HEADER TRANSFERASE 28-MAY-04 1WH4 TITLE SOLUTION STRUCTURE OF THE DEATH DOMAIN OF INTERLEUKIN-1 TITLE 2 RECEPTOR-ASSOCIATED KINASE4 (IRAK4) FROM MUS MUSCULUS COMPND MOL_ID: 1; COMPND 2 MOLECULE: INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: DEATH DOMAIN; COMPND 5 SYNONYM: IRAK4; COMPND 6 EC: 2.7.1.37; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 3 ORGANISM_COMMON: MOUSE; SOURCE 4 GENE: RIKEN CDNA 9330209D03; SOURCE 5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 6 EXPRESSION_SYSTEM_PLASMID: P021209-23; SOURCE 7 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS KEYWDS DEATH DOMAIN, STRUCTURAL GENOMICS, RIKEN STRUCTURAL KEYWDS 2 GENOMICS/PROTEOMICS INITIATIVE, RSGI EXPDTA NMR, 20 STRUCTURES AUTHOR N.NAMEKI,T.TOMIZAWA,S.KOSHIBA,T.KIGAWA,S.YOKOYAMA,RIKEN AUTHOR 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI) REVDAT 1 28-NOV-04 1WH4 0 JRNL AUTH N.NAMEKI,T.TOMIZAWA,S.KOSHIBA,T.KIGAWA,S.YOKOYAMA JRNL TITL SOLUTION STRUCTURE OF THE DEATH DOMAIN OF JRNL TITL 2 INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE4 (IRAK4) JRNL TITL 3 FROM MUS MUSCULUS JRNL REF TO BE PUBLISHED JRNL REFN REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : OPALP REMARK 3 AUTHORS : KORADI, R.,BILLETER, M.,GUENTERT, P. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1WH4 COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006 REMARK 4 REMARK 4 THIS IS THE REMEDIATED VERSION OF THIS PDB ENTRY. REMARK 4 REMEDIATED DATA FILE REVISION 3.100 (2007-03-17) REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ . REMARK 100 THE RCSB ID CODE IS RCSB023574. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 296 REMARK 210 PH : 7.5 REMARK 210 IONIC STRENGTH : 120MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.7MM DEATH DOMAIN U-15N, REMARK 210 13C; 20MM D-TRIS-HCL(PH 7.5); REMARK 210 100MM NACL; 1MM D-DTT; 0.02% REMARK 210 NAN3; 90% H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.6, NMRPIPE REMARK 210 20020425, NMRVIEW 5.0.4, REMARK 210 KUJIRA 0.901, CYANA 1.0.7 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS, REMARK 210 RESTRAINED MOLECULAR DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS, REMARK 210 STRUCTURES WITH THE LOWEST REMARK 210 ENERGY, TARGET FUNCTION 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 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 M RES CSSEQI PSI PHI REMARK 500 1 SER A 2 146.74 102.40 REMARK 500 4 SER A 6 169.77 58.29 REMARK 500 4 LYS A 117 -34.29 64.78 REMARK 500 5 SER A 6 139.21 73.18 REMARK 500 6 THR A 115 132.56 93.28 REMARK 500 6 LYS A 117 164.59 59.35 REMARK 500 8 SER A 118 -84.78 142.57 REMARK 500 9 SER A 2 132.30 79.16 REMARK 500 9 LEU A 119 159.53 70.06 REMARK 500 12 SER A 2 -63.99 68.54 REMARK 500 14 SER A 2 117.78 113.57 REMARK 500 14 GLN A 114 169.17 63.73 REMARK 500 14 SER A 126 161.49 74.22 REMARK 500 17 ASN A 85 70.64 114.68 REMARK 500 17 SER A 126 -33.64 68.73 REMARK 500 18 ASN A 85 10.27 110.67 REMARK 500 20 ASN A 9 150.02 70.04 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 PRO A 11 LEU A 12 1 149.36 REMARK 500 GLY A 1 SER A 2 6 137.69 REMARK 500 SER A 126 GLY A 127 6 -135.82 REMARK 500 GLY A 1 SER A 2 11 -136.35 REMARK 500 PRO A 113 GLN A 114 12 149.61 REMARK 500 SER A 126 GLY A 127 12 143.11 REMARK 500 PRO A 121 SER A 122 20 -141.97 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: MMT007016958.1 RELATED DB: TARGETDB DBREF 1WH4 A 8 121 UNP Q8R4K2 IRAK4_MOUSE 1 114 SEQADV 1WH4 GLY A 1 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 2 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 3 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 GLY A 4 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 5 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 6 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 GLY A 7 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 122 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 GLY A 123 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 PRO A 124 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 125 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 SER A 126 UNP Q8R4K2 CLONING ARTIFACT SEQADV 1WH4 GLY A 127 UNP Q8R4K2 CLONING ARTIFACT SEQRES 1 A 127 GLY SER SER GLY SER SER GLY MET ASN LYS PRO LEU THR SEQRES 2 A 127 PRO SER THR TYR ILE ARG ASN LEU ASN VAL GLY ILE LEU SEQRES 3 A 127 ARG LYS LEU SER ASP PHE ILE ASP PRO GLN GLU GLY TRP SEQRES 4 A 127 LYS LYS LEU ALA VAL ALA ILE LYS LYS PRO SER GLY ASP SEQRES 5 A 127 ASP ARG TYR ASN GLN PHE HIS ILE ARG ARG PHE GLU ALA SEQRES 6 A 127 LEU LEU GLN THR GLY LYS SER PRO THR CYS GLU LEU LEU SEQRES 7 A 127 PHE ASP TRP GLY THR THR ASN CYS THR VAL GLY ASP LEU SEQRES 8 A 127 VAL ASP LEU LEU VAL GLN ILE GLU LEU PHE ALA PRO ALA SEQRES 9 A 127 THR LEU LEU LEU PRO ASP ALA VAL PRO GLN THR VAL LYS SEQRES 10 A 127 SER LEU PRO PRO SER GLY PRO SER SER GLY HELIX 1 1 TYR A 17 LEU A 21 5 5 HELIX 2 2 ASN A 22 ASP A 34 1 13 HELIX 3 3 GLU A 37 ILE A 46 1 10 HELIX 4 4 ASN A 56 GLN A 68 1 13 HELIX 5 5 SER A 72 ASN A 85 1 14 HELIX 6 6 THR A 87 ILE A 98 1 12 HELIX 7 7 LEU A 100 LEU A 108 1 9 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 13.034 26.098 -21.364 1.00 0.00 N ATOM 2 CA GLY A 1 14.284 25.843 -20.643 1.00 0.00 C ATOM 3 C GLY A 1 13.984 25.327 -19.244 1.00 0.00 C ATOM 4 O GLY A 1 13.012 24.592 -19.068 1.00 0.00 O ATOM 5 HA2 GLY A 1 14.865 25.099 -21.184 1.00 0.00 H ATOM 6 HA3 GLY A 1 14.850 26.769 -20.572 1.00 0.00 H ATOM 7 H1 GLY A 1 13.146 26.400 -22.311 1.00 0.00 H ATOM 8 N SER A 2 14.850 25.689 -18.291 1.00 0.00 N ATOM 9 CA SER A 2 14.970 25.280 -16.886 1.00 0.00 C ATOM 10 C SER A 2 16.114 24.276 -16.759 1.00 0.00 C ATOM 11 O SER A 2 16.315 23.454 -17.657 1.00 0.00 O ATOM 12 CB SER A 2 13.718 24.645 -16.265 1.00 0.00 C ATOM 13 OG SER A 2 12.647 25.562 -16.194 1.00 0.00 O ATOM 14 H SER A 2 15.628 26.256 -18.590 1.00 0.00 H ATOM 15 HA SER A 2 15.217 26.170 -16.307 1.00 0.00 H ATOM 16 HB2 SER A 2 13.424 23.754 -16.818 1.00 0.00 H ATOM 17 HB3 SER A 2 13.959 24.330 -15.248 1.00 0.00 H ATOM 18 HG SER A 2 12.214 25.410 -15.330 1.00 0.00 H ATOM 19 N SER A 3 16.800 24.318 -15.617 1.00 0.00 N ATOM 20 CA SER A 3 17.829 23.396 -15.146 1.00 0.00 C ATOM 21 C SER A 3 17.748 23.385 -13.608 1.00 0.00 C ATOM 22 O SER A 3 16.992 24.179 -13.029 1.00 0.00 O ATOM 23 CB SER A 3 19.212 23.869 -15.631 1.00 0.00 C ATOM 24 OG SER A 3 19.265 23.903 -17.046 1.00 0.00 O ATOM 25 H SER A 3 16.534 24.993 -14.913 1.00 0.00 H ATOM 26 HA SER A 3 17.627 22.392 -15.525 1.00 0.00 H ATOM 27 HB2 SER A 3 19.409 24.873 -15.246 1.00 0.00 H ATOM 28 HB3 SER A 3 19.981 23.183 -15.274 1.00 0.00 H ATOM 29 HG SER A 3 20.175 24.060 -17.320 1.00 0.00 H ATOM 30 N GLY A 4 18.510 22.526 -12.929 1.00 0.00 N ATOM 31 CA GLY A 4 18.535 22.463 -11.474 1.00 0.00 C ATOM 32 C GLY A 4 19.487 21.374 -10.999 1.00 0.00 C ATOM 33 O GLY A 4 20.638 21.662 -10.683 1.00 0.00 O ATOM 34 H GLY A 4 19.131 21.888 -13.426 1.00 0.00 H ATOM 35 HA2 GLY A 4 18.858 23.424 -11.070 1.00 0.00 H ATOM 36 HA3 GLY A 4 17.533 22.255 -11.100 1.00 0.00 H ATOM 37 N SER A 5 19.014 20.128 -10.974 1.00 0.00 N ATOM 38 CA SER A 5 19.736 18.929 -10.556 1.00 0.00 C ATOM 39 C SER A 5 20.238 18.936 -9.102 1.00 0.00 C ATOM 40 O SER A 5 21.039 18.068 -8.742 1.00 0.00 O ATOM 41 CB SER A 5 20.826 18.617 -11.589 1.00 0.00 C ATOM 42 OG SER A 5 20.225 18.420 -12.861 1.00 0.00 O ATOM 43 H SER A 5 18.055 19.995 -11.267 1.00 0.00 H ATOM 44 HA SER A 5 19.021 18.111 -10.596 1.00 0.00 H ATOM 45 HB2 SER A 5 21.538 19.441 -11.642 1.00 0.00 H ATOM 46 HB3 SER A 5 21.360 17.710 -11.302 1.00 0.00 H ATOM 47 HG SER A 5 19.479 19.047 -12.945 1.00 0.00 H ATOM 48 N SER A 6 19.740 19.829 -8.245 1.00 0.00 N ATOM 49 CA SER A 6 19.861 19.684 -6.799 1.00 0.00 C ATOM 50 C SER A 6 18.998 18.492 -6.346 1.00 0.00 C ATOM 51 O SER A 6 18.134 18.024 -7.092 1.00 0.00 O ATOM 52 CB SER A 6 19.412 20.999 -6.145 1.00 0.00 C ATOM 53 OG SER A 6 19.815 21.086 -4.788 1.00 0.00 O ATOM 54 H SER A 6 18.949 20.370 -8.574 1.00 0.00 H ATOM 55 HA SER A 6 20.906 19.496 -6.554 1.00 0.00 H ATOM 56 HB2 SER A 6 19.862 21.836 -6.679 1.00 0.00 H ATOM 57 HB3 SER A 6 18.325 21.078 -6.213 1.00 0.00 H ATOM 58 HG SER A 6 20.721 21.482 -4.793 1.00 0.00 H ATOM 59 N GLY A 7 19.185 18.022 -5.112 1.00 0.00 N ATOM 60 CA GLY A 7 18.310 17.057 -4.450 1.00 0.00 C ATOM 61 C GLY A 7 18.162 17.458 -2.986 1.00 0.00 C ATOM 62 O GLY A 7 19.105 18.013 -2.409 1.00 0.00 O ATOM 63 H GLY A 7 19.878 18.463 -4.524 1.00 0.00 H ATOM 64 HA2 GLY A 7 17.329 17.047 -4.926 1.00 0.00 H ATOM 65 HA3 GLY A 7 18.751 16.062 -4.517 1.00 0.00 H ATOM 66 N MET A 8 16.994 17.214 -2.381 1.00 0.00 N ATOM 67 CA MET A 8 16.677 17.731 -1.054 1.00 0.00 C ATOM 68 C MET A 8 17.321 16.855 0.020 1.00 0.00 C ATOM 69 O MET A 8 18.331 17.253 0.590 1.00 0.00 O ATOM 70 CB MET A 8 15.158 17.909 -0.868 1.00 0.00 C ATOM 71 CG MET A 8 14.821 18.715 0.395 1.00 0.00 C ATOM 72 SD MET A 8 15.513 20.394 0.394 1.00 0.00 S ATOM 73 CE MET A 8 14.651 21.118 1.812 1.00 0.00 C ATOM 74 H MET A 8 16.279 16.703 -2.880 1.00 0.00 H ATOM 75 HA MET A 8 17.133 18.719 -0.981 1.00 0.00 H ATOM 76 HB2 MET A 8 14.755 18.455 -1.719 1.00 0.00 H ATOM 77 HB3 MET A 8 14.666 16.938 -0.822 1.00 0.00 H ATOM 78 HG2 MET A 8 13.736 18.792 0.466 1.00 0.00 H ATOM 79 HG3 MET A 8 15.182 18.183 1.277 1.00 0.00 H ATOM 80 HE1 MET A 8 13.573 21.067 1.661 1.00 0.00 H ATOM 81 HE2 MET A 8 14.920 20.574 2.712 1.00 0.00 H ATOM 82 HE3 MET A 8 14.949 22.160 1.928 1.00 0.00 H ATOM 83 N ASN A 9 16.766 15.676 0.310 1.00 0.00 N ATOM 84 CA ASN A 9 17.363 14.679 1.202 1.00 0.00 C ATOM 85 C ASN A 9 16.813 13.294 0.835 1.00 0.00 C ATOM 86 O ASN A 9 15.999 13.195 -0.090 1.00 0.00 O ATOM 87 CB ASN A 9 17.099 15.029 2.683 1.00 0.00 C ATOM 88 CG ASN A 9 18.283 14.622 3.555 1.00 0.00 C ATOM 89 OD1 ASN A 9 18.952 13.626 3.293 1.00 0.00 O ATOM 90 ND2 ASN A 9 18.636 15.408 4.551 1.00 0.00 N ATOM 91 H ASN A 9 15.983 15.345 -0.239 1.00 0.00 H ATOM 92 HA ASN A 9 18.441 14.679 1.025 1.00 0.00 H ATOM 93 HB2 ASN A 9 16.949 16.105 2.783 1.00 0.00 H ATOM 94 HB3 ASN A 9 16.195 14.529 3.034 1.00 0.00 H ATOM 95 HD21 ASN A 9 18.093 16.241 4.765 1.00 0.00 H ATOM 96 HD22 ASN A 9 19.413 15.179 5.170 1.00 0.00 H ATOM 97 N LYS A 10 17.243 12.223 1.511 1.00 0.00 N ATOM 98 CA LYS A 10 16.758 10.875 1.212 1.00 0.00 C ATOM 99 C LYS A 10 15.272 10.718 1.592 1.00 0.00 C ATOM 100 O LYS A 10 14.781 11.500 2.412 1.00 0.00 O ATOM 101 CB LYS A 10 17.657 9.805 1.856 1.00 0.00 C ATOM 102 CG LYS A 10 17.455 9.637 3.370 1.00 0.00 C ATOM 103 CD LYS A 10 18.306 8.496 3.940 1.00 0.00 C ATOM 104 CE LYS A 10 19.752 8.958 4.124 1.00 0.00 C ATOM 105 NZ LYS A 10 20.673 7.850 4.433 1.00 0.00 N ATOM 106 H LYS A 10 17.858 12.363 2.302 1.00 0.00 H ATOM 107 HA LYS A 10 16.842 10.760 0.136 1.00 0.00 H ATOM 108 HB2 LYS A 10 17.448 8.850 1.374 1.00 0.00 H ATOM 109 HB3 LYS A 10 18.698 10.046 1.651 1.00 0.00 H ATOM 110 HG2 LYS A 10 17.684 10.570 3.887 1.00 0.00 H ATOM 111 HG3 LYS A 10 16.416 9.386 3.554 1.00 0.00 H ATOM 112 HD2 LYS A 10 17.901 8.217 4.914 1.00 0.00 H ATOM 113 HD3 LYS A 10 18.255 7.630 3.278 1.00 0.00 H ATOM 114 HE2 LYS A 10 20.093 9.454 3.214 1.00 0.00 H ATOM 115 HE3 LYS A 10 19.762 9.679 4.938 1.00 0.00 H ATOM 116 HZ1 LYS A 10 20.795 7.287 3.596 1.00 0.00 H ATOM 117 HZ2 LYS A 10 21.576 8.208 4.719 1.00 0.00 H ATOM 118 HZ3 LYS A 10 20.278 7.253 5.156 1.00 0.00 H ATOM 119 N PRO A 11 14.561 9.722 1.033 1.00 0.00 N ATOM 120 CA PRO A 11 13.188 9.389 1.405 1.00 0.00 C ATOM 121 C PRO A 11 13.027 8.875 2.844 1.00 0.00 C ATOM 122 O PRO A 11 13.958 8.851 3.653 1.00 0.00 O ATOM 123 CB PRO A 11 12.728 8.322 0.390 1.00 0.00 C ATOM 124 CG PRO A 11 13.694 8.457 -0.778 1.00 0.00 C ATOM 125 CD PRO A 11 14.979 8.895 -0.091 1.00 0.00 C ATOM 126 HA PRO A 11 12.581 10.285 1.297 1.00 0.00 H ATOM 127 HB2 PRO A 11 12.846 7.321 0.807 1.00 0.00 H ATOM 128 HB3 PRO A 11 11.697 8.486 0.072 1.00 0.00 H ATOM 129 HG2 PRO A 11 13.818 7.518 -1.318 1.00 0.00 H ATOM 130 HG3 PRO A 11 13.356 9.246 -1.449 1.00 0.00 H ATOM 131 HD2 PRO A 11 15.524 8.030 0.281 1.00 0.00 H ATOM 132 HD3 PRO A 11 15.590 9.439 -0.806 1.00 0.00 H ATOM 133 N LEU A 12 11.811 8.421 3.145 1.00 0.00 N ATOM 134 CA LEU A 12 11.496 7.361 4.104 1.00 0.00 C ATOM 135 C LEU A 12 12.296 6.066 3.844 1.00 0.00 C ATOM 136 O LEU A 12 13.201 6.047 3.010 1.00 0.00 O ATOM 137 CB LEU A 12 9.981 7.246 4.367 1.00 0.00 C ATOM 138 CG LEU A 12 9.074 7.083 3.147 1.00 0.00 C ATOM 139 CD1 LEU A 12 8.619 8.403 2.513 1.00 0.00 C ATOM 140 CD2 LEU A 12 9.788 6.199 2.153 1.00 0.00 C ATOM 141 H LEU A 12 11.122 8.553 2.424 1.00 0.00 H ATOM 142 HA LEU A 12 11.826 7.659 5.038 1.00 0.00 H ATOM 143 HB2 LEU A 12 9.813 6.396 5.031 1.00 0.00 H ATOM 144 HB3 LEU A 12 9.659 8.125 4.926 1.00 0.00 H ATOM 145 HG LEU A 12 8.196 6.562 3.494 1.00 0.00 H ATOM 146 HD11 LEU A 12 7.888 8.201 1.732 1.00 0.00 H ATOM 147 HD12 LEU A 12 8.164 9.034 3.277 1.00 0.00 H ATOM 148 HD13 LEU A 12 9.454 8.936 2.070 1.00 0.00 H ATOM 149 HD21 LEU A 12 10.662 6.719 1.779 1.00 0.00 H ATOM 150 HD22 LEU A 12 10.169 5.355 2.715 1.00 0.00 H ATOM 151 HD23 LEU A 12 9.137 5.882 1.343 1.00 0.00 H ATOM 152 N THR A 13 12.017 4.988 4.575 1.00 0.00 N ATOM 153 CA THR A 13 12.778 3.743 4.517 1.00 0.00 C ATOM 154 C THR A 13 11.823 2.549 4.521 1.00 0.00 C ATOM 155 O THR A 13 10.775 2.634 5.164 1.00 0.00 O ATOM 156 CB THR A 13 13.750 3.680 5.707 1.00 0.00 C ATOM 157 OG1 THR A 13 13.081 4.021 6.905 1.00 0.00 O ATOM 158 CG2 THR A 13 14.911 4.653 5.520 1.00 0.00 C ATOM 159 H THR A 13 11.264 4.974 5.242 1.00 0.00 H ATOM 160 HA THR A 13 13.351 3.718 3.592 1.00 0.00 H ATOM 161 HB THR A 13 14.154 2.670 5.798 1.00 0.00 H ATOM 162 HG1 THR A 13 13.753 4.066 7.614 1.00 0.00 H ATOM 163 HG21 THR A 13 15.612 4.542 6.343 1.00 0.00 H ATOM 164 HG22 THR A 13 15.419 4.424 4.584 1.00 0.00 H ATOM 165 HG23 THR A 13 14.550 5.679 5.496 1.00 0.00 H ATOM 166 N PRO A 14 12.183 1.425 3.874 1.00 0.00 N ATOM 167 CA PRO A 14 11.296 0.285 3.648 1.00 0.00 