USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1094 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 502 BB9 HN2 : B 502 BB9 N : B 501 SER C :(H bumps) USER MOD NoAdj-H: B 504 DBU H2 : B 504 DBU N : B 503 THR C :(H bumps) USER MOD NoAdj-H: B 505 BB9 HN2 : B 505 BB9 N : B 504 DBU C :(H bumps) USER MOD NoAdj-H: B 506 3GL HN2 : B 506 3GL N : B 505 BB9 C :(H bumps) USER MOD NoAdj-H: B 507 BB9 HN2 : B 507 BB9 N : B 506 3GL C :(H bumps) USER MOD NoAdj-H: B 509 BB9 HN2 : B 509 BB9 N : B 508 CYS C :(H bumps) USER MOD NoAdj-H: B 510 MH6 HB3 : B 510 MH6 CB : B 501 SER CB :(H bumps) USER MOD NoAdj-H: B 510 MH6 HB2 : B 510 MH6 CB : B 501 SER CB :(H bumps) USER MOD NoAdj-H: B 511 BB9 HN2 : B 511 BB9 N : B 510 MH6 C :(H bumps) USER MOD Set 1.1: A 247 ASN : amide:sc= -6.88! C(o=-16!,f=-19!) USER MOD Set 1.2: A 251 HIS : no HD1:sc= -9.28! C(o=-16!,f=-23!) USER MOD Set 2.1: A 196 HIS : no HD1:sc= -1.64 K(o=-6.7,f=-8.3!) USER MOD Set 2.2: A 212 HIS : no HE2:sc= -5.09! C(o=-6.7!,f=-12!) USER MOD Set 3.1: A 147 GLN : amide:sc= -11.2! C(o=-12!,f=-17!) USER MOD Set 3.2: A 151 LYS NZ :NH3+ -133:sc= 0.856 (180deg=-0.919) USER MOD Set 3.3: A 155 TYR OH : rot -12:sc= -1.6! USER MOD Set 4.1: A 142 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 510 MH6 OG : rot -122:sc= 1.83 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 THR OG1 : rot 132:sc= -3.83! USER MOD Single : A 119 LYS NZ :NH3+ 168:sc= -6.98! (180deg=-7.31!) USER MOD Single : A 130 GLN : amide:sc= -0.602 K(o=-0.6,f=-3.4!) USER MOD Single : A 131 TYR OH : rot 180:sc= -0.661! USER MOD Single : A 141 ASN : amide:sc= -6.3! C(o=-6.3!,f=-12!) USER MOD Single : A 145 TYR OH : rot 114:sc= -2.42! USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 154 SER OG : rot -50:sc= 0.478! USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0412 USER MOD Single : A 157 LYS NZ :NH3+ -162:sc= -0.0329 (180deg=-0.354) USER MOD Single : A 161 GLN :FLIP amide:sc= -5.86! C(o=-11!,f=-5.9!) USER MOD Single : A 164 GLN : amide:sc= -1.72 X(o=-1.7,f=-1.5) USER MOD Single : A 171 THR OG1 : rot 65:sc= 1.2 USER MOD Single : A 178 MET CE :methyl 164:sc= -2 (180deg=-2.8!) USER MOD Single : A 186 SER OG : rot 110:sc= -0.96 USER MOD Single : A 190 MET CE :methyl 166:sc=-0.00127 (180deg=-0.351) USER MOD Single : A 198 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 203 ASN : amide:sc= -7.16! C(o=-7.2!,f=-9.8!) USER MOD Single : A 204 HIS : no HD1:sc= -17.9! C(o=-18!,f=-30!) USER MOD Single : A 205 TYR OH : rot 180:sc= 0 USER MOD Single : A 207 CYS SG : rot 21:sc= -1.65! USER MOD Single : A 209 TYR OH : rot 180:sc= -0.933! USER MOD Single : A 211 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 213 THR OG1 : rot -120:sc= -1.73! USER MOD Single : A 218 MET CE :methyl -128:sc= -3.66 (180deg=-7.05!) USER MOD Single : A 219 TYR OH : rot 180:sc= -2.91! USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 226 THR OG1 : rot 151:sc= 1.2 USER MOD Single : A 228 ASN : amide:sc= -11.1! C(o=-11!,f=-11!) USER MOD Single : A 233 LYS NZ :NH3+ -169:sc= -27.2! (180deg=-28.3!) USER MOD Single : A 239 TYR OH : rot 28:sc= 0.179 USER MOD Single : A 240 MET CE :methyl -125:sc= -1.07 (180deg=-5.42!) USER MOD Single : A 252 THR OG1 : rot 180:sc= 0 USER MOD Single : B 503 THR OG1 : rot -171:sc= 0.349 USER MOD Single : B 506 3GL OH : rot 127:sc= -6.35! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 111 110.957 20.671 -2.253 1.00 0.00 N ATOM 2 CA GLY A 111 111.790 19.448 -2.417 1.00 0.00 C ATOM 3 C GLY A 111 112.510 19.061 -1.140 1.00 0.00 C ATOM 4 O GLY A 111 112.202 19.575 -0.065 1.00 0.00 O ATOM 0 HA2 GLY A 111 111.157 18.621 -2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 111 112.522 19.614 -3.207 1.00 0.00 H new ATOM 8 N ILE A 112 113.470 18.150 -1.260 1.00 0.00 N ATOM 9 CA ILE A 112 114.238 17.692 -0.108 1.00 0.00 C ATOM 10 C ILE A 112 115.076 18.824 0.488 1.00 0.00 C ATOM 11 O ILE A 112 115.953 19.386 -0.168 1.00 0.00 O ATOM 12 CB ILE A 112 115.144 16.498 -0.479 1.00 0.00 C ATOM 13 CG1 ILE A 112 114.300 15.242 -0.736 1.00 0.00 C ATOM 14 CG2 ILE A 112 116.173 16.240 0.613 1.00 0.00 C ATOM 15 CD1 ILE A 112 113.702 14.637 0.516 1.00 0.00 C ATOM 0 H ILE A 112 113.735 17.714 -2.143 1.00 0.00 H new ATOM 0 HA ILE A 112 113.523 17.362 0.645 1.00 0.00 H new ATOM 0 HB ILE A 112 115.679 16.747 -1.396 1.00 0.00 H new ATOM 0 HG12 ILE A 112 113.495 15.493 -1.427 1.00 0.00 H new ATOM 0 HG13 ILE A 112 114.921 14.494 -1.228 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.800 15.395 0.330 1.00 0.00 H new ATOM 0 HG22 ILE A 112 116.795 17.125 0.743 1.00 0.00 H new ATOM 0 HG23 ILE A 112 115.662 16.015 1.549 1.00 0.00 H new ATOM 0 HD11 ILE A 112 113.120 13.754 0.251 1.00 0.00 H new ATOM 0 HD12 ILE A 112 114.501 14.353 1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 112 113.053 15.368 0.999 1.00 0.00 H new ATOM 27 N ASN A 113 114.780 19.140 1.746 1.00 0.00 N ATOM 28 CA ASN A 113 115.468 20.195 2.489 1.00 0.00 C ATOM 29 C ASN A 113 116.532 19.614 3.414 1.00 0.00 C ATOM 30 O ASN A 113 116.263 19.343 4.583 1.00 0.00 O ATOM 31 CB ASN A 113 114.455 20.979 3.324 1.00 0.00 C ATOM 32 CG ASN A 113 113.386 21.631 2.471 1.00 0.00 C ATOM 33 OD1 ASN A 113 113.682 22.460 1.611 1.00 0.00 O ATOM 34 ND2 ASN A 113 112.134 21.259 2.707 1.00 0.00 N ATOM 0 H ASN A 113 114.052 18.669 2.283 1.00 0.00 H new ATOM 0 HA ASN A 113 115.954 20.854 1.769 1.00 0.00 H new ATOM 0 HB2 ASN A 113 113.984 20.308 4.043 1.00 0.00 H new ATOM 0 HB3 ASN A 113 114.976 21.746 3.897 1.00 0.00 H new ATOM 0 HD21 ASN A 113 111.371 21.664 2.165 1.00 0.00 H new ATOM 0 HD22 ASN A 113 111.935 20.568 3.430 1.00 0.00 H new ATOM 41 N LEU A 114 117.739 19.422 2.888 1.00 0.00 N ATOM 42 CA LEU A 114 118.836 18.869 3.679 1.00 0.00 C ATOM 43 C LEU A 114 120.188 19.392 3.195 1.00 0.00 C ATOM 44 O LEU A 114 120.383 19.622 2.003 1.00 0.00 O ATOM 45 CB LEU A 114 118.834 17.337 3.590 1.00 0.00 C ATOM 46 CG LEU A 114 117.511 16.641 3.936 1.00 0.00 C ATOM 47 CD1 LEU A 114 117.551 15.173 3.513 1.00 0.00 C ATOM 48 CD2 LEU A 114 117.218 16.757 5.428 1.00 0.00 C ATOM 0 H LEU A 114 117.982 19.640 1.922 1.00 0.00 H new ATOM 0 HA LEU A 114 118.686 19.182 4.712 1.00 0.00 H new ATOM 0 HB2 LEU A 114 119.116 17.052 2.576 1.00 0.00 H new ATOM 0 HB3 LEU A 114 119.607 16.954 4.256 1.00 0.00 H new ATOM 0 HG LEU A 114 116.710 17.137 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 114 116.604 14.695 3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 114 117.713 15.109 2.437 1.00 0.00 H new ATOM 0 HD13 LEU A 114 118.364 14.666 4.034 1.00 0.00 H new ATOM 0 HD21 LEU A 114 116.276 16.257 5.654 1.00 0.00 H new ATOM 0 HD22 LEU A 114 118.022 16.288 5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 114 117.146 17.809 5.704 1.00 0.00 H new ATOM 60 N THR A 115 121.121 19.556 4.131 1.00 0.00 N ATOM 61 CA THR A 115 122.471 20.024 3.816 1.00 0.00 C ATOM 62 C THR A 115 123.392 18.827 3.597 1.00 0.00 C ATOM 63 O THR A 115 123.253 17.813 4.280 1.00 0.00 O ATOM 64 CB THR A 115 123.032 20.856 4.971 1.00 0.00 C ATOM 65 OG1 THR A 115 123.296 20.038 6.090 1.00 0.00 O ATOM 66 CG2 THR A 115 122.112 21.964 5.432 1.00 0.00 C ATOM 0 H THR A 115 120.965 19.370 5.122 1.00 0.00 H new ATOM 0 HA THR A 115 122.419 20.635 2.915 1.00 0.00 H new ATOM 0 HB THR A 115 123.942 21.307 4.575 1.00 0.00 H new ATOM 0 HG1 THR A 115 124.194 20.231 6.432 1.00 0.00 H new ATOM 0 HG21 THR A 115 122.580 22.508 6.253 1.00 0.00 H new ATOM 0 HG22 THR A 115 121.923 22.648 4.605 1.00 0.00 H new ATOM 0 HG23 THR A 115 121.169 21.536 5.772 1.00 0.00 H new ATOM 74 N PRO A 116 124.364 18.917 2.674 1.00 0.00 N ATOM 75 CA PRO A 116 125.295 17.817 2.431 1.00 0.00 C ATOM 76 C PRO A 116 125.719 17.146 3.735 1.00 0.00 C ATOM 77 O PRO A 116 125.808 15.922 3.815 1.00 0.00 O ATOM 78 CB PRO A 116 126.476 18.516 1.760 1.00 0.00 C ATOM 79 CG PRO A 116 125.857 19.651 1.014 1.00 0.00 C ATOM 80 CD PRO A 116 124.652 20.085 1.818 1.00 0.00 C ATOM 0 HA PRO A 116 124.866 17.017 1.828 1.00 0.00 H new ATOM 0 HB2 PRO A 116 127.199 18.870 2.495 1.00 0.00 H new ATOM 0 HB3 PRO A 116 127.008 17.842 1.089 1.00 0.00 H new ATOM 0 HG2 PRO A 116 126.564 20.473 0.900 1.00 0.00 H new ATOM 0 HG3 PRO A 116 125.564 19.342 0.011 1.00 0.00 H new ATOM 0 HD2 PRO A 116 124.866 20.974 2.412 1.00 0.00 H new ATOM 0 HD3 PRO A 116 123.807 20.328 1.174 1.00 0.00 H new ATOM 88 N GLU A 117 125.954 17.959 4.757 1.00 0.00 N ATOM 89 CA GLU A 117 126.357 17.460 6.068 1.00 0.00 C ATOM 90 C GLU A 117 125.194 16.811 6.814 1.00 0.00 C ATOM 91 O GLU A 117 125.375 15.828 7.536 1.00 0.00 O ATOM 92 CB GLU A 117 126.920 18.609 6.906 1.00 0.00 C ATOM 93 CG GLU A 117 127.131 18.259 8.370 1.00 0.00 C ATOM 94 CD GLU A 117 128.062 17.077 8.564 1.00 0.00 C ATOM 95 OE1 GLU A 117 127.761 15.989 8.032 1.00 0.00 O ATOM 96 OE2 GLU A 117 129.092 17.240 9.252 1.00 0.00 O ATOM 0 H GLU A 117 125.872 18.974 4.703 1.00 0.00 H new ATOM 0 HA GLU A 117 127.121 16.698 5.910 1.00 0.00 H new ATOM 0 HB2 GLU A 117 127.871 18.926 6.478 1.00 0.00 H new ATOM 0 HB3 GLU A 117 126.242 19.460 6.840 1.00 0.00 H new ATOM 0 HG2 GLU A 117 127.538 19.126 8.891 1.00 0.00 H new ATOM 0 HG3 GLU A 117 126.167 18.036 8.828 1.00 0.00 H new ATOM 103 N GLU A 118 124.006 17.368 6.644 1.00 0.00 N ATOM 104 CA GLU A 118 122.816 16.855 7.308 1.00 0.00 C ATOM 105 C GLU A 118 122.290 15.583 6.651 1.00 0.00 C ATOM 106 O GLU A 118 121.724 14.724 7.327 1.00 0.00 O ATOM 107 CB GLU A 118 121.725 17.929 7.349 1.00 0.00 C ATOM 108 CG GLU A 118 121.874 18.921 8.499 1.00 0.00 C ATOM 109 CD GLU A 118 123.267 19.514 8.629 1.00 0.00 C ATOM 110 OE1 GLU A 118 124.179 19.072 7.905 1.00 0.00 O ATOM 111 OE2 GLU A 118 123.447 20.417 9.474 1.00 0.00 O ATOM 0 H GLU A 118 123.839 18.179 6.049 1.00 0.00 H new ATOM 0 HA GLU A 118 123.100 16.595 8.328 1.00 0.00 H new ATOM 0 HB2 GLU A 118 121.733 18.477 6.407 1.00 0.00 H new ATOM 0 HB3 GLU A 118 120.753 17.442 7.426 1.00 0.00 H new ATOM 0 HG2 GLU A 118 121.157 19.731 8.362 1.00 0.00 H new ATOM 0 HG3 GLU A 118 121.615 18.421 9.432 1.00 0.00 H new ATOM 118 N LYS A 119 122.444 15.466 5.332 1.00 0.00 N ATOM 119 CA LYS A 119 121.930 14.284 4.650 1.00 0.00 C ATOM 120 C LYS A 119 122.409 13.039 5.379 1.00 0.00 C ATOM 121 O LYS A 119 121.656 12.101 5.626 1.00 0.00 O ATOM 122 CB LYS A 119 122.391 14.196 3.186 1.00 0.00 C ATOM 123 CG LYS A 119 121.597 15.039 2.194 1.00 0.00 C ATOM 124 CD LYS A 119 122.001 16.502 2.231 1.00 0.00 C ATOM 125 CE LYS A 119 121.628 17.216 0.938 1.00 0.00 C ATOM 126 NZ LYS A 119 122.131 18.617 0.909 1.00 0.00 N ATOM 0 H LYS A 119 122.905 16.151 4.733 1.00 0.00 H new ATOM 0 HA LYS A 119 120.843 14.358 4.656 1.00 0.00 H new ATOM 0 HB2 LYS A 119 123.438 14.496 3.135 1.00 0.00 H new ATOM 0 HB3 LYS A 119 122.342 13.154 2.870 1.00 0.00 H new ATOM 0 HG2 LYS A 119 121.746 14.648 1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 119 120.533 14.952 2.416 1.00 0.00 H new ATOM 0 HD2 LYS A 119 121.514 16.994 3.073 1.00 0.00 H new ATOM 0 HD3 LYS A 119 123.076 16.580 2.394 1.00 0.00 H new ATOM 0 HE2 LYS A 119 122.036 16.667 0.090 1.00 0.00 H new ATOM 0 HE3 LYS A 119 120.544 17.218 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 122.038 19.000 -0.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 121.576 19.199 1.