.262 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.653 5.551 -1.338 1.00 0.00 C ATOM 189 H ILE A 15 4.947 2.840 1.025 1.00 0.00 H ATOM 190 HA ILE A 15 4.189 5.631 1.216 1.00 0.00 H ATOM 191 HB ILE A 15 2.686 3.185 0.221 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.893 3.468 -0.884 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.576 3.823 -1.997 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.111 4.950 0.393 1.00 0.00 H ATOM 195 HG22 ILE A 15 1.642 5.003 -1.288 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.290 6.161 -0.127 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.970 5.639 -2.367 1.00 0.00 H ATOM 198 HD12 ILE A 15 5.497 5.714 -0.684 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.891 6.289 -1.133 1.00 0.00 H ATOM 200 N CYS A 16 2.472 3.434 3.000 1.00 0.00 N ATOM 201 CA CYS A 16 1.540 3.348 4.166 1.00 0.00 C ATOM 202 C CYS A 16 2.241 2.673 5.353 1.00 0.00 C ATOM 203 O CYS A 16 1.754 1.698 5.895 1.00 0.00 O ATOM 204 CB CYS A 16 0.360 2.499 3.673 1.00 0.00 C ATOM 205 SG CYS A 16 -0.249 3.146 2.090 1.00 0.00 S ATOM 206 H CYS A 16 2.799 2.613 2.571 1.00 0.00 H ATOM 207 HA CYS A 16 1.195 4.332 4.442 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.682 1.477 3.543 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.434 2.534 4.405 1.00 0.00 H HETATM 210 N NH2 A 17 3.374 3.149 5.787 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.774 3.934 5.357 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.826 2.726 6.547 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 4 ATOM 1 N GLY A 1 -6.384 5.811 -2.553 1.00 0.00 N ATOM 2 CA GLY A 1 -4.925 5.838 -2.836 1.00 0.00 C ATOM 3 C GLY A 1 -4.325 4.451 -2.585 1.00 0.00 C ATOM 4 O GLY A 1 -5.004 3.440 -2.660 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.577 5.151 -1.770 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.890 5.496 -3.404 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.706 6.760 -2.290 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.766 6.121 -3.868 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.445 6.555 -2.190 1.00 0.00 H ATOM 10 N CYS A 2 -3.053 4.388 -2.283 1.00 0.00 N ATOM 11 CA CYS A 2 -2.407 3.064 -2.028 1.00 0.00 C ATOM 12 C CYS A 2 -2.793 2.542 -0.653 1.00 0.00 C ATOM 13 O CYS A 2 -3.204 1.410 -0.497 1.00 0.00 O ATOM 14 CB CYS A 2 -0.899 3.317 -2.093 1.00 0.00 C ATOM 15 SG CYS A 2 -0.031 1.756 -2.413 1.00 0.00 S ATOM 16 H CYS A 2 -2.525 5.213 -2.226 1.00 0.00 H ATOM 17 HA CYS A 2 -2.691 2.363 -2.781 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.687 4.017 -2.881 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.562 3.728 -1.150 1.00 0.00 H ATOM 20 N CYS A 3 -2.652 3.362 0.340 1.00 0.00 N ATOM 21 CA CYS A 3 -2.996 2.941 1.737 1.00 0.00 C ATOM 22 C CYS A 3 -4.454 2.459 1.838 1.00 0.00 C ATOM 23 O CYS A 3 -4.791 1.699 2.722 1.00 0.00 O ATOM 24 CB CYS A 3 -2.780 4.184 2.602 1.00 0.00 C ATOM 25 SG CYS A 3 -1.004 4.556 2.709 1.00 0.00 S ATOM 26 H CYS A 3 -2.310 4.262 0.166 1.00 0.00 H ATOM 27 HA CYS A 3 -2.328 2.157 2.061 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.300 5.026 2.165 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.168 4.001 3.591 1.00 0.00 H ATOM 30 N SER A 4 -5.319 2.880 0.945 1.00 0.00 N ATOM 31 CA SER A 4 -6.744 2.419 1.007 1.00 0.00 C ATOM 32 C SER A 4 -6.889 1.029 0.356 1.00 0.00 C ATOM 33 O SER A 4 -7.945 0.431 0.386 1.00 0.00 O ATOM 34 CB SER A 4 -7.544 3.469 0.230 1.00 0.00 C ATOM 35 OG SER A 4 -6.779 3.918 -0.883 1.00 0.00 O ATOM 36 H SER A 4 -5.037 3.488 0.229 1.00 0.00 H ATOM 37 HA SER A 4 -7.083 2.387 2.032 1.00 0.00 H ATOM 38 HB2 SER A 4 -8.465 3.034 -0.126 1.00 0.00 H ATOM 39 HB3 SER A 4 -7.773 4.303 0.882 1.00 0.00 H ATOM 40 HG SER A 4 -6.799 3.218 -1.554 1.00 0.00 H ATOM 41 N ASN A 5 -5.838 0.509 -0.232 1.00 0.00 N ATOM 42 CA ASN A 5 -5.914 -0.839 -0.874 1.00 0.00 C ATOM 43 C ASN A 5 -4.945 -1.784 -0.160 1.00 0.00 C ATOM 44 O ASN A 5 -3.789 -1.456 -0.004 1.00 0.00 O ATOM 45 CB ASN A 5 -5.472 -0.606 -2.328 1.00 0.00 C ATOM 46 CG ASN A 5 -5.532 -1.913 -3.129 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.449 -2.992 -2.575 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.653 -1.859 -4.423 1.00 0.00 N ATOM 49 H ASN A 5 -4.990 1.001 -0.246 1.00 0.00 H ATOM 50 HA ASN A 5 -6.922 -1.220 -0.845 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.127 0.120 -2.788 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.460 -0.230 -2.338 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.704 -0.991 -4.873 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.693 -2.683 -4.945 1.00 0.00 H ATOM 55 N PRO A 6 -5.431 -2.931 0.247 1.00 0.00 N ATOM 56 CA PRO A 6 -4.561 -3.907 0.956 1.00 0.00 C ATOM 57 C PRO A 6 -3.417 -4.357 0.043 1.00 0.00 C ATOM 58 O PRO A 6 -2.265 -4.326 0.429 1.00 0.00 O ATOM 59 CB PRO A 6 -5.516 -5.049 1.312 1.00 0.00 C ATOM 60 CG PRO A 6 -6.644 -4.922 0.338 1.00 0.00 C ATOM 61 CD PRO A 6 -6.802 -3.445 0.081 1.00 0.00 C ATOM 62 HA PRO A 6 -4.167 -3.466 1.858 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.020 -6.004 1.197 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.881 -4.932 2.318 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.407 -5.442 -0.580 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.554 -5.316 0.767 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.161 -3.274 -0.925 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.463 -2.998 0.805 1.00 0.00 H ATOM 69 N ALA A 7 -3.715 -4.734 -1.175 1.00 0.00 N ATOM 70 CA ALA A 7 -2.627 -5.144 -2.116 1.00 0.00 C ATOM 71 C ALA A 7 -1.625 -3.994 -2.248 1.00 0.00 C ATOM 72 O ALA A 7 -0.424 -4.192 -2.229 1.00 0.00 O ATOM 73 CB ALA A 7 -3.320 -5.412 -3.454 1.00 0.00 C ATOM 74 H ALA A 7 -4.648 -4.721 -1.476 1.00 0.00 H ATOM 75 HA ALA A 7 -2.132 -6.038 -1.763 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.091 -6.155 -3.318 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.597 -5.774 -4.166 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.763 -4.499 -3.821 1.00 0.00 H ATOM 79 N CYS A 8 -2.118 -2.785 -2.357 1.00 0.00 N ATOM 80 CA CYS A 8 -1.206 -1.608 -2.463 1.00 0.00 C ATOM 81 C CYS A 8 -0.502 -1.377 -1.114 1.00 0.00 C ATOM 82 O CYS A 8 0.681 -1.102 -1.070 1.00 0.00 O ATOM 83 CB CYS A 8 -2.103 -0.419 -2.816 1.00 0.00 C ATOM 84 SG CYS A 8 -1.158 0.790 -3.785 1.00 0.00 S ATOM 85 H CYS A 8 -3.089 -2.651 -2.349 1.00 0.00 H ATOM 86 HA CYS A 8 -0.481 -1.763 -3.245 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.945 -0.763 -3.392 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.453 0.043 -1.907 1.00 0.00 H ATOM 89 N MET A 9 -1.215 -1.499 -0.012 1.00 0.00 N ATOM 90 CA MET A 9 -0.587 -1.300 1.327 1.00 0.00 C ATOM 91 C MET A 9 0.634 -2.209 1.467 1.00 0.00 C ATOM 92 O MET A 9 1.690 -1.784 1.891 1.00 0.00 O ATOM 93 CB MET A 9 -1.664 -1.708 2.338 1.00 0.00 C ATOM 94 CG MET A 9 -2.624 -0.539 2.581 1.00 0.00 C ATOM 95 SD MET A 9 -4.163 -1.169 3.293 1.00 0.00 S ATOM 96 CE MET A 9 -3.875 -0.622 4.993 1.00 0.00 C ATOM 97 H MET A 9 -2.170 -1.732 -0.065 1.00 0.00 H ATOM 98 HA MET A 9 -0.312 -0.271 1.470 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.214 -2.553 1.953 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.195 -1.984 3.266 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.173 0.165 3.263 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.836 -0.049 1.642 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.695 -0.949 5.617 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.807 0.458 5.017 1.00 0.00 H ATOM 105 HE3 MET A 9 -2.954 -1.048 5.357 1.00 0.00 H ATOM 106 N VAL A 10 0.491 -3.458 1.107 1.00 0.00 N ATOM 107 CA VAL A 10 1.641 -4.406 1.208 1.00 0.00 C ATOM 108 C VAL A 10 2.683 -4.063 0.138 1.00 0.00 C ATOM 109 O VAL A 10 3.875 -4.176 0.363 1.00 0.00 O ATOM 110 CB VAL A 10 1.050 -5.805 0.963 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.126 -6.868 1.179 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.100 -6.066 1.937 1.00 0.00 C ATOM 113 H VAL A 10 -0.375 -3.771 0.763 1.00 0.00 H ATOM 114 HA VAL A 10 2.077 -4.354 2.189 1.00 0.00 H ATOM 115 HB VAL A 10 0.685 -5.868 -0.052 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.673 -7.848 1.159 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.605 -6.710 2.136 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.862 -6.800 0.396 1.00 0.00 H ATOM 119 HG21 VAL A 10 0.054 -5.498 2.843 1.00 0.00 H ATOM 120 HG22 VAL A 10 -0.137 -7.120 2.175 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.033 -5.773 1.482 1.00 0.00 H ATOM 122 N ASN A 11 2.241 -3.648 -1.020 1.00 0.00 N ATOM 123 CA ASN A 11 3.195 -3.292 -2.115 1.00 0.00 C ATOM 124 C ASN A 11 3.949 -2.007 -1.775 1.00 0.00 C ATOM 125 O ASN A 11 5.100 -1.852 -2.124 1.00 0.00 O ATOM 126 CB ASN A 11 2.334 -3.071 -3.358 1.00 0.00 C ATOM 127 CG ASN A 11 2.760 -4.049 -4.450 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.520 -3.696 -5.334 1.00 0.00 O ATOM 129 ND2 ASN A 11 2.303 -5.267 -4.433 1.00 0.00 N ATOM 130 H ASN A 11 1.274 -3.570 -1.170 1.00 0.00 H ATOM 131 HA ASN A 11 3.887 -4.101 -2.286 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.296 -3.232 -3.116 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.467 -2.060 -3.714 1.00 0.00 H ATOM 134 HD21 ASN A 11 1.683 -5.553 -3.728 1.00 0.00 H ATOM 135 HD22 ASN A 11 2.576 -5.901 -5.129 1.00 0.00 H ATOM 136 N ASN A 12 3.306 -1.077 -1.113 1.00 0.00 N ATOM 137 CA ASN A 12 3.988 0.206 -0.771 1.00 0.00 C ATOM 138 C ASN A 12 4.050 0.407 0.747 1.00 0.00 C ATOM 139 O ASN A 12 3.394 1.285 1.280 1.00 0.00 O ATOM 140 CB ASN A 12 3.132 1.293 -1.418 1.00 0.00 C ATOM 141 CG ASN A 12 3.550 1.481 -2.880 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.306 2.381 -3.198 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.085 0.672 -3.791 1.00 0.00 N ATOM 144 H ASN A 12 2.371 -1.216 -0.851 1.00 0.00 H ATOM 145 HA ASN A 12 4.982 0.226 -1.192 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.091 1.006 -1.370 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.274 2.219 -0.887 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.469 -0.044 -3.539 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.361 0.776 -4.727 1.00 0.00 H ATOM 150 N PRO A 13 4.858 -0.393 1.396 1.00 0.00 N ATOM 151 CA PRO A 13 5.023 -0.276 2.867 1.00 0.00 C ATOM 152 C PRO A 13 5.681 1.065 3.206 1.00 0.00 C ATOM 153 O PRO A 13 5.434 1.639 4.249 1.00 0.00 O ATOM 154 CB PRO A 13 5.936 -1.454 3.221 1.00 0.00 C ATOM 155 CG PRO A 13 6.665 -1.759 1.954 1.00 0.00 C ATOM 156 CD PRO A 13 5.695 -1.467 0.841 1.00 0.00 C ATOM 157 HA PRO A 13 4.074 -0.376 3.367 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.633 -1.165 4.000 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.353 -2.307 3.529 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.544 -1.131 1.866 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.948 -2.802 1.927 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.222 -1.128 -0.044 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.095 -2.337 0.621 1.00 0.00 H ATOM 164 N GLN A 14 6.504 1.578 2.319 1.00 0.00 N ATOM 165 CA GLN A 14 7.164 2.898 2.577 1.00 0.00 C ATOM 166 C GLN A 14 6.094 3.980 2.714 1.00 0.00 C ATOM 167 O GLN A 14 6.200 4.882 3.519 1.00 0.00 O ATOM 168 CB GLN A 14 8.041 3.191 1.347 1.00 0.00 C ATOM 169 CG GLN A 14 8.882 1.967 0.969 1.00 0.00 C ATOM 170 CD GLN A 14 8.320 1.357 -0.318 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.315 0.676 -0.287 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.909 1.585 -1.457 1.00 0.00 N ATOM 173 H GLN A 14 6.675 1.100 1.481 1.00 0.00 H ATOM 174 HA GLN A 14 7.766 2.853 3.463 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.404 3.453 0.516 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.695 4.020 1.568 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.907 2.268 0.810 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.840 1.238 1.764 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.715 2.144 -1.495 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.542 1.202 -2.280 1.00 0.00 H ATOM 181 N ILE A 15 5.065 3.887 1.927 1.00 0.00 N ATOM 182 CA ILE A 15 3.965 4.894 1.992 1.00 0.00 C ATOM 183 C ILE A 15 2.931 4.454 3.036 1.00 0.00 C ATOM 184 O ILE A 15 2.493 5.238 3.855 1.00 0.00 O ATOM 185 CB ILE A 15 3.348 4.918 0.588 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.448 5.127 -0.459 1.00 0.00 C ATOM 187 CG2 ILE A 15 2.339 6.065 0.489 1.00 0.00 C ATOM 188 CD1 ILE A 15 3.827 5.121 -1.852 1.00 0.00 C ATOM 189 H ILE A 15 5.014 3.143 1.294 1.00 0.00 H ATOM 190 HA ILE A 15 4.359 5.867 2.240 1.00 0.00 H ATOM 191 HB ILE A 15 2.844 3.980 0.398 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.938 6.076 -0.286 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.173 4.329 -0.386 1.00 0.00 H ATOM 194 HG21 ILE A 15 2.807 6.984 0.814 1.00 0.00 H ATOM 195 HG22 ILE A 15 1.489 5.852 1.119 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.012 6.172 -0.536 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.601 4.995 -2.592 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.315 6.058 -2.018 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.121 4.309 -1.927 1.00 0.00 H ATOM 200 N CYS A 16 2.546 3.207 3.017 1.00 0.00 N ATOM 201 CA CYS A 16 1.545 2.716 4.012 1.00 0.00 C ATOM 202 C CYS A 16 2.235 1.788 5.016 1.00 0.00 C ATOM 203 O CYS A 16 2.233 0.583 4.857 1.00 0.00 O ATOM 204 CB CYS A 16 0.504 1.951 3.192 1.00 0.00 C ATOM 205 SG CYS A 16 -0.085 2.987 1.821 1.00 0.00 S ATOM 206 H CYS A 16 2.917 2.587 2.347 1.00 0.00 H ATOM 207 HA CYS A 16 1.081 3.546 4.524 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.953 1.054 2.797 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.327 1.684 3.830 1.00 0.00 H HETATM 210 N NH2 A 17 2.851 2.301 6.041 1.00 0.00 N HETATM 211 HN1 NH2 A 17 2.854 3.272 6.175 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.314 1.718 6.676 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 5 ATOM 1 N GLY A 1 -6.557 5.469 -2.466 1.00 0.00 N ATOM 2 CA GLY A 1 -5.089 5.613 -2.645 1.00 0.00 C ATOM 3 C GLY A 1 -4.410 4.276 -2.343 1.00 0.00 C ATOM 4 O GLY A 1 -5.063 3.255 -2.190 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.032 6.319 -2.819 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.771 5.341 -1.452 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.893 4.643 -2.994 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.882 5.897 -3.662 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.712 6.370 -1.974 1.00 0.00 H ATOM 10 N CYS A 2 -3.103 4.269 -2.254 1.00 0.00 N ATOM 11 CA CYS A 2 -2.373 3.000 -1.959 1.00 0.00 C ATOM 12 C CYS A 2 -2.812 2.445 -0.610 1.00 0.00 C ATOM 13 O CYS A 2 -3.195 1.299 -0.493 1.00 0.00 O ATOM 14 CB CYS A 2 -0.890 3.370 -1.920 1.00 0.00 C ATOM 15 SG CYS A 2 0.116 1.882 -2.159 1.00 0.00 S ATOM 16 H CYS A 2 -2.602 5.104 -2.379 1.00 0.00 H ATOM 17 HA CYS A 2 -2.552 2.282 -2.728 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.678 4.080 -2.700 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.655 3.810 -0.963 1.00 0.00 H ATOM 20 N CYS A 3 -2.753 3.252 0.406 1.00 0.00 N ATOM 21 CA CYS A 3 -3.163 2.781 1.770 1.00 0.00 C ATOM 22 C CYS A 3 -4.620 2.301 1.763 1.00 0.00 C ATOM 23 O CYS A 3 -4.973 1.377 2.469 1.00 0.00 O ATOM 24 CB CYS A 3 -2.984 3.977 2.709 1.00 0.00 C ATOM 25 SG CYS A 3 -1.391 3.839 3.568 1.00 0.00 S ATOM 26 H CYS A 3 -2.431 4.166 0.270 1.00 0.00 H ATOM 27 HA CYS A 3 -2.522 1.976 2.083 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.010 4.896 2.138 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.784 3.984 3.436 1.00 0.00 H ATOM 30 N SER A 4 -5.464 2.896 0.960 1.00 0.00 N ATOM 31 CA SER A 4 -6.888 2.435 0.904 1.00 0.00 C ATOM 32 C SER A 4 -6.947 1.031 0.275 1.00 0.00 C ATOM 33 O SER A 4 -7.864 0.270 0.518 1.00 0.00 O ATOM 34 CB SER A 4 -7.636 3.458 0.024 1.00 0.00 C ATOM 35 OG SER A 4 -6.890 4.681 -0.062 1.00 0.00 O ATOM 36 H SER A 4 -5.164 3.628 0.382 1.00 0.00 H ATOM 37 HA SER A 4 -7.315 2.416 1.894 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.765 3.052 -0.967 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.615 3.649 0.455 1.00 0.00 H ATOM 40 HG SER A 4 -7.076 5.202 0.729 1.00 0.00 H ATOM 41 N ASN A 5 -5.964 0.688 -0.525 1.00 0.00 N ATOM 42 CA ASN A 5 -5.948 -0.658 -1.175 1.00 0.00 C ATOM 43 C ASN A 5 -5.073 -1.623 -0.364 1.00 0.00 C ATOM 44 O ASN A 5 -3.921 -1.337 -0.097 1.00 0.00 O ATOM 45 CB ASN A 5 -5.342 -0.420 -2.564 1.00 0.00 C ATOM 46 CG ASN A 5 -5.463 -1.686 -3.420 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.529 -2.786 -2.907 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.479 -1.578 -4.718 1.00 0.00 N ATOM 49 H ASN A 5 -5.230 1.319 -0.696 1.00 0.00 H ATOM 50 HA ASN A 5 -6.950 -1.041 -1.271 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.868 0.389 -3.050 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.301 -0.158 -2.458 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.412 -0.696 -5.139 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.561 -2.380 -5.275 1.00 0.00 H ATOM 55 N PRO A 6 -5.641 -2.748 -0.007 1.00 0.00 N ATOM 56 CA PRO A 6 -4.884 -3.761 0.777 1.00 0.00 C ATOM 57 C PRO A 6 -3.690 -4.283 -0.035 1.00 0.00 C ATOM 58 O PRO A 6 -2.608 -4.484 0.495 1.00 0.00 O ATOM 59 CB PRO A 6 -5.925 -4.851 1.052 1.00 0.00 C ATOM 60 CG PRO A 6 -6.951 -4.674 -0.020 1.00 0.00 C ATOM 61 CD PRO A 6 -7.010 -3.196 -0.298 1.00 0.00 C ATOM 62 HA PRO A 6 -4.545 -3.335 1.709 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.468 -5.829 0.981 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.372 -4.708 2.022 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.654 -5.214 -0.911 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.913 -5.021 0.324 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.266 -3.016 -1.337 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.711 -2.707 0.360 1.00 0.00 H ATOM 69 N ALA A 7 -3.863 -4.477 -1.317 1.00 0.00 N ATOM 70 CA ALA A 7 -2.725 -4.955 -2.154 1.00 0.00 C ATOM 71 C ALA A 7 -1.661 -3.859 -2.213 1.00 0.00 C ATOM 72 O ALA A 7 -0.489 -4.105 -2.006 1.00 0.00 O ATOM 73 CB ALA A 7 -3.317 -5.208 -3.544 1.00 0.00 C ATOM 74 H ALA A 7 -4.732 -4.287 -1.730 1.00 0.00 H ATOM 75 HA ALA A 7 -2.308 -5.865 -1.749 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.527 -5.195 -4.279 1.00 0.00 H ATOM 77 HB2 ALA A 7 -4.034 -4.435 -3.774 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.807 -6.170 -3.557 1.00 0.00 H ATOM 79 N CYS A 8 -2.066 -2.643 -2.476 1.00 0.00 N ATOM 80 CA CYS A 8 -1.080 -1.526 -2.530 1.00 0.00 C ATOM 81 C CYS A 8 -0.448 -1.322 -1.149 1.00 0.00 C ATOM 82 O CYS A 8 0.735 -1.064 -1.039 1.00 0.00 O ATOM 83 CB CYS A 8 -1.871 -0.286 -2.950 1.00 0.00 C ATOM 84 SG CYS A 8 -0.750 0.919 -3.712 1.00 0.00 S ATOM 85 H CYS A 8 -3.020 -2.468 -2.625 1.00 0.00 H ATOM 86 HA CYS A 8 -0.321 -1.739 -3.260 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.630 -0.571 -3.663 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.341 0.155 -2.083 1.00 0.00 H ATOM 89 N MET A 9 -1.224 -1.441 -0.097 1.00 0.00 N ATOM 90 CA MET A 9 -0.672 -1.261 1.279 1.00 0.00 C ATOM 91 C MET A 9 0.556 -2.157 1.483 1.00 0.00 C ATOM 92 O MET A 9 1.628 -1.689 1.819 1.00 0.00 O ATOM 93 CB MET A 9 -1.806 -1.695 2.210 1.00 0.00 C ATOM 94 CG MET A 9 -2.748 -0.518 2.453 1.00 0.00 C ATOM 95 SD MET A 9 -2.501 0.117 4.131 1.00 0.00 S ATOM 96 CE MET A 9 -3.961 -0.649 4.880 1.00 0.00 C ATOM 97 H MET A 9 -2.176 -1.654 -0.212 1.00 0.00 H ATOM 98 HA MET A 9 -0.421 -0.228 1.458 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.358 -2.507 1.755 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.394 -2.024 3.148 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.539 0.261 1.735 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.770 -0.847 2.334 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.410 0.043 5.584 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.666 -1.555 5.393 1.00 0.00 H ATOM 105 HE3 MET A 9 -4.681 -0.894 4.113 1.00 0.00 H ATOM 106 N VAL A 10 0.404 -3.440 1.273 1.00 0.00 N ATOM 107 CA VAL A 10 1.560 -4.373 1.452 1.00 0.00 C ATOM 108 C VAL A 10 2.629 -4.103 0.384 1.00 0.00 C ATOM 109 O VAL A 10 3.810 -4.268 0.627 1.00 0.00 O ATOM 110 CB VAL A 10 0.978 -5.782 1.289 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.059 -6.826 1.590 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.182 -5.977 2.268 1.00 0.00 C ATOM 113 H VAL A 10 -0.468 -3.787 0.992 1.00 0.00 H ATOM 114 HA VAL A 10 1.979 -4.264 2.440 1.00 0.00 H ATOM 115 HB VAL A 10 0.621 -5.910 0.278 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.592 -7.774 1.815 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.644 -6.504 2.440 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.705 -6.940 0.730 1.00 0.00 H ATOM 119 HG21 VAL A 10 -1.061 -5.481 1.886 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.083 -5.554 3.228 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.384 -7.034 2.381 1.00 0.00 H ATOM 122 N ASN A 11 2.224 -3.694 -0.794 1.00 0.00 N ATOM 123 CA ASN A 11 3.219 -3.416 -1.882 1.00 0.00 C ATOM 124 C ASN A 11 3.970 -2.109 -1.612 1.00 0.00 C ATOM 125 O ASN A 11 5.103 -1.946 -2.028 1.00 0.00 O ATOM 126 CB ASN A 11 2.402 -3.294 -3.171 1.00 0.00 C ATOM 127 CG ASN A 11 2.249 -4.674 -3.810 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.183 -5.454 -3.828 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.113 -5.014 -4.342 1.00 0.00 N ATOM 130 H ASN A 11 1.266 -3.576 -0.966 1.00 0.00 H ATOM 131 HA ASN A 11 3.916 -4.235 -1.969 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.428 -2.888 -2.944 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.915 -2.637 -3.859 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.359 -4.388 -4.340 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.006 -5.905 -4.734 1.00 0.00 H ATOM 136 N ASN A 12 3.355 -1.172 -0.935 1.00 0.00 N ATOM 137 CA ASN A 12 4.037 0.127 -0.654 1.00 0.00 C ATOM 138 C ASN A 12 4.321 0.264 0.847 1.00 0.00 C ATOM 139 O ASN A 12 3.574 0.910 1.562 1.00 0.00 O ATOM 140 CB ASN A 12 3.047 1.204 -1.111 1.00 0.00 C ATOM 141 CG ASN A 12 3.306 1.558 -2.573 1.00 0.00 C ATOM 142 OD1 ASN A 12 3.842 2.606 -2.869 1.00 0.00 O ATOM 143 ND2 ASN A 12 2.937 0.733 -3.510 1.00 0.00 N ATOM 144 H ASN A 12 2.440 -1.318 -0.618 1.00 0.00 H ATOM 145 HA ASN A 12 4.954 0.202 -1.222 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.038 0.836 -1.004 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.173 2.087 -0.503 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.495 -0.110 -3.278 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.102 0.956 -4.447 1.00 0.00 H ATOM 150 N PRO A 13 5.395 -0.343 1.279 1.00 0.00 N ATOM 151 CA PRO A 13 5.788 -0.281 2.711 1.00 0.00 C ATOM 152 C PRO A 13 6.199 1.144 3.102 1.00 0.00 C ATOM 153 O PRO A 13 5.935 1.587 4.203 1.00 0.00 O ATOM 154 CB PRO A 13 6.967 -1.249 2.803 1.00 0.00 C ATOM 155 CG PRO A 13 7.517 -1.310 1.415 1.00 0.00 C ATOM 156 CD PRO A 13 6.340 -1.141 0.491 1.00 0.00 C ATOM 157 HA PRO A 13 4.982 -0.624 3.336 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.712 -0.868 3.489 1.00 0.00 H ATOM 159 HB3 PRO A 13 6.629 -2.228 3.113 1.00 0.00 H ATOM 160 HG2 PRO A 13 8.233 -0.511 1.265 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.984 -2.265 1.236 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.629 -0.615 -0.407 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.905 -2.100 0.251 1.00 0.00 H ATOM 164 N GLN A 14 6.833 1.868 2.211 1.00 0.00 N ATOM 165 CA GLN A 14 7.245 3.269 2.537 1.00 0.00 C ATOM 166 C GLN A 14 6.020 4.195 2.555 1.00 0.00 C ATOM 167 O GLN A 14 6.013 5.214 3.220 1.00 0.00 O ATOM 168 CB GLN A 14 8.257 3.684 1.448 1.00 0.00 C ATOM 169 CG GLN A 14 7.549 3.976 0.120 1.00 0.00 C ATOM 170 CD GLN A 14 7.410 2.686 -0.685 1.00 0.00 C ATOM 171 OE1 GLN A 14 6.401 2.020 -0.608 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.386 2.297 -1.452 1.00 0.00 N ATOM 173 H GLN A 14 7.028 1.492 1.329 1.00 0.00 H ATOM 174 HA GLN A 14 7.721 3.289 3.498 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.784 4.574 1.770 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.967 2.885 1.302 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.573 4.388 0.318 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.133 4.687 -0.447 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.204 2.836 -1.519 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.313 1.457 -1.947 1.00 0.00 H ATOM 181 N ILE A 15 4.985 3.845 1.842 1.00 0.00 N ATOM 182 CA ILE A 15 3.762 4.704 1.831 1.00 0.00 C ATOM 183 C ILE A 15 2.820 4.269 2.961 1.00 0.00 C ATOM 184 O ILE A 15 2.254 5.090 3.660 1.00 0.00 O ATOM 185 CB ILE A 15 3.108 4.474 0.461 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.130 4.703 -0.664 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.938 5.444 0.282 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.618 6.150 -0.637 1.00 0.00 C ATOM 189 H ILE A 15 5.008 3.016 1.322 1.00 0.00 H ATOM 190 HA ILE A 15 4.030 5.743 1.943 1.00 0.00 H ATOM 191 HB ILE A 15 2.738 3.459 0.409 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.970 4.037 -0.533 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.662 4.506 -1.615 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.156 4.967 -0.288 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.279 6.322 -0.244 1.00 0.00 H ATOM 196 HG23 ILE A 15 1.555 5.733 1.249 1.00 0.00 H ATOM 197 HD11 ILE A 15 5.101 6.347 0.308 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.776 6.816 -0.760 1.00 0.00 H ATOM 199 HD13 ILE A 15 5.325 6.308 -1.440 1.00 0.00 H ATOM 200 N CYS A 16 2.650 2.988 3.152 1.00 0.00 N ATOM 201 CA CYS A 16 1.748 2.510 4.240 1.00 0.00 C ATOM 202 C CYS A 16 2.545 1.691 5.259 1.00 0.00 C ATOM 203 O CYS A 16 2.553 1.997 6.435 1.00 0.00 O ATOM 204 CB CYS A 16 0.697 1.640 3.543 1.00 0.00 C ATOM 205 SG CYS A 16 -0.257 2.655 2.380 1.00 0.00 S ATOM 206 H CYS