C ATOM 168 C PRO A 14 10.794 -0.406 4.920 1.00 0.00 C ATOM 169 O PRO A 14 9.828 -1.165 4.857 1.00 0.00 O ATOM 170 CB PRO A 14 12.068 -0.692 2.748 1.00 0.00 C ATOM 171 CG PRO A 14 13.523 -0.233 2.827 1.00 0.00 C ATOM 172 CD PRO A 14 13.417 1.253 3.131 1.00 0.00 C ATOM 173 HA PRO A 14 10.430 0.638 3.093 1.00 0.00 H ATOM 174 HB2 PRO A 14 11.970 -1.725 3.079 1.00 0.00 H ATOM 175 HB3 PRO A 14 11.703 -0.602 1.727 1.00 0.00 H ATOM 176 HG2 PRO A 14 14.021 -0.725 3.662 1.00 0.00 H ATOM 177 HG3 PRO A 14 14.065 -0.408 1.895 1.00 0.00 H ATOM 178 HD2 PRO A 14 14.279 1.576 3.714 1.00 0.00 H ATOM 179 HD3 PRO A 14 13.351 1.824 2.206 1.00 0.00 H ATOM 180 N SER A 15 11.400 -0.169 6.076 1.00 0.00 N ATOM 181 CA SER A 15 11.039 -0.806 7.336 1.00 0.00 C ATOM 182 C SER A 15 10.292 0.161 8.274 1.00 0.00 C ATOM 183 O SER A 15 9.970 -0.200 9.406 1.00 0.00 O ATOM 184 CB SER A 15 12.332 -1.390 7.914 1.00 0.00 C ATOM 185 OG SER A 15 13.375 -0.430 7.851 1.00 0.00 O ATOM 186 H SER A 15 12.243 0.386 6.116 1.00 0.00 H ATOM 187 HA SER A 15 10.366 -1.645 7.150 1.00 0.00 H ATOM 188 HB2 SER A 15 12.175 -1.722 8.936 1.00 0.00 H ATOM 189 HB3 SER A 15 12.622 -2.260 7.323 1.00 0.00 H ATOM 190 HG SER A 15 14.202 -0.884 8.122 1.00 0.00 H ATOM 191 N THR A 16 10.007 1.390 7.831 1.00 0.00 N ATOM 192 CA THR A 16 9.151 2.346 8.531 1.00 0.00 C ATOM 193 C THR A 16 7.677 1.998 8.292 1.00 0.00 C ATOM 194 O THR A 16 7.290 1.659 7.175 1.00 0.00 O ATOM 195 CB THR A 16 9.564 3.741 8.034 1.00 0.00 C ATOM 196 OG1 THR A 16 10.872 3.986 8.517 1.00 0.00 O ATOM 197 CG2 THR A 16 8.664 4.875 8.508 1.00 0.00 C ATOM 198 H THR A 16 10.314 1.659 6.900 1.00 0.00 H ATOM 199 HA THR A 16 9.313 2.285 9.607 1.00 0.00 H ATOM 200 HB THR A 16 9.566 3.764 6.946 1.00 0.00 H ATOM 201 HG1 THR A 16 11.503 3.931 7.773 1.00 0.00 H ATOM 202 HG21 THR A 16 7.674 4.745 8.068 1.00 0.00 H ATOM 203 HG22 THR A 16 8.604 4.880 9.596 1.00 0.00 H ATOM 204 HG23 THR A 16 9.072 5.825 8.162 1.00 0.00 H ATOM 205 N TYR A 17 6.849 2.056 9.341 1.00 0.00 N ATOM 206 CA TYR A 17 5.433 1.711 9.292 1.00 0.00 C ATOM 207 C TYR A 17 4.644 2.736 8.475 1.00 0.00 C ATOM 208 O TYR A 17 4.974 3.923 8.489 1.00 0.00 O ATOM 209 CB TYR A 17 4.889 1.674 10.723 1.00 0.00 C ATOM 210 CG TYR A 17 5.599 0.718 11.664 1.00 0.00 C ATOM 211 CD1 TYR A 17 5.749 -0.644 11.343 1.00 0.00 C ATOM 212 CD2 TYR A 17 6.126 1.207 12.872 1.00 0.00 C ATOM 213 CE1 TYR A 17 6.444 -1.500 12.216 1.00 0.00 C ATOM 214 CE2 TYR A 17 6.831 0.362 13.743 1.00 0.00 C ATOM 215 CZ TYR A 17 6.993 -1.001 13.415 1.00 0.00 C ATOM 216 OH TYR A 17 7.627 -1.845 14.268 1.00 0.00 O ATOM 217 H TYR A 17 7.192 2.319 10.252 1.00 0.00 H ATOM 218 HA TYR A 17 5.326 0.725 8.849 1.00 0.00 H ATOM 219 HB2 TYR A 17 5.000 2.682 11.122 1.00 0.00 H ATOM 220 HB3 TYR A 17 3.829 1.418 10.697 1.00 0.00 H ATOM 221 HD1 TYR A 17 5.331 -1.048 10.430 1.00 0.00 H ATOM 222 HD2 TYR A 17 5.999 2.244 13.138 1.00 0.00 H ATOM 223 HE1 TYR A 17 6.560 -2.545 11.972 1.00 0.00 H ATOM 224 HE2 TYR A 17 7.260 0.770 14.647 1.00 0.00 H ATOM 225 HH TYR A 17 7.929 -1.401 15.072 1.00 0.00 H ATOM 226 N ILE A 18 3.538 2.320 7.851 1.00 0.00 N ATOM 227 CA ILE A 18 2.747 3.174 6.951 1.00 0.00 C ATOM 228 C ILE A 18 2.257 4.438 7.653 1.00 0.00 C ATOM 229 O ILE A 18 2.354 5.546 7.128 1.00 0.00 O ATOM 230 CB ILE A 18 1.512 2.439 6.376 1.00 0.00 C ATOM 231 CG1 ILE A 18 1.679 0.938 6.137 1.00 0.00 C ATOM 232 CG2 ILE A 18 1.129 3.122 5.060 1.00 0.00 C ATOM 233 CD1 ILE A 18 2.678 0.690 5.023 1.00 0.00 C ATOM 234 H ILE A 18 3.328 1.327 7.880 1.00 0.00 H ATOM 235 HA ILE A 18 3.406 3.470 6.132 1.00 0.00 H ATOM 236 HB ILE A 18 0.682 2.539 7.076 1.00 0.00 H ATOM 237 HG12 ILE A 18 1.981 0.444 7.051 1.00 0.00 H ATOM 238 HG13 ILE A 18 0.731 0.494 5.856 1.00 0.00 H ATOM 239 HG21 ILE A 18 1.999 3.188 4.385 1.00 0.00 H ATOM 240 HG22 ILE A 18 0.337 2.546 4.585 1.00 0.00 H ATOM 241 HG23 ILE A 18 0.744 4.107 5.288 1.00 0.00 H ATOM 242 HD11 ILE A 18 2.218 0.965 4.078 1.00 0.00 H ATOM 243 HD12 ILE A 18 3.570 1.310 5.181 1.00 0.00 H ATOM 244 HD13 ILE A 18 2.884 -0.373 4.999 1.00 0.00 H ATOM 245 N ARG A 19 1.706 4.267 8.853 1.00 0.00 N ATOM 246 CA ARG A 19 1.157 5.354 9.651 1.00 0.00 C ATOM 247 C ARG A 19 2.239 6.336 10.101 1.00 0.00 C ATOM 248 O ARG A 19 1.937 7.480 10.445 1.00 0.00 O ATOM 249 CB ARG A 19 0.410 4.731 10.834 1.00 0.00 C ATOM 250 CG ARG A 19 1.363 4.079 11.845 1.00 0.00 C ATOM 251 CD ARG A 19 0.539 3.338 12.889 1.00 0.00 C ATOM 252 NE ARG A 19 1.405 2.750 13.915 1.00 0.00 N ATOM 253 CZ ARG A 19 2.031 3.403 14.895 1.00 0.00 C ATOM 254 NH1 ARG A 19 1.753 4.678 15.148 1.00 0.00 N ATOM 255 NH2 ARG A 19 2.960 2.781 15.604 1.00 0.00 N ATOM 256 H ARG A 19 1.621 3.320 9.191 1.00 0.00 H ATOM 257 HA ARG A 19 0.435 5.900 9.044 1.00 0.00 H ATOM 258 HB2 ARG A 19 -0.177 5.494 11.339 1.00 0.00 H ATOM 259 HB3 ARG A 19 -0.292 3.989 10.456 1.00 0.00 H ATOM 260 HG2 ARG A 19 2.049 3.380 11.355 1.00 0.00 H ATOM 261 HG3 ARG A 19 1.948 4.856 12.340 1.00 0.00 H ATOM 262 HD2 ARG A 19 -0.181 4.025 13.336 1.00 0.00 H ATOM 263 HD3 ARG A 19 -0.003 2.536 12.393 1.00 0.00 H ATOM 264 HE ARG A 19 1.648 1.765 13.760 1.00 0.00 H ATOM 265 HH11 ARG A 19 1.007 5.180 14.660 1.00 0.00 H ATOM 266 HH12 ARG A 19 2.211 5.193 15.899 1.00 0.00 H ATOM 267 HH21 ARG A 19 3.164 1.791 15.451 1.00 0.00 H ATOM 268 HH22 ARG A 19 3.576 3.296 16.231 1.00 0.00 H ATOM 269 N ASN A 20 3.504 5.906 10.144 1.00 0.00 N ATOM 270 CA ASN A 20 4.608 6.772 10.537 1.00 0.00 C ATOM 271 C ASN A 20 4.827 7.844 9.463 1.00 0.00 C ATOM 272 O ASN A 20 5.240 8.957 9.785 1.00 0.00 O ATOM 273 CB ASN A 20 5.871 5.928 10.782 1.00 0.00 C ATOM 274 CG ASN A 20 6.930 6.667 11.589 1.00 0.00 C ATOM 275 OD1 ASN A 20 7.214 7.833 11.369 1.00 0.00 O ATOM 276 ND2 ASN A 20 7.527 6.037 12.579 1.00 0.00 N ATOM 277 H ASN A 20 3.738 5.011 9.738 1.00 0.00 H ATOM 278 HA ASN A 20 4.346 7.274 11.469 1.00 0.00 H ATOM 279 HB2 ASN A 20 5.601 5.019 11.316 1.00 0.00 H ATOM 280 HB3 ASN A 20 6.303 5.654 9.822 1.00 0.00 H ATOM 281 HD21 ASN A 20 7.337 5.077 12.864 1.00 0.00 H ATOM 282 HD22 ASN A 20 8.304 6.498 13.047 1.00 0.00 H ATOM 283 N LEU A 21 4.486 7.554 8.202 1.00 0.00 N ATOM 284 CA LEU A 21 4.682 8.478 7.092 1.00 0.00 C ATOM 285 C LEU A 21 3.925 9.784 7.345 1.00 0.00 C ATOM 286 O LEU A 21 2.819 9.782 7.900 1.00 0.00 O ATOM 287 CB LEU A 21 4.266 7.836 5.754 1.00 0.00 C ATOM 288 CG LEU A 21 4.970 6.510 5.352 1.00 0.00 C ATOM 289 CD1 LEU A 21 4.829 6.291 3.840 1.00 0.00 C ATOM 290 CD2 LEU A 21 6.458 6.591 5.722 1.00 0.00 C ATOM 291 H LEU A 21 4.067 6.656 7.995 1.00 0.00 H ATOM 292 HA LEU A 21 5.743 8.718 7.046 1.00 0.00 H ATOM 293 HB2 LEU A 21 3.191 7.682 5.774 1.00 0.00 H ATOM 294 HB3 LEU A 21 4.465 8.576 4.976 1.00 0.00 H ATOM 295 HG LEU A 21 4.521 5.624 5.833 1.00 0.00 H ATOM 296 HD11 LEU A 21 5.504 6.939 3.285 1.00 0.00 H ATOM 297 HD12 LEU A 21 5.043 5.251 3.600 1.00 0.00 H ATOM 298 HD13 LEU A 21 3.804 6.489 3.527 1.00 0.00 H ATOM 299 HD21 LEU A 21 6.985 5.735 5.334 1.00 0.00 H ATOM 300 HD22 LEU A 21 6.901 7.503 5.320 1.00 0.00 H ATOM 301 HD23 LEU A 21 6.581 6.572 6.804 1.00 0.00 H ATOM 302 N ASN A 22 4.536 10.918 6.986 1.00 0.00 N ATOM 303 CA ASN A 22 3.931 12.226 7.234 1.00 0.00 C ATOM 304 C ASN A 22 2.696 12.413 6.347 1.00 0.00 C ATOM 305 O ASN A 22 2.608 11.827 5.267 1.00 0.00 O ATOM 306 CB ASN A 22 4.932 13.374 6.989 1.00 0.00 C ATOM 307 CG ASN A 22 4.634 14.592 7.865 1.00 0.00 C ATOM 308 OD1 ASN A 22 3.531 14.754 8.377 1.00 0.00 O ATOM 309 ND2 ASN A 22 5.589 15.476 8.074 1.00 0.00 N ATOM 310 H ASN A 22 5.456 10.862 6.557 1.00 0.00 H ATOM 311 HA ASN A 22 3.625 12.243 8.281 1.00 0.00 H ATOM 312 HB2 ASN A 22 5.948 13.022 7.178 1.00 0.00 H ATOM 313 HB3 ASN A 22 4.872 13.688 5.947 1.00 0.00 H ATOM 314 HD21 ASN A 22 6.513 15.319 7.674 1.00 0.00 H ATOM 315 HD22 ASN A 22 5.422 16.280 8.665 1.00 0.00 H ATOM 316 N VAL A 23 1.780 13.297 6.742 1.00 0.00 N ATOM 317 CA VAL A 23 0.583 13.631 5.998 1.00 0.00 C ATOM 318 C VAL A 23 0.918 14.113 4.584 1.00 0.00 C ATOM 319 O VAL A 23 0.191 13.784 3.655 1.00 0.00 O ATOM 320 CB VAL A 23 -0.244 14.634 6.817 1.00 0.00 C ATOM 321 CG1 VAL A 23 0.447 15.988 6.991 1.00 0.00 C ATOM 322 CG2 VAL A 23 -1.628 14.826 6.211 1.00 0.00 C ATOM 323 H VAL A 23 1.898 13.796 7.611 1.00 0.00 H ATOM 324 HA VAL A 23 -0.008 12.722 5.912 1.00 0.00 H ATOM 325 HB VAL A 23 -0.386 14.212 7.811 1.00 0.00 H ATOM 326 HG11 VAL A 23 1.382 15.877 7.534 1.00 0.00 H ATOM 327 HG12 VAL A 23 0.657 16.428 6.021 1.00 0.00 H ATOM 328 HG13 VAL A 23 -0.216 16.659 7.530 1.00 0.00 H ATOM 329 HG21 VAL A 23 -1.543 15.257 5.215 1.00 0.00 H ATOM 330 HG22 VAL A 23 -2.119 13.857 6.146 1.00 0.00 H ATOM 331 HG23 VAL A 23 -2.219 15.490 6.838 1.00 0.00 H ATOM 332 N GLY A 24 2.034 14.824 4.386 1.00 0.00 N ATOM 333 CA GLY A 24 2.438 15.260 3.060 1.00 0.00 C ATOM 334 C GLY A 24 2.682 14.062 2.145 1.00 0.00 C ATOM 335 O GLY A 24 2.140 14.017 1.046 1.00 0.00 O ATOM 336 H GLY A 24 2.613 15.084 5.169 1.00 0.00 H ATOM 337 HA2 GLY A 24 1.644 15.876 2.637 1.00 0.00 H ATOM 338 HA3 GLY A 24 3.337 15.865 3.126 1.00 0.00 H ATOM 339 N ILE A 25 3.435 13.059 2.604 1.00 0.00 N ATOM 340 CA ILE A 25 3.678 11.825 1.872 1.00 0.00 C ATOM 341 C ILE A 25 2.351 11.078 1.681 1.00 0.00 C ATOM 342 O ILE A 25 2.111 10.584 0.583 1.00 0.00 O ATOM 343 CB ILE A 25 4.752 10.984 2.600 1.00 0.00 C ATOM 344 CG1 ILE A 25 6.127 11.695 2.623 1.00 0.00 C ATOM 345 CG2 ILE A 25 4.948 9.628 1.897 1.00 0.00 C ATOM 346 CD1 ILE A 25 6.348 12.747 3.711 1.00 0.00 C ATOM 347 H ILE A 25 3.823 13.116 3.533 1.00 0.00 H ATOM 348 HA ILE A 25 4.061 12.078 0.878 1.00 0.00 H ATOM 349 HB ILE A 25 4.434 10.785 3.625 1.00 0.00 H ATOM 350 HG12 ILE A 25 6.879 10.948 2.826 1.00 0.00 H ATOM 351 HG13 ILE A 25 6.341 12.129 1.645 1.00 0.00 H ATOM 352 HG21 ILE A 25 4.031 9.039 1.939 1.00 0.00 H ATOM 353 HG22 ILE A 25 5.233 9.774 0.854 1.00 0.00 H ATOM 354 HG23 ILE A 25 5.724 9.059 2.403 1.00 0.00 H ATOM 355 HD11 ILE A 25 5.716 13.613 3.548 1.00 0.00 H ATOM 356 HD12 ILE A 25 6.143 12.300 4.681 1.00 0.00 H ATOM 357 HD13 ILE A 25 7.389 13.075 3.691 1.00 0.00 H ATOM 358 N LEU A 26 1.471 11.016 2.689 1.00 0.00 N ATOM 359 CA LEU A 26 0.125 10.457 2.539 1.00 0.00 C ATOM 360 C LEU A 26 -0.621 11.151 1.395 1.00 0.00 C ATOM 361 O LEU A 26 -1.246 10.461 0.591 1.00 0.00 O ATOM 362 CB LEU A 26 -0.668 10.563 3.857 1.00 0.00 C ATOM 363 CG LEU A 26 -0.436 9.395 4.832 1.00 0.00 C ATOM 364 CD1 LEU A 26 -0.859 9.775 6.256 1.00 0.00 C ATOM 365 CD2 LEU A 26 -1.244 8.171 4.390 1.00 0.00 C ATOM 366 H LEU A 26 1.729 11.389 3.596 1.00 0.00 H ATOM 367 HA LEU A 26 0.225 9.406 2.269 1.00 0.00 H ATOM 368 HB2 LEU A 26 -0.392 11.486 4.342 1.00 0.00 H ATOM 369 HB3 LEU A 26 -1.734 10.643 3.646 1.00 0.00 H ATOM 370 HG LEU A 26 0.625 9.143 4.849 1.00 0.00 H ATOM 371 HD11 LEU A 26 -1.904 10.092 6.270 1.00 0.00 H ATOM 372 HD12 LEU A 26 -0.735 8.918 6.920 1.00 0.00 H ATOM 373 HD13 LEU A 26 -0.228 10.583 6.622 1.00 0.00 H ATOM 374 HD21 LEU A 26 -1.101 7.356 5.097 1.00 0.00 H ATOM 375 HD22 LEU A 26 -2.304 8.414 4.353 1.00 0.00 H ATOM 376 HD23 LEU A 26 -0.908 7.848 3.407 1.00 0.00 H ATOM 377 N ARG A 27 -0.538 12.481 1.276 1.00 0.00 N ATOM 378 CA ARG A 27 -1.111 13.233 0.157 1.00 0.00 C ATOM 379 C ARG A 27 -0.463 12.819 -1.156 1.00 0.00 C ATOM 380 O ARG A 27 -1.184 12.548 -2.106 1.00 0.00 O ATOM 381 CB ARG A 27 -1.005 14.744 0.346 1.00 0.00 C ATOM 382 CG ARG A 27 -1.712 15.237 1.618 1.00 0.00 C ATOM 383 CD ARG A 27 -2.610 16.422 1.291 1.00 0.00 C ATOM 384 NE ARG A 27 -3.927 16.024 0.770 1.00 0.00 N ATOM 385 CZ ARG A 27 -4.715 16.750 -0.031 1.00 0.00 C ATOM 386 NH1 ARG A 27 -4.348 17.965 -0.425 1.00 0.00 N ATOM 387 NH2 ARG A 27 -5.872 16.253 -0.441 1.00 0.00 N ATOM 388 H ARG A 27 -0.051 12.990 2.007 1.00 0.00 H ATOM 389 HA ARG A 27 -2.179 13.032 0.103 1.00 0.00 H ATOM 390 HB2 ARG A 27 0.033 15.064 0.367 1.00 0.00 H ATOM 391 HB3 ARG A 27 -1.461 15.201 -0.534 1.00 0.00 H ATOM 392 HG2 ARG A 27 -2.297 14.450 2.094 1.00 0.00 H ATOM 393 HG3 ARG A 27 -0.954 15.579 2.320 1.00 0.00 H ATOM 394 HD2 ARG A 27 -2.742 17.006 2.195 1.00 0.00 H ATOM 395 HD3 ARG A 27 -2.089 17.010 0.547 1.00 0.00 H ATOM 396 HE ARG A 27 -4.286 15.130 1.100 1.00 0.00 H ATOM 397 HH11 ARG A 27 -3.460 18.353 -0.132 1.00 0.00 H ATOM 398 HH12 ARG A 27 -4.942 18.547 -1.017 1.00 0.00 H ATOM 399 HH21 ARG A 27 -6.155 15.329 -0.118 1.00 0.00 H ATOM 400 HH22 ARG A 27 -6.390 16.642 -1.230 1.00 0.00 H ATOM 401 N LYS A 28 0.871 12.757 -1.230 1.00 0.00 N ATOM 402 CA LYS A 28 1.585 12.363 -2.450 1.00 0.00 C ATOM 403 C LYS A 28 1.146 10.983 -2.916 1.00 0.00 C ATOM 404 O LYS A 28 0.937 10.761 -4.101 1.00 0.00 O ATOM 405 CB LYS A 28 3.106 12.372 -2.245 1.00 0.00 C ATOM 406 CG LYS A 28 3.653 13.765 -1.931 1.00 0.00 C ATOM 407 CD LYS A 28 5.123 13.922 -2.344 1.00 0.00 C ATOM 408 CE LYS A 28 5.291 14.288 -3.830 1.00 0.00 C ATOM 409 NZ LYS A 28 5.600 15.722 -4.031 1.00 0.00 N ATOM 410 H LYS A 28 1.398 13.001 -0.398 1.00 0.00 H ATOM 411 HA LYS A 28 1.323 13.064 -3.245 1.00 0.00 H ATOM 412 HB2 LYS A 28 3.389 11.683 -1.449 1.00 0.00 H ATOM 413 HB3 LYS A 28 3.562 12.022 -3.166 1.00 0.00 H ATOM 414 HG2 LYS A 28 3.026 14.497 -2.429 1.00 0.00 H ATOM 415 HG3 LYS A 28 3.594 13.934 -0.862 1.00 0.00 H ATOM 416 HD2 LYS A 28 5.581 14.687 -1.719 1.00 0.00 H ATOM 417 HD3 LYS A 28 5.638 12.982 -2.142 1.00 0.00 H ATOM 418 HE2 LYS A 28 6.111 13.702 -4.248 1.00 0.00 H ATOM 419 HE3 LYS A 28 4.374 14.033 -4.368 1.00 0.00 H ATOM 420 HZ1 LYS A 28 6.463 15.977 -3.557 1.00 0.00 H ATOM 421 HZ2 LYS A 28 5.710 15.923 -5.021 1.00 0.00 H ATOM 422 HZ3 LYS A 28 4.878 16.315 -3.628 1.00 0.00 H ATOM 423 N LEU A 29 1.027 10.042 -1.988 1.00 0.00 N ATOM 424 CA LEU A 29 0.490 8.720 -2.276 1.00 0.00 C ATOM 425 C LEU A 29 -0.951 8.815 -2.758 1.00 0.00 C ATOM 426 O LEU A 29 -1.269 8.237 -3.792 1.00 0.00 O ATOM 427 CB LEU A 29 0.613 7.821 -1.039 1.00 0.00 C ATOM 428 CG LEU A 29 1.914 7.004 -1.015 1.00 0.00 C ATOM 429 CD1 LEU A 29 1.842 5.854 -2.029 1.00 0.00 C ATOM 430 CD2 LEU A 29 3.191 7.816 -1.264 1.00 0.00 C ATOM 431 H LEU