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 123.132 18.633 1.192 1.00 0.00 H new ATOM 140 N PHE A 120 123.708 13.046 5.672 1.00 0.00 N ATOM 141 CA PHE A 120 124.376 11.929 6.326 1.00 0.00 C ATOM 142 C PHE A 120 123.838 11.646 7.727 1.00 0.00 C ATOM 143 O PHE A 120 123.852 10.504 8.186 1.00 0.00 O ATOM 144 CB PHE A 120 125.872 12.210 6.419 1.00 0.00 C ATOM 145 CG PHE A 120 126.427 12.866 5.191 1.00 0.00 C ATOM 146 CD1 PHE A 120 126.175 12.335 3.941 1.00 0.00 C ATOM 147 CD2 PHE A 120 127.204 14.008 5.286 1.00 0.00 C ATOM 148 CE1 PHE A 120 126.681 12.926 2.807 1.00 0.00 C ATOM 149 CE2 PHE A 120 127.717 14.607 4.154 1.00 0.00 C ATOM 150 CZ PHE A 120 127.455 14.066 2.910 1.00 0.00 C ATOM 0 H PHE A 120 124.326 13.830 5.461 1.00 0.00 H new ATOM 0 HA PHE A 120 124.180 11.047 5.716 1.00 0.00 H new ATOM 0 HB2 PHE A 120 126.062 12.849 7.282 1.00 0.00 H new ATOM 0 HB3 PHE A 120 126.401 11.273 6.593 1.00 0.00 H new ATOM 0 HD1 PHE A 120 125.572 11.443 3.853 1.00 0.00 H new ATOM 0 HD2 PHE A 120 127.411 14.434 6.256 1.00 0.00 H new ATOM 0 HE1 PHE A 120 126.474 12.499 1.837 1.00 0.00 H new ATOM 0 HE2 PHE A 120 128.322 15.497 4.240 1.00 0.00 H new ATOM 0 HZ PHE A 120 127.854 14.532 2.021 1.00 0.00 H new ATOM 160 N GLU A 121 123.363 12.683 8.398 1.00 0.00 N ATOM 161 CA GLU A 121 122.820 12.535 9.743 1.00 0.00 C ATOM 162 C GLU A 121 121.546 11.697 9.716 1.00 0.00 C ATOM 163 O GLU A 121 121.217 11.010 10.683 1.00 0.00 O ATOM 164 CB GLU A 121 122.548 13.908 10.359 1.00 0.00 C ATOM 165 CG GLU A 121 123.802 14.750 10.549 1.00 0.00 C ATOM 166 CD GLU A 121 124.773 14.143 11.545 1.00 0.00 C ATOM 167 OE1 GLU A 121 125.316 13.055 11.262 1.00 0.00 O ATOM 168 OE2 GLU A 121 124.988 14.757 12.612 1.00 0.00 O ATOM 0 H GLU A 121 123.341 13.636 8.036 1.00 0.00 H new ATOM 0 HA GLU A 121 123.556 12.019 10.360 1.00 0.00 H new ATOM 0 HB2 GLU A 121 121.849 14.451 9.722 1.00 0.00 H new ATOM 0 HB3 GLU A 121 122.061 13.774 11.325 1.00 0.00 H new ATOM 0 HG2 GLU A 121 124.302 14.870 9.588 1.00 0.00 H new ATOM 0 HG3 GLU A 121 123.517 15.746 10.887 1.00 0.00 H new ATOM 175 N VAL A 122 120.834 11.772 8.602 1.00 0.00 N ATOM 176 CA VAL A 122 119.584 11.040 8.423 1.00 0.00 C ATOM 177 C VAL A 122 119.760 9.756 7.590 1.00 0.00 C ATOM 178 O VAL A 122 119.187 8.729 7.954 1.00 0.00 O ATOM 179 CB VAL A 122 118.494 11.961 7.828 1.00 0.00 C ATOM 180 CG1 VAL A 122 118.906 12.492 6.462 1.00 0.00 C ATOM 181 CG2 VAL A 122 117.144 11.263 7.762 1.00 0.00 C ATOM 0 H VAL A 122 121.103 12.339 7.798 1.00 0.00 H new ATOM 0 HA VAL A 122 119.257 10.715 9.411 1.00 0.00 H new ATOM 0 HB VAL A 122 118.388 12.813 8.499 1.00 0.00 H new ATOM 0 HG11 VAL A 122 118.119 13.136 6.070 1.00 0.00 H new ATOM 0 HG12 VAL A 122 119.829 13.064 6.557 1.00 0.00 H new ATOM 0 HG13 VAL A 122 119.065 11.657 5.780 1.00 0.00 H new ATOM 0 HG21 VAL A 122 116.404 11.942 7.338 1.00 0.00 H new ATOM 0 HG22 VAL A 122 117.224 10.375 7.134 1.00 0.00 H new ATOM 0 HG23 VAL A 122 116.836 10.971 8.766 1.00 0.00 H new ATOM 191 N PHE A 123 120.537 9.768 6.500 1.00 0.00 N ATOM 192 CA PHE A 123 120.725 8.539 5.703 1.00 0.00 C ATOM 193 C PHE A 123 122.155 8.016 5.828 1.00 0.00 C ATOM 194 O PHE A 123 122.385 6.815 5.968 1.00 0.00 O ATOM 195 CB PHE A 123 120.429 8.820 4.237 1.00 0.00 C ATOM 196 CG PHE A 123 119.131 9.531 4.020 1.00 0.00 C ATOM 197 CD1 PHE A 123 117.933 8.863 4.170 1.00 0.00 C ATOM 198 CD2 PHE A 123 119.114 10.870 3.674 1.00 0.00 C ATOM 199 CE1 PHE A 123 116.732 9.515 3.976 1.00 0.00 C ATOM 200 CE2 PHE A 123 117.916 11.531 3.478 1.00 0.00 C ATOM 201 CZ PHE A 123 116.723 10.851 3.628 1.00 0.00 C ATOM 0 H PHE A 123 121.035 10.588 6.153 1.00 0.00 H new ATOM 0 HA PHE A 123 120.038 7.784 6.086 1.00 0.00 H new ATOM 0 HB2 PHE A 123 121.238 9.419 3.819 1.00 0.00 H new ATOM 0 HB3 PHE A 123 120.415 7.878 3.689 1.00 0.00 H new ATOM 0 HD1 PHE A 123 117.935 7.818 4.442 1.00 0.00 H new ATOM 0 HD2 PHE A 123 120.045 11.404 3.556 1.00 0.00 H new ATOM 0 HE1 PHE A 123 115.801 8.981 4.096 1.00 0.00 H new ATOM 0 HE2 PHE A 123 117.913 12.577 3.208 1.00 0.00 H new ATOM 0 HZ PHE A 123 115.785 11.363 3.473 1.00 0.00 H new ATOM 211 N GLY A 124 123.101 8.940 5.799 1.00 0.00 N ATOM 212 CA GLY A 124 124.502 8.583 5.935 1.00 0.00 C ATOM 213 C GLY A 124 125.186 8.144 4.648 1.00 0.00 C ATOM 214 O GLY A 124 125.483 6.964 4.478 1.00 0.00 O ATOM 0 H GLY A 124 122.925 9.938 5.683 1.00 0.00 H new ATOM 0 HA2 GLY A 124 125.041 9.439 6.340 1.00 0.00 H new ATOM 0 HA3 GLY A 124 124.586 7.778 6.665 1.00 0.00 H new ATOM 218 N ASP A 125 125.455 9.113 3.767 1.00 0.00 N ATOM 219 CA ASP A 125 126.147 8.881 2.486 1.00 0.00 C ATOM 220 C ASP A 125 125.202 8.975 1.293 1.00 0.00 C ATOM 221 O ASP A 125 125.631 9.284 0.181 1.00 0.00 O ATOM 222 CB ASP A 125 126.873 7.529 2.461 1.00 0.00 C ATOM 223 CG ASP A 125 127.833 7.365 3.623 1.00 0.00 C ATOM 224 OD1 ASP A 125 127.922 8.293 4.455 1.00 0.00 O ATOM 225 OD2 ASP A 125 128.496 6.309 3.702 1.00 0.00 O ATOM 0 H ASP A 125 125.199 10.088 3.920 1.00 0.00 H new ATOM 0 HA ASP A 125 126.887 9.676 2.402 1.00 0.00 H new ATOM 0 HB2 ASP A 125 126.138 6.725 2.485 1.00 0.00 H new ATOM 0 HB3 ASP A 125 127.421 7.432 1.524 1.00 0.00 H new ATOM 230 N PHE A 126 123.925 8.703 1.515 1.00 0.00 N ATOM 231 CA PHE A 126 122.943 8.755 0.436 1.00 0.00 C ATOM 232 C PHE A 126 122.596 10.195 0.063 1.00 0.00 C ATOM 233 O PHE A 126 122.080 10.959 0.879 1.00 0.00 O ATOM 234 CB PHE A 126 121.684 7.984 0.836 1.00 0.00 C ATOM 235 CG PHE A 126 120.426 8.483 0.181 1.00 0.00 C ATOM 236 CD1 PHE A 126 119.751 9.567 0.713 1.00 0.00 C ATOM 237 CD2 PHE A 126 119.925 7.881 -0.959 1.00 0.00 C ATOM 238 CE1 PHE A 126 118.597 10.044 0.124 1.00 0.00 C ATOM 239 CE2 PHE A 126 118.770 8.352 -1.555 1.00 0.00 C ATOM 240 CZ PHE A 126 118.104 9.437 -1.011 1.00 0.00 C ATOM 0 H PHE A 126 123.544 8.445 2.425 1.00 0.00 H new ATOM 0 HA PHE A 126 123.382 8.286 -0.444 1.00 0.00 H new ATOM 0 HB2 PHE A 126 121.820 6.932 0.584 1.00 0.00 H new ATOM 0 HB3 PHE A 126 121.565 8.040 1.918 1.00 0.00 H new ATOM 0 HD1 PHE A 126 120.132 10.047 1.602 1.00 0.00 H new ATOM 0 HD2 PHE A 126 120.441 7.035 -1.388 1.00 0.00 H new ATOM 0 HE1 PHE A 126 118.082 10.891 0.552 1.00 0.00 H new ATOM 0 HE2 PHE A 126 118.387 7.874 -2.445 1.00 0.00 H new ATOM 0 HZ PHE A 126 117.201 9.807 -1.474 1.00 0.00 H new ATOM 250 N ASP A 127 122.883 10.549 -1.188 1.00 0.00 N ATOM 251 CA ASP A 127 122.605 11.885 -1.706 1.00 0.00 C ATOM 252 C ASP A 127 121.490 11.818 -2.754 1.00 0.00 C ATOM 253 O ASP A 127 121.675 11.225 -3.817 1.00 0.00 O ATOM 254 CB ASP A 127 123.868 12.473 -2.334 1.00 0.00 C ATOM 255 CG ASP A 127 123.659 13.890 -2.829 1.00 0.00 C ATOM 256 OD1 ASP A 127 123.335 14.766 -2.000 1.00 0.00 O ATOM 257 OD2 ASP A 127 123.818 14.123 -4.044 1.00 0.00 O ATOM 0 H ASP A 127 123.313 9.921 -1.867 1.00 0.00 H new ATOM 0 HA ASP A 127 122.284 12.523 -0.883 1.00 0.00 H new ATOM 0 HB2 ASP A 127 124.674 12.462 -1.601 1.00 0.00 H new ATOM 0 HB3 ASP A 127 124.185 11.843 -3.165 1.00 0.00 H new ATOM 262 N PRO A 128 120.309 12.404 -2.476 1.00 0.00 N ATOM 263 CA PRO A 128 119.180 12.370 -3.414 1.00 0.00 C ATOM 264 C PRO A 128 119.399 13.218 -4.666 1.00 0.00 C ATOM 265 O PRO A 128 118.948 12.851 -5.749 1.00 0.00 O ATOM 266 CB PRO A 128 118.009 12.911 -2.587 1.00 0.00 C ATOM 267 CG PRO A 128 118.643 13.765 -1.545 1.00 0.00 C ATOM 268 CD PRO A 128 119.972 13.128 -1.233 1.00 0.00 C ATOM 0 HA PRO A 128 119.020 11.364 -3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 128 117.320 13.487 -3.205 1.00 0.00 H new ATOM 0 HB3 PRO A 128 117.434 12.101 -2.139 1.00 0.00 H new ATOM 0 HG2 PRO A 128 118.775 14.785 -1.905 1.00 0.00 H new ATOM 0 HG3 PRO A 128 118.018 13.820 -0.653 1.00 0.00 H new ATOM 0 HD2 PRO A 128 120.727 13.875 -0.987 1.00 0.00 H new ATOM 0 HD3 PRO A 128 119.903 12.452 -0.381 1.00 0.00 H new ATOM 276 N ASP A 129 120.074 14.356 -4.522 1.00 0.00 N ATOM 277 CA ASP A 129 120.312 15.229 -5.668 1.00 0.00 C ATOM 278 C ASP A 129 121.040 14.475 -6.778 1.00 0.00 C ATOM 279 O ASP A 129 120.588 14.447 -7.922 1.00 0.00 O ATOM 280 CB ASP A 129 121.116 16.462 -5.250 1.00 0.00 C ATOM 281 CG ASP A 129 120.397 17.295 -4.208 1.00 0.00 C ATOM 282 OD1 ASP A 129 119.279 17.772 -4.498 1.00 0.00 O ATOM 283 OD2 ASP A 129 120.950 17.471 -3.102 1.00 0.00 O ATOM 0 H ASP A 129 120.460 14.691 -3.639 1.00 0.00 H new ATOM 0 HA ASP A 129 119.345 15.558 -6.049 1.00 0.00 H new ATOM 0 HB2 ASP A 129 122.082 16.146 -4.855 1.00 0.00 H new ATOM 0 HB3 ASP A 129 121.316 17.077 -6.128 1.00 0.00 H new ATOM 288 N GLN A 130 122.169 13.870 -6.444 1.00 0.00 N ATOM 289 CA GLN A 130 122.942 13.124 -7.428 1.00 0.00 C ATOM 290 C GLN A 130 122.104 12.021 -8.067 1.00 0.00 C ATOM 291 O GLN A 130 122.162 11.816 -9.279 1.00 0.00 O ATOM 292 CB GLN A 130 124.202 12.543 -6.790 1.00 0.00 C ATOM 293 CG GLN A 130 125.275 13.587 -6.531 1.00 0.00 C ATOM 294 CD GLN A 130 125.988 14.020 -7.798 1.00 0.00 C ATOM 295 OE1 GLN A 130 125.371 14.547 -8.724 1.00 0.00 O ATOM 296 NE2 GLN A 130 127.297 13.799 -7.844 1.00 0.00 N ATOM 0 H GLN A 130 122.570 13.880 -5.506 1.00 0.00 H new ATOM 0 HA GLN A 130 123.240 13.815 -8.216 1.00 0.00 H new ATOM 0 HB2 GLN A 130 123.937 12.062 -5.848 1.00 0.00 H new ATOM 0 HB3 GLN A 130 124.607 11.768 -7.441 1.00 0.00 H new ATOM 0 HG2 GLN A 130 124.822 14.458 -6.058 1.00 0.00 H new ATOM 0 HG3 GLN A 130 126.004 13.186 -5.827 1.00 0.00 H new ATOM 0 HE21 GLN A 130 127.768 13.359 -7.053 1.00 0.00 H new ATOM 0 HE22 GLN A 130 127.831 14.069 -8.670 1.00 0.00 H new ATOM 305 N TYR A 131 121.322 11.312 -7.256 1.00 0.00 N ATOM 306 CA TYR A 131 120.477 10.237 -7.768 1.00 0.00 C ATOM 307 C TYR A 131 119.206 10.802 -8.392 1.00 0.00 C ATOM 308 O TYR A 131 118.567 10.146 -9.214 1.00 0.00 O ATOM 309 CB TYR A 131 120.113 9.255 -6.652 1.00 0.00 C ATOM 310 CG TYR A 131 121.298 8.754 -5.846 1.00 0.00 C ATOM 311 CD1 TYR A 131 122.612 8.995 -6.247 1.00 0.00 C ATOM 312 CD2 TYR A 131 121.097 8.031 -4.677 1.00 0.00 C ATOM 313 CE1 TYR A 131 123.680 8.530 -5.503 1.00 0.00 C ATOM 314 CE2 TYR A 131 122.162 7.566 -3.931 1.00 0.00 C ATOM 315 CZ TYR A 131 123.450 7.818 -4.347 1.00 0.00 C ATOM 316 OH TYR A 131 124.511 7.356 -3.604 1.00 0.00 O ATOM 0 H TYR A 131 121.256 11.461 -6.249 1.00 0.00 H new ATOM 0 HA TYR A 131 121.040 9.705 -8.535 1.00 0.00 H new ATOM 0 HB2 TYR A 131 119.407 9.738 -5.976 1.00 0.00 H new ATOM 0 HB3 TYR A 131 119.600 8.399 -7.091 1.00 0.00 H new ATOM 0 HD1 TYR A 131 122.798 9.553 -7.153 1.00 0.00 H new ATOM 0 HD2 TYR A 131 120.089 7.829 -4.345 1.00 0.00 H new ATOM 0 HE1 TYR A 131 124.692 8.724 -5.827 1.00 0.00 H new ATOM 0 HE2 TYR A 131 121.985 7.007 -3.024 1.00 0.00 H new ATOM 0 HH TYR A 131 124.176 6.874 -2.819 1.00 0.00 H new ATOM 326 N GLU A 132 118.849 12.030 -8.016 1.00 0.00 N ATOM 327 CA GLU A 132 117.662 12.671 -8.570 1.00 0.00 C ATOM 328 C GLU A 132 117.777 12.730 -10.085 1.00 0.00 C ATOM 329 O GLU A 132 116.844 12.388 -10.811 1.00 0.00 O ATOM 330 CB GLU A 132 117.473 14.074 -7.986 1.00 0.00 C ATOM 331 CG GLU A 132 116.566 14.969 -8.815 1.00 0.00 C ATOM 332 CD GLU A 132 115.276 14.287 -9.216 1.00 0.00 C ATOM 333 OE1 GLU A 132 114.512 13.881 -8.315 1.00 0.00 O ATOM 334 OE2 GLU A 132 115.031 14.160 -10.434 1.00 0.00 O ATOM 0 H GLU A 132 119.360 12.594 -7.337 1.00 0.00 H new ATOM 0 HA GLU A 132 116.786 12.081 -8.301 1.00 0.00 H new ATOM 0 HB2 GLU A 132 117.060 13.986 -6.981 1.00 0.00 H new ATOM 0 HB3 GLU A 132 118.448 14.551 -7.889 1.00 0.00 H new ATOM 0 HG2 GLU A 132 116.334 15.870 -8.247 1.00 0.00 H new ATOM 0 HG3 GLU A 132 117.098 15.286 -9.712 1.00 0.00 H new ATOM 341 N GLU A 133 118.942 13.154 -10.549 1.00 0.00 N ATOM 342 CA GLU A 133 119.217 13.247 -11.971 1.00 0.00 C ATOM 343 C GLU A 133 119.197 11.860 -12.602 1.00 0.00 C ATOM 344 O GLU A 133 118.697 11.666 -13.710 1.00 0.00 O ATOM 345 CB GLU A 133 120.596 13.874 -12.181 1.00 0.00 C ATOM 346 CG GLU A 133 120.817 15.145 -11.376 1.00 0.00 C ATOM 347 CD GLU A 133 119.907 16.280 -11.808 1.00 0.00 C ATOM 348 OE1 GLU A 133 119.120 16.082 -12.757 1.00 0.00 O ATOM 349 OE2 GLU A 133 119.986 17.367 -11.199 1.00 0.00 O ATOM 0 H GLU A 133 119.718 13.441 -9.953 1.00 0.00 H new ATOM 0 HA GLU A 133 118.451 13.865 -12.440 1.00 0.00 H new ATOM 0 HB2 GLU A 133 121.361 13.146 -11.912 1.00 0.00 H new ATOM 0 HB3 GLU A 133 120.727 14.097 -13.240 1.00 0.00 H new ATOM 0 HG2 GLU A 133 120.651 14.934 -10.320 1.00 0.00 H new ATOM 0 HG3 GLU A 133 121.856 15.459 -11.479 1.00 0.00 H new ATOM 356 N GLU A 134 119.788 10.907 -11.885 1.00 0.00 N ATOM 357 CA GLU A 134 119.895 9.532 -12.357 1.00 0.00 C ATOM 358 C GLU A 134 118.525 8.873 -12.547 1.00 0.00 C ATOM 359 O GLU A 134 118.295 8.207 -13.556 1.00 0.00 O ATOM 360 CB GLU A 134 120.752 8.711 -11.391 1.00 0.00 C ATOM 361 CG GLU A 134 120.988 7.278 -11.836 1.00 0.00 C ATOM 362 CD GLU A 134 121.737 7.183 -13.152 1.00 0.00 C ATOM 363 OE1 GLU A 134 121.196 7.642 -14.180 1.00 0.00 O ATOM 364 OE2 GLU A 134 122.865 6.647 -13.154 1.00 0.00 O ATOM 0 H GLU A 134 120.203 11.066 -10.967 1.00 0.00 H new ATOM 0 HA GLU A 134 120.375 9.560 -13.335 1.00 0.00 H new ATOM 0 HB2 GLU A 134 121.716 9.205 -11.267 1.00 0.00 H new ATOM 0 HB3 GLU A 134 120.271 8.702 -10.413 1.00 0.00 H new ATOM 0 HG2 GLU A 134 121.551 6.752 -11.065 1.00 0.00 H new ATOM 0 HG3 GLU A 134 120.028 6.770 -11.933 1.00 0.00 H new ATOM 371 N VAL A 135 117.613 9.057 -11.590 1.00 0.00 N ATOM 372 CA VAL A 135 116.284 8.466 -11.706 1.00 0.00 C ATOM 373 C VAL A 135 115.517 9.119 -12.839 1.00 0.00 C ATOM 374 O VAL A 135 114.715 8.477 -13.517 1.00 0.00 O ATOM 375 CB VAL A 135 115.457 8.556 -10.402 1.00 0.00 C ATOM 376 CG1 VAL A 135 116.070 7.689 -9.319 1.00 0.00 C ATOM 377 CG2 VAL A 135 115.322 9.989 -9.920 1.00 0.00 C ATOM 0 H VAL A 135 117.768 9.601 -10.741 1.00 0.00 H new ATOM 0 HA VAL A 135 116.438 7.407 -11.914 1.00 0.00 H new ATOM 0 HB VAL A 135 114.456 8.186 -10.624 1.00 0.00 H new ATOM 0 HG11 VAL A 135 115.474 7.766 -8.410 1.00 0.00 H new ATOM 0 HG12 VAL A 135 116.091 6.651 -9.652 1.00 0.00 H new ATOM 0 HG13 VAL A 135 117.087 8.025 -9.116 1.00 0.00 H new ATOM 0 HG21 VAL A 135 114.735 10.010 -9.002 1.00 0.00 H new ATOM 0 HG22 VAL A 135 116.312 10.403 -9.727 1.00 0.00 H new ATOM 0 HG23 VAL A 135 114.822 10.584 -10.684 1.00 0.00 H new ATOM 387 N ARG A 136 115.778 