A 16 3.119 2.339 2.580 1.00 0.00 H ATOM 207 HA CYS A 16 1.271 3.347 4.724 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.187 0.841 3.008 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.032 1.221 4.285 1.00 0.00 H HETATM 210 N NH2 A 17 3.218 0.651 4.857 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.217 0.398 3.908 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.726 0.119 5.501 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 6 ATOM 1 N GLY A 1 -6.360 5.975 -2.009 1.00 0.00 N ATOM 2 CA GLY A 1 -4.975 5.953 -2.540 1.00 0.00 C ATOM 3 C GLY A 1 -4.416 4.540 -2.416 1.00 0.00 C ATOM 4 O GLY A 1 -5.158 3.579 -2.287 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.373 5.548 -1.059 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.980 5.429 -2.642 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.695 6.952 -1.950 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.984 6.248 -3.579 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.357 6.633 -1.975 1.00 0.00 H ATOM 10 N CYS A 2 -3.115 4.402 -2.453 1.00 0.00 N ATOM 11 CA CYS A 2 -2.503 3.045 -2.341 1.00 0.00 C ATOM 12 C CYS A 2 -2.879 2.406 -1.010 1.00 0.00 C ATOM 13 O CYS A 2 -3.482 1.355 -0.964 1.00 0.00 O ATOM 14 CB CYS A 2 -0.993 3.268 -2.411 1.00 0.00 C ATOM 15 SG CYS A 2 -0.149 1.672 -2.550 1.00 0.00 S ATOM 16 H CYS A 2 -2.543 5.188 -2.557 1.00 0.00 H ATOM 17 HA CYS A 2 -2.819 2.424 -3.152 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.761 3.875 -3.266 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.662 3.772 -1.516 1.00 0.00 H ATOM 20 N CYS A 3 -2.518 3.040 0.063 1.00 0.00 N ATOM 21 CA CYS A 3 -2.830 2.493 1.426 1.00 0.00 C ATOM 22 C CYS A 3 -4.305 2.086 1.540 1.00 0.00 C ATOM 23 O CYS A 3 -4.636 1.150 2.244 1.00 0.00 O ATOM 24 CB CYS A 3 -2.501 3.622 2.411 1.00 0.00 C ATOM 25 SG CYS A 3 -0.759 4.106 2.242 1.00 0.00 S ATOM 26 H CYS A 3 -2.030 3.885 -0.030 1.00 0.00 H ATOM 27 HA CYS A 3 -2.202 1.644 1.631 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.132 4.475 2.205 1.00 0.00 H ATOM 29 HB3 CYS A 3 -2.683 3.281 3.419 1.00 0.00 H ATOM 30 N SER A 4 -5.194 2.757 0.852 1.00 0.00 N ATOM 31 CA SER A 4 -6.636 2.367 0.927 1.00 0.00 C ATOM 32 C SER A 4 -6.809 0.920 0.432 1.00 0.00 C ATOM 33 O SER A 4 -7.701 0.210 0.868 1.00 0.00 O ATOM 34 CB SER A 4 -7.374 3.354 0.015 1.00 0.00 C ATOM 35 OG SER A 4 -6.797 4.661 0.148 1.00 0.00 O ATOM 36 H SER A 4 -4.917 3.502 0.278 1.00 0.00 H ATOM 37 HA SER A 4 -6.998 2.461 1.941 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.287 3.027 -1.009 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.423 3.376 0.291 1.00 0.00 H ATOM 40 HG SER A 4 -6.564 4.792 1.079 1.00 0.00 H ATOM 41 N ASN A 5 -5.953 0.478 -0.456 1.00 0.00 N ATOM 42 CA ASN A 5 -6.037 -0.922 -0.975 1.00 0.00 C ATOM 43 C ASN A 5 -5.051 -1.810 -0.203 1.00 0.00 C ATOM 44 O ASN A 5 -3.893 -1.459 -0.071 1.00 0.00 O ATOM 45 CB ASN A 5 -5.623 -0.816 -2.454 1.00 0.00 C ATOM 46 CG ASN A 5 -5.690 -2.188 -3.138 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.681 -3.212 -2.486 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.747 -2.251 -4.435 1.00 0.00 N ATOM 49 H ASN A 5 -5.234 1.067 -0.774 1.00 0.00 H ATOM 50 HA ASN A 5 -7.041 -1.301 -0.894 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.290 -0.132 -2.959 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.611 -0.440 -2.519 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.744 -1.431 -4.969 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.794 -3.121 -4.878 1.00 0.00 H ATOM 55 N PRO A 6 -5.527 -2.942 0.269 1.00 0.00 N ATOM 56 CA PRO A 6 -4.649 -3.883 1.023 1.00 0.00 C ATOM 57 C PRO A 6 -3.527 -4.403 0.121 1.00 0.00 C ATOM 58 O PRO A 6 -2.382 -4.479 0.526 1.00 0.00 O ATOM 59 CB PRO A 6 -5.604 -4.998 1.454 1.00 0.00 C ATOM 60 CG PRO A 6 -6.744 -4.922 0.488 1.00 0.00 C ATOM 61 CD PRO A 6 -6.897 -3.465 0.144 1.00 0.00 C ATOM 62 HA PRO A 6 -4.233 -3.397 1.891 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.112 -5.961 1.388 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.956 -4.822 2.458 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.529 -5.501 -0.401 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.648 -5.276 0.954 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.264 -3.351 -0.866 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.549 -2.973 0.849 1.00 0.00 H ATOM 69 N ALA A 7 -3.842 -4.722 -1.106 1.00 0.00 N ATOM 70 CA ALA A 7 -2.789 -5.200 -2.048 1.00 0.00 C ATOM 71 C ALA A 7 -1.775 -4.075 -2.264 1.00 0.00 C ATOM 72 O ALA A 7 -0.581 -4.295 -2.298 1.00 0.00 O ATOM 73 CB ALA A 7 -3.522 -5.528 -3.351 1.00 0.00 C ATOM 74 H ALA A 7 -4.771 -4.624 -1.415 1.00 0.00 H ATOM 75 HA ALA A 7 -2.300 -6.082 -1.658 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.361 -6.176 -3.141 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.845 -6.024 -4.029 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.880 -4.615 -3.802 1.00 0.00 H ATOM 79 N CYS A 8 -2.244 -2.861 -2.382 1.00 0.00 N ATOM 80 CA CYS A 8 -1.305 -1.717 -2.566 1.00 0.00 C ATOM 81 C CYS A 8 -0.594 -1.431 -1.238 1.00 0.00 C ATOM 82 O CYS A 8 0.579 -1.113 -1.210 1.00 0.00 O ATOM 83 CB CYS A 8 -2.177 -0.530 -2.989 1.00 0.00 C ATOM 84 SG CYS A 8 -1.191 0.649 -3.947 1.00 0.00 S ATOM 85 H CYS A 8 -3.210 -2.703 -2.330 1.00 0.00 H ATOM 86 HA CYS A 8 -0.589 -1.942 -3.336 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.998 -0.882 -3.595 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.561 -0.044 -2.110 1.00 0.00 H ATOM 89 N MET A 9 -1.298 -1.558 -0.135 1.00 0.00 N ATOM 90 CA MET A 9 -0.677 -1.309 1.206 1.00 0.00 C ATOM 91 C MET A 9 0.601 -2.138 1.354 1.00 0.00 C ATOM 92 O MET A 9 1.667 -1.601 1.579 1.00 0.00 O ATOM 93 CB MET A 9 -1.729 -1.763 2.231 1.00 0.00 C ATOM 94 CG MET A 9 -2.028 -0.625 3.209 1.00 0.00 C ATOM 95 SD MET A 9 -1.780 -1.215 4.903 1.00 0.00 S ATOM 96 CE MET A 9 0.025 -1.060 4.948 1.00 0.00 C ATOM 97 H MET A 9 -2.241 -1.825 -0.193 1.00 0.00 H ATOM 98 HA MET A 9 -0.464 -0.265 1.333 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.635 -2.044 1.717 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.350 -2.613 2.779 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.368 0.206 3.010 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.053 -0.306 3.085 1.00 0.00 H ATOM 103 HE1 MET A 9 0.294 -0.080 5.312 1.00 0.00 H ATOM 104 HE2 MET A 9 0.425 -1.198 3.953 1.00 0.00 H ATOM 105 HE3 MET A 9 0.438 -1.809 5.607 1.00 0.00 H ATOM 106 N VAL A 10 0.498 -3.435 1.221 1.00 0.00 N ATOM 107 CA VAL A 10 1.710 -4.305 1.349 1.00 0.00 C ATOM 108 C VAL A 10 2.708 -3.998 0.219 1.00 0.00 C ATOM 109 O VAL A 10 3.906 -4.155 0.381 1.00 0.00 O ATOM 110 CB VAL A 10 1.190 -5.755 1.258 1.00 0.00 C ATOM 111 CG1 VAL A 10 0.513 -6.007 -0.094 1.00 0.00 C ATOM 112 CG2 VAL A 10 2.360 -6.731 1.423 1.00 0.00 C ATOM 113 H VAL A 10 -0.379 -3.837 1.038 1.00 0.00 H ATOM 114 HA VAL A 10 2.175 -4.147 2.308 1.00 0.00 H ATOM 115 HB VAL A 10 0.470 -5.925 2.047 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.266 -6.102 -0.862 1.00 0.00 H ATOM 117 HG12 VAL A 10 -0.142 -5.184 -0.332 1.00 0.00 H ATOM 118 HG13 VAL A 10 -0.065 -6.919 -0.042 1.00 0.00 H ATOM 119 HG21 VAL A 10 2.106 -7.680 0.971 1.00 0.00 H ATOM 120 HG22 VAL A 10 2.558 -6.876 2.475 1.00 0.00 H ATOM 121 HG23 VAL A 10 3.239 -6.328 0.943 1.00 0.00 H ATOM 122 N ASN A 11 2.230 -3.559 -0.919 1.00 0.00 N ATOM 123 CA ASN A 11 3.159 -3.242 -2.051 1.00 0.00 C ATOM 124 C ASN A 11 3.851 -1.894 -1.809 1.00 0.00 C ATOM 125 O ASN A 11 4.926 -1.644 -2.323 1.00 0.00 O ATOM 126 CB ASN A 11 2.284 -3.175 -3.309 1.00 0.00 C ATOM 127 CG ASN A 11 2.344 -4.514 -4.050 1.00 0.00 C ATOM 128 OD1 ASN A 11 1.321 -5.096 -4.348 1.00 0.00 O ATOM 129 ND2 ASN A 11 3.498 -5.029 -4.374 1.00 0.00 N ATOM 130 H ASN A 11 1.263 -3.439 -1.031 1.00 0.00 H ATOM 131 HA ASN A 11 3.893 -4.022 -2.157 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.262 -2.966 -3.029 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.646 -2.394 -3.957 1.00 0.00 H ATOM 134 HD21 ASN A 11 4.329 -4.559 -4.147 1.00 0.00 H ATOM 135 HD22 ASN A 11 3.536 -5.892 -4.837 1.00 0.00 H ATOM 136 N ASN A 12 3.252 -1.023 -1.037 1.00 0.00 N ATOM 137 CA ASN A 12 3.882 0.300 -0.766 1.00 0.00 C ATOM 138 C ASN A 12 4.024 0.516 0.746 1.00 0.00 C ATOM 139 O ASN A 12 3.442 1.434 1.301 1.00 0.00 O ATOM 140 CB ASN A 12 2.923 1.324 -1.372 1.00 0.00 C ATOM 141 CG ASN A 12 3.324 1.601 -2.824 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.167 2.439 -3.083 1.00 0.00 O ATOM 143 ND2 ASN A 12 2.754 0.933 -3.791 1.00 0.00 N ATOM 144 H ASN A 12 2.388 -1.238 -0.632 1.00 0.00 H ATOM 145 HA ASN A 12 4.843 0.363 -1.250 1.00 0.00 H ATOM 146 HB2 ASN A 12 1.918 0.935 -1.341 1.00 0.00 H ATOM 147 HB3 ASN A 12 2.976 2.238 -0.805 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.076 0.254 -3.588 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.001 1.110 -4.722 1.00 0.00 H ATOM 150 N PRO A 13 4.803 -0.332 1.371 1.00 0.00 N ATOM 151 CA PRO A 13 5.024 -0.231 2.839 1.00 0.00 C ATOM 152 C PRO A 13 5.782 1.057 3.192 1.00 0.00 C ATOM 153 O PRO A 13 5.625 1.598 4.267 1.00 0.00 O ATOM 154 CB PRO A 13 5.864 -1.463 3.160 1.00 0.00 C ATOM 155 CG PRO A 13 6.527 -1.818 1.870 1.00 0.00 C ATOM 156 CD PRO A 13 5.553 -1.454 0.787 1.00 0.00 C ATOM 157 HA PRO A 13 4.085 -0.278 3.369 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.605 -1.221 3.911 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.235 -2.274 3.495 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.445 -1.254 1.753 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.734 -2.877 1.837 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.077 -1.146 -0.109 1.00 0.00 H ATOM 163 HD3 PRO A 13 4.892 -2.277 0.579 1.00 0.00 H ATOM 164 N GLN A 14 6.602 1.553 2.298 1.00 0.00 N ATOM 165 CA GLN A 14 7.364 2.814 2.598 1.00 0.00 C ATOM 166 C GLN A 14 6.387 3.952 2.884 1.00 0.00 C ATOM 167 O GLN A 14 6.613 4.785 3.741 1.00 0.00 O ATOM 168 CB GLN A 14 8.183 3.152 1.338 1.00 0.00 C ATOM 169 CG GLN A 14 8.825 1.892 0.745 1.00 0.00 C ATOM 170 CD GLN A 14 8.068 1.499 -0.525 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.240 0.614 -0.493 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.300 2.126 -1.642 1.00 0.00 N ATOM 173 H GLN A 14 6.712 1.099 1.439 1.00 0.00 H ATOM 174 HA GLN A 14 8.014 2.665 3.436 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.533 3.601 0.603 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.960 3.858 1.600 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.862 2.089 0.509 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.768 1.085 1.458 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.955 2.855 -1.673 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.816 1.868 -2.457 1.00 0.00 H ATOM 181 N ILE A 15 5.312 3.987 2.161 1.00 0.00 N ATOM 182 CA ILE A 15 4.297 5.066 2.356 1.00 0.00 C ATOM 183 C ILE A 15 3.136 4.564 3.225 1.00 0.00 C ATOM 184 O ILE A 15 2.616 5.292 4.049 1.00 0.00 O ATOM 185 CB ILE A 15 3.789 5.410 0.947 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.973 5.702 0.020 1.00 0.00 C ATOM 187 CG2 ILE A 15 2.889 6.650 1.005 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.674 5.144 -1.364 1.00 0.00 C ATOM 189 H ILE A 15 5.172 3.303 1.479 1.00 0.00 H ATOM 190 HA ILE A 15 4.757 5.934 2.803 1.00 0.00 H ATOM 191 HB ILE A 15 3.222 4.576 0.558 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.122 6.769 -0.052 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.868 5.239 0.407 1.00 0.00 H ATOM 194 HG21 ILE A 15 2.311 6.718 0.096 1.00 0.00 H ATOM 195 HG22 ILE A 15 3.501 7.537 1.108 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.221 6.573 1.850 1.00 0.00 H ATOM 197 HD11 ILE A 15 5.238 4.237 -1.516 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.952 5.872 -2.110 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.619 4.932 -1.446 1.00 0.00 H ATOM 200 N CYS A 16 2.714 3.337 3.047 1.00 0.00 N ATOM 201 CA CYS A 16 1.569 2.816 3.860 1.00 0.00 C ATOM 202 C CYS A 16 2.050 2.250 5.201 1.00 0.00 C ATOM 203 O CYS A 16 1.250 1.956 6.070 1.00 0.00 O ATOM 204 CB CYS A 16 0.949 1.717 3.003 1.00 0.00 C ATOM 205 SG CYS A 16 0.175 2.454 1.541 1.00 0.00 S ATOM 206 H CYS A 16 3.136 2.762 2.367 1.00 0.00 H ATOM 207 HA CYS A 16 0.845 3.597 4.026 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.718 1.028 2.692 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.205 1.189 3.581 1.00 0.00 H HETATM 210 N NH2 A 17 3.321 2.079 5.414 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.974 2.313 4.720 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.630 1.720 6.271 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 7 ATOM 1 N GLY A 1 -7.392 4.987 -1.950 1.00 0.00 N ATOM 2 CA GLY A 1 -6.064 5.405 -2.473 1.00 0.00 C ATOM 3 C GLY A 1 -5.084 4.239 -2.335 1.00 0.00 C ATOM 4 O GLY A 1 -5.462 3.146 -1.949 1.00 0.00 O ATOM 5 H1 GLY A 1 -8.136 5.566 -2.380 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.408 5.106 -0.913 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.556 3.989 -2.185 1.00 0.00 H ATOM 8 HA2 GLY A 1 -6.154 5.682 -3.513 1.00 0.00 H ATOM 9 HA3 GLY A 1 -5.702 6.248 -1.906 1.00 0.00 H ATOM 10 N CYS A 2 -3.827 4.449 -2.644 1.00 0.00 N ATOM 11 CA CYS A 2 -2.838 3.333 -2.528 1.00 0.00 C ATOM 12 C CYS A 2 -2.805 2.789 -1.102 1.00 0.00 C ATOM 13 O CYS A 2 -2.872 1.596 -0.885 1.00 0.00 O ATOM 14 CB CYS A 2 -1.481 3.923 -2.913 1.00 0.00 C ATOM 15 SG CYS A 2 -0.537 2.679 -3.832 1.00 0.00 S ATOM 16 H CYS A 2 -3.535 5.332 -2.955 1.00 0.00 H ATOM 17 HA CYS A 2 -3.097 2.550 -3.206 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.626 4.796 -3.527 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.937 4.196 -2.017 1.00 0.00 H ATOM 20 N CYS A 3 -2.722 3.647 -0.132 1.00 0.00 N ATOM 21 CA CYS A 3 -2.700 3.169 1.281 1.00 0.00 C ATOM 22 C CYS A 3 -4.026 2.479 1.605 1.00 0.00 C ATOM 23 O CYS A 3 -4.060 1.495 2.314 1.00 0.00 O ATOM 24 CB CYS A 3 -2.498 4.417 2.147 1.00 0.00 C ATOM 25 SG CYS A 3 -1.231 4.084 3.403 1.00 0.00 S ATOM 26 H CYS A 3 -2.685 4.600 -0.333 1.00 0.00 H ATOM 27 HA CYS A 3 -1.885 2.484 1.423 1.00 0.00 H ATOM 28 HB2 CYS A 3 -2.181 5.241 1.522 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.427 4.671 2.637 1.00 0.00 H ATOM 30 N SER A 4 -5.115 2.971 1.072 1.00 0.00 N ATOM 31 CA SER A 4 -6.434 2.317 1.335 1.00 0.00 C ATOM 32 C SER A 4 -6.515 0.984 0.565 1.00 0.00 C ATOM 33 O SER A 4 -7.312 0.122 0.880 1.00 0.00 O ATOM 34 CB SER A 4 -7.499 3.308 0.834 1.00 0.00 C ATOM 35 OG SER A 4 -6.893 4.560 0.501 1.00 0.00 O ATOM 36 H SER A 4 -5.065 3.758 0.490 1.00 0.00 H ATOM 37 HA SER A 4 -6.556 2.147 2.392 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.986 2.906 -0.038 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.238 3.457 1.615 1.00 0.00 H ATOM 40 HG SER A 4 -6.727 5.038 1.324 1.00 0.00 H ATOM 41 N ASN A 5 -5.681 0.812 -0.435 1.00 0.00 N ATOM 42 CA ASN A 5 -5.684 -0.457 -1.224 1.00 0.00 C ATOM 43 C ASN A 5 -4.909 -1.531 -0.458 1.00 0.00 C ATOM 44 O ASN A 5 -3.764 -1.322 -0.112 1.00 0.00 O ATOM 45 CB ASN A 5 -4.952 -0.117 -2.534 1.00 0.00 C ATOM 46 CG ASN A 5 -5.073 -1.275 -3.531 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.331 -2.402 -3.156 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.881 -1.048 -4.797 1.00 0.00 N ATOM 49 H ASN A 5 -5.041 1.517 -0.664 1.00 0.00 H ATOM 50 HA ASN A 5 -6.692 -0.777 -1.428 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.385 0.773 -2.969 1.00 0.00 H ATOM 52 HB3 ASN A 5 -3.906 0.057 -2.322 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.660 -0.142 -5.108 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.956 -1.778 -5.444 1.00 0.00 H ATOM 55 N PRO A 6 -5.539 -2.654 -0.233 1.00 0.00 N ATOM 56 CA PRO A 6 -4.862 -3.766 0.484 1.00 0.00 C ATOM 57 C PRO A 6 -3.650 -4.248 -0.314 1.00 0.00 C ATOM 58 O PRO A 6 -2.622 -4.579 0.244 1.00 0.00 O ATOM 59 CB PRO A 6 -5.946 -4.837 0.593 1.00 0.00 C ATOM 60 CG PRO A 6 -6.901 -4.517 -0.509 1.00 0.00 C ATOM 61 CD PRO A 6 -6.906 -3.017 -0.631 1.00 0.00 C ATOM 62 HA PRO A 6 -4.565 -3.448 1.470 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.512 -5.817 0.444 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.443 -4.780 1.550 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.570 -4.972 -1.434 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.893 -4.867 -0.260 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.111 -2.720 -1.652 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.625 -2.578 0.046 1.00 0.00 H ATOM 69 N ALA A 7 -3.756 -4.264 -1.620 1.00 0.00 N ATOM 70 CA ALA A 7 -2.601 -4.697 -2.458 1.00 0.00 C ATOM 71 C ALA A 7 -1.461 -3.687 -2.300 1.00 0.00 C ATOM 72 O ALA A 7 -0.338 -4.047 -2.012 1.00 0.00 O ATOM 73 CB ALA A 7 -3.115 -4.697 -3.898 1.00 0.00 C ATOM 74 H ALA A 7 -4.591 -3.973 -2.047 1.00 0.00 H ATOM 75 HA ALA A 7 -2.278 -5.686 -2.175 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.285 -4.834 -4.576 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.597 -3.753 -4.109 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.825 -5.500 -4.030 1.00 0.00 H ATOM 79 N CYS A 8 -1.746 -2.422 -2.472 1.00 0.00 N ATOM 80 CA CYS A 8 -0.677 -1.396 -2.315 1.00 0.00 C ATOM 81 C CYS A 8 -0.210 -1.345 -0.852 1.00 0.00 C ATOM 82 O CYS A 8 0.958 -1.170 -0.581 1.00 0.00 O ATOM 83 CB CYS A 8 -1.303 -0.062 -2.728 1.00 0.00 C ATOM 84 SG CYS A 8 -0.095 1.266 -2.454 1.00 0.00 S ATOM 85 H CYS A 8 -2.660 -2.151 -2.694 1.00 0.00 H ATOM 86 HA CYS A 8 0.148 -1.625 -2.963 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.574 -0.098 -3.775 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.182 0.117 -2.135 1.00 0.00 H ATOM 89 N MET A 9 -1.117 -1.495 0.089 1.00 0.00 N ATOM 90 CA MET A 9 -0.736 -1.457 1.538 1.00 0.00 C ATOM 91 C MET A 9 0.484 -2.348 1.795 1.00 0.00 C ATOM 92 O MET A 9 1.459 -1.924 2.384 1.00 0.00 O ATOM 93 CB MET A 9 -1.956 -2.010 2.288 1.00 0.00 C ATOM 94 CG MET A 9 -2.636 -0.893 3.079 1.00 0.00 C ATOM 95 SD MET A 9 -2.237 -1.092 4.833 1.00 0.00 S ATOM 96 CE MET A 9 -3.297 0.235 5.446 1.00 0.00 C ATOM 97 H MET A 9 -2.058 -1.629 -0.161 1.00 0.00 H ATOM 98 HA MET A 9 -0.537 -0.447 1.851 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.657 -2.427 1.578 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.633 -2.785 2.969 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.282 0.068 2.733 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.708 -0.954 2.942 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.256 0.188 4.953 1.00 0.00 H ATOM 104 HE2 MET A 9 -2.829 1.186 5.245 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.438 0.124 6.507 1.00 0.00 H ATOM 106 N VAL A 10 0.430 -3.576 1.360 1.00 0.00 N ATOM 107 CA VAL A 10 1.581 -4.503 1.579 1.00 0.00 C ATOM 108 C VAL A 10 2.663 -4.275 0.513 1.00 0.00 C ATOM 109 O VAL A 10 3.844 -4.369 0.790 1.00 0.00 O ATOM 110 CB VAL A 10 0.990 -5.916 1.462 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.029 -6.951 1.897 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.232 -6.036 2.368 1.00 0.00 C ATOM 113 H VAL A 10 -0.372 -3.892 0.893 1.00 0.00 H ATOM 114 HA VAL A 10 1.990 -4.359 2.566 1.00 0.00 H ATOM 115 HB VAL A 10 0.705 -6.105 0.436 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.955 -6.774 1.375 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.666 -7.943 1.668 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.196 -6.865 2.960 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.432 -7.080 2.563 1.00 0.00 H ATOM 120 HG22 VAL A 10 -1.086 -5.593 1.880 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.042 -5.527 3.300 1.00 0.00 H ATOM 122 N ASN A 11 2.276 -3.991 -0.708 1.00 0.00 N ATOM 123 CA ASN A 11 3.293 -3.771 -1.788 1.00 0.00 C ATOM 124 C ASN A 11 4.042 -2.448 -1.578 1.00 0.00 C ATOM 125 O ASN A 11 5.185 -2.316 -1.967 1.00 0.00 O ATOM 126 CB ASN A 11 2.511 -3.728 -3.104 1.00 0.00 C ATOM 127 CG ASN A 11 2.315 -5.151 -3.622 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.195 -5.699 -4.256 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.203 -5.785 -3.373 1.00 0.00 N ATOM 130 H ASN A 11 1.318 -3.929 -0.916 1.00 0.00 H ATOM 131 HA ASN A 11 3.993 -4.593 -1.810 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.550 -3.260 -2.945 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.069 -3.158 -3.835 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.491 -5.348 -2.853 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.073 -6.694 -3.709 1.00 0.00 H ATOM 136 N ASN A 12 3.409 -1.469 -0.988 1.00 0.00 N ATOM 137 CA ASN A 12 4.094 -0.159 -0.777 1.00 0.00 C ATOM 138 C ASN A 12 4.136 0.203 0.712 1.00 0.00 C ATOM 139 O ASN A 12 3.467 1.125 1.147 1.00 0.00 O ATOM 140 CB ASN A 12 3.259 0.858 -1.561 1.00 0.00 C ATOM 141 CG ASN A 12 3.902 1.094 -2.925 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.618 2.061 -3.115 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.685 0.243 -3.887 1.00 0.00 N ATOM 144 H ASN A 12 2.478 -1.586 -0.692 1.00 0.00 H ATOM 145 HA ASN A 12 5.092 -0.192 -1.179 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.258 0.474 -1.694 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.221 1.789 -1.018 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.112 -0.536 -3.730 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.094 0.381 -4.767 1.00 0.00 H ATOM 150 N PRO A 13 4.954 -0.510 1.448 1.00 0.00 N ATOM 151 CA PRO A 13 5.107 -0.238 2.901 1.00 0.00 C ATOM 152 C PRO A 13 5.743 1.143 3.096 1.00 0.00 C ATOM 153 O PRO A 13 5.503 1.813 4.081 1.00 0.00 O ATOM 154 CB PRO A 13 6.035 -1.354 3.380 1.00 0.00 C ATOM 155 CG PRO A 13 6.771 -1.792 2.156 1.00 0.00 C ATOM 156 CD PRO A 13 5.804 -1.632 1.015 1.00 0.00 C ATOM 157 HA PRO A 13 4.158 -0.293 3.404 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.720 -0.977 4.125 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.462 -2.177 3.776 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.642 -1.171 2.002 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.063 -2.831 2.247 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.329 -1.391 0.100 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.215 -2.525 0.894 1.00 0.00 H ATOM 164 N GLN A 14 6.540 1.576 2.151 1.00 0.00 N ATOM 165 CA GLN A 14 7.182 2.928 2.261 1.00 0.00 C ATOM 166 C GLN A 14 6.106 3.982 2.505 1.00 0.00 C ATOM 167 O GLN A 14 6.272 4.893 3.293 1.00 0.00 O ATOM 168 CB GLN A 14 7.862 3.187 0.905 1.00 0.00 C ATOM 169 CG GLN A 14 8.764 2.008 0.524 1.00 0.00 C ATOM 170 CD GLN A 14 8.189 1.302 -0.705 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.744 0.174 -0.615 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.178 1.915 -1.854 1.00 0.00 N ATOM 173 H GLN A 14 6.706 1.019 1.364 1.00 0.00 H ATOM 174 HA GLN A 14 7.908 2.941 3.049 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.106 3.323 0.142 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.461 4.084 0.975 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.756 2.371 0.302 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.811 1.313 1.347 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.531 2.827 -1.927 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.820 1.464 -2.647 1.00 0.00 H ATOM 181 N ILE A 15 4.999 3.844 1.832 1.00 0.00 N ATOM 182 CA ILE A 15 3.878 4.815 1.998 1.00 0.00 C ATOM 183 C ILE A 15 3.039 4.439 3.224 1.00 0.00 C ATOM 184 O ILE A 15 2.700 5.282 4.036 1.00 0.00 O ATOM 185 CB ILE A 15 3.041 4.696 0.709 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.908 5.045 -0.510 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.856 5.655 0.773 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.497 6.453 -0.347 1.00 0.00 C ATOM 189 H ILE A 15 4.906 3.088 1.222 1.00 0.00 H ATOM 190 HA ILE A 15 4.260 5.823 2.099 1.00 0.00 H ATOM 191 HB ILE A 15 2.671 3.687 0.614 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.708 4.326 -0.592 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.302 5.011 -1.406 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.008 5.151 1.208 1.00 0.00 H ATOM 195 HG22 ILE A 15 1.605 5.990 -0.225 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.117 6.506 1.381 1.00 0.00 H ATOM 197 HD11 ILE A 15 5.551 6.380 -0.119 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.990 6.970 0.457 1.00 0.00 H ATOM 199 HD13 ILE A 15 4.366 7.009 -1.264 1.00 0.00 H ATOM 200 N CYS A 16 2.704 3.183 3.363 1.00 0.00 N ATOM 201 CA CYS A 16 1.885 2.749 4.535 1.00 0.00 C ATOM 202 C CYS A 16 2.756 1.945 5.500 1.00 0.00 C ATOM 203 O CYS A 16 2.875 0.743 5.376 1.00 0.00 O ATOM 204 CB CYS A 16 0.772 1.874 3.949 1.00 0.00 C ATOM 205 SG CYS A 16 0.003 2.730 2.546 1.00 0.00 S ATOM 206 H CYS A 16 2.992 2.520 2.695 1.00 0.00 H ATOM 207 HA CYS A 16 1.457 3.603 5.034 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.193 0.932 3.616 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.026 1.684 4.706 1.00 0.00 H HETATM 210 N NH2 A 17 3.384 2.559 6.460 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.292 3.529 6.568 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.950 2.049 7.077 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 8 ATOM 1 N GLY A 1 -6.276 5.746 -2.427 1.00 0.00 N ATOM 2 CA GLY A 1 -4.803 5.738 -2.645 1.00 0.00 C ATOM 3 C GLY A 1 -4.250 4.347 -2.334 1.00 0.00 C ATOM 4 O GLY A 1 -4.993 3.425 -2.040 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.733 5.129 -3.125 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.634 6.715 -2.530 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.487 5.397 -1.468 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.592 5.988 -3.675 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.335 6.462 -1.995 1.00 0.00 H ATOM 10 N CYS A 2 -2.954 4.178 -2.394 1.00 0.00 N ATOM 11 CA CYS A 2 -2.361 2.836 -2.102 1.00 0.00 C ATOM 12 C CYS A 2 -2.799 2.350 -0.725 1.00 0.00 C ATOM 13 O CYS A 2 -3.237 1.231 -0.560 1.00 0.00 O ATOM 14 CB CYS A 2 -0.848 3.041 -2.144 1.00 0.00 