A 29 1.383 10.250 -1.060 1.00 0.00 H ATOM 432 HA LEU A 29 1.061 8.289 -3.097 1.00 0.00 H ATOM 433 HB2 LEU A 29 0.547 8.423 -0.132 1.00 0.00 H ATOM 434 HB3 LEU A 29 -0.228 7.126 -1.016 1.00 0.00 H ATOM 435 HG LEU A 29 1.992 6.602 -0.012 1.00 0.00 H ATOM 436 HD11 LEU A 29 1.719 6.239 -3.042 1.00 0.00 H ATOM 437 HD12 LEU A 29 2.753 5.260 -1.989 1.00 0.00 H ATOM 438 HD13 LEU A 29 1.001 5.202 -1.792 1.00 0.00 H ATOM 439 HD21 LEU A 29 3.279 8.598 -0.514 1.00 0.00 H ATOM 440 HD22 LEU A 29 4.061 7.166 -1.194 1.00 0.00 H ATOM 441 HD23 LEU A 29 3.173 8.262 -2.255 1.00 0.00 H ATOM 442 N SER A 30 -1.807 9.552 -2.049 1.00 0.00 N ATOM 443 CA SER A 30 -3.203 9.749 -2.431 1.00 0.00 C ATOM 444 C SER A 30 -3.304 10.330 -3.842 1.00 0.00 C ATOM 445 O SER A 30 -4.179 9.933 -4.601 1.00 0.00 O ATOM 446 CB SER A 30 -3.925 10.604 -1.379 1.00 0.00 C ATOM 447 OG SER A 30 -3.773 10.050 -0.075 1.00 0.00 O ATOM 448 H SER A 30 -1.464 10.026 -1.224 1.00 0.00 H ATOM 449 HA SER A 30 -3.700 8.784 -2.471 1.00 0.00 H ATOM 450 HB2 SER A 30 -3.525 11.618 -1.393 1.00 0.00 H ATOM 451 HB3 SER A 30 -4.984 10.649 -1.630 1.00 0.00 H ATOM 452 HG SER A 30 -2.820 10.084 0.139 1.00 0.00 H ATOM 453 N ASP A 31 -2.376 11.190 -4.251 1.00 0.00 N ATOM 454 CA ASP A 31 -2.295 11.747 -5.597 1.00 0.00 C ATOM 455 C ASP A 31 -2.331 10.641 -6.659 1.00 0.00 C ATOM 456 O ASP A 31 -3.039 10.768 -7.660 1.00 0.00 O ATOM 457 CB ASP A 31 -1.002 12.568 -5.698 1.00 0.00 C ATOM 458 CG ASP A 31 -1.039 13.706 -6.705 1.00 0.00 C ATOM 459 OD1 ASP A 31 -1.828 13.700 -7.666 1.00 0.00 O ATOM 460 OD2 ASP A 31 -0.273 14.674 -6.474 1.00 0.00 O ATOM 461 H ASP A 31 -1.690 11.510 -3.577 1.00 0.00 H ATOM 462 HA ASP A 31 -3.145 12.412 -5.747 1.00 0.00 H ATOM 463 HB2 ASP A 31 -0.785 13.010 -4.723 1.00 0.00 H ATOM 464 HB3 ASP A 31 -0.173 11.917 -5.965 1.00 0.00 H ATOM 465 N PHE A 32 -1.604 9.540 -6.418 1.00 0.00 N ATOM 466 CA PHE A 32 -1.336 8.476 -7.384 1.00 0.00 C ATOM 467 C PHE A 32 -2.189 7.215 -7.166 1.00 0.00 C ATOM 468 O PHE A 32 -2.366 6.455 -8.118 1.00 0.00 O ATOM 469 CB PHE A 32 0.160 8.096 -7.331 1.00 0.00 C ATOM 470 CG PHE A 32 1.193 9.211 -7.469 1.00 0.00 C ATOM 471 CD1 PHE A 32 0.896 10.443 -8.089 1.00 0.00 C ATOM 472 CD2 PHE A 32 2.492 9.000 -6.971 1.00 0.00 C ATOM 473 CE1 PHE A 32 1.863 11.460 -8.152 1.00 0.00 C ATOM 474 CE2 PHE A 32 3.472 10.003 -7.073 1.00 0.00 C ATOM 475 CZ PHE A 32 3.155 11.244 -7.646 1.00 0.00 C ATOM 476 H PHE A 32 -1.113 9.499 -5.532 1.00 0.00 H ATOM 477 HA PHE A 32 -1.556 8.848 -8.384 1.00 0.00 H ATOM 478 HB2 PHE A 32 0.351 7.590 -6.380 1.00 0.00 H ATOM 479 HB3 PHE A 32 0.354 7.375 -8.125 1.00 0.00 H ATOM 480 HD1 PHE A 32 -0.082 10.642 -8.500 1.00 0.00 H ATOM 481 HD2 PHE A 32 2.743 8.068 -6.494 1.00 0.00 H ATOM 482 HE1 PHE A 32 1.600 12.412 -8.589 1.00 0.00 H ATOM 483 HE2 PHE A 32 4.467 9.818 -6.702 1.00 0.00 H ATOM 484 HZ PHE A 32 3.900 12.027 -7.701 1.00 0.00 H ATOM 485 N ILE A 33 -2.671 6.960 -5.944 1.00 0.00 N ATOM 486 CA ILE A 33 -3.395 5.741 -5.548 1.00 0.00 C ATOM 487 C ILE A 33 -4.921 5.944 -5.485 1.00 0.00 C ATOM 488 O ILE A 33 -5.681 4.981 -5.596 1.00 0.00 O ATOM 489 CB ILE A 33 -2.797 5.249 -4.208 1.00 0.00 C ATOM 490 CG1 ILE A 33 -1.295 4.906 -4.310 1.00 0.00 C ATOM 491 CG2 ILE A 33 -3.504 4.042 -3.584 1.00 0.00 C ATOM 492 CD1 ILE A 33 -0.993 3.730 -5.244 1.00 0.00 C ATOM 493 H ILE A 33 -2.424 7.607 -5.203 1.00 0.00 H ATOM 494 HA ILE A 33 -3.228 4.975 -6.304 1.00 0.00 H ATOM 495 HB ILE A 33 -2.906 6.069 -3.505 1.00 0.00 H ATOM 496 HG12 ILE A 33 -0.730 5.774 -4.651 1.00 0.00 H ATOM 497 HG13 ILE A 33 -0.923 4.657 -3.315 1.00 0.00 H ATOM 498 HG21 ILE A 33 -4.508 4.324 -3.282 1.00 0.00 H ATOM 499 HG22 ILE A 33 -3.562 3.227 -4.296 1.00 0.00 H ATOM 500 HG23 ILE A 33 -2.968 3.699 -2.699 1.00 0.00 H ATOM 501 HD11 ILE A 33 -1.512 2.824 -4.932 1.00 0.00 H ATOM 502 HD12 ILE A 33 -1.267 3.974 -6.269 1.00 0.00 H ATOM 503 HD13 ILE A 33 0.071 3.536 -5.194 1.00 0.00 H ATOM 504 N ASP A 34 -5.380 7.181 -5.297 1.00 0.00 N ATOM 505 CA ASP A 34 -6.789 7.569 -5.354 1.00 0.00 C ATOM 506 C ASP A 34 -7.387 7.402 -6.760 1.00 0.00 C ATOM 507 O ASP A 34 -8.505 6.889 -6.846 1.00 0.00 O ATOM 508 CB ASP A 34 -6.895 9.006 -4.845 1.00 0.00 C ATOM 509 CG ASP A 34 -8.291 9.545 -4.582 1.00 0.00 C ATOM 510 OD1 ASP A 34 -8.976 9.927 -5.552 1.00 0.00 O ATOM 511 OD2 ASP A 34 -8.565 9.795 -3.382 1.00 0.00 O ATOM 512 H ASP A 34 -4.713 7.935 -5.204 1.00 0.00 H ATOM 513 HA ASP A 34 -7.351 6.931 -4.673 1.00 0.00 H ATOM 514 HB2 ASP A 34 -6.352 9.067 -3.901 1.00 0.00 H ATOM 515 HB3 ASP A 34 -6.428 9.667 -5.570 1.00 0.00 H ATOM 516 N PRO A 35 -6.699 7.762 -7.870 1.00 0.00 N ATOM 517 CA PRO A 35 -7.151 7.394 -9.207 1.00 0.00 C ATOM 518 C PRO A 35 -6.919 5.896 -9.466 1.00 0.00 C ATOM 519 O PRO A 35 -6.330 5.192 -8.644 1.00 0.00 O ATOM 520 CB PRO A 35 -6.329 8.275 -10.157 1.00 0.00 C ATOM 521 CG PRO A 35 -5.001 8.413 -9.438 1.00 0.00 C ATOM 522 CD PRO A 35 -5.430 8.481 -7.977 1.00 0.00 C ATOM 523 HA PRO A 35 -8.210 7.617 -9.324 1.00 0.00 H ATOM 524 HB2 PRO A 35 -6.202 7.842 -11.147 1.00 0.00 H ATOM 525 HB3 PRO A 35 -6.786 9.260 -10.235 1.00 0.00 H ATOM 526 HG2 PRO A 35 -4.394 7.523 -9.611 1.00 0.00 H ATOM 527 HG3 PRO A 35 -4.469 9.309 -9.749 1.00 0.00 H ATOM 528 HD2 PRO A 35 -4.643 8.035 -7.388 1.00 0.00 H ATOM 529 HD3 PRO A 35 -5.572 9.512 -7.672 1.00 0.00 H ATOM 530 N GLN A 36 -7.340 5.414 -10.642 1.00 0.00 N ATOM 531 CA GLN A 36 -7.014 4.088 -11.183 1.00 0.00 C ATOM 532 C GLN A 36 -7.492 2.922 -10.292 1.00 0.00 C ATOM 533 O GLN A 36 -7.107 1.773 -10.527 1.00 0.00 O ATOM 534 CB GLN A 36 -5.499 4.019 -11.508 1.00 0.00 C ATOM 535 CG GLN A 36 -5.076 4.999 -12.617 1.00 0.00 C ATOM 536 CD GLN A 36 -3.561 5.149 -12.773 1.00 0.00 C ATOM 537 OE1 GLN A 36 -2.768 4.223 -12.594 1.00 0.00 O ATOM 538 NE2 GLN A 36 -3.118 6.339 -13.134 1.00 0.00 N ATOM 539 H GLN A 36 -7.853 6.055 -11.241 1.00 0.00 H ATOM 540 HA GLN A 36 -7.553 3.981 -12.126 1.00 0.00 H ATOM 541 HB2 GLN A 36 -4.918 4.224 -10.607 1.00 0.00 H ATOM 542 HB3 GLN A 36 -5.249 3.014 -11.840 1.00 0.00 H ATOM 543 HG2 GLN A 36 -5.485 4.665 -13.567 1.00 0.00 H ATOM 544 HG3 GLN A 36 -5.495 5.981 -12.406 1.00 0.00 H ATOM 545 HE21 GLN A 36 -3.762 7.102 -13.331 1.00 0.00 H ATOM 546 HE22 GLN A 36 -2.135 6.546 -13.243 1.00 0.00 H ATOM 547 N GLU A 37 -8.336 3.184 -9.283 1.00 0.00 N ATOM 548 CA GLU A 37 -8.677 2.250 -8.208 1.00 0.00 C ATOM 549 C GLU A 37 -7.413 1.654 -7.557 1.00 0.00 C ATOM 550 O GLU A 37 -7.418 0.524 -7.063 1.00 0.00 O ATOM 551 CB GLU A 37 -9.740 1.237 -8.698 1.00 0.00 C ATOM 552 CG GLU A 37 -11.142 1.852 -8.574 1.00 0.00 C ATOM 553 CD GLU A 37 -12.256 1.009 -9.206 1.00 0.00 C ATOM 554 OE1 GLU A 37 -12.436 -0.181 -8.847 1.00 0.00 O ATOM 555 OE2 GLU A 37 -13.059 1.543 -10.009 1.00 0.00 O ATOM 556 H GLU A 37 -8.597 4.149 -9.139 1.00 0.00 H ATOM 557 HA GLU A 37 -9.140 2.834 -7.413 1.00 0.00 H ATOM 558 HB2 GLU A 37 -9.555 0.958 -9.735 1.00 0.00 H ATOM 559 HB3 GLU A 37 -9.713 0.335 -8.094 1.00 0.00 H ATOM 560 HG2 GLU A 37 -11.371 1.982 -7.515 1.00 0.00 H ATOM 561 HG3 GLU A 37 -11.128 2.838 -9.038 1.00 0.00 H ATOM 562 N GLY A 38 -6.325 2.433 -7.513 1.00 0.00 N ATOM 563 CA GLY A 38 -5.047 2.040 -6.934 1.00 0.00 C ATOM 564 C GLY A 38 -5.206 1.537 -5.501 1.00 0.00 C ATOM 565 O GLY A 38 -4.610 0.527 -5.127 1.00 0.00 O ATOM 566 H GLY A 38 -6.407 3.376 -7.888 1.00 0.00 H ATOM 567 HA2 GLY A 38 -4.599 1.256 -7.543 1.00 0.00 H ATOM 568 HA3 GLY A 38 -4.383 2.905 -6.936 1.00 0.00 H ATOM 569 N TRP A 39 -6.021 2.212 -4.690 1.00 0.00 N ATOM 570 CA TRP A 39 -6.270 1.828 -3.313 1.00 0.00 C ATOM 571 C TRP A 39 -7.007 0.491 -3.240 1.00 0.00 C ATOM 572 O TRP A 39 -6.677 -0.329 -2.390 1.00 0.00 O ATOM 573 CB TRP A 39 -7.087 2.907 -2.609 1.00 0.00 C ATOM 574 CG TRP A 39 -8.437 3.151 -3.198 1.00 0.00 C ATOM 575 CD1 TRP A 39 -8.704 3.934 -4.266 1.00 0.00 C ATOM 576 CD2 TRP A 39 -9.696 2.515 -2.831 1.00 0.00 C ATOM 577 NE1 TRP A 39 -10.037 3.821 -4.590 1.00 0.00 N ATOM 578 CE2 TRP A 39 -10.697 2.962 -3.739 1.00 0.00 C ATOM 579 CE3 TRP A 39 -10.068 1.534 -1.884 1.00 0.00 C ATOM 580 CZ2 TRP A 39 -12.007 2.475 -3.695 1.00 0.00 C ATOM 581 CZ3 TRP A 39 -11.383 1.039 -1.846 1.00 0.00 C ATOM 582 CH2 TRP A 39 -12.363 1.541 -2.712 1.00 0.00 C ATOM 583 H TRP A 39 -6.393 3.097 -5.010 1.00 0.00 H ATOM 584 HA TRP A 39 -5.311 1.725 -2.800 1.00 0.00 H ATOM 585 HB2 TRP A 39 -7.224 2.556 -1.595 1.00 0.00 H ATOM 586 HB3 TRP A 39 -6.534 3.843 -2.573 1.00 0.00 H ATOM 587 HD1 TRP A 39 -7.987 4.542 -4.808 1.00 0.00 H ATOM 588 HE1 TRP A 39 -10.421 4.307 -5.405 1.00 0.00 H ATOM 589 HE3 TRP A 39 -9.322 1.133 -1.210 1.00 0.00 H ATOM 590 HZ2 TRP A 39 -12.687 2.741 -4.481 1.00 0.00 H ATOM 591 HZ3 TRP A 39 -11.652 0.220 -1.198 1.00 0.00 H ATOM 592 HH2 TRP A 39 -13.357 1.133 -2.668 1.00 0.00 H ATOM 593 N LYS A 40 -7.988 0.234 -4.118 1.00 0.00 N ATOM 594 CA LYS A 40 -8.680 -1.056 -4.164 1.00 0.00 C ATOM 595 C LYS A 40 -7.669 -2.146 -4.462 1.00 0.00 C ATOM 596 O LYS A 40 -7.715 -3.209 -3.845 1.00 0.00 O ATOM 597 CB LYS A 40 -9.790 -1.080 -5.234 1.00 0.00 C ATOM 598 CG LYS A 40 -11.113 -0.501 -4.767 1.00 0.00 C ATOM 599 CD LYS A 40 -12.307 -1.038 -5.556 1.00 0.00 C ATOM 600 CE LYS A 40 -13.426 0.004 -5.704 1.00 0.00 C ATOM 601 NZ LYS A 40 -14.332 -0.342 -6.817 1.00 0.00 N ATOM 602 H LYS A 40 -8.190 0.931 -4.823 1.00 0.00 H ATOM 603 HA LYS A 40 -9.103 -1.276 -3.185 1.00 0.00 H ATOM 604 HB2 LYS A 40 -9.509 -0.466 -6.084 1.00 0.00 H ATOM 605 HB3 LYS A 40 -9.947 -2.109 -5.560 1.00 0.00 H ATOM 606 HG2 LYS A 40 -11.263 -0.733 -3.717 1.00 0.00 H ATOM 607 HG3 LYS A 40 -11.031 0.566 -4.928 1.00 0.00 H ATOM 608 HD2 LYS A 40 -11.971 -1.346 -6.546 1.00 0.00 H ATOM 609 HD3 LYS A 40 -12.682 -1.901 -5.011 1.00 0.00 H ATOM 610 HE2 LYS A 40 -13.992 0.068 -4.771 1.00 0.00 H ATOM 611 HE3 LYS A 40 -12.975 0.975 -5.921 1.00 0.00 H ATOM 612 HZ1 LYS A 40 -14.810 -1.219 -6.650 1.00 0.00 H ATOM 613 HZ2 LYS A 40 -15.072 0.346 -6.936 1.00 0.00 H ATOM 614 HZ3 LYS A 40 -13.799 -0.406 -7.685 1.00 0.00 H ATOM 615 N LYS A 41 -6.749 -1.873 -5.386 1.00 0.00 N ATOM 616 CA LYS A 41 -5.750 -2.827 -5.825 1.00 0.00 C ATOM 617 C LYS A 41 -4.816 -3.135 -4.664 1.00 0.00 C ATOM 618 O LYS A 41 -4.564 -4.305 -4.394 1.00 0.00 O ATOM 619 CB LYS A 41 -5.017 -2.274 -7.040 1.00 0.00 C ATOM 620 CG LYS A 41 -5.843 -2.404 -8.320 1.00 0.00 C ATOM 621 CD LYS A 41 -5.312 -1.380 -9.327 1.00 0.00 C ATOM 622 CE LYS A 41 -6.028 -1.418 -10.677 1.00 0.00 C ATOM 623 NZ LYS A 41 -5.466 -2.400 -11.629 1.00 0.00 N ATOM 624 H LYS A 41 -6.695 -0.916 -5.718 1.00 0.00 H ATOM 625 HA LYS A 41 -6.248 -3.741 -6.137 1.00 0.00 H ATOM 626 HB2 LYS A 41 -4.762 -1.233 -6.860 1.00 0.00 H ATOM 627 HB3 LYS A 41 -4.109 -2.836 -7.191 1.00 0.00 H ATOM 628 HG2 LYS A 41 -5.733 -3.414 -8.720 1.00 0.00 H ATOM 629 HG3 LYS A 41 -6.894 -2.226 -8.094 1.00 0.00 H ATOM 630 HD2 LYS A 41 -5.463 -0.382 -8.913 1.00 0.00 H ATOM 631 HD3 LYS A 41 -4.243 -1.548 -9.449 1.00 0.00 H ATOM 632 HE2 LYS A 41 -7.085 -1.629 -10.508 1.00 0.00 H ATOM 633 HE3 LYS A 41 -5.943 -0.426 -11.125 1.00 0.00 H ATOM 634 HZ1 LYS A 41 -6.004 -2.363 -12.490 1.00 0.00 H ATOM 635 HZ2 LYS A 41 -4.511 -2.174 -11.891 1.00 0.00 H ATOM 636 HZ3 LYS A 41 -5.491 -3.347 -11.268 1.00 0.00 H ATOM 637 N LEU A 42 -4.321 -2.107 -3.970 1.00 0.00 N ATOM 638 CA LEU A 42 -3.491 -2.237 -2.792 1.00 0.00 C ATOM 639 C LEU A 42 -4.221 -3.035 -1.712 1.00 0.00 C ATOM 640 O LEU A 42 -3.693 -4.038 -1.247 1.00 0.00 O ATOM 641 CB LEU A 42 -3.108 -0.814 -2.356 1.00 0.00 C ATOM 642 CG LEU A 42 -1.982 -0.670 -1.322 1.00 0.00 C ATOM 643 CD1 LEU A 42 -2.529 -0.389 0.075 1.00 0.00 C ATOM 644 CD2 LEU A 42 -0.957 -1.806 -1.305 1.00 0.00 C ATOM 645 H LEU A 42 -4.472 -1.148 -4.263 1.00 0.00 H ATOM 646 HA LEU A 42 -2.597 -2.786 -3.087 1.00 0.00 H ATOM 647 HB2 LEU A 42 -2.773 -0.281 -3.248 1.00 0.00 H ATOM 648 HB3 LEU A 42 -3.998 -0.298 -1.987 1.00 0.00 H ATOM 649 HG LEU A 42 -1.454 0.222 -1.625 1.00 0.00 H ATOM 650 HD11 LEU A 42 -3.024 0.577 0.079 1.00 0.00 H ATOM 651 HD12 LEU A 42 -3.244 -1.158 0.353 1.00 0.00 H ATOM 652 HD13 LEU A 42 -1.714 -0.363 0.799 1.00 0.00 H ATOM 653 HD21 LEU A 42 -0.527 -1.929 -2.298 1.00 0.00 H ATOM 654 HD22 LEU A 42 -0.154 -1.574 -0.606 1.00 0.00 H ATOM 655 HD23 LEU A 42 -1.423 -2.737 -0.988 1.00 0.00 H ATOM 656 N ALA A 43 -5.449 -2.641 -1.359 1.00 0.00 N ATOM 657 CA ALA A 43 -6.269 -3.296 -0.347 1.00 0.00 C ATOM 658 C ALA A 43 -6.368 -4.794 -0.600 1.00 0.00 C ATOM 659 O ALA A 43 -6.057 -5.592 0.280 1.00 0.00 O ATOM 660 CB ALA A 43 -7.668 -2.673 -0.302 1.00 0.00 C ATOM 661 H ALA A 43 -5.834 -1.813 -1.799 1.00 0.00 H ATOM 662 HA ALA A 43 -5.797 -3.153 0.620 1.00 0.00 H ATOM 663 HB1 ALA A 43 -8.270 -3.188 0.446 1.00 0.00 H ATOM 664 HB2 ALA A 43 -7.603 -1.621 -0.038 1.00 0.00 H ATOM 665 HB3 ALA A 43 -8.148 -2.771 -1.273 1.00 0.00 H ATOM 666 N VAL A 44 -6.801 -5.189 -1.795 1.00 0.00 N ATOM 667 CA VAL A 44 -7.031 -6.567 -2.129 1.00 0.00 C ATOM 668 C VAL A 44 -5.716 -7.344 -2.302 1.00 0.00 C ATOM 669 O VAL A 44 -5.690 -8.563 -2.131 1.00 0.00 O ATOM 670 CB VAL A 44 -7.974 -6.536 -3.347 1.00 0.00 C ATOM 671 CG1 VAL A 44 -7.299 -6.309 -4.708 1.00 0.00 C ATOM 672 CG2 VAL A 44 -8.822 -7.785 -3.316 1.00 0.00 C ATOM 673 H VAL A 44 -7.134 -4.560 -2.513 1.00 0.00 H ATOM 674 HA VAL A 44 -7.562 -7.009 -1.284 1.00 0.00 H ATOM 675 HB VAL A 44 -8.681 -5.716 -3.209 1.00 0.00 H ATOM 676 HG11 VAL A 44 -6.583 -7.100 -4.912 1.00 0.00 H ATOM 677 HG12 VAL A 44 -8.047 -6.272 -5.501 1.00 0.00 H ATOM 678 HG13 VAL A 44 -6.783 -5.355 -4.702 1.00 0.00 H ATOM 679 HG21 VAL A 44 -9.571 -7.718 -4.092 1.00 0.00 H ATOM 680 HG22 VAL A 44 -8.193 -8.660 -3.456 1.00 0.00 H ATOM 681 HG23 VAL A 44 -9.319 -7.821 -2.348 1.00 0.00 H ATOM 682 N ALA A 45 -4.598 -6.661 -2.571 1.00 0.00 N ATOM 683 CA ALA A 45 -3.281 -7.277 -2.592 1.00 0.00 C ATOM 684 C ALA A 45 -2.751 -7.543 -1.177 1.00 0.00 C ATOM 685 O ALA A 45 -1.811 -8.321 -1.027 1.00 0.00 O ATOM 686 CB ALA A 45 -2.321 -6.381 -3.381 1.00 0.00 C ATOM 687 H ALA A 45 -4.632 -5.653 -2.669 1.00 0.00 H ATOM 