10.400 -13.043 1.00 0.00 N ATOM 388 CA ARG A 136 115.116 11.135 -14.103 1.00 0.00 C ATOM 389 C ARG A 136 115.408 10.468 -15.449 1.00 0.00 C ATOM 390 O ARG A 136 114.513 10.288 -16.267 1.00 0.00 O ATOM 391 CB ARG A 136 115.551 12.606 -14.101 1.00 0.00 C ATOM 392 CG ARG A 136 114.910 13.454 -15.191 1.00 0.00 C ATOM 393 CD ARG A 136 113.445 13.742 -14.898 1.00 0.00 C ATOM 394 NE ARG A 136 112.847 14.620 -15.902 1.00 0.00 N ATOM 395 CZ ARG A 136 113.237 15.875 -16.111 1.00 0.00 C ATOM 396 NH1 ARG A 136 114.201 16.405 -15.372 1.00 0.00 N ATOM 397 NH2 ARG A 136 112.658 16.603 -17.056 1.00 0.00 N ATOM 0 H ARG A 136 116.439 10.947 -12.492 1.00 0.00 H new ATOM 0 HA ARG A 136 114.040 11.116 -13.933 1.00 0.00 H new ATOM 0 HB2 ARG A 136 115.311 13.042 -13.131 1.00 0.00 H new ATOM 0 HB3 ARG A 136 116.634 12.652 -14.212 1.00 0.00 H new ATOM 0 HG2 ARG A 136 115.453 14.394 -15.286 1.00 0.00 H new ATOM 0 HG3 ARG A 136 114.994 12.939 -16.148 1.00 0.00 H new ATOM 0 HD2 ARG A 136 112.892 12.804 -14.861 1.00 0.00 H new ATOM 0 HD3 ARG A 136 113.356 14.203 -13.914 1.00 0.00 H new ATOM 0 HE ARG A 136 112.088 14.250 -16.475 1.00 0.00 H new ATOM 0 HH11 ARG A 136 114.646 15.851 -14.641 1.00 0.00 H new ATOM 0 HH12 ARG A 136 114.498 17.367 -15.535 1.00 0.00 H new ATOM 0 HH21 ARG A 136 111.912 16.201 -17.624 1.00 0.00 H new ATOM 0 HH22 ARG A 136 112.958 17.565 -17.215 1.00 0.00 H new ATOM 411 N GLU A 137 116.664 10.103 -15.673 1.00 0.00 N ATOM 412 CA GLU A 137 117.057 9.456 -16.924 1.00 0.00 C ATOM 413 C GLU A 137 116.570 8.003 -16.983 1.00 0.00 C ATOM 414 O GLU A 137 116.148 7.528 -18.038 1.00 0.00 O ATOM 415 CB GLU A 137 118.580 9.522 -17.090 1.00 0.00 C ATOM 416 CG GLU A 137 119.102 8.916 -18.390 1.00 0.00 C ATOM 417 CD GLU A 137 119.294 7.410 -18.320 1.00 0.00 C ATOM 418 OE1 GLU A 137 118.294 6.684 -18.149 1.00 0.00 O ATOM 419 OE2 GLU A 137 120.452 6.957 -18.439 1.00 0.00 O ATOM 0 H GLU A 137 117.427 10.242 -15.010 1.00 0.00 H new ATOM 0 HA GLU A 137 116.585 9.992 -17.747 1.00 0.00 H new ATOM 0 HB2 GLU A 137 118.894 10.565 -17.038 1.00 0.00 H new ATOM 0 HB3 GLU A 137 119.047 9.007 -16.251 1.00 0.00 H new ATOM 0 HG2 GLU A 137 118.406 9.149 -19.196 1.00 0.00 H new ATOM 0 HG3 GLU A 137 120.053 9.385 -18.645 1.00 0.00 H new ATOM 426 N ARG A 138 116.640 7.302 -15.855 1.00 0.00 N ATOM 427 CA ARG A 138 116.217 5.898 -15.790 1.00 0.00 C ATOM 428 C ARG A 138 114.723 5.722 -16.065 1.00 0.00 C ATOM 429 O ARG A 138 114.332 4.957 -16.947 1.00 0.00 O ATOM 430 CB ARG A 138 116.539 5.309 -14.410 1.00 0.00 C ATOM 431 CG ARG A 138 118.011 4.996 -14.199 1.00 0.00 C ATOM 432 CD ARG A 138 118.356 4.864 -12.722 1.00 0.00 C ATOM 433 NE ARG A 138 117.698 3.727 -12.080 1.00 0.00 N ATOM 434 CZ ARG A 138 117.978 2.457 -12.357 1.00 0.00 C ATOM 435 NH1 ARG A 138 118.850 2.159 -13.311 1.00 0.00 N ATOM 436 NH2 ARG A 138 117.385 1.482 -11.678 1.00 0.00 N ATOM 0 H ARG A 138 116.985 7.679 -14.972 1.00 0.00 H new ATOM 0 HA ARG A 138 116.769 5.371 -16.568 1.00 0.00 H new ATOM 0 HB2 ARG A 138 116.214 6.011 -13.642 1.00 0.00 H new ATOM 0 HB3 ARG A 138 115.961 4.395 -14.272 1.00 0.00 H new ATOM 0 HG2 ARG A 138 118.263 4.070 -14.715 1.00 0.00 H new ATOM 0 HG3 ARG A 138 118.618 5.784 -14.645 1.00 0.00 H new ATOM 0 HD2 ARG A 138 119.436 4.760 -12.615 1.00 0.00 H new ATOM 0 HD3 ARG A 138 118.072 5.780 -12.205 1.00 0.00 H new ATOM 0 HE ARG A 138 116.983 3.919 -11.379 1.00 0.00 H new ATOM 0 HH11 ARG A 138 119.308 2.905 -13.835 1.00 0.00 H new ATOM 0 HH12 ARG A 138 119.063 1.184 -13.521 1.00 0.00 H new ATOM 0 HH21 ARG A 138 116.714 1.707 -10.943 1.00 0.00 H new ATOM 0 HH22 ARG A 138 117.600 0.508 -11.891 1.00 0.00 H new ATOM 450 N TRP A 139 113.897 6.393 -15.272 1.00 0.00 N ATOM 451 CA TRP A 139 112.446 6.274 -15.387 1.00 0.00 C ATOM 452 C TRP A 139 111.789 7.561 -15.891 1.00 0.00 C ATOM 453 O TRP A 139 110.766 7.520 -16.568 1.00 0.00 O ATOM 454 CB TRP A 139 111.914 5.878 -14.011 1.00 0.00 C ATOM 455 CG TRP A 139 112.598 4.634 -13.514 1.00 0.00 C ATOM 456 CD1 TRP A 139 112.659 3.437 -14.168 1.00 0.00 C ATOM 457 CD2 TRP A 139 113.339 4.459 -12.292 1.00 0.00 C ATOM 458 NE1 TRP A 139 113.389 2.533 -13.438 1.00 0.00 N ATOM 459 CE2 TRP A 139 113.815 3.132 -12.283 1.00 0.00 C ATOM 460 CE3 TRP A 139 113.649 5.286 -11.205 1.00 0.00 C ATOM 461 CZ2 TRP A 139 114.582 2.617 -11.239 1.00 0.00 C ATOM 462 CZ3 TRP A 139 114.411 4.768 -10.166 1.00 0.00 C ATOM 463 CH2 TRP A 139 114.869 3.445 -10.194 1.00 0.00 C ATOM 0 H TRP A 139 114.208 7.029 -14.538 1.00 0.00 H new ATOM 0 HA TRP A 139 112.199 5.516 -16.130 1.00 0.00 H new ATOM 0 HB2 TRP A 139 112.074 6.693 -13.305 1.00 0.00 H new ATOM 0 HB3 TRP A 139 110.838 5.710 -14.066 1.00 0.00 H new ATOM 0 HD1 TRP A 139 112.199 3.231 -15.123 1.00 0.00 H new ATOM 0 HE1 TRP A 139 113.583 1.570 -13.712 1.00 0.00 H new ATOM 0 HE3 TRP A 139 113.302 6.308 -11.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 114.937 1.597 -11.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 114.655 5.396 -9.322 1.00 0.00 H new ATOM 0 HH2 TRP A 139 115.462 3.073 -9.371 1.00 0.00 H new ATOM 474 N GLY A 140 112.416 8.687 -15.579 1.00 0.00 N ATOM 475 CA GLY A 140 111.943 9.997 -16.018 1.00 0.00 C ATOM 476 C GLY A 140 110.465 10.085 -16.381 1.00 0.00 C ATOM 477 O GLY A 140 110.114 10.841 -17.284 1.00 0.00 O ATOM 0 H GLY A 140 113.266 8.720 -15.016 1.00 0.00 H new ATOM 0 HA2 GLY A 140 112.146 10.719 -15.227 1.00 0.00 H new ATOM 0 HA3 GLY A 140 112.529 10.301 -16.885 1.00 0.00 H new ATOM 481 N ASN A 141 109.594 9.348 -15.696 1.00 0.00 N ATOM 482 CA ASN A 141 108.158 9.413 -16.005 1.00 0.00 C ATOM 483 C ASN A 141 107.337 8.317 -15.324 1.00 0.00 C ATOM 484 O ASN A 141 106.226 8.020 -15.762 1.00 0.00 O ATOM 485 CB ASN A 141 107.912 9.370 -17.523 1.00 0.00 C ATOM 486 CG ASN A 141 108.746 8.323 -18.235 1.00 0.00 C ATOM 487 OD1 ASN A 141 109.961 8.464 -18.367 1.00 0.00 O ATOM 488 ND2 ASN A 141 108.094 7.264 -18.701 1.00 0.00 N ATOM 0 H ASN A 141 109.844 8.711 -14.939 1.00 0.00 H new ATOM 0 HA ASN A 141 107.819 10.368 -15.604 1.00 0.00 H new ATOM 0 HB2 ASN A 141 106.856 9.171 -17.708 1.00 0.00 H new ATOM 0 HB3 ASN A 141 108.131 10.350 -17.948 1.00 0.00 H new ATOM 0 HD21 ASN A 141 108.602 6.527 -19.191 1.00 0.00 H new ATOM 0 HD22 ASN A 141 107.085 7.187 -18.569 1.00 0.00 H new ATOM 495 N THR A 142 107.853 7.728 -14.252 1.00 0.00 N ATOM 496 CA THR A 142 107.110 6.691 -13.540 1.00 0.00 C ATOM 497 C THR A 142 106.250 7.307 -12.437 1.00 0.00 C ATOM 498 O THR A 142 106.611 8.327 -11.852 1.00 0.00 O ATOM 499 CB THR A 142 108.071 5.661 -12.947 1.00 0.00 C ATOM 500 OG1 THR A 142 107.367 4.712 -12.167 1.00 0.00 O ATOM 501 CG2 THR A 142 109.143 6.273 -12.073 1.00 0.00 C ATOM 0 H THR A 142 108.769 7.945 -13.860 1.00 0.00 H new ATOM 0 HA THR A 142 106.454 6.189 -14.251 1.00 0.00 H new ATOM 0 HB THR A 142 108.553 5.189 -13.803 1.00 0.00 H new ATOM 0 HG1 THR A 142 107.998 4.060 -11.797 1.00 0.00 H new ATOM 0 HG21 THR A 142 109.790 5.486 -11.685 1.00 0.00 H new ATOM 0 HG22 THR A 142 109.736 6.973 -12.661 1.00 0.00 H new ATOM 0 HG23 THR A 142 108.677 6.802 -11.242 1.00 0.00 H new ATOM 509 N ASP A 143 105.100 6.691 -12.175 1.00 0.00 N ATOM 510 CA ASP A 143 104.175 7.193 -11.159 1.00 0.00 C ATOM 511 C ASP A 143 104.810 7.200 -9.770 1.00 0.00 C ATOM 512 O ASP A 143 104.754 8.208 -9.065 1.00 0.00 O ATOM 513 CB ASP A 143 102.882 6.376 -11.152 1.00 0.00 C ATOM 514 CG ASP A 143 101.893 6.868 -10.114 1.00 0.00 C ATOM 515 OD1 ASP A 143 101.485 8.045 -10.194 1.00 0.00 O ATOM 516 OD2 ASP A 143 101.525 6.074 -9.223 1.00 0.00 O ATOM 0 H ASP A 143 104.786 5.845 -12.650 1.00 0.00 H new ATOM 0 HA ASP A 143 103.935 8.224 -11.418 1.00 0.00 H new ATOM 0 HB2 ASP A 143 102.421 6.421 -12.139 1.00 0.00 H new ATOM 0 HB3 ASP A 143 103.118 5.330 -10.958 1.00 0.00 H new ATOM 521 N ALA A 144 105.399 6.082 -9.371 1.00 0.00 N ATOM 522 CA ALA A 144 106.021 5.987 -8.056 1.00 0.00 C ATOM 523 C ALA A 144 106.961 7.162 -7.808 1.00 0.00 C ATOM 524 O ALA A 144 107.022 7.700 -6.702 1.00 0.00 O ATOM 525 CB ALA A 144 106.787 4.678 -7.941 1.00 0.00 C ATOM 0 H ALA A 144 105.460 5.233 -9.933 1.00 0.00 H new ATOM 0 HA ALA A 144 105.234 6.015 -7.302 1.00 0.00 H new ATOM 0 HB1 ALA A 144 107.250 4.613 -6.956 1.00 0.00 H new ATOM 0 HB2 ALA A 144 106.101 3.842 -8.076 1.00 0.00 H new ATOM 0 HB3 ALA A 144 107.560 4.640 -8.708 1.00 0.00 H new ATOM 531 N TYR A 145 107.696 7.551 -8.843 1.00 0.00 N ATOM 532 CA TYR A 145 108.641 8.658 -8.747 1.00 0.00 C ATOM 533 C TYR A 145 107.932 10.008 -8.650 1.00 0.00 C ATOM 534 O TYR A 145 108.259 10.832 -7.796 1.00 0.00 O ATOM 535 CB TYR A 145 109.562 8.666 -9.966 1.00 0.00 C ATOM 536 CG TYR A 145 110.499 9.854 -10.033 1.00 0.00 C ATOM 537 CD1 TYR A 145 110.842 10.578 -8.895 1.00 0.00 C ATOM 538 CD2 TYR A 145 111.044 10.249 -11.248 1.00 0.00 C ATOM 539 CE1 TYR A 145 111.696 11.658 -8.970 1.00 0.00 C ATOM 540 CE2 TYR A 145 111.898 11.331 -11.329 1.00 0.00 C ATOM 541 CZ TYR A 145 112.220 12.031 -10.188 1.00 0.00 C ATOM 542 OH TYR A 145 113.066 13.110 -10.265 1.00 0.00 O ATOM 0 H TYR A 145 107.655 7.114 -9.764 1.00 0.00 H new ATOM 0 HA TYR A 145 109.221 8.510 -7.836 1.00 0.00 H new ATOM 0 HB2 TYR A 145 110.154 7.751 -9.965 1.00 0.00 H new ATOM 0 HB3 TYR A 145 108.951 8.649 -10.868 1.00 0.00 H new ATOM 0 HD1 TYR A 145 110.433 10.289 -7.938 1.00 0.00 H new ATOM 0 HD2 TYR A 145 110.796 9.701 -12.145 1.00 0.00 H new ATOM 0 HE1 TYR A 145 111.953 12.209 -8.077 1.00 0.00 H new ATOM 0 HE2 TYR A 145 112.311 11.627 -12.282 1.00 0.00 H new ATOM 0 HH TYR A 145 113.960 12.807 -10.528 1.00 0.00 H new ATOM 552 N ARG A 146 106.971 10.235 -9.538 1.00 0.00 N ATOM 553 CA ARG A 146 106.240 11.496 -9.556 1.00 0.00 C ATOM 554 C ARG A 146 105.596 11.797 -8.208 1.00 0.00 C ATOM 555 O ARG A 146 105.532 12.955 -7.794 1.00 0.00 O ATOM 556 CB ARG A 146 105.183 11.502 -10.662 1.00 0.00 C ATOM 557 CG ARG A 146 105.774 11.539 -12.063 1.00 0.00 C ATOM 558 CD ARG A 146 104.716 11.852 -13.110 1.00 0.00 C ATOM 559 NE ARG A 146 103.683 10.822 -13.178 1.00 0.00 N ATOM 560 CZ ARG A 146 103.912 9.576 -13.576 1.00 0.00 C ATOM 561 NH1 ARG A 146 105.130 9.210 -13.951 1.00 0.00 N ATOM 562 NH2 ARG A 146 102.923 8.693 -13.601 1.00 0.00 N ATOM 0 H ARG A 146 106.681 9.566 -10.251 1.00 0.00 H new ATOM 0 HA ARG A 146 106.966 12.283 -9.762 1.00 0.00 H new ATOM 0 HB2 ARG A 146 104.559 10.614 -10.562 1.00 0.00 H new ATOM 0 HB3 ARG A 146 104.532 12.366 -10.527 1.00 0.00 H new ATOM 0 HG2 ARG A 146 106.562 12.290 -12.106 1.00 0.00 H new ATOM 0 HG3 ARG A 146 106.237 10.578 -12.289 1.00 0.00 H new ATOM 0 HD2 ARG A 146 104.254 12.812 -12.881 1.00 0.00 H new ATOM 0 HD3 ARG A 146 105.192 11.952 -14.086 1.00 0.00 H new ATOM 0 HE ARG A 146 102.733 11.074 -12.905 1.00 0.00 H new ATOM 0 HH11 ARG A 146 105.894 9.886 -13.934 1.00 0.00 H new ATOM 0 HH12 ARG A 146 105.303 8.252 -14.256 1.00 0.00 H new ATOM 0 HH21 ARG A 146 101.984 8.970 -13.314 1.00 0.00 H new ATOM 0 HH22 ARG A 146 103.101 7.736 -13.907 1.00 0.00 H new ATOM 576 N GLN A 147 105.116 10.766 -7.520 1.00 0.00 N ATOM 577 CA GLN A 147 104.482 10.969 -6.223 1.00 0.00 C ATOM 578 C GLN A 147 105.538 11.375 -5.189 1.00 0.00 C ATOM 579 O GLN A 147 105.312 12.268 -4.378 1.00 0.00 O ATOM 580 CB GLN A 147 103.715 9.715 -5.795 1.00 0.00 C ATOM 581 CG GLN A 147 102.560 9.971 -4.835 1.00 0.00 C ATOM 582 CD GLN A 147 103.009 10.412 -3.457 1.00 0.00 C ATOM 583 OE1 GLN A 147 103.639 11.453 -3.299 1.00 0.00 O ATOM 584 NE2 GLN A 147 102.678 9.617 -2.445 1.00 0.00 N ATOM 0 H GLN A 147 105.153 9.796 -7.833 1.00 0.00 H new ATOM 0 HA GLN A 147 103.755 11.778 -6.298 1.00 0.00 H new ATOM 0 HB2 GLN A 147 103.326 9.222 -6.686 1.00 0.00 H new ATOM 0 HB3 GLN A 147 104.413 9.022 -5.326 1.00 0.00 H new ATOM 0 HG2 GLN A 147 101.908 10.735 -5.258 1.00 0.00 H new ATOM 0 HG3 GLN A 147 101.966 9.062 -4.742 1.00 0.00 H new ATOM 0 HE21 GLN A 147 102.153 8.760 -2.620 1.00 0.00 H new ATOM 0 HE22 GLN A 147 102.949 9.864 -1.493 1.00 0.00 H new ATOM 593 N SER A 148 106.710 10.761 -5.245 1.00 0.00 N ATOM 594 CA SER A 148 107.785 11.127 -4.328 1.00 0.00 C ATOM 595 C SER A 148 108.009 12.642 -4.385 1.00 0.00 C ATOM 596 O SER A 148 107.962 13.322 -3.362 1.00 0.00 O ATOM 597 CB SER A 148 109.064 10.378 -4.687 1.00 0.00 C ATOM 598 OG SER A 148 110.121 10.713 -3.805 1.00 0.00 O ATOM 0 H SER A 148 106.942 10.018 -5.904 1.00 0.00 H new ATOM 0 HA SER A 148 107.505 10.849 -3.312 1.00 0.00 H new ATOM 0 HB2 SER A 148 108.882 9.304 -4.649 1.00 0.00 H new ATOM 0 HB3 SER A 148 109.352 10.616 -5.711 1.00 0.00 H new ATOM 0 HG SER A 148 110.928 10.217 -4.058 1.00 0.00 H new ATOM 604 N LYS A 149 108.195 13.162 -5.595 1.00 0.00 N ATOM 605 CA LYS A 149 108.366 14.602 -5.814 1.00 0.00 C ATOM 606 C LYS A 149 107.125 15.357 -5.342 1.00 0.00 C ATOM 607 O LYS A 149 107.216 16.423 -4.728 1.00 0.00 O ATOM 608 CB LYS A 149 108.595 14.877 -7.302 1.00 0.00 C ATOM 609 CG LYS A 149 109.873 14.251 -7.840 1.00 0.00 C ATOM 610 CD LYS A 149 110.205 14.746 -9.241 1.00 0.00 C ATOM 611 CE LYS A 149 109.143 14.347 -10.254 1.00 0.00 C ATOM 612 NZ LYS A 149 109.523 14.740 -11.639 1.00 0.00 N ATOM 0 H LYS A 149 108.232 12.605 -6.448 1.00 0.00 H new ATOM 0 HA LYS A 149 109.230 14.943 -5.244 1.00 0.00 H new ATOM 0 HB2 LYS A 149 107.746 14.497 -7.870 1.00 0.00 H new ATOM 0 HB3 LYS A 149 108.630 15.954 -7.464 1.00 0.00 H new ATOM 0 HG2 LYS A 149 110.700 14.482 -7.169 1.00 0.00 H new ATOM 0 HG3 LYS A 149 109.767 13.166 -7.854 1.00 0.00 H new ATOM 0 HD2 LYS A 149 110.304 15.831 -9.228 1.00 0.00 H new ATOM 0 HD3 LYS A 149 111.169 14.342 -9.549 1.00 0.00 H new ATOM 0 HE2 LYS A 149 108.988 13.269 -10.212 1.00 0.00 H new ATOM 0 HE3 LYS A 149 108.195 14.816 -9.