C ATOM 15 SG CYS A 2 -0.034 1.479 -2.573 1.00 0.00 S ATOM 16 H CYS A 2 -2.371 4.931 -2.632 1.00 0.00 H ATOM 17 HA CYS A 2 -2.656 2.134 -2.850 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.609 3.787 -2.882 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.501 3.371 -1.176 1.00 0.00 H ATOM 20 N CYS A 3 -2.679 3.191 0.255 1.00 0.00 N ATOM 21 CA CYS A 3 -3.079 2.801 1.643 1.00 0.00 C ATOM 22 C CYS A 3 -4.554 2.371 1.683 1.00 0.00 C ATOM 23 O CYS A 3 -4.954 1.597 2.527 1.00 0.00 O ATOM 24 CB CYS A 3 -2.856 4.050 2.497 1.00 0.00 C ATOM 25 SG CYS A 3 -1.077 4.334 2.737 1.00 0.00 S ATOM 26 H CYS A 3 -2.320 4.082 0.075 1.00 0.00 H ATOM 27 HA CYS A 3 -2.452 2.003 1.996 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.295 4.908 2.001 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.325 3.912 3.461 1.00 0.00 H ATOM 30 N SER A 4 -5.362 2.858 0.774 1.00 0.00 N ATOM 31 CA SER A 4 -6.803 2.466 0.763 1.00 0.00 C ATOM 32 C SER A 4 -6.964 1.012 0.292 1.00 0.00 C ATOM 33 O SER A 4 -7.980 0.385 0.539 1.00 0.00 O ATOM 34 CB SER A 4 -7.476 3.419 -0.235 1.00 0.00 C ATOM 35 OG SER A 4 -6.849 4.703 -0.188 1.00 0.00 O ATOM 36 H SER A 4 -5.023 3.480 0.096 1.00 0.00 H ATOM 37 HA SER A 4 -7.238 2.593 1.742 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.383 3.016 -1.230 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.526 3.509 0.010 1.00 0.00 H ATOM 40 HG SER A 4 -7.116 5.134 0.637 1.00 0.00 H ATOM 41 N ASN A 5 -5.981 0.470 -0.385 1.00 0.00 N ATOM 42 CA ASN A 5 -6.086 -0.940 -0.871 1.00 0.00 C ATOM 43 C ASN A 5 -5.067 -1.822 -0.141 1.00 0.00 C ATOM 44 O ASN A 5 -3.895 -1.505 -0.108 1.00 0.00 O ATOM 45 CB ASN A 5 -5.749 -0.866 -2.366 1.00 0.00 C ATOM 46 CG ASN A 5 -5.963 -2.235 -3.023 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.993 -3.253 -2.361 1.00 0.00 O ATOM 48 ND2 ASN A 5 -6.103 -2.308 -4.315 1.00 0.00 N ATOM 49 H ASN A 5 -5.169 0.985 -0.576 1.00 0.00 H ATOM 50 HA ASN A 5 -7.087 -1.315 -0.735 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.389 -0.140 -2.842 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.717 -0.570 -2.490 1.00 0.00 H ATOM 53 HD21 ASN A 5 -6.071 -1.494 -4.859 1.00 0.00 H ATOM 54 HD22 ASN A 5 -6.244 -3.176 -4.746 1.00 0.00 H ATOM 55 N PRO A 6 -5.535 -2.914 0.410 1.00 0.00 N ATOM 56 CA PRO A 6 -4.622 -3.848 1.125 1.00 0.00 C ATOM 57 C PRO A 6 -3.591 -4.430 0.150 1.00 0.00 C ATOM 58 O PRO A 6 -2.448 -4.649 0.503 1.00 0.00 O ATOM 59 CB PRO A 6 -5.568 -4.919 1.675 1.00 0.00 C ATOM 60 CG PRO A 6 -6.768 -4.851 0.785 1.00 0.00 C ATOM 61 CD PRO A 6 -6.919 -3.402 0.405 1.00 0.00 C ATOM 62 HA PRO A 6 -4.125 -3.334 1.938 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.103 -5.896 1.610 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.845 -4.700 2.696 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.611 -5.455 -0.100 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.648 -5.182 1.313 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.357 -3.312 -0.578 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.504 -2.867 1.140 1.00 0.00 H ATOM 69 N ALA A 7 -3.975 -4.654 -1.082 1.00 0.00 N ATOM 70 CA ALA A 7 -3.002 -5.189 -2.082 1.00 0.00 C ATOM 71 C ALA A 7 -1.957 -4.113 -2.381 1.00 0.00 C ATOM 72 O ALA A 7 -0.790 -4.399 -2.577 1.00 0.00 O ATOM 73 CB ALA A 7 -3.817 -5.508 -3.339 1.00 0.00 C ATOM 74 H ALA A 7 -4.896 -4.448 -1.355 1.00 0.00 H ATOM 75 HA ALA A 7 -2.528 -6.085 -1.707 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.186 -5.399 -4.208 1.00 0.00 H ATOM 77 HB2 ALA A 7 -4.649 -4.825 -3.413 1.00 0.00 H ATOM 78 HB3 ALA A 7 -4.185 -6.521 -3.287 1.00 0.00 H ATOM 79 N CYS A 8 -2.366 -2.868 -2.397 1.00 0.00 N ATOM 80 CA CYS A 8 -1.397 -1.763 -2.659 1.00 0.00 C ATOM 81 C CYS A 8 -0.601 -1.480 -1.380 1.00 0.00 C ATOM 82 O CYS A 8 0.591 -1.243 -1.422 1.00 0.00 O ATOM 83 CB CYS A 8 -2.245 -0.549 -3.050 1.00 0.00 C ATOM 84 SG CYS A 8 -1.226 0.634 -3.971 1.00 0.00 S ATOM 85 H CYS A 8 -3.306 -2.662 -2.222 1.00 0.00 H ATOM 86 HA CYS A 8 -0.736 -2.028 -3.466 1.00 0.00 H ATOM 87 HB2 CYS A 8 -3.070 -0.869 -3.669 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.629 -0.074 -2.158 1.00 0.00 H ATOM 89 N MET A 9 -1.252 -1.516 -0.241 1.00 0.00 N ATOM 90 CA MET A 9 -0.555 -1.263 1.053 1.00 0.00 C ATOM 91 C MET A 9 0.690 -2.150 1.184 1.00 0.00 C ATOM 92 O MET A 9 1.789 -1.663 1.361 1.00 0.00 O ATOM 93 CB MET A 9 -1.581 -1.631 2.130 1.00 0.00 C ATOM 94 CG MET A 9 -2.561 -0.476 2.335 1.00 0.00 C ATOM 95 SD MET A 9 -2.129 0.422 3.844 1.00 0.00 S ATOM 96 CE MET A 9 -3.236 -0.457 4.970 1.00 0.00 C ATOM 97 H MET A 9 -2.215 -1.713 -0.234 1.00 0.00 H ATOM 98 HA MET A 9 -0.287 -0.224 1.140 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.125 -2.511 1.821 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.070 -1.836 3.054 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.510 0.193 1.491 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.565 -0.864 2.427 1.00 0.00 H ATOM 103 HE1 MET A 9 -2.885 -1.473 5.098 1.00 0.00 H ATOM 104 HE2 MET A 9 -4.237 -0.461 4.559 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.247 0.038 5.926 1.00 0.00 H ATOM 106 N VAL A 10 0.521 -3.446 1.102 1.00 0.00 N ATOM 107 CA VAL A 10 1.693 -4.370 1.230 1.00 0.00 C ATOM 108 C VAL A 10 2.746 -4.056 0.156 1.00 0.00 C ATOM 109 O VAL A 10 3.934 -4.221 0.376 1.00 0.00 O ATOM 110 CB VAL A 10 1.113 -5.783 1.054 1.00 0.00 C ATOM 111 CG1 VAL A 10 0.591 -5.968 -0.372 1.00 0.00 C ATOM 112 CG2 VAL A 10 2.203 -6.820 1.333 1.00 0.00 C ATOM 113 H VAL A 10 -0.377 -3.811 0.958 1.00 0.00 H ATOM 114 HA VAL A 10 2.129 -4.278 2.212 1.00 0.00 H ATOM 115 HB VAL A 10 0.299 -5.921 1.752 1.00 0.00 H ATOM 116 HG11 VAL A 10 -0.094 -5.167 -0.612 1.00 0.00 H ATOM 117 HG12 VAL A 10 0.075 -6.917 -0.447 1.00 0.00 H ATOM 118 HG13 VAL A 10 1.422 -5.955 -1.065 1.00 0.00 H ATOM 119 HG21 VAL A 10 2.817 -6.487 2.160 1.00 0.00 H ATOM 120 HG22 VAL A 10 2.818 -6.938 0.450 1.00 0.00 H ATOM 121 HG23 VAL A 10 1.743 -7.766 1.583 1.00 0.00 H ATOM 122 N ASN A 11 2.320 -3.598 -0.993 1.00 0.00 N ATOM 123 CA ASN A 11 3.289 -3.263 -2.080 1.00 0.00 C ATOM 124 C ASN A 11 3.997 -1.932 -1.787 1.00 0.00 C ATOM 125 O ASN A 11 5.125 -1.726 -2.191 1.00 0.00 O ATOM 126 CB ASN A 11 2.448 -3.138 -3.353 1.00 0.00 C ATOM 127 CG ASN A 11 2.422 -4.485 -4.075 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.442 -4.965 -4.525 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.299 -5.126 -4.207 1.00 0.00 N ATOM 130 H ASN A 11 1.362 -3.471 -1.138 1.00 0.00 H ATOM 131 HA ASN A 11 4.012 -4.057 -2.194 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.443 -2.841 -3.095 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.887 -2.390 -4.001 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.466 -4.751 -3.843 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.280 -5.985 -4.678 1.00 0.00 H ATOM 136 N ASN A 12 3.344 -1.024 -1.104 1.00 0.00 N ATOM 137 CA ASN A 12 3.983 0.294 -0.802 1.00 0.00 C ATOM 138 C ASN A 12 4.121 0.500 0.711 1.00 0.00 C ATOM 139 O ASN A 12 3.496 1.378 1.279 1.00 0.00 O ATOM 140 CB ASN A 12 3.046 1.342 -1.404 1.00 0.00 C ATOM 141 CG ASN A 12 3.520 1.687 -2.814 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.264 2.626 -3.002 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.120 0.964 -3.819 1.00 0.00 N ATOM 144 H ASN A 12 2.432 -1.206 -0.792 1.00 0.00 H ATOM 145 HA ASN A 12 4.952 0.359 -1.274 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.040 0.951 -1.440 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.061 2.229 -0.795 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.515 0.207 -3.671 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.427 1.173 -4.724 1.00 0.00 H ATOM 150 N PRO A 13 4.955 -0.311 1.319 1.00 0.00 N ATOM 151 CA PRO A 13 5.195 -0.206 2.783 1.00 0.00 C ATOM 152 C PRO A 13 5.913 1.104 3.120 1.00 0.00 C ATOM 153 O PRO A 13 5.762 1.642 4.196 1.00 0.00 O ATOM 154 CB PRO A 13 6.083 -1.414 3.086 1.00 0.00 C ATOM 155 CG PRO A 13 6.742 -1.740 1.784 1.00 0.00 C ATOM 156 CD PRO A 13 5.756 -1.385 0.711 1.00 0.00 C ATOM 157 HA PRO A 13 4.266 -0.285 3.327 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.825 -1.151 3.829 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.488 -2.247 3.422 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.648 -1.159 1.667 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.969 -2.794 1.734 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.271 -1.033 -0.172 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.131 -2.230 0.477 1.00 0.00 H ATOM 164 N GLN A 14 6.700 1.614 2.208 1.00 0.00 N ATOM 165 CA GLN A 14 7.439 2.888 2.475 1.00 0.00 C ATOM 166 C GLN A 14 6.475 4.052 2.759 1.00 0.00 C ATOM 167 O GLN A 14 6.855 5.046 3.346 1.00 0.00 O ATOM 168 CB GLN A 14 8.256 3.165 1.203 1.00 0.00 C ATOM 169 CG GLN A 14 7.325 3.414 0.008 1.00 0.00 C ATOM 170 CD GLN A 14 7.365 2.214 -0.937 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.065 1.104 -0.542 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.726 2.392 -2.173 1.00 0.00 N ATOM 173 H GLN A 14 6.813 1.154 1.351 1.00 0.00 H ATOM 174 HA GLN A 14 8.101 2.757 3.310 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.873 4.040 1.359 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.890 2.320 0.990 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.315 3.561 0.358 1.00 0.00 H ATOM 178 HG3 GLN A 14 7.650 4.294 -0.524 1.00 0.00 H ATOM 179 HE21 GLN A 14 7.974 3.288 -2.486 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.743 1.636 -2.794 1.00 0.00 H ATOM 181 N ILE A 15 5.245 3.943 2.339 1.00 0.00 N ATOM 182 CA ILE A 15 4.267 5.048 2.577 1.00 0.00 C ATOM 183 C ILE A 15 3.121 4.559 3.472 1.00 0.00 C ATOM 184 O ILE A 15 2.739 5.222 4.416 1.00 0.00 O ATOM 185 CB ILE A 15 3.742 5.430 1.186 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.899 5.926 0.311 1.00 0.00 C ATOM 187 CG2 ILE A 15 2.716 6.556 1.309 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.477 5.900 -1.155 1.00 0.00 C ATOM 189 H ILE A 15 4.964 3.138 1.863 1.00 0.00 H ATOM 190 HA ILE A 15 4.760 5.893 3.027 1.00 0.00 H ATOM 191 HB ILE A 15 3.280 4.568 0.726 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.151 6.939 0.593 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.759 5.290 0.451 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.764 6.150 1.619 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.606 7.048 0.353 1.00 0.00 H ATOM 196 HG23 ILE A 15 3.058 7.273 2.043 1.00 0.00 H ATOM 197 HD11 ILE A 15 3.662 6.593 -1.299 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.156 4.906 -1.425 1.00 0.00 H ATOM 199 HD13 ILE A 15 5.314 6.192 -1.773 1.00 0.00 H ATOM 200 N CYS A 16 2.570 3.409 3.185 1.00 0.00 N ATOM 201 CA CYS A 16 1.449 2.887 4.025 1.00 0.00 C ATOM 202 C CYS A 16 1.986 2.178 5.275 1.00 0.00 C ATOM 203 O CYS A 16 1.239 1.883 6.186 1.00 0.00 O ATOM 204 CB CYS A 16 0.704 1.901 3.130 1.00 0.00 C ATOM 205 SG CYS A 16 -0.144 2.801 1.799 1.00 0.00 S ATOM 206 H CYS A 16 2.890 2.890 2.417 1.00 0.00 H ATOM 207 HA CYS A 16 0.788 3.689 4.311 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.405 1.199 2.702 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.024 1.365 3.722 1.00 0.00 H HETATM 210 N NH2 A 17 3.260 1.889 5.369 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.874 2.120 4.641 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.599 1.438 6.170 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 9 ATOM 1 N GLY A 1 -7.768 5.585 -2.497 1.00 0.00 N ATOM 2 CA GLY A 1 -6.319 5.927 -2.564 1.00 0.00 C ATOM 3 C GLY A 1 -5.490 4.646 -2.461 1.00 0.00 C ATOM 4 O GLY A 1 -5.963 3.628 -1.986 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.993 4.879 -3.227 1.00 0.00 H ATOM 6 H2 GLY A 1 -8.335 6.442 -2.656 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.988 5.196 -1.561 1.00 0.00 H ATOM 8 HA2 GLY A 1 -6.112 6.420 -3.503 1.00 0.00 H ATOM 9 HA3 GLY A 1 -6.063 6.583 -1.748 1.00 0.00 H ATOM 10 N CYS A 2 -4.257 4.679 -2.903 1.00 0.00 N ATOM 11 CA CYS A 2 -3.401 3.454 -2.834 1.00 0.00 C ATOM 12 C CYS A 2 -3.317 2.942 -1.400 1.00 0.00 C ATOM 13 O CYS A 2 -3.523 1.774 -1.136 1.00 0.00 O ATOM 14 CB CYS A 2 -2.019 3.878 -3.334 1.00 0.00 C ATOM 15 SG CYS A 2 -1.201 2.440 -4.071 1.00 0.00 S ATOM 16 H CYS A 2 -3.895 5.510 -3.283 1.00 0.00 H ATOM 17 HA CYS A 2 -3.800 2.691 -3.469 1.00 0.00 H ATOM 18 HB2 CYS A 2 -2.123 4.658 -4.072 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.429 4.242 -2.506 1.00 0.00 H ATOM 20 N CYS A 3 -3.026 3.810 -0.479 1.00 0.00 N ATOM 21 CA CYS A 3 -2.932 3.393 0.957 1.00 0.00 C ATOM 22 C CYS A 3 -4.229 2.708 1.399 1.00 0.00 C ATOM 23 O CYS A 3 -4.221 1.854 2.265 1.00 0.00 O ATOM 24 CB CYS A 3 -2.708 4.684 1.748 1.00 0.00 C ATOM 25 SG CYS A 3 -0.986 5.214 1.566 1.00 0.00 S ATOM 26 H CYS A 3 -2.876 4.745 -0.733 1.00 0.00 H ATOM 27 HA CYS A 3 -2.095 2.727 1.096 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.364 5.454 1.374 1.00 0.00 H ATOM 29 HB3 CYS A 3 -2.919 4.506 2.793 1.00 0.00 H ATOM 30 N SER A 4 -5.339 3.056 0.799 1.00 0.00 N ATOM 31 CA SER A 4 -6.631 2.409 1.174 1.00 0.00 C ATOM 32 C SER A 4 -6.668 0.962 0.656 1.00 0.00 C ATOM 33 O SER A 4 -7.443 0.151 1.120 1.00 0.00 O ATOM 34 CB SER A 4 -7.720 3.242 0.488 1.00 0.00 C ATOM 35 OG SER A 4 -7.366 4.625 0.509 1.00 0.00 O ATOM 36 H SER A 4 -5.325 3.738 0.095 1.00 0.00 H ATOM 37 HA SER A 4 -6.767 2.428 2.243 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.826 2.921 -0.535 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.661 3.094 1.006 1.00 0.00 H ATOM 40 HG SER A 4 -8.178 5.137 0.641 1.00 0.00 H ATOM 41 N ASN A 5 -5.834 0.637 -0.305 1.00 0.00 N ATOM 42 CA ASN A 5 -5.815 -0.750 -0.856 1.00 0.00 C ATOM 43 C ASN A 5 -4.803 -1.599 -0.086 1.00 0.00 C ATOM 44 O ASN A 5 -3.648 -1.224 0.025 1.00 0.00 O ATOM 45 CB ASN A 5 -5.371 -0.591 -2.318 1.00 0.00 C ATOM 46 CG ASN A 5 -5.494 -1.929 -3.056 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.522 -2.979 -2.448 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.551 -1.938 -4.358 1.00 0.00 N ATOM 49 H ASN A 5 -5.211 1.304 -0.660 1.00 0.00 H ATOM 50 HA ASN A 5 -6.799 -1.190 -0.812 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.994 0.142 -2.805 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.344 -0.264 -2.349 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.519 -1.095 -4.858 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.633 -2.788 -4.839 1.00 0.00 H ATOM 55 N PRO A 6 -5.252 -2.726 0.405 1.00 0.00 N ATOM 56 CA PRO A 6 -4.348 -3.635 1.153 1.00 0.00 C ATOM 57 C PRO A 6 -3.238 -4.143 0.222 1.00 0.00 C ATOM 58 O PRO A 6 -2.088 -4.228 0.608 1.00 0.00 O ATOM 59 CB PRO A 6 -5.279 -4.757 1.627 1.00 0.00 C ATOM 60 CG PRO A 6 -6.432 -4.720 0.675 1.00 0.00 C ATOM 61 CD PRO A 6 -6.614 -3.271 0.306 1.00 0.00 C ATOM 62 HA PRO A 6 -3.924 -3.126 2.006 1.00 0.00 H ATOM 63 HB2 PRO A 6 -4.774 -5.711 1.574 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.622 -4.564 2.632 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.207 -5.307 -0.204 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.328 -5.089 1.155 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.995 -3.180 -0.703 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.265 -2.777 1.009 1.00 0.00 H ATOM 69 N ALA A 7 -3.568 -4.445 -1.012 1.00 0.00 N ATOM 70 CA ALA A 7 -2.525 -4.905 -1.975 1.00 0.00 C ATOM 71 C ALA A 7 -1.479 -3.798 -2.131 1.00 0.00 C ATOM 72 O ALA A 7 -0.284 -4.045 -2.114 1.00 0.00 O ATOM 73 CB ALA A 7 -3.266 -5.147 -3.294 1.00 0.00 C ATOM 74 H ALA A 7 -4.498 -4.341 -1.308 1.00 0.00 H ATOM 75 HA ALA A 7 -2.064 -5.819 -1.629 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.834 -6.065 -3.225 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.552 -5.224 -4.102 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.941 -4.326 -3.484 1.00 0.00 H ATOM 79 N CYS A 8 -1.921 -2.570 -2.252 1.00 0.00 N ATOM 80 CA CYS A 8 -0.954 -1.444 -2.374 1.00 0.00 C ATOM 81 C CYS A 8 -0.190 -1.311 -1.058 1.00 0.00 C ATOM 82 O CYS A 8 1.017 -1.172 -1.047 1.00 0.00 O ATOM 83 CB CYS A 8 -1.785 -0.190 -2.650 1.00 0.00 C ATOM 84 SG CYS A 8 -0.730 1.281 -2.483 1.00 0.00 S ATOM 85 H CYS A 8 -2.885 -2.394 -2.236 1.00 0.00 H ATOM 86 HA CYS A 8 -0.275 -1.622 -3.188 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.183 -0.235 -3.652 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.597 -0.134 -1.941 1.00 0.00 H ATOM 89 N MET A 9 -0.886 -1.363 0.056 1.00 0.00 N ATOM 90 CA MET A 9 -0.206 -1.257 1.378 1.00 0.00 C ATOM 91 C MET A 9 0.940 -2.272 1.471 1.00 0.00 C ATOM 92 O MET A 9 2.057 -1.927 1.806 1.00 0.00 O ATOM 93 CB MET A 9 -1.289 -1.580 2.410 1.00 0.00 C ATOM 94 CG MET A 9 -2.169 -0.349 2.644 1.00 0.00 C ATOM 95 SD MET A 9 -3.241 -0.642 4.070 1.00 0.00 S ATOM 96 CE MET A 9 -2.425 0.504 5.205 1.00 0.00 C ATOM 97 H MET A 9 -1.864 -1.483 0.025 1.00 0.00 H ATOM 98 HA MET A 9 0.164 -0.259 1.532 1.00 0.00 H ATOM 99 HB2 MET A 9 -1.902 -2.393 2.048 1.00 0.00 H ATOM 100 HB3 MET A 9 -0.824 -1.869 3.334 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.543 0.510 2.833 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.775 -0.169 1.768 1.00 0.00 H ATOM 103 HE1 MET A 9 -2.684 0.242 6.222 1.00 0.00 H ATOM 104 HE2 MET A 9 -2.749 1.514 4.991 1.00 0.00 H ATOM 105 HE3 MET A 9 -1.358 0.438 5.082 1.00 0.00 H ATOM 106 N VAL A 10 0.676 -3.520 1.172 1.00 0.00 N ATOM 107 CA VAL A 10 1.760 -4.549 1.238 1.00 0.00 C ATOM 108 C VAL A 10 2.809 -4.271 0.146 1.00 0.00 C ATOM 109 O VAL A 10 3.992 -4.469 0.349 1.00 0.00 O ATOM 110 CB VAL A 10 1.065 -5.896 0.993 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.066 -7.038 1.185 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.082 -6.077 1.985 1.00 0.00 C ATOM 113 H VAL A 10 -0.232 -3.777 0.896 1.00 0.00 H ATOM 114 HA VAL A 10 2.222 -4.542 2.212 1.00 0.00 H ATOM 115 HB VAL A 10 0.678 -5.921 -0.011 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.239 -7.187 2.239 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.996 -6.791 0.696 1.00 0.00 H ATOM 118 HG13 VAL A 10 1.661 -7.943 0.757 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.032 -7.067 2.410 1.00 0.00 H ATOM 120 HG22 VAL A 10 -1.020 -5.956 1.469 1.00 0.00 H ATOM 121 HG23 VAL A 10 0.001 -5.340 2.771 1.00 0.00 H ATOM 122 N ASN A 11 2.386 -3.810 -1.008 1.00 0.00 N ATOM 123 CA ASN A 11 3.365 -3.516 -2.102 1.00 0.00 C ATOM 124 C ASN A 11 4.172 -2.259 -1.766 1.00 0.00 C ATOM 125 O ASN A 11 5.305 -2.110 -2.190 1.00 0.00 O ATOM 126 CB ASN A 11 2.525 -3.275 -3.361 1.00 0.00 C ATOM 127 CG ASN A 11 2.340 -4.594 -4.106 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.100 -4.912 -5.002 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.367 -5.388 -3.770 1.00 0.00 N ATOM 130 H ASN A 11 1.428 -3.656 -1.152 1.00 0.00 H ATOM 131 HA ASN A 11 4.022 -4.358 -2.255 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.559 -2.875 -3.086 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.033 -2.572 -4.005 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.754 -5.137 -3.042 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.239 -6.234 -4.244 1.00 0.00 H ATOM 136 N ASN A 12 3.600 -1.342 -1.024 1.00 0.00 N ATOM 137 CA ASN A 12 4.335 -0.090 -0.682 1.00 0.00 C ATOM 138 C ASN A 12 4.291 0.186 0.828 1.00 0.00 C ATOM 139 O ASN A 12 3.668 1.139 1.267 1.00 0.00 O ATOM 140 CB ASN A 12 3.605 1.011 -1.454 1.00 0.00 C ATOM 141 CG ASN A 12 4.310 1.237 -2.794 1.00 0.00 C ATOM 142 OD1 ASN A 12 5.117 2.140 -2.930 1.00 0.00 O ATOM 143 ND2 ASN A 12 4.041 0.447 -3.795 1.00 0.00 N ATOM 144 H ASN A 12 2.679 -1.469 -0.705 1.00 0.00 H ATOM 145 HA ASN A 12 5.354 -0.154 -1.019 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.581 0.711 -1.627 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.618 1.924 -0.882 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.397 -0.283 -3.683 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.484 0.577 -4.658 1.00 0.00 H ATOM 150 N PRO A 13 4.979 -0.640 1.580 1.00 0.00 N ATOM 151 CA PRO A 13 5.031 -0.456 3.056 1.00 0.00 C ATOM 152 C PRO A 13 5.755 0.853 3.385 1.00 0.00 C ATOM 153 O PRO A 13 5.451 1.521 4.356 1.00 0.00 O ATOM 154 CB PRO A 13 5.813 -1.677 3.543 1.00 0.00 C ATOM 155 CG PRO A 13 6.617 -2.108 2.360 1.00 0.00 C ATOM 156 CD PRO A 13 5.779 -1.798 1.147 1.00 0.00 C ATOM 157 HA PRO A 13 4.037 -0.458 3.474 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.463 -1.403 4.363 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.137 -2.464 3.839 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.550 -1.561 2.321 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.809 -3.170 2.406 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.411 -1.546 0.308 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.135 -2.630 0.906 1.00 0.00 H ATOM 164 N GLN A 14 6.704 1.228 2.562 1.00 0.00 N ATOM 165 CA GLN A 14 7.457 2.499 2.793 1.00 0.00 C ATOM 166 C GLN A 14 6.493 3.680 2.931 1.00 0.00 C ATOM 167 O GLN A 14 6.781 4.647 3.612 1.00 0.00 O ATOM 168 CB GLN A 14 8.371 2.683 1.565 1.00 0.00 C ATOM 169 CG GLN A 14 7.619 2.342 0.269 1.00 0.00 C ATOM 170 CD GLN A 14 8.091 3.264 -0.861 1.00 0.00 C ATOM 171 OE1 GLN A 14 9.015 4.036 -0.694 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.484 3.224 -2.012 1.00 0.00 N ATOM 173 H GLN A 14 6.916 0.671 1.786 1.00 0.00 H ATOM 174 HA GLN A 14 8.054 2.410 3.678 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.705 3.710 1.522 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.229 2.036 1.657 1.00 0.00 H ATOM 177 HG2 GLN A 14 7.818 1.314 -0.002 1.00 0.00 H ATOM 178 HG3 GLN A 14 6.560 2.476 0.421 1.00 0.00 H ATOM 179 HE21 GLN A 14 6.730 2.609 -2.152 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.784 3.804 -2.743 1.00 0.00 H ATOM 181 N ILE A 15 5.354 3.607 2.295 1.00 0.00 N ATOM 182 CA ILE A 15 4.364 4.725 2.383 1.00 0.00 C ATOM 183 C ILE A 15 3.205 4.327 3.312 1.00 0.00 C ATOM 184 O ILE A 15 2.796 5.093 4.166 1.00 0.00 O ATOM 185 CB ILE A 15 3.862 4.943 0.945 1.00 0.00 C ATOM 186 CG1 ILE A 15 5.054 5.096 -0.004 1.00 0.00 C ATOM 187 CG2 ILE A 15 3.018 6.219 0.878 1.00 0.00 C ATOM 188 CD1 ILE A 15 5.864 6.339 0.370 1.00 0.00 C ATOM 189 H ILE A 15 5.151 2.818 1.758 1.00 0.00 H ATOM 190 HA ILE A 15 4.846 5.618 2.744 1.00 0.00 H ATOM 191 HB ILE A 15 3.263 4.096 0.639 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.684 4.221 0.063 1.00 0.00 H ATOM 193 HG13 ILE A 15 4.693 5.198 -1.015 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.996 5.995 1.147 1.00 0.00 H ATOM 195 HG22 ILE A 15 3.049 6.613 -0.126 1.00 0.00 H ATOM 196 HG23 ILE A 15 3.420 6.950 1.563 1.00 0.00 H ATOM 197 HD11 ILE A 15 6.496 6.117 1.218 1.00 0.00 H ATOM 198 HD12 ILE A 15 5.194 7.150 0.622 1.00 0.00 H ATOM 199 HD13 ILE A 15 6.478 6.628 -0.468 1.00 0.00 H ATOM 200 N CYS A 16 2.673 3.143 3.150 1.00 0.00 N ATOM 201 CA CYS A 16 1.540 2.701 4.018 1.00 0.00 C ATOM 202 C CYS A 16 1.659 1.201 4.307 1.00 0.00 C ATOM 203 O CYS A 16 0.823 0.415 3.902 1.00 0.00 O ATOM 204 CB CYS A 16 0.275 3.001 3.206 1.00 0.00 C ATOM 205 SG CYS A 16 -0.136 4.760 3.342 1.00 0.00 S ATOM 206 H CYS A 16 3.020 2.540 2.456 1.00 0.00 H ATOM 207 HA CYS A 16 1.527 3.262 4.940 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.448 2.751 2.168 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.545 2.413 3.589 1.00 0.00 H HETATM 210 N NH2 A 17 2.672 0.768 5.001 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.350 1.398 5.328 1.00 0.00 H HETATM 212 HN2 NH2 A 17 2.757 -0.187 5.201 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 10 ATOM 1 N GLY A 1 -6.749 6.385 -1.163 1.00 0.00 N ATOM 2 CA GLY A 1 -5.592 6.428 -2.103 1.00 0.00 C ATOM 3 C GLY A 1 -5.109 5.001 -2.361 1.00 0.00 C ATOM 4 O GLY A 1 -5.891 4.066 -2.395 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.631 6.298 -1.705 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.768 7.253 -0.604 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.651 5.566 -0.524 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.898 6.882 -3.036 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.789 7.001 -1.667 1.00 0.00 H ATOM 10 N CYS A 2 -3.831 4.812 -2.533 1.00 0.00 N ATOM 11 CA CYS A 2 -3.315 3.435 -2.776 1.00 0.00 C ATOM 12 C CYS A 2 -3.262 2.661 -1.466 1.00 0.00 C ATOM 13 O CYS A 2 -3.644 1.509 -1.397 1.00 0.00 O ATOM 14 CB CYS A 2 -1.912 3.606 -3.360 1.00 0.00 C ATOM 15 SG CYS A 2 -1.595 2.257 -4.520 1.00 0.00 S ATOM 16 H CYS A 2 -3.211 5.573 -2.497 1.00 0.00 H ATOM 17 HA CYS A 2 -3.942 2.927 -3.476 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.850 4.553 -3.872 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.179 3.576 -2.567 1.00 0.00 H ATOM 20 N CYS A 3 -2.800 3.288 -0.426 1.00 0.00 N ATOM 21 CA CYS A 3 -2.712 2.603 0.904 1.00 0.00 C ATOM 22 C CYS A 3 -4.056 1.967 1.277 1.00 0.00 C ATOM 23 O CYS A 3 -4.092 0.900 1.859 1.00 0.00 O ATOM 24 CB CYS A 3 -2.327 3.691 1.910 1.00 0.00 C ATOM 25 SG CYS A 3 -0.553 4.028 1.788 1.00 0.00 S ATOM 26 H CYS A 3 -2.511 4.217 -0.521 1.00 0.00 H ATOM 27 HA CYS A 3 -1.946 1.847 0.879 1.00 0.00 H ATOM 28 HB2 CYS A 3 -2.884 4.594 1.697 1.00 0.00 H ATOM 29 HB3 CYS A 3 -2.559 3.354 2.908 1.00 0.00 H ATOM 30 N SER A 4 -5.156 2.591 0.934 1.00 0.00 N ATOM 31 CA SER A 4 -6.488 1.988 1.263 1.00 0.00 C ATOM 32 C SER A 4 -6.579 0.570 0.669 1.00 0.00 C ATOM 33 O SER A 4 -7.241 -0.297 1.211 1.00 0.00 O ATOM 34 CB SER A 4 -7.539 2.912 0.631 1.00 0.00 C ATOM 35 OG SER A 4 -6.899 3.943 -0.123 1.00 0.00 O ATOM 36 H SER A 4 -5.115 3.446 0.451 1.00 0.00 H ATOM 37 HA SER A 4 -6.627 1.953 2.332 1.00 0.00 H ATOM 38 HB2 SER A 4 -8.176 2.337 -0.020 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.142 3.351 1.414 1.00 0.00 H ATOM 40 HG SER A 4 -6.870 3.657 -1.049 1.00 0.00 H ATOM 41 N ASN A 5 -5.900 0.330 -0.431 1.00 0.00 N ATOM 42 CA ASN A 5 -5.918 -1.027 -1.057 1.00 0.00 C ATOM 43 C ASN A 5 -4.961 -1.945 -0.298 1.00 0.00 C ATOM 44 O ASN A 5 -3.799 -1.610 -0.135 1.00 0.00 O ATOM 45 CB ASN A 5 -5.413 -0.822 -2.493 1.00 0.00 C ATOM 46 CG ASN A 5 -5.580 -2.114 -3.305 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.776 -3.182 -2.754 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.501 -2.065 -4.600 1.00 0.00 N ATOM 49 H ASN A 5 -5.361 1.045 -0.837 1.00 0.00 H ATOM 50 HA ASN A 5 -6.914 -1.435 -1.069 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.977 -0.031 -2.962 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.362 -0.552 -2.470 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.334 -1.210 -5.050 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.609 -2.883 -5.129 1.00 0.00 H ATOM 55 N PRO A 6 -5.457 -3.080 0.129 1.00 0.00 N ATOM 56 CA PRO A 6 -4.599 -4.044 0.865 1.00 0.00 C ATOM 57 C PRO A 6 -3.438 -4.490 -0.026 1.00 0.00 C ATOM 58 O PRO A 6 -2.331 -4.694 0.442 1.00 0.00 O ATOM 59 CB PRO A 6 -5.552 -5.192 1.213 1.00 0.00 C ATOM 60 CG PRO A 6 -6.658 -5.070 0.219 1.00 0.00 C ATOM 61 CD PRO A 6 -6.824 -3.591 -0.037 1.00 0.00 C ATOM 62 HA PRO A 6 -4.223 -3.592 1.769 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.047 -6.143 1.102 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.936 -5.079 2.215 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.393 -5.585 -0.696 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.567 -5.473 0.626 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.183 -3.416 -1.045 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.481 -3.141 0.691 1.00 0.00 H ATOM 69 N ALA A 7 -3.672 -4.602 -1.310 1.00 0.00 N ATOM 70 CA ALA A 7 -2.577 -4.990 -2.239 1.00 0.00 C ATOM 71 C ALA A 7 -1.516 -3.886 -2.239 1.00 0.00 C ATOM 72 O ALA A 7 -0.347 -4.135 -2.016 1.00 0.00 O ATOM 73 CB ALA A 7 -3.235 -5.123 -3.620 1.00 0.00 C ATOM 74 H ALA A 7 -4.565 -4.402 -1.661 1.00 0.00 H ATOM 75 HA ALA A 7 -2.141 -5.931 -1.940 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.914 -4.297 -3.778 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.784 -6.052 -3.668 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.473 -5.116 -4.386 1.00 0.00 H ATOM 79 N CYS A 8 -1.916 -2.659 -2.460 1.00 0.00 N ATOM 80 CA CYS A 8 -0.925 -1.545 -2.446 1.00 0.00 C ATOM 81 C CYS A 8 -0.325 -1.392 -1.045 1.00 0.00 C ATOM 82 O CYS A 8 0.863 -1.188 -0.897 1.00 0.00 O ATOM 83 CB CYS A 8 -1.686 -0.284 -2.843 1.00 0.00 C ATOM 84 SG CYS A 8 -0.495 0.935 -3.460 1.00 0.00 S ATOM 85 H CYS A 8 -2.866 -2.473 -2.616 1.00 0.00 H ATOM 86 HA CYS A 8 -0.152 -1.736 -3.169 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.396 -0.522 -3.619 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.208 0.113 -1.984 1.00 0.00 H ATOM 89 N MET A 9 -1.135 -1.499 -0.015 1.00 0.00 N ATOM 90 CA MET A 9 -0.603 -1.368 1.383 1.00 0.00 C ATOM 91 C MET A 9 0.582 -2.316 1.589 1.00 0.00 C ATOM 92 O MET A 9 1.601 -1.944 2.137 1.00 0.00 O ATOM 93 CB MET A 9 -1.762 -1.777 2.294 1.00 0.00 C ATOM 94 CG MET A 9 -1.816 -0.850 3.507 1.00 0.00 C ATOM 95 SD MET A 9 -2.068 -1.834 5.008 1.00 0.00 S ATOM 96 CE MET A 9 -0.460 -2.666 5.024 1.00 0.00 C ATOM 97 H MET A 9 -2.093 -1.674 -0.160 1.00 0.00 H ATOM 98 HA MET A 9 -0.314 -0.350 1.585 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.690 -1.709 1.751 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.615 -2.795 2.626 1.00 0.00 H ATOM 101 HG2 MET A 9 -0.887 -0.305 3.584 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.635 -0.153 3.392 1.00 0.00 H ATOM 103 HE1 MET A 9 -0.421 -3.359 5.852 1.00 0.00 H ATOM 104 HE2 MET A 9 0.326 -1.933 5.128 1.00 0.00 H ATOM 105 HE3 MET A 9 -0.322 -3.208 4.104 1.00 0.00 H ATOM 106 N VAL A 10 0.444 -3.539 1.152 1.00 0.00 N ATOM 107 CA VAL A 10 1.550 -4.530 1.311 1.00 0.00 C ATOM 108 C VAL A 10 2.635 -4.286 0.250 1.00 0.00 C ATOM 109 O VAL A 10 3.808 -4.513 0.489 1.00 0.00 O ATOM 110 CB VAL A 10 0.891 -5.906 1.125 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.939 -7.005 1.301 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.207 -6.096 2.179 1.00 0.00 C ATOM 113 H VAL A 10 -0.394 -3.804 0.716 1.00 0.00 H ATOM 114 HA VAL A 10 1.976 -4.458 2.297 1.00 0.00 H ATOM 115 HB VAL A 10 0.462 -5.970 0.135 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.402 -6.911 2.271 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.690 -6.909 0.534 1.00 0.00 H ATOM 118 HG13 VAL A 10 1.467 -7.971 1.223 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.953 -5.323 2.069 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.227 -6.041 3.167 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.671 -7.062 2.044 1.00 0.00 H ATOM 122 N ASN A 11 2.257 -3.820 -0.912 1.00 0.00 N ATOM 123 CA ASN A 11 3.271 -3.557 -1.982 1.00 0.00 C ATOM 124 C ASN A 11 4.068 -2.288 -1.660 1.00 0.00 C ATOM 125 O ASN A 11 5.239 -2.189 -1.971 1.00 0.00 O ATOM 126 CB ASN A 11 2.469 -3.359 -3.274 1.00 0.00 C ATOM 127 CG ASN A 11 2.225 -4.710 -3.944 1.00 0.00 C ATOM 128 OD1 ASN A 11 2.833 -5.024 -4.949 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.339 -5.524 -3.446 1.00 0.00 N ATOM 130 H ASN A 11 1.306 -3.640 -1.083 1.00 0.00 H ATOM 131 HA ASN A 11 3.939 -4.399 -2.086 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.523 -2.898 -3.040 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.023 -2.720 -3.948 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.828 -5.268 -2.646 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.183 -6.399 -3.863 1.00 0.00 H ATOM 136 N ASN A 12 3.446 -1.311 -1.048 1.00 0.00 N ATOM 137 CA ASN A 12 4.173 -0.050 -0.722 1.00 0.00 C ATOM 138 C ASN A 12 4.048 0.287 0.769 1.00 0.00 C ATOM 139 O ASN A 12 3.449 1.287 1.132 1.00 0.00 O ATOM 140 CB ASN A 12 3.497 1.026 -1.575 1.00 0.00 C ATOM 141 CG ASN A 12 4.246 1.158 -2.900 1.00 0.00 C ATOM 142 OD1 ASN A 12 5.199 1.905 -3.002 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.857 0.460 -3.928 1.00 0.00 N ATOM 144 H ASN A 12 2.497 -1.404 -0.806 1.00 0.00 H ATOM 145 HA ASN A 12 5.211 -0.133 -1.001 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.472 0.748 -1.764 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.526 1.967 -1.053 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.089 -0.143 -3.850 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.337 0.533 -4.780 1.00 0.00 H ATOM 150 N PRO A 13 4.637 -0.550 1.595 1.00 0.00 N ATOM 151 CA PRO A 13 4.600 -0.317 3.064 1.00 0.00 C ATOM 152 C PRO A 13 5.407 0.937 3.412 1.00 0.00 C ATOM 153 O PRO A 13 5.056 1.680 4.304 1.00 0.00 O ATOM 154 CB PRO A 13 5.237 -1.581 3.648 1.00 0.00 C ATOM 155 CG PRO A 13 6.092 -2.121 2.545 1.00 0.00 C ATOM 156 CD PRO A 13 5.390 -1.769 1.257 1.00 0.00 C ATOM 157 HA PRO A 13 3.582 -0.222 3.406 1.00 0.00 H ATOM 158 HB2 PRO A 13 5.839 -1.334 4.512 1.00 0.00 H ATOM 159 HB3 PRO A 13 4.475 -2.301 3.912 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.075 -1.668 2.577 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.173 -3.193 2.635 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.110 -1.578 0.474 1.00 0.00 H ATOM 163 HD3 PRO A 13 4.711 -2.556 0.966 1.00 0.00 H ATOM 164 N GLN A 14 6.474 1.179 2.698 1.00 0.00 N ATOM 165 CA GLN A 14 7.309 2.393 2.966 1.00 0.00 C ATOM 166 C GLN A 14 6.452 3.660 2.890 1.00 0.00 C ATOM 167 O GLN A 14 6.621 4.587 3.655 1.00 0.00 O ATOM 168 CB GLN A 14 8.376 2.420 1.866 1.00 0.00 C ATOM 169 CG GLN A 14 9.124 1.081 1.815 1.00 0.00 C ATOM 170 CD GLN A 14 8.757 0.336 0.526 1.00 0.00 C ATOM 171 OE1 GLN A 14 8.217 -0.750 0.571 1.00 0.00 O ATOM 172 NE2 GLN A 14 9.021 0.878 -0.629 1.00 0.00 N ATOM 173 H GLN A 14 6.722 0.563 1.977 1.00 0.00 H ATOM 174 HA GLN A 14 7.772 2.323 3.928 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.901 2.603 0.913 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.077 3.212 2.076 1.00 0.00 H ATOM 177 HG2 GLN A 14 10.189 1.265 1.834 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.849 0.478 2.668 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.451 1.760 -0.675 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.793 0.403 -1.454 1.00 0.00 H ATOM 181 N ILE A 15 5.540 3.695 1.964 1.00 0.00 N ATOM 182 CA ILE A 15 4.655 4.892 1.811 1.00 0.00 C ATOM 183 C ILE A 15 3.487 4.822 2.802 1.00 0.00 C ATOM 184 O ILE A 15 3.159 5.798 3.453 1.00 0.00 O ATOM 185 CB ILE A 15 4.142 4.827 0.366 1.00 0.00 C ATOM 186 CG1 ILE A 15 5.331 4.791 -0.604 1.00 0.00 C ATOM 187 CG2 ILE A 15 3.294 6.064 0.063 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.828 4.869 -2.049 1.00 0.00 C ATOM 189 H ILE A 15 5.435 2.930 1.366 1.00 0.00 H ATOM 190 HA ILE A 15 5.221 5.798 1.960 1.00 0.00 H ATOM 191 HB ILE A 15 3.540 3.938 0.238 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.979 5.631 -0.404 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.879 3.873 -0.467 1.00 0.00 H ATOM 194 HG21 ILE A 15 2.401 5.769 -0.472 1.00 0.00 H ATOM 195 HG22 ILE A 15 3.870 6.746 -0.547 1.00 0.00 H ATOM 196 HG23 ILE A 15 3.019 6.552 0.986 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.183 4.023 -2.257 1.00 0.00 H ATOM 198 HD12 ILE A 15 5.672 4.852 -2.724 1.00 0.00 H ATOM 199 HD13 ILE A 15 4.274 5.786 -2.186 1.00 0.00 H ATOM 200 N CYS A 16 2.847 3.681 2.913 1.00 0.00 N ATOM 201 CA CYS A 16 1.690 3.551 3.856 1.00 0.00 C ATOM 202 C CYS A 16 2.168 3.622 5.308 1.00 0.00 C ATOM 203 O CYS A 16 1.497 4.171 6.155 1.00 0.00 O ATOM 204 CB CYS A 16 1.069 2.183 3.559 1.00 0.00 C ATOM 205 SG CYS A 16 0.320 2.208 1.909 1.00 0.00 S ATOM 206 H CYS A 16 3.123 2.912 2.368 1.00 0.00 H ATOM 207 HA CYS A 16 0.966 4.325 3.665 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.833 1.420 3.601 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.305 1.966 4.293 1.00 0.00 H HETATM 210 N NH2 A 17 3.310 3.088 5.647 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.868 2.638 4.973 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.613 3.132 6.578 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 11 ATOM 1 N GLY A 1 -6.739 6.382 -0.981 1.00 0.00 N ATOM 2 CA GLY A 1 -5.380 6.493 -1.573 1.00 0.00 C ATOM 3 C GLY A 1 -4.770 5.094 -1.704 1.00 0.00 C ATOM 4 O GLY A 1 -5.464 4.093 -1.611 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.933 7.216 -0.400 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.793 5.524 -0.388 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.440 6.320 -1.741 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.449 6.958 -2.546 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.757 7.093 -0.929 1.00 0.00 H ATOM 10 N CYS A 2 -3.481 5.005 -1.915 1.00 0.00 N ATOM 11 CA CYS A 2 -2.836 3.658 -2.043 1.00 0.00 C ATOM 12 C CYS A 2 -3.061 2.846 -0.771 1.00 0.00 C ATOM 13 O CYS A 2 -3.311 1.658 -0.818 1.00 0.00 O ATOM 14 CB CYS A 2 -1.342 3.914 -2.254 1.00 0.00 C ATOM 15 SG CYS A 2 -0.693 2.698 -3.433 1.00 0.00 S ATOM 16 H CYS A 2 -2.938 5.819 -1.989 1.00 0.00 H ATOM 17 HA CYS A 2 -3.240 3.136 -2.886 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.200 4.909 -2.639 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.825 3.816 -1.310 1.00 0.00 H ATOM 20 N CYS A 3 -2.992 3.484 0.362 1.00 0.00 N ATOM 21 CA CYS A 3 -3.223 2.752 1.648 1.00 0.00 C ATOM 22 C CYS A 3 -4.634 2.142 1.652 1.00 0.00 C ATOM 23 O CYS A 3 -4.892 1.170 2.329 1.00 0.00 O ATOM 24 CB CYS A 3 -3.075 3.799 2.753 1.00 0.00 C ATOM 25 SG CYS A 3 -1.351 4.355 2.836 1.00 0.00 S ATOM 26 H CYS A 3 -2.799 4.443 0.365 1.00 0.00 H ATOM 27 HA CYS A 3 -2.486 1.977 1.774 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.713 4.641 2.542 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.361 3.364 3.700 1.00 0.00 H ATOM 30 N SER A 4 -5.543 2.686 0.879 1.00 0.00 N ATOM 31 CA SER A 4 -6.922 2.112 0.827 1.00 0.00 C ATOM 32 C SER A 4 -6.922 0.802 0.015 1.00 0.00 C ATOM 33 O SER A 4 -7.920 0.105 -0.046 1.00 0.00 O ATOM 34 CB SER A 4 -7.774 3.181 0.137 1.00 0.00 C ATOM 35 OG SER A 4 -7.337 4.476 0.549 1.00 0.00 O ATOM 36 H SER A 4 -5.318 3.463 0.323 1.00 0.00 H ATOM 37 HA SER A 4 -7.291 1.933 1.824 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.667 3.090 -0.930 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.814 3.035 0.403 1.00 0.00 H ATOM 40 HG SER A 4 -7.743 4.666 1.402 1.00 0.00 H ATOM 41 N ASN A 5 -5.808 0.460 -0.599 1.00 0.00 N ATOM 42 CA ASN A 5 -5.738 -0.804 -1.391 1.00 0.00 C ATOM 43 C ASN A 5 -4.858 -1.816 -0.661 1.00 0.00 C ATOM 44 O ASN A 5 -3.696 -1.547 -0.410 1.00 0.00 O ATOM 45 CB ASN A 5 -5.087 -0.428 -2.733 1.00 0.00 C ATOM 46 CG ASN A 5 -5.199 -1.607 -3.713 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.463 -2.726 -3.317 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.995 -1.406 -4.984 1.00 0.00 N ATOM 49 H ASN A 5 -5.012 1.031 -0.530 1.00 0.00 H ATOM 50 HA ASN A 5 -6.725 -1.203 -1.558 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.586 0.434 -3.148 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.037 -0.199 -2.575 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.769 -0.508 -5.309 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.073 -2.150 -5.616 1.00 0.00 H ATOM 55 N PRO A 6 -5.419 -2.960 -0.361 1.00 0.00 N ATOM 56 CA PRO A 6 -4.645 -4.020 0.325 1.00 0.00 C ATOM 57 C PRO A 6 -3.479 -4.463 -0.558 1.00 0.00 C ATOM 58 O PRO A 6 -2.405 -4.763 -0.073 1.00 0.00 O ATOM 59 CB PRO A 6 -5.671 -5.136 0.535 1.00 0.00 C ATOM 60 CG PRO A 6 -6.718 -4.887 -0.501 1.00 0.00 C ATOM 61 CD PRO A 6 -6.796 -3.391 -0.644 1.00 0.00 C ATOM 62 HA PRO A 6 -4.283 -3.669 1.279 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.208 -6.101 0.385 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.102 -5.074 1.522 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.432 -5.342 -1.439 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.673 -5.274 -0.172 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.088 -3.121 -1.650 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.478 -2.972 0.082 1.00 0.00 H ATOM 69 N ALA A 7 -3.667 -4.466 -1.856 1.00 0.00 N ATOM 70 CA ALA A 7 -2.550 -4.857 -2.765 1.00 0.00 C ATOM 71 C ALA A 7 -1.416 -3.843 -2.619 1.00 0.00 C ATOM 72 O ALA A 7 -0.256 -4.194 -2.595 1.00 0.00 O ATOM 73 CB ALA A 7 -3.125 -4.811 -4.179 1.00 0.00 C ATOM 74 H ALA A 7 -4.533 -4.188 -2.230 1.00 0.00 H ATOM 75 HA ALA A 7 -2.204 -5.853 -2.531 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.583 -3.848 -4.348 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.867 -5.585 -4.293 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.331 -4.964 -4.897 1.00 0.00 H ATOM 79 N CYS A 8 -1.752 -2.581 -2.500 1.00 0.00 N ATOM 80 CA CYS A 8 -0.694 -1.541 -2.333 1.00 0.00 C ATOM 81 C CYS A 8 -0.187 -1.553 -0.892 1.00 0.00 C ATOM 82 O CYS A 8 1.001 -1.499 -0.645 1.00 0.00 O ATOM 83 CB CYS A 8 -1.341 -0.185 -2.649 1.00 0.00 C ATOM 84 SG CYS A 8 -0.146 1.133 -2.276 1.00 0.00 S ATOM 85 H CYS A 8 -2.696 -2.327 -2.506 1.00 0.00 H ATOM 86 HA CYS A 8 0.113 -1.723 -3.015 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.610 -0.147 -3.695 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.221 -0.052 -2.038 1.00 0.00 H ATOM 89 N MET A 9 -1.080 -1.615 0.065 1.00 0.00 N ATOM 90 CA MET A 9 -0.667 -1.617 1.501 1.00 0.00 C ATOM 91 C MET A 9 0.397 -2.688 1.781 1.00 0.00 C ATOM 92 O MET A 9 1.420 -2.411 2.374 1.00 0.00 O ATOM 93 CB MET A 9 -1.950 -1.939 2.272 1.00 0.00 C ATOM 94 CG MET A 9 -2.671 -0.642 2.644 1.00 0.00 C ATOM 95 SD MET A 9 -1.700 0.258 3.879 1.00 0.00 S ATOM 96 CE MET A 9 -1.842 -0.953 5.220 1.00 0.00 C ATOM 97 H MET A 9 -2.040 -1.653 -0.158 1.00 0.00 H ATOM 98 HA MET A 9 -0.300 -0.647 1.788 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.597 -2.546 1.657 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.700 -2.479 3.170 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.788 -0.029 1.761 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.644 -0.876 3.049 1.00 0.00 H ATOM 103 HE1 MET A 9 -2.784 -1.478 5.137 1.00 0.00 H ATOM 104 HE2 MET A 9 -1.792 -0.442 6.174 1.00 0.00 H ATOM 105 HE3 MET A 9 -1.030 -1.660 5.155 1.00 0.00 H ATOM 106 N VAL A 10 0.158 -3.906 1.383 1.00 0.00 N ATOM 107 CA VAL A 10 1.157 -4.988 1.661 1.00 0.00 C ATOM 108 C VAL A 10 2.391 -4.875 0.749 1.00 0.00 C ATOM 109 O VAL A 10 3.424 -5.443 1.041 1.00 0.00 O ATOM 110 CB VAL A 10 0.413 -6.306 1.393 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.275 -7.499 1.824 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.899 -6.330 2.181 1.00 0.00 C ATOM 113 H VAL A 10 -0.682 -4.115 0.918 1.00 0.00 H ATOM 114 HA VAL A 10 1.462 -4.952 2.695 1.00 0.00 H ATOM 115 HB VAL A 10 0.200 -6.388 0.337 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.309 -7.194 1.883 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.175 -8.293 1.097 1.00 0.00 H ATOM 118 HG13 VAL A 10 0.947 -7.851 2.789 1.00 0.00 H ATOM 119 HG21 VAL A 10 -1.724 -6.448 1.496 1.00 0.00 H ATOM 120 HG22 VAL A 10 -1.013 -5.403 2.725 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.883 -7.160 2.877 1.00 0.00 H ATOM 122 N ASN A 11 2.301 -4.172 -0.355 1.00 0.00 N ATOM 123 CA ASN A 11 3.493 -4.079 -1.262 1.00 0.00 C ATOM 124 C ASN A 11 4.158 -2.696 -1.215 1.00 0.00 C ATOM 125 O ASN A 11 5.213 -2.504 -1.790 1.00 0.00 O ATOM 126 CB ASN A 11 2.950 -4.354 -2.666 1.00 0.00 C ATOM 127 CG ASN A 11 2.634 -5.842 -2.799 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.526 -6.658 -2.908 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.395 -6.233 -2.791 1.00 0.00 N ATOM 130 H ASN A 11 1.460 -3.725 -0.593 1.00 0.00 H ATOM 131 HA ASN A 11 4.210 -4.842 -1.002 1.00 0.00 H ATOM 132 HB2 ASN A 11 2.052 -3.778 -2.827 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.693 -4.081 -3.400 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.670 -5.570 -2.701 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.180 -7.184 -2.877 1.00 0.00 H ATOM 136 N ASN A 12 3.572 -1.730 -0.556 1.00 0.00 N ATOM 137 CA ASN A 12 4.207 -0.377 -0.515 1.00 0.00 C ATOM 138 C ASN A 12 4.282 0.149 0.923 1.00 0.00 C ATOM 139 O ASN A 12 3.533 1.034 1.301 1.00 0.00 O ATOM 140 CB ASN A 12 3.318 0.525 -1.381 1.00 0.00 C ATOM 141 CG ASN A 12 3.963 0.700 -2.755 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.624 1.687 -3.011 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.800 -0.225 -3.656 1.00 0.00 N ATOM 144 H ASN A 12 2.714 -1.886 -0.101 1.00 0.00 H ATOM 145 HA ASN A 12 5.195 -0.423 -0.942 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.343 0.079 -1.495 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.220 1.491 -0.912 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.270 -1.023 -3.449 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.207 -0.123 -4.542 1.00 0.00 H ATOM 150 N PRO A 13 5.205 -0.400 1.678 1.00 0.00 N ATOM 151 CA PRO A 13 5.398 0.036 3.086 1.00 0.00 C ATOM 152 C PRO A 13 5.949 1.468 3.128 1.00 0.00 C ATOM 153 O PRO A 13 5.632 2.238 4.014 1.00 0.00 O ATOM 154 CB PRO A 13 6.406 -0.971 3.639 1.00 0.00 C ATOM 155 CG PRO A 13 7.133 -1.491 2.438 1.00 0.00 C ATOM 156 CD PRO A 13 6.147 -1.468 1.302 1.00 0.00 C ATOM 157 HA PRO A 13 4.471 -0.028 3.637 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.094 -0.484 4.318 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.894 -1.778 4.136 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.981 -0.858 2.213 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.462 -2.504 2.612 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.646 -1.233 0.370 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.628 -2.410 1.230 1.00 0.00 H ATOM 164 N GLN A 14 6.762 1.835 2.171 1.00 0.00 N ATOM 165 CA GLN A 14 7.316 3.224 2.149 1.00 0.00 C ATOM 166 C GLN A 14 6.194 4.243 1.905 1.00 0.00 C ATOM 167 O GLN A 14 6.344 5.413 2.190 1.00 0.00 O ATOM 168 CB GLN A 14 8.345 3.247 1.010 1.00 0.00 C ATOM 169 CG GLN A 14 7.650 3.120 -0.353 1.00 0.00 C ATOM 170 CD GLN A 14 7.763 1.682 -0.870 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.689 0.738 -0.102 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.937 1.470 -2.142 1.00 0.00 N ATOM 173 H GLN A 14 6.996 1.201 1.460 1.00 0.00 H ATOM 174 HA GLN A 14 7.803 3.436 3.084 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.890 4.178 1.045 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.035 2.425 1.136 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.611 3.387 -0.254 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.125 3.788 -1.056 1.00 0.00 H ATOM 179 HE21 GLN A 14 7.990 2.227 -2.765 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.029 0.554 -2.477 1.00 0.00 H ATOM 181 N ILE A 15 5.075 3.805 1.386 1.00 0.00 N ATOM 182 CA ILE A 15 3.941 4.742 1.131 1.00 0.00 C ATOM 183 C ILE A 15 2.923 4.649 2.273 1.00 0.00 C ATOM 184 O ILE A 15 2.372 5.641 2.703 1.00 0.00 O ATOM 185 CB ILE A 15 3.307 4.275 -0.191 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.372 4.173 -1.290 1.00 0.00 C ATOM 187 CG2 ILE A 15 2.236 5.271 -0.631 1.00 0.00 C ATOM 188 CD1 ILE A 15 5.061 5.531 -1.477 1.00 0.00 C ATOM 189 H ILE A 15 4.980 2.859 1.172 1.00 0.00 H ATOM 190 HA ILE A 15 4.303 5.754 1.030 1.00 0.00 H ATOM 191 HB ILE A 15 2.850 3.307 -0.044 1.00 0.00 H ATOM 192 HG12 ILE A 15 5.103 3.429 -1.013 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.901 3.882 -2.218 1.00 0.00 H ATOM 194 HG21 ILE A 15 2.371 5.502 -1.676 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.325 6.175 -0.048 1.00 0.00 H ATOM 196 HG23 ILE A 15 1.260 4.839 -0.482 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.324 6.280 -1.739 1.00 0.00 H ATOM 198 HD12 ILE A 15 5.793 5.456 -2.268 1.00 0.00 H ATOM 199 HD13 ILE A 15 5.552 5.815 -0.561 1.00 0.00 H ATOM 200 N CYS A 16 2.665 3.462 2.764 1.00 0.00 N ATOM 201 CA CYS A 16 1.677 3.310 3.875 1.00 0.00 C ATOM 202 C CYS A 16 2.393 2.891 5.162 1.00 0.00 C ATOM 203 O CYS A 16 2.283 3.551 6.176 1.00 0.00 O ATOM 204 CB CYS A 16 0.712 2.214 3.418 1.00 0.00 C ATOM 205 SG CYS A 16 -0.288 2.828 2.043 1.00 0.00 S ATOM 206 H CYS A 16 3.118 2.671 2.401 1.00 0.00 H ATOM 207 HA CYS A 16 1.140 4.233 4.027 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.273 1.347 3.099 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.062 1.945 4.237 1.00 0.00 H HETATM 210 N NH2 A 17 3.131 1.817 5.169 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.226 1.280 4.358 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.594 1.551 5.987 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 12 ATOM 1 N GLY A 1 -6.155 5.692 -3.441 1.00 0.00 N ATOM 2 CA GLY A 1 -4.732 5.820 -3.038 1.00 0.00 C ATOM 3 C GLY A 1 -4.157 4.426 -2.794 1.00 0.00 C ATOM 4 O GLY A 1 -4.774 3.431 -3.122 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.487 6.592 -3.834 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.725 5.442 -2.607 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.246 4.948 -4.160 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.180 6.303 -3.831 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.660 6.403 -2.134 1.00 0.00 H ATOM 10 N CYS A 2 -2.983 4.336 -2.224 1.00 0.00 N ATOM 11 CA CYS A 2 -2.391 2.988 -1.977 1.00 0.00 C ATOM 12 C CYS A 2 -2.846 2.449 -0.626 1.00 0.00 C ATOM 13 O CYS A 2 -3.331 1.340 -0.522 1.00 0.00 O ATOM 14 CB CYS A 2 -0.876 3.187 -1.992 1.00 0.00 C ATOM 15 SG CYS A 2 -0.064 1.627 -2.437 1.00 0.00 S ATOM 16 H CYS A 2 -2.496 5.146 -1.966 1.00 0.00 H ATOM 17 HA CYS A 2 -2.677 2.315 -2.755 1.00 0.00 H ATOM 18 HB2 CYS A 2 -0.624 3.947 -2.712 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.542 3.500 -1.011 1.00 0.00 H ATOM 20 N CYS A 3 -2.697 3.232 0.402 1.00 0.00 N ATOM 21 CA CYS A 3 -3.118 2.787 1.771 1.00 0.00 C ATOM 22 C CYS A 3 -4.592 2.359 1.773 1.00 0.00 C ATOM 23 O CYS A 3 -5.009 1.542 2.572 1.00 0.00 O ATOM 24 CB CYS A 3 -2.895 3.998 2.685 1.00 0.00 C ATOM 25 SG CYS A 3 -1.118 4.375 2.799 1.00 0.00 S ATOM 26 H CYS A 3 -2.304 4.117 0.272 1.00 0.00 H ATOM 27 HA CYS A 3 -2.500 1.968 2.099 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.418 4.852 2.282 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.276 3.779 3.672 1.00 0.00 H ATOM 30 N SER A 4 -5.380 2.884 0.873 1.00 0.00 N ATOM 31 CA SER A 4 -6.818 2.491 0.812 1.00 0.00 C ATOM 32 C SER A 4 -6.948 1.022 0.386 1.00 0.00 C ATOM 33 O SER A 4 -7.923 0.365 0.697 1.00 0.00 O ATOM 34 CB SER A 4 -7.438 3.412 -0.241 1.00 0.00 C ATOM 35 OG SER A 4 -6.433 3.832 -1.166 1.00 0.00 O ATOM 36 H SER A 4 -5.028 3.530 0.227 1.00 0.00 H ATOM 37 HA SER A 4 -7.293 2.650 1.767 1.00 0.00 H ATOM 38 HB2 SER A 4 -8.213 2.885 -0.771 1.00 0.00 H ATOM 39 HB3 SER A 4 -7.870 4.275 0.251 1.00 0.00 H ATOM 40 HG SER A 4 -6.440 3.213 -1.908 1.00 0.00 H ATOM 41 N ASN A 5 -5.977 0.506 -0.328 1.00 0.00 N ATOM 42 CA ASN A 5 -6.041 -0.918 -0.782 1.00 0.00 C ATOM 43 C ASN A 5 -5.016 -1.759 -0.016 1.00 0.00 C ATOM 44 O ASN A 5 -3.852 -1.408 0.031 1.00 0.00 O ATOM 45 CB ASN A 5 -5.685 -0.856 -2.270 1.00 0.00 C ATOM 46 CG ASN A 5 -5.759 -2.252 -2.901 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.660 -3.253 -2.221 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.915 -2.365 -4.186 1.00 0.00 N ATOM 49 H ASN A 5 -5.199 1.057 -0.569 1.00 0.00 H ATOM 50 HA ASN A 5 -7.036 -1.313 -0.655 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.380 -0.198 -2.772 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.684 -0.467 -2.379 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.985 -1.561 -4.747 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.963 -3.254 -4.596 1.00 0.00 H ATOM 55 N PRO A 6 -5.467 -2.859 0.552 1.00 0.00 N ATOM 56 CA PRO A 6 -4.554 -3.749 1.317 1.00 0.00 C ATOM 57 C PRO A 6 -3.463 -4.310 0.399 1.00 0.00 C ATOM 58 O PRO A 6 -2.321 -4.436 0.797 1.00 0.00 O ATOM 59 CB PRO A 6 -5.476 -4.846 1.849 1.00 0.00 C ATOM 60 CG PRO A 6 -6.651 -4.833 0.929 1.00 0.00 C ATOM 61 CD PRO A 6 -6.839 -3.395 0.524 1.00 0.00 C ATOM 62 HA PRO A 6 -4.112 -3.211 2.141 1.00 0.00 H ATOM 63 HB2 PRO A 6 -4.976 -5.803 1.813 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.792 -4.619 2.854 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.451 -5.447 0.060 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.531 -5.185 1.443 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.261 -3.335 -0.471 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.460 -2.876 1.236 1.00 0.00 H ATOM 69 N ALA A 7 -3.795 -4.612 -0.833 1.00 0.00 N ATOM 70 CA ALA A 7 -2.757 -5.123 -1.782 1.00 0.00 C ATOM 71 C ALA A 7 -1.753 -3.997 -2.038 1.00 0.00 C ATOM 72 O ALA A 7 -0.551 -4.194 -1.975 1.00 0.00 O ATOM 73 CB ALA A 7 -3.502 -5.487 -3.073 1.00 0.00 C ATOM 74 H ALA A 7 -4.720 -4.475 -1.141 1.00 0.00 H ATOM 75 HA ALA A 7 -2.257 -5.989 -1.375 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.593 -4.608 -3.699 1.00 0.00 H ATOM 77 HB2 ALA A 7 -4.484 -5.860 -2.832 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.948 -6.249 -3.607 1.00 0.00 H ATOM 79 N CYS A 8 -2.244 -2.808 -2.297 1.00 0.00 N ATOM 80 CA CYS A 8 -1.326 -1.656 -2.528 1.00 0.00 C ATOM 81 C CYS A 8 -0.525 -1.383 -1.251 1.00 0.00 C ATOM 82 O CYS A 8 0.668 -1.150 -1.301 1.00 0.00 O ATOM 83 CB CYS A 8 -2.228 -0.467 -2.869 1.00 0.00 C ATOM 84 SG CYS A 8 -1.279 0.764 -3.808 1.00 0.00 S ATOM 85 H CYS A 8 -3.214 -2.677 -2.318 1.00 0.00 H ATOM 86 HA CYS A 8 -0.665 -1.864 -3.352 1.00 0.00 H ATOM 87 HB2 CYS A 8 -3.059 -0.809 -3.466 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.597 -0.024 -1.958 1.00 0.00 H ATOM 89 N MET A 9 -1.168 -1.439 -0.105 1.00 0.00 N ATOM 90 CA MET A 9 -0.445 -1.215 1.183 1.00 0.00 C ATOM 91 C MET A 9 0.772 -2.137 1.248 1.00 0.00 C ATOM 92 O MET A 9 1.870 -1.713 1.553 1.00 0.00 O ATOM 93 CB MET A 9 -1.451 -1.585 2.272 1.00 0.00 C ATOM 94 CG MET A 9 -2.504 -0.480 2.412 1.00 0.00 C ATOM 95 SD MET A 9 -2.398 0.255 4.068 1.00 0.00 S ATOM 96 CE MET A 9 -3.708 -0.725 4.841 1.00 0.00 C ATOM 97 H MET A 9 -2.126 -1.649 -0.089 1.00 0.00 H ATOM 98 HA MET A 9 -0.150 -0.185 1.282 1.00 0.00 H ATOM 99 HB2 MET A 9 -1.934 -2.514 2.013 1.00 0.00 H ATOM 100 HB3 MET A 9 -0.932 -1.705 3.205 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.326 0.280 1.663 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.488 -0.901 2.266 1.00 0.00 H ATOM 103 HE1 MET A 9 -3.532 -0.782 5.907 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.715 -1.719 4.420 1.00 0.00 H ATOM 105 HE3 MET A 9 -4.658 -0.257 4.659 1.00 0.00 H ATOM 106 N VAL A 10 0.584 -3.396 0.940 1.00 0.00 N ATOM 107 CA VAL A 10 1.724 -4.359 0.957 1.00 0.00 C ATOM 108 C VAL A 10 2.751 -3.951 -0.108 1.00 0.00 C ATOM 109 O VAL A 10 3.946 -3.981 0.123 1.00 0.00 O ATOM 110 CB VAL A 10 1.097 -5.717 0.614 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.194 -6.752 0.341 1.00 0.00 C ATOM 112 CG2 VAL A 10 0.232 -6.191 1.782 1.00 0.00 C ATOM 113 H VAL A 10 -0.313 -3.705 0.685 1.00 0.00 H ATOM 114 HA VAL A 10 2.184 -4.392 1.934 1.00 0.00 H ATOM 115 HB VAL A 10 0.482 -5.609 -0.266 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.688 -6.517 -0.590 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.752 -7.736 0.278 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.917 -6.733 1.144 1.00 0.00 H ATOM 119 HG21 VAL A 10 0.029 -5.357 2.442 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.754 -6.966 2.326 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.700 -6.581 1.404 1.00 0.00 H ATOM 122 N ASN A 11 2.287 -3.563 -1.269 1.00 0.00 N ATOM 123 CA ASN A 11 3.225 -3.144 -2.355 1.00 0.00 C ATOM 124 C ASN A 11 3.938 -1.847 -1.967 1.00 0.00 C ATOM 125 O ASN A 11 5.079 -1.629 -2.327 1.00 0.00 O ATOM 126 CB ASN A 11 2.356 -2.909 -3.594 1.00 0.00 C ATOM 127 CG ASN A 11 2.075 -4.240 -4.296 1.00 0.00 C ATOM 128 OD1 ASN A 11 2.692 -4.559 -5.298 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.163 -5.038 -3.819 1.00 0.00 N ATOM 130 H ASN A 11 1.320 -3.545 -1.423 1.00 0.00 H ATOM 131 HA ASN A 11 3.943 -3.922 -2.551 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.423 -2.455 -3.296 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.874 -2.250 -4.273 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.658 -4.786 -3.013 1.00 0.00 H ATOM 135 HD22 ASN A 11 0.971 -5.887 -4.268 1.00 0.00 H ATOM 136 N ASN A 12 3.271 -0.978 -1.243 1.00 0.00 N ATOM 137 CA ASN A 12 3.906 0.314 -0.841 1.00 0.00 C ATOM 138 C ASN A 12 4.085 0.373 0.685 1.00 0.00 C ATOM 139 O ASN A 12 3.361 1.075 1.371 1.00 0.00 O ATOM 140 CB ASN A 12 2.925 1.397 -1.311 1.00 0.00 C ATOM 141 CG ASN A 12 3.288 1.862 -2.729 1.00 0.00 C ATOM 142 OD1 ASN A 12 3.416 3.043 -2.978 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.446 0.983 -3.678 1.00 0.00 N ATOM 144 H ASN A 12 2.345 -1.173 -0.970 1.00 0.00 H ATOM 145 HA ASN A 12 4.855 0.438 -1.338 1.00 0.00 H ATOM 146 HB2 ASN A 12 1.924 0.990 -1.316 1.00 0.00 H ATOM 147 HB3 ASN A 12 2.967 2.239 -0.636 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.335 0.032 -3.490 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.671 1.278 -4.584 1.00 0.00 H ATOM 150 N PRO A 13 5.057 -0.362 1.174 1.00 0.00 N ATOM 151 CA PRO A 13 5.334 -0.385 2.636 1.00 0.00 C ATOM 152 C PRO A 13 5.918 0.959 3.098 1.00 0.00 C ATOM 153 O PRO A 13 5.681 1.400 4.211 1.00 0.00 O ATOM 154 CB PRO A 13 6.357 -1.508 2.793 1.00 0.00 C ATOM 155 CG PRO A 13 7.013 -1.625 1.452 1.00 0.00 C ATOM 156 CD PRO A 13 5.981 -1.231 0.428 1.00 0.00 C ATOM 157 HA PRO A 13 4.440 -0.621 3.189 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.083 -1.246 3.550 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.861 -2.432 3.047 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.863 -0.961 1.398 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.327 -2.643 1.280 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.446 -0.691 -0.389 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.461 -2.105 0.062 1.00 0.00 H ATOM 164 N GLN A 14 6.669 1.619 2.252 1.00 0.00 N ATOM 165 CA GLN A 14 7.258 2.940 2.635 1.00 0.00 C ATOM 166 C GLN A 14 6.161 4.007 2.755 1.00 0.00 C ATOM 167 O GLN A 14 6.377 5.064 3.313 1.00 0.00 O ATOM 168 CB GLN A 14 8.260 3.283 1.512 1.00 0.00 C ATOM 169 CG GLN A 14 7.549 3.961 0.328 1.00 0.00 C ATOM 170 CD GLN A 14 7.089 2.905 -0.682 1.00 0.00 C ATOM 171 OE1 GLN A 14 6.427 1.952 -0.325 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.412 3.033 -1.933 1.00 0.00 N ATOM 173 H GLN A 14 6.837 1.249 1.360 1.00 0.00 H ATOM 174 HA GLN A 14 7.779 2.851 3.569 1.00 0.00 H ATOM 175 HB2 GLN A 14 9.014 3.952 1.899 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.734 2.377 1.169 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.695 4.513 0.686 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.233 4.642 -0.157 1.00 0.00 H ATOM 179 HE21 GLN A 14 7.943 3.800 -2.227 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.119 2.360 -2.582 1.00 0.00 H ATOM 181 N ILE A 15 4.991 3.746 2.235 1.00 0.00 N ATOM 182 CA ILE A 15 3.897 4.754 2.324 1.00 0.00 C ATOM 183 C ILE A 15 2.860 4.334 3.375 1.00 0.00 C ATOM 184 O ILE A 15 2.465 5.123 4.210 1.00 0.00 O ATOM 185 CB ILE A 15 3.279 4.792 0.920 1.00 0.00 C ATOM 186 CG1 ILE A 15 4.284 5.425 -0.050 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.989 5.616 0.938 1.00 0.00 C ATOM 188 CD1 ILE A 15 3.626 5.650 -1.415 1.00 0.00 C ATOM 189 H ILE A 15 4.838 2.894 1.787 1.00 0.00 H ATOM 190 HA ILE A 15 4.306 5.722 2.570 1.00 0.00 H ATOM 191 HB ILE A 15 3.059 3.785 0.601 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.623 6.373 0.348 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.128 4.763 -0.164 1.00 0.00 H ATOM 194 HG21 ILE A 15 2.107 6.450 1.610 1.00 0.00 H ATOM 195 HG22 ILE A 15 1.171 4.996 1.271 1.00 0.00 H ATOM 196 HG23 ILE A 15 1.779 5.980 -0.057 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.213 5.170 -2.183 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.572 6.709 -1.620 1.00 0.00 H ATOM 199 HD13 ILE A 15 2.629 5.231 -1.410 1.00 0.00 H ATOM 200 N CYS A 16 2.403 3.107 3.338 1.00 0.00 N ATOM 201 CA CYS A 16 1.379 2.667 4.339 1.00 0.00 C ATOM 202 C CYS A 16 2.026 1.824 5.445 1.00 0.00 C ATOM 203 O CYS A 16 1.494 1.715 6.536 1.00 0.00 O ATOM 204 CB CYS A 16 0.368 1.827 3.548 1.00 0.00 C ATOM 205 SG CYS A 16 -0.174 2.737 2.073 1.00 0.00 S ATOM 206 H CYS A 16 2.722 2.481 2.652 1.00 0.00 H ATOM 207 HA CYS A 16 0.883 3.525 4.769 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.827 0.899 3.245 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.485 1.613 4.177 1.00 0.00 H HETATM 210 N NH2 A 17 3.151 1.214 5.217 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.589 1.297 4.344 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.565 0.669 5.920 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 13 ATOM 1 N GLY A 1 -6.639 6.223 -0.989 1.00 0.00 N ATOM 2 CA GLY A 1 -5.302 6.343 -1.624 1.00 0.00 C ATOM 3 C GLY A 1 -4.649 4.965 -1.740 1.00 0.00 C ATOM 4 O GLY A 1 -5.281 3.946 -1.530 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.361 6.092 -1.721 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.843 7.090 -0.458 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.644 5.405 -0.340 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.412 6.767 -2.608 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.676 6.985 -1.024 1.00 0.00 H ATOM 10 N CYS A 2 -3.387 4.925 -2.079 1.00 0.00 N ATOM 11 CA CYS A 2 -2.685 3.611 -2.215 1.00 0.00 C ATOM 12 C CYS A 2 -2.842 2.793 -0.936 1.00 0.00 C ATOM 13 O CYS A 2 -3.117 1.611 -0.973 1.00 0.00 O ATOM 14 CB CYS A 2 -1.215 3.957 -2.446 1.00 0.00 C ATOM 15 SG CYS A 2 -0.450 2.687 -3.480 1.00 0.00 S ATOM 16 H CYS A 2 -2.899 5.760 -2.246 1.00 0.00 H ATOM 17 HA CYS A 2 -3.072 3.068 -3.053 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.142 4.915 -2.931 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.703 3.996 -1.495 1.00 0.00 H ATOM 20 N CYS A 3 -2.681 3.423 0.191 1.00 0.00 N ATOM 21 CA CYS A 3 -2.826 2.696 1.494 1.00 0.00 C ATOM 22 C CYS A 3 -4.213 2.045 1.589 1.00 0.00 C ATOM 23 O CYS A 3 -4.371 0.993 2.173 1.00 0.00 O ATOM 24 CB CYS A 3 -2.651 3.758 2.581 1.00 0.00 C ATOM 25 SG CYS A 3 -0.904 4.234 2.684 1.00 0.00 S ATOM 26 H CYS A 3 -2.468 4.378 0.179 1.00 0.00 H ATOM 27 HA CYS A 3 -2.055 1.948 1.589 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.250 4.624 2.337 1.00 0.00 H ATOM 29 HB3 CYS A 3 -2.973 3.355 3.531 1.00 0.00 H ATOM 30 N SER A 4 -5.214 2.654 1.005 1.00 0.00 N ATOM 31 CA SER A 4 -6.582 2.056 1.047 1.00 0.00 C ATOM 32 C SER A 4 -6.606 0.739 0.251 1.00 0.00 C ATOM 33 O SER A 4 -7.454 -0.107 0.464 1.00 0.00 O ATOM 34 CB SER A 4 -7.496 3.098 0.396 1.00 0.00 C ATOM 35 OG SER A 4 -7.020 4.413 0.703 1.00 0.00 O ATOM 36 H SER A 4 -5.070 3.497 0.531 1.00 0.00 H ATOM 37 HA SER A 4 -6.884 1.885 2.069 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.491 2.961 -0.672 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.504 2.971 0.769 1.00 0.00 H ATOM 40 HG SER A 4 -7.406 4.679 1.550 1.00 0.00 H ATOM 41 N ASN A 5 -5.678 0.554 -0.657 1.00 0.00 N ATOM 42 CA ASN A 5 -5.644 -0.712 -1.449 1.00 0.00 C ATOM 43 C ASN A 5 -4.831 -1.757 -0.686 1.00 0.00 C ATOM 44 O ASN A 5 -3.695 -1.503 -0.337 1.00 0.00 O ATOM 45 CB ASN A 5 -4.941 -0.345 -2.762 1.00 0.00 C ATOM 46 CG ASN A 5 -5.245 -1.399 -3.835 1.00 0.00 C ATOM 47 OD1 ASN A 5 -6.008 -2.319 -3.611 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.673 -1.305 -5.000 1.00 0.00 N ATOM 49 H ASN A 5 -4.996 1.242 -0.812 1.00 0.00 H ATOM 50 HA ASN A 5 -6.642 -1.067 -1.645 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.292 0.620 -3.097 1.00 0.00 H ATOM 52 HB3 ASN A 5 -3.871 -0.304 -2.598 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.053 -0.569 -5.186 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.870 -1.966 -5.697 1.00 0.00 H ATOM 55 N PRO A 6 -5.420 -2.907 -0.459 1.00 0.00 N ATOM 56 CA PRO A 6 -4.711 -3.987 0.276 1.00 0.00 C ATOM 57 C PRO A 6 -3.451 -4.400 -0.483 1.00 0.00 C ATOM 58 O PRO A 6 -2.415 -4.634 0.111 1.00 0.00 O ATOM 59 CB PRO A 6 -5.745 -5.112 0.344 1.00 0.00 C ATOM 60 CG PRO A 6 -6.686 -4.828 -0.779 1.00 0.00 C ATOM 61 CD PRO A 6 -6.769 -3.327 -0.861 1.00 0.00 C ATOM 62 HA PRO A 6 -4.457 -3.665 1.270 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.265 -6.071 0.203 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.270 -5.083 1.287 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.304 -5.240 -1.704 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.661 -5.234 -0.561 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.988 -3.014 -1.871 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.505 -2.948 -0.169 1.00 0.00 H ATOM 69 N ALA A 7 -3.519 -4.465 -1.788 1.00 0.00 N ATOM 70 CA ALA A 7 -2.310 -4.837 -2.575 1.00 0.00 C ATOM 71 C ALA A 7 -1.216 -3.793 -2.332 1.00 0.00 C ATOM 72 O ALA A 7 -0.088 -4.127 -2.027 1.00 0.00 O ATOM 73 CB ALA A 7 -2.745 -4.822 -4.039 1.00 0.00 C ATOM 74 H ALA A 7 -4.361 -4.254 -2.247 1.00 0.00 H ATOM 75 HA ALA A 7 -1.966 -5.822 -2.297 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.291 -3.981 -4.540 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.819 -4.737 -4.093 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.434 -5.738 -4.520 1.00 0.00 H ATOM 79 N CYS A 8 -1.550 -2.526 -2.450 1.00 0.00 N ATOM 80 CA CYS A 8 -0.526 -1.460 -2.209 1.00 0.00 C ATOM 81 C CYS A 8 -0.126 -1.452 -0.731 1.00 0.00 C ATOM 82 O CYS A 8 1.040 -1.404 -0.405 1.00 0.00 O ATOM 83 CB CYS A 8 -1.171 -0.125 -2.593 1.00 0.00 C ATOM 84 SG CYS A 8 -0.022 1.216 -2.173 1.00 0.00 S ATOM 85 H CYS A 8 -2.469 -2.282 -2.684 1.00 0.00 H ATOM 86 HA CYS A 8 0.339 -1.631 -2.822 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.367 -0.112 -3.652 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.096 0.006 -2.052 1.00 0.00 H ATOM 89 N MET A 9 -1.077 -1.503 0.167 1.00 0.00 N ATOM 90 CA MET A 9 -0.732 -1.505 1.624 1.00 0.00 C ATOM 91 C MET A 9 0.350 -2.558 1.910 1.00 0.00 C ATOM 92 O MET A 9 1.276 -2.322 2.668 1.00 0.00 O ATOM 93 CB MET A 9 -2.038 -1.865 2.346 1.00 0.00 C ATOM 94 CG MET A 9 -2.271 -0.896 3.510 1.00 0.00 C ATOM 95 SD MET A 9 -3.491 -1.592 4.651 1.00 0.00 S ATOM 96 CE MET A 9 -4.795 -1.937 3.442 1.00 0.00 C ATOM 97 H MET A 9 -2.019 -1.545 -0.116 1.00 0.00 H ATOM 98 HA MET A 9 -0.397 -0.527 1.930 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.862 -1.797 1.651 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.971 -2.872 2.725 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.344 -0.741 4.041 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.633 0.051 3.128 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.639 -1.325 2.565 1.00 0.00 H ATOM 104 HE2 MET A 9 -5.764 -1.718 3.874 1.00 0.00 H ATOM 105 HE3 MET A 9 -4.759 -2.979 3.164 1.00 0.00 H ATOM 106 N VAL A 10 0.229 -3.716 1.314 1.00 0.00 N ATOM 107 CA VAL A 10 1.235 -4.794 1.549 1.00 0.00 C ATOM 108 C VAL A 10 2.461 -4.611 0.641 1.00 0.00 C ATOM 109 O VAL A 10 3.588 -4.694 1.097 1.00 0.00 O ATOM 110 CB VAL A 10 0.498 -6.106 1.225 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.454 -7.294 1.366 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.669 -6.289 2.200 1.00 0.00 C ATOM 113 H VAL A 10 -0.531 -3.879 0.716 1.00 0.00 H ATOM 114 HA VAL A 10 1.538 -4.793 2.583 1.00 0.00 H ATOM 115 HB VAL A 10 0.120 -6.069 0.216 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.307 -7.154 0.715 1.00 0.00 H ATOM 117 HG12 VAL A 10 0.942 -8.207 1.097 1.00 0.00 H ATOM 118 HG13 VAL A 10 1.791 -7.358 2.388 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.317 -6.144 3.213 1.00 0.00 H ATOM 120 HG22 VAL A 10 -1.073 -7.289 2.096 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.439 -5.567 1.978 1.00 0.00 H ATOM 122 N ASN A 11 2.260 -4.381 -0.634 1.00 0.00 N ATOM 123 CA ASN A 11 3.430 -4.219 -1.562 1.00 0.00 C ATOM 124 C ASN A 11 4.097 -2.849 -1.418 1.00 0.00 C ATOM 125 O ASN A 11 5.246 -2.683 -1.775 1.00 0.00 O ATOM 126 CB ASN A 11 2.870 -4.360 -2.977 1.00 0.00 C ATOM 127 CG ASN A 11 2.622 -5.833 -3.294 1.00 0.00 C ATOM 128 OD1 ASN A 11 1.567 -6.186 -3.780 1.00 0.00 O ATOM 129 ND2 ASN A 11 3.553 -6.713 -3.052 1.00 0.00 N ATOM 130 H ASN A 11 1.342 -4.333 -0.984 1.00 0.00 H ATOM 131 HA ASN A 11 4.151 -4.997 -1.382 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.943 -3.809 -3.054 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.582 -3.959 -3.683 1.00 0.00 H ATOM 134 HD21 ASN A 11 4.410 -6.431 -2.671 1.00 0.00 H ATOM 135 HD22 ASN A 11 3.395 -7.659 -3.249 1.00 0.00 H ATOM 136 N ASN A 12 3.397 -1.863 -0.929 1.00 0.00 N ATOM 137 CA ASN A 12 4.010 -0.509 -0.805 1.00 0.00 C ATOM 138 C ASN A 12 3.980 -0.024 0.647 1.00 0.00 C ATOM 139 O ASN A 12 3.207 0.853 0.989 1.00 0.00 O ATOM 140 CB ASN A 12 3.154 0.395 -1.696 1.00 0.00 C ATOM 141 CG ASN A 12 3.876 0.632 -3.021 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.791 1.429 -3.089 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.508 -0.031 -4.079 1.00 0.00 N ATOM 144 H ASN A 12 2.461 -2.004 -0.656 1.00 0.00 H ATOM 145 HA ASN A 12 5.024 -0.523 -1.174 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.201 -0.077 -1.881 1.00 0.00 H ATOM 147 HB3 ASN A 12 2.993 1.340 -1.202 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.773 -0.674 -4.025 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.972 0.108 -4.929 1.00 0.00 H ATOM 150 N PRO A 13 4.849 -0.583 1.454 1.00 0.00 N ATOM 151 CA PRO A 13 4.931 -0.168 2.879 1.00 0.00 C ATOM 152 C PRO A 13 5.446 1.274 2.964 1.00 0.00 C ATOM 153 O PRO A 13 5.085 2.018 3.852 1.00 0.00 O ATOM 154 CB PRO A 13 5.929 -1.157 3.485 1.00 0.00 C ATOM 155 CG PRO A 13 6.750 -1.635 2.327 1.00 0.00 C ATOM 156 CD PRO A 13 5.831 -1.630 1.131 1.00 0.00 C ATOM 157 HA PRO A 13 3.972 -0.263 3.364 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.553 -0.657 4.214 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.411 -1.987 3.937 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.586 -0.967 2.160 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.105 -2.640 2.507 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.377 -1.380 0.232 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.338 -2.582 1.028 1.00 0.00 H ATOM 164 N GLN A 14 6.285 1.666 2.033 1.00 0.00 N ATOM 165 CA GLN A 14 6.836 3.060 2.037 1.00 0.00 C ATOM 166 C GLN A 14 5.710 4.097 1.943 1.00 0.00 C ATOM 167 O GLN A 14 5.851 5.217 2.396 1.00 0.00 O ATOM 168 CB GLN A 14 7.754 3.155 0.810 1.00 0.00 C ATOM 169 CG GLN A 14 7.051 2.590 -0.441 1.00 0.00 C ATOM 170 CD GLN A 14 7.239 3.548 -1.618 1.00 0.00 C ATOM 171 OE1 GLN A 14 8.210 4.275 -1.675 1.00 0.00 O ATOM 172 NE2 GLN A 14 6.356 3.574 -2.572 1.00 0.00 N ATOM 173 H GLN A 14 6.554 1.040 1.331 1.00 0.00 H ATOM 174 HA GLN A 14 7.407 3.219 2.931 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.006 4.190 0.639 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.659 2.596 0.995 1.00 0.00 H ATOM 177 HG2 GLN A 14 7.476 1.626 -0.692 1.00 0.00 H ATOM 178 HG3 GLN A 14 5.997 2.474 -0.245 1.00 0.00 H ATOM 179 HE21 GLN A 14 5.572 2.980 -2.536 1.00 0.00 H ATOM 180 HE22 GLN A 14 6.473 4.181 -3.329 1.00 0.00 H ATOM 181 N ILE A 15 4.601 3.735 1.365 1.00 0.00 N ATOM 182 CA ILE A 15 3.464 4.700 1.249 1.00 0.00 C ATOM 183 C ILE A 15 2.741 4.797 2.596 1.00 0.00 C ATOM 184 O ILE A 15 2.354 5.869 3.024 1.00 0.00 O ATOM 185 CB ILE A 15 2.525 4.127 0.174 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.301 3.866 -1.122 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.404 5.128 -0.117 1.00 0.00 C ATOM 188 CD1 ILE A 15 3.835 5.193 -1.685 1.00 0.00 C ATOM 189 H ILE A 15 4.512 2.830 1.015 1.00 0.00 H ATOM 190 HA ILE A 15 3.825 5.671 0.947 1.00 0.00 H ATOM 191 HB ILE A 15 2.091 3.201 0.532 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.128 3.203 -0.917 1.00 0.00 H ATOM 193 HG13 ILE A 15 2.644 3.409 -1.847 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.828 6.038 -0.512 1.00 0.00 H ATOM 195 HG22 ILE A 15 0.868 5.345 0.795 1.00 0.00 H ATOM 196 HG23 ILE A 15 0.725 4.709 -0.842 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.010 5.090 -2.746 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.762 5.450 -1.188 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.108 5.977 -1.516 1.00 0.00 H ATOM 200 N CYS A 16 2.556 3.689 3.266 1.00 0.00 N ATOM 201 CA CYS A 16 1.849 3.718 4.586 1.00 0.00 C ATOM 202 C CYS A 16 2.847 3.500 5.730 1.00 0.00 C ATOM 203 O CYS A 16 2.544 2.844 6.707 1.00 0.00 O ATOM 204 CB CYS A 16 0.831 2.571 4.529 1.00 0.00 C ATOM 205 SG CYS A 16 0.091 2.485 2.872 1.00 0.00 S ATOM 206 H CYS A 16 2.876 2.834 2.902 1.00 0.00 H ATOM 207 HA CYS A 16 1.331 4.657 4.712 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.329 1.640 4.752 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.056 2.745 5.261 1.00 0.00 H HETATM 210 N NH2 A 17 4.038 4.025 5.651 1.00 0.00 N HETATM 211 HN1 NH2 A 17 4.290 4.556 4.868 1.00 0.00 H HETATM 212 HN2 NH2 A 17 4.682 3.885 6.375 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 14 ATOM 1 N GLY A 1 -6.839 6.225 -1.141 1.00 0.00 N ATOM 2 CA GLY A 1 -5.497 6.312 -1.784 1.00 0.00 C ATOM 3 C GLY A 1 -4.805 4.954 -1.729 1.00 0.00 C ATOM 4 O GLY A 1 -5.431 3.937 -1.476 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.576 6.338 -1.864 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.928 6.977 -0.428 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.951 5.296 -0.680 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.615 6.609 -2.811 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.892 7.044 -1.265 1.00 0.00 H ATOM 10 N CYS A 2 -3.519 4.920 -1.961 1.00 0.00 N ATOM 11 CA CYS A 2 -2.788 3.620 -1.924 1.00 0.00 C ATOM 12 C CYS A 2 -3.051 2.892 -0.608 1.00 0.00 C ATOM 13 O CYS A 2 -3.184 1.683 -0.579 1.00 0.00 O ATOM 14 CB CYS A 2 -1.307 3.972 -2.051 1.00 0.00 C ATOM 15 SG CYS A 2 -0.524 2.826 -3.217 1.00 0.00 S ATOM 16 H CYS A 2 -3.037 5.751 -2.161 1.00 0.00 H ATOM 17 HA CYS A 2 -3.092 3.011 -2.747 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.202 4.985 -2.409 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.837 3.885 -1.084 1.00 0.00 H ATOM 20 N CYS A 3 -3.141 3.614 0.475 1.00 0.00 N ATOM 21 CA CYS A 3 -3.413 2.963 1.797 1.00 0.00 C ATOM 22 C CYS A 3 -4.753 2.213 1.742 1.00 0.00 C ATOM 23 O CYS A 3 -4.923 1.181 2.369 1.00 0.00 O ATOM 24 CB CYS A 3 -3.472 4.100 2.821 1.00 0.00 C ATOM 25 SG CYS A 3 -2.211 3.829 4.093 1.00 0.00 S ATOM 26 H CYS A 3 -3.041 4.586 0.415 1.00 0.00 H ATOM 27 HA CYS A 3 -2.613 2.284 2.046 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.285 5.041 2.329 1.00 0.00 H ATOM 29 HB3 CYS A 3 -4.448 4.120 3.281 1.00 0.00 H ATOM 30 N SER A 4 -5.700 2.711 0.984 1.00 0.00 N ATOM 31 CA SER A 4 -7.020 2.023 0.869 1.00 0.00 C ATOM 32 C SER A 4 -6.886 0.746 0.023 1.00 0.00 C ATOM 33 O SER A 4 -7.765 -0.096 0.015 1.00 0.00 O ATOM 34 CB SER A 4 -7.951 3.027 0.174 1.00 0.00 C ATOM 35 OG SER A 4 -7.516 4.362 0.447 1.00 0.00 O ATOM 36 H SER A 4 -5.540 3.534 0.478 1.00 0.00 H ATOM 37 HA SER A 4 -7.403 1.785 1.848 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.934 2.859 -0.892 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.960 2.884 0.538 1.00 0.00 H ATOM 40 HG SER A 4 -7.835 4.597 1.323 1.00 0.00 H ATOM 41 N ASN A 5 -5.795 0.592 -0.687 1.00 0.00 N ATOM 42 CA ASN A 5 -5.602 -0.627 -1.525 1.00 0.00 C ATOM 43 C ASN A 5 -4.801 -1.665 -0.742 1.00 0.00 C ATOM 44 O ASN A 5 -3.679 -1.400 -0.342 1.00 0.00 O ATOM 45 CB ASN A 5 -4.800 -0.157 -2.748 1.00 0.00 C ATOM 46 CG ASN A 5 -4.915 -1.183 -3.879 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.270 -2.328 -3.658 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.618 -0.821 -5.089 1.00 0.00 N ATOM 49 H ASN A 5 -5.098 1.277 -0.667 1.00 0.00 H ATOM 50 HA ASN A 5 -6.553 -1.027 -1.836 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.185 0.793 -3.084 1.00 0.00 H ATOM 52 HB3 ASN A 5 -3.758 -0.047 -2.474 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.322 0.098 -5.267 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.693 -1.462 -5.825 1.00 0.00 H ATOM 55 N PRO A 6 -5.385 -2.823 -0.556 1.00 0.00 N ATOM 56 CA PRO A 6 -4.690 -3.907 0.179 1.00 0.00 C ATOM 57 C PRO A 6 -3.439 -4.336 -0.589 1.00 0.00 C ATOM 58 O PRO A 6 -2.416 -4.639 -0.001 1.00 0.00 O ATOM 59 CB PRO A 6 -5.731 -5.023 0.247 1.00 0.00 C ATOM 60 CG PRO A 6 -6.656 -4.743 -0.888 1.00 0.00 C ATOM 61 CD PRO A 6 -6.716 -3.245 -1.016 1.00 0.00 C ATOM 62 HA PRO A 6 -4.431 -3.583 1.173 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.255 -5.987 0.115 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.268 -4.987 1.179 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.270 -5.181 -1.798 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.639 -5.132 -0.672 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.881 -2.960 -2.046 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.480 -2.838 -0.376 1.00 0.00 H ATOM 69 N ALA A 7 -3.502 -4.338 -1.899 1.00 0.00 N ATOM 70 CA ALA A 7 -2.303 -4.721 -2.699 1.00 0.00 C ATOM 71 C ALA A 7 -1.188 -3.702 -2.453 1.00 0.00 C ATOM 72 O ALA A 7 -0.037 -4.057 -2.304 1.00 0.00 O ATOM 73 CB ALA A 7 -2.750 -4.691 -4.165 1.00 0.00 C ATOM 74 H ALA A 7 -4.330 -4.073 -2.351 1.00 0.00 H ATOM 75 HA ALA A 7 -1.974 -5.715 -2.429 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.295 -5.596 -4.397 1.00 0.00 H ATOM 77 HB2 ALA A 7 -1.883 -4.624 -4.800 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.387 -3.832 -4.335 1.00 0.00 H ATOM 79 N CYS A 8 -1.522 -2.433 -2.397 1.00 0.00 N ATOM 80 CA CYS A 8 -0.471 -1.398 -2.151 1.00 0.00 C ATOM 81 C CYS A 8 0.014 -1.471 -0.700 1.00 0.00 C ATOM 82 O CYS A 8 1.199 -1.477 -0.442 1.00 0.00 O ATOM 83 CB CYS A 8 -1.132 -0.042 -2.415 1.00 0.00 C ATOM 84 SG CYS A 8 0.059 1.278 -2.059 1.00 0.00 S ATOM 85 H CYS A 8 -2.457 -2.167 -2.510 1.00 0.00 H ATOM 86 HA CYS A 8 0.351 -1.539 -2.829 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.435 0.016 -3.450 1.00 0.00 H ATOM 88 HB3 CYS A 8 -1.993 0.075 -1.775 1.00 0.00 H ATOM 89 N MET A 9 -0.887 -1.532 0.246 1.00 0.00 N ATOM 90 CA MET A 9 -0.479 -1.605 1.679 1.00 0.00 C ATOM 91 C MET A 9 0.512 -2.754 1.919 1.00 0.00 C ATOM 92 O MET A 9 1.487 -2.603 2.626 1.00 0.00 O ATOM 93 CB MET A 9 -1.789 -1.851 2.433 1.00 0.00 C ATOM 94 CG MET A 9 -2.547 -0.533 2.600 1.00 0.00 C ATOM 95 SD MET A 9 -1.707 0.494 