688 HA ALA A 45 -3.348 -8.239 -3.104 1.00 0.00 H ATOM 689 HB1 ALA A 45 -1.341 -6.853 -3.433 1.00 0.00 H ATOM 690 HB2 ALA A 45 -2.699 -6.238 -4.392 1.00 0.00 H ATOM 691 HB3 ALA A 45 -2.225 -5.411 -2.892 1.00 0.00 H ATOM 692 N ILE A 46 -3.312 -6.936 -0.129 1.00 0.00 N ATOM 693 CA ILE A 46 -2.845 -7.119 1.239 1.00 0.00 C ATOM 694 C ILE A 46 -3.464 -8.404 1.797 1.00 0.00 C ATOM 695 O ILE A 46 -4.652 -8.463 2.135 1.00 0.00 O ATOM 696 CB ILE A 46 -3.140 -5.858 2.076 1.00 0.00 C ATOM 697 CG1 ILE A 46 -2.225 -4.705 1.621 1.00 0.00 C ATOM 698 CG2 ILE A 46 -2.887 -6.130 3.561 1.00 0.00 C ATOM 699 CD1 ILE A 46 -2.784 -3.319 1.940 1.00 0.00 C ATOM 700 H ILE A 46 -4.098 -6.312 -0.268 1.00 0.00 H ATOM 701 HA ILE A 46 -1.759 -7.246 1.222 1.00 0.00 H ATOM 702 HB ILE A 46 -4.185 -5.574 1.949 1.00 0.00 H ATOM 703 HG12 ILE A 46 -1.244 -4.811 2.086 1.00 0.00 H ATOM 704 HG13 ILE A 46 -2.080 -4.755 0.546 1.00 0.00 H ATOM 705 HG21 ILE A 46 -3.052 -5.231 4.145 1.00 0.00 H ATOM 706 HG22 ILE A 46 -3.578 -6.891 3.899 1.00 0.00 H ATOM 707 HG23 ILE A 46 -1.867 -6.482 3.714 1.00 0.00 H ATOM 708 HD11 ILE A 46 -3.698 -3.156 1.374 1.00 0.00 H ATOM 709 HD12 ILE A 46 -3.003 -3.222 2.999 1.00 0.00 H ATOM 710 HD13 ILE A 46 -2.044 -2.572 1.653 1.00 0.00 H ATOM 711 N LYS A 47 -2.649 -9.454 1.901 1.00 0.00 N ATOM 712 CA LYS A 47 -3.029 -10.695 2.564 1.00 0.00 C ATOM 713 C LYS A 47 -2.429 -10.696 3.973 1.00 0.00 C ATOM 714 O LYS A 47 -1.531 -9.911 4.277 1.00 0.00 O ATOM 715 CB LYS A 47 -2.575 -11.899 1.716 1.00 0.00 C ATOM 716 CG LYS A 47 -3.489 -12.198 0.506 1.00 0.00 C ATOM 717 CD LYS A 47 -3.397 -11.243 -0.703 1.00 0.00 C ATOM 718 CE LYS A 47 -2.069 -11.344 -1.475 1.00 0.00 C ATOM 719 NZ LYS A 47 -2.190 -12.063 -2.760 1.00 0.00 N ATOM 720 H LYS A 47 -1.672 -9.356 1.639 1.00 0.00 H ATOM 721 HA LYS A 47 -4.113 -10.748 2.662 1.00 0.00 H ATOM 722 HB2 LYS A 47 -1.541 -11.774 1.392 1.00 0.00 H ATOM 723 HB3 LYS A 47 -2.606 -12.778 2.357 1.00 0.00 H ATOM 724 HG2 LYS A 47 -3.268 -13.209 0.164 1.00 0.00 H ATOM 725 HG3 LYS A 47 -4.522 -12.203 0.855 1.00 0.00 H ATOM 726 HD2 LYS A 47 -4.220 -11.457 -1.382 1.00 0.00 H ATOM 727 HD3 LYS A 47 -3.544 -10.219 -0.371 1.00 0.00 H ATOM 728 HE2 LYS A 47 -1.703 -10.347 -1.698 1.00 0.00 H ATOM 729 HE3 LYS A 47 -1.326 -11.836 -0.848 1.00 0.00 H ATOM 730 HZ1 LYS A 47 -2.522 -13.007 -2.590 1.00 0.00 H ATOM 731 HZ2 LYS A 47 -2.831 -11.604 -3.397 1.00 0.00 H ATOM 732 HZ3 LYS A 47 -1.280 -12.132 -3.214 1.00 0.00 H ATOM 733 N LYS A 48 -2.955 -11.527 4.870 1.00 0.00 N ATOM 734 CA LYS A 48 -2.368 -11.836 6.172 1.00 0.00 C ATOM 735 C LYS A 48 -1.143 -12.736 5.970 1.00 0.00 C ATOM 736 O LYS A 48 -0.970 -13.264 4.871 1.00 0.00 O ATOM 737 CB LYS A 48 -3.442 -12.516 7.043 1.00 0.00 C ATOM 738 CG LYS A 48 -4.586 -11.552 7.389 1.00 0.00 C ATOM 739 CD LYS A 48 -5.260 -11.889 8.729 1.00 0.00 C ATOM 740 CE LYS A 48 -6.251 -10.779 9.090 1.00 0.00 C ATOM 741 NZ LYS A 48 -7.008 -11.052 10.332 1.00 0.00 N ATOM 742 H LYS A 48 -3.760 -12.074 4.583 1.00 0.00 H ATOM 743 HA LYS A 48 -2.034 -10.909 6.635 1.00 0.00 H ATOM 744 HB2 LYS A 48 -3.839 -13.377 6.510 1.00 0.00 H ATOM 745 HB3 LYS A 48 -2.997 -12.871 7.968 1.00 0.00 H ATOM 746 HG2 LYS A 48 -4.185 -10.548 7.430 1.00 0.00 H ATOM 747 HG3 LYS A 48 -5.327 -11.552 6.594 1.00 0.00 H ATOM 748 HD2 LYS A 48 -5.779 -12.845 8.644 1.00 0.00 H ATOM 749 HD3 LYS A 48 -4.500 -11.954 9.508 1.00 0.00 H ATOM 750 HE2 LYS A 48 -5.702 -9.844 9.196 1.00 0.00 H ATOM 751 HE3 LYS A 48 -6.958 -10.665 8.269 1.00 0.00 H ATOM 752 HZ1 LYS A 48 -7.579 -11.889 10.233 1.00 0.00 H ATOM 753 HZ2 LYS A 48 -6.415 -11.154 11.149 1.00 0.00 H ATOM 754 HZ3 LYS A 48 -7.627 -10.271 10.528 1.00 0.00 H ATOM 755 N PRO A 49 -0.327 -13.003 7.008 1.00 0.00 N ATOM 756 CA PRO A 49 0.825 -13.893 6.889 1.00 0.00 C ATOM 757 C PRO A 49 0.428 -15.267 6.338 1.00 0.00 C ATOM 758 O PRO A 49 1.088 -15.798 5.448 1.00 0.00 O ATOM 759 CB PRO A 49 1.438 -13.973 8.292 1.00 0.00 C ATOM 760 CG PRO A 49 0.996 -12.664 8.939 1.00 0.00 C ATOM 761 CD PRO A 49 -0.399 -12.469 8.359 1.00 0.00 C ATOM 762 HA PRO A 49 1.546 -13.433 6.215 1.00 0.00 H ATOM 763 HB2 PRO A 49 1.006 -14.806 8.846 1.00 0.00 H ATOM 764 HB3 PRO A 49 2.525 -14.057 8.256 1.00 0.00 H ATOM 765 HG2 PRO A 49 0.989 -12.732 10.026 1.00 0.00 H ATOM 766 HG3 PRO A 49 1.634 -11.845 8.611 1.00 0.00 H ATOM 767 HD2 PRO A 49 -1.105 -13.052 8.950 1.00 0.00 H ATOM 768 HD3 PRO A 49 -0.672 -11.417 8.361 1.00 0.00 H ATOM 769 N SER A 50 -0.683 -15.819 6.825 1.00 0.00 N ATOM 770 CA SER A 50 -1.254 -17.088 6.397 1.00 0.00 C ATOM 771 C SER A 50 -1.789 -17.039 4.955 1.00 0.00 C ATOM 772 O SER A 50 -1.829 -18.060 4.266 1.00 0.00 O ATOM 773 CB SER A 50 -2.402 -17.408 7.360 1.00 0.00 C ATOM 774 OG SER A 50 -2.084 -17.075 8.706 1.00 0.00 O ATOM 775 H SER A 50 -1.128 -15.417 7.635 1.00 0.00 H ATOM 776 HA SER A 50 -0.496 -17.869 6.468 1.00 0.00 H ATOM 777 HB2 SER A 50 -3.265 -16.815 7.068 1.00 0.00 H ATOM 778 HB3 SER A 50 -2.659 -18.461 7.281 1.00 0.00 H ATOM 779 HG SER A 50 -2.938 -16.886 9.152 1.00 0.00 H ATOM 780 N GLY A 51 -2.169 -15.856 4.465 1.00 0.00 N ATOM 781 CA GLY A 51 -2.783 -15.652 3.159 1.00 0.00 C ATOM 782 C GLY A 51 -4.228 -15.159 3.226 1.00 0.00 C ATOM 783 O GLY A 51 -4.802 -14.900 2.169 1.00 0.00 O ATOM 784 H GLY A 51 -2.013 -15.025 5.015 1.00 0.00 H ATOM 785 HA2 GLY A 51 -2.186 -14.928 2.608 1.00 0.00 H ATOM 786 HA3 GLY A 51 -2.781 -16.575 2.583 1.00 0.00 H ATOM 787 N ASP A 52 -4.834 -15.014 4.414 1.00 0.00 N ATOM 788 CA ASP A 52 -6.219 -14.547 4.537 1.00 0.00 C ATOM 789 C ASP A 52 -6.329 -13.164 3.898 1.00 0.00 C ATOM 790 O ASP A 52 -5.467 -12.310 4.117 1.00 0.00 O ATOM 791 CB ASP A 52 -6.729 -14.411 5.987 1.00 0.00 C ATOM 792 CG ASP A 52 -6.267 -15.440 7.009 1.00 0.00 C ATOM 793 OD1 ASP A 52 -5.106 -15.320 7.464 1.00 0.00 O ATOM 794 OD2 ASP A 52 -7.098 -16.246 7.490 1.00 0.00 O ATOM 795 H ASP A 52 -4.386 -15.355 5.256 1.00 0.00 H ATOM 796 HA ASP A 52 -6.860 -15.255 4.011 1.00 0.00 H ATOM 797 HB2 ASP A 52 -6.443 -13.436 6.369 1.00 0.00 H ATOM 798 HB3 ASP A 52 -7.819 -14.419 5.955 1.00 0.00 H ATOM 799 N ASP A 53 -7.392 -12.898 3.148 1.00 0.00 N ATOM 800 CA ASP A 53 -7.601 -11.597 2.521 1.00 0.00 C ATOM 801 C ASP A 53 -7.894 -10.575 3.629 1.00 0.00 C ATOM 802 O ASP A 53 -8.985 -10.633 4.210 1.00 0.00 O ATOM 803 CB ASP A 53 -8.818 -11.625 1.577 1.00 0.00 C ATOM 804 CG ASP A 53 -8.817 -12.563 0.381 1.00 0.00 C ATOM 805 OD1 ASP A 53 -7.871 -13.342 0.166 1.00 0.00 O ATOM 806 OD2 ASP A 53 -9.850 -12.505 -0.346 1.00 0.00 O ATOM 807 H ASP A 53 -8.048 -13.643 2.951 1.00 0.00 H ATOM 808 HA ASP A 53 -6.716 -11.308 1.950 1.00 0.00 H ATOM 809 HB2 ASP A 53 -9.690 -11.898 2.160 1.00 0.00 H ATOM 810 HB3 ASP A 53 -8.966 -10.608 1.208 1.00 0.00 H ATOM 811 N ARG A 54 -6.981 -9.657 3.991 1.00 0.00 N ATOM 812 CA ARG A 54 -7.274 -8.640 5.016 1.00 0.00 C ATOM 813 C ARG A 54 -8.572 -7.893 4.737 1.00 0.00 C ATOM 814 O ARG A 54 -9.410 -7.825 5.639 1.00 0.00 O ATOM 815 CB ARG A 54 -6.109 -7.654 5.244 1.00 0.00 C ATOM 816 CG ARG A 54 -4.972 -8.338 6.006 1.00 0.00 C ATOM 817 CD ARG A 54 -3.993 -7.375 6.688 1.00 0.00 C ATOM 818 NE ARG A 54 -3.128 -8.078 7.652 1.00 0.00 N ATOM 819 CZ ARG A 54 -3.396 -8.278 8.947 1.00 0.00 C ATOM 820 NH1 ARG A 54 -4.491 -7.778 9.504 1.00 0.00 N ATOM 821 NH2 ARG A 54 -2.580 -8.991 9.697 1.00 0.00 N ATOM 822 H ARG A 54 -6.028 -9.731 3.649 1.00 0.00 H ATOM 823 HA ARG A 54 -7.437 -9.174 5.950 1.00 0.00 H ATOM 824 HB2 ARG A 54 -5.762 -7.250 4.294 1.00 0.00 H ATOM 825 HB3 ARG A 54 -6.462 -6.828 5.866 1.00 0.00 H ATOM 826 HG2 ARG A 54 -5.431 -8.931 6.793 1.00 0.00 H ATOM 827 HG3 ARG A 54 -4.425 -8.984 5.328 1.00 0.00 H ATOM 828 HD2 ARG A 54 -3.346 -6.903 5.958 1.00 0.00 H ATOM 829 HD3 ARG A 54 -4.547 -6.582 7.195 1.00 0.00 H ATOM 830 HE ARG A 54 -2.200 -8.375 7.334 1.00 0.00 H ATOM 831 HH11 ARG A 54 -4.935 -6.973 9.083 1.00 0.00 H ATOM 832 HH12 ARG A 54 -4.674 -7.951 10.496 1.00 0.00 H ATOM 833 HH21 ARG A 54 -1.659 -9.287 9.353 1.00 0.00 H ATOM 834 HH22 ARG A 54 -2.623 -8.895 10.712 1.00 0.00 H ATOM 835 N TYR A 55 -8.775 -7.384 3.521 1.00 0.00 N ATOM 836 CA TYR A 55 -9.843 -6.432 3.231 1.00 0.00 C ATOM 837 C TYR A 55 -10.648 -6.879 2.006 1.00 0.00 C ATOM 838 O TYR A 55 -10.265 -6.647 0.860 1.00 0.00 O ATOM 839 CB TYR A 55 -9.245 -5.030 3.049 1.00 0.00 C ATOM 840 CG TYR A 55 -8.212 -4.612 4.078 1.00 0.00 C ATOM 841 CD1 TYR A 55 -8.588 -4.367 5.413 1.00 0.00 C ATOM 842 CD2 TYR A 55 -6.863 -4.470 3.699 1.00 0.00 C ATOM 843 CE1 TYR A 55 -7.622 -3.998 6.367 1.00 0.00 C ATOM 844 CE2 TYR A 55 -5.897 -4.098 4.646 1.00 0.00 C ATOM 845 CZ TYR A 55 -6.267 -3.864 5.988 1.00 0.00 C ATOM 846 OH TYR A 55 -5.309 -3.544 6.900 1.00 0.00 O ATOM 847 H TYR A 55 -8.061 -7.494 2.813 1.00 0.00 H ATOM 848 HA TYR A 55 -10.529 -6.381 4.080 1.00 0.00 H ATOM 849 HB2 TYR A 55 -8.789 -4.958 2.060 1.00 0.00 H ATOM 850 HB3 TYR A 55 -10.058 -4.318 3.079 1.00 0.00 H ATOM 851 HD1 TYR A 55 -9.616 -4.458 5.731 1.00 0.00 H ATOM 852 HD2 TYR A 55 -6.551 -4.666 2.684 1.00 0.00 H ATOM 853 HE1 TYR A 55 -7.926 -3.817 7.388 1.00 0.00 H ATOM 854 HE2 TYR A 55 -4.868 -3.989 4.345 1.00 0.00 H ATOM 855 HH TYR A 55 -5.671 -3.278 7.765 1.00 0.00 H ATOM 856 N ASN A 56 -11.758 -7.579 2.238 1.00 0.00 N ATOM 857 CA ASN A 56 -12.719 -7.983 1.210 1.00 0.00 C ATOM 858 C ASN A 56 -13.710 -6.870 0.886 1.00 0.00 C ATOM 859 O ASN A 56 -13.718 -5.828 1.542 1.00 0.00 O ATOM 860 CB ASN A 56 -13.475 -9.246 1.668 1.00 0.00 C ATOM 861 CG ASN A 56 -12.947 -10.501 0.997 1.00 0.00 C ATOM 862 OD1 ASN A 56 -13.712 -11.396 0.647 1.00 0.00 O ATOM 863 ND2 ASN A 56 -11.649 -10.618 0.804 1.00 0.00 N ATOM 864 H ASN A 56 -11.994 -7.786 3.202 1.00 0.00 H ATOM 865 HA ASN A 56 -12.184 -8.194 0.281 1.00 0.00 H ATOM 866 HB2 ASN A 56 -13.425 -9.368 2.751 1.00 0.00 H ATOM 867 HB3 ASN A 56 -14.531 -9.151 1.413 1.00 0.00 H ATOM 868 HD21 ASN A 56 -11.030 -9.877 1.098 1.00 0.00 H ATOM 869 HD22 ASN A 56 -11.228 -11.428 0.344 1.00 0.00 H ATOM 870 N GLN A 57 -14.587 -7.122 -0.095 1.00 0.00 N ATOM 871 CA GLN A 57 -15.530 -6.155 -0.642 1.00 0.00 C ATOM 872 C GLN A 57 -16.392 -5.467 0.422 1.00 0.00 C ATOM 873 O GLN A 57 -16.672 -4.273 0.302 1.00 0.00 O ATOM 874 CB GLN A 57 -16.408 -6.801 -1.718 1.00 0.00 C ATOM 875 CG GLN A 57 -15.616 -7.149 -2.982 1.00 0.00 C ATOM 876 CD GLN A 57 -15.398 -5.954 -3.899 1.00 0.00 C ATOM 877 OE1 GLN A 57 -16.340 -5.459 -4.508 1.00 0.00 O ATOM 878 NE2 GLN A 57 -14.166 -5.511 -4.076 1.00 0.00 N ATOM 879 H GLN A 57 -14.552 -8.026 -0.550 1.00 0.00 H ATOM 880 HA GLN A 57 -14.912 -5.414 -1.117 1.00 0.00 H ATOM 881 HB2 GLN A 57 -16.856 -7.711 -1.320 1.00 0.00 H ATOM 882 HB3 GLN A 57 -17.216 -6.117 -1.985 1.00 0.00 H ATOM 883 HG2 GLN A 57 -14.664 -7.610 -2.727 1.00 0.00 H ATOM 884 HG3 GLN A 57 -16.196 -7.877 -3.537 1.00 0.00 H ATOM 885 HE21 GLN A 57 -13.379 -6.053 -3.728 1.00 0.00 H ATOM 886 HE22 GLN A 57 -14.015 -4.816 -4.791 1.00 0.00 H ATOM 887 N PHE A 58 -16.740 -6.192 1.486 1.00 0.00 N ATOM 888 CA PHE A 58 -17.423 -5.682 2.668 1.00 0.00 C ATOM 889 C PHE A 58 -16.777 -4.393 3.204 1.00 0.00 C ATOM 890 O PHE A 58 -17.467 -3.426 3.526 1.00 0.00 O ATOM 891 CB PHE A 58 -17.425 -6.813 3.711 1.00 0.00 C ATOM 892 CG PHE A 58 -18.239 -6.583 4.970 1.00 0.00 C ATOM 893 CD1 PHE A 58 -19.559 -6.100 4.889 1.00 0.00 C ATOM 894 CD2 PHE A 58 -17.712 -6.948 6.225 1.00 0.00 C ATOM 895 CE1 PHE A 58 -20.346 -5.985 6.047 1.00 0.00 C ATOM 896 CE2 PHE A 58 -18.497 -6.828 7.385 1.00 0.00 C ATOM 897 CZ PHE A 58 -19.812 -6.339 7.296 1.00 0.00 C ATOM 898 H PHE A 58 -16.540 -7.185 1.462 1.00 0.00 H ATOM 899 HA PHE A 58 -18.447 -5.452 2.385 1.00 0.00 H ATOM 900 HB2 PHE A 58 -17.823 -7.716 3.241 1.00 0.00 H ATOM 901 HB3 PHE A 58 -16.392 -7.020 3.995 1.00 0.00 H ATOM 902 HD1 PHE A 58 -19.994 -5.835 3.938 1.00 0.00 H ATOM 903 HD2 PHE A 58 -16.708 -7.342 6.309 1.00 0.00 H ATOM 904 HE1 PHE A 58 -21.365 -5.634 5.969 1.00 0.00 H ATOM 905 HE2 PHE A 58 -18.082 -7.114 8.342 1.00 0.00 H ATOM 906 HZ PHE A 58 -20.419 -6.234 8.183 1.00 0.00 H ATOM 907 N HIS A 59 -15.445 -4.350 3.265 1.00 0.00 N ATOM 908 CA HIS A 59 -14.685 -3.192 3.722 1.00 0.00 C ATOM 909 C HIS A 59 -14.348 -2.249 2.564 1.00 0.00 C ATOM 910 O HIS A 59 -14.108 -1.063 2.782 1.00 0.00 O ATOM 911 CB HIS A 59 -13.401 -3.684 4.396 1.00 0.00 C ATOM 912 CG HIS A 59 -13.660 -4.597 5.568 1.00 0.00 C ATOM 913 ND1 HIS A 59 -13.221 -5.892 5.690 1.00 0.00 N ATOM 914 CD2 HIS A 59 -14.400 -4.307 6.685 1.00 0.00 C ATOM 915 CE1 HIS A 59 -13.662 -6.367 6.858 1.00 0.00 C ATOM 916 NE2 HIS A 59 -14.395 -5.444 7.507 1.00 0.00 N ATOM 917 H HIS A 59 -14.911 -5.127 2.901 1.00 0.00 H ATOM 918 HA HIS A 59 -15.273 -2.636 4.456 1.00 0.00 H ATOM 919 HB2 HIS A 59 -12.794 -4.219 3.662 1.00 0.00 H ATOM 920 HB3 HIS A 59 -12.835 -2.819 4.742 1.00 0.00 H ATOM 921 HD1 HIS A 59 -12.664 -6.454 5.056 1.00 0.00 H ATOM 922 HD2 HIS A 59 -14.900 -3.368 6.886 1.00 0.00 H ATOM 923 HE1 HIS A 59 -13.423 -7.365 7.190 1.00 0.00 H ATOM 924 N ILE A 60 -14.324 -2.738 1.322 1.00 0.00 N ATOM 925 CA ILE A 60 -14.072 -1.900 0.151 1.00 0.00 C ATOM 926 C ILE A 60 -15.199 -0.882 0.036 1.00 0.00 C ATOM 927 O ILE A 60 -14.913 0.291 -0.165 1.00 0.00 O ATOM 928 CB ILE A 60 -13.909 -2.770 -1.112 1.00 0.00 C ATOM 929 CG1 ILE A 60 -12.644 -3.659 -1.026 1.00 0.00 C ATOM 930 CG2 ILE A 60 -13.941 -1.991 -2.433 1.00 0.00 C ATOM 931 CD1 ILE A 60 -11.309 -2.919 -1.191 1.00 0.00 C ATOM 932 H ILE A 60 -14.467 -3.731 1.196 1.00 0.00 H ATOM 933 HA ILE A 60 -13.151 -1.340 0.319 1.00 0.00 H ATOM 934 HB ILE A 60 -14.778 -3.414 -1.154 1.00 0.00 H ATOM 935 HG12 ILE A 60 -12.620 -4.166 -0.061 1.00 0.00 H ATOM 936 HG13 ILE A 60 -12.699 -4.428 -1.796 1.00 0.00 H ATOM 937 HG21 ILE A 60 -13.161 -1.235 -2.445 1.00 0.00 H ATOM 938 HG22 ILE A 60 -13.805 -2.688 -3.259 1.00 0.00 H ATOM 939 HG23 ILE A 60 -14.910 -1.506 -2.562 1.00 0.00 H ATOM 940 HD11 ILE A 60 -11.253 -2.078 -0.500 1.00 0.00 H ATOM 941 HD12 ILE A 60 -10.493 -3.607 -0.972 1.00 0.00 H ATOM 942 HD13 ILE A 60 -11.200 -2.557 -2.213 1.00 0.00 H ATOM 943 