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 108.774 14.451 -12.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 109.647 15.772 -11.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 110.414 14.272 -11.900 1.00 0.00 H new ATOM 626 N GLU A 150 105.975 14.777 -5.633 1.00 0.00 N ATOM 627 CA GLU A 150 104.680 15.335 -5.266 1.00 0.00 C ATOM 628 C GLU A 150 104.561 15.703 -3.790 1.00 0.00 C ATOM 629 O GLU A 150 104.287 16.848 -3.429 1.00 0.00 O ATOM 630 CB GLU A 150 103.617 14.277 -5.531 1.00 0.00 C ATOM 631 CG GLU A 150 102.200 14.797 -5.348 1.00 0.00 C ATOM 632 CD GLU A 150 101.791 15.772 -6.435 1.00 0.00 C ATOM 633 OE1 GLU A 150 102.605 16.020 -7.349 1.00 0.00 O ATOM 634 OE2 GLU A 150 100.653 16.284 -6.374 1.00 0.00 O ATOM 0 H GLU A 150 105.910 13.893 -6.138 1.00 0.00 H new ATOM 0 HA GLU A 150 104.557 16.244 -5.855 1.00 0.00 H new ATOM 0 HB2 GLU A 150 103.732 13.902 -6.548 1.00 0.00 H new ATOM 0 HB3 GLU A 150 103.778 13.433 -4.860 1.00 0.00 H new ATOM 0 HG2 GLU A 150 101.507 13.956 -5.340 1.00 0.00 H new ATOM 0 HG3 GLU A 150 102.119 15.286 -4.377 1.00 0.00 H new ATOM 641 N LYS A 151 104.709 14.678 -2.952 1.00 0.00 N ATOM 642 CA LYS A 151 104.562 14.801 -1.504 1.00 0.00 C ATOM 643 C LYS A 151 105.826 15.260 -0.785 1.00 0.00 C ATOM 644 O LYS A 151 105.749 15.986 0.204 1.00 0.00 O ATOM 645 CB LYS A 151 104.151 13.450 -0.927 1.00 0.00 C ATOM 646 CG LYS A 151 105.325 12.499 -0.749 1.00 0.00 C ATOM 647 CD LYS A 151 104.877 11.088 -0.415 1.00 0.00 C ATOM 648 CE LYS A 151 103.714 11.079 0.565 1.00 0.00 C ATOM 649 NZ LYS A 151 103.436 9.711 1.084 1.00 0.00 N ATOM 0 H LYS A 151 104.936 13.733 -3.262 1.00 0.00 H new ATOM 0 HA LYS A 151 103.805 15.568 -1.342 1.00 0.00 H new ATOM 0 HB2 LYS A 151 103.666 13.605 0.037 1.00 0.00 H new ATOM 0 HB3 LYS A 151 103.413 12.989 -1.584 1.00 0.00 H new ATOM 0 HG2 LYS A 151 105.918 12.483 -1.663 1.00 0.00 H new ATOM 0 HG3 LYS A 151 105.973 12.870 0.045 1.00 0.00 H new ATOM 0 HD2 LYS A 151 104.584 10.574 -1.330 1.00 0.00 H new ATOM 0 HD3 LYS A 151 105.713 10.532 0.009 1.00 0.00 H new ATOM 0 HE2 LYS A 151 103.936 11.745 1.398 1.00 0.00 H new ATOM 0 HE3 LYS A 151 102.822 11.469 0.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 102.415 9.522 1.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 103.947 9.011 0.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 103.752 9.644 2.072 1.00 0.00 H new ATOM 663 N THR A 152 106.986 14.805 -1.246 1.00 0.00 N ATOM 664 CA THR A 152 108.235 15.155 -0.586 1.00 0.00 C ATOM 665 C THR A 152 108.407 16.662 -0.494 1.00 0.00 C ATOM 666 O THR A 152 109.014 17.169 0.449 1.00 0.00 O ATOM 667 CB THR A 152 109.431 14.547 -1.312 1.00 0.00 C ATOM 668 OG1 THR A 152 110.617 14.753 -0.568 1.00 0.00 O ATOM 669 CG2 THR A 152 109.658 15.135 -2.683 1.00 0.00 C ATOM 0 H THR A 152 107.086 14.202 -2.062 1.00 0.00 H new ATOM 0 HA THR A 152 108.190 14.745 0.423 1.00 0.00 H new ATOM 0 HB THR A 152 109.199 13.487 -1.418 1.00 0.00 H new ATOM 0 HG1 THR A 152 111.376 14.356 -1.045 1.00 0.00 H new ATOM 0 HG21 THR A 152 110.523 14.659 -3.144 1.00 0.00 H new ATOM 0 HG22 THR A 152 108.777 14.965 -3.302 1.00 0.00 H new ATOM 0 HG23 THR A 152 109.838 16.206 -2.594 1.00 0.00 H new ATOM 677 N ALA A 153 107.885 17.380 -1.483 1.00 0.00 N ATOM 678 CA ALA A 153 108.010 18.829 -1.496 1.00 0.00 C ATOM 679 C ALA A 153 107.522 19.404 -0.167 1.00 0.00 C ATOM 680 O ALA A 153 107.868 20.520 0.220 1.00 0.00 O ATOM 681 CB ALA A 153 107.236 19.416 -2.671 1.00 0.00 C ATOM 0 H ALA A 153 107.378 16.986 -2.276 1.00 0.00 H new ATOM 0 HA ALA A 153 109.059 19.099 -1.620 1.00 0.00 H new ATOM 0 HB1 ALA A 153 107.338 20.501 -2.668 1.00 0.00 H new ATOM 0 HB2 ALA A 153 107.633 19.016 -3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 153 106.183 19.151 -2.582 1.00 0.00 H new ATOM 687 N SER A 154 106.699 18.606 0.508 1.00 0.00 N ATOM 688 CA SER A 154 106.113 18.977 1.795 1.00 0.00 C ATOM 689 C SER A 154 106.868 18.349 2.966 1.00 0.00 C ATOM 690 O SER A 154 106.698 18.762 4.113 1.00 0.00 O ATOM 691 CB SER A 154 104.649 18.535 1.845 1.00 0.00 C ATOM 692 OG SER A 154 104.537 17.124 1.782 1.00 0.00 O ATOM 0 H SER A 154 106.419 17.682 0.178 1.00 0.00 H new ATOM 0 HA SER A 154 106.183 20.061 1.888 1.00 0.00 H new ATOM 0 HB2 SER A 154 104.188 18.898 2.763 1.00 0.00 H new ATOM 0 HB3 SER A 154 104.103 18.983 1.015 1.00 0.00 H new ATOM 0 HG SER A 154 105.071 16.787 1.033 1.00 0.00 H new ATOM 698 N TYR A 155 107.679 17.333 2.680 1.00 0.00 N ATOM 699 CA TYR A 155 108.427 16.636 3.725 1.00 0.00 C ATOM 700 C TYR A 155 109.612 17.440 4.247 1.00 0.00 C ATOM 701 O TYR A 155 110.420 17.972 3.486 1.00 0.00 O ATOM 702 CB TYR A 155 108.931 15.275 3.236 1.00 0.00 C ATOM 703 CG TYR A 155 107.891 14.177 3.174 1.00 0.00 C ATOM 704 CD1 TYR A 155 106.531 14.433 3.329 1.00 0.00 C ATOM 705 CD2 TYR A 155 108.290 12.863 2.976 1.00 0.00 C ATOM 706 CE1 TYR A 155 105.606 13.405 3.287 1.00 0.00 C ATOM 707 CE2 TYR A 155 107.375 11.834 2.939 1.00 0.00 C ATOM 708 CZ TYR A 155 106.034 12.107 3.095 1.00 0.00 C ATOM 709 OH TYR A 155 105.122 11.079 3.069 1.00 0.00 O ATOM 0 H TYR A 155 107.835 16.975 1.738 1.00 0.00 H new ATOM 0 HA TYR A 155 107.722 16.499 4.545 1.00 0.00 H new ATOM 0 HB2 TYR A 155 109.359 15.402 2.242 1.00 0.00 H new ATOM 0 HB3 TYR A 155 109.739 14.950 3.892 1.00 0.00 H new ATOM 0 HD1 TYR A 155 106.194 15.447 3.484 1.00 0.00 H new ATOM 0 HD2 TYR A 155 109.339 12.642 2.848 1.00 0.00 H new ATOM 0 HE1 TYR A 155 104.554 13.617 3.404 1.00 0.00 H new ATOM 0 HE2 TYR A 155 107.708 10.818 2.788 1.00 0.00 H new ATOM 0 HH TYR A 155 104.254 11.403 3.389 1.00 0.00 H new ATOM 719 N THR A 156 109.706 17.476 5.573 1.00 0.00 N ATOM 720 CA THR A 156 110.783 18.156 6.281 1.00 0.00 C ATOM 721 C THR A 156 111.743 17.111 6.843 1.00 0.00 C ATOM 722 O THR A 156 111.564 15.915 6.616 1.00 0.00 O ATOM 723 CB THR A 156 110.227 19.014 7.423 1.00 0.00 C ATOM 724 OG1 THR A 156 111.174 19.993 7.811 1.00 0.00 O ATOM 725 CG2 THR A 156 109.878 18.218 8.665 1.00 0.00 C ATOM 0 H THR A 156 109.029 17.029 6.191 1.00 0.00 H new ATOM 0 HA THR A 156 111.307 18.812 5.586 1.00 0.00 H new ATOM 0 HB THR A 156 109.316 19.462 7.027 1.00 0.00 H new ATOM 0 HG1 THR A 156 110.805 20.535 8.540 1.00 0.00 H new ATOM 0 HG21 THR A 156 109.491 18.890 9.431 1.00 0.00 H new ATOM 0 HG22 THR A 156 109.121 17.473 8.419 1.00 0.00 H new ATOM 0 HG23 THR A 156 110.771 17.717 9.039 1.00 0.00 H new ATOM 733 N LYS A 157 112.746 17.554 7.585 1.00 0.00 N ATOM 734 CA LYS A 157 113.701 16.625 8.179 1.00 0.00 C ATOM 735 C LYS A 157 113.006 15.707 9.180 1.00 0.00 C ATOM 736 O LYS A 157 113.219 14.494 9.181 1.00 0.00 O ATOM 737 CB LYS A 157 114.835 17.377 8.869 1.00 0.00 C ATOM 738 CG LYS A 157 115.851 16.458 9.527 1.00 0.00 C ATOM 739 CD LYS A 157 116.879 17.249 10.301 1.00 0.00 C ATOM 740 CE LYS A 157 117.825 16.341 11.070 1.00 0.00 C ATOM 741 NZ LYS A 157 117.104 15.508 12.072 1.00 0.00 N ATOM 0 H LYS A 157 112.921 18.538 7.790 1.00 0.00 H new ATOM 0 HA LYS A 157 114.121 16.020 7.376 1.00 0.00 H new ATOM 0 HB2 LYS A 157 115.343 18.005 8.138 1.00 0.00 H new ATOM 0 HB3 LYS A 157 114.415 18.042 9.623 1.00 0.00 H new ATOM 0 HG2 LYS A 157 115.340 15.766 10.197 1.00 0.00 H new ATOM 0 HG3 LYS A 157 116.348 15.856 8.766 1.00 0.00 H new ATOM 0 HD2 LYS A 157 117.451 17.872 9.614 1.00 0.00 H new ATOM 0 HD3 LYS A 157 116.374 17.920 10.996 1.00 0.00 H new ATOM 0 HE2 LYS A 157 118.353 15.692 10.371 1.00 0.00 H new ATOM 0 HE3 LYS A 157 118.578 16.946 11.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 117.782 15.140 12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 116.389 16.088 12.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 116.637 14.713 11.591 1.00 0.00 H new ATOM 755 N GLU A 158 112.177 16.298 10.030 1.00 0.00 N ATOM 756 CA GLU A 158 111.443 15.550 11.045 1.00 0.00 C ATOM 757 C GLU A 158 110.761 14.327 10.439 1.00 0.00 C ATOM 758 O GLU A 158 110.631 13.286 11.084 1.00 0.00 O ATOM 759 CB GLU A 158 110.383 16.453 11.681 1.00 0.00 C ATOM 760 CG GLU A 158 110.954 17.702 12.334 1.00 0.00 C ATOM 761 CD GLU A 158 111.830 17.391 13.532 1.00 0.00 C ATOM 762 OE1 GLU A 158 111.947 16.201 13.892 1.00 0.00 O ATOM 763 OE2 GLU A 158 112.394 18.341 14.116 1.00 0.00 O ATOM 0 H GLU A 158 111.994 17.301 10.037 1.00 0.00 H new ATOM 0 HA GLU A 158 112.153 15.214 11.801 1.00 0.00 H new ATOM 0 HB2 GLU A 158 109.665 16.750 10.916 1.00 0.00 H new ATOM 0 HB3 GLU A 158 109.834 15.882 12.429 1.00 0.00 H new ATOM 0 HG2 GLU A 158 111.536 18.257 11.598 1.00 0.00 H new ATOM 0 HG3 GLU A 158 110.135 18.350 12.647 1.00 0.00 H new ATOM 770 N ASP A 159 110.312 14.477 9.198 1.00 0.00 N ATOM 771 CA ASP A 159 109.617 13.408 8.487 1.00 0.00 C ATOM 772 C ASP A 159 110.560 12.283 8.072 1.00 0.00 C ATOM 773 O ASP A 159 110.284 11.114 8.319 1.00 0.00 O ATOM 774 CB ASP A 159 108.919 13.972 7.248 1.00 0.00 C ATOM 775 CG ASP A 159 107.898 15.038 7.595 1.00 0.00 C ATOM 776 OD1 ASP A 159 107.735 15.335 8.797 1.00 0.00 O ATOM 777 OD2 ASP A 159 107.261 15.575 6.665 1.00 0.00 O ATOM 0 H ASP A 159 110.418 15.336 8.659 1.00 0.00 H new ATOM 0 HA ASP A 159 108.881 12.989 9.173 1.00 0.00 H new ATOM 0 HB2 ASP A 159 109.665 14.393 6.574 1.00 0.00 H new ATOM 0 HB3 ASP A 159 108.426 13.161 6.711 1.00 0.00 H new ATOM 782 N TRP A 160 111.662 12.635 7.426 1.00 0.00 N ATOM 783 CA TRP A 160 112.620 11.638 6.965 1.00 0.00 C ATOM 784 C TRP A 160 113.248 10.862 8.117 1.00 0.00 C ATOM 785 O TRP A 160 113.397 9.647 8.037 1.00 0.00 O ATOM 786 CB TRP A 160 113.710 12.289 6.120 1.00 0.00 C ATOM 787 CG TRP A 160 113.230 12.757 4.780 1.00 0.00 C ATOM 788 CD1 TRP A 160 113.435 13.985 4.235 1.00 0.00 C ATOM 789 CD2 TRP A 160 112.487 12.006 3.807 1.00 0.00 C ATOM 790 NE1 TRP A 160 112.862 14.056 2.990 1.00 0.00 N ATOM 791 CE2 TRP A 160 112.277 12.852 2.703 1.00 0.00 C ATOM 792 CE3 TRP A 160 111.978 10.705 3.760 1.00 0.00 C ATOM 793 CZ2 TRP A 160 111.584 12.439 1.568 1.00 0.00 C ATOM 794 CZ3 TRP A 160 111.289 10.298 2.633 1.00 0.00 C ATOM 795 CH2 TRP A 160 111.099 11.162 1.551 1.00 0.00 C ATOM 0 H TRP A 160 111.915 13.599 7.209 1.00 0.00 H new ATOM 0 HA TRP A 160 112.065 10.927 6.353 1.00 0.00 H new ATOM 0 HB2 TRP A 160 114.123 13.138 6.665 1.00 0.00 H new ATOM 0 HB3 TRP A 160 114.522 11.576 5.977 1.00 0.00 H new ATOM 0 HD1 TRP A 160 113.972 14.790 4.714 1.00 0.00 H new ATOM 0 HE1 TRP A 160 112.871 14.872 2.378 1.00 0.00 H new ATOM 0 HE3 TRP A 160 112.121 10.029 4.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 111.435 13.105 0.