3.835 1.00 0.00 S ATOM 96 CE MET A 9 -3.009 0.445 5.091 1.00 0.00 C ATOM 97 H MET A 9 -1.843 -1.528 0.013 1.00 0.00 H ATOM 98 HA MET A 9 -0.048 -0.667 1.994 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.401 -2.547 1.873 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.573 -2.262 3.399 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.572 -0.007 1.652 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.559 -0.736 2.921 1.00 0.00 H ATOM 103 HE1 MET A 9 -2.789 1.172 5.866 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.056 -0.545 5.518 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.959 0.686 4.638 1.00 0.00 H ATOM 106 N VAL A 10 0.266 -3.902 1.355 1.00 0.00 N ATOM 107 CA VAL A 10 1.193 -5.053 1.584 1.00 0.00 C ATOM 108 C VAL A 10 2.421 -4.988 0.657 1.00 0.00 C ATOM 109 O VAL A 10 3.478 -5.494 0.994 1.00 0.00 O ATOM 110 CB VAL A 10 0.347 -6.307 1.303 1.00 0.00 C ATOM 111 CG1 VAL A 10 0.066 -6.434 -0.199 1.00 0.00 C ATOM 112 CG2 VAL A 10 1.101 -7.550 1.780 1.00 0.00 C ATOM 113 H VAL A 10 -0.532 -4.015 0.797 1.00 0.00 H ATOM 114 HA VAL A 10 1.516 -5.059 2.613 1.00 0.00 H ATOM 115 HB VAL A 10 -0.590 -6.228 1.839 1.00 0.00 H ATOM 116 HG11 VAL A 10 -0.500 -7.337 -0.385 1.00 0.00 H ATOM 117 HG12 VAL A 10 0.999 -6.481 -0.736 1.00 0.00 H ATOM 118 HG13 VAL A 10 -0.499 -5.579 -0.541 1.00 0.00 H ATOM 119 HG21 VAL A 10 1.348 -7.444 2.826 1.00 0.00 H ATOM 120 HG22 VAL A 10 2.008 -7.665 1.206 1.00 0.00 H ATOM 121 HG23 VAL A 10 0.476 -8.420 1.643 1.00 0.00 H ATOM 122 N ASN A 11 2.301 -4.392 -0.505 1.00 0.00 N ATOM 123 CA ASN A 11 3.477 -4.335 -1.442 1.00 0.00 C ATOM 124 C ASN A 11 4.183 -2.974 -1.402 1.00 0.00 C ATOM 125 O ASN A 11 5.245 -2.820 -1.970 1.00 0.00 O ATOM 126 CB ASN A 11 2.900 -4.575 -2.838 1.00 0.00 C ATOM 127 CG ASN A 11 2.516 -6.047 -2.990 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.368 -6.916 -2.970 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.265 -6.374 -3.135 1.00 0.00 N ATOM 130 H ASN A 11 1.443 -3.996 -0.768 1.00 0.00 H ATOM 131 HA ASN A 11 4.179 -5.120 -1.206 1.00 0.00 H ATOM 132 HB2 ASN A 11 2.030 -3.953 -2.983 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.644 -4.322 -3.580 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.573 -5.677 -3.149 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.014 -7.315 -3.236 1.00 0.00 H ATOM 136 N ASN A 12 3.614 -1.983 -0.765 1.00 0.00 N ATOM 137 CA ASN A 12 4.283 -0.646 -0.731 1.00 0.00 C ATOM 138 C ASN A 12 4.214 -0.039 0.679 1.00 0.00 C ATOM 139 O ASN A 12 3.455 0.880 0.923 1.00 0.00 O ATOM 140 CB ASN A 12 3.514 0.218 -1.736 1.00 0.00 C ATOM 141 CG ASN A 12 4.340 0.375 -3.011 1.00 0.00 C ATOM 142 OD1 ASN A 12 5.043 1.354 -3.178 1.00 0.00 O ATOM 143 ND2 ASN A 12 4.289 -0.552 -3.921 1.00 0.00 N ATOM 144 H ASN A 12 2.747 -2.110 -0.320 1.00 0.00 H ATOM 145 HA ASN A 12 5.312 -0.737 -1.046 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.572 -0.254 -1.976 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.328 1.191 -1.308 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.723 -1.342 -3.786 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.809 -0.463 -4.744 1.00 0.00 H ATOM 150 N PRO A 13 5.024 -0.569 1.564 1.00 0.00 N ATOM 151 CA PRO A 13 5.071 -0.059 2.959 1.00 0.00 C ATOM 152 C PRO A 13 5.623 1.370 2.975 1.00 0.00 C ATOM 153 O PRO A 13 5.247 2.178 3.801 1.00 0.00 O ATOM 154 CB PRO A 13 6.010 -1.036 3.674 1.00 0.00 C ATOM 155 CG PRO A 13 6.854 -1.608 2.584 1.00 0.00 C ATOM 156 CD PRO A 13 5.984 -1.661 1.352 1.00 0.00 C ATOM 157 HA PRO A 13 4.092 -0.094 3.407 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.624 -0.507 4.387 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.454 -1.824 4.162 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.708 -0.968 2.411 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.180 -2.603 2.844 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.576 -1.489 0.463 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.468 -2.606 1.292 1.00 0.00 H ATOM 164 N GLN A 14 6.505 1.691 2.056 1.00 0.00 N ATOM 165 CA GLN A 14 7.071 3.079 2.006 1.00 0.00 C ATOM 166 C GLN A 14 5.957 4.118 1.839 1.00 0.00 C ATOM 167 O GLN A 14 6.113 5.271 2.199 1.00 0.00 O ATOM 168 CB GLN A 14 8.008 3.099 0.791 1.00 0.00 C ATOM 169 CG GLN A 14 7.251 2.660 -0.475 1.00 0.00 C ATOM 170 CD GLN A 14 7.907 3.279 -1.714 1.00 0.00 C ATOM 171 OE1 GLN A 14 9.010 3.788 -1.646 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.278 3.242 -2.853 1.00 0.00 N ATOM 173 H GLN A 14 6.790 1.023 1.395 1.00 0.00 H ATOM 174 HA GLN A 14 7.628 3.279 2.899 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.389 4.100 0.651 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.834 2.423 0.966 1.00 0.00 H ATOM 177 HG2 GLN A 14 7.270 1.584 -0.556 1.00 0.00 H ATOM 178 HG3 GLN A 14 6.226 2.997 -0.416 1.00 0.00 H ATOM 179 HE21 GLN A 14 6.397 2.817 -2.915 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.680 3.651 -3.648 1.00 0.00 H ATOM 181 N ILE A 15 4.838 3.720 1.304 1.00 0.00 N ATOM 182 CA ILE A 15 3.711 4.680 1.116 1.00 0.00 C ATOM 183 C ILE A 15 2.921 4.809 2.421 1.00 0.00 C ATOM 184 O ILE A 15 2.524 5.891 2.803 1.00 0.00 O ATOM 185 CB ILE A 15 2.835 4.080 0.002 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.700 3.828 -1.242 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.704 5.061 -0.341 1.00 0.00 C ATOM 188 CD1 ILE A 15 2.810 3.658 -2.472 1.00 0.00 C ATOM 189 H ILE A 15 4.738 2.786 1.031 1.00 0.00 H ATOM 190 HA ILE A 15 4.087 5.644 0.807 1.00 0.00 H ATOM 191 HB ILE A 15 2.410 3.145 0.339 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.363 4.668 -1.397 1.00 0.00 H ATOM 193 HG13 ILE A 15 4.285 2.931 -1.096 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.737 5.902 0.334 1.00 0.00 H ATOM 195 HG22 ILE A 15 0.749 4.564 -0.247 1.00 0.00 H ATOM 196 HG23 ILE A 15 1.826 5.412 -1.356 1.00 0.00 H ATOM 197 HD11 ILE A 15 1.902 3.146 -2.188 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.332 3.083 -3.217 1.00 0.00 H ATOM 199 HD13 ILE A 15 2.567 4.627 -2.873 1.00 0.00 H ATOM 200 N CYS A 16 2.698 3.719 3.108 1.00 0.00 N ATOM 201 CA CYS A 16 1.941 3.780 4.389 1.00 0.00 C ATOM 202 C CYS A 16 2.785 3.185 5.522 1.00 0.00 C ATOM 203 O CYS A 16 2.480 2.129 6.043 1.00 0.00 O ATOM 204 CB CYS A 16 0.677 2.943 4.147 1.00 0.00 C ATOM 205 SG CYS A 16 -0.463 3.853 3.076 1.00 0.00 S ATOM 206 H CYS A 16 3.036 2.858 2.782 1.00 0.00 H ATOM 207 HA CYS A 16 1.670 4.799 4.621 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.947 2.011 3.674 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.197 2.737 5.091 1.00 0.00 H HETATM 210 N NH2 A 17 3.844 3.822 5.935 1.00 0.00 N HETATM 211 HN1 NH2 A 17 4.099 4.674 5.523 1.00 0.00 H HETATM 212 HN2 NH2 A 17 4.386 3.451 6.663 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 15 ATOM 1 N GLY A 1 -6.829 5.412 -3.106 1.00 0.00 N ATOM 2 CA GLY A 1 -5.655 5.816 -2.290 1.00 0.00 C ATOM 3 C GLY A 1 -4.765 4.597 -2.059 1.00 0.00 C ATOM 4 O GLY A 1 -5.250 3.492 -1.891 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.621 5.178 -2.478 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.582 4.580 -3.680 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.105 6.195 -3.728 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.101 6.581 -2.814 1.00 0.00 H ATOM 9 HA3 GLY A 1 -5.991 6.195 -1.337 1.00 0.00 H ATOM 10 N CYS A 2 -3.468 4.773 -2.057 1.00 0.00 N ATOM 11 CA CYS A 2 -2.566 3.600 -1.840 1.00 0.00 C ATOM 12 C CYS A 2 -2.859 2.969 -0.483 1.00 0.00 C ATOM 13 O CYS A 2 -2.999 1.767 -0.369 1.00 0.00 O ATOM 14 CB CYS A 2 -1.136 4.135 -1.893 1.00 0.00 C ATOM 15 SG CYS A 2 -0.072 2.886 -2.658 1.00 0.00 S ATOM 16 H CYS A 2 -3.095 5.670 -2.201 1.00 0.00 H ATOM 17 HA CYS A 2 -2.714 2.879 -2.616 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.105 5.044 -2.476 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.788 4.337 -0.892 1.00 0.00 H ATOM 20 N CYS A 3 -2.978 3.774 0.531 1.00 0.00 N ATOM 21 CA CYS A 3 -3.293 3.234 1.892 1.00 0.00 C ATOM 22 C CYS A 3 -4.679 2.589 1.872 1.00 0.00 C ATOM 23 O CYS A 3 -4.940 1.638 2.580 1.00 0.00 O ATOM 24 CB CYS A 3 -3.259 4.436 2.836 1.00 0.00 C ATOM 25 SG CYS A 3 -1.653 4.484 3.677 1.00 0.00 S ATOM 26 H CYS A 3 -2.875 4.734 0.391 1.00 0.00 H ATOM 27 HA CYS A 3 -2.550 2.511 2.188 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.401 5.345 2.271 1.00 0.00 H ATOM 29 HB3 CYS A 3 -4.047 4.341 3.571 1.00 0.00 H ATOM 30 N SER A 4 -5.564 3.079 1.038 1.00 0.00 N ATOM 31 CA SER A 4 -6.925 2.470 0.939 1.00 0.00 C ATOM 32 C SER A 4 -6.841 1.145 0.154 1.00 0.00 C ATOM 33 O SER A 4 -7.777 0.367 0.139 1.00 0.00 O ATOM 34 CB SER A 4 -7.782 3.498 0.178 1.00 0.00 C ATOM 35 OG SER A 4 -7.167 4.786 0.233 1.00 0.00 O ATOM 36 H SER A 4 -5.330 3.833 0.458 1.00 0.00 H ATOM 37 HA SER A 4 -7.336 2.301 1.925 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.880 3.199 -0.851 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.768 3.546 0.628 1.00 0.00 H ATOM 40 HG SER A 4 -7.482 5.229 1.028 1.00 0.00 H ATOM 41 N ASN A 5 -5.723 0.884 -0.490 1.00 0.00 N ATOM 42 CA ASN A 5 -5.570 -0.379 -1.265 1.00 0.00 C ATOM 43 C ASN A 5 -4.784 -1.405 -0.442 1.00 0.00 C ATOM 44 O ASN A 5 -3.663 -1.140 -0.038 1.00 0.00 O ATOM 45 CB ASN A 5 -4.774 0.015 -2.519 1.00 0.00 C ATOM 46 CG ASN A 5 -4.762 -1.147 -3.518 1.00 0.00 C ATOM 47 OD1 ASN A 5 -4.952 -2.288 -3.146 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.540 -0.909 -4.777 1.00 0.00 N ATOM 49 H ASN A 5 -4.977 1.521 -0.456 1.00 0.00 H ATOM 50 HA ASN A 5 -6.535 -0.769 -1.545 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.235 0.879 -2.979 1.00 0.00 H ATOM 52 HB3 ASN A 5 -3.759 0.253 -2.239 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.380 0.009 -5.082 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.544 -1.647 -5.424 1.00 0.00 H ATOM 55 N PRO A 6 -5.378 -2.554 -0.232 1.00 0.00 N ATOM 56 CA PRO A 6 -4.695 -3.624 0.536 1.00 0.00 C ATOM 57 C PRO A 6 -3.458 -4.088 -0.238 1.00 0.00 C ATOM 58 O PRO A 6 -2.419 -4.345 0.341 1.00 0.00 O ATOM 59 CB PRO A 6 -5.754 -4.722 0.645 1.00 0.00 C ATOM 60 CG PRO A 6 -6.679 -4.470 -0.505 1.00 0.00 C ATOM 61 CD PRO A 6 -6.711 -2.975 -0.685 1.00 0.00 C ATOM 62 HA PRO A 6 -4.419 -3.272 1.516 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.294 -5.698 0.563 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.290 -4.634 1.580 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.302 -4.952 -1.399 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.667 -4.832 -0.274 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.866 -2.720 -1.723 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.473 -2.535 -0.063 1.00 0.00 H ATOM 69 N ALA A 7 -3.547 -4.162 -1.543 1.00 0.00 N ATOM 70 CA ALA A 7 -2.358 -4.576 -2.342 1.00 0.00 C ATOM 71 C ALA A 7 -1.227 -3.576 -2.106 1.00 0.00 C ATOM 72 O ALA A 7 -0.092 -3.954 -1.871 1.00 0.00 O ATOM 73 CB ALA A 7 -2.807 -4.542 -3.800 1.00 0.00 C ATOM 74 H ALA A 7 -4.387 -3.922 -1.995 1.00 0.00 H ATOM 75 HA ALA A 7 -2.046 -5.572 -2.069 1.00 0.00 H ATOM 76 HB1 ALA A 7 -1.955 -4.334 -4.433 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.549 -3.768 -3.930 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.231 -5.497 -4.067 1.00 0.00 H ATOM 79 N CYS A 8 -1.533 -2.301 -2.145 1.00 0.00 N ATOM 80 CA CYS A 8 -0.475 -1.274 -1.898 1.00 0.00 C ATOM 81 C CYS A 8 0.065 -1.443 -0.478 1.00 0.00 C ATOM 82 O CYS A 8 1.255 -1.534 -0.272 1.00 0.00 O ATOM 83 CB CYS A 8 -1.141 0.097 -2.052 1.00 0.00 C ATOM 84 SG CYS A 8 -0.063 1.367 -1.327 1.00 0.00 S ATOM 85 H CYS A 8 -2.457 -2.024 -2.318 1.00 0.00 H ATOM 86 HA CYS A 8 0.319 -1.378 -2.619 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.295 0.308 -3.099 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.090 0.097 -1.539 1.00 0.00 H ATOM 89 N MET A 9 -0.801 -1.495 0.504 1.00 0.00 N ATOM 90 CA MET A 9 -0.329 -1.667 1.918 1.00 0.00 C ATOM 91 C MET A 9 0.719 -2.782 2.009 1.00 0.00 C ATOM 92 O MET A 9 1.710 -2.662 2.710 1.00 0.00 O ATOM 93 CB MET A 9 -1.576 -2.065 2.711 1.00 0.00 C ATOM 94 CG MET A 9 -1.645 -1.268 4.018 1.00 0.00 C ATOM 95 SD MET A 9 -2.888 0.039 3.869 1.00 0.00 S ATOM 96 CE MET A 9 -4.344 -1.038 3.817 1.00 0.00 C ATOM 97 H MET A 9 -1.767 -1.425 0.312 1.00 0.00 H ATOM 98 HA MET A 9 0.072 -0.742 2.295 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.456 -1.872 2.117 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.527 -3.119 2.942 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.918 -1.930 4.828 1.00 0.00 H ATOM 102 HG3 MET A 9 -0.682 -0.827 4.226 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.376 -1.554 2.866 1.00 0.00 H ATOM 104 HE2 MET A 9 -5.237 -0.442 3.938 1.00 0.00 H ATOM 105 HE3 MET A 9 -4.289 -1.763 4.615 1.00 0.00 H ATOM 106 N VAL A 10 0.494 -3.872 1.326 1.00 0.00 N ATOM 107 CA VAL A 10 1.456 -5.014 1.384 1.00 0.00 C ATOM 108 C VAL A 10 2.621 -4.813 0.394 1.00 0.00 C ATOM 109 O VAL A 10 3.758 -5.127 0.696 1.00 0.00 O ATOM 110 CB VAL A 10 0.628 -6.252 0.995 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.477 -7.516 1.162 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.606 -6.357 1.897 1.00 0.00 C ATOM 113 H VAL A 10 -0.328 -3.948 0.791 1.00 0.00 H ATOM 114 HA VAL A 10 1.837 -5.133 2.384 1.00 0.00 H ATOM 115 HB VAL A 10 0.313 -6.168 -0.037 1.00 0.00 H ATOM 116 HG11 VAL A 10 0.927 -8.371 0.808 1.00 0.00 H ATOM 117 HG12 VAL A 10 1.716 -7.650 2.208 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.389 -7.415 0.596 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.795 -5.403 2.369 1.00 0.00 H ATOM 120 HG22 VAL A 10 -0.437 -7.104 2.655 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.463 -6.636 1.299 1.00 0.00 H ATOM 122 N ASN A 11 2.345 -4.327 -0.792 1.00 0.00 N ATOM 123 CA ASN A 11 3.436 -4.151 -1.809 1.00 0.00 C ATOM 124 C ASN A 11 4.132 -2.791 -1.699 1.00 0.00 C ATOM 125 O ASN A 11 5.163 -2.581 -2.308 1.00 0.00 O ATOM 126 CB ASN A 11 2.739 -4.264 -3.167 1.00 0.00 C ATOM 127 CG ASN A 11 2.689 -5.728 -3.608 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.544 -6.180 -4.341 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.716 -6.495 -3.196 1.00 0.00 N ATOM 130 H ASN A 11 1.415 -4.100 -1.027 1.00 0.00 H ATOM 131 HA ASN A 11 4.161 -4.940 -1.710 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.735 -3.874 -3.089 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.287 -3.690 -3.898 1.00 0.00 H ATOM 134 HD21 ASN A 11 1.020 -6.136 -2.606 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.678 -7.431 -3.482 1.00 0.00 H ATOM 136 N ASN A 12 3.594 -1.856 -0.960 1.00 0.00 N ATOM 137 CA ASN A 12 4.251 -0.522 -0.865 1.00 0.00 C ATOM 138 C ASN A 12 4.293 -0.027 0.591 1.00 0.00 C ATOM 139 O ASN A 12 3.441 0.732 1.016 1.00 0.00 O ATOM 140 CB ASN A 12 3.386 0.394 -1.729 1.00 0.00 C ATOM 141 CG ASN A 12 3.999 0.515 -3.125 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.788 1.403 -3.382 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.664 -0.339 -4.055 1.00 0.00 N ATOM 144 H ASN A 12 2.750 -2.018 -0.485 1.00 0.00 H ATOM 145 HA ASN A 12 5.250 -0.570 -1.271 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.393 -0.019 -1.806 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.333 1.370 -1.275 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.016 -1.051 -3.862 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.067 -0.270 -4.949 1.00 0.00 H ATOM 150 N PRO A 13 5.300 -0.460 1.307 1.00 0.00 N ATOM 151 CA PRO A 13 5.473 -0.032 2.722 1.00 0.00 C ATOM 152 C PRO A 13 5.869 1.453 2.809 1.00 0.00 C ATOM 153 O PRO A 13 5.611 2.111 3.801 1.00 0.00 O ATOM 154 CB PRO A 13 6.603 -0.922 3.229 1.00 0.00 C ATOM 155 CG PRO A 13 7.362 -1.324 2.003 1.00 0.00 C ATOM 156 CD PRO A 13 6.359 -1.389 0.882 1.00 0.00 C ATOM 157 HA PRO A 13 4.575 -0.223 3.289 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.238 -0.364 3.902 1.00 0.00 H ATOM 159 HB3 PRO A 13 6.202 -1.794 3.720 1.00 0.00 H ATOM 160 HG2 PRO A 13 8.127 -0.592 1.784 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.810 -2.296 2.148 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.807 -1.068 -0.046 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.961 -2.388 0.788 1.00 0.00 H ATOM 164 N GLN A 14 6.499 1.980 1.787 1.00 0.00 N ATOM 165 CA GLN A 14 6.923 3.422 1.807 1.00 0.00 C ATOM 166 C GLN A 14 5.734 4.347 2.093 1.00 0.00 C ATOM 167 O GLN A 14 5.888 5.415 2.658 1.00 0.00 O ATOM 168 CB GLN A 14 7.479 3.722 0.405 1.00 0.00 C ATOM 169 CG GLN A 14 8.588 2.729 0.042 1.00 0.00 C ATOM 170 CD GLN A 14 8.095 1.808 -1.077 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.435 0.822 -0.815 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.379 2.085 -2.316 1.00 0.00 N ATOM 173 H GLN A 14 6.701 1.424 1.010 1.00 0.00 H ATOM 174 HA GLN A 14 7.689 3.575 2.543 1.00 0.00 H ATOM 175 HB2 GLN A 14 6.682 3.648 -0.321 1.00 0.00 H ATOM 176 HB3 GLN A 14 7.880 4.724 0.392 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.463 3.269 -0.294 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.842 2.137 0.907 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.914 2.880 -2.531 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.055 1.505 -3.036 1.00 0.00 H ATOM 181 N ILE A 15 4.559 3.960 1.702 1.00 0.00 N ATOM 182 CA ILE A 15 3.364 4.826 1.941 1.00 0.00 C ATOM 183 C ILE A 15 2.478 4.239 3.045 1.00 0.00 C ATOM 184 O ILE A 15 1.940 4.962 3.861 1.00 0.00 O ATOM 185 CB ILE A 15 2.587 4.909 0.605 1.00 0.00 C ATOM 186 CG1 ILE A 15 2.815 3.657 -0.271 1.00 0.00 C ATOM 187 CG2 ILE A 15 3.032 6.155 -0.168 1.00 0.00 C ATOM 188 CD1 ILE A 15 4.067 3.833 -1.146 1.00 0.00 C ATOM 189 H ILE A 15 4.462 3.103 1.253 1.00 0.00 H ATOM 190 HA ILE A 15 3.689 5.816 2.225 1.00 0.00 H ATOM 191 HB ILE A 15 1.534 4.995 0.829 1.00 0.00 H ATOM 192 HG12 ILE A 15 2.938 2.790 0.360 1.00 0.00 H ATOM 193 HG13 ILE A 15 1.956 3.512 -0.909 1.00 0.00 H ATOM 194 HG21 ILE A 15 4.078 6.351 0.029 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.443 7.003 0.145 1.00 0.00 H ATOM 196 HG23 ILE A 15 2.890 5.991 -1.226 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.397 2.869 -1.507 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.852 4.282 -0.558 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.833 4.472 -1.986 1.00 0.00 H ATOM 200 N CYS A 16 2.311 2.940 3.080 1.00 0.00 N ATOM 201 CA CYS A 16 1.443 2.325 4.135 1.00 0.00 C ATOM 202 C CYS A 16 2.088 1.043 4.676 1.00 0.00 C ATOM 203 O CYS A 16 1.447 0.013 4.780 1.00 0.00 O ATOM 204 CB CYS A 16 0.120 2.011 3.430 1.00 0.00 C ATOM 205 SG CYS A 16 -0.413 3.448 2.457 1.00 0.00 S ATOM 206 H CYS A 16 2.748 2.369 2.413 1.00 0.00 H ATOM 207 HA CYS A 16 1.272 3.023 4.936 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.258 1.163 2.773 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.633 1.775 4.167 1.00 0.00 H HETATM 210 N NH2 A 17 3.340 1.066 5.035 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.859 1.894 4.951 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.762 0.257 5.391 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 16 ATOM 1 N GLY A 1 -6.822 6.249 -1.670 1.00 0.00 N ATOM 2 CA GLY A 1 -5.669 6.197 -2.610 1.00 0.00 C ATOM 3 C GLY A 1 -5.057 4.792 -2.597 1.00 0.00 C ATOM 4 O GLY A 1 -5.650 3.853 -2.096 1.00 0.00 O ATOM 5 H1 GLY A 1 -6.689 5.544 -0.911 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.699 6.039 -2.185 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.883 7.196 -1.253 1.00 0.00 H ATOM 8 HA2 GLY A 1 -6.008 6.433 -3.605 1.00 0.00 H ATOM 9 HA3 GLY A 1 -4.921 6.915 -2.303 1.00 0.00 H ATOM 10 N CYS A 2 -3.876 4.639 -3.141 1.00 0.00 N ATOM 11 CA CYS A 2 -3.227 3.291 -3.165 1.00 0.00 C ATOM 12 C CYS A 2 -3.117 2.720 -1.757 1.00 0.00 C ATOM 13 O CYS A 2 -3.479 1.588 -1.503 1.00 0.00 O ATOM 14 CB CYS A 2 -1.833 3.511 -3.750 1.00 0.00 C ATOM 15 SG CYS A 2 -1.245 1.955 -4.470 1.00 0.00 S ATOM 16 H CYS A 2 -3.419 5.410 -3.537 1.00 0.00 H ATOM 17 HA CYS A 2 -3.785 2.623 -3.790 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.871 4.272 -4.506 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.155 3.821 -2.964 1.00 0.00 H ATOM 20 N CYS A 3 -2.622 3.498 -0.846 1.00 0.00 N ATOM 21 CA CYS A 3 -2.476 3.015 0.564 1.00 0.00 C ATOM 22 C CYS A 3 -3.820 2.502 1.098 1.00 0.00 C ATOM 23 O CYS A 3 -3.860 1.651 1.962 1.00 0.00 O ATOM 24 CB CYS A 3 -1.990 4.218 1.374 1.00 0.00 C ATOM 25 SG CYS A 3 -0.292 3.926 1.930 1.00 0.00 S ATOM 26 H CYS A 3 -2.344 4.403 -1.092 1.00 0.00 H ATOM 27 HA CYS A 3 -1.742 2.226 0.605 1.00 0.00 H ATOM 28 HB2 CYS A 3 -2.021 5.105 0.762 1.00 0.00 H ATOM 29 HB3 CYS A 3 -2.630 4.350 2.234 1.00 0.00 H ATOM 30 N SER A 4 -4.921 2.992 0.587 1.00 0.00 N ATOM 31 CA SER A 4 -6.249 2.499 1.061 1.00 0.00 C ATOM 32 C SER A 4 -6.485 1.058 0.558 1.00 0.00 C ATOM 33 O SER A 4 -7.402 0.386 0.992 1.00 0.00 O ATOM 34 CB SER A 4 -7.269 3.467 0.449 1.00 0.00 C ATOM 35 OG SER A 4 -6.702 4.781 0.356 1.00 0.00 O ATOM 36 H SER A 4 -4.882 3.668 -0.119 1.00 0.00 H ATOM 37 HA SER A 4 -6.303 2.537 2.141 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.535 3.128 -0.538 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.160 3.490 1.066 1.00 0.00 H ATOM 40 HG SER A 4 -6.463 5.068 1.249 1.00 0.00 H ATOM 41 N ASN A 5 -5.663 0.577 -0.344 1.00 0.00 N ATOM 42 CA ASN A 5 -5.825 -0.816 -0.864 1.00 0.00 C ATOM 43 C ASN A 5 -4.901 -1.751 -0.087 1.00 0.00 C ATOM 44 O ASN A 5 -3.717 -1.480 0.006 1.00 0.00 O ATOM 45 CB ASN A 5 -5.383 -0.744 -2.333 1.00 0.00 C ATOM 46 CG ASN A 5 -5.470 -2.130 -2.989 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.980 -3.069 -2.410 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.975 -2.304 -4.180 1.00 0.00 N ATOM 49 H ASN A 5 -4.924 1.129 -0.677 1.00 0.00 H ATOM 50 HA ASN A 5 -6.852 -1.138 -0.794 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.021 -0.055 -2.863 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.360 -0.395 -2.377 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.547 -1.559 -4.651 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.032 -3.183 -4.609 1.00 0.00 H ATOM 55 N PRO A 6 -5.450 -2.824 0.437 1.00 0.00 N ATOM 56 CA PRO A 6 -4.624 -3.795 1.209 1.00 0.00 C ATOM 57 C PRO A 6 -3.518 -4.375 0.319 1.00 0.00 C ATOM 58 O PRO A 6 -2.401 -4.587 0.757 1.00 0.00 O ATOM 59 CB PRO A 6 -5.633 -4.853 1.652 1.00 0.00 C ATOM 60 CG PRO A 6 -6.761 -4.729 0.677 1.00 0.00 C ATOM 61 CD PRO A 6 -6.855 -3.261 0.358 1.00 0.00 C ATOM 62 HA PRO A 6 -4.196 -3.312 2.073 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.189 -5.837 1.602 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.982 -4.643 2.651 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.550 -5.299 -0.218 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.683 -5.064 1.128 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.261 -3.111 -0.634 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.450 -2.748 1.099 1.00 0.00 H ATOM 69 N ALA A 7 -3.809 -4.596 -0.939 1.00 0.00 N ATOM 70 CA ALA A 7 -2.761 -5.119 -1.861 1.00 0.00 C ATOM 71 C ALA A 7 -1.663 -4.061 -1.981 1.00 0.00 C ATOM 72 O ALA A 7 -0.486 -4.347 -1.856 1.00 0.00 O ATOM 73 CB ALA A 7 -3.451 -5.338 -3.213 1.00 0.00 C ATOM 74 H ALA A 7 -4.705 -4.391 -1.278 1.00 0.00 H ATOM 75 HA ALA A 7 -2.360 -6.051 -1.491 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.506 -5.509 -3.060 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.014 -6.198 -3.699 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.314 -4.466 -3.835 1.00 0.00 H ATOM 79 N CYS A 8 -2.046 -2.828 -2.201 1.00 0.00 N ATOM 80 CA CYS A 8 -1.032 -1.743 -2.310 1.00 0.00 C ATOM 81 C CYS A 8 -0.357 -1.528 -0.953 1.00 0.00 C ATOM 82 O CYS A 8 0.829 -1.283 -0.885 1.00 0.00 O ATOM 83 CB CYS A 8 -1.786 -0.483 -2.740 1.00 0.00 C ATOM 84 SG CYS A 8 -0.614 0.894 -2.871 1.00 0.00 S ATOM 85 H CYS A 8 -2.995 -2.620 -2.281 1.00 0.00 H ATOM 86 HA CYS A 8 -0.301 -2.000 -3.054 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.255 -0.652 -3.696 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.537 -0.244 -2.001 1.00 0.00 H ATOM 89 N MET A 9 -1.099 -1.630 0.128 1.00 0.00 N ATOM 90 CA MET A 9 -0.496 -1.446 1.479 1.00 0.00 C ATOM 91 C MET A 9 0.751 -2.325 1.606 1.00 0.00 C ATOM 92 O MET A 9 1.777 -1.901 2.108 1.00 0.00 O ATOM 93 CB MET A 9 -1.573 -1.913 2.457 1.00 0.00 C ATOM 94 CG MET A 9 -2.593 -0.802 2.681 1.00 0.00 C ATOM 95 SD MET A 9 -2.102 0.172 4.121 1.00 0.00 S ATOM 96 CE MET A 9 -3.286 -0.543 5.284 1.00 0.00 C ATOM 97 H MET A 9 -2.054 -1.835 0.052 1.00 0.00 H ATOM 98 HA MET A 9 -0.254 -0.407 1.652 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.070 -2.782 2.053 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.116 -2.169 3.394 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.633 -0.166 1.812 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.567 -1.237 2.856 1.00 0.00 H ATOM 103 HE1 MET A 9 -4.286 -0.469 4.871 1.00 0.00 H ATOM 104 HE2 MET A 9 -3.237 -0.004 6.215 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.044 -1.580 5.458 1.00 0.00 H ATOM 106 N VAL A 10 0.670 -3.545 1.139 1.00 0.00 N ATOM 107 CA VAL A 10 1.848 -4.455 1.206 1.00 0.00 C ATOM 108 C VAL A 10 2.858 -4.048 0.131 1.00 0.00 C ATOM 109 O VAL A 10 4.046 -3.973 0.378 1.00 0.00 O ATOM 110 CB VAL A 10 1.301 -5.864 0.931 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.425 -6.891 1.083 1.00 0.00 C ATOM 112 CG2 VAL A 10 0.182 -6.188 1.929 1.00 0.00 C ATOM 113 H VAL A 10 -0.167 -3.857 0.731 1.00 0.00 H ATOM 114 HA VAL A 10 2.301 -4.414 2.184 1.00 0.00 H ATOM 115 HB VAL A 10 0.912 -5.906 -0.075 1.00 0.00 H ATOM 116 HG11 VAL A 10 2.113 -7.673 1.760 1.00 0.00 H ATOM 117 HG12 VAL A 10 3.304 -6.406 1.476 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.653 -7.320 0.119 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.775 -5.968 1.482 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.308 -5.587 2.817 1.00 0.00 H ATOM 121 HG23 VAL A 10 0.226 -7.235 2.193 1.00 0.00 H ATOM 122 N ASN A 11 2.388 -3.787 -1.063 1.00 0.00 N ATOM 123 CA ASN A 11 3.310 -3.385 -2.170 1.00 0.00 C ATOM 124 C ASN A 11 3.993 -2.050 -1.852 1.00 0.00 C ATOM 125 O ASN A 11 5.119 -1.820 -2.248 1.00 0.00 O ATOM 126 CB ASN A 11 2.425 -3.236 -3.413 1.00 0.00 C ATOM 127 CG ASN A 11 1.833 -4.591 -3.834 1.00 0.00 C ATOM 128 OD1 ASN A 11 0.804 -4.629 -4.478 1.00 0.00 O ATOM 129 ND2 ASN A 11 2.430 -5.708 -3.505 1.00 0.00 N ATOM 130 H ASN A 11 1.422 -3.858 -1.230 1.00 0.00 H ATOM 131 HA ASN A 11 4.050 -4.149 -2.337 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.620 -2.549 -3.196 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.021 -2.841 -4.223 1.00 0.00 H ATOM 134 HD21 ASN A 11 3.259 -5.695 -2.988 1.00 0.00 H ATOM 135 HD22 ASN A 11 2.043 -6.565 -3.782 1.00 0.00 H ATOM 136 N ASN A 12 3.321 -1.167 -1.162 1.00 0.00 N ATOM 137 CA ASN A 12 3.927 0.153 -0.835 1.00 0.00 C ATOM 138 C ASN A 12 4.062 0.312 0.683 1.00 0.00 C ATOM 139 O ASN A 12 3.328 1.064 1.301 1.00 0.00 O ATOM 140 CB ASN A 12 2.948 1.181 -1.398 1.00 0.00 C ATOM 141 CG ASN A 12 3.139 1.307 -2.913 1.00 0.00 C ATOM 142 OD1 ASN A 12 3.897 2.138 -3.375 1.00 0.00 O ATOM 143 ND2 ASN A 12 2.481 0.516 -3.715 1.00 0.00 N ATOM 144 H ASN A 12 2.407 -1.367 -0.860 1.00 0.00 H ATOM 145 HA ASN A 12 4.889 0.259 -1.314 1.00 0.00 H ATOM 146 HB2 ASN A 12 1.937 0.867 -1.186 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.130 2.133 -0.933 1.00 0.00 H ATOM 148 HD21 ASN A 12 1.868 -0.153 -3.348 1.00 0.00 H ATOM 149 HD22 ASN A 12 2.592 0.598 -4.685 1.00 0.00 H ATOM 150 N PRO A 13 5.005 -0.402 1.243 1.00 0.00 N ATOM 151 CA PRO A 13 5.237 -0.332 2.707 1.00 0.00 C ATOM 152 C PRO A 13 5.801 1.040 3.097 1.00 0.00 C ATOM 153 O PRO A 13 5.563 1.527 4.186 1.00 0.00 O ATOM 154 CB PRO A 13 6.255 -1.444 2.966 1.00 0.00 C ATOM 155 CG PRO A 13 6.951 -1.643 1.658 1.00 0.00 C ATOM 156 CD PRO A 13 5.945 -1.321 0.582 1.00 0.00 C ATOM 157 HA PRO A 13 4.326 -0.536 3.243 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.959 -1.135 3.724 1.00 0.00 H ATOM 159 HB3 PRO A 13 5.755 -2.354 3.262 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.802 -0.978 1.591 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.274 -2.667 1.561 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.431 -0.838 -0.257 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.429 -2.212 0.262 1.00 0.00 H ATOM 164 N GLN A 14 6.538 1.669 2.213 1.00 0.00 N ATOM 165 CA GLN A 14 7.114 3.015 2.523 1.00 0.00 C ATOM 166 C GLN A 14 5.998 4.039 2.774 1.00 0.00 C ATOM 167 O GLN A 14 6.215 5.060 3.400 1.00 0.00 O ATOM 168 CB GLN A 14 7.970 3.396 1.297 1.00 0.00 C ATOM 169 CG GLN A 14 7.098 3.975 0.170 1.00 0.00 C ATOM 170 CD GLN A 14 6.562 2.851 -0.724 1.00 0.00 C ATOM 171 OE1 GLN A 14 6.600 1.692 -0.360 1.00 0.00 O ATOM 172 NE2 GLN A 14 6.047 3.151 -1.879 1.00 0.00 N ATOM 173 H GLN A 14 6.708 1.257 1.339 1.00 0.00 H ATOM 174 HA GLN A 14 7.739 2.947 3.392 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.698 4.136 1.592 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.487 2.518 0.935 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.269 4.517 0.593 1.00 0.00 H ATOM 178 HG3 GLN A 14 7.695 4.648 -0.432 1.00 0.00 H ATOM 179 HE21 GLN A 14 6.001 4.087 -2.168 1.00 0.00 H ATOM 180 HE22 GLN A 14 5.715 2.440 -2.466 1.00 0.00 H ATOM 181 N ILE A 15 4.810 3.772 2.300 1.00 0.00 N ATOM 182 CA ILE A 15 3.684 4.726 2.523 1.00 0.00 C ATOM 183 C ILE A 15 2.862 4.267 3.732 1.00 0.00 C ATOM 184 O ILE A 15 2.554 5.042 4.619 1.00 0.00 O ATOM 185 CB ILE A 15 2.834 4.692 1.241 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.735 4.614 -0.001 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.990 5.965 1.155 1.00 0.00 C ATOM 188 CD1 ILE A 15 2.883 4.745 -1.275 1.00 0.00 C ATOM 189 H ILE A 15 4.658 2.940 1.810 1.00 0.00 H ATOM 190 HA ILE A 15 4.068 5.722 2.685 1.00 0.00 H ATOM 191 HB ILE A 15 2.180 3.830 1.271 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.459 5.417 0.036 1.00 0.00 H ATOM 193 HG13 ILE A 15 4.251 3.664 -0.008 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.397 5.942 0.249 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.640 6.826 1.136 1.00 0.00 H ATOM 196 HG23 ILE A 15 1.337 6.023 2.013 1.00 0.00 H ATOM 197 HD11 ILE A 15 1.868 4.445 -1.066 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.294 4.114 -2.048 1.00 0.00 H ATOM 199 HD13 ILE A 15 2.890 5.774 -1.609 1.00 0.00 H ATOM 200 N CYS A 16 2.510 3.005 3.779 1.00 0.00 N ATOM 201 CA CYS A 16 1.716 2.488 4.931 1.00 0.00 C ATOM 202 C CYS A 16 2.328 1.180 5.437 1.00 0.00 C ATOM 203 O CYS A 16 2.637 1.053 6.604 1.00 0.00 O ATOM 204 CB CYS A 16 0.308 2.251 4.383 1.00 0.00 C ATOM 205 SG CYS A 16 -0.449 3.838 3.942 1.00 0.00 S ATOM 206 H CYS A 16 2.780 2.396 3.059 1.00 0.00 H ATOM 207 HA CYS A 16 1.681 3.218 5.722 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.363 1.623 3.508 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.295 1.763 5.136 1.00 0.00 H HETATM 210 N NH2 A 17 2.510 0.190 4.607 1.00 0.00 N HETATM 211 HN1 NH2 A 17 2.261 0.287 3.663 1.00 0.00 H HETATM 212 HN2 NH2 A 17 2.895 -0.653 4.925 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 17 ATOM 1 N GLY A 1 -7.829 5.432 -2.188 1.00 0.00 N ATOM 2 CA GLY A 1 -6.443 5.807 -2.560 1.00 0.00 C ATOM 3 C GLY A 1 -5.561 4.554 -2.513 1.00 0.00 C ATOM 4 O GLY A 1 -6.050 3.448 -2.339 1.00 0.00 O ATOM 5 H1 GLY A 1 -8.472 6.221 -2.380 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.858 5.199 -1.173 1.00 0.00 H ATOM 7 H3 GLY A 1 -8.123 4.604 -2.740 1.00 0.00 H ATOM 8 HA2 GLY A 1 -6.442 6.217 -3.561 1.00 0.00 H ATOM 9 HA3 GLY A 1 -6.067 6.540 -1.865 1.00 0.00 H ATOM 10 N CYS A 2 -4.270 4.705 -2.674 1.00 0.00 N ATOM 11 CA CYS A 2 -3.365 3.508 -2.647 1.00 0.00 C ATOM 12 C CYS A 2 -3.414 2.833 -1.280 1.00 0.00 C ATOM 13 O CYS A 2 -3.659 1.646 -1.172 1.00 0.00 O ATOM 14 CB CYS A 2 -1.956 4.031 -2.934 1.00 0.00 C ATOM 15 SG CYS A 2 -0.976 2.707 -3.677 1.00 0.00 S ATOM 16 H CYS A 2 -3.897 5.599 -2.822 1.00 0.00 H ATOM 17 HA CYS A 2 -3.655 2.813 -3.405 1.00 0.00 H ATOM 18 HB2 CYS A 2 -2.011 4.870 -3.611 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.490 4.340 -2.011 1.00 0.00 H ATOM 20 N CYS A 3 -3.185 3.579 -0.242 1.00 0.00 N ATOM 21 CA CYS A 3 -3.218 2.992 1.136 1.00 0.00 C ATOM 22 C CYS A 3 -4.578 2.329 1.400 1.00 0.00 C ATOM 23 O CYS A 3 -4.680 1.407 2.188 1.00 0.00 O ATOM 24 CB CYS A 3 -2.979 4.163 2.092 1.00 0.00 C ATOM 25 SG CYS A 3 -1.199 4.325 2.404 1.00 0.00 S ATOM 26 H CYS A 3 -2.995 4.529 -0.368 1.00 0.00 H ATOM 27 HA CYS A 3 -2.429 2.265 1.245 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.352 5.074 1.652 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.491 3.977 3.027 1.00 0.00 H ATOM 30 N SER A 4 -5.618 2.766 0.730 1.00 0.00 N ATOM 31 CA SER A 4 -6.954 2.127 0.928 1.00 0.00 C ATOM 32 C SER A 4 -6.935 0.709 0.335 1.00 0.00 C ATOM 33 O SER A 4 -7.677 -0.163 0.755 1.00 0.00 O ATOM 34 CB SER A 4 -7.954 3.011 0.177 1.00 0.00 C ATOM 35 OG SER A 4 -7.451 4.345 0.079 1.00 0.00 O ATOM 36 H SER A 4 -5.520 3.498 0.084 1.00 0.00 H ATOM 37 HA SER A 4 -7.205 2.092 1.976 1.00 0.00 H ATOM 38 HB2 SER A 4 -8.107 2.617 -0.815 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.897 3.010 0.709 1.00 0.00 H ATOM 40 HG SER A 4 -7.601 4.786 0.927 1.00 0.00 H ATOM 41 N ASN A 5 -6.081 0.473 -0.632 1.00 0.00 N ATOM 42 CA ASN A 5 -5.995 -0.882 -1.253 1.00 0.00 C ATOM 43 C ASN A 5 -5.102 -1.789 -0.399 1.00 0.00 C ATOM 44 O ASN A 5 -3.985 -1.420 -0.084 1.00 0.00 O ATOM 45 CB ASN A 5 -5.350 -0.649 -2.627 1.00 0.00 C ATOM 46 CG ASN A 5 -5.319 -1.953 -3.437 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.392 -3.036 -2.889 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.194 -1.896 -4.732 1.00 0.00 N ATOM 49 H ASN A 5 -5.487 1.188 -0.944 1.00 0.00 H ATOM 50 HA ASN A 5 -6.979 -1.310 -1.372 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.916 0.095 -3.165 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.337 -0.296 -2.486 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.116 -1.030 -5.179 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.174 -2.721 -5.261 1.00 0.00 H ATOM 55 N PRO A 6 -5.605 -2.955 -0.077 1.00 0.00 N ATOM 56 CA PRO A 6 -4.821 -3.924 0.731 1.00 0.00 C ATOM 57 C PRO A 6 -3.578 -4.354 -0.053 1.00 0.00 C ATOM 58 O PRO A 6 -2.533 -4.605 0.516 1.00 0.00 O ATOM 59 CB PRO A 6 -5.792 -5.087 0.950 1.00 0.00 C ATOM 60 CG PRO A 6 -6.770 -4.972 -0.173 1.00 0.00 C ATOM 61 CD PRO A 6 -6.923 -3.497 -0.444 1.00 0.00 C ATOM 62 HA PRO A 6 -4.542 -3.492 1.677 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.266 -6.032 0.899 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.300 -4.990 1.898 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.386 -5.476 -1.049 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.722 -5.394 0.113 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.129 -3.325 -1.491 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.694 -3.066 0.176 1.00 0.00 H ATOM 69 N ALA A 7 -3.673 -4.414 -1.362 1.00 0.00 N ATOM 70 CA ALA A 7 -2.487 -4.792 -2.179 1.00 0.00 C ATOM 71 C ALA A 7 -1.456 -3.663 -2.099 1.00 0.00 C ATOM 72 O ALA A 7 -0.288 -3.900 -1.855 1.00 0.00 O ATOM 73 CB ALA A 7 -3.007 -4.960 -3.612 1.00 0.00 C ATOM 74 H ALA A 7 -4.521 -4.182 -1.805 1.00 0.00 H ATOM 75 HA ALA A 7 -2.061 -5.719 -1.824 1.00 0.00 H ATOM 76 HB1 ALA A 7 -3.188 -3.990 -4.048 1.00 0.00 H ATOM 77 HB2 ALA A 7 -3.928 -5.523 -3.597 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.275 -5.488 -4.201 1.00 0.00 H ATOM 79 N CYS A 8 -1.879 -2.432 -2.273 1.00 0.00 N ATOM 80 CA CYS A 8 -0.912 -1.297 -2.181 1.00 0.00 C ATOM 81 C CYS A 8 -0.359 -1.210 -0.760 1.00 0.00 C ATOM 82 O CYS A 8 0.830 -1.048 -0.563 1.00 0.00 O ATOM 83 CB CYS A 8 -1.688 -0.028 -2.531 1.00 0.00 C ATOM 84 SG CYS A 8 -0.656 1.418 -2.155 1.00 0.00 S ATOM 85 H CYS A 8 -2.825 -2.259 -2.451 1.00 0.00 H ATOM 86 HA CYS A 8 -0.113 -1.440 -2.885 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.933 -0.032 -3.581 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.593 0.013 -1.945 1.00 0.00 H ATOM 89 N MET A 9 -1.212 -1.327 0.237 1.00 0.00 N ATOM 90 CA MET A 9 -0.730 -1.264 1.655 1.00 0.00 C ATOM 91 C MET A 9 0.488 -2.175 1.835 1.00 0.00 C ATOM 92 O MET A 9 1.450 -1.813 2.489 1.00 0.00 O ATOM 93 CB MET A 9 -1.899 -1.762 2.515 1.00 0.00 C ATOM 94 CG MET A 9 -2.458 -0.609 3.349 1.00 0.00 C ATOM 95 SD MET A 9 -2.606 -1.133 5.077 1.00 0.00 S ATOM 96 CE MET A 9 -0.836 -1.220 5.452 1.00 0.00 C ATOM 97 H MET A 9 -2.169 -1.464 0.047 1.00 0.00 H ATOM 98 HA MET A 9 -0.480 -0.251 1.922 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.681 -2.157 1.882 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.545 -2.538 3.175 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.797 0.242 3.286 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.432 -0.335 2.971 1.00 0.00 H ATOM 103 HE1 MET A 9 -0.348 -0.327 5.085 1.00 0.00 H ATOM 104 HE2 MET A 9 -0.413 -2.091 4.973 1.00 0.00 H ATOM 105 HE3 MET A 9 -0.697 -1.292 6.518 1.00 0.00 H ATOM 106 N VAL A 10 0.456 -3.346 1.251 1.00 0.00 N ATOM 107 CA VAL A 10 1.616 -4.282 1.373 1.00 0.00 C ATOM 108 C VAL A 10 2.685 -3.914 0.338 1.00 0.00 C ATOM 109 O VAL A 10 3.869 -3.923 0.622 1.00 0.00 O ATOM 110 CB VAL A 10 1.035 -5.675 1.087 1.00 0.00 C ATOM 111 CG1 VAL A 10 2.137 -6.735 1.178 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.048 -5.995 2.117 1.00 0.00 C ATOM 113 H VAL A 10 -0.329 -3.610 0.722 1.00 0.00 H ATOM 114 HA VAL A 10 2.026 -4.250 2.372 1.00 0.00 H ATOM 115 HB VAL A 10 0.606 -5.685 0.094 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.950 -7.509 0.451 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.140 -7.166 2.166 1.00 0.00 H ATOM 118 HG13 VAL A 10 3.098 -6.281 0.984 1.00 0.00 H ATOM 119 HG21 VAL A 10 0.377 -5.967 3.110 1.00 0.00 H ATOM 120 HG22 VAL A 10 -0.448 -6.979 1.926 1.00 0.00 H ATOM 121 HG23 VAL A 10 -0.838 -5.266 2.045 1.00 0.00 H ATOM 122 N ASN A 11 2.272 -3.589 -0.864 1.00 0.00 N ATOM 123 CA ASN A 11 3.259 -3.217 -1.930 1.00 0.00 C ATOM 124 C ASN A 11 4.008 -1.932 -1.560 1.00 0.00 C ATOM 125 O ASN A 11 5.125 -1.718 -1.990 1.00 0.00 O ATOM 126 CB ASN A 11 2.435 -3.001 -3.203 1.00 0.00 C ATOM 127 CG ASN A 11 2.304 -4.324 -3.956 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.148 -4.665 -4.766 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.278 -5.093 -3.727 1.00 0.00 N ATOM 130 H ASN A 11 1.310 -3.591 -1.065 1.00 0.00 H ATOM 131 HA ASN A 11 3.960 -4.023 -2.086 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.454 -2.635 -2.945 1.00 0.00 H ATOM 133 HB3 ASN A 11 2.931 -2.278 -3.833 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.596 -4.821 -3.076 1.00 0.00 H ATOM 135 HD22 ASN A 11 1.194 -5.949 -4.198 1.00 0.00 H ATOM 136 N ASN A 12 3.409 -1.078 -0.768 1.00 0.00 N ATOM 137 CA ASN A 12 4.089 0.193 -0.366 1.00 0.00 C ATOM 138 C ASN A 12 4.433 0.145 1.131 1.00 0.00 C ATOM 139 O ASN A 12 3.803 0.815 1.930 1.00 0.00 O ATOM 140 CB ASN A 12 3.066 1.299 -0.647 1.00 0.00 C ATOM 141 CG ASN A 12 3.253 1.846 -2.066 1.00 0.00 C ATOM 142 OD1 ASN A 12 3.530 3.016 -2.241 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.108 1.057 -3.095 1.00 0.00 N ATOM 144 H ASN A 12 2.506 -1.272 -0.434 1.00 0.00 H ATOM 145 HA ASN A 12 4.976 0.349 -0.957 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.066 0.905 -0.538 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.211 2.100 0.061 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.877 0.115 -2.965 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.227 1.410 -4.002 1.00 0.00 H ATOM 150 N PRO A 13 5.419 -0.656 1.467 1.00 0.00 N ATOM 151 CA PRO A 13 5.836 -0.814 2.891 1.00 0.00 C ATOM 152 C PRO A 13 6.504 0.456 3.435 1.00 0.00 C ATOM 153 O PRO A 13 6.404 0.756 4.610 1.00 0.00 O ATOM 154 CB PRO A 13 6.836 -1.968 2.845 1.00 0.00 C ATOM 155 CG PRO A 13 7.364 -1.961 1.446 1.00 0.00 C ATOM 156 CD PRO A 13 6.244 -1.477 0.563 1.00 0.00 C ATOM 157 HA PRO A 13 4.991 -1.087 3.501 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.634 -1.798 3.555 1.00 0.00 H ATOM 159 HB3 PRO A 13 6.342 -2.907 3.051 1.00 0.00 H ATOM 160 HG2 PRO A 13 8.208 -1.290 1.377 1.00 0.00 H ATOM 161 HG3 PRO A 13 7.659 -2.959 1.151 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.634 -0.878 -0.252 1.00 0.00 H ATOM 163 HD3 PRO A 13 5.669 -2.307 0.185 1.00 0.00 H ATOM 164 N GLN A 14 7.177 1.202 2.601 1.00 0.00 N ATOM 165 CA GLN A 14 7.848 2.454 3.092 1.00 0.00 C ATOM 166 C GLN A 14 6.940 3.671 2.881 1.00 0.00 C ATOM 167 O GLN A 14 7.222 4.750 3.370 1.00 0.00 O ATOM 168 CB GLN A 14 9.173 2.641 2.314 1.00 0.00 C ATOM 169 CG GLN A 14 9.355 1.602 1.195 1.00 0.00 C ATOM 170 CD GLN A 14 8.485 1.983 -0.003 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.389 1.478 -0.158 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.919 2.865 -0.853 1.00 0.00 N ATOM 173 H GLN A 14 7.236 0.943 1.661 1.00 0.00 H ATOM 174 HA GLN A 14 8.068 2.352 4.143 1.00 0.00 H ATOM 175 HB2 GLN A 14 9.185 3.628 1.876 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.998 2.557 3.007 1.00 0.00 H ATOM 177 HG2 GLN A 14 10.393 1.584 0.893 1.00 0.00 H ATOM 178 HG3 GLN A 14 9.073 0.624 1.554 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.796 3.278 -0.721 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.371 3.115 -1.626 1.00 0.00 H ATOM 181 N ILE A 15 5.860 3.510 2.162 1.00 0.00 N ATOM 182 CA ILE A 15 4.932 4.654 1.926 1.00 0.00 C ATOM 183 C ILE A 15 3.665 4.477 2.774 1.00 0.00 C ATOM 184 O ILE A 15 3.116 5.431 3.292 1.00 0.00 O ATOM 185 CB ILE A 15 4.588 4.615 0.429 1.00 0.00 C ATOM 186 CG1 ILE A 15 5.853 4.370 -0.401 1.00 0.00 C ATOM 187 CG2 ILE A 15 3.968 5.952 0.009 1.00 0.00 C ATOM 188 CD1 ILE A 15 6.883 5.475 -0.138 1.00 0.00 C ATOM 189 H ILE A 15 5.657 2.635 1.781 1.00 0.00 H ATOM 190 HA ILE A 15 5.418 5.583 2.168 1.00 0.00 H ATOM 191 HB ILE A 15 3.877 3.820 0.247 1.00 0.00 H ATOM 192 HG12 ILE A 15 6.276 3.414 -0.130 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.594 4.364 -1.449 1.00 0.00 H ATOM 194 HG21 ILE A 15 3.581 6.463 0.877 1.00 0.00 H ATOM 195 HG22 ILE A 15 3.165 5.772 -0.690 1.00 0.00 H ATOM 196 HG23 ILE A 15 4.721 6.567 -0.463 1.00 0.00 H ATOM 197 HD11 ILE A 15 6.424 6.444 -0.293 1.00 0.00 H ATOM 198 HD12 ILE A 15 7.714 5.360 -0.817 1.00 0.00 H ATOM 199 HD13 ILE A 15 7.239 5.406 0.882 1.00 0.00 H ATOM 200 N CYS A 16 3.200 3.262 2.923 1.00 0.00 N ATOM 201 CA CYS A 16 1.976 3.014 3.737 1.00 0.00 C ATOM 202 C CYS A 16 2.336 2.140 4.949 1.00 0.00 C ATOM 203 O CYS A 16 1.855 1.033 5.088 1.00 0.00 O ATOM 204 CB CYS A 16 1.016 2.281 2.790 1.00 0.00 C ATOM 205 SG CYS A 16 -0.697 2.582 3.296 1.00 0.00 S ATOM 206 H CYS A 16 3.659 2.506 2.498 1.00 0.00 H ATOM 207 HA CYS A 16 1.539 3.945 4.059 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.160 2.644 1.782 1.00 0.00 H ATOM 209 HB3 CYS A 16 1.220 1.220 2.820 1.00 0.00 H HETATM 210 N NH2 A 17 3.191 2.588 5.830 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.585 3.480 5.727 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.442 2.029 6.595 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 18 ATOM 1 N GLY A 1 -6.237 7.145 -3.427 1.00 0.00 N ATOM 2 CA GLY A 1 -5.506 6.725 -2.199 1.00 0.00 C ATOM 3 C GLY A 1 -4.883 5.349 -2.428 1.00 0.00 C ATOM 4 O GLY A 1 -5.434 4.525 -3.135 1.00 0.00 O ATOM 5 H1 GLY A 1 -5.586 7.621 -4.074 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.005 7.794 -3.167 1.00 0.00 H ATOM 7 H3 GLY A 1 -6.633 6.308 -3.896 1.00 0.00 H ATOM 8 HA2 GLY A 1 -4.731 7.448 -1.976 1.00 0.00 H ATOM 9 HA3 GLY A 1 -6.194 6.668 -1.372 1.00 0.00 H ATOM 10 N CYS A 2 -3.744 5.086 -1.841 1.00 0.00 N ATOM 11 CA CYS A 2 -3.089 3.756 -2.036 1.00 0.00 C ATOM 12 C CYS A 2 -3.243 2.889 -0.789 1.00 0.00 C ATOM 13 O CYS A 2 -3.581 1.726 -0.868 1.00 0.00 O ATOM 14 CB CYS A 2 -1.613 4.064 -2.286 1.00 0.00 C ATOM 15 SG CYS A 2 -0.889 2.759 -3.314 1.00 0.00 S ATOM 16 H CYS A 2 -3.316 5.765 -1.277 1.00 0.00 H ATOM 17 HA CYS A 2 -3.505 3.252 -2.886 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.522 5.012 -2.787 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.094 4.106 -1.342 1.00 0.00 H ATOM 20 N CYS A 3 -2.988 3.447 0.359 1.00 0.00 N ATOM 21 CA CYS A 3 -3.106 2.662 1.633 1.00 0.00 C ATOM 22 C CYS A 3 -4.480 1.983 1.736 1.00 0.00 C ATOM 23 O CYS A 3 -4.612 0.930 2.331 1.00 0.00 O ATOM 24 CB CYS A 3 -2.920 3.679 2.761 1.00 0.00 C ATOM 25 SG CYS A 3 -1.525 3.175 3.801 1.00 0.00 S ATOM 26 H CYS A 3 -2.713 4.386 0.380 1.00 0.00 H ATOM 27 HA CYS A 3 -2.328 1.918 1.680 1.00 0.00 H ATOM 28 HB2 CYS A 3 -2.722 4.655 2.343 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.818 3.721 3.361 1.00 0.00 H ATOM 30 N SER A 4 -5.500 2.566 1.152 1.00 0.00 N ATOM 31 CA SER A 4 -6.856 1.936 1.205 1.00 0.00 C ATOM 32 C SER A 4 -6.848 0.609 0.432 1.00 0.00 C ATOM 33 O SER A 4 -7.651 -0.266 0.683 1.00 0.00 O ATOM 34 CB SER A 4 -7.803 2.956 0.559 1.00 0.00 C ATOM 35 OG SER A 4 -7.545 4.254 1.102 1.00 0.00 O ATOM 36 H SER A 4 -5.372 3.403 0.668 1.00 0.00 H ATOM 37 HA SER A 4 -7.146 1.767 2.230 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.646 2.975 -0.509 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.827 2.669 0.761 1.00 0.00 H ATOM 40 HG SER A 4 -8.396 4.696 1.223 1.00 0.00 H ATOM 41 N ASN A 5 -5.926 0.443 -0.488 1.00 0.00 N ATOM 42 CA ASN A 5 -5.849 -0.837 -1.245 1.00 0.00 C ATOM 43 C ASN A 5 -4.920 -1.792 -0.499 1.00 0.00 C ATOM 44 O ASN A 5 -3.760 -1.473 -0.292 1.00 0.00 O ATOM 45 CB ASN A 5 -5.247 -0.490 -2.613 1.00 0.00 C ATOM 46 CG ASN A 5 -5.380 -1.693 -3.556 1.00 0.00 C ATOM 47 OD1 ASN A 5 -6.055 -2.658 -3.246 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.763 -1.676 -4.701 1.00 0.00 N ATOM 49 H ASN A 5 -5.272 1.155 -0.663 1.00 0.00 H ATOM 50 HA ASN A 5 -6.830 -1.268 -1.364 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.766 0.360 -3.033 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.197 -0.251 -2.495 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.224 -0.900 -4.956 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.836 -2.444 -5.309 1.00 0.00 H ATOM 55 N PRO A 6 -5.440 -2.937 -0.127 1.00 0.00 N ATOM 56 CA PRO A 6 -4.614 -3.938 0.595 1.00 0.00 C ATOM 57 C PRO A 6 -3.443 -4.371 -0.285 1.00 0.00 C ATOM 58 O PRO A 6 -2.343 -4.582 0.193 1.00 0.00 O ATOM 59 CB PRO A 6 -5.595 -5.081 0.882 1.00 0.00 C ATOM 60 CG PRO A 6 -6.671 -4.913 -0.138 1.00 0.00 C ATOM 61 CD PRO A 6 -6.806 -3.424 -0.350 1.00 0.00 C ATOM 62 HA PRO A 6 -4.249 -3.522 1.523 1.00 0.00 H ATOM 63 HB2 PRO A 6 -5.100 -6.036 0.758 1.00 0.00 H ATOM 64 HB3 PRO A 6 -6.002 -4.989 1.877 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.390 -5.407 -1.060 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.600 -5.314 0.230 1.00 0.00 H ATOM 67 HD2 PRO A 6 -7.135 -3.208 -1.359 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.478 -2.989 0.376 1.00 0.00 H ATOM 69 N ALA A 7 -3.660 -4.467 -1.572 1.00 0.00 N ATOM 70 CA ALA A 7 -2.545 -4.848 -2.483 1.00 0.00 C ATOM 71 C ALA A 7 -1.449 -3.781 -2.409 1.00 0.00 C ATOM 72 O ALA A 7 -0.275 -4.093 -2.385 1.00 0.00 O ATOM 73 CB ALA A 7 -3.160 -4.899 -3.885 1.00 0.00 C ATOM 74 H ALA A 7 -4.547 -4.263 -1.939 1.00 0.00 H ATOM 75 HA ALA A 7 -2.149 -5.814 -2.211 1.00 0.00 H ATOM 76 HB1 ALA A 7 -4.230 -5.030 -3.809 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.734 -5.725 -4.434 1.00 0.00 H ATOM 78 HB3 ALA A 7 -2.945 -3.975 -4.402 1.00 0.00 H ATOM 79 N CYS A 8 -1.824 -2.524 -2.357 1.00 0.00 N ATOM 80 CA CYS A 8 -0.794 -1.448 -2.268 1.00 0.00 C ATOM 81 C CYS A 8 -0.237 -1.382 -0.845 1.00 0.00 C ATOM 82 O CYS A 8 0.962 -1.306 -0.643 1.00 0.00 O ATOM 83 CB CYS A 8 -1.500 -0.132 -2.621 1.00 0.00 C ATOM 84 SG CYS A 8 -0.515 1.264 -2.008 1.00 0.00 S ATOM 85 H CYS A 8 -2.778 -2.295 -2.367 1.00 0.00 H ATOM 86 HA CYS A 8 -0.005 -1.638 -2.969 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.604 -0.056 -3.693 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.476 -0.108 -2.162 1.00 0.00 H ATOM 89 N MET A 9 -1.101 -1.399 0.139 1.00 0.00 N ATOM 90 CA MET A 9 -0.645 -1.321 1.563 1.00 0.00 C ATOM 91 C MET A 9 0.473 -2.328 1.846 1.00 0.00 C ATOM 92 O MET A 9 1.486 -1.993 2.433 1.00 0.00 O ATOM 93 CB MET A 9 -1.883 -1.667 2.400 1.00 0.00 C ATOM 94 CG MET A 9 -1.967 -0.735 3.616 1.00 0.00 C ATOM 95 SD MET A 9 -3.069 -1.455 4.856 1.00 0.00 S ATOM 96 CE MET A 9 -1.971 -2.787 5.407 1.00 0.00 C ATOM 97 H MET A 9 -2.063 -1.451 -0.060 1.00 0.00 H ATOM 98 HA MET A 9 -0.316 -0.322 1.794 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.769 -1.553 1.794 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.811 -2.692 2.738 1.00 0.00 H ATOM 101 HG2 MET A 9 -0.983 -0.607 4.042 1.00 0.00 H ATOM 102 HG3 MET A 9 -2.354 0.225 3.306 1.00 0.00 H ATOM 103 HE1 MET A 9 -1.397 -3.147 4.566 1.00 0.00 H ATOM 104 HE2 MET A 9 -2.561 -3.595 5.819 1.00 0.00 H ATOM 105 HE3 MET A 9 -1.301 -2.417 6.164 1.00 0.00 H ATOM 106 N VAL A 10 0.282 -3.560 1.462 1.00 0.00 N ATOM 107 CA VAL A 10 1.320 -4.604 1.738 1.00 0.00 C ATOM 108 C VAL A 10 2.509 -4.507 0.765 1.00 0.00 C ATOM 109 O VAL A 10 3.614 -4.890 1.099 1.00 0.00 O ATOM 110 CB VAL A 10 0.583 -5.950 1.591 1.00 0.00 C ATOM 111 CG1 VAL A 10 0.198 -6.193 0.125 1.00 0.00 C ATOM 112 CG2 VAL A 10 1.495 -7.084 2.070 1.00 0.00 C ATOM 113 H VAL A 10 -0.556 -3.803 1.008 1.00 0.00 H ATOM 114 HA VAL A 10 1.675 -4.501 2.750 1.00 0.00 H ATOM 115 HB VAL A 10 -0.314 -5.935 2.192 1.00 0.00 H ATOM 116 HG11 VAL A 10 0.188 -5.253 -0.407 1.00 0.00 H ATOM 117 HG12 VAL A 10 -0.785 -6.637 0.079 1.00 0.00 H ATOM 118 HG13 VAL A 10 0.914 -6.860 -0.331 1.00 0.00 H ATOM 119 HG21 VAL A 10 1.941 -7.569 1.215 1.00 0.00 H ATOM 120 HG22 VAL A 10 0.913 -7.802 2.629 1.00 0.00 H ATOM 121 HG23 VAL A 10 2.275 -6.681 2.703 1.00 0.00 H ATOM 122 N ASN A 11 2.303 -4.014 -0.429 1.00 0.00 N ATOM 123 CA ASN A 11 3.445 -3.929 -1.398 1.00 0.00 C ATOM 124 C ASN A 11 4.210 -2.612 -1.258 1.00 0.00 C ATOM 125 O ASN A 11 5.362 -2.525 -1.644 1.00 0.00 O ATOM 126 CB ASN A 11 2.813 -4.009 -2.788 1.00 0.00 C ATOM 127 CG ASN A 11 3.265 -5.292 -3.485 1.00 0.00 C ATOM 128 OD1 ASN A 11 4.428 -5.446 -3.810 1.00 0.00 O ATOM 129 ND2 ASN A 11 2.390 -6.224 -3.733 1.00 0.00 N ATOM 130 H ASN A 11 1.409 -3.714 -0.694 1.00 0.00 H ATOM 131 HA ASN A 11 4.113 -4.763 -1.258 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.741 -4.004 -2.700 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.129 -3.160 -3.372 1.00 0.00 H ATOM 134 HD21 ASN A 11 1.454 -6.101 -3.473 1.00 0.00 H ATOM 135 HD22 ASN A 11 2.669 -7.047 -4.179 1.00 0.00 H ATOM 136 N ASN A 12 3.596 -1.581 -0.736 1.00 0.00 N ATOM 137 CA ASN A 12 4.309 -0.280 -0.609 1.00 0.00 C ATOM 138 C ASN A 12 4.492 0.109 0.860 1.00 0.00 C ATOM 139 O ASN A 12 3.709 0.873 1.397 1.00 0.00 O ATOM 140 CB ASN A 12 3.409 0.733 -1.322 1.00 0.00 C ATOM 141 CG ASN A 12 3.750 0.769 -2.812 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.668 1.454 -3.227 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.038 0.062 -3.639 1.00 0.00 N ATOM 144 H ASN A 12 2.661 -1.658 -0.439 1.00 0.00 H ATOM 145 HA ASN A 12 5.264 -0.325 -1.106 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.374 0.443 -1.198 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.561 1.710 -0.895 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.296 -0.484 -3.304 1.00 0.00 H ATOM 149 HD22 ASN A 12 3.244 0.070 -4.597 1.00 0.00 H ATOM 150 N PRO A 13 5.545 -0.403 1.461 1.00 0.00 N ATOM 151 CA PRO A 13 5.859 -0.074 2.883 1.00 0.00 C ATOM 152 C PRO A 13 6.179 1.421 3.015 1.00 0.00 C ATOM 153 O PRO A 13 5.959 2.029 4.048 1.00 0.00 O ATOM 154 CB PRO A 13 7.084 -0.937 3.186 1.00 0.00 C ATOM 155 CG PRO A 13 7.694 -1.205 1.849 1.00 0.00 C ATOM 156 CD PRO A 13 6.539 -1.322 0.891 1.00 0.00 C ATOM 157 HA PRO A 13 5.040 -0.348 3.532 1.00 0.00 H ATOM 158 HB2 PRO A 13 7.777 -0.396 3.820 1.00 0.00 H ATOM 159 HB3 PRO A 13 6.788 -1.863 3.653 1.00 0.00 H ATOM 160 HG2 PRO A 13 8.344 -0.388 1.561 1.00 0.00 H ATOM 161 