N ARG A 61 -16.462 -1.286 0.225 1.00 0.00 N ATOM 944 CA ARG A 61 -17.594 -0.355 0.235 1.00 0.00 C ATOM 945 C ARG A 61 -17.398 0.770 1.247 1.00 0.00 C ATOM 946 O ARG A 61 -17.792 1.906 0.981 1.00 0.00 O ATOM 947 CB ARG A 61 -18.887 -1.103 0.571 1.00 0.00 C ATOM 948 CG ARG A 61 -19.442 -1.930 -0.590 1.00 0.00 C ATOM 949 CD ARG A 61 -19.836 -1.081 -1.807 1.00 0.00 C ATOM 950 NE ARG A 61 -20.954 -1.694 -2.539 1.00 0.00 N ATOM 951 CZ ARG A 61 -20.905 -2.769 -3.334 1.00 0.00 C ATOM 952 NH1 ARG A 61 -19.740 -3.329 -3.650 1.00 0.00 N ATOM 953 NH2 ARG A 61 -22.031 -3.282 -3.815 1.00 0.00 N ATOM 954 H ARG A 61 -16.632 -2.277 0.384 1.00 0.00 H ATOM 955 HA ARG A 61 -17.686 0.093 -0.754 1.00 0.00 H ATOM 956 HB2 ARG A 61 -18.723 -1.757 1.429 1.00 0.00 H ATOM 957 HB3 ARG A 61 -19.644 -0.375 0.859 1.00 0.00 H ATOM 958 HG2 ARG A 61 -18.729 -2.702 -0.885 1.00 0.00 H ATOM 959 HG3 ARG A 61 -20.336 -2.414 -0.216 1.00 0.00 H ATOM 960 HD2 ARG A 61 -20.167 -0.098 -1.468 1.00 0.00 H ATOM 961 HD3 ARG A 61 -18.978 -0.945 -2.465 1.00 0.00 H ATOM 962 HE ARG A 61 -21.841 -1.214 -2.393 1.00 0.00 H ATOM 963 HH11 ARG A 61 -18.871 -2.907 -3.365 1.00 0.00 H ATOM 964 HH12 ARG A 61 -19.700 -4.088 -4.332 1.00 0.00 H ATOM 965 HH21 ARG A 61 -22.931 -2.876 -3.563 1.00 0.00 H ATOM 966 HH22 ARG A 61 -22.028 -4.045 -4.478 1.00 0.00 H ATOM 967 N ARG A 62 -16.805 0.461 2.401 1.00 0.00 N ATOM 968 CA ARG A 62 -16.475 1.421 3.438 1.00 0.00 C ATOM 969 C ARG A 62 -15.518 2.471 2.877 1.00 0.00 C ATOM 970 O ARG A 62 -15.817 3.659 2.953 1.00 0.00 O ATOM 971 CB ARG A 62 -15.895 0.657 4.642 1.00 0.00 C ATOM 972 CG ARG A 62 -16.384 1.164 6.007 1.00 0.00 C ATOM 973 CD ARG A 62 -17.177 0.063 6.726 1.00 0.00 C ATOM 974 NE ARG A 62 -17.438 0.381 8.137 1.00 0.00 N ATOM 975 CZ ARG A 62 -17.971 -0.460 9.031 1.00 0.00 C ATOM 976 NH1 ARG A 62 -18.428 -1.643 8.623 1.00 0.00 N ATOM 977 NH2 ARG A 62 -18.035 -0.120 10.316 1.00 0.00 N ATOM 978 H ARG A 62 -16.503 -0.483 2.573 1.00 0.00 H ATOM 979 HA ARG A 62 -17.393 1.928 3.730 1.00 0.00 H ATOM 980 HB2 ARG A 62 -16.137 -0.404 4.554 1.00 0.00 H ATOM 981 HB3 ARG A 62 -14.810 0.722 4.615 1.00 0.00 H ATOM 982 HG2 ARG A 62 -15.513 1.426 6.607 1.00 0.00 H ATOM 983 HG3 ARG A 62 -17.011 2.046 5.881 1.00 0.00 H ATOM 984 HD2 ARG A 62 -18.124 -0.093 6.207 1.00 0.00 H ATOM 985 HD3 ARG A 62 -16.597 -0.862 6.701 1.00 0.00 H ATOM 986 HE ARG A 62 -17.082 1.280 8.467 1.00 0.00 H ATOM 987 HH11 ARG A 62 -18.458 -1.850 7.639 1.00 0.00 H ATOM 988 HH12 ARG A 62 -18.717 -2.388 9.255 1.00 0.00 H ATOM 989 HH21 ARG A 62 -17.737 0.805 10.625 1.00 0.00 H ATOM 990 HH22 ARG A 62 -18.441 -0.719 11.023 1.00 0.00 H ATOM 991 N PHE A 63 -14.412 2.049 2.257 1.00 0.00 N ATOM 992 CA PHE A 63 -13.489 2.983 1.624 1.00 0.00 C ATOM 993 C PHE A 63 -14.140 3.729 0.450 1.00 0.00 C ATOM 994 O PHE A 63 -13.888 4.916 0.279 1.00 0.00 O ATOM 995 CB PHE A 63 -12.212 2.261 1.181 1.00 0.00 C ATOM 996 CG PHE A 63 -11.282 1.763 2.278 1.00 0.00 C ATOM 997 CD1 PHE A 63 -10.914 2.577 3.368 1.00 0.00 C ATOM 998 CD2 PHE A 63 -10.719 0.480 2.170 1.00 0.00 C ATOM 999 CE1 PHE A 63 -10.043 2.094 4.362 1.00 0.00 C ATOM 1000 CE2 PHE A 63 -9.857 -0.007 3.169 1.00 0.00 C ATOM 1001 CZ PHE A 63 -9.531 0.791 4.275 1.00 0.00 C ATOM 1002 H PHE A 63 -14.216 1.057 2.190 1.00 0.00 H ATOM 1003 HA PHE A 63 -13.225 3.729 2.367 1.00 0.00 H ATOM 1004 HB2 PHE A 63 -12.520 1.415 0.571 1.00 0.00 H ATOM 1005 HB3 PHE A 63 -11.637 2.925 0.541 1.00 0.00 H ATOM 1006 HD1 PHE A 63 -11.290 3.580 3.459 1.00 0.00 H ATOM 1007 HD2 PHE A 63 -10.949 -0.130 1.308 1.00 0.00 H ATOM 1008 HE1 PHE A 63 -9.762 2.721 5.198 1.00 0.00 H ATOM 1009 HE2 PHE A 63 -9.422 -0.992 3.087 1.00 0.00 H ATOM 1010 HZ PHE A 63 -8.865 0.416 5.041 1.00 0.00 H ATOM 1011 N GLU A 64 -15.002 3.086 -0.341 1.00 0.00 N ATOM 1012 CA GLU A 64 -15.732 3.746 -1.422 1.00 0.00 C ATOM 1013 C GLU A 64 -16.569 4.901 -0.878 1.00 0.00 C ATOM 1014 O GLU A 64 -16.606 5.953 -1.500 1.00 0.00 O ATOM 1015 CB GLU A 64 -16.649 2.784 -2.194 1.00 0.00 C ATOM 1016 CG GLU A 64 -15.894 1.787 -3.081 1.00 0.00 C ATOM 1017 CD GLU A 64 -16.756 1.075 -4.122 1.00 0.00 C ATOM 1018 OE1 GLU A 64 -17.662 1.722 -4.693 1.00 0.00 O ATOM 1019 OE2 GLU A 64 -16.492 -0.123 -4.384 1.00 0.00 O ATOM 1020 H GLU A 64 -15.107 2.092 -0.210 1.00 0.00 H ATOM 1021 HA GLU A 64 -15.007 4.172 -2.117 1.00 0.00 H ATOM 1022 HB2 GLU A 64 -17.291 2.249 -1.499 1.00 0.00 H ATOM 1023 HB3 GLU A 64 -17.286 3.399 -2.828 1.00 0.00 H ATOM 1024 HG2 GLU A 64 -15.104 2.315 -3.607 1.00 0.00 H ATOM 1025 HG3 GLU A 64 -15.445 1.036 -2.441 1.00 0.00 H ATOM 1026 N ALA A 65 -17.199 4.757 0.291 1.00 0.00 N ATOM 1027 CA ALA A 65 -18.001 5.827 0.878 1.00 0.00 C ATOM 1028 C ALA A 65 -17.174 7.108 1.061 1.00 0.00 C ATOM 1029 O ALA A 65 -17.684 8.216 0.886 1.00 0.00 O ATOM 1030 CB ALA A 65 -18.571 5.340 2.207 1.00 0.00 C ATOM 1031 H ALA A 65 -17.109 3.882 0.795 1.00 0.00 H ATOM 1032 HA ALA A 65 -18.835 6.046 0.208 1.00 0.00 H ATOM 1033 HB1 ALA A 65 -19.016 4.360 2.070 1.00 0.00 H ATOM 1034 HB2 ALA A 65 -17.789 5.283 2.961 1.00 0.00 H ATOM 1035 HB3 ALA A 65 -19.338 6.029 2.544 1.00 0.00 H ATOM 1036 N LEU A 66 -15.879 6.959 1.355 1.00 0.00 N ATOM 1037 CA LEU A 66 -14.926 8.055 1.444 1.00 0.00 C ATOM 1038 C LEU A 66 -14.831 8.749 0.095 1.00 0.00 C ATOM 1039 O LEU A 66 -15.166 9.928 0.001 1.00 0.00 O ATOM 1040 CB LEU A 66 -13.536 7.571 1.879 1.00 0.00 C ATOM 1041 CG LEU A 66 -13.536 6.720 3.151 1.00 0.00 C ATOM 1042 CD1 LEU A 66 -12.137 6.145 3.305 1.00 0.00 C ATOM 1043 CD2 LEU A 66 -13.905 7.562 4.379 1.00 0.00 C ATOM 1044 H LEU A 66 -15.524 6.014 1.427 1.00 0.00 H ATOM 1045 HA LEU A 66 -15.296 8.766 2.180 1.00 0.00 H ATOM 1046 HB2 LEU A 66 -13.074 7.011 1.071 1.00 0.00 H ATOM 1047 HB3 LEU A 66 -12.897 8.433 2.034 1.00 0.00 H ATOM 1048 HG LEU A 66 -14.229 5.882 3.038 1.00 0.00 H ATOM 1049 HD11 LEU A 66 -12.070 5.590 4.241 1.00 0.00 H ATOM 1050 HD12 LEU A 66 -11.934 5.479 2.472 1.00 0.00 H ATOM 1051 HD13 LEU A 66 -11.403 6.949 3.284 1.00 0.00 H ATOM 1052 HD21 LEU A 66 -13.225 8.407 4.484 1.00 0.00 H ATOM 1053 HD22 LEU A 66 -14.931 7.917 4.298 1.00 0.00 H ATOM 1054 HD23 LEU A 66 -13.831 6.947 5.273 1.00 0.00 H ATOM 1055 N LEU A 67 -14.411 8.024 -0.949 1.00 0.00 N ATOM 1056 CA LEU A 67 -14.181 8.585 -2.277 1.00 0.00 C ATOM 1057 C LEU A 67 -15.461 9.188 -2.839 1.00 0.00 C ATOM 1058 O LEU A 67 -15.418 10.217 -3.503 1.00 0.00 O ATOM 1059 CB LEU A 67 -13.538 7.533 -3.203 1.00 0.00 C ATOM 1060 CG LEU A 67 -14.428 6.608 -4.065 1.00 0.00 C ATOM 1061 CD1 LEU A 67 -14.954 7.257 -5.352 1.00 0.00 C ATOM 1062 CD2 LEU A 67 -13.608 5.380 -4.473 1.00 0.00 C ATOM 1063 H LEU A 67 -14.202 7.046 -0.796 1.00 0.00 H ATOM 1064 HA LEU A 67 -13.461 9.397 -2.152 1.00 0.00 H ATOM 1065 HB2 LEU A 67 -12.844 8.054 -3.859 1.00 0.00 H ATOM 1066 HB3 LEU A 67 -12.939 6.895 -2.564 1.00 0.00 H ATOM 1067 HG LEU A 67 -15.264 6.247 -3.477 1.00 0.00 H ATOM 1068 HD11 LEU A 67 -14.133 7.719 -5.900 1.00 0.00 H ATOM 1069 HD12 LEU A 67 -15.411 6.503 -5.989 1.00 0.00 H ATOM 1070 HD13 LEU A 67 -15.702 8.016 -5.142 1.00 0.00 H ATOM 1071 HD21 LEU A 67 -12.758 5.681 -5.089 1.00 0.00 H ATOM 1072 HD22 LEU A 67 -13.247 4.877 -3.576 1.00 0.00 H ATOM 1073 HD23 LEU A 67 -14.234 4.684 -5.032 1.00 0.00 H ATOM 1074 N GLN A 68 -16.608 8.583 -2.536 1.00 0.00 N ATOM 1075 CA GLN A 68 -17.927 9.029 -2.946 1.00 0.00 C ATOM 1076 C GLN A 68 -18.346 10.346 -2.279 1.00 0.00 C ATOM 1077 O GLN A 68 -19.344 10.932 -2.703 1.00 0.00 O ATOM 1078 CB GLN A 68 -18.933 7.915 -2.619 1.00 0.00 C ATOM 1079 CG GLN A 68 -18.807 6.706 -3.563 1.00 0.00 C ATOM 1080 CD GLN A 68 -19.311 7.020 -4.965 1.00 0.00 C ATOM 1081 OE1 GLN A 68 -20.394 7.580 -5.130 1.00 0.00 O ATOM 1082 NE2 GLN A 68 -18.564 6.661 -5.996 1.00 0.00 N ATOM 1083 H GLN A 68 -16.551 7.734 -1.980 1.00 0.00 H ATOM 1084 HA GLN A 68 -17.915 9.202 -4.024 1.00 0.00 H ATOM 1085 HB2 GLN A 68 -18.790 7.587 -1.589 1.00 0.00 H ATOM 1086 HB3 GLN A 68 -19.942 8.309 -2.696 1.00 0.00 H ATOM 1087 HG2 GLN A 68 -17.770 6.379 -3.619 1.00 0.00 H ATOM 1088 HG3 GLN A 68 -19.400 5.885 -3.160 1.00 0.00 H ATOM 1089 HE21 GLN A 68 -17.673 6.208 -5.856 1.00 0.00 H ATOM 1090 HE22 GLN A 68 -18.890 6.819 -6.946 1.00 0.00 H ATOM 1091 N THR A 69 -17.617 10.844 -1.279 1.00 0.00 N ATOM 1092 CA THR A 69 -17.971 12.060 -0.546 1.00 0.00 C ATOM 1093 C THR A 69 -16.827 13.080 -0.509 1.00 0.00 C ATOM 1094 O THR A 69 -17.091 14.284 -0.463 1.00 0.00 O ATOM 1095 CB THR A 69 -18.497 11.672 0.846 1.00 0.00 C ATOM 1096 OG1 THR A 69 -17.599 10.811 1.519 1.00 0.00 O ATOM 1097 CG2 THR A 69 -19.832 10.934 0.763 1.00 0.00 C ATOM 1098 H THR A 69 -16.801 10.331 -0.968 1.00 0.00 H ATOM 1099 HA THR A 69 -18.779 12.568 -1.064 1.00 0.00 H ATOM 1100 HB THR A 69 -18.624 12.571 1.446 1.00 0.00 H ATOM 1101 HG1 THR A 69 -17.639 9.935 1.077 1.00 0.00 H ATOM 1102 HG21 THR A 69 -19.699 9.980 0.255 1.00 0.00 H ATOM 1103 HG22 THR A 69 -20.217 10.759 1.765 1.00 0.00 H ATOM 1104 HG23 THR A 69 -20.552 11.538 0.211 1.00 0.00 H ATOM 1105 N GLY A 70 -15.574 12.627 -0.599 1.00 0.00 N ATOM 1106 CA GLY A 70 -14.396 13.464 -0.793 1.00 0.00 C ATOM 1107 C GLY A 70 -13.215 13.137 0.118 1.00 0.00 C ATOM 1108 O GLY A 70 -12.177 13.787 0.006 1.00 0.00 O ATOM 1109 H GLY A 70 -15.437 11.621 -0.619 1.00 0.00 H ATOM 1110 HA2 GLY A 70 -14.070 13.364 -1.829 1.00 0.00 H ATOM 1111 HA3 GLY A 70 -14.649 14.507 -0.622 1.00 0.00 H ATOM 1112 N LYS A 71 -13.321 12.194 1.058 1.00 0.00 N ATOM 1113 CA LYS A 71 -12.158 11.685 1.768 1.00 0.00 C ATOM 1114 C LYS A 71 -11.401 10.742 0.839 1.00 0.00 C ATOM 1115 O LYS A 71 -12.034 9.959 0.132 1.00 0.00 O ATOM 1116 CB LYS A 71 -12.667 10.963 3.015 1.00 0.00 C ATOM 1117 CG LYS A 71 -12.908 11.952 4.168 1.00 0.00 C ATOM 1118 CD LYS A 71 -11.628 12.145 4.981 1.00 0.00 C ATOM 1119 CE LYS A 71 -11.374 10.873 5.794 1.00 0.00 C ATOM 1120 NZ LYS A 71 -11.873 10.982 7.179 1.00 0.00 N ATOM 1121 H LYS A 71 -14.161 11.648 1.199 1.00 0.00 H ATOM 1122 HA LYS A 71 -11.499 12.507 2.049 1.00 0.00 H ATOM 1123 HB2 LYS A 71 -13.609 10.464 2.783 1.00 0.00 H ATOM 1124 HB3 LYS A 71 -11.943 10.199 3.300 1.00 0.00 H ATOM 1125 HG2 LYS A 71 -13.241 12.916 3.780 1.00 0.00 H ATOM 1126 HG3 LYS A 71 -13.689 11.560 4.819 1.00 0.00 H ATOM 1127 HD2 LYS A 71 -10.789 12.312 4.305 1.00 0.00 H ATOM 1128 HD3 LYS A 71 -11.729 13.013 5.630 1.00 0.00 H ATOM 1129 HE2 LYS A 71 -11.870 10.047 5.274 1.00 0.00 H ATOM 1130 HE3 LYS A 71 -10.303 10.684 5.811 1.00 0.00 H ATOM 1131 HZ1 LYS A 71 -11.579 11.859 7.598 1.00 0.00 H ATOM 1132 HZ2 LYS A 71 -12.887 10.965 7.220 1.00 0.00 H ATOM 1133 HZ3 LYS A 71 -11.504 10.240 7.769 1.00 0.00 H ATOM 1134 N SER A 72 -10.068 10.774 0.854 1.00 0.00 N ATOM 1135 CA SER A 72 -9.309 9.812 0.074 1.00 0.00 C ATOM 1136 C SER A 72 -9.453 8.438 0.724 1.00 0.00 C ATOM 1137 O SER A 72 -9.155 8.302 1.916 1.00 0.00 O ATOM 1138 CB SER A 72 -7.824 10.163 -0.023 1.00 0.00 C ATOM 1139 OG SER A 72 -7.250 9.415 -1.087 1.00 0.00 O ATOM 1140 H SER A 72 -9.577 11.429 1.451 1.00 0.00 H ATOM 1141 HA SER A 72 -9.731 9.810 -0.931 1.00 0.00 H ATOM 1142 HB2 SER A 72 -7.688 11.226 -0.189 1.00 0.00 H ATOM 1143 HB3 SER A 72 -7.324 9.911 0.911 1.00 0.00 H ATOM 1144 HG SER A 72 -7.724 9.643 -1.921 1.00 0.00 H ATOM 1145 N PRO A 73 -9.804 7.402 -0.049 1.00 0.00 N ATOM 1146 CA PRO A 73 -9.679 6.033 0.401 1.00 0.00 C ATOM 1147 C PRO A 73 -8.210 5.630 0.526 1.00 0.00 C ATOM 1148 O PRO A 73 -7.920 4.767 1.345 1.00 0.00 O ATOM 1149 CB PRO A 73 -10.408 5.205 -0.655 1.00 0.00 C ATOM 1150 CG PRO A 73 -10.179 6.012 -1.930 1.00 0.00 C ATOM 1151 CD PRO A 73 -10.217 7.450 -1.441 1.00 0.00 C ATOM 1152 HA PRO A 73 -10.146 5.905 1.379 1.00 0.00 H ATOM 1153 HB2 PRO A 73 -10.007 4.197 -0.726 1.00 0.00 H ATOM 1154 HB3 PRO A 73 -11.472 5.180 -0.430 1.00 0.00 H ATOM 1155 HG2 PRO A 73 -9.189 5.798 -2.333 1.00 0.00 H ATOM 1156 HG3 PRO A 73 -10.941 5.839 -2.681 1.00 0.00 H ATOM 1157 HD2 PRO A 73 -9.532 8.041 -2.042 1.00 0.00 H ATOM 1158 HD3 PRO A 73 -11.228 7.853 -1.501 1.00 0.00 H ATOM 1159 N THR A 74 -7.284 6.251 -0.221 1.00 0.00 N ATOM 1160 CA THR A 74 -5.866 5.958 -0.096 1.00 0.00 C ATOM 1161 C THR A 74 -5.426 6.215 1.332 1.00 0.00 C ATOM 1162 O THR A 74 -4.818 5.339 1.938 1.00 0.00 O ATOM 1163 CB THR A 74 -5.023 6.822 -1.041 1.00 0.00 C ATOM 1164 OG1 THR A 74 -5.425 6.592 -2.366 1.00 0.00 O ATOM 1165 CG2 THR A 74 -3.526 6.505 -0.887 1.00 0.00 C ATOM 1166 H THR A 74 -7.550 6.973 -0.874 1.00 0.00 H ATOM 1167 HA THR A 74 -5.714 4.903 -0.330 1.00 0.00 H ATOM 1168 HB THR A 74 -5.180 7.875 -0.813 1.00 0.00 H ATOM 1169 HG1 THR A 74 -6.166 7.167 -2.573 1.00 0.00 H ATOM 1170 HG21 THR A 74 -2.934 7.076 -1.590 1.00 0.00 H ATOM 1171 HG22 THR A 74 -3.181 6.773 0.110 1.00 0.00 H ATOM 1172 HG23 THR A 74 -3.340 5.450 -1.065 1.00 0.00 H ATOM 1173 N CYS A 75 -5.679 7.429 1.829 1.00 0.00 N ATOM 1174 CA CYS A 75 -5.175 7.863 3.114 1.00 0.00 C ATOM 1175 C CYS A 75 -5.717 6.956 4.207 1.00 0.00 C ATOM 1176 O CYS A 75 -4.925 6.384 4.947 1.00 0.00 O ATOM 1177 CB CYS A 75 -5.530 9.338 3.328 1.00 0.00 C ATOM 1178 SG CYS A 75 -4.965 9.840 4.979 1.00 0.00 S ATOM 1179 H CYS A 75 -6.195 8.086 1.263 1.00 0.00 H ATOM 1180 HA CYS A 75 -4.089 7.747 3.111 1.00 0.00 H ATOM 1181 HB2 CYS A 75 -5.013 9.938 2.582 1.00 0.00 H ATOM 1182 HB3 CYS A 75 -6.605 9.511 3.222 1.00 0.00 H ATOM 1183 HG CYS A 75 -5.948 9.253 5.689 1.00 0.00 H ATOM 1184 N GLU A 76 -7.039 6.798 4.278 1.00 0.00 N ATOM 1185 CA GLU A 76 -7.677 5.955 5.280 1.00 0.00 C ATOM 1186 C GLU A 76 -7.144 4.528 5.225 1.00 0.00 C ATOM 1187 O GLU A 76 -6.801 3.978 6.268 1.00 0.00 O ATOM 1188 CB GLU A 76 -9.192 5.962 5.065 1.00 0.00 C ATOM 1189 CG GLU A 76 -9.858 7.152 5.762 1.00 0.00 C ATOM 1190 CD GLU A 76 -9.928 6.980 7.279 1.00 0.00 C ATOM 1191 OE1 GLU A 76 -10.807 6.209 7.750 1.00 0.00 O ATOM 1192 OE2 GLU A 76 -9.198 7.701 7.986 1.00 0.00 O ATOM 1193 H GLU A 76 -7.638 7.272 3.616 1.00 0.00 H ATOM 1194 HA GLU A 76 -7.436 6.349 6.267 1.00 0.00 H ATOM 1195 HB2 GLU A 76 -9.388 6.011 3.993 1.00 0.00 H ATOM 1196 HB3 GLU A 76 -9.618 5.029 