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 110.891 9.295 2.588 1.00 0.00 H new ATOM 0 HH2 TRP A 160 110.558 10.813 0.684 1.00 0.00 H new ATOM 806 N GLN A 161 113.622 11.556 9.183 1.00 0.00 N ATOM 807 CA GLN A 161 114.237 10.887 10.324 1.00 0.00 C ATOM 808 C GLN A 161 113.264 9.907 10.973 1.00 0.00 C ATOM 809 O GLN A 161 113.632 8.766 11.253 1.00 0.00 O ATOM 810 CB GLN A 161 114.771 11.910 11.332 1.00 0.00 C ATOM 811 CG GLN A 161 115.030 11.338 12.716 1.00 0.00 C ATOM 812 CD GLN A 161 113.748 11.089 13.488 1.00 0.00 C ATOM 813 OE1 GLN A 161 113.473 9.826 13.787 1.00 0.00 O flip ATOM 814 NE2 GLN A 161 113.010 12.021 13.804 1.00 0.00 N flip ATOM 0 H GLN A 161 113.514 12.565 9.283 1.00 0.00 H new ATOM 0 HA GLN A 161 115.087 10.308 9.964 1.00 0.00 H new ATOM 0 HB2 GLN A 161 115.698 12.335 10.946 1.00 0.00 H new ATOM 0 HB3 GLN A 161 114.056 12.729 11.416 1.00 0.00 H new ATOM 0 HG2 GLN A 161 115.582 10.403 12.622 1.00 0.00 H new ATOM 0 HG3 GLN A 161 115.662 12.026 13.278 1.00 0.00 H new ATOM 0 HE21 GLN A 161 113.261 12.977 13.553 1.00 0.00 H new ATOM 0 HE22 GLN A 161 112.148 11.837 14.317 1.00 0.00 H new ATOM 823 N ARG A 162 112.021 10.322 11.183 1.00 0.00 N ATOM 824 CA ARG A 162 111.034 9.420 11.763 1.00 0.00 C ATOM 825 C ARG A 162 110.930 8.176 10.889 1.00 0.00 C ATOM 826 O ARG A 162 110.731 7.062 11.374 1.00 0.00 O ATOM 827 CB ARG A 162 109.669 10.103 11.868 1.00 0.00 C ATOM 828 CG ARG A 162 108.575 9.193 12.403 1.00 0.00 C ATOM 829 CD ARG A 162 107.238 9.912 12.473 1.00 0.00 C ATOM 830 NE ARG A 162 106.807 10.391 11.162 1.00 0.00 N ATOM 831 CZ ARG A 162 105.674 11.054 10.957 1.00 0.00 C ATOM 832 NH1 ARG A 162 104.862 11.315 11.972 1.00 0.00 N ATOM 833 NH2 ARG A 162 105.352 11.458 9.735 1.00 0.00 N ATOM 0 H ARG A 162 111.677 11.257 10.966 1.00 0.00 H new ATOM 0 HA ARG A 162 111.350 9.143 12.769 1.00 0.00 H new ATOM 0 HB2 ARG A 162 109.756 10.974 12.518 1.00 0.00 H new ATOM 0 HB3 ARG A 162 109.378 10.468 10.883 1.00 0.00 H new ATOM 0 HG2 ARG A 162 108.484 8.316 11.763 1.00 0.00 H new ATOM 0 HG3 ARG A 162 108.850 8.836 13.396 1.00 0.00 H new ATOM 0 HD2 ARG A 162 106.484 9.237 12.879 1.00 0.00 H new ATOM 0 HD3 ARG A 162 107.315 10.755 13.160 1.00 0.00 H new ATOM 0 HE ARG A 162 107.409 10.206 10.360 1.00 0.00 H new ATOM 0 HH11 ARG A 162 105.107 11.007 12.913 1.00 0.00 H new ATOM 0 HH12 ARG A 162 103.993 11.824 11.812 1.00 0.00 H new ATOM 0 HH21 ARG A 162 105.975 11.260 8.952 1.00 0.00 H new ATOM 0 HH22 ARG A 162 104.482 11.967 9.579 1.00 0.00 H new ATOM 847 N ILE A 163 111.086 8.396 9.589 1.00 0.00 N ATOM 848 CA ILE A 163 111.038 7.335 8.592 1.00 0.00 C ATOM 849 C ILE A 163 112.296 6.472 8.649 1.00 0.00 C ATOM 850 O ILE A 163 112.211 5.250 8.747 1.00 0.00 O ATOM 851 CB ILE A 163 110.881 7.931 7.176 1.00 0.00 C ATOM 852 CG1 ILE A 163 109.420 8.313 6.886 1.00 0.00 C ATOM 853 CG2 ILE A 163 111.383 6.955 6.118 1.00 0.00 C ATOM 854 CD1 ILE A 163 108.704 9.053 8.002 1.00 0.00 C ATOM 0 H ILE A 163 111.250 9.322 9.195 1.00 0.00 H new ATOM 0 HA ILE A 163 110.175 6.708 8.815 1.00 0.00 H new ATOM 0 HB ILE A 163 111.486 8.837 7.136 1.00 0.00 H new ATOM 0 HG12 ILE A 163 109.396 8.932 5.989 1.00 0.00 H new ATOM 0 HG13 ILE A 163 108.863 7.404 6.661 1.00 0.00 H new ATOM 0 HG21 ILE A 163 111.262 7.397 5.129 1.00 0.00 H new ATOM 0 HG22 ILE A 163 112.437 6.739 6.293 1.00 0.00 H new ATOM 0 HG23 ILE A 163 110.809 6.030 6.175 1.00 0.00 H new ATOM 0 HD11 ILE A 163 107.682 9.274 7.695 1.00 0.00 H new ATOM 0 HD12 ILE A 163 108.687 8.432 8.898 1.00 0.00 H new ATOM 0 HD13 ILE A 163 109.228 9.984 8.216 1.00 0.00 H new ATOM 866 N GLN A 164 113.464 7.101 8.595 1.00 0.00 N ATOM 867 CA GLN A 164 114.710 6.352 8.653 1.00 0.00 C ATOM 868 C GLN A 164 114.713 5.473 9.882 1.00 0.00 C ATOM 869 O GLN A 164 115.017 4.282 9.809 1.00 0.00 O ATOM 870 CB GLN A 164 115.909 7.291 8.640 1.00 0.00 C ATOM 871 CG GLN A 164 116.064 7.987 7.310 1.00 0.00 C ATOM 872 CD GLN A 164 116.246 7.012 6.164 1.00 0.00 C ATOM 873 OE1 GLN A 164 117.235 6.281 6.106 1.00 0.00 O ATOM 874 NE2 GLN A 164 115.285 6.989 5.248 1.00 0.00 N ATOM 0 H GLN A 164 113.573 8.112 8.512 1.00 0.00 H new ATOM 0 HA GLN A 164 114.787 5.718 7.770 1.00 0.00 H new ATOM 0 HB2 GLN A 164 115.796 8.035 9.428 1.00 0.00 H new ATOM 0 HB3 GLN A 164 116.815 6.727 8.862 1.00 0.00 H new ATOM 0 HG2 GLN A 164 115.186 8.604 7.122 1.00 0.00 H new ATOM 0 HG3 GLN A 164 116.922 8.658 7.352 1.00 0.00 H new ATOM 0 HE21 GLN A 164 114.482 7.612 5.335 1.00 0.00 H new ATOM 0 HE22 GLN A 164 115.349 6.348 4.457 1.00 0.00 H new ATOM 883 N ASP A 165 114.316 6.051 11.003 1.00 0.00 N ATOM 884 CA ASP A 165 114.215 5.295 12.229 1.00 0.00 C ATOM 885 C ASP A 165 113.273 4.129 11.992 1.00 0.00 C ATOM 886 O ASP A 165 113.411 3.066 12.596 1.00 0.00 O ATOM 887 CB ASP A 165 113.708 6.165 13.380 1.00 0.00 C ATOM 888 CG ASP A 165 114.715 7.219 13.794 1.00 0.00 C ATOM 889 OD1 ASP A 165 115.763 7.334 13.124 1.00 0.00 O ATOM 890 OD2 ASP A 165 114.456 7.929 14.788 1.00 0.00 O ATOM 0 H ASP A 165 114.061 7.035 11.085 1.00 0.00 H new ATOM 0 HA ASP A 165 115.203 4.932 12.512 1.00 0.00 H new ATOM 0 HB2 ASP A 165 112.779 6.651 13.083 1.00 0.00 H new ATOM 0 HB3 ASP A 165 113.476 5.531 14.236 1.00 0.00 H new ATOM 895 N GLU A 166 112.305 4.342 11.095 1.00 0.00 N ATOM 896 CA GLU A 166 111.336 3.299 10.776 1.00 0.00 C ATOM 897 C GLU A 166 112.024 2.165 10.026 1.00 0.00 C ATOM 898 O GLU A 166 111.861 0.993 10.366 1.00 0.00 O ATOM 899 CB GLU A 166 110.179 3.857 9.942 1.00 0.00 C ATOM 900 CG GLU A 166 108.922 3.004 10.000 1.00 0.00 C ATOM 901 CD GLU A 166 108.311 2.953 11.387 1.00 0.00 C ATOM 902 OE1 GLU A 166 108.837 3.631 12.295 1.00 0.00 O ATOM 903 OE2 GLU A 166 107.302 2.239 11.564 1.00 0.00 O ATOM 0 H GLU A 166 112.175 5.216 10.585 1.00 0.00 H new ATOM 0 HA GLU A 166 110.925 2.916 11.710 1.00 0.00 H new ATOM 0 HB2 GLU A 166 109.942 4.862 10.290 1.00 0.00 H new ATOM 0 HB3 GLU A 166 110.500 3.947 8.904 1.00 0.00 H new ATOM 0 HG2 GLU A 166 108.187 3.399 9.298 1.00 0.00 H new ATOM 0 HG3 GLU A 166 109.160 1.991 9.675 1.00 0.00 H new ATOM 910 N ALA A 167 112.819 2.524 9.017 1.00 0.00 N ATOM 911 CA ALA A 167 113.554 1.532 8.244 1.00 0.00 C ATOM 912 C ALA A 167 114.479 0.760 9.167 1.00 0.00 C ATOM 913 O ALA A 167 114.556 -0.467 9.109 1.00 0.00 O ATOM 914 CB ALA A 167 114.345 2.191 7.124 1.00 0.00 C ATOM 0 H ALA A 167 112.967 3.489 8.720 1.00 0.00 H new ATOM 0 HA ALA A 167 112.844 0.844 7.786 1.00 0.00 H new ATOM 0 HB1 ALA A 167 114.885 1.429 6.562 1.00 0.00 H new ATOM 0 HB2 ALA A 167 113.662 2.718 6.457 1.00 0.00 H new ATOM 0 HB3 ALA A 167 115.056 2.900 7.549 1.00 0.00 H new ATOM 920 N ASP A 168 115.170 1.492 10.035 1.00 0.00 N ATOM 921 CA ASP A 168 116.079 0.886 10.991 1.00 0.00 C ATOM 922 C ASP A 168 115.348 -0.173 11.794 1.00 0.00 C ATOM 923 O ASP A 168 115.739 -1.337 11.808 1.00 0.00 O ATOM 924 CB ASP A 168 116.617 1.959 11.940 1.00 0.00 C ATOM 925 CG ASP A 168 117.582 1.394 12.963 1.00 0.00 C ATOM 926 OD1 ASP A 168 117.831 0.171 12.933 1.00 0.00 O ATOM 927 OD2 ASP A 168 118.090 2.176 13.795 1.00 0.00 O ATOM 0 H ASP A 168 115.115 2.509 10.093 1.00 0.00 H new ATOM 0 HA ASP A 168 116.908 0.425 10.453 1.00 0.00 H new ATOM 0 HB2 ASP A 168 117.119 2.734 11.361 1.00 0.00 H new ATOM 0 HB3 ASP A 168 115.783 2.436 12.455 1.00 0.00 H new ATOM 932 N GLU A 169 114.266 0.234 12.444 1.00 0.00 N ATOM 933 CA GLU A 169 113.469 -0.691 13.227 1.00 0.00 C ATOM 934 C GLU A 169 113.136 -1.911 12.386 1.00 0.00 C ATOM 935 O GLU A 169 113.364 -3.046 12.801 1.00 0.00 O ATOM 936 CB GLU A 169 112.185 -0.017 13.713 1.00 0.00 C ATOM 937 CG GLU A 169 111.295 -0.932 14.536 1.00 0.00 C ATOM 938 CD GLU A 169 111.968 -1.409 15.809 1.00 0.00 C ATOM 939 OE1 GLU A 169 112.337 -0.555 16.641 1.00 0.00 O ATOM 940 OE2 GLU A 169 112.124 -2.638 15.973 1.00 0.00 O ATOM 0 H GLU A 169 113.924 1.195 12.443 1.00 0.00 H new ATOM 0 HA GLU A 169 114.043 -1.001 14.101 1.00 0.00 H new ATOM 0 HB2 GLU A 169 112.446 0.856 14.311 1.00 0.00 H new ATOM 0 HB3 GLU A 169 111.624 0.343 12.851 1.00 0.00 H new ATOM 0 HG2 GLU A 169 110.375 -0.405 14.791 1.00 0.00 H new ATOM 0 HG3 GLU A 169 111.012 -1.795 13.934 1.00 0.00 H new ATOM 947 N LEU A 170 112.608 -1.664 11.191 1.00 0.00 N ATOM 948 CA LEU A 170 112.256 -2.739 10.276 1.00 0.00 C ATOM 949 C LEU A 170 113.455 -3.641 10.031 1.00 0.00 C ATOM 950 O LEU A 170 113.315 -4.852 9.889 1.00 0.00 O ATOM 951 CB LEU A 170 111.743 -2.165 8.950 1.00 0.00 C ATOM 952 CG LEU A 170 111.522 -3.190 7.834 1.00 0.00 C ATOM 953 CD1 LEU A 170 110.650 -2.592 6.739 1.00 0.00 C ATOM 954 CD2 LEU A 170 112.855 -3.674 7.256 1.00 0.00 C ATOM 0 H LEU A 170 112.415 -0.728 10.836 1.00 0.00 H new ATOM 0 HA LEU A 170 111.462 -3.332 10.729 1.00 0.00 H new ATOM 0 HB2 LEU A 170 110.802 -1.648 9.137 1.00 0.00 H new ATOM 0 HB3 LEU A 170 112.453 -1.417 8.598 1.00 0.00 H new ATOM 0 HG LEU A 170 111.011 -4.053 8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 170 110.499 -3.329 5.951 1.00 0.00 H new ATOM 0 HD12 LEU A 170 109.685 -2.306 7.158 1.00 0.00 H new ATOM 0 HD13 LEU A 170 111.140 -1.712 6.324 1.00 0.00 H new ATOM 0 HD21 LEU A 170 112.666 -4.401 6.466 1.00 0.00 H new ATOM 0 HD22 LEU A 170 113.403 -2.826 6.846 1.00 0.00 H new ATOM 0 HD23 LEU A 170 113.446 -4.140 8.045 1.00 0.00 H new ATOM 966 N THR A 171 114.635 -3.041 9.995 1.00 0.00 N ATOM 967 CA THR A 171 115.860 -3.785 9.776 1.00 0.00 C ATOM 968 C THR A 171 116.184 -4.618 11.005 1.00 0.00 C ATOM 969 O THR A 171 116.551 -5.789 10.902 1.00 0.00 O ATOM 970 CB THR A 171 117.006 -2.818 9.477 1.00 0.00 C ATOM 971 OG1 THR A 171 116.658 -1.944 8.417 1.00 0.00 O ATOM 972 CG2 THR A 171 118.295 -3.506 9.091 1.00 0.00 C ATOM 0 H THR A 171 114.767 -2.037 10.115 1.00 0.00 H new ATOM 0 HA THR A 171 115.729 -4.451 8.924 1.00 0.00 H new ATOM 0 HB THR A 171 117.170 -2.275 10.408 1.00 0.00 H new ATOM 0 HG1 THR A 171 115.913 -1.372 8.696 1.00 0.00 H new ATOM 0 HG21 THR A 171 119.062 -2.757 8.894 1.00 0.00 H new ATOM 0 HG22 THR A 171 118.620 -4.153 9.906 1.00 0.00 H new ATOM 0 HG23 THR A 171 118.134 -4.105 8.195 1.00 0.00 H new ATOM 980 N ARG A 172 116.055 -3.994 12.170 1.00 0.00 N ATOM 981 CA ARG A 172 116.343 -4.660 13.429 1.00 0.00 C ATOM 982 C ARG A 172 115.612 -5.994 13.542 1.00 0.00 C ATOM 983 O ARG A 172 116.188 -6.987 13.988 1.00 0.00 O ATOM 984 CB ARG A 172 115.965 -3.764 14.610 1.00 0.00 C ATOM 985 CG ARG A 172 116.780 -2.482 14.684 1.00 0.00 C ATOM 986 CD ARG A 172 116.433 -1.641 15.909 1.00 0.00 C ATOM 987 NE ARG A 172 116.711 -2.332 17.168 1.00 0.00 N ATOM 988 CZ ARG A 172 115.885 -3.211 17.730 1.00 0.00 C ATOM 989 NH1 ARG A 172 114.711 -3.474 17.173 1.00 0.00 N ATOM 990 NH2 ARG A 172 116.228 -3.817 18.859 1.00 0.00 N ATOM 0 H ARG A 172 115.752 -3.025 12.266 1.00 0.00 H new ATOM 0 HA ARG A 172 117.415 -4.856 13.453 1.00 0.00 H new ATOM 0 HB2 ARG A 172 114.908 -3.509 14.539 1.00 0.00 H new ATOM 0 HB3 ARG A 172 116.097 -4.323 15.537 1.00 0.00 H new ATOM 0 HG2 ARG A 172 117.841 -2.730 14.706 1.00 0.00 H new ATOM 0 HG3 ARG A 172 116.609 -1.894 13.783 1.00 0.00 H new ATOM 0 HD2 ARG A 172 117.000 -0.710 15.878 1.00 0.00 H new ATOM 0 HD3 ARG A 172 115.377 -1.373 15.873 1.00 0.00 H new ATOM 0 HE ARG A 172 117.590 -2.128 17.643 1.00 0.00 H new ATOM 0 HH11 ARG A 172 114.438 -3.002 16.311 1.00 0.00 H new ATOM 0 HH12 ARG A 172 114.080 -4.148 17.607 1.00 0.00 H new ATOM 0 HH21 ARG A 172 117.125 -3.609 19.297 1.00 0.00 H new ATOM 0 HH22 ARG A 172 115.594 -4.491 19.289 1.00 0.00 H new ATOM 1004 N ARG A 173 114.341 -6.016 13.146 1.00 0.00 N ATOM 1005 CA ARG A 173 113.551 -7.243 13.222 1.00 0.00 C ATOM 1006 C ARG A 173 113.965 -8.236 12.139 1.00 0.00 C ATOM 1007 O ARG A 173 114.056 -9.437 12.394 1.00 0.00 O ATOM 1008 CB ARG A 173 112.041 -6.947 13.160 1.00 0.00 C ATOM 1009 CG ARG A 173 111.643 -5.836 12.200 1.00 0.00 C ATOM 1010 CD ARG A 173 110.153 -5.518 12.288 1.00 0.00 C ATOM 1011 NE ARG A 173 109.312 -6.659 11.928 1.00 0.00 N ATOM 1012 CZ ARG A 173 109.031 -7.664 12.752 1.00 0.00 C ATOM 1013 NH1 ARG A 173 109.468 -7.644 14.004 1.00 0.00 N ATOM 1014 NH2 ARG A 173 108.294 -8.683 12.330 1.00 0.00 N ATOM 0 H ARG A 173 113.841 -5.209 12.774 1.00 0.00 H new ATOM 0 HA ARG A 173 113.754 -7.703 14.189 1.00 0.00 H new ATOM 0 HB2 ARG A 173 111.519 -7.859 12.873 1.00 0.00 H new ATOM 0 HB3 ARG A 173 111.696 -6.684 14.160 1.00 0.00 H new ATOM 0 HG2 ARG A 173 112.220 -4.939 12.423 1.00 0.00 H new ATOM 0 HG3 ARG A 173 111.892 -6.130 11.180 1.00 0.00 H new ATOM 0 HD2 ARG A 173 109.913 -5.200 13.302 1.00 0.00 H new ATOM 0 HD3 ARG A 173 109.924 -4.681 11.629 1.00 0.00 H new ATOM 0 HE ARG A 173 108.917 -6.685 10.988 1.00 0.00 H new ATOM 0 HH11 ARG A 173 110.022 -6.855 14.338 1.00 0.00 H new ATOM 0 HH12 ARG A 173 109.250 -8.417 14.633 1.00 0.00 H new ATOM 0 HH21 ARG A 173 107.942 -8.696 11.373 1.00 0.00 H new ATOM 0 HH22 ARG A 173 108.079 -9.453 12.963 1.00 0.00 H new ATOM 1028 N PHE A 174 114.245 -7.732 10.943 1.00 0.00 N ATOM 1029 CA PHE A 174 114.679 -8.584 9.840 1.00 0.00 C ATOM 1030 C PHE A 174 115.953 -9.312 10.219 1.00 0.00 C ATOM 1031 O PHE A 174 116.074 -10.510 10.022 1.00 0.00 O ATOM 1032 CB PHE A 174 114.911 -7.755 8.576 1.00 0.00 C ATOM 1033 CG PHE A 174 113.649 -7.333 7.878 1.00 0.00 C ATOM 1034 CD1 PHE A 174 112.534 -6.957 8.601 1.00 0.00 C ATOM 1035 CD2 PHE A 174 113.589 -7.294 6.496 1.00 0.00 C ATOM 1036 CE1 PHE A 174 111.380 -6.551 7.964 1.00 0.00 C ATOM 1037 CE2 PHE A 174 112.436 -6.891 5.850 1.00 0.00 C ATOM 1038 CZ PHE A 174 111.330 -6.518 6.587 1.00 0.00 C ATOM 0 H PHE A 174 114.180 -6.741 10.712 1.00 0.00 H new ATOM 0 HA PHE A 174 113.894 -9.313 9.638 1.00 0.00 H new ATOM 0 HB2 PHE A 174 115.483 -6.865 8.838 1.00 0.00 H new ATOM 0 HB3 PHE A 174 115.521 -8.333 7.882 1.00 0.00 H new ATOM 0 HD1 PHE A 174 112.566 -6.981 9.680 1.00 0.00 H new ATOM 0 HD2 PHE A 174 114.453 -7.582 5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 174 110.517 -6.259 8.543 1.00 0.00 H new ATOM 0 HE2 PHE A 174 112.400 -6.868 4.771 1.00 0.00 H new ATOM 0 HZ PHE A 174 110.427 -6.201 6.086 1.00 0.00 H new ATOM 1048 N VAL A 175 116.898 -8.583 10.766 1.00 0.00 N ATOM 1049 CA