HG3 PRO A 13 8.246 -2.132 1.867 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.829 -1.011 -0.105 1.00 0.00 H ATOM 163 HD3 PRO A 13 6.152 -2.328 0.882 1.00 0.00 H ATOM 164 N GLN A 14 6.682 2.015 1.959 1.00 0.00 N ATOM 165 CA GLN A 14 7.002 3.475 1.977 1.00 0.00 C ATOM 166 C GLN A 14 5.701 4.261 2.115 1.00 0.00 C ATOM 167 O GLN A 14 5.617 5.227 2.850 1.00 0.00 O ATOM 168 CB GLN A 14 7.678 3.744 0.621 1.00 0.00 C ATOM 169 CG GLN A 14 7.684 5.245 0.296 1.00 0.00 C ATOM 170 CD GLN A 14 7.316 5.445 -1.176 1.00 0.00 C ATOM 171 OE1 GLN A 14 6.571 6.343 -1.511 1.00 0.00 O ATOM 172 NE2 GLN A 14 7.813 4.650 -2.083 1.00 0.00 N ATOM 173 H GLN A 14 6.836 1.494 1.145 1.00 0.00 H ATOM 174 HA GLN A 14 7.670 3.705 2.780 1.00 0.00 H ATOM 175 HB2 GLN A 14 8.697 3.387 0.653 1.00 0.00 H ATOM 176 HB3 GLN A 14 7.142 3.216 -0.156 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.968 5.760 0.923 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.670 5.647 0.473 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.421 3.923 -1.824 1.00 0.00 H ATOM 180 HE22 GLN A 14 7.581 4.777 -3.026 1.00 0.00 H ATOM 181 N ILE A 15 4.688 3.832 1.421 1.00 0.00 N ATOM 182 CA ILE A 15 3.365 4.518 1.493 1.00 0.00 C ATOM 183 C ILE A 15 2.608 4.030 2.731 1.00 0.00 C ATOM 184 O ILE A 15 1.996 4.805 3.441 1.00 0.00 O ATOM 185 CB ILE A 15 2.629 4.118 0.206 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.326 4.764 -1.001 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.173 4.599 0.269 1.00 0.00 C ATOM 188 CD1 ILE A 15 2.941 6.243 -1.089 1.00 0.00 C ATOM 189 H ILE A 15 4.799 3.041 0.858 1.00 0.00 H ATOM 190 HA ILE A 15 3.498 5.587 1.530 1.00 0.00 H ATOM 191 HB ILE A 15 2.647 3.044 0.103 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.396 4.682 -0.885 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.021 4.259 -1.905 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.129 5.539 0.801 1.00 0.00 H ATOM 195 HG22 ILE A 15 0.569 3.866 0.784 1.00 0.00 H ATOM 196 HG23 ILE A 15 0.797 4.735 -0.733 1.00 0.00 H ATOM 197 HD11 ILE A 15 1.907 6.328 -1.393 1.00 0.00 H ATOM 198 HD12 ILE A 15 3.570 6.738 -1.813 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.070 6.706 -0.124 1.00 0.00 H ATOM 200 N CYS A 16 2.648 2.751 2.998 1.00 0.00 N ATOM 201 CA CYS A 16 1.938 2.206 4.191 1.00 0.00 C ATOM 202 C CYS A 16 2.921 1.409 5.054 1.00 0.00 C ATOM 203 O CYS A 16 3.291 0.299 4.718 1.00 0.00 O ATOM 204 CB CYS A 16 0.844 1.294 3.627 1.00 0.00 C ATOM 205 SG CYS A 16 -0.244 2.248 2.539 1.00 0.00 S ATOM 206 H CYS A 16 3.152 2.143 2.415 1.00 0.00 H ATOM 207 HA CYS A 16 1.492 3.005 4.759 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.298 0.487 3.069 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.263 0.885 4.441 1.00 0.00 H HETATM 210 N NH2 A 17 3.369 1.932 6.160 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.073 2.827 6.436 1.00 0.00 H HETATM 212 HN2 NH2 A 17 3.997 1.431 6.718 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 19 ATOM 1 N GLY A 1 -6.972 5.978 -1.810 1.00 0.00 N ATOM 2 CA GLY A 1 -6.213 5.622 -3.041 1.00 0.00 C ATOM 3 C GLY A 1 -5.427 4.330 -2.800 1.00 0.00 C ATOM 4 O GLY A 1 -5.982 3.323 -2.405 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.908 6.343 -2.072 1.00 0.00 H ATOM 6 H2 GLY A 1 -6.450 6.706 -1.286 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.089 5.130 -1.210 1.00 0.00 H ATOM 8 HA2 GLY A 1 -6.905 5.473 -3.856 1.00 0.00 H ATOM 9 HA3 GLY A 1 -5.529 6.421 -3.286 1.00 0.00 H ATOM 10 N CYS A 2 -4.139 4.336 -3.018 1.00 0.00 N ATOM 11 CA CYS A 2 -3.355 3.086 -2.781 1.00 0.00 C ATOM 12 C CYS A 2 -3.318 2.776 -1.282 1.00 0.00 C ATOM 13 O CYS A 2 -3.485 1.649 -0.869 1.00 0.00 O ATOM 14 CB CYS A 2 -1.941 3.363 -3.307 1.00 0.00 C ATOM 15 SG CYS A 2 -1.393 2.043 -4.433 1.00 0.00 S ATOM 16 H CYS A 2 -3.691 5.154 -3.324 1.00 0.00 H ATOM 17 HA CYS A 2 -3.795 2.269 -3.313 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.932 4.309 -3.836 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.264 3.420 -2.472 1.00 0.00 H ATOM 20 N CYS A 3 -3.114 3.768 -0.467 1.00 0.00 N ATOM 21 CA CYS A 3 -3.065 3.533 1.011 1.00 0.00 C ATOM 22 C CYS A 3 -4.327 2.802 1.492 1.00 0.00 C ATOM 23 O CYS A 3 -4.259 1.959 2.365 1.00 0.00 O ATOM 24 CB CYS A 3 -2.967 4.917 1.656 1.00 0.00 C ATOM 25 SG CYS A 3 -1.334 5.100 2.425 1.00 0.00 S ATOM 26 H CYS A 3 -2.992 4.668 -0.826 1.00 0.00 H ATOM 27 HA CYS A 3 -2.187 2.954 1.260 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.097 5.680 0.904 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.734 5.017 2.409 1.00 0.00 H ATOM 30 N SER A 4 -5.470 3.102 0.922 1.00 0.00 N ATOM 31 CA SER A 4 -6.732 2.406 1.342 1.00 0.00 C ATOM 32 C SER A 4 -6.794 0.980 0.760 1.00 0.00 C ATOM 33 O SER A 4 -7.721 0.234 1.025 1.00 0.00 O ATOM 34 CB SER A 4 -7.882 3.260 0.783 1.00 0.00 C ATOM 35 OG SER A 4 -7.483 3.865 -0.445 1.00 0.00 O ATOM 36 H SER A 4 -5.501 3.777 0.211 1.00 0.00 H ATOM 37 HA SER A 4 -6.794 2.370 2.418 1.00 0.00 H ATOM 38 HB2 SER A 4 -8.745 2.634 0.607 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.141 4.022 1.505 1.00 0.00 H ATOM 40 HG SER A 4 -7.571 3.200 -1.147 1.00 0.00 H ATOM 41 N ASN A 5 -5.824 0.595 -0.030 1.00 0.00 N ATOM 42 CA ASN A 5 -5.826 -0.774 -0.623 1.00 0.00 C ATOM 43 C ASN A 5 -4.741 -1.621 0.048 1.00 0.00 C ATOM 44 O ASN A 5 -3.588 -1.222 0.083 1.00 0.00 O ATOM 45 CB ASN A 5 -5.497 -0.558 -2.108 1.00 0.00 C ATOM 46 CG ASN A 5 -5.562 -1.886 -2.873 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.521 -2.949 -2.287 1.00 0.00 O ATOM 48 ND2 ASN A 5 -5.643 -1.870 -4.174 1.00 0.00 N ATOM 49 H ASN A 5 -5.087 1.206 -0.236 1.00 0.00 H ATOM 50 HA ASN A 5 -6.795 -1.233 -0.519 1.00 0.00 H ATOM 51 HB2 ASN A 5 -6.211 0.132 -2.530 1.00 0.00 H ATOM 52 HB3 ASN A 5 -4.502 -0.147 -2.194 1.00 0.00 H ATOM 53 HD21 ASN A 5 -5.659 -1.016 -4.657 1.00 0.00 H ATOM 54 HD22 ASN A 5 -5.697 -2.714 -4.671 1.00 0.00 H ATOM 55 N PRO A 6 -5.129 -2.772 0.547 1.00 0.00 N ATOM 56 CA PRO A 6 -4.156 -3.678 1.211 1.00 0.00 C ATOM 57 C PRO A 6 -3.095 -4.113 0.198 1.00 0.00 C ATOM 58 O PRO A 6 -1.921 -4.192 0.519 1.00 0.00 O ATOM 59 CB PRO A 6 -5.017 -4.844 1.696 1.00 0.00 C ATOM 60 CG PRO A 6 -6.221 -4.805 0.815 1.00 0.00 C ATOM 61 CD PRO A 6 -6.476 -3.346 0.531 1.00 0.00 C ATOM 62 HA PRO A 6 -3.696 -3.184 2.052 1.00 0.00 H ATOM 63 HB2 PRO A 6 -4.483 -5.780 1.579 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.304 -4.698 2.724 1.00 0.00 H ATOM 65 HG2 PRO A 6 -6.027 -5.341 -0.104 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.070 -5.230 1.324 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.937 -3.220 -0.440 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.077 -2.901 1.305 1.00 0.00 H ATOM 69 N ALA A 7 -3.483 -4.348 -1.037 1.00 0.00 N ATOM 70 CA ALA A 7 -2.469 -4.720 -2.070 1.00 0.00 C ATOM 71 C ALA A 7 -1.450 -3.584 -2.154 1.00 0.00 C ATOM 72 O ALA A 7 -0.252 -3.804 -2.190 1.00 0.00 O ATOM 73 CB ALA A 7 -3.236 -4.861 -3.390 1.00 0.00 C ATOM 74 H ALA A 7 -4.429 -4.242 -1.286 1.00 0.00 H ATOM 75 HA ALA A 7 -1.985 -5.649 -1.813 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.751 -4.271 -4.154 1.00 0.00 H ATOM 77 HB2 ALA A 7 -4.249 -4.518 -3.258 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.246 -5.899 -3.691 1.00 0.00 H ATOM 79 N CYS A 8 -1.925 -2.364 -2.150 1.00 0.00 N ATOM 80 CA CYS A 8 -0.997 -1.204 -2.187 1.00 0.00 C ATOM 81 C CYS A 8 -0.157 -1.202 -0.907 1.00 0.00 C ATOM 82 O CYS A 8 1.042 -1.013 -0.942 1.00 0.00 O ATOM 83 CB CYS A 8 -1.889 0.035 -2.218 1.00 0.00 C ATOM 84 SG CYS A 8 -2.425 0.383 -3.913 1.00 0.00 S ATOM 85 H CYS A 8 -2.892 -2.214 -2.096 1.00 0.00 H ATOM 86 HA CYS A 8 -0.371 -1.242 -3.064 1.00 0.00 H ATOM 87 HB2 CYS A 8 -2.754 -0.139 -1.601 1.00 0.00 H ATOM 88 HB3 CYS A 8 -1.340 0.880 -1.832 1.00 0.00 H ATOM 89 N MET A 9 -0.789 -1.417 0.222 1.00 0.00 N ATOM 90 CA MET A 9 -0.052 -1.437 1.517 1.00 0.00 C ATOM 91 C MET A 9 1.047 -2.502 1.483 1.00 0.00 C ATOM 92 O MET A 9 2.172 -2.254 1.868 1.00 0.00 O ATOM 93 CB MET A 9 -1.114 -1.789 2.560 1.00 0.00 C ATOM 94 CG MET A 9 -1.943 -0.547 2.904 1.00 0.00 C ATOM 95 SD MET A 9 -3.674 -1.028 3.160 1.00 0.00 S ATOM 96 CE MET A 9 -3.415 -2.133 4.572 1.00 0.00 C ATOM 97 H MET A 9 -1.758 -1.572 0.216 1.00 0.00 H ATOM 98 HA MET A 9 0.368 -0.470 1.728 1.00 0.00 H ATOM 99 HB2 MET A 9 -1.764 -2.556 2.165 1.00 0.00 H ATOM 100 HB3 MET A 9 -0.633 -2.153 3.448 1.00 0.00 H ATOM 101 HG2 MET A 9 -1.555 -0.093 3.806 1.00 0.00 H ATOM 102 HG3 MET A 9 -1.883 0.163 2.091 1.00 0.00 H ATOM 103 HE1 MET A 9 -3.746 -1.640 5.475 1.00 0.00 H ATOM 104 HE2 MET A 9 -2.366 -2.379 4.653 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.981 -3.036 4.431 1.00 0.00 H ATOM 106 N VAL A 10 0.728 -3.682 1.019 1.00 0.00 N ATOM 107 CA VAL A 10 1.755 -4.766 0.951 1.00 0.00 C ATOM 108 C VAL A 10 2.837 -4.397 -0.074 1.00 0.00 C ATOM 109 O VAL A 10 4.013 -4.641 0.133 1.00 0.00 O ATOM 110 CB VAL A 10 0.993 -6.033 0.515 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.979 -7.194 0.346 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.045 -6.412 1.577 1.00 0.00 C ATOM 113 H VAL A 10 -0.189 -3.854 0.710 1.00 0.00 H ATOM 114 HA VAL A 10 2.200 -4.920 1.921 1.00 0.00 H ATOM 115 HB VAL A 10 0.495 -5.849 -0.426 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.503 -8.117 0.646 1.00 0.00 H ATOM 117 HG12 VAL A 10 2.851 -7.021 0.962 1.00 0.00 H ATOM 118 HG13 VAL A 10 2.278 -7.263 -0.691 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.696 -7.185 1.188 1.00 0.00 H ATOM 120 HG22 VAL A 10 -0.634 -5.543 1.832 1.00 0.00 H ATOM 121 HG23 VAL A 10 0.461 -6.778 2.462 1.00 0.00 H ATOM 122 N ASN A 11 2.452 -3.816 -1.179 1.00 0.00 N ATOM 123 CA ASN A 11 3.458 -3.440 -2.220 1.00 0.00 C ATOM 124 C ASN A 11 4.179 -2.139 -1.851 1.00 0.00 C ATOM 125 O ASN A 11 5.288 -1.896 -2.290 1.00 0.00 O ATOM 126 CB ASN A 11 2.653 -3.243 -3.506 1.00 0.00 C ATOM 127 CG ASN A 11 2.361 -4.600 -4.143 1.00 0.00 C ATOM 128 OD1 ASN A 11 3.246 -5.239 -4.678 1.00 0.00 O ATOM 129 ND2 ASN A 11 1.150 -5.072 -4.117 1.00 0.00 N ATOM 130 H ASN A 11 1.500 -3.629 -1.328 1.00 0.00 H ATOM 131 HA ASN A 11 4.172 -4.239 -2.355 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.723 -2.745 -3.277 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.220 -2.638 -4.196 1.00 0.00 H ATOM 134 HD21 ASN A 11 0.432 -4.558 -3.689 1.00 0.00 H ATOM 135 HD22 ASN A 11 0.951 -5.936 -4.534 1.00 0.00 H ATOM 136 N ASN A 12 3.559 -1.291 -1.069 1.00 0.00 N ATOM 137 CA ASN A 12 4.210 0.002 -0.697 1.00 0.00 C ATOM 138 C ASN A 12 4.100 0.254 0.817 1.00 0.00 C ATOM 139 O ASN A 12 3.507 1.232 1.237 1.00 0.00 O ATOM 140 CB ASN A 12 3.426 1.067 -1.471 1.00 0.00 C ATOM 141 CG ASN A 12 4.159 1.419 -2.763 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.915 2.369 -2.806 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.958 0.698 -3.828 1.00 0.00 N ATOM 144 H ASN A 12 2.656 -1.495 -0.735 1.00 0.00 H ATOM 145 HA ASN A 12 5.245 0.006 -1.007 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.447 0.685 -1.711 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.329 1.954 -0.864 1.00 0.00 H ATOM 148 HD21 ASN A 12 3.344 -0.064 -3.797 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.418 0.918 -4.662 1.00 0.00 H ATOM 150 N PRO A 13 4.691 -0.623 1.592 1.00 0.00 N ATOM 151 CA PRO A 13 4.666 -0.470 3.074 1.00 0.00 C ATOM 152 C PRO A 13 5.503 0.741 3.510 1.00 0.00 C ATOM 153 O PRO A 13 5.220 1.368 4.511 1.00 0.00 O ATOM 154 CB PRO A 13 5.279 -1.775 3.584 1.00 0.00 C ATOM 155 CG PRO A 13 6.115 -2.270 2.451 1.00 0.00 C ATOM 156 CD PRO A 13 5.429 -1.827 1.182 1.00 0.00 C ATOM 157 HA PRO A 13 3.651 -0.377 3.428 1.00 0.00 H ATOM 158 HB2 PRO A 13 5.896 -1.584 4.453 1.00 0.00 H ATOM 159 HB3 PRO A 13 4.507 -2.493 3.818 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.104 -1.841 2.510 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.175 -3.347 2.474 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.160 -1.587 0.421 1.00 0.00 H ATOM 163 HD3 PRO A 13 4.742 -2.584 0.829 1.00 0.00 H ATOM 164 N GLN A 14 6.530 1.076 2.763 1.00 0.00 N ATOM 165 CA GLN A 14 7.381 2.256 3.137 1.00 0.00 C ATOM 166 C GLN A 14 6.543 3.544 3.192 1.00 0.00 C ATOM 167 O GLN A 14 6.890 4.487 3.874 1.00 0.00 O ATOM 168 CB GLN A 14 8.469 2.349 2.054 1.00 0.00 C ATOM 169 CG GLN A 14 7.839 2.521 0.662 1.00 0.00 C ATOM 170 CD GLN A 14 7.913 1.199 -0.106 1.00 0.00 C ATOM 171 OE1 GLN A 14 7.568 0.161 0.422 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.353 1.189 -1.330 1.00 0.00 N ATOM 173 H GLN A 14 6.739 0.554 1.959 1.00 0.00 H ATOM 174 HA GLN A 14 7.840 2.084 4.091 1.00 0.00 H ATOM 175 HB2 GLN A 14 9.105 3.195 2.263 1.00 0.00 H ATOM 176 HB3 GLN A 14 9.061 1.446 2.067 1.00 0.00 H ATOM 177 HG2 GLN A 14 6.807 2.819 0.766 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.380 3.282 0.119 1.00 0.00 H ATOM 179 HE21 GLN A 14 8.635 2.025 -1.758 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.399 0.343 -1.826 1.00 0.00 H ATOM 181 N ILE A 15 5.446 3.585 2.488 1.00 0.00 N ATOM 182 CA ILE A 15 4.581 4.803 2.507 1.00 0.00 C ATOM 183 C ILE A 15 3.197 4.447 3.064 1.00 0.00 C ATOM 184 O ILE A 15 2.670 5.126 3.925 1.00 0.00 O ATOM 185 CB ILE A 15 4.481 5.263 1.044 1.00 0.00 C ATOM 186 CG1 ILE A 15 5.881 5.521 0.476 1.00 0.00 C ATOM 187 CG2 ILE A 15 3.671 6.556 0.967 1.00 0.00 C ATOM 188 CD1 ILE A 15 6.596 6.595 1.308 1.00 0.00 C ATOM 189 H ILE A 15 5.188 2.812 1.955 1.00 0.00 H ATOM 190 HA ILE A 15 5.039 5.578 3.105 1.00 0.00 H ATOM 191 HB ILE A 15 3.986 4.499 0.463 1.00 0.00 H ATOM 192 HG12 ILE A 15 6.454 4.605 0.496 1.00 0.00 H ATOM 193 HG13 ILE A 15 5.793 5.863 -0.541 1.00 0.00 H ATOM 194 HG21 ILE A 15 3.816 7.123 1.875 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.623 6.319 0.855 1.00 0.00 H ATOM 196 HG23 ILE A 15 4.002 7.141 0.120 1.00 0.00 H ATOM 197 HD11 ILE A 15 5.864 7.244 1.768 1.00 0.00 H ATOM 198 HD12 ILE A 15 7.238 7.181 0.664 1.00 0.00 H ATOM 199 HD13 ILE A 15 7.190 6.121 2.075 1.00 0.00 H ATOM 200 N CYS A 16 2.612 3.375 2.590 1.00 0.00 N ATOM 201 CA CYS A 16 1.271 2.959 3.100 1.00 0.00 C ATOM 202 C CYS A 16 1.417 1.689 3.944 1.00 0.00 C ATOM 203 O CYS A 16 0.749 0.700 3.712 1.00 0.00 O ATOM 204 CB CYS A 16 0.424 2.694 1.852 1.00 0.00 C ATOM 205 SG CYS A 16 -0.052 4.272 1.100 1.00 0.00 S ATOM 206 H CYS A 16 3.061 2.834 1.904 1.00 0.00 H ATOM 207 HA CYS A 16 0.829 3.749 3.685 1.00 0.00 H ATOM 208 HB2 CYS A 16 0.998 2.115 1.142 1.00 0.00 H ATOM 209 HB3 CYS A 16 -0.461 2.146 2.133 1.00 0.00 H HETATM 210 N NH2 A 17 2.276 1.673 4.927 1.00 0.00 N HETATM 211 HN1 NH2 A 17 2.818 2.468 5.119 1.00 0.00 H HETATM 212 HN2 NH2 A 17 2.378 0.868 5.474 1.00 0.00 H TER 213 NH2 A 17 ENDMDL MODEL 20 ATOM 1 N GLY A 1 -7.101 6.180 -1.179 1.00 0.00 N ATOM 2 CA GLY A 1 -5.681 6.443 -1.511 1.00 0.00 C ATOM 3 C GLY A 1 -4.932 5.119 -1.648 1.00 0.00 C ATOM 4 O GLY A 1 -5.529 4.058 -1.640 1.00 0.00 O ATOM 5 H1 GLY A 1 -7.155 5.439 -0.446 1.00 0.00 H ATOM 6 H2 GLY A 1 -7.602 5.862 -2.027 1.00 0.00 H ATOM 7 H3 GLY A 1 -7.540 7.047 -0.820 1.00 0.00 H ATOM 8 HA2 GLY A 1 -5.626 6.991 -2.438 1.00 0.00 H ATOM 9 HA3 GLY A 1 -5.234 7.025 -0.722 1.00 0.00 H ATOM 10 N CYS A 2 -3.627 5.163 -1.771 1.00 0.00 N ATOM 11 CA CYS A 2 -2.848 3.891 -1.905 1.00 0.00 C ATOM 12 C CYS A 2 -3.095 2.995 -0.699 1.00 0.00 C ATOM 13 O CYS A 2 -3.368 1.817 -0.829 1.00 0.00 O ATOM 14 CB CYS A 2 -1.374 4.292 -1.971 1.00 0.00 C ATOM 15 SG CYS A 2 -0.458 3.026 -2.888 1.00 0.00 S ATOM 16 H CYS A 2 -3.165 6.030 -1.769 1.00 0.00 H ATOM 17 HA CYS A 2 -3.129 3.380 -2.802 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.276 5.241 -2.463 1.00 0.00 H ATOM 19 HB3 CYS A 2 -0.976 4.364 -0.969 1.00 0.00 H ATOM 20 N CYS A 3 -3.013 3.550 0.474 1.00 0.00 N ATOM 21 CA CYS A 3 -3.250 2.737 1.709 1.00 0.00 C ATOM 22 C CYS A 3 -4.628 2.058 1.648 1.00 0.00 C ATOM 23 O CYS A 3 -4.832 1.011 2.232 1.00 0.00 O ATOM 24 CB CYS A 3 -3.182 3.720 2.878 1.00 0.00 C ATOM 25 SG CYS A 3 -1.542 4.497 2.929 1.00 0.00 S ATOM 26 H CYS A 3 -2.796 4.502 0.537 1.00 0.00 H ATOM 27 HA CYS A 3 -2.473 1.993 1.813 1.00 0.00 H ATOM 28 HB2 CYS A 3 -3.936 4.477 2.753 1.00 0.00 H ATOM 29 HB3 CYS A 3 -3.360 3.187 3.801 1.00 0.00 H ATOM 30 N SER A 4 -5.567 2.626 0.934 1.00 0.00 N ATOM 31 CA SER A 4 -6.916 1.987 0.826 1.00 0.00 C ATOM 32 C SER A 4 -6.813 0.666 0.042 1.00 0.00 C ATOM 33 O SER A 4 -7.672 -0.195 0.140 1.00 0.00 O ATOM 34 CB SER A 4 -7.774 3.001 0.060 1.00 0.00 C ATOM 35 OG SER A 4 -7.428 4.326 0.467 1.00 0.00 O ATOM 36 H SER A 4 -5.388 3.465 0.461 1.00 0.00 H ATOM 37 HA SER A 4 -7.331 1.814 1.805 1.00 0.00 H ATOM 38 HB2 SER A 4 -7.598 2.893 -0.996 1.00 0.00 H ATOM 39 HB3 SER A 4 -8.816 2.811 0.264 1.00 0.00 H ATOM 40 HG SER A 4 -7.542 4.381 1.426 1.00 0.00 H ATOM 41 N ASN A 5 -5.765 0.495 -0.729 1.00 0.00 N ATOM 42 CA ASN A 5 -5.596 -0.764 -1.510 1.00 0.00 C ATOM 43 C ASN A 5 -4.719 -1.736 -0.721 1.00 0.00 C ATOM 44 O ASN A 5 -3.617 -1.379 -0.335 1.00 0.00 O ATOM 45 CB ASN A 5 -4.876 -0.345 -2.798 1.00 0.00 C ATOM 46 CG ASN A 5 -4.798 -1.524 -3.775 1.00 0.00 C ATOM 47 OD1 ASN A 5 -5.044 -2.658 -3.411 1.00 0.00 O ATOM 48 ND2 ASN A 5 -4.454 -1.308 -5.010 1.00 0.00 N ATOM 49 H ASN A 5 -5.078 1.196 -0.791 1.00 0.00 H ATOM 50 HA ASN A 5 -6.554 -1.203 -1.742 1.00 0.00 H ATOM 51 HB2 ASN A 5 -5.411 0.472 -3.261 1.00 0.00 H ATOM 52 HB3 ASN A 5 -3.872 -0.023 -2.554 1.00 0.00 H ATOM 53 HD21 ASN A 5 -4.244 -0.400 -5.313 1.00 0.00 H ATOM 54 HD22 ASN A 5 -4.396 -2.057 -5.642 1.00 0.00 H ATOM 55 N PRO A 6 -5.206 -2.939 -0.527 1.00 0.00 N ATOM 56 CA PRO A 6 -4.419 -3.956 0.210 1.00 0.00 C ATOM 57 C PRO A 6 -3.151 -4.279 -0.582 1.00 0.00 C ATOM 58 O PRO A 6 -2.089 -4.451 -0.016 1.00 0.00 O ATOM 59 CB PRO A 6 -5.367 -5.153 0.307 1.00 0.00 C ATOM 60 CG PRO A 6 -6.326 -4.958 -0.822 1.00 0.00 C ATOM 61 CD PRO A 6 -6.500 -3.470 -0.965 1.00 0.00 C ATOM 62 HA PRO A 6 -4.168 -3.598 1.195 1.00 0.00 H ATOM 63 HB2 PRO A 6 -4.817 -6.081 0.184 1.00 0.00 H ATOM 64 HB3 PRO A 6 -5.893 -5.145 1.249 1.00 0.00 H ATOM 65 HG2 PRO A 6 -5.921 -5.383 -1.732 1.00 0.00 H ATOM 66 HG3 PRO A 6 -7.274 -5.414 -0.588 1.00 0.00 H ATOM 67 HD2 PRO A 6 -6.698 -3.206 -1.996 1.00 0.00 H ATOM 68 HD3 PRO A 6 -7.287 -3.114 -0.319 1.00 0.00 H ATOM 69 N ALA A 7 -3.241 -4.318 -1.890 1.00 0.00 N ATOM 70 CA ALA A 7 -2.019 -4.587 -2.704 1.00 0.00 C ATOM 71 C ALA A 7 -0.985 -3.506 -2.399 1.00 0.00 C ATOM 72 O ALA A 7 0.182 -3.787 -2.210 1.00 0.00 O ATOM 73 CB ALA A 7 -2.453 -4.502 -4.168 1.00 0.00 C ATOM 74 H ALA A 7 -4.105 -4.141 -2.332 1.00 0.00 H ATOM 75 HA ALA A 7 -1.628 -5.568 -2.484 1.00 0.00 H ATOM 76 HB1 ALA A 7 -2.002 -5.313 -4.724 1.00 0.00 H ATOM 77 HB2 ALA A 7 -2.131 -3.560 -4.583 1.00 0.00 H ATOM 78 HB3 ALA A 7 -3.528 -4.576 -4.232 1.00 0.00 H ATOM 79 N CYS A 8 -1.414 -2.265 -2.333 1.00 0.00 N ATOM 80 CA CYS A 8 -0.459 -1.160 -2.016 1.00 0.00 C ATOM 81 C CYS A 8 -0.011 -1.273 -0.553 1.00 0.00 C ATOM 82 O CYS A 8 1.159 -1.184 -0.247 1.00 0.00 O ATOM 83 CB CYS A 8 -1.218 0.157 -2.243 1.00 0.00 C ATOM 84 SG CYS A 8 -0.250 1.527 -1.556 1.00 0.00 S ATOM 85 H CYS A 8 -2.362 -2.068 -2.473 1.00 0.00 H ATOM 86 HA CYS A 8 0.392 -1.208 -2.676 1.00 0.00 H ATOM 87 HB2 CYS A 8 -1.365 0.314 -3.301 1.00 0.00 H ATOM 88 HB3 CYS A 8 -2.175 0.110 -1.750 1.00 0.00 H ATOM 89 N MET A 9 -0.933 -1.467 0.355 1.00 0.00 N ATOM 90 CA MET A 9 -0.564 -1.581 1.799 1.00 0.00 C ATOM 91 C MET A 9 0.430 -2.722 2.029 1.00 0.00 C ATOM 92 O MET A 9 1.356 -2.600 2.811 1.00 0.00 O ATOM 93 CB MET A 9 -1.885 -1.879 2.512 1.00 0.00 C ATOM 94 CG MET A 9 -2.647 -0.579 2.746 1.00 0.00 C ATOM 95 SD MET A 9 -1.978 0.247 4.213 1.00 0.00 S ATOM 96 CE MET A 9 -2.990 -0.608 5.448 1.00 0.00 C ATOM 97 H MET A 9 -1.876 -1.537 0.094 1.00 0.00 H ATOM 98 HA MET A 9 -0.153 -0.652 2.156 1.00 0.00 H ATOM 99 HB2 MET A 9 -2.481 -2.542 1.903 1.00 0.00 H ATOM 100 HB3 MET A 9 -1.683 -2.345 3.457 1.00 0.00 H ATOM 101 HG2 MET A 9 -2.537 0.064 1.885 1.00 0.00 H ATOM 102 HG3 MET A 9 -3.694 -0.799 2.900 1.00 0.00 H ATOM 103 HE1 MET A 9 -3.606 0.113 5.966 1.00 0.00 H ATOM 104 HE2 MET A 9 -2.343 -1.107 6.156 1.00 0.00 H ATOM 105 HE3 MET A 9 -3.620 -1.336 4.959 1.00 0.00 H ATOM 106 N VAL A 10 0.243 -3.836 1.376 1.00 0.00 N ATOM 107 CA VAL A 10 1.170 -4.985 1.582 1.00 0.00 C ATOM 108 C VAL A 10 2.432 -4.855 0.716 1.00 0.00 C ATOM 109 O VAL A 10 3.526 -5.106 1.177 1.00 0.00 O ATOM 110 CB VAL A 10 0.362 -6.233 1.197 1.00 0.00 C ATOM 111 CG1 VAL A 10 1.201 -7.495 1.421 1.00 0.00 C ATOM 112 CG2 VAL A 10 -0.900 -6.315 2.061 1.00 0.00 C ATOM 113 H VAL A 10 -0.523 -3.922 0.765 1.00 0.00 H ATOM 114 HA VAL A 10 1.447 -5.043 2.622 1.00 0.00 H ATOM 115 HB VAL A 10 0.082 -6.174 0.156 1.00 0.00 H ATOM 116 HG11 VAL A 10 1.834 -7.668 0.561 1.00 0.00 H ATOM 117 HG12 VAL A 10 0.545 -8.341 1.555 1.00 0.00 H ATOM 118 HG13 VAL A 10 1.814 -7.373 2.301 1.00 0.00 H ATOM 119 HG21 VAL A 10 -0.632 -6.220 3.102 1.00 0.00 H ATOM 120 HG22 VAL A 10 -1.382 -7.266 1.900 1.00 0.00 H ATOM 121 HG23 VAL A 10 -1.574 -5.522 1.789 1.00 0.00 H ATOM 122 N ASN A 11 2.305 -4.493 -0.539 1.00 0.00 N ATOM 123 CA ASN A 11 3.529 -4.394 -1.404 1.00 0.00 C ATOM 124 C ASN A 11 4.165 -3.001 -1.353 1.00 0.00 C ATOM 125 O ASN A 11 5.277 -2.812 -1.815 1.00 0.00 O ATOM 126 CB ASN A 11 3.053 -4.703 -2.824 1.00 0.00 C ATOM 127 CG ASN A 11 3.385 -6.157 -3.154 1.00 0.00 C ATOM 128 OD1 ASN A 11 4.525 -6.567 -3.058 1.00 0.00 O ATOM 129 ND2 ASN A 11 2.436 -6.962 -3.537 1.00 0.00 N ATOM 130 H ASN A 11 1.416 -4.306 -0.913 1.00 0.00 H ATOM 131 HA ASN A 11 4.249 -5.140 -1.099 1.00 0.00 H ATOM 132 HB2 ASN A 11 1.990 -4.554 -2.891 1.00 0.00 H ATOM 133 HB3 ASN A 11 3.552 -4.052 -3.527 1.00 0.00 H ATOM 134 HD21 ASN A 11 1.513 -6.637 -3.610 1.00 0.00 H ATOM 135 HD22 ASN A 11 2.644 -7.892 -3.758 1.00 0.00 H ATOM 136 N ASN A 12 3.492 -2.023 -0.811 1.00 0.00 N ATOM 137 CA ASN A 12 4.082 -0.651 -0.753 1.00 0.00 C ATOM 138 C ASN A 12 4.007 -0.091 0.673 1.00 0.00 C ATOM 139 O ASN A 12 3.335 0.890 0.920 1.00 0.00 O ATOM 140 CB ASN A 12 3.238 0.190 -1.718 1.00 0.00 C ATOM 141 CG ASN A 12 3.904 0.209 -3.094 1.00 0.00 C ATOM 142 OD1 ASN A 12 4.717 1.067 -3.374 1.00 0.00 O ATOM 143 ND2 ASN A 12 3.599 -0.708 -3.972 1.00 0.00 N ATOM 144 H ASN A 12 2.595 -2.182 -0.444 1.00 0.00 H ATOM 145 HA ASN A 12 5.105 -0.671 -1.090 1.00 0.00 H ATOM 146 HB2 ASN A 12 2.249 -0.237 -1.801 1.00 0.00 H ATOM 147 HB3 ASN A 12 3.161 1.196 -1.343 1.00 0.00 H ATOM 148 HD21 ASN A 12 2.945 -1.400 -3.752 1.00 0.00 H ATOM 149 HD22 ASN A 12 4.027 -0.701 -4.852 1.00 0.00 H ATOM 150 N PRO A 13 4.727 -0.717 1.567 1.00 0.00 N ATOM 151 CA PRO A 13 4.753 -0.252 2.981 1.00 0.00 C ATOM 152 C PRO A 13 5.414 1.131 3.078 1.00 0.00 C ATOM 153 O PRO A 13 5.095 1.920 3.944 1.00 0.00 O ATOM 154 CB PRO A 13 5.576 -1.323 3.695 1.00 0.00 C ATOM 155 CG PRO A 13 6.414 -1.942 2.622 1.00 0.00 C ATOM 156 CD PRO A 13 5.586 -1.893 1.364 1.00 0.00 C ATOM 157 HA PRO A 13 3.754 -0.223 3.388 1.00 0.00 H ATOM 158 HB2 PRO A 13 6.205 -0.867 4.448 1.00 0.00 H ATOM 159 HB3 PRO A 13 4.929 -2.066 4.137 1.00 0.00 H ATOM 160 HG2 PRO A 13 7.332 -1.381 2.489 1.00 0.00 H ATOM 161 HG3 PRO A 13 6.638 -2.968 2.870 1.00 0.00 H ATOM 162 HD2 PRO A 13 6.222 -1.760 0.500 1.00 0.00 H ATOM 163 HD3 PRO A 13 4.988 -2.787 1.265 1.00 0.00 H ATOM 164 N GLN A 14 6.322 1.432 2.183 1.00 0.00 N ATOM 165 CA GLN A 14 6.990 2.774 2.211 1.00 0.00 C ATOM 166 C GLN A 14 5.948 3.869 1.971 1.00 0.00 C ATOM 167 O GLN A 14 6.032 4.957 2.507 1.00 0.00 O ATOM 168 CB GLN A 14 8.018 2.765 1.069 1.00 0.00 C ATOM 169 CG GLN A 14 8.908 1.519 1.150 1.00 0.00 C ATOM 170 CD GLN A 14 8.547 0.562 0.008 1.00 0.00 C ATOM 171 OE1 GLN A 14 8.107 -0.545 0.249 1.00 0.00 O ATOM 172 NE2 GLN A 14 8.709 0.941 -1.232 1.00 0.00 N ATOM 173 H GLN A 14 6.553 0.784 1.491 1.00 0.00 H ATOM 174 HA GLN A 14 7.479 2.928 3.154 1.00 0.00 H ATOM 175 HB2 GLN A 14 7.500 2.769 0.120 1.00 0.00 H ATOM 176 HB3 GLN A 14 8.635 3.647 1.142 1.00 0.00 H ATOM 177 HG2 GLN A 14 9.946 1.816 1.065 1.00 0.00 H ATOM 178 HG3 GLN A 14 8.753 1.026 2.096 1.00 0.00 H ATOM 179 HE21 GLN A 14 9.070 1.830 -1.430 1.00 0.00 H ATOM 180 HE22 GLN A 14 8.457 0.339 -1.964 1.00 0.00 H ATOM 181 N ILE A 15 4.964 3.581 1.168 1.00 0.00 N ATOM 182 CA ILE A 15 3.900 4.588 0.880 1.00 0.00 C ATOM 183 C ILE A 15 3.075 4.826 2.150 1.00 0.00 C ATOM 184 O ILE A 15 2.865 5.947 2.562 1.00 0.00 O ATOM 185 CB ILE A 15 3.042 3.956 -0.223 1.00 0.00 C ATOM 186 CG1 ILE A 15 3.887 3.784 -1.500 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.837 4.852 -0.523 1.00 0.00 C ATOM 188 CD1 ILE A 15 3.984 5.118 -2.256 1.00 0.00 C ATOM 189 H ILE A 15 4.920 2.693 0.763 1.00 0.00 H ATOM 190 HA ILE A 15 4.336 5.512 0.531 1.00 0.00 H ATOM 191 HB ILE A 15 2.692 2.989 0.112 1.00 0.00 H ATOM 192 HG12 ILE A 15 4.879 3.451 -1.231 1.00 0.00 H ATOM 193 HG13 ILE A 15 3.425 3.044 -2.139 1.00 0.00 H ATOM 194 HG21 ILE A 15 1.654 4.861 -1.587 1.00 0.00 H ATOM 195 HG22 ILE A 15 2.046 5.856 -0.183 1.00 0.00 H ATOM 196 HG23 ILE A 15 0.965 4.472 -0.009 1.00 0.00 H ATOM 197 HD11 ILE A 15 4.845 5.100 -2.910 1.00 0.00 H ATOM 198 HD12 ILE A 15 4.082 5.928 -1.547 1.00 0.00 H ATOM 199 HD13 ILE A 15 3.089 5.263 -2.847 1.00 0.00 H ATOM 200 N CYS A 16 2.617 3.767 2.769 1.00 0.00 N ATOM 201 CA CYS A 16 1.813 3.917 4.019 1.00 0.00 C ATOM 202 C CYS A 16 2.718 3.742 5.244 1.00 0.00 C ATOM 203 O CYS A 16 2.589 2.788 5.991 1.00 0.00 O ATOM 204 CB CYS A 16 0.758 2.809 3.962 1.00 0.00 C ATOM 205 SG CYS A 16 -0.256 3.005 2.472 1.00 0.00 S ATOM 206 H CYS A 16 2.816 2.873 2.418 1.00 0.00 H ATOM 207 HA CYS A 16 1.333 4.882 4.042 1.00 0.00 H ATOM 208 HB2 CYS A 16 1.246 1.846 3.943 1.00 0.00 H ATOM 209 HB3 CYS A 16 0.129 2.875 4.837 1.00 0.00 H HETATM 210 N NH2 A 17 3.642 4.627 5.488 1.00 0.00 N HETATM 211 HN1 NH2 A 17 3.754 5.399 4.892 1.00 0.00 H HETATM 212 HN2 NH2 A 17 4.224 4.525 6.269 1.00 0.00 H TER 213 NH2 A 17 ENDMDL CONECT 15 84 CONECT 25 205 CONECT 84 15 CONECT 205 25 CONECT 210 211 212 CONECT 211 210 CONECT 212 210 MASTER 103 0 1 1 0 0 0 6 110 1 7 2 END