5.430 1.00 0.00 H ATOM 1197 HG2 GLU A 76 -9.320 8.065 5.496 1.00 0.00 H ATOM 1198 HG3 GLU A 76 -10.877 7.266 5.406 1.00 0.00 H ATOM 1199 N LEU A 77 -7.060 3.937 4.030 1.00 0.00 N ATOM 1200 CA LEU A 77 -6.533 2.589 3.869 1.00 0.00 C ATOM 1201 C LEU A 77 -5.106 2.515 4.394 1.00 0.00 C ATOM 1202 O LEU A 77 -4.802 1.635 5.193 1.00 0.00 O ATOM 1203 CB LEU A 77 -6.599 2.156 2.394 1.00 0.00 C ATOM 1204 CG LEU A 77 -5.800 0.883 2.051 1.00 0.00 C ATOM 1205 CD1 LEU A 77 -6.253 -0.389 2.768 1.00 0.00 C ATOM 1206 CD2 LEU A 77 -5.931 0.634 0.553 1.00 0.00 C ATOM 1207 H LEU A 77 -7.370 4.445 3.207 1.00 0.00 H ATOM 1208 HA LEU A 77 -7.152 1.927 4.472 1.00 0.00 H ATOM 1209 HB2 LEU A 77 -7.646 2.022 2.113 1.00 0.00 H ATOM 1210 HB3 LEU A 77 -6.186 2.962 1.787 1.00 0.00 H ATOM 1211 HG LEU A 77 -4.744 1.047 2.261 1.00 0.00 H ATOM 1212 HD11 LEU A 77 -6.208 -0.259 3.849 1.00 0.00 H ATOM 1213 HD12 LEU A 77 -7.268 -0.638 2.471 1.00 0.00 H ATOM 1214 HD13 LEU A 77 -5.595 -1.214 2.491 1.00 0.00 H ATOM 1215 HD21 LEU A 77 -5.349 -0.244 0.286 1.00 0.00 H ATOM 1216 HD22 LEU A 77 -6.974 0.486 0.286 1.00 0.00 H ATOM 1217 HD23 LEU A 77 -5.568 1.485 -0.006 1.00 0.00 H ATOM 1218 N LEU A 78 -4.226 3.404 3.926 1.00 0.00 N ATOM 1219 CA LEU A 78 -2.815 3.355 4.273 1.00 0.00 C ATOM 1220 C LEU A 78 -2.640 3.525 5.788 1.00 0.00 C ATOM 1221 O LEU A 78 -1.800 2.876 6.407 1.00 0.00 O ATOM 1222 CB LEU A 78 -2.033 4.477 3.556 1.00 0.00 C ATOM 1223 CG LEU A 78 -1.707 4.247 2.071 1.00 0.00 C ATOM 1224 CD1 LEU A 78 -0.821 5.381 1.548 1.00 0.00 C ATOM 1225 CD2 LEU A 78 -1.037 2.904 1.763 1.00 0.00 C ATOM 1226 H LEU A 78 -4.559 4.143 3.317 1.00 0.00 H ATOM 1227 HA LEU A 78 -2.468 2.368 3.960 1.00 0.00 H ATOM 1228 HB2 LEU A 78 -2.598 5.405 3.650 1.00 0.00 H ATOM 1229 HB3 LEU A 78 -1.099 4.641 4.083 1.00 0.00 H ATOM 1230 HG LEU A 78 -2.633 4.290 1.521 1.00 0.00 H ATOM 1231 HD11 LEU A 78 -0.644 5.242 0.481 1.00 0.00 H ATOM 1232 HD12 LEU A 78 -1.330 6.333 1.692 1.00 0.00 H ATOM 1233 HD13 LEU A 78 0.136 5.391 2.070 1.00 0.00 H ATOM 1234 HD21 LEU A 78 -1.725 2.082 1.962 1.00 0.00 H ATOM 1235 HD22 LEU A 78 -0.776 2.858 0.705 1.00 0.00 H ATOM 1236 HD23 LEU A 78 -0.137 2.781 2.360 1.00 0.00 H ATOM 1237 N PHE A 79 -3.405 4.449 6.367 1.00 0.00 N ATOM 1238 CA PHE A 79 -3.398 4.799 7.775 1.00 0.00 C ATOM 1239 C PHE A 79 -3.837 3.604 8.622 1.00 0.00 C ATOM 1240 O PHE A 79 -3.134 3.226 9.563 1.00 0.00 O ATOM 1241 CB PHE A 79 -4.330 6.004 7.964 1.00 0.00 C ATOM 1242 CG PHE A 79 -4.447 6.491 9.386 1.00 0.00 C ATOM 1243 CD1 PHE A 79 -3.419 7.268 9.952 1.00 0.00 C ATOM 1244 CD2 PHE A 79 -5.603 6.192 10.132 1.00 0.00 C ATOM 1245 CE1 PHE A 79 -3.550 7.743 11.267 1.00 0.00 C ATOM 1246 CE2 PHE A 79 -5.725 6.660 11.449 1.00 0.00 C ATOM 1247 CZ PHE A 79 -4.695 7.430 12.013 1.00 0.00 C ATOM 1248 H PHE A 79 -4.080 4.937 5.786 1.00 0.00 H ATOM 1249 HA PHE A 79 -2.387 5.079 8.068 1.00 0.00 H ATOM 1250 HB2 PHE A 79 -3.979 6.831 7.347 1.00 0.00 H ATOM 1251 HB3 PHE A 79 -5.325 5.747 7.603 1.00 0.00 H ATOM 1252 HD1 PHE A 79 -2.533 7.508 9.382 1.00 0.00 H ATOM 1253 HD2 PHE A 79 -6.399 5.596 9.703 1.00 0.00 H ATOM 1254 HE1 PHE A 79 -2.777 8.341 11.725 1.00 0.00 H ATOM 1255 HE2 PHE A 79 -6.605 6.412 12.029 1.00 0.00 H ATOM 1256 HZ PHE A 79 -4.764 7.779 13.027 1.00 0.00 H ATOM 1257 N ASP A 80 -4.983 3.012 8.279 1.00 0.00 N ATOM 1258 CA ASP A 80 -5.569 1.867 8.966 1.00 0.00 C ATOM 1259 C ASP A 80 -4.622 0.675 8.883 1.00 0.00 C ATOM 1260 O ASP A 80 -4.269 0.082 9.897 1.00 0.00 O ATOM 1261 CB ASP A 80 -6.926 1.532 8.337 1.00 0.00 C ATOM 1262 CG ASP A 80 -7.667 0.452 9.119 1.00 0.00 C ATOM 1263 OD1 ASP A 80 -7.325 -0.750 9.033 1.00 0.00 O ATOM 1264 OD2 ASP A 80 -8.657 0.792 9.805 1.00 0.00 O ATOM 1265 H ASP A 80 -5.502 3.386 7.487 1.00 0.00 H ATOM 1266 HA ASP A 80 -5.724 2.125 10.013 1.00 0.00 H ATOM 1267 HB2 ASP A 80 -7.541 2.433 8.327 1.00 0.00 H ATOM 1268 HB3 ASP A 80 -6.792 1.204 7.306 1.00 0.00 H ATOM 1269 N TRP A 81 -4.132 0.369 7.683 1.00 0.00 N ATOM 1270 CA TRP A 81 -3.216 -0.729 7.414 1.00 0.00 C ATOM 1271 C TRP A 81 -1.925 -0.622 8.237 1.00 0.00 C ATOM 1272 O TRP A 81 -1.340 -1.634 8.631 1.00 0.00 O ATOM 1273 CB TRP A 81 -2.937 -0.719 5.913 1.00 0.00 C ATOM 1274 CG TRP A 81 -2.049 -1.782 5.385 1.00 0.00 C ATOM 1275 CD1 TRP A 81 -2.041 -3.093 5.709 1.00 0.00 C ATOM 1276 CD2 TRP A 81 -1.017 -1.601 4.392 1.00 0.00 C ATOM 1277 NE1 TRP A 81 -1.031 -3.725 5.009 1.00 0.00 N ATOM 1278 CE2 TRP A 81 -0.348 -2.839 4.210 1.00 0.00 C ATOM 1279 CE3 TRP A 81 -0.584 -0.496 3.637 1.00 0.00 C ATOM 1280 CZ2 TRP A 81 0.762 -2.958 3.375 1.00 0.00 C ATOM 1281 CZ3 TRP A 81 0.510 -0.615 2.772 1.00 0.00 C ATOM 1282 CH2 TRP A 81 1.195 -1.836 2.671 1.00 0.00 C ATOM 1283 H TRP A 81 -4.460 0.910 6.887 1.00 0.00 H ATOM 1284 HA TRP A 81 -3.718 -1.658 7.673 1.00 0.00 H ATOM 1285 HB2 TRP A 81 -3.883 -0.782 5.374 1.00 0.00 H ATOM 1286 HB3 TRP A 81 -2.447 0.228 5.664 1.00 0.00 H ATOM 1287 HD1 TRP A 81 -2.720 -3.559 6.406 1.00 0.00 H ATOM 1288 HE1 TRP A 81 -0.772 -4.708 5.073 1.00 0.00 H ATOM 1289 HE3 TRP A 81 -1.088 0.449 3.748 1.00 0.00 H ATOM 1290 HZ2 TRP A 81 1.285 -3.894 3.264 1.00 0.00 H ATOM 1291 HZ3 TRP A 81 0.835 0.249 2.224 1.00 0.00 H ATOM 1292 HH2 TRP A 81 2.062 -1.959 2.062 1.00 0.00 H ATOM 1293 N GLY A 82 -1.513 0.597 8.590 1.00 0.00 N ATOM 1294 CA GLY A 82 -0.461 0.842 9.558 1.00 0.00 C ATOM 1295 C GLY A 82 -0.683 0.053 10.858 1.00 0.00 C ATOM 1296 O GLY A 82 0.258 -0.580 11.344 1.00 0.00 O ATOM 1297 H GLY A 82 -2.035 1.384 8.225 1.00 0.00 H ATOM 1298 HA2 GLY A 82 0.491 0.558 9.109 1.00 0.00 H ATOM 1299 HA3 GLY A 82 -0.441 1.907 9.775 1.00 0.00 H ATOM 1300 N THR A 83 -1.898 0.054 11.418 1.00 0.00 N ATOM 1301 CA THR A 83 -2.230 -0.657 12.654 1.00 0.00 C ATOM 1302 C THR A 83 -2.203 -2.176 12.455 1.00 0.00 C ATOM 1303 O THR A 83 -1.951 -2.919 13.408 1.00 0.00 O ATOM 1304 CB THR A 83 -3.580 -0.144 13.215 1.00 0.00 C ATOM 1305 OG1 THR A 83 -3.510 -0.049 14.626 1.00 0.00 O ATOM 1306 CG2 THR A 83 -4.806 -0.996 12.899 1.00 0.00 C ATOM 1307 H THR A 83 -2.666 0.522 10.940 1.00 0.00 H ATOM 1308 HA THR A 83 -1.451 -0.421 13.377 1.00 0.00 H ATOM 1309 HB THR A 83 -3.763 0.858 12.829 1.00 0.00 H ATOM 1310 HG1 THR A 83 -2.887 0.691 14.794 1.00 0.00 H ATOM 1311 HG21 THR A 83 -4.919 -1.109 11.825 1.00 0.00 H ATOM 1312 HG22 THR A 83 -4.703 -1.985 13.340 1.00 0.00 H ATOM 1313 HG23 THR A 83 -5.698 -0.511 13.295 1.00 0.00 H ATOM 1314 N THR A 84 -2.421 -2.660 11.228 1.00 0.00 N ATOM 1315 CA THR A 84 -2.307 -4.074 10.910 1.00 0.00 C ATOM 1316 C THR A 84 -0.861 -4.546 11.135 1.00 0.00 C ATOM 1317 O THR A 84 -0.676 -5.684 11.571 1.00 0.00 O ATOM 1318 CB THR A 84 -2.864 -4.308 9.487 1.00 0.00 C ATOM 1319 OG1 THR A 84 -4.154 -4.879 9.590 1.00 0.00 O ATOM 1320 CG2 THR A 84 -1.993 -5.168 8.574 1.00 0.00 C ATOM 1321 H THR A 84 -2.608 -2.022 10.463 1.00 0.00 H ATOM 1322 HA THR A 84 -2.927 -4.624 11.620 1.00 0.00 H ATOM 1323 HB THR A 84 -2.992 -3.353 8.984 1.00 0.00 H ATOM 1324 HG1 THR A 84 -4.792 -4.132 9.523 1.00 0.00 H ATOM 1325 HG21 THR A 84 -1.071 -4.633 8.341 1.00 0.00 H ATOM 1326 HG22 THR A 84 -1.742 -6.112 9.052 1.00 0.00 H ATOM 1327 HG23 THR A 84 -2.521 -5.359 7.642 1.00 0.00 H ATOM 1328 N ASN A 85 0.125 -3.656 10.954 1.00 0.00 N ATOM 1329 CA ASN A 85 1.576 -3.788 11.131 1.00 0.00 C ATOM 1330 C ASN A 85 2.169 -4.096 9.763 1.00 0.00 C ATOM 1331 O ASN A 85 2.604 -5.228 9.505 1.00 0.00 O ATOM 1332 CB ASN A 85 2.064 -4.810 12.183 1.00 0.00 C ATOM 1333 CG ASN A 85 1.693 -4.465 13.614 1.00 0.00 C ATOM 1334 OD1 ASN A 85 2.480 -3.872 14.346 1.00 0.00 O ATOM 1335 ND2 ASN A 85 0.501 -4.820 14.052 1.00 0.00 N ATOM 1336 H ASN A 85 -0.168 -2.749 10.608 1.00 0.00 H ATOM 1337 HA ASN A 85 1.968 -2.819 11.442 1.00 0.00 H ATOM 1338 HB2 ASN A 85 1.731 -5.816 11.932 1.00 0.00 H ATOM 1339 HB3 ASN A 85 3.152 -4.829 12.133 1.00 0.00 H ATOM 1340 HD21 ASN A 85 -0.122 -5.268 13.388 1.00 0.00 H ATOM 1341 HD22 ASN A 85 0.193 -4.554 14.974 1.00 0.00 H ATOM 1342 N CYS A 86 2.211 -3.085 8.891 1.00 0.00 N ATOM 1343 CA CYS A 86 2.937 -3.131 7.628 1.00 0.00 C ATOM 1344 C CYS A 86 3.761 -1.859 7.430 1.00 0.00 C ATOM 1345 O CYS A 86 3.621 -0.894 8.191 1.00 0.00 O ATOM 1346 CB CYS A 86 1.962 -3.416 6.484 1.00 0.00 C ATOM 1347 SG CYS A 86 1.315 -5.106 6.675 1.00 0.00 S ATOM 1348 H CYS A 86 1.885 -2.169 9.163 1.00 0.00 H ATOM 1349 HA CYS A 86 3.662 -3.937 7.664 1.00 0.00 H ATOM 1350 HB2 CYS A 86 1.143 -2.696 6.497 1.00 0.00 H ATOM 1351 HB3 CYS A 86 2.479 -3.341 5.528 1.00 0.00 H ATOM 1352 HG CYS A 86 1.744 -5.572 5.484 1.00 0.00 H ATOM 1353 N THR A 87 4.652 -1.876 6.438 1.00 0.00 N ATOM 1354 CA THR A 87 5.696 -0.877 6.251 1.00 0.00 C ATOM 1355 C THR A 87 5.734 -0.317 4.829 1.00 0.00 C ATOM 1356 O THR A 87 5.083 -0.821 3.918 1.00 0.00 O ATOM 1357 CB THR A 87 7.052 -1.507 6.627 1.00 0.00 C ATOM 1358 OG1 THR A 87 7.217 -2.699 5.886 1.00 0.00 O ATOM 1359 CG2 THR A 87 7.164 -1.840 8.113 1.00 0.00 C ATOM 1360 H THR A 87 4.748 -2.682 5.835 1.00 0.00 H ATOM 1361 HA THR A 87 5.477 -0.033 6.900 1.00 0.00 H ATOM 1362 HB THR A 87 7.853 -0.813 6.381 1.00 0.00 H ATOM 1363 HG1 THR A 87 8.041 -3.138 6.163 1.00 0.00 H ATOM 1364 HG21 THR A 87 8.149 -2.256 8.318 1.00 0.00 H ATOM 1365 HG22 THR A 87 7.046 -0.933 8.702 1.00 0.00 H ATOM 1366 HG23 THR A 87 6.403 -2.564 8.399 1.00 0.00 H ATOM 1367 N VAL A 88 6.539 0.721 4.629 1.00 0.00 N ATOM 1368 CA VAL A 88 6.820 1.324 3.337 1.00 0.00 C ATOM 1369 C VAL A 88 7.233 0.254 2.321 1.00 0.00 C ATOM 1370 O VAL A 88 6.828 0.333 1.166 1.00 0.00 O ATOM 1371 CB VAL A 88 8.003 2.290 3.533 1.00 0.00 C ATOM 1372 CG1 VAL A 88 8.693 2.729 2.232 1.00 0.00 C ATOM 1373 CG2 VAL A 88 7.590 3.543 4.293 1.00 0.00 C ATOM 1374 H VAL A 88 7.042 1.089 5.431 1.00 0.00 H ATOM 1375 HA VAL A 88 5.910 1.851 3.009 1.00 0.00 H ATOM 1376 HB VAL A 88 8.736 1.774 4.147 1.00 0.00 H ATOM 1377 HG11 VAL A 88 9.561 3.332 2.474 1.00 0.00 H ATOM 1378 HG12 VAL A 88 9.071 1.875 1.670 1.00 0.00 H ATOM 1379 HG13 VAL A 88 8.002 3.285 1.604 1.00 0.00 H ATOM 1380 HG21 VAL A 88 7.069 3.287 5.214 1.00 0.00 H ATOM 1381 HG22 VAL A 88 8.483 4.112 4.550 1.00 0.00 H ATOM 1382 HG23 VAL A 88 6.945 4.144 3.659 1.00 0.00 H ATOM 1383 N GLY A 89 8.096 -0.684 2.720 1.00 0.00 N ATOM 1384 CA GLY A 89 8.634 -1.696 1.832 1.00 0.00 C ATOM 1385 C GLY A 89 7.532 -2.674 1.476 1.00 0.00 C ATOM 1386 O GLY A 89 7.413 -3.013 0.308 1.00 0.00 O ATOM 1387 H GLY A 89 8.414 -0.720 3.680 1.00 0.00 H ATOM 1388 HA2 GLY A 89 9.005 -1.226 0.921 1.00 0.00 H ATOM 1389 HA3 GLY A 89 9.462 -2.220 2.309 1.00 0.00 H ATOM 1390 N ASP A 90 6.686 -3.029 2.453 1.00 0.00 N ATOM 1391 CA ASP A 90 5.455 -3.802 2.259 1.00 0.00 C ATOM 1392 C ASP A 90 4.616 -3.141 1.159 1.00 0.00 C ATOM 1393 O ASP A 90 4.171 -3.805 0.225 1.00 0.00 O ATOM 1394 CB ASP A 90 4.668 -3.857 3.586 1.00 0.00 C ATOM 1395 CG ASP A 90 3.912 -5.151 3.865 1.00 0.00 C ATOM 1396 OD1 ASP A 90 3.117 -5.604 3.018 1.00 0.00 O ATOM 1397 OD2 ASP A 90 4.062 -5.656 5.005 1.00 0.00 O ATOM 1398 H ASP A 90 6.858 -2.660 3.380 1.00 0.00 H ATOM 1399 HA ASP A 90 5.724 -4.815 1.958 1.00 0.00 H ATOM 1400 HB2 ASP A 90 5.355 -3.706 4.411 1.00 0.00 H ATOM 1401 HB3 ASP A 90 3.946 -3.044 3.625 1.00 0.00 H ATOM 1402 N LEU A 91 4.440 -1.814 1.262 1.00 0.00 N ATOM 1403 CA LEU A 91 3.679 -0.979 0.338 1.00 0.00 C ATOM 1404 C LEU A 91 4.296 -1.012 -1.044 1.00 0.00 C ATOM 1405 O LEU A 91 3.607 -1.404 -1.974 1.00 0.00 O ATOM 1406 CB LEU A 91 3.513 0.447 0.904 1.00 0.00 C ATOM 1407 CG LEU A 91 2.850 1.465 -0.041 1.00 0.00 C ATOM 1408 CD1 LEU A 91 1.480 1.036 -0.585 1.00 0.00 C ATOM 1409 CD2 LEU A 91 2.685 2.797 0.704 1.00 0.00 C ATOM 1410 H LEU A 91 4.846 -1.379 2.084 1.00 0.00 H ATOM 1411 HA LEU A 91 2.689 -1.416 0.222 1.00 0.00 H ATOM 1412 HB2 LEU A 91 2.943 0.386 1.823 1.00 0.00 H ATOM 1413 HB3 LEU A 91 4.483 0.845 1.178 1.00 0.00 H ATOM 1414 HG LEU A 91 3.517 1.633 -0.883 1.00 0.00 H ATOM 1415 HD11 LEU A 91 0.743 0.964 0.208 1.00 0.00 H ATOM 1416 HD12 LEU A 91 1.136 1.760 -1.323 1.00 0.00 H ATOM 1417 HD13 LEU A 91 1.559 0.069 -1.078 1.00 0.00 H ATOM 1418 HD21 LEU A 91 3.658 3.154 1.041 1.00 0.00 H ATOM 1419 HD22 LEU A 91 2.245 3.543 0.043 1.00 0.00 H ATOM 1420 HD23 LEU A 91 2.044 2.664 1.574 1.00 0.00 H ATOM 1421 N VAL A 92 5.558 -0.618 -1.192 1.00 0.00 N ATOM 1422 CA VAL A 92 6.292 -0.683 -2.451 1.00 0.00 C ATOM 1423 C VAL A 92 6.082 -2.044 -3.106 1.00 0.00 C ATOM 1424 O VAL A 92 5.769 -2.099 -4.291 1.00 0.00 O ATOM 1425 CB VAL A 92 7.777 -0.408 -2.159 1.00 0.00 C ATOM 1426 CG1 VAL A 92 8.754 -1.053 -3.144 1.00 0.00 C ATOM 1427 CG2 VAL A 92 8.040 1.090 -2.018 1.00 0.00 C ATOM 1428 H VAL A 92 6.079 -0.371 -0.357 1.00 0.00 H ATOM 1429 HA VAL A 92 5.902 0.076 -3.127 1.00 0.00 H ATOM 1430 HB VAL A 92 8.005 -0.836 -1.199 1.00 0.00 H ATOM 1431 HG11 VAL A 92 9.765 -0.786 -2.854 1.00 0.00 H ATOM 1432 HG12 VAL A 92 8.668 -2.146 -3.087 1.00 0.00 H ATOM 1433 HG13 VAL A 92 8.552 -0.724 -4.162 1.00 0.00 H ATOM 1434 HG21 VAL A 92 9.054 1.244 -1.655 1.00 0.00 H ATOM 1435 HG22 VAL A 92 7.923 1.579 -2.980 1.00 0.00 H ATOM 1436 HG23 VAL A 92 7.348 1.514 -1.294 1.00 0.00 H ATOM 1437 N ASP A 93 6.244 -3.117 -2.336 1.00 0.00 N ATOM 1438 CA ASP A 93 6.207 -4.489 -2.816 1.00 0.00 C ATOM 1439 C ASP A 93 4.897 -4.748 -3.562 1.00 0.00 C ATOM 1440 O ASP A 93 4.889 -5.217 -4.704 1.00 0.00 O ATOM 1441 CB ASP A 93 6.329 -5.455 -1.624 1.00 0.00 C ATOM 1442 CG ASP A 93 7.511 -6.413 -1.671 1.00 0.00 C ATOM 1443 OD1 ASP A 93 8.035 -6.713 -2.772 1.00 0.00 O ATOM 1444 OD2 ASP A 93 7.943 -6.852 -0.583 1.00 0.00 O ATOM 1445 H ASP A 93 6.518 -2.972 -1.367 1.00 0.00 H ATOM 1446 HA ASP A 93 7.049 -4.617 -3.490 1.00 0.00 H ATOM 1447 HB2 ASP A 93 6.366 -4.896 -0.693 1.00 0.00 H ATOM 1448 HB3 ASP A 93 5.434 -6.056 -1.579 1.00 0.00 H ATOM 1449 N LEU A 94 3.791 -4.403 -2.898 1.00 0.00 N ATOM 1450 CA LEU A 94 2.426 -4.546 -3.384 1.00 0.00 C ATOM 1451 C LEU A 94 2.166 -3.566 -4.518 1.00 0.00 C ATOM 1452 O LEU A 94 1.449 -3.892 -5.456 1.00 0.00 O ATOM 1453 CB LEU A 94 1.439 -4.242 -2.248 1.00 0.00 C ATOM 1454 CG LEU A 