VAL A 175 118.163 -9.163 11.169 1.00 0.00 C ATOM 1050 C VAL A 175 117.997 -10.177 12.298 1.00 0.00 C ATOM 1051 O VAL A 175 118.513 -11.291 12.214 1.00 0.00 O ATOM 1052 CB VAL A 175 119.140 -8.041 11.561 1.00 0.00 C ATOM 1053 CG1 VAL A 175 120.145 -8.478 12.616 1.00 0.00 C ATOM 1054 CG2 VAL A 175 119.860 -7.564 10.320 1.00 0.00 C ATOM 0 H VAL A 175 116.816 -7.582 10.944 1.00 0.00 H new ATOM 0 HA VAL A 175 118.573 -9.713 10.322 1.00 0.00 H new ATOM 0 HB VAL A 175 118.560 -7.231 12.003 1.00 0.00 H new ATOM 0 HG11 VAL A 175 120.808 -7.646 12.853 1.00 0.00 H new ATOM 0 HG12 VAL A 175 119.615 -8.788 13.517 1.00 0.00 H new ATOM 0 HG13 VAL A 175 120.733 -9.313 12.235 1.00 0.00 H new ATOM 0 HG21 VAL A 175 120.556 -6.768 10.586 1.00 0.00 H new ATOM 0 HG22 VAL A 175 120.411 -8.394 9.877 1.00 0.00 H new ATOM 0 HG23 VAL A 175 119.134 -7.186 9.601 1.00 0.00 H new ATOM 1064 N ALA A 176 117.278 -9.803 13.344 1.00 0.00 N ATOM 1065 CA ALA A 176 117.061 -10.709 14.464 1.00 0.00 C ATOM 1066 C ALA A 176 116.374 -11.993 14.003 1.00 0.00 C ATOM 1067 O ALA A 176 116.701 -13.083 14.471 1.00 0.00 O ATOM 1068 CB ALA A 176 116.245 -10.026 15.550 1.00 0.00 C ATOM 0 H ALA A 176 116.838 -8.888 13.443 1.00 0.00 H new ATOM 0 HA ALA A 176 118.033 -10.977 14.878 1.00 0.00 H new ATOM 0 HB1 ALA A 176 116.092 -10.717 16.379 1.00 0.00 H new ATOM 0 HB2 ALA A 176 116.778 -9.145 15.906 1.00 0.00 H new ATOM 0 HB3 ALA A 176 115.279 -9.726 15.145 1.00 0.00 H new ATOM 1074 N LEU A 177 115.417 -11.856 13.091 1.00 0.00 N ATOM 1075 CA LEU A 177 114.669 -13.003 12.568 1.00 0.00 C ATOM 1076 C LEU A 177 115.412 -13.683 11.418 1.00 0.00 C ATOM 1077 O LEU A 177 115.457 -14.909 11.336 1.00 0.00 O ATOM 1078 CB LEU A 177 113.292 -12.530 12.086 1.00 0.00 C ATOM 1079 CG LEU A 177 113.256 -12.000 10.648 1.00 0.00 C ATOM 1080 CD1 LEU A 177 113.118 -13.149 9.646 1.00 0.00 C ATOM 1081 CD2 LEU A 177 112.128 -10.989 10.469 1.00 0.00 C ATOM 0 H LEU A 177 115.137 -10.959 12.695 1.00 0.00 H new ATOM 0 HA LEU A 177 114.558 -13.733 13.370 1.00 0.00 H new ATOM 0 HB2 LEU A 177 112.590 -13.360 12.169 1.00 0.00 H new ATOM 0 HB3 LEU A 177 112.939 -11.745 12.755 1.00 0.00 H new ATOM 0 HG LEU A 177 114.201 -11.492 10.453 1.00 0.00 H new ATOM 0 HD11 LEU A 177 113.095 -12.747 8.633 1.00 0.00 H new ATOM 0 HD12 LEU A 177 113.967 -13.825 9.749 1.00 0.00 H new ATOM 0 HD13 LEU A 177 112.194 -13.694 9.842 1.00 0.00 H new ATOM 0 HD21 LEU A 177 112.123 -10.628 9.441 1.00 0.00 H new ATOM 0 HD22 LEU A 177 111.173 -11.466 10.690 1.00 0.00 H new ATOM 0 HD23 LEU A 177 112.280 -10.150 11.148 1.00 0.00 H new ATOM 1093 N MET A 178 115.975 -12.878 10.525 1.00 0.00 N ATOM 1094 CA MET A 178 116.693 -13.387 9.361 1.00 0.00 C ATOM 1095 C MET A 178 117.963 -14.124 9.763 1.00 0.00 C ATOM 1096 O MET A 178 118.200 -15.261 9.353 1.00 0.00 O ATOM 1097 CB MET A 178 117.048 -12.212 8.456 1.00 0.00 C ATOM 1098 CG MET A 178 117.699 -12.612 7.155 1.00 0.00 C ATOM 1099 SD MET A 178 119.401 -13.160 7.370 1.00 0.00 S ATOM 1100 CE MET A 178 120.013 -12.959 5.702 1.00 0.00 C ATOM 0 H MET A 178 115.948 -11.860 10.586 1.00 0.00 H new ATOM 0 HA MET A 178 116.051 -14.096 8.838 1.00 0.00 H new ATOM 0 HB2 MET A 178 116.141 -11.648 8.238 1.00 0.00 H new ATOM 0 HB3 MET A 178 117.718 -11.542 8.994 1.00 0.00 H new ATOM 0 HG2 MET A 178 117.119 -13.412 6.694 1.00 0.00 H new ATOM 0 HG3 MET A 178 117.678 -11.766 6.468 1.00 0.00 H new ATOM 0 HE1 MET A 178 121.103 -12.978 5.710 1.00 0.00 H new ATOM 0 HE2 MET A 178 119.640 -13.771 5.077 1.00 0.00 H new ATOM 0 HE3 MET A 178 119.670 -12.005 5.301 1.00 0.00 H new ATOM 1110 N ASP A 179 118.771 -13.457 10.576 1.00 0.00 N ATOM 1111 CA ASP A 179 120.024 -14.011 11.066 1.00 0.00 C ATOM 1112 C ASP A 179 119.766 -15.271 11.868 1.00 0.00 C ATOM 1113 O ASP A 179 120.633 -16.138 11.983 1.00 0.00 O ATOM 1114 CB ASP A 179 120.751 -12.969 11.918 1.00 0.00 C ATOM 1115 CG ASP A 179 120.881 -11.652 11.193 1.00 0.00 C ATOM 1116 OD1 ASP A 179 120.102 -11.426 10.248 1.00 0.00 O ATOM 1117 OD2 ASP A 179 121.751 -10.844 11.579 1.00 0.00 O ATOM 0 H ASP A 179 118.575 -12.515 10.914 1.00 0.00 H new ATOM 0 HA ASP A 179 120.655 -14.273 10.216 1.00 0.00 H new ATOM 0 HB2 ASP A 179 120.209 -12.819 12.852 1.00 0.00 H new ATOM 0 HB3 ASP A 179 121.742 -13.340 12.181 1.00 0.00 H new ATOM 1122 N ALA A 180 118.554 -15.385 12.393 1.00 0.00 N ATOM 1123 CA ALA A 180 118.170 -16.563 13.149 1.00 0.00 C ATOM 1124 C ALA A 180 118.108 -17.768 12.228 1.00 0.00 C ATOM 1125 O ALA A 180 117.842 -18.886 12.670 1.00 0.00 O ATOM 1126 CB ALA A 180 116.839 -16.349 13.854 1.00 0.00 C ATOM 0 H ALA A 180 117.824 -14.678 12.308 1.00 0.00 H new ATOM 0 HA ALA A 180 118.922 -16.746 13.916 1.00 0.00 H new ATOM 0 HB1 ALA A 180 116.575 -17.247 14.413 1.00 0.00 H new ATOM 0 HB2 ALA A 180 116.922 -15.506 14.540 1.00 0.00 H new ATOM 0 HB3 ALA A 180 116.065 -16.141 13.115 1.00 0.00 H new ATOM 1132 N GLY A 181 118.347 -17.540 10.940 1.00 0.00 N ATOM 1133 CA GLY A 181 118.301 -18.625 9.984 1.00 0.00 C ATOM 1134 C GLY A 181 116.879 -18.965 9.631 1.00 0.00 C ATOM 1135 O GLY A 181 116.584 -20.062 9.156 1.00 0.00 O ATOM 0 H GLY A 181 118.571 -16.626 10.545 1.00 0.00 H new ATOM 0 HA2 GLY A 181 118.847 -18.345 9.083 1.00 0.00 H new ATOM 0 HA3 GLY A 181 118.797 -19.502 10.399 1.00 0.00 H new ATOM 1139 N GLU A 182 115.994 -18.011 9.881 1.00 0.00 N ATOM 1140 CA GLU A 182 114.579 -18.189 9.609 1.00 0.00 C ATOM 1141 C GLU A 182 114.296 -17.954 8.122 1.00 0.00 C ATOM 1142 O GLU A 182 114.690 -16.921 7.581 1.00 0.00 O ATOM 1143 CB GLU A 182 113.787 -17.208 10.474 1.00 0.00 C ATOM 1144 CG GLU A 182 112.282 -17.342 10.347 1.00 0.00 C ATOM 1145 CD GLU A 182 111.529 -16.515 11.369 1.00 0.00 C ATOM 1146 OE1 GLU A 182 111.663 -15.275 11.342 1.00 0.00 O ATOM 1147 OE2 GLU A 182 110.805 -17.108 12.196 1.00 0.00 O ATOM 0 H GLU A 182 116.235 -17.101 10.274 1.00 0.00 H new ATOM 0 HA GLU A 182 114.277 -19.208 9.851 1.00 0.00 H new ATOM 0 HB2 GLU A 182 114.067 -17.353 11.517 1.00 0.00 H new ATOM 0 HB3 GLU A 182 114.074 -16.191 10.206 1.00 0.00 H new ATOM 0 HG2 GLU A 182 111.978 -17.038 9.345 1.00 0.00 H new ATOM 0 HG3 GLU A 182 112.005 -18.390 10.459 1.00 0.00 H new ATOM 1154 N PRO A 183 113.624 -18.892 7.421 1.00 0.00 N ATOM 1155 CA PRO A 183 113.342 -18.715 5.996 1.00 0.00 C ATOM 1156 C PRO A 183 112.501 -17.469 5.746 1.00 0.00 C ATOM 1157 O PRO A 183 111.786 -16.997 6.630 1.00 0.00 O ATOM 1158 CB PRO A 183 112.622 -20.003 5.578 1.00 0.00 C ATOM 1159 CG PRO A 183 112.157 -20.629 6.854 1.00 0.00 C ATOM 1160 CD PRO A 183 113.104 -20.170 7.936 1.00 0.00 C ATOM 0 HA PRO A 183 114.247 -18.559 5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 183 111.782 -19.787 4.917 1.00 0.00 H new ATOM 0 HB3 PRO A 183 113.292 -20.669 5.035 1.00 0.00 H new ATOM 0 HG2 PRO A 183 111.135 -20.328 7.082 1.00 0.00 H new ATOM 0 HG3 PRO A 183 112.159 -21.716 6.774 1.00 0.00 H new ATOM 0 HD2 PRO A 183 112.591 -20.039 8.889 1.00 0.00 H new ATOM 0 HD3 PRO A 183 113.904 -20.891 8.101 1.00 0.00 H new ATOM 1168 N ALA A 184 112.646 -16.908 4.549 1.00 0.00 N ATOM 1169 CA ALA A 184 111.959 -15.676 4.191 1.00 0.00 C ATOM 1170 C ALA A 184 110.447 -15.829 4.050 1.00 0.00 C ATOM 1171 O ALA A 184 109.737 -14.824 4.055 1.00 0.00 O ATOM 1172 CB ALA A 184 112.564 -15.087 2.924 1.00 0.00 C ATOM 0 H ALA A 184 113.236 -17.290 3.810 1.00 0.00 H new ATOM 0 HA ALA A 184 112.108 -14.989 5.024 1.00 0.00 H new ATOM 0 HB1 ALA A 184 112.042 -14.166 2.666 1.00 0.00 H new ATOM 0 HB2 ALA A 184 113.619 -14.872 3.091 1.00 0.00 H new ATOM 0 HB3 ALA A 184 112.464 -15.802 2.107 1.00 0.00 H new ATOM 1178 N ASP A 185 109.927 -17.053 3.944 1.00 0.00 N ATOM 1179 CA ASP A 185 108.480 -17.227 3.829 1.00 0.00 C ATOM 1180 C ASP A 185 107.907 -17.586 5.193 1.00 0.00 C ATOM 1181 O ASP A 185 106.770 -18.040 5.317 1.00 0.00 O ATOM 1182 CB ASP A 185 108.135 -18.302 2.797 1.00 0.00 C ATOM 1183 CG ASP A 185 106.641 -18.443 2.581 1.00 0.00 C ATOM 1184 OD1 ASP A 185 105.875 -17.674 3.199 1.00 0.00 O ATOM 1185 OD2 ASP A 185 106.236 -19.319 1.788 1.00 0.00 O ATOM 0 H ASP A 185 110.470 -17.917 3.935 1.00 0.00 H new ATOM 0 HA ASP A 185 108.037 -16.292 3.487 1.00 0.00 H new ATOM 0 HB2 ASP A 185 108.614 -18.058 1.849 1.00 0.00 H new ATOM 0 HB3 ASP A 185 108.543 -19.258 3.123 1.00 0.00 H new ATOM 1190 N SER A 186 108.723 -17.354 6.214 1.00 0.00 N ATOM 1191 CA SER A 186 108.357 -17.614 7.593 1.00 0.00 C ATOM 1192 C SER A 186 107.273 -16.661 8.051 1.00 0.00 C ATOM 1193 O SER A 186 107.264 -15.494 7.668 1.00 0.00 O ATOM 1194 CB SER A 186 109.584 -17.434 8.486 1.00 0.00 C ATOM 1195 OG SER A 186 110.603 -18.355 8.141 1.00 0.00 O ATOM 0 H SER A 186 109.664 -16.977 6.103 1.00 0.00 H new ATOM 0 HA SER A 186 107.983 -18.635 7.664 1.00 0.00 H new ATOM 0 HB2 SER A 186 109.962 -16.416 8.390 1.00 0.00 H new ATOM 0 HB3 SER A 186 109.302 -17.573 9.530 1.00 0.00 H new ATOM 0 HG SER A 186 111.347 -17.877 7.720 1.00 0.00 H new ATOM 1201 N GLU A 187 106.375 -17.143 8.891 1.00 0.00 N ATOM 1202 CA GLU A 187 105.317 -16.290 9.404 1.00 0.00 C ATOM 1203 C GLU A 187 105.948 -15.016 9.946 1.00 0.00 C ATOM 1204 O GLU A 187 105.401 -13.919 9.839 1.00 0.00 O ATOM 1205 CB GLU A 187 104.532 -17.010 10.501 1.00 0.00 C ATOM 1206 CG GLU A 187 103.818 -18.261 10.017 1.00 0.00 C ATOM 1207 CD GLU A 187 103.048 -18.958 11.122 1.00 0.00 C ATOM 1208 OE1 GLU A 187 102.140 -18.326 11.702 1.00 0.00 O ATOM 1209 OE2 GLU A 187 103.353 -20.135 11.407 1.00 0.00 O ATOM 0 H GLU A 187 106.355 -18.105 9.229 1.00 0.00 H new ATOM 0 HA GLU A 187 104.618 -16.045 8.604 1.00 0.00 H new ATOM 0 HB2 GLU A 187 105.214 -17.280 11.307 1.00 0.00 H new ATOM 0 HB3 GLU A 187 103.798 -16.323 10.922 1.00 0.00 H new ATOM 0 HG2 GLU A 187 103.132 -17.995 9.213 1.00 0.00 H new ATOM 0 HG3 GLU A 187 104.549 -18.952 9.597 1.00 0.00 H new ATOM 1216 N GLY A 188 107.128 -15.199 10.521 1.00 0.00 N ATOM 1217 CA GLY A 188 107.878 -14.094 11.069 1.00 0.00 C ATOM 1218 C GLY A 188 108.370 -13.168 9.973 1.00 0.00 C ATOM 1219 O GLY A 188 108.301 -11.947 10.097 1.00 0.00 O ATOM 0 H GLY A 188 107.582 -16.107 10.617 1.00 0.00 H new ATOM 0 HA2 GLY A 188 107.252 -13.537 11.766 1.00 0.00 H new ATOM 0 HA3 GLY A 188 108.728 -14.474 11.637 1.00 0.00 H new ATOM 1223 N ALA A 189 108.873 -13.758 8.895 1.00 0.00 N ATOM 1224 CA ALA A 189 109.383 -12.991 7.765 1.00 0.00 C ATOM 1225 C ALA A 189 108.253 -12.334 6.971 1.00 0.00 C ATOM 1226 O ALA A 189 108.340 -11.160 6.612 1.00 0.00 O ATOM 1227 CB ALA A 189 110.206 -13.893 6.857 1.00 0.00 C ATOM 0 H ALA A 189 108.939 -14.769 8.780 1.00 0.00 H new ATOM 0 HA ALA A 189 110.015 -12.195 8.158 1.00 0.00 H new ATOM 0 HB1 ALA A 189 110.584 -13.314 6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 189 111.044 -14.307 7.418 1.00 0.00 H new ATOM 0 HB3 ALA A 189 109.580 -14.705 6.487 1.00 0.00 H new ATOM 1233 N MET A 190 107.202 -13.100 6.680 1.00 0.00 N ATOM 1234 CA MET A 190 106.073 -12.588 5.908 1.00 0.00 C ATOM 1235 C MET A 190 105.465 -11.350 6.570 1.00 0.00 C ATOM 1236 O MET A 190 105.165 -10.365 5.896 1.00 0.00 O ATOM 1237 CB MET A 190 105.012 -13.681 5.724 1.00 0.00 C ATOM 1238 CG MET A 190 104.120 -13.890 6.936 1.00 0.00 C ATOM 1239 SD MET A 190 102.920 -12.562 7.164 1.00 0.00 S ATOM 1240 CE MET A 190 102.068 -13.124 8.635 1.00 0.00 C ATOM 0 H MET A 190 107.110 -14.075 6.967 1.00 0.00 H new ATOM 0 HA MET A 190 106.442 -12.292 4.926 1.00 0.00 H new ATOM 0 HB2 MET A 190 104.388 -13.426 4.867 1.00 0.00 H new ATOM 0 HB3 MET A 190 105.511 -14.621 5.487 1.00 0.00 H new ATOM 0 HG2 MET A 190 103.590 -14.837 6.832 1.00 0.00 H new ATOM 0 HG3 MET A 190 104.741 -13.969 7.828 1.00 0.00 H new ATOM 0 HE1 MET A 190 101.474 -12.308 9.046 1.00 0.00 H new ATOM 0 HE2 MET A 190 101.413 -13.957 8.380 1.00 0.00 H new ATOM 0 HE3 MET A 190 102.798 -13.450 9.376 1.00 0.00 H new ATOM 1250 N ASP A 191 105.299 -11.396 7.892 1.00 0.00 N ATOM 1251 CA ASP A 191 104.745 -10.264 8.627 1.00 0.00 C ATOM 1252 C ASP A 191 105.674 -9.066 8.520 1.00 0.00 C ATOM 1253 O ASP A 191 105.216 -7.926 8.483 1.00 0.00 O ATOM 1254 CB ASP A 191 104.491 -10.620 10.097 1.00 0.00 C ATOM 1255 CG ASP A 191 105.763 -10.770 10.908 1.00 0.00 C ATOM 1256 OD1 ASP A 191 106.842 -10.427 10.392 1.00 0.00 O ATOM 1257 OD2 ASP A 191 105.673 -11.214 12.072 1.00 0.00 O ATOM 0 H ASP A 191 105.539 -12.201 8.471 1.00 0.00 H new ATOM 0 HA ASP A 191 103.784 -10.008 8.180 1.00 0.00 H new ATOM 0 HB2 ASP A 191 103.870 -9.846 10.549 1.00 0.00 H new ATOM 0 HB3 ASP A 191 103.926 -11.551 10.145 1.00 0.00 H new ATOM 1262 N ALA A 192 106.978 -9.308 8.447 1.00 0.00 N ATOM 1263 CA ALA A 192 107.925 -8.216 8.314 1.00 0.00 C ATOM 1264 C ALA A 192 107.580 -7.403 7.072 1.00 0.00 C ATOM 1265 O ALA A 192 107.453 -6.181 7.126 1.00 0.00 O ATOM 1266 CB ALA A 192 109.346 -8.768 8.239 1.00 0.00 C ATOM 0 H ALA A 192 107.396 -10.238 8.477 1.00 0.00 H new ATOM 0 HA ALA A 192 107.866 -7.562 9.184 1.00 0.00 H new ATOM 0 HB1 ALA A 192 110.052 -7.943 8.139 1.00 0.00 H new ATOM 0 HB2 ALA A 192 109.568 -9.327 9.148 1.00 0.00 H new ATOM 0 HB3 ALA A 192 109.435 -9.428 7.376 1.00 0.00 H new ATOM 1272 N ALA A 193 107.412 -8.103 5.955 1.00 0.00 N ATOM 1273 CA ALA A 193 107.058 -7.464 4.695 1.00 0.00 C ATOM 1274 C ALA A 193 105.796 -6.632 4.860 1.00 0.00 C ATOM 1275 O ALA A 193 105.720 -5.502 4.380 1.00 0.00 O ATOM 1276 CB ALA A 193 106.888 -8.512 3.617 1.00 0.00 C ATOM 0 H ALA A 193 107.516 -9.116 5.898 1.00 0.00 H new ATOM 0 HA ALA A 193 107.862 -6.792 4.395 1.00 0.00 H new ATOM 0 HB1 ALA A 193 106.623 -8.028 2.677 1.00 0.00 H new ATOM 0 HB2 ALA A 193 107.822 -9.060 3.492 1.00 0.00 H new ATOM 0 HB3 ALA A 193 106.096 -9.204 3.904 1.00 0.00 H new ATOM 1282 N GLU A 194 104.805 -7.175 5.557 1.00 0.00 N ATOM 1283 CA GLU A 194 103.572 -6.438 5.785 1.00 0.00 C ATOM 1284 C GLU A 194 103.926 -5.057 6.326 1.00 0.00 C ATOM 1285 O GLU A 194 103.486 -4.039 5.797 1.00 0.00 O ATOM 1286 CB GLU A 194 102.660 -7.194 6.756 1.00 0.00 C ATOM 1287 CG GLU A 194 102.108 -8.490 6.186 1.00 0.00 C ATOM 1288 CD GLU A 194 101.204 -9.218 7.162 1.00 0.00 C ATOM 1289 OE1 GLU A 194 101.011 -8.708 8.286 1.00 0.00 O ATOM 1290 OE2 GLU A 194 100.689 -10.297 6.802 1.00 0.00 O ATOM 0 H GLU A 194 104.831 -8.108 5.968 1.00 0.00 H new ATOM 0 HA GLU A 194 103.026 -6.331 4.848 1.00 0.00 H new ATOM 0 HB2 GLU A 194 103.216 -7.415 7.667 1.00 0.00 H new ATOM 0 HB3 GLU A 194 101.829 -6.548 7.039 1.00 0.00 H new ATOM 0 HG2 GLU A 194 101.552 -8.274 5.274 1.00 0.00 H new ATOM 0 HG3 GLU A 194 102.936 -9.142 5.908 1.00 0.00 H new ATOM 1297 N ASP A 195 104.759 -5.031 7.352 1.00 0.00 N ATOM 1298 CA ASP A 195 105.209 -3.772 7.924 1.00 0.00 C ATOM 1299 C ASP A 195 105.887 -2.931 6.839 1.00 0.00 C ATOM 1300 O ASP A 195 105.667 -1.725 6.736 1.00 0.00 O ATOM 1301 CB ASP A 195 106.182 -4.030 9.077 1.00 0.00 C ATOM 1302 CG ASP A 195 106.643 -2.748 9.743 1.00 0.00 C ATOM 1303 OD1 ASP A 195 105.782 -2.005 10.260 1.00 0.00 O ATOM 1304 OD2 ASP A 195 107.864 -2.487 9.747 1.00 0.00 O ATOM 0 H ASP A 195 105.137 -5.863 7.805 1.00 0.00 H new ATOM 0 HA ASP A 195 104.348 -3.229 8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 195 105.701 -4.669 9.818 1.00 0.00 H new ATOM 0 HB3 ASP A 195 107.049 -4.574 8.702 1.00 0.00 H new ATOM 1309 N HIS A 196 106.731 -3.591 6.048 1.00 0.00 N ATOM 1310 CA HIS A 196 107.486 -2.951 4.970 1.00 0.00 C ATOM 1311 C HIS A 196 106.590 -2.230 3.969 1.00 0.00 C ATOM 1312 O HIS A 196 106.918 -1.139 3.511 1.00 0.00 O ATOM 1313 CB HIS A 196 108.310 -4.017 4.245 1.00 0.00 C ATOM 1314 CG HIS A 196 109.227 -3.496 3.185 1.00 0.00 C ATOM 1315 ND1 HIS A 196 108.756 -2.807 2.092 1.00 0.00 N ATOM 1316 CD2 HIS A 196 110.567 -3.636 3.078 1.00 0.00 C ATOM 1317 CE1 HIS A 196 109.816 -2.548 1.345 1.00 0.00 C ATOM 1318 NE2 HIS A 196 110.938 -3.030 1.905 1.00 0.00 N ATOM 0 H HIS A 196 106.912 -4.591 6.137 1.00 0.00 H new ATOM 0 HA HIS A 196 108.131 -2.196 5.420 1.00 0.00 H new ATOM 0 HB2 HIS A 196 108.902 -4.560 4.982 1.00 0.00 H new ATOM 0 HB3 HIS A 196 107.628 -4.736 3.792 1.00 0.00 H new ATOM 0 HD2 HIS A 196 111.220 -4.130 3.782 1.00 0.00 H new ATOM 0 HE1 HIS A 196 109.784 -2.017 0.405 1.00 0.00 H new ATOM 0 HE2 HIS A 196 111.884 -2.959 1.530 1.00 0.00 H new ATOM 1326 N ARG A 197 105.476 -2.847 3.611 1.00 0.00 N ATOM 1327 CA ARG A 197 104.568 -2.251 2.639 1.00 0.00 C ATOM 1328 C ARG A 197 103.789 -1.073 3.223 1.00 0.00 C ATOM 1329 O ARG A 197 103.634 -0.036 2.579 1.00 0.00 O ATOM 1330 CB ARG A 197 103.591 -3.300 2.098 1.00 0.00 C ATOM 1331 CG ARG A 197 102.715 -3.955 3.151 1.00 0.00 C ATOM 1332 CD ARG A 197 101.464 -4.564 2.540 1.00 0.00 C ATOM 1333 NE ARG A 197 100.644 -3.555 1.874 1.00 0.00 N ATOM 1334 CZ ARG A 197 99.430 -3.793 1.389 1.00 0.00 C ATOM 1335 NH1 ARG A 197 98.882 -4.991 1.529 1.00 0.00 N ATOM 1336 NH2 ARG A 197 98.759 -2.829 0.774 1.00 0.00 N ATOM 0 H ARG A 197 105.178 -3.753 3.974 1.00 0.00 H new ATOM 0 HA ARG A 197 105.183 -1.872 1.823 1.00 0.00 H new ATOM 0 HB2 ARG A 197 102.949 -2.829 1.353 1.00 0.00 H new ATOM 0 HB3 ARG A 197 104.160 -4.075 1.585 1.00 0.00 H new ATOM 0 HG2 ARG A 197 103.283 -4.730 3.666 1.00 0.00 H new ATOM 0 HG3 ARG A 197 102.432 -3.216 3.900 1.00 0.00 H new ATOM 0 HD2 ARG A 197 101.747 -5.335 1.823 1.00 0.00 H new ATOM 0 HD3 ARG A 197 100.879 -5.053 3.319 1.00 0.00 H new ATOM 0 HE ARG A 197 101.025 -2.614 1.776 1.00 0.00 H new ATOM 0 HH11 ARG A 197 99.392 -5.732 2.010 1.00 0.00 H new ATOM 0 HH12 ARG A 197 97.950 -5.172 1.156 1.00 0.00 H new ATOM 0 HH21 ARG A 197 99.175 -1.903 0.673 1.00 0.00 H new ATOM 0 HH22 ARG A 197 97.827 -3.013 0.402 1.00 0.00 H new ATOM 1350 N GLN A 198 103.256 -1.267 4.425 1.00 0.00 N ATOM 1351 CA GLN A 198 102.437 -0.255 5.084 1.00 0.00 C ATOM 1352 C GLN A 198 103.124 1.104 5.163 1.00 0.00 C ATOM 1353 O GLN A 198 102.636 2.104 4.638 1.00 0.00 O ATOM 1354 CB GLN A 198 102.084 -0.717 6.500 1.00 0.00 C ATOM 1355 CG GLN A 198 101.149 -1.915 6.535 1.00 0.00 C ATOM 1356 CD GLN A 198 100.825 -2.361 7.947 1.00 0.00 C ATOM 1357 OE1 GLN A 198 101.381 -1.663 8.930 1.00 0.00 O flip ATOM 1358 NE2 GLN A 198 100.084 -3.322 8.152 1.00 0.00 N flip ATOM 0 H GLN A 198 103.378 -2.123 4.966 1.00 0.00 H new ATOM 0 HA GLN A 198 101.538 -0.135 4.480 1.00 0.00 H new ATOM 0 HB2 GLN A 198 103.002 -0.968 7.031 1.00 0.00 H new ATOM 0 HB3 GLN A 198 101.621 0.110 7.038 1.00 0.00 H new ATOM 0 HG2 GLN A 198 100.224 -1.664 6.016 1.00 0.00 H new ATOM 0 HG3 GLN A 198 101.605 -2.743 5.992 1.00 0.00 H new ATOM 0 HE21 GLN A 198 99.678 -3.830 7.366 1.00 0.00 H new ATOM 0 HE22 GLN A 198 99.876 -3.610 9.108 1.00 0.00 H new ATOM 1367 N GLY A 199 104.241 1.119 5.885 1.00 0.00 N ATOM 1368 CA GLY A 199 104.992 2.338 6.117 1.00 0.00 C ATOM 1369 C GLY A 199 105.680 2.927 4.896 1.00 0.00 C ATOM 1370 O GLY A 199 105.827 4.144 4.805 1.00 0.00 O ATOM 0 H GLY A 199 104.645 0.290 6.321 1.00 0.00 H new ATOM 0 HA2 GLY A 199 104.316 3.088 6.528 1.00 0.00 H new ATOM 0 HA3 GLY A 199 105.747 2.139 6.877 1.00 0.00 H new ATOM 1374 N ILE A 200 106.128 2.090 3.968 1.00 0.00 N ATOM 1375 CA ILE A 200 106.826 2.595 2.787 1.00 0.00 C ATOM 1376 C ILE A 200 105.878 3.310 1.814 1.00 0.00 C ATOM 1377 O ILE A 200 106.238 4.327 1.221 1.00 0.00 O ATOM 1378 CB ILE A 200 107.591 1.468 2.052 1.00 0.00 C ATOM 1379 CG1 ILE A 200 108.895 2.013 1.464 1.00 0.00 C ATOM 1380 CG2 ILE A 200 106.736 0.837 0.960 1.00 0.00 C ATOM 1381 CD1 ILE A 200 109.626 1.027 0.580 1.00 0.00 C ATOM 0 H ILE A 200 106.024 1.076 4.006 1.00 0.00 H new ATOM 0 HA ILE A 200 107.549 3.326 3.149 1.00 0.00 H new ATOM 0 HB ILE A 200 107.827 0.690 2.778 1.00 0.00 H new ATOM 0 HG12 ILE A 200 108.675 2.911 0.886 1.00 0.00 H new ATOM 0 HG13 ILE A 200 109.553 2.312 2.280 1.00 0.00 H new ATOM 0 HG21 ILE A 200 107.303 0.049 0.464 1.00 0.00 H new ATOM 0 HG22 ILE A 200 105.836 0.412 1.403 1.00 0.00 H new ATOM 0 HG23 ILE A 200 106.457 1.598 0.231 1.00 0.00 H new ATOM 0 HD11 ILE A 200 110.539 1.486 0.201 1.00 0.00 H new ATOM 0 HD12 ILE A 200 109.879 0.138 1.158 1.00 0.00 H new ATOM 0 HD13 ILE A 200 108.987 0.746 -0.257 1.00 0.00 H new ATOM 1393 N ALA A 201 104.674 2.764 1.647 1.00 0.00 N ATOM 1394 CA ALA A 201 103.679 3.337 0.738 1.00 0.00 C ATOM 1395 C ALA A 201 103.239 4.728 1.180 1.00 0.00 C ATOM 1396 O ALA A 201 103.024 5.620 0.360 1.00 0.00 O ATOM 1397 CB ALA A 201 102.472 2.410 0.644 1.00 0.00 C ATOM 0 H ALA A 201 104.362 1.922 2.131 1.00 0.00 H new ATOM 0 HA ALA A 201 104.142 3.437 -0.244 1.00 0.00 H new ATOM 0 HB1 ALA A 201 101.734 2.841 -0.033 1.00 0.00 H new ATOM 0 HB2 ALA A 201 102.788 1.438 0.266 1.00 0.00 H new ATOM 0 HB3 ALA A 201 102.029 2.288 1.632 1.00 0.00 H new ATOM 1403 N ARG A 202 103.103 4.890 2.480 1.00 0.00 N ATOM 1404 CA ARG A 202 102.682 6.148 3.078 1.00 0.00 C ATOM 1405 C ARG A 202 103.781 7.206 3.075 1.00 0.00 C ATOM 1406 O ARG A 202 103.505 8.365 3.384 1.00 0.00 O ATOM 1407 CB ARG A 202 102.247 5.903 4.517 1.00 0.00 C ATOM 1408 CG ARG A 202 103.331 5.275 5.364 1.00 0.00 C ATOM 1409 CD ARG A 202 102.955 5.268 6.837 1.00 0.00 C ATOM 1410 NE ARG A 202 102.443 6.564 7.279 1.00 0.00 N ATOM 1411 CZ ARG A 202 103.100 7.715 7.135 1.00 0.00 C ATOM 1412 NH1 ARG A 202 104.290 7.742 6.547 1.00 0.00 N ATOM 1413 NH2 ARG A 202 102.561 8.843 7.576 1.00 0.00 N ATOM 0 H ARG A 202 103.282 4.150 3.159 1.00 0.00 H new ATOM 0 HA ARG A 202 101.858 6.526 2.473 1.00 0.00 H new ATOM 0 HB2 ARG A 202 101.946 6.850 4.966 1.00 0.00 H new ATOM 0 HB3 ARG A 202 101.370 5.255 4.520 1.00 0.00 H new ATOM 0 HG2 ARG A 202 103.510 4.253 5.029 1.00 0.00 H new ATOM 0 HG3 ARG A 202 104.263 5.823 5.228 1.00 0.00 H new ATOM 0 HD2 ARG A 202 102.201 4.501 7.015 1.00 0.00 H new ATOM 0 HD3 ARG A 202 103.828 5.001 7.433 1.00 0.00 H new ATOM 0 HE ARG A 202 101.526 6.589 7.725 1.00 0.00 H new ATOM 0 HH11 ARG A 202 104.708 6.878 6.202 1.00 0.00 H new ATOM 0 HH12 ARG A 202 104.786 8.627 6.441 1.00 0.00 H new ATOM 0 HH21 ARG A 202 101.645 8.829 8.025 1.00 0.00 H new ATOM 0 HH22 ARG A 202 103.062 9.725 7.467 1.00 0.00 H new ATOM 1427 N ASN A 203 105.027 6.839 2.758 1.00 0.00 N ATOM 1428 CA ASN A 203 106.113 7.823 2.773 1.00 0.00 C ATOM 1429 C ASN A 203 106.542 8.231 1.369 1.00 0.00 C ATOM 1430 O ASN A 203 107.215 9.246 1.194 1.00 0.00 O ATOM 1431 CB ASN A 203 107.317 7.276 3.540 1.00 0.00 C ATOM 1432 CG ASN A 203 107.009 7.043 5.005 1.00 0.00 C ATOM 1433 OD1 ASN A 203 106.552 7.945 5.706 1.00 0.00 O ATOM 1434 ND2 ASN A 203 107.273 5.832 5.480 1.00 0.00 N ATOM 0 H ASN A 203 105.304 5.893 2.494 1.00 0.00 H new ATOM 0 HA ASN A 203 105.730 8.712 3.275 1.00 0.00 H new ATOM 0 HB2 ASN A 203 107.639 6.339 3.085 1.00 0.00 H new ATOM 0 HB3 ASN A 203 108.149 7.975 3.453 1.00 0.00 H new ATOM 0 HD21 ASN A 203 107.097 5.620 6.462 1.00 0.00 H new ATOM 0 HD22 ASN A 203 107.652 5.113 4.863 1.00 0.00 H new ATOM 1441 N HIS A 204 106.153 7.448 0.370 1.00 0.00 N ATOM 1442 CA HIS A 204 106.512 7.765 -1.013 1.00 0.00 C ATOM 1443 C HIS A 204 105.319 7.643 -1.960 1.00 0.00 C ATOM 1444 O HIS A 204 105.011 8.587 -2.689 1.00 0.00 O ATOM 1445 CB HIS A 204 107.681 6.901 -1.495 1.00 0.00 C ATOM 1446 CG HIS A 204 107.461 5.430 -1.360 1.00 0.00 C ATOM 1447 ND1 HIS A 204 106.258 4.849 -1.665 1.00 0.00 N ATOM 1448 CD2 HIS A 204 108.330 4.470 -0.977 1.00 0.00 C ATOM 1449 CE1 HIS A 204 106.418 3.558 -1.462 1.00 0.00 C ATOM 1450 NE2 HIS A 204 107.659 3.279 -1.048 1.00 0.00 N ATOM 0 H HIS A 204 105.597 6.601 0.485 1.00 0.00 H new ATOM 0 HA HIS A 204 106.830 8.807 -1.026 1.00 0.00 H new ATOM 0 HB2 HIS A 204 107.879 7.131 -2.542 1.00 0.00 H new ATOM 0 HB3 HIS A 204 108.574 7.175 -0.934 1.00 0.00 H new ATOM 0 HD2 HIS A 204 109.356 4.614 -0.673 1.00 0.00 H new ATOM 0 HE1 HIS A 204 105.645 2.818 -1.611 1.00 0.00 H new ATOM 0 HE2 HIS A 204 108.033 2.356 -0.828 1.00 0.00 H new ATOM 1458 N TYR A 205 104.641 6.495 -1.958 1.00 0.00 N ATOM 1459 CA TYR A 205 103.489 6.318 -2.839 1.00 0.00 C ATOM 1460 C TYR A 205 102.726 5.031 -2.550 1.00 0.00 C ATOM 1461 O TYR A 205 103.323 3.998 -2.255 1.00 0.00 O ATOM 1462 CB TYR A 205 103.935 6.291 -4.302 1.00 0.00 C ATOM 1463 CG TYR A 205 104.815 5.111 -4.651 1.00 0.00 C ATOM 1464 CD1 TYR A 205 106.149 5.091 -4.281 1.00 0.00 C ATOM 1465 CD2 TYR A 205 104.309 4.019 -5.344 1.00 0.00 C ATOM 1466 CE1 TYR A 205 106.961 4.021 -4.592 1.00 0.00 C ATOM 1467 CE2 TYR A 205 105.115 2.940 -5.659 1.00 0.00 C ATOM 1468 CZ TYR A 205 106.440 2.947 -5.281 1.00 0.00 C ATOM 1469 OH TYR A 205 107.247 1.876 -5.593 1.00 0.00 O ATOM 0 H TYR A 205 104.863 5.691 -1.370 1.00 0.00 H new ATOM 0 HA TYR A 205 102.828 7.164 -2.652 1.00 0.00 H new ATOM 0 HB2 TYR A 205 103.052 6.275 -4.941 1.00 0.00 H new ATOM 0 HB3 TYR A 205 104.473 7.212 -4.525 1.00 0.00 H new ATOM 0 HD1 TYR A 205 106.561 5.929 -3.739 1.00 0.00 H new ATOM 0 HD2 TYR A 205 103.271 4.012 -5.641 1.00 0.00 H new ATOM 0 HE1 TYR A 205 108.000 4.024 -4.297 1.00 0.00 H new ATOM 0 HE2 TYR A 205 104.708 2.097 -6.198 1.00 0.00 H new ATOM 0 HH TYR A 205 106.725 1.204 -6.078 1.00 0.00 H new ATOM 1479 N ASP A 206 101.409 5.084 -2.700 1.00 0.00 N ATOM 1480 CA ASP A 206 100.577 3.904 -2.518 1.00 0.00 C ATOM 1481 C ASP A 206 101.117 2.768 -3.381 1.00 0.00 C ATOM 1482 O ASP A 206 101.065 2.836 -4.609 1.00 0.00 O ATOM 1483 CB ASP A 206 99.133 4.217 -2.916 1.00 0.00 C ATOM 1484 CG ASP A 206 98.522 5.307 -2.057 1.00 0.00 C ATOM 1485 OD1 ASP A 206 99.221 5.814 -1.155 1.00 0.00 O ATOM 1486 OD2 ASP A 206 97.344 5.653 -2.287 1.00 0.00 O ATOM 0 H ASP A 206 100.896 5.930 -2.947 1.00 0.00 H new ATOM 0 HA ASP A 206 100.597 3.606 -1.470 1.00 0.00 H new ATOM 0 HB2 ASP A 206 99.105 4.523 -3.962 1.00 0.00 H new ATOM 0 HB3 ASP