94 1.537 -5.224 -1.070 1.00 0.00 C ATOM 1455 CD1 LEU A 94 1.046 -4.561 0.214 1.00 0.00 C ATOM 1456 CD2 LEU A 94 0.717 -6.478 -1.334 1.00 0.00 C ATOM 1457 H LEU A 94 3.933 -4.007 -1.973 1.00 0.00 H ATOM 1458 HA LEU A 94 2.268 -5.565 -3.746 1.00 0.00 H ATOM 1459 HB2 LEU A 94 1.638 -3.233 -1.892 1.00 0.00 H ATOM 1460 HB3 LEU A 94 0.425 -4.263 -2.649 1.00 0.00 H ATOM 1461 HG LEU A 94 2.569 -5.518 -0.930 1.00 0.00 H ATOM 1462 HD11 LEU A 94 0.027 -4.218 0.086 1.00 0.00 H ATOM 1463 HD12 LEU A 94 1.103 -5.271 1.041 1.00 0.00 H ATOM 1464 HD13 LEU A 94 1.679 -3.708 0.446 1.00 0.00 H ATOM 1465 HD21 LEU A 94 -0.337 -6.216 -1.394 1.00 0.00 H ATOM 1466 HD22 LEU A 94 1.042 -6.940 -2.264 1.00 0.00 H ATOM 1467 HD23 LEU A 94 0.874 -7.188 -0.522 1.00 0.00 H ATOM 1468 N LEU A 95 2.704 -2.349 -4.436 1.00 0.00 N ATOM 1469 CA LEU A 95 2.536 -1.335 -5.466 1.00 0.00 C ATOM 1470 C LEU A 95 3.131 -1.834 -6.774 1.00 0.00 C ATOM 1471 O LEU A 95 2.487 -1.697 -7.812 1.00 0.00 O ATOM 1472 CB LEU A 95 3.149 0.007 -5.055 1.00 0.00 C ATOM 1473 CG LEU A 95 2.365 0.770 -3.982 1.00 0.00 C ATOM 1474 CD1 LEU A 95 3.132 2.052 -3.653 1.00 0.00 C ATOM 1475 CD2 LEU A 95 0.927 1.078 -4.399 1.00 0.00 C ATOM 1476 H LEU A 95 3.276 -2.148 -3.621 1.00 0.00 H ATOM 1477 HA LEU A 95 1.474 -1.189 -5.632 1.00 0.00 H ATOM 1478 HB2 LEU A 95 4.169 -0.154 -4.713 1.00 0.00 H ATOM 1479 HB3 LEU A 95 3.188 0.643 -5.931 1.00 0.00 H ATOM 1480 HG LEU A 95 2.299 0.176 -3.089 1.00 0.00 H ATOM 1481 HD11 LEU A 95 3.307 2.611 -4.566 1.00 0.00 H ATOM 1482 HD12 LEU A 95 2.577 2.663 -2.943 1.00 0.00 H ATOM 1483 HD13 LEU A 95 4.093 1.789 -3.210 1.00 0.00 H ATOM 1484 HD21 LEU A 95 0.339 0.162 -4.364 1.00 0.00 H ATOM 1485 HD22 LEU A 95 0.478 1.777 -3.694 1.00 0.00 H ATOM 1486 HD23 LEU A 95 0.910 1.482 -5.408 1.00 0.00 H ATOM 1487 N VAL A 96 4.311 -2.456 -6.743 1.00 0.00 N ATOM 1488 CA VAL A 96 4.849 -3.140 -7.908 1.00 0.00 C ATOM 1489 C VAL A 96 3.864 -4.238 -8.338 1.00 0.00 C ATOM 1490 O VAL A 96 3.491 -4.257 -9.511 1.00 0.00 O ATOM 1491 CB VAL A 96 6.286 -3.642 -7.648 1.00 0.00 C ATOM 1492 CG1 VAL A 96 6.855 -4.352 -8.883 1.00 0.00 C ATOM 1493 CG2 VAL A 96 7.242 -2.478 -7.326 1.00 0.00 C ATOM 1494 H VAL A 96 4.802 -2.549 -5.856 1.00 0.00 H ATOM 1495 HA VAL A 96 4.895 -2.416 -8.719 1.00 0.00 H ATOM 1496 HB VAL A 96 6.281 -4.339 -6.814 1.00 0.00 H ATOM 1497 HG11 VAL A 96 7.860 -4.719 -8.676 1.00 0.00 H ATOM 1498 HG12 VAL A 96 6.229 -5.205 -9.146 1.00 0.00 H ATOM 1499 HG13 VAL A 96 6.885 -3.665 -9.728 1.00 0.00 H ATOM 1500 HG21 VAL A 96 8.260 -2.851 -7.212 1.00 0.00 H ATOM 1501 HG22 VAL A 96 7.210 -1.734 -8.119 1.00 0.00 H ATOM 1502 HG23 VAL A 96 6.961 -1.997 -6.395 1.00 0.00 H ATOM 1503 N GLN A 97 3.371 -5.083 -7.418 1.00 0.00 N ATOM 1504 CA GLN A 97 2.467 -6.182 -7.772 1.00 0.00 C ATOM 1505 C GLN A 97 1.219 -5.718 -8.538 1.00 0.00 C ATOM 1506 O GLN A 97 0.683 -6.481 -9.343 1.00 0.00 O ATOM 1507 CB GLN A 97 2.136 -7.084 -6.554 1.00 0.00 C ATOM 1508 CG GLN A 97 0.728 -7.019 -5.928 1.00 0.00 C ATOM 1509 CD GLN A 97 0.437 -8.259 -5.084 1.00 0.00 C ATOM 1510 OE1 GLN A 97 1.130 -8.589 -4.128 1.00 0.00 O ATOM 1511 NE2 GLN A 97 -0.615 -8.984 -5.419 1.00 0.00 N ATOM 1512 H GLN A 97 3.699 -5.022 -6.458 1.00 0.00 H ATOM 1513 HA GLN A 97 3.035 -6.803 -8.466 1.00 0.00 H ATOM 1514 HB2 GLN A 97 2.251 -8.105 -6.907 1.00 0.00 H ATOM 1515 HB3 GLN A 97 2.874 -6.939 -5.763 1.00 0.00 H ATOM 1516 HG2 GLN A 97 0.618 -6.136 -5.303 1.00 0.00 H ATOM 1517 HG3 GLN A 97 -0.023 -6.970 -6.716 1.00 0.00 H ATOM 1518 HE21 GLN A 97 -1.173 -8.735 -6.212 1.00 0.00 H ATOM 1519 HE22 GLN A 97 -0.741 -9.869 -4.935 1.00 0.00 H ATOM 1520 N ILE A 98 0.731 -4.498 -8.303 1.00 0.00 N ATOM 1521 CA ILE A 98 -0.474 -3.966 -8.941 1.00 0.00 C ATOM 1522 C ILE A 98 -0.166 -3.064 -10.151 1.00 0.00 C ATOM 1523 O ILE A 98 -1.105 -2.491 -10.707 1.00 0.00 O ATOM 1524 CB ILE A 98 -1.401 -3.302 -7.904 1.00 0.00 C ATOM 1525 CG1 ILE A 98 -0.734 -2.059 -7.303 1.00 0.00 C ATOM 1526 CG2 ILE A 98 -1.806 -4.302 -6.800 1.00 0.00 C ATOM 1527 CD1 ILE A 98 -1.656 -1.225 -6.423 1.00 0.00 C ATOM 1528 H ILE A 98 1.189 -3.940 -7.590 1.00 0.00 H ATOM 1529 HA ILE A 98 -1.048 -4.798 -9.335 1.00 0.00 H ATOM 1530 HB ILE A 98 -2.304 -2.989 -8.435 1.00 0.00 H ATOM 1531 HG12 ILE A 98 0.115 -2.361 -6.711 1.00 0.00 H ATOM 1532 HG13 ILE A 98 -0.369 -1.438 -8.111 1.00 0.00 H ATOM 1533 HG21 ILE A 98 -0.947 -4.562 -6.186 1.00 0.00 H ATOM 1534 HG22 ILE A 98 -2.567 -3.875 -6.149 1.00 0.00 H ATOM 1535 HG23 ILE A 98 -2.211 -5.206 -7.249 1.00 0.00 H ATOM 1536 HD11 ILE A 98 -2.530 -0.937 -7.000 1.00 0.00 H ATOM 1537 HD12 ILE A 98 -1.943 -1.806 -5.548 1.00 0.00 H ATOM 1538 HD13 ILE A 98 -1.134 -0.328 -6.100 1.00 0.00 H ATOM 1539 N GLU A 99 1.099 -2.949 -10.581 1.00 0.00 N ATOM 1540 CA GLU A 99 1.587 -2.159 -11.724 1.00 0.00 C ATOM 1541 C GLU A 99 1.727 -0.658 -11.367 1.00 0.00 C ATOM 1542 O GLU A 99 1.859 0.202 -12.247 1.00 0.00 O ATOM 1543 CB GLU A 99 0.713 -2.399 -12.981 1.00 0.00 C ATOM 1544 CG GLU A 99 1.422 -2.307 -14.351 1.00 0.00 C ATOM 1545 CD GLU A 99 1.967 -3.637 -14.898 1.00 0.00 C ATOM 1546 OE1 GLU A 99 1.319 -4.697 -14.721 1.00 0.00 O ATOM 1547 OE2 GLU A 99 3.013 -3.637 -15.594 1.00 0.00 O ATOM 1548 H GLU A 99 1.806 -3.482 -10.079 1.00 0.00 H ATOM 1549 HA GLU A 99 2.582 -2.539 -11.939 1.00 0.00 H ATOM 1550 HB2 GLU A 99 0.246 -3.377 -12.903 1.00 0.00 H ATOM 1551 HB3 GLU A 99 -0.091 -1.661 -12.979 1.00 0.00 H ATOM 1552 HG2 GLU A 99 0.686 -1.953 -15.072 1.00 0.00 H ATOM 1553 HG3 GLU A 99 2.210 -1.558 -14.315 1.00 0.00 H ATOM 1554 N LEU A 100 1.683 -0.302 -10.077 1.00 0.00 N ATOM 1555 CA LEU A 100 1.705 1.077 -9.580 1.00 0.00 C ATOM 1556 C LEU A 100 3.144 1.503 -9.290 1.00 0.00 C ATOM 1557 O LEU A 100 3.544 1.836 -8.172 1.00 0.00 O ATOM 1558 CB LEU A 100 0.764 1.279 -8.378 1.00 0.00 C ATOM 1559 CG LEU A 100 -0.650 1.796 -8.721 1.00 0.00 C ATOM 1560 CD1 LEU A 100 -0.588 3.221 -9.288 1.00 0.00 C ATOM 1561 CD2 LEU A 100 -1.435 0.914 -9.699 1.00 0.00 C ATOM 1562 H LEU A 100 1.772 -1.050 -9.390 1.00 0.00 H ATOM 1563 HA LEU A 100 1.355 1.719 -10.379 1.00 0.00 H ATOM 1564 HB2 LEU A 100 0.705 0.367 -7.791 1.00 0.00 H ATOM 1565 HB3 LEU A 100 1.216 2.019 -7.728 1.00 0.00 H ATOM 1566 HG LEU A 100 -1.216 1.840 -7.790 1.00 0.00 H ATOM 1567 HD11 LEU A 100 -1.598 3.605 -9.435 1.00 0.00 H ATOM 1568 HD12 LEU A 100 -0.072 3.879 -8.593 1.00 0.00 H ATOM 1569 HD13 LEU A 100 -0.064 3.237 -10.241 1.00 0.00 H ATOM 1570 HD21 LEU A 100 -2.420 1.345 -9.879 1.00 0.00 H ATOM 1571 HD22 LEU A 100 -0.911 0.827 -10.649 1.00 0.00 H ATOM 1572 HD23 LEU A 100 -1.577 -0.082 -9.289 1.00 0.00 H ATOM 1573 N PHE A 101 3.940 1.516 -10.348 1.00 0.00 N ATOM 1574 CA PHE A 101 5.365 1.759 -10.247 1.00 0.00 C ATOM 1575 C PHE A 101 5.664 3.198 -9.844 1.00 0.00 C ATOM 1576 O PHE A 101 6.637 3.423 -9.136 1.00 0.00 O ATOM 1577 CB PHE A 101 6.061 1.400 -11.569 1.00 0.00 C ATOM 1578 CG PHE A 101 5.712 0.026 -12.111 1.00 0.00 C ATOM 1579 CD1 PHE A 101 5.654 -1.095 -11.258 1.00 0.00 C ATOM 1580 CD2 PHE A 101 5.391 -0.120 -13.473 1.00 0.00 C ATOM 1581 CE1 PHE A 101 5.206 -2.330 -11.754 1.00 0.00 C ATOM 1582 CE2 PHE A 101 4.958 -1.360 -13.968 1.00 0.00 C ATOM 1583 CZ PHE A 101 4.851 -2.461 -13.105 1.00 0.00 C ATOM 1584 H PHE A 101 3.535 1.221 -11.220 1.00 0.00 H ATOM 1585 HA PHE A 101 5.725 1.112 -9.447 1.00 0.00 H ATOM 1586 HB2 PHE A 101 5.790 2.152 -12.312 1.00 0.00 H ATOM 1587 HB3 PHE A 101 7.139 1.460 -11.438 1.00 0.00 H ATOM 1588 HD1 PHE A 101 5.947 -1.020 -10.221 1.00 0.00 H ATOM 1589 HD2 PHE A 101 5.476 0.718 -14.149 1.00 0.00 H ATOM 1590 HE1 PHE A 101 5.147 -3.197 -11.110 1.00 0.00 H ATOM 1591 HE2 PHE A 101 4.713 -1.477 -15.015 1.00 0.00 H ATOM 1592 HZ PHE A 101 4.534 -3.426 -13.478 1.00 0.00 H ATOM 1593 N ALA A 102 4.837 4.173 -10.240 1.00 0.00 N ATOM 1594 CA ALA A 102 5.014 5.571 -9.853 1.00 0.00 C ATOM 1595 C ALA A 102 5.122 5.737 -8.321 1.00 0.00 C ATOM 1596 O ALA A 102 6.178 6.155 -7.846 1.00 0.00 O ATOM 1597 CB ALA A 102 3.921 6.439 -10.488 1.00 0.00 C ATOM 1598 H ALA A 102 4.050 3.918 -10.822 1.00 0.00 H ATOM 1599 HA ALA A 102 5.970 5.900 -10.265 1.00 0.00 H ATOM 1600 HB1 ALA A 102 3.867 7.394 -9.967 1.00 0.00 H ATOM 1601 HB2 ALA A 102 4.162 6.615 -11.534 1.00 0.00 H ATOM 1602 HB3 ALA A 102 2.948 5.952 -10.434 1.00 0.00 H ATOM 1603 N PRO A 103 4.094 5.413 -7.514 1.00 0.00 N ATOM 1604 CA PRO A 103 4.175 5.557 -6.063 1.00 0.00 C ATOM 1605 C PRO A 103 5.219 4.629 -5.415 1.00 0.00 C ATOM 1606 O PRO A 103 5.834 5.044 -4.433 1.00 0.00 O ATOM 1607 CB PRO A 103 2.761 5.321 -5.528 1.00 0.00 C ATOM 1608 CG PRO A 103 2.073 4.551 -6.644 1.00 0.00 C ATOM 1609 CD PRO A 103 2.755 5.026 -7.912 1.00 0.00 C ATOM 1610 HA PRO A 103 4.439 6.588 -5.834 1.00 0.00 H ATOM 1611 HB2 PRO A 103 2.760 4.766 -4.592 1.00 0.00 H ATOM 1612 HB3 PRO A 103 2.253 6.271 -5.382 1.00 0.00 H ATOM 1613 HG2 PRO A 103 2.254 3.487 -6.502 1.00 0.00 H ATOM 1614 HG3 PRO A 103 1.012 4.781 -6.693 1.00 0.00 H ATOM 1615 HD2 PRO A 103 2.755 4.233 -8.657 1.00 0.00 H ATOM 1616 HD3 PRO A 103 2.228 5.901 -8.292 1.00 0.00 H ATOM 1617 N ALA A 104 5.471 3.431 -5.967 1.00 0.00 N ATOM 1618 CA ALA A 104 6.561 2.550 -5.531 1.00 0.00 C ATOM 1619 C ALA A 104 7.881 3.323 -5.636 1.00 0.00 C ATOM 1620 O ALA A 104 8.615 3.427 -4.658 1.00 0.00 O ATOM 1621 CB ALA A 104 6.587 1.292 -6.409 1.00 0.00 C ATOM 1622 H ALA A 104 4.973 3.152 -6.802 1.00 0.00 H ATOM 1623 HA ALA A 104 6.430 2.216 -4.487 1.00 0.00 H ATOM 1624 HB1 ALA A 104 7.381 0.632 -6.059 1.00 0.00 H ATOM 1625 HB2 ALA A 104 5.631 0.770 -6.359 1.00 0.00 H ATOM 1626 HB3 ALA A 104 6.782 1.548 -7.449 1.00 0.00 H ATOM 1627 N THR A 105 8.148 3.937 -6.791 1.00 0.00 N ATOM 1628 CA THR A 105 9.386 4.648 -7.048 1.00 0.00 C ATOM 1629 C THR A 105 9.495 5.867 -6.117 1.00 0.00 C ATOM 1630 O THR A 105 10.578 6.190 -5.635 1.00 0.00 O ATOM 1631 CB THR A 105 9.384 5.151 -8.507 1.00 0.00 C ATOM 1632 OG1 THR A 105 9.126 4.152 -9.468 1.00 0.00 O ATOM 1633 CG2 THR A 105 10.709 5.784 -8.912 1.00 0.00 C ATOM 1634 H THR A 105 7.480 3.914 -7.551 1.00 0.00 H ATOM 1635 HA THR A 105 10.200 3.930 -6.860 1.00 0.00 H ATOM 1636 HB THR A 105 8.599 5.898 -8.596 1.00 0.00 H ATOM 1637 HG1 THR A 105 8.206 3.841 -9.350 1.00 0.00 H ATOM 1638 HG21 THR A 105 11.496 5.033 -8.882 1.00 0.00 H ATOM 1639 HG22 THR A 105 10.630 6.157 -9.926 1.00 0.00 H ATOM 1640 HG23 THR A 105 10.941 6.615 -8.248 1.00 0.00 H ATOM 1641 N LEU A 106 8.386 6.580 -5.875 1.00 0.00 N ATOM 1642 CA LEU A 106 8.371 7.791 -5.057 1.00 0.00 C ATOM 1643 C LEU A 106 8.901 7.476 -3.658 1.00 0.00 C ATOM 1644 O LEU A 106 9.673 8.253 -3.080 1.00 0.00 O ATOM 1645 CB LEU A 106 6.931 8.336 -5.003 1.00 0.00 C ATOM 1646 CG LEU A 106 6.710 9.450 -3.960 1.00 0.00 C ATOM 1647 CD1 LEU A 106 7.457 10.739 -4.311 1.00 0.00 C ATOM 1648 CD2 LEU A 106 5.222 9.763 -3.807 1.00 0.00 C ATOM 1649 H LEU A 106 7.502 6.265 -6.263 1.00 0.00 H ATOM 1650 HA LEU A 106 9.020 8.533 -5.519 1.00 0.00 H ATOM 1651 HB2 LEU A 106 6.642 8.682 -5.997 1.00 0.00 H ATOM 1652 HB3 LEU A 106 6.275 7.511 -4.738 1.00 0.00 H ATOM 1653 HG LEU A 106 7.050 9.102 -2.987 1.00 0.00 H ATOM 1654 HD11 LEU A 106 7.121 11.113 -5.278 1.00 0.00 H ATOM 1655 HD12 LEU A 106 7.267 11.491 -3.547 1.00 0.00 H ATOM 1656 HD13 LEU A 106 8.529 10.548 -4.359 1.00 0.00 H ATOM 1657 HD21 LEU A 106 4.648 8.838 -3.821 1.00 0.00 H ATOM 1658 HD22 LEU A 106 5.060 10.261 -2.852 1.00 0.00 H ATOM 1659 HD23 LEU A 106 4.874 10.406 -4.612 1.00 0.00 H ATOM 1660 N LEU A 107 8.446 6.347 -3.117 1.00 0.00 N ATOM 1661 CA LEU A 107 8.843 5.833 -1.820 1.00 0.00 C ATOM 1662 C LEU A 107 10.277 5.325 -1.885 1.00 0.00 C ATOM 1663 O LEU A 107 11.072 5.661 -1.005 1.00 0.00 O ATOM 1664 CB LEU A 107 7.911 4.683 -1.409 1.00 0.00 C ATOM 1665 CG LEU A 107 6.462 5.108 -1.113 1.00 0.00 C ATOM 1666 CD1 LEU A 107 5.554 3.883 -1.188 1.00 0.00 C ATOM 1667 CD2 LEU A 107 6.323 5.787 0.257 1.00 0.00 C ATOM 1668 H LEU A 107 7.865 5.752 -3.701 1.00 0.00 H ATOM 1669 HA LEU A 107 8.791 6.632 -1.082 1.00 0.00 H ATOM 1670 HB2 LEU A 107 7.906 3.955 -2.219 1.00 0.00 H ATOM 1671 HB3 LEU A 107 8.327 4.186 -0.533 1.00 0.00 H ATOM 1672 HG LEU A 107 6.125 5.813 -1.871 1.00 0.00 H ATOM 1673 HD11 LEU A 107 5.848 3.142 -0.444 1.00 0.00 H ATOM 1674 HD12 LEU A 107 4.521 4.176 -1.024 1.00 0.00 H ATOM 1675 HD13 LEU A 107 5.632 3.443 -2.185 1.00 0.00 H ATOM 1676 HD21 LEU A 107 6.683 5.125 1.043 1.00 0.00 H ATOM 1677 HD22 LEU A 107 6.898 6.711 0.265 1.00 0.00 H ATOM 1678 HD23 LEU A 107 5.276 6.021 0.451 1.00 0.00 H ATOM 1679 N LEU A 108 10.598 4.487 -2.876 1.00 0.00 N ATOM 1680 CA LEU A 108 11.855 3.758 -2.932 1.00 0.00 C ATOM 1681 C LEU A 108 12.207 3.512 -4.411 1.00 0.00 C ATOM 1682 O LEU A 108 11.803 2.505 -4.993 1.00 0.00 O ATOM 1683 CB LEU A 108 11.692 2.464 -2.122 1.00 0.00 C ATOM 1684 CG LEU A 108 12.945 1.977 -1.383 1.00 0.00 C ATOM 1685 CD1 LEU A 108 12.540 0.713 -0.615 1.00 0.00 C ATOM 1686 CD2 LEU A 108 14.161 1.743 -2.281 1.00 0.00 C ATOM 1687 H LEU A 108 9.893 4.204 -3.558 1.00 0.00 H ATOM 1688 HA LEU A 108 12.625 4.355 -2.446 1.00 0.00 H ATOM 1689 HB2 LEU A 108 10.931 2.633 -1.361 1.00 0.00 H ATOM 1690 HB3 LEU A 108 11.320 1.680 -2.772 1.00 0.00 H ATOM 1691 HG LEU A 108 13.247 2.730 -0.659 1.00 0.00 H ATOM 1692 HD11 LEU A 108 12.063 -0.019 -1.267 1.00 0.00 H ATOM 1693 HD12 LEU A 108 13.410 0.262 -0.144 1.00 0.00 H ATOM 1694 HD13 LEU A 108 11.813 0.984 0.153 1.00 0.00 H ATOM 1695 HD21 LEU A 108 13.906 1.101 -3.116 1.00 0.00 H ATOM 1696 HD22 LEU A 108 14.534 2.697 -2.651 1.00 0.00 H ATOM 1697 HD23 LEU A 108 14.950 1.273 -1.690 1.00 0.00 H ATOM 1698 N PRO A 109 12.955 4.418 -5.058 1.00 0.00 N ATOM 1699 CA PRO A 109 13.164 4.414 -6.507 1.00 0.00 C ATOM 1700 C PRO A 109 14.059 3.268 -6.994 1.00 0.00 C ATOM 1701 O PRO A 109 14.262 3.102 -8.196 1.00 0.00 O ATOM 1702 CB PRO A 109 13.756 5.790 -6.829 1.00 0.00 C ATOM 1703 CG PRO A 109 14.480 6.171 -5.542 1.00 0.00 C ATOM 1704 CD PRO A 109 13.598 5.566 -4.450 1.00 0.00 C ATOM 1705 HA PRO A 109 12.206 4.320 -7.007 1.00 0.00 H ATOM 1706 HB2 PRO A 109 14.429 5.768 -7.687 1.00 0.00 H ATOM 1707 HB3 PRO A 109 12.953 6.505 -7.006 1.00 0.00 H ATOM 1708 HG2 PRO A 109 15.458 5.691 -5.532 1.00 0.00 H ATOM 1709 HG3 PRO A 109 14.576 7.251 -5.434 1.00 0.00 H ATOM 1710 HD2 PRO A 109 14.197 5.245 -3.597 1.00 0.00 H ATOM 1711 HD3 PRO A 109 12.835 6.279 -4.134 1.00 0.00 H ATOM 1712 N ASP A 110 14.612 2.487 -6.071 1.00 0.00 N ATOM 1713 CA ASP A 110 15.543 1.397 -6.331 1.00 0.00 C ATOM 1714 C ASP A 110 14.817 0.045 -6.328 1.00 0.00 C ATOM 1715 O ASP A 110 15.226 -0.887 -7.009 1.00 0.00 O ATOM 1716 CB ASP A 110 16.611 1.464 -5.231 1.00 0.00 C ATOM 1717 CG ASP A 110 17.929 0.828 -5.648 1.00 0.00 C ATOM 1718 OD1 ASP A 110 18.006 -0.414 -5.683 1.00 0.00 O ATOM 1719 OD2 ASP A 110 18.913 1.585 -5.840 1.00 0.00 O ATOM 1720 H ASP A 110 14.382 2.675 -5.109 1.00 0.00 H ATOM 1721 HA ASP A 110 16.024 1.542 -7.300 1.00 0.00 H ATOM 1722 HB2 ASP A 110 16.809 2.511 -4.991 1.00 0.00 H ATOM 1723 HB3 ASP A 110 16.242 0.985 -4.322 1.00 0.00 H ATOM 1724 N ALA A 111 13.703 -0.050 -5.593 1.00 0.00 N ATOM 1725 CA ALA A 111 12.991 -1.288 -5.265 1.00 0.00 C ATOM 1726 C ALA A 111 11.996 -1.736 -6.338 1.00 0.00 C ATOM 1727 O ALA A 111 11.232 -2.683 -6.134 1.00 0.00 O ATOM 1728 CB ALA A 111 12.217 -1.025 -3.978 1.00 0.00 C ATOM 1729 H ALA A 111 13.343 0.797 -5.176 1.00 0.00 H ATOM 1730 HA ALA A 111 13.708 -2.096 -5.097 1.00 0.00 H ATOM 1731 HB1 ALA A 111 11.617 -1.898 -3.722 1.00 0.00 H ATOM 1732 HB2 ALA A 111 12.916 -0.852 -3.165 1.00 0.00 H ATOM 1733 HB3 ALA A 111 11.566 -0.156 -4.129 1.00 0.00 H ATOM 1734 N VAL A 112 11.929 -1.016 -7.448 1.00 0.00 N ATOM 1735 CA VAL A 112 10.994 -1.236 -8.532 1.00 0.00 C ATOM 1736 C VAL A 112 11.856 -1.500 -9.768 1.00 0.00 C ATOM 1737 O VAL A 112 12.782 -0.723 -10.030 1.00 0.00 O ATOM 1738 CB VAL A 112 10.033 -0.039 -8.599 1.00 0.00 C ATOM 1739 CG1 VAL A 112 10.730 1.330 -8.579 1.00 0.00 C ATOM 1740 CG2 VAL A 112 9.088 -0.139 -9.800 1.00 0.00 C ATOM 1741 H VAL A 112 12.575 -0.249 -7.565 1.00 0.00 H ATOM 1742 HA VAL A 112 10.388 -2.114 -8.316 1.00 0.00 H ATOM 1743 HB VAL A 112 9.414 -0.079 -7.702 1.00 0.00 H ATOM 1744 HG11 VAL A 112 9.966 2.094 -8.536 1.00 0.00 H ATOM 1745 HG12 VAL A 112 11.351 1.448 -7.691 1.00 0.00 H ATOM 1746 HG13 VAL A 112 11.338 1.466 -9.473 1.00 0.00 H ATOM 1747 HG21 VAL A 112 8.342 0.650 -9.726 1.00 0.00 H ATOM 1748 HG22 VAL A 112 9.642 -0.019 -10.730 1.00 0.00 H ATOM 1749 HG23 VAL A 112 8.582 -1.104 -9.809 1.00 0.00 H ATOM 1750 N PRO A 113 11.631 -2.604 -10.501 1.00 0.00 N ATOM 1751 CA PRO A 113 12.597 -3.080 -11.480 1.00 0.00 C ATOM 1752 C PRO A 113 12.668 -2.171 -12.709 1.00 0.00 C ATOM 1753 O PRO A 113 13.746 -2.047 -13.291 1.00 0.00 O ATOM 1754 CB PRO A 113 12.172 -4.510 -11.819 1.00 0.00 C ATOM 1755 CG PRO A 113 10.671 -4.512 -11.543 1.00 0.00 C ATOM 1756 CD PRO A 113 10.540 -3.558 -10.359 1.00 0.00 C ATOM 1757 HA PRO A 113 13.586 -3.117 -11.023 1.00 0.00 H ATOM 1758 HB2 PRO A 113 12.402 -4.769 -12.851 1.00 0.00 H ATOM 1759 HB3 PRO A 113 12.666 -5.205 -11.137 1.00 0.00 H ATOM 1760 HG2 PRO A 113 10.143 -4.107 -12.408 1.00 0.00 H ATOM 1761 HG3 PRO A 113 10.301 -5.505 -11.294 1.00 0.00 H ATOM 1762 HD2 PRO A 113 9.569 -3.065 -10.383 1.00 0.00 H ATOM 1763 HD3 PRO A 113 10.660 -4.110 -9.428 1.00 0.00 H ATOM 1764 N GLN A 114 11.573 -1.496 -13.077 1.00 0.00 N ATOM 1765 CA GLN A 114 11.542 -0.545 -14.181 1.00 0.00 C ATOM 1766 C GLN A 114 12.517 0.597 -13.916 1.00 0.00 C ATOM 1767 O GLN A 114 12.381 1.355 -12.949 1.00 0.00 O ATOM 1768 CB GLN A 114 10.117 -0.023 -14.412 1.00 0.00 C ATOM 1769 CG GLN A 114 9.233 -1.076 -15.087 1.00 0.00 C ATOM 1770 CD GLN A 114 9.469 -1.200 -16.589 1.00 0.00 C ATOM 1771 OE1 GLN A 114 8.846 -0.501 -17.388 1.00 0.00 O ATOM 1772 NE2 GLN A 114 10.366 -2.076 -17.010 1.00 0.00 N ATOM 1773 H GLN A 114 10.725 -1.627 -12.547 1.00 0.00 H ATOM 1774 HA GLN A 114 11.873 -1.064 -15.080 1.00 0.00 H ATOM 1775 HB2 GLN A 114 9.677 0.257 -13.454 1.00 0.00 H ATOM 1776 HB3 GLN A 114 10.143 0.862 -15.047 1.00 0.00 H ATOM 1777 HG2 GLN A 114 9.418 -2.045 -14.628 1.00 0.00 H ATOM 1778 HG3 GLN A 114 8.190 -0.802 -14.923 1.00 0.00 H ATOM 1779 HE21 GLN A 114 10.834 -2.686 -16.343 1.00 0.00 H ATOM 1780 HE22 GLN A 114 10.531 -2.214 -17.993 1.00 0.00 H ATOM 1781 N THR A 115 13.522 0.696 -14.779 1.00 0.00 N ATOM 1782 CA THR A 115 14.499 1.765 -14.838 1.00 0.00 C ATOM 1783 C THR A 115 13.778 3.063 -15.230 1.00 0.00 C ATOM 1784 O THR A 115 13.644 3.363 -16.417 1.00 0.00 O ATOM 1785 CB THR A 115 15.582 1.327 -15.844 1.00 0.00 C ATOM 1786 OG1 THR A 115 16.122 0.077 -15.445 1.00 0.00 O ATOM 1787 CG2 THR A 115 16.734 2.317 -16.018 1.00 0.00 C ATOM 1788 H THR A 115 13.619 -0.026 -15.479 1.00 0.00 H ATOM 1789 HA THR A 115 14.946 1.882 -13.854 1.00 0.00 H ATOM 1790 HB THR A 115 15.106 1.184 -16.813 1.00 0.00 H ATOM 1791 HG1 THR A 115 16.638 0.226 -14.638 1.00 0.00 H ATOM 1792 HG21 THR A 115 16.358 3.248 -16.442 1.00 0.00 H ATOM 1793 HG22 THR A 115 17.210 2.522 -15.063 1.00 0.00 H ATOM 1794 HG23 THR A 115 17.470 1.896 -16.702 1.00 0.00 H ATOM 1795 N VAL A 116 13.238 3.805 -14.260 1.00 0.00 N ATOM 1796 CA VAL A 116 12.626 5.109 -14.480 1.00 0.00 C ATOM 1797 C VAL A 116 12.611 5.871 -13.157 1.00 0.00 C ATOM 1798 O VAL A 116 12.174 5.366 -12.125 1.00 0.00 O ATOM 1799 CB VAL A 116 11.223 4.978 -15.115 1.00 0.00 C ATOM 1800 CG1 VAL A 116 10.258 4.076 -14.338 1.00 0.00 C ATOM 1801 CG2 VAL A 116 10.567 6.350 -15.317 1.00 0.00 C ATOM 1802 H VAL A 116 13.260 3.470 -13.303 1.00 0.00 H ATOM 1803 HA VAL A 116 13.256 5.650 -15.189 1.00 0.00 H ATOM 1804 HB VAL A 116 11.349 4.545 -16.105 1.00 0.00 H ATOM 1805 HG11 VAL A 116 10.076 4.481 -13.345 1.00 0.00 H ATOM 1806 HG12 VAL A 116 9.310 4.005 -14.863 1.00 0.00 H ATOM 1807 HG13 VAL A 116 10.670 3.072 -14.244 1.00 0.00 H ATOM 1808 HG21 VAL A 116 9.679 6.236 -15.938 1.00 0.00 H ATOM 1809 HG22 VAL A 116 10.281 6.785 -14.360 1.00 0.00 H ATOM 1810 HG23 VAL A 116 11.270 7.017 -15.816 1.00 0.00 H ATOM 1811 N LYS A 117 13.083 7.111 -13.195 1.00 0.00 N ATOM 1812 CA LYS A 117 13.122 8.061 -12.094 1.00 0.00 C ATOM 1813 C LYS A 117 13.162 9.447 -12.715 1.00 0.00 C ATOM 1814 O LYS A 117 13.473 9.577 -13.902 1.00 0.00 O ATOM 1815 CB LYS A 117 14.337 7.810 -11.181 1.00 0.00 C ATOM 1816 CG LYS A 117 15.724 7.935 -11.840 1.00 0.00 C ATOM 1817 CD LYS A 117 16.083 6.735 -12.728 1.00 0.00 C ATOM 1818 CE LYS A 117 17.578 6.668 -13.032 1.00 0.00 C ATOM 1819 NZ LYS A 117 17.875 5.565 -13.966 1.00 0.00 N ATOM 1820 H LYS A 117 13.380 7.501 -14.083 1.00 0.00 H ATOM 1821 HA LYS A 117 12.219 7.961 -11.496 1.00 0.00 H ATOM 1822 HB2 LYS A 117 14.289 8.538 -10.373 1.00 0.00 H ATOM 1823 HB3 LYS A 117 14.243 6.825 -10.721 1.00 0.00 H ATOM 1824 HG2 LYS A 117 15.777 8.850 -12.426 1.00 0.00 H ATOM 1825 HG3 LYS A 117 16.459 8.014 -11.043 1.00 0.00 H ATOM 1826 HD2 LYS A 117 15.783 5.819 -12.220 1.00 0.00 H ATOM 1827 HD3 LYS A 117 15.551 6.811 -13.674 1.00 0.00 H ATOM 1828 HE2 LYS A 117 17.895 7.613 -13.479 1.00 0.00 H ATOM 1829 HE3 LYS A 117 18.132 6.510 -12.105 1.00 0.00 H ATOM 1830 HZ1 LYS A 117 17.341 5.682 -14.820 1.00 0.00 H ATOM 1831 HZ2 LYS A 117 18.856 5.597 -14.233 1.00 0.00 H ATOM 1832 HZ3 LYS A 117 17.661 4.664 -13.547 1.00 0.00 H ATOM 1833 N SER A 118 12.906 10.490 -11.936 1.00 0.00 N ATOM 1834 CA SER A 118 13.031 11.856 -12.409 1.00 0.00 C ATOM 1835 C SER A 118 13.313 12.756 -11.216 1.00 0.00 C ATOM 1836 O SER A 118 12.796 12.508 -10.120 1.00 0.00 O ATOM 1837 CB SER A 118 11.722 12.248 -13.100 1.00 0.00 C ATOM 1838 OG SER A 118 11.903 13.398 -13.898 1.00 0.00 O ATOM 1839 H SER A 118 12.690 10.353 -10.957 1.00 0.00 H ATOM 1840 HA SER A 118 13.855 11.916 -13.122 1.00 0.00 H ATOM 1841 HB2 SER A 118 11.395 11.436 -13.751 1.00 0.00 H ATOM 1842 HB3 SER A 118 10.954 12.427 -12.346 1.00 0.00 H ATOM 1843 HG SER A 118 11.254 14.078 -13.638 1.00 0.00 H ATOM 1844 N LEU A 119 14.079 13.825 -11.421 1.00 0.00 N ATOM 1845 CA LEU A 119 14.139 14.923 -10.463 1.00 0.00 C ATOM 1846 C LEU A 119 12.876 15.786 -10.617 1.00 0.00 C ATOM 1847 O LEU A 119 12.459 16.057 -11.750 1.00 0.00 O ATOM 1848 CB LEU A 119 15.428 15.747 -10.634 1.00 0.00 C ATOM 1849 CG LEU A 119 15.545 16.509 -11.973 1.00 0.00 C ATOM 1850 CD1 LEU A 119 15.108 17.978 -11.869 1.00 0.00 C ATOM 1851 CD2 LEU A 119 16.985 16.462 -12.485 1.00 0.00 C ATOM 1852 H LEU A 119 14.446 13.993 -12.350 1.00 0.00 H ATOM 1853 HA LEU A 119 14.182 14.484 -9.467 1.00 0.00 H ATOM 1854 HB2 LEU A 119 15.501 16.456 -9.807 1.00 0.00 H ATOM 1855 HB3 LEU A 119 16.264 15.054 -10.527 1.00 0.00 H ATOM 1856 HG LEU A 119 14.928 16.014 -12.720 1.00 0.00 H ATOM 1857 HD11 LEU A 119 14.096 18.042 -11.480 1.00 0.00 H ATOM 1858 HD12 LEU A 119 15.766 18.524 -11.190 1.00 0.00 H ATOM 1859 HD13 LEU A 119 15.111 18.440 -12.855 1.00 0.00 H ATOM 1860 HD21 LEU A 119 17.635 17.021 -11.816 1.00 0.00 H ATOM 1861 HD22 LEU A 119 17.318 15.427 -12.507 1.00 0.00 H ATOM 1862 HD23 LEU A 119 17.036 16.865 -13.496 1.00 0.00 H ATOM 1863 N PRO A 120 12.240 16.218 -9.522 1.00 0.00 N ATOM 1864 CA PRO A 120 11.292 17.325 -9.536 1.00 0.00 C ATOM 1865 C PRO A 120 12.048 18.669 -9.649 1.00 0.00 C ATOM 1866 O PRO A 120 13.081 18.836 -8.995 1.00 0.00 O ATOM 1867 CB PRO A 120 10.541 17.197 -8.210 1.00 0.00 C ATOM 1868 CG PRO A 120 11.561 16.548 -7.272 1.00 0.00 C ATOM 1869 CD PRO A 120 12.379 15.658 -8.191 1.00 0.00 C ATOM 1870 HA PRO A 120 10.596 17.201 -10.363 1.00 0.00 H ATOM 1871 HB2 PRO A 120 10.194 18.162 -7.840 1.00 0.00 H ATOM 1872 HB3 PRO A 120 9.696 16.519 -8.339 1.00 0.00 H ATOM 1873 HG2 PRO A 120 12.216 17.303 -6.844 1.00 0.00 H ATOM 1874 HG3 PRO A 120 11.080 15.971 -6.484 1.00 0.00 H ATOM 1875 HD2 PRO A 120 13.417 15.644 -7.871 1.00 0.00 H ATOM 1876 HD3 PRO A 120 11.975 14.648 -8.183 1.00 0.00 H ATOM 1877 N PRO A 121 11.558 19.648 -10.436 1.00 0.00 N ATOM 1878 CA PRO A 121 12.222 20.943 -10.615 1.00 0.00 C ATOM 1879 C PRO A 121 12.261 21.770 -9.322 1.00 0.00 C ATOM 1880 O PRO A 121 11.628 21.413 -8.323 1.00 0.00 O ATOM 1881 CB PRO A 121 11.450 21.648 -11.736 1.00 0.00 C ATOM 1882 CG PRO A 121 10.061 21.018 -11.677 1.00 0.00 C ATOM 1883 CD PRO A 121 10.346 19.585 -11.237 1.00 0.00 C ATOM 1884 HA PRO A 121 13.250 20.778 -10.943 1.00 0.00 H ATOM 1885 HB2 PRO A 121 11.407 22.731 -11.608 1.00 0.00 H ATOM 1886 HB3 PRO A 121 11.918 21.406 -12.688 1.00 0.00 H ATOM 1887 HG2 PRO A 121 9.467 21.518 -10.912 1.00 0.00 H ATOM 1888 HG3 PRO A 121 9.557 21.050 -12.645 1.00 0.00 H ATOM 1889 HD2 PRO A 121 9.509 19.203 -10.655 1.00 0.00 H ATOM 1890 HD3 PRO A 121 10.523 18.959 -12.113 1.00 0.00 H ATOM 1891 N SER A 122 12.994 22.883 -9.336 1.00 0.00 N ATOM 1892 CA SER A 122 13.456 23.578 -8.137 1.00 0.00 C ATOM 1893 C SER A 122 13.038 25.051 -8.153 1.00 0.00 C ATOM 1894 O SER A 122 13.108 25.709 -9.198 1.00 0.00 O ATOM 1895 CB SER A 122 14.987 23.465 -8.008 1.00 0.00 C ATOM 1896 OG SER A 122 15.609 22.723 -9.054 1.00 0.00 O ATOM 1897 H SER A 122 13.437 23.166 -10.202 1.00 0.00 H ATOM 1898 HA SER A 122 13.026 23.097 -7.262 1.00 0.00 H ATOM 1899 HB2 SER A 122 15.413 24.468 -8.010 1.00 0.00 H ATOM 1900 HB3 SER A 122 15.225 22.999 -7.051 1.00 0.00 H ATOM 1901 HG SER A 122 15.343 23.147 -9.899 1.00 0.00 H ATOM 1902 N GLY A 123 12.656 25.599 -7.000 1.00 0.00 N ATOM 1903 CA GLY A 123 12.379 27.020 -6.849 1.00 0.00 C ATOM 1904 C GLY A 123 12.188 27.403 -5.387 1.00 0.00 C ATOM 1905 O GLY A 123 11.057 27.396 -4.903 1.00 0.00 O ATOM 1906 H GLY A 123 12.468 24.993 -6.207 1.00 0.00 H ATOM 1907 HA2 GLY A 123 13.204 27.596 -7.260 1.00 0.00 H ATOM 1908 HA3 GLY A 123 11.476 27.277 -7.404 1.00 0.00 H ATOM 1909 N PRO A 124 13.254 27.712 -4.632 1.00 0.00 N ATOM 1910 CA PRO A 124 13.130 28.344 -3.325 1.00 0.00 C ATOM 1911 C PRO A 124 12.897 29.853 -3.514 1.00 0.00 C ATOM 1912 O PRO A 124 13.781 30.671 -3.237 1.00 0.00 O ATOM 1913 CB PRO A 124 14.449 28.005 -2.623 1.00 0.00 C ATOM 1914 CG PRO A 124 15.461 28.013 -3.771 1.00 0.00 C ATOM 1915 CD PRO A 124 14.656 27.503 -4.971 1.00 0.00 C ATOM 1916 HA PRO A 124 12.300 27.921 -2.755 1.00 0.00 H ATOM 1917 HB2 PRO A 124 14.708 28.711 -1.833 1.00 0.00 H ATOM 1918 HB3 PRO A 124 14.386 27.001 -2.207 1.00 0.00 H ATOM 1919 HG2 PRO A 124 15.795 29.033 -3.960 1.00 0.00 H ATOM 1920 HG3 PRO A 124 16.314 27.372 -3.551 1.00 0.00 H ATOM 1921 HD2 PRO A 124 14.936 28.055 -5.871 1.00 0.00 H ATOM 1922 HD3 PRO A 124 14.834 26.434 -5.098 1.00 0.00 H ATOM 1923 N SER A 125 11.734 30.255 -4.030 1.00 0.00 N ATOM 1924 CA SER A 125 11.356 31.663 -4.010 1.00 0.00 C ATOM 1925 C SER A 125 10.993 32.062 -2.575 1.00 0.00 C ATOM 1926 O SER A 125 10.678 31.206 -1.737 1.00 0.00 O ATOM 1927 CB SER A 125 10.236 31.944 -5.021 1.00 0.00 C ATOM 1928 OG SER A 125 9.185 31.002 -4.946 1.00 0.00 O ATOM 1929 H SER A 125 11.008 29.593 -4.277 1.00 0.00 H ATOM 1930 HA SER A 125 12.215 32.257 -4.315 1.00 0.00 H ATOM 1931 HB2 SER A 125 9.841 32.946 -4.851 1.00 0.00 H ATOM 1932 HB3 SER A 125 10.656 31.914 -6.028 1.00 0.00 H ATOM 1933 HG SER A 125 8.533 31.270 -5.618 1.00 0.00 H ATOM 1934 N SER A 126 11.010 33.357 -2.288 1.00 0.00 N ATOM 1935 CA SER A 126 10.567 33.944 -1.033 1.00 0.00 C ATOM 1936 C SER A 126 9.662 35.142 -1.349 1.00 0.00 C ATOM 1937 O SER A 126 9.401 35.461 -2.522 1.00 0.00 O ATOM 1938 CB SER A 126 11.800 34.300 -0.186 1.00 0.00 C ATOM 1939 OG SER A 126 12.757 35.044 -0.916 1.00 0.00 O ATOM 1940 H SER A 126 11.292 34.023 -3.001 1.00 0.00 H ATOM 1941 HA SER A 126 9.970 33.217 -0.474 1.00 0.00 H ATOM 1942 HB2 SER A 126 11.488 34.864 0.690 1.00 0.00 H ATOM 1943 HB3 SER A 126 12.280 33.386 0.161 1.00 0.00 H ATOM 1944 HG SER A 126 13.279 34.399 -1.439 1.00 0.00 H ATOM 1945 N GLY A 127 9.119 35.799 -0.327 1.00 0.00 N ATOM 1946 CA GLY A 127 8.192 36.895 -0.527 1.00 0.00 C ATOM 1947 C GLY A 127 7.575 37.331 0.776 1.00 0.00 C ATOM 1948 O GLY A 127 6.502 37.967 0.703 1.00 0.00 O ATOM 1949 H GLY A 127 9.286 35.540 0.636 1.00 0.00 H ATOM 1950 HA2 GLY A 127 8.720 37.735 -0.975 1.00 0.00 H ATOM 1951 HA3 GLY A 127 7.399 36.556 -1.185 1.00 0.00 H TER 1952 GLY A 127