A 206 98.531 3.312 -2.833 1.00 0.00 H new ATOM 1491 N CYS A 207 101.651 1.730 -2.737 1.00 0.00 N ATOM 1492 CA CYS A 207 102.217 0.590 -3.458 1.00 0.00 C ATOM 1493 C CYS A 207 101.372 -0.663 -3.266 1.00 0.00 C ATOM 1494 O CYS A 207 100.853 -0.912 -2.177 1.00 0.00 O ATOM 1495 CB CYS A 207 103.645 0.314 -2.976 1.00 0.00 C ATOM 1496 SG CYS A 207 103.750 -0.309 -1.282 1.00 0.00 S ATOM 0 H CYS A 207 101.703 1.655 -1.721 1.00 0.00 H new ATOM 0 HA CYS A 207 102.228 0.844 -4.518 1.00 0.00 H new ATOM 0 HB2 CYS A 207 104.109 -0.410 -3.646 1.00 0.00 H new ATOM 0 HB3 CYS A 207 104.225 1.234 -3.049 1.00 0.00 H new ATOM 0 HG CYS A 207 102.605 -0.817 -0.935 1.00 0.00 H new ATOM 1502 N GLY A 208 101.258 -1.461 -4.320 1.00 0.00 N ATOM 1503 CA GLY A 208 100.498 -2.697 -4.242 1.00 0.00 C ATOM 1504 C GLY A 208 101.413 -3.896 -4.098 1.00 0.00 C ATOM 1505 O GLY A 208 102.634 -3.755 -4.173 1.00 0.00 O ATOM 0 H GLY A 208 101.679 -1.275 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 208 99.815 -2.654 -3.394 1.00 0.00 H new ATOM 0 HA3 GLY A 208 99.887 -2.808 -5.138 1.00 0.00 H new ATOM 1509 N TYR A 209 100.840 -5.077 -3.901 1.00 0.00 N ATOM 1510 CA TYR A 209 101.641 -6.287 -3.763 1.00 0.00 C ATOM 1511 C TYR A 209 102.462 -6.523 -5.023 1.00 0.00 C ATOM 1512 O TYR A 209 103.678 -6.687 -4.966 1.00 0.00 O ATOM 1513 CB TYR A 209 100.742 -7.494 -3.498 1.00 0.00 C ATOM 1514 CG TYR A 209 99.911 -7.366 -2.240 1.00 0.00 C ATOM 1515 CD1 TYR A 209 100.517 -7.224 -0.997 1.00 0.00 C ATOM 1516 CD2 TYR A 209 98.522 -7.389 -2.294 1.00 0.00 C ATOM 1517 CE1 TYR A 209 99.763 -7.109 0.153 1.00 0.00 C ATOM 1518 CE2 TYR A 209 97.762 -7.275 -1.147 1.00 0.00 C ATOM 1519 CZ TYR A 209 98.386 -7.135 0.073 1.00 0.00 C ATOM 1520 OH TYR A 209 97.632 -7.022 1.219 1.00 0.00 O ATOM 0 H TYR A 209 99.833 -5.223 -3.834 1.00 0.00 H new ATOM 0 HA TYR A 209 102.317 -6.157 -2.918 1.00 0.00 H new ATOM 0 HB2 TYR A 209 100.077 -7.635 -4.350 1.00 0.00 H new ATOM 0 HB3 TYR A 209 101.361 -8.388 -3.425 1.00 0.00 H new ATOM 0 HD1 TYR A 209 101.595 -7.203 -0.930 1.00 0.00 H new ATOM 0 HD2 TYR A 209 98.029 -7.498 -3.249 1.00 0.00 H new ATOM 0 HE1 TYR A 209 100.249 -6.999 1.111 1.00 0.00 H new ATOM 0 HE2 TYR A 209 96.684 -7.295 -1.206 1.00 0.00 H new ATOM 0 HH TYR A 209 96.680 -7.058 0.989 1.00 0.00 H new ATOM 1530 N GLU A 210 101.781 -6.528 -6.161 1.00 0.00 N ATOM 1531 CA GLU A 210 102.431 -6.732 -7.447 1.00 0.00 C ATOM 1532 C GLU A 210 103.456 -5.635 -7.711 1.00 0.00 C ATOM 1533 O GLU A 210 104.550 -5.874 -8.237 1.00 0.00 O ATOM 1534 CB GLU A 210 101.379 -6.710 -8.559 1.00 0.00 C ATOM 1535 CG GLU A 210 101.959 -6.915 -9.949 1.00 0.00 C ATOM 1536 CD GLU A 210 100.899 -6.889 -11.032 1.00 0.00 C ATOM 1537 OE1 GLU A 210 99.710 -6.712 -10.695 1.00 0.00 O ATOM 1538 OE2 GLU A 210 101.258 -7.048 -12.218 1.00 0.00 O ATOM 0 H GLU A 210 100.772 -6.392 -6.219 1.00 0.00 H new ATOM 0 HA GLU A 210 102.940 -7.696 -7.429 1.00 0.00 H new ATOM 0 HB2 GLU A 210 100.640 -7.487 -8.364 1.00 0.00 H new ATOM 0 HB3 GLU A 210 100.853 -5.756 -8.531 1.00 0.00 H new ATOM 0 HG2 GLU A 210 102.697 -6.138 -10.149 1.00 0.00 H new ATOM 0 HG3 GLU A 210 102.484 -7.870 -9.982 1.00 0.00 H new ATOM 1545 N MET A 211 103.057 -4.417 -7.363 1.00 0.00 N ATOM 1546 CA MET A 211 103.876 -3.237 -7.575 1.00 0.00 C ATOM 1547 C MET A 211 105.276 -3.356 -6.981 1.00 0.00 C ATOM 1548 O MET A 211 106.253 -3.491 -7.719 1.00 0.00 O ATOM 1549 CB MET A 211 103.178 -2.000 -7.011 1.00 0.00 C ATOM 1550 CG MET A 211 101.826 -1.720 -7.648 1.00 0.00 C ATOM 1551 SD MET A 211 101.028 -0.254 -6.965 1.00 0.00 S ATOM 1552 CE MET A 211 99.508 -0.223 -7.912 1.00 0.00 C ATOM 0 H MET A 211 102.156 -4.223 -6.926 1.00 0.00 H new ATOM 0 HA MET A 211 103.999 -3.140 -8.654 1.00 0.00 H new ATOM 0 HB2 MET A 211 103.045 -2.127 -5.937 1.00 0.00 H new ATOM 0 HB3 MET A 211 103.823 -1.133 -7.152 1.00 0.00 H new ATOM 0 HG2 MET A 211 101.954 -1.592 -8.723 1.00 0.00 H new ATOM 0 HG3 MET A 211 101.176 -2.583 -7.505 1.00 0.00 H new ATOM 0 HE1 MET A 211 98.904 0.630 -7.603 1.00 0.00 H new ATOM 0 HE2 MET A 211 99.742 -0.137 -8.973 1.00 0.00 H new ATOM 0 HE3 MET A 211 98.951 -1.144 -7.737 1.00 0.00 H new ATOM 1562 N HIS A 212 105.402 -3.246 -5.656 1.00 0.00 N ATOM 1563 CA HIS A 212 106.733 -3.281 -5.057 1.00 0.00 C ATOM 1564 C HIS A 212 107.293 -4.687 -4.840 1.00 0.00 C ATOM 1565 O HIS A 212 108.508 -4.819 -4.707 1.00 0.00 O ATOM 1566 CB HIS A 212 106.848 -2.372 -3.827 1.00 0.00 C ATOM 1567 CG HIS A 212 107.045 -3.090 -2.526 1.00 0.00 C ATOM 1568 ND1 HIS A 212 106.138 -4.010 -2.054 1.00 0.00 N ATOM 1569 CD2 HIS A 212 108.049 -2.959 -1.631 1.00 0.00 C ATOM 1570 CE1 HIS A 212 106.610 -4.413 -0.885 1.00 0.00 C ATOM 1571 NE2 HIS A 212 107.767 -3.803 -0.589 1.00 0.00 N ATOM 0 H HIS A 212 104.628 -3.136 -5.000 1.00 0.00 H new ATOM 0 HA HIS A 212 107.396 -2.854 -5.809 1.00 0.00 H new ATOM 0 HB2 HIS A 212 107.682 -1.687 -3.977 1.00 0.00 H new ATOM 0 HB3 HIS A 212 105.946 -1.765 -3.757 1.00 0.00 H new ATOM 0 HD1 HIS A 212 105.279 -4.318 -2.510 1.00 0.00 H new ATOM 0 HD2 HIS A 212 108.909 -2.312 -1.720 1.00 0.00 H new ATOM 0 HE1 HIS A 212 106.125 -5.140 -0.251 1.00 0.00 H new ATOM 1579 N THR A 213 106.503 -5.759 -4.922 1.00 0.00 N ATOM 1580 CA THR A 213 107.125 -7.078 -4.859 1.00 0.00 C ATOM 1581 C THR A 213 108.229 -7.073 -5.906 1.00 0.00 C ATOM 1582 O THR A 213 109.386 -7.385 -5.617 1.00 0.00 O ATOM 1583 CB THR A 213 106.120 -8.192 -5.166 1.00 0.00 C ATOM 1584 OG1 THR A 213 106.731 -9.461 -5.050 1.00 0.00 O ATOM 1585 CG2 THR A 213 105.518 -8.118 -6.539 1.00 0.00 C ATOM 0 H THR A 213 105.488 -5.746 -5.026 1.00 0.00 H new ATOM 0 HA THR A 213 107.509 -7.271 -3.857 1.00 0.00 H new ATOM 0 HB THR A 213 105.324 -8.052 -4.434 1.00 0.00 H new ATOM 0 HG1 THR A 213 106.677 -9.930 -5.909 1.00 0.00 H new ATOM 0 HG21 THR A 213 104.818 -8.943 -6.674 1.00 0.00 H new ATOM 0 HG22 THR A 213 104.990 -7.171 -6.654 1.00 0.00 H new ATOM 0 HG23 THR A 213 106.308 -8.186 -7.287 1.00 0.00 H new ATOM 1593 N CYS A 214 107.868 -6.637 -7.118 1.00 0.00 N ATOM 1594 CA CYS A 214 108.843 -6.503 -8.194 1.00 0.00 C ATOM 1595 C CYS A 214 109.919 -5.516 -7.756 1.00 0.00 C ATOM 1596 O CYS A 214 111.101 -5.763 -7.981 1.00 0.00 O ATOM 1597 CB CYS A 214 108.200 -6.036 -9.503 1.00 0.00 C ATOM 1598 SG CYS A 214 107.931 -4.234 -9.587 1.00 0.00 S ATOM 0 H CYS A 214 106.916 -6.374 -7.372 1.00 0.00 H new ATOM 0 HA CYS A 214 109.279 -7.483 -8.388 1.00 0.00 H new ATOM 0 HB2 CYS A 214 108.833 -6.339 -10.337 1.00 0.00 H new ATOM 0 HB3 CYS A 214 107.243 -6.543 -9.629 1.00 0.00 H new ATOM 1603 N LEU A 215 109.554 -4.430 -7.087 1.00 0.00 N ATOM 1604 CA LEU A 215 110.590 -3.519 -6.615 1.00 0.00 C ATOM 1605 C LEU A 215 111.620 -4.342 -5.844 1.00 0.00 C ATOM 1606 O LEU A 215 112.827 -4.128 -5.950 1.00 0.00 O ATOM 1607 CB LEU A 215 110.014 -2.409 -5.725 1.00 0.00 C ATOM 1608 CG LEU A 215 111.047 -1.419 -5.178 1.00 0.00 C ATOM 1609 CD1 LEU A 215 111.913 -2.061 -4.094 1.00 0.00 C ATOM 1610 CD2 LEU A 215 111.915 -0.891 -6.311 1.00 0.00 C ATOM 0 H LEU A 215 108.594 -4.165 -6.866 1.00 0.00 H new ATOM 0 HA LEU A 215 111.052 -3.024 -7.469 1.00 0.00 H new ATOM 0 HB2 LEU A 215 109.269 -1.855 -6.296 1.00 0.00 H new ATOM 0 HB3 LEU A 215 109.494 -2.870 -4.885 1.00 0.00 H new ATOM 0 HG LEU A 215 110.511 -0.586 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 215 112.636 -1.332 -3.727 1.00 0.00 H new ATOM 0 HD12 LEU A 215 111.280 -2.391 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 215 112.442 -2.918 -4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 215 112.646 -0.188 -5.912 1.00 0.00 H new ATOM 0 HD22 LEU A 215 112.434 -1.722 -6.789 1.00 0.00 H new ATOM 0 HD23 LEU A 215 111.288 -0.385 -7.044 1.00 0.00 H new ATOM 1622 N GLY A 216 111.101 -5.291 -5.070 1.00 0.00 N ATOM 1623 CA GLY A 216 111.931 -6.169 -4.264 1.00 0.00 C ATOM 1624 C GLY A 216 112.962 -6.956 -5.061 1.00 0.00 C ATOM 1625 O GLY A 216 114.067 -7.192 -4.574 1.00 0.00 O ATOM 0 H GLY A 216 110.100 -5.469 -4.987 1.00 0.00 H new ATOM 0 HA2 GLY A 216 112.447 -5.573 -3.511 1.00 0.00 H new ATOM 0 HA3 GLY A 216 111.289 -6.869 -3.730 1.00 0.00 H new ATOM 1629 N GLU A 217 112.615 -7.390 -6.273 1.00 0.00 N ATOM 1630 CA GLU A 217 113.561 -8.166 -7.080 1.00 0.00 C ATOM 1631 C GLU A 217 114.604 -7.263 -7.739 1.00 0.00 C ATOM 1632 O GLU A 217 115.770 -7.641 -7.844 1.00 0.00 O ATOM 1633 CB GLU A 217 112.843 -9.031 -8.124 1.00 0.00 C ATOM 1634 CG GLU A 217 112.288 -8.259 -9.306 1.00 0.00 C ATOM 1635 CD GLU A 217 111.673 -9.165 -10.355 1.00 0.00 C ATOM 1636 OE1 GLU A 217 110.715 -9.893 -10.023 1.00 0.00 O ATOM 1637 OE2 GLU A 217 112.150 -9.145 -11.510 1.00 0.00 O ATOM 0 H GLU A 217 111.709 -7.224 -6.711 1.00 0.00 H new ATOM 0 HA GLU A 217 114.083 -8.840 -6.401 1.00 0.00 H new ATOM 0 HB2 GLU A 217 113.538 -9.785 -8.493 1.00 0.00 H new ATOM 0 HB3 GLU A 217 112.025 -9.562 -7.637 1.00 0.00 H new ATOM 0 HG2 GLU A 217 111.536 -7.553 -8.954 1.00 0.00 H new ATOM 0 HG3 GLU A 217 113.087 -7.673 -9.760 1.00 0.00 H new ATOM 1644 N MET A 218 114.203 -6.069 -8.166 1.00 0.00 N ATOM 1645 CA MET A 218 115.147 -5.139 -8.787 1.00 0.00 C ATOM 1646 C MET A 218 115.967 -4.455 -7.704 1.00 0.00 C ATOM 1647 O MET A 218 116.823 -3.612 -7.972 1.00 0.00 O ATOM 1648 CB MET A 218 114.399 -4.093 -9.613 1.00 0.00 C ATOM 1649 CG MET A 218 113.592 -4.688 -10.754 1.00 0.00 C ATOM 1650 SD MET A 218 112.482 -3.489 -11.507 1.00 0.00 S ATOM 1651 CE MET A 218 111.433 -3.104 -10.108 1.00 0.00 C ATOM 0 H MET A 218 113.246 -5.724 -8.096 1.00 0.00 H new ATOM 0 HA MET A 218 115.810 -5.694 -9.451 1.00 0.00 H new ATOM 0 HB2 MET A 218 113.731 -3.534 -8.958 1.00 0.00 H new ATOM 0 HB3 MET A 218 115.117 -3.380 -10.019 1.00 0.00 H new ATOM 0 HG2 MET A 218 114.272 -5.076 -11.512 1.00 0.00 H new ATOM 0 HG3 MET A 218 113.012 -5.533 -10.383 1.00 0.00 H new ATOM 0 HE1 MET A 218 110.388 -3.220 -10.394 1.00 0.00 H new ATOM 0 HE2 MET A 218 111.661 -3.781 -9.285 1.00 0.00 H new ATOM 0 HE3 MET A 218 111.610 -2.076 -9.792 1.00 0.00 H new ATOM 1661 N TYR A 219 115.642 -4.813 -6.469 1.00 0.00 N ATOM 1662 CA TYR A 219 116.265 -4.247 -5.281 1.00 0.00 C ATOM 1663 C TYR A 219 117.763 -4.546 -5.261 1.00 0.00 C ATOM 1664 O TYR A 219 118.576 -3.753 -4.784 1.00 0.00 O ATOM 1665 CB TYR A 219 115.584 -4.895 -4.070 1.00 0.00 C ATOM 1666 CG TYR A 219 115.516 -4.077 -2.796 1.00 0.00 C ATOM 1667 CD1 TYR A 219 116.106 -2.822 -2.669 1.00 0.00 C ATOM 1668 CD2 TYR A 219 114.820 -4.584 -1.706 1.00 0.00 C ATOM 1669 CE1 TYR A 219 116.001 -2.106 -1.490 1.00 0.00 C ATOM 1670 CE2 TYR A 219 114.708 -3.876 -0.532 1.00 0.00 C ATOM 1671 CZ TYR A 219 115.298 -2.638 -0.426 1.00 0.00 C ATOM 1672 OH TYR A 219 115.180 -1.927 0.746 1.00 0.00 O ATOM 0 H TYR A 219 114.930 -5.513 -6.262 1.00 0.00 H new ATOM 0 HA TYR A 219 116.148 -3.163 -5.267 1.00 0.00 H new ATOM 0 HB2 TYR A 219 114.566 -5.160 -4.356 1.00 0.00 H new ATOM 0 HB3 TYR A 219 116.105 -5.826 -3.847 1.00 0.00 H new ATOM 0 HD1 TYR A 219 116.652 -2.403 -3.501 1.00 0.00 H new ATOM 0 HD2 TYR A 219 114.356 -5.556 -1.782 1.00 0.00 H new ATOM 0 HE1 TYR A 219 116.466 -1.135 -1.402 1.00 0.00 H new ATOM 0 HE2 TYR A 219 114.160 -4.290 0.302 1.00 0.00 H new ATOM 0 HH TYR A 219 114.654 -2.444 1.391 1.00 0.00 H new ATOM 1682 N VAL A 220 118.093 -5.731 -5.772 1.00 0.00 N ATOM 1683 CA VAL A 220 119.462 -6.230 -5.826 1.00 0.00 C ATOM 1684 C VAL A 220 120.239 -5.698 -7.028 1.00 0.00 C ATOM 1685 O VAL A 220 121.468 -5.623 -7.001 1.00 0.00 O ATOM 1686 CB VAL A 220 119.455 -7.768 -5.925 1.00 0.00 C ATOM 1687 CG1 VAL A 220 118.660 -8.372 -4.778 1.00 0.00 C ATOM 1688 CG2 VAL A 220 118.901 -8.217 -7.270 1.00 0.00 C ATOM 0 H VAL A 220 117.408 -6.377 -6.164 1.00 0.00 H new ATOM 0 HA VAL A 220 119.949 -5.886 -4.914 1.00 0.00 H new ATOM 0 HB VAL A 220 120.482 -8.124 -5.849 1.00 0.00 H new ATOM 0 HG11 VAL A 220 118.666 -9.459 -4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 220 119.111 -8.081 -3.829 1.00 0.00 H new ATOM 0 HG13 VAL A 220 117.633 -8.010 -4.817 1.00 0.00 H new ATOM 0 HG21 VAL A 220 118.905 -9.306 -7.320 1.00 0.00 H new ATOM 0 HG22 VAL A 220 117.880 -7.852 -7.383 1.00 0.00 H new ATOM 0 HG23 VAL A 220 119.521 -7.815 -8.071 1.00 0.00 H new ATOM 1698 N SER A 221 119.519 -5.380 -8.101 1.00 0.00 N ATOM 1699 CA SER A 221 120.149 -4.914 -9.334 1.00 0.00 C ATOM 1700 C SER A 221 121.030 -3.691 -9.111 1.00 0.00 C ATOM 1701 O SER A 221 122.174 -3.672 -9.565 1.00 0.00 O ATOM 1702 CB SER A 221 119.088 -4.609 -10.393 1.00 0.00 C ATOM 1703 OG SER A 221 119.684 -4.163 -11.599 1.00 0.00 O ATOM 0 H SER A 221 118.501 -5.436 -8.142 1.00 0.00 H new ATOM 0 HA SER A 221 120.794 -5.720 -9.686 1.00 0.00 H new ATOM 0 HB2 SER A 221 118.495 -5.503 -10.586 1.00 0.00 H new ATOM 0 HB3 SER A 221 118.404 -3.847 -10.018 1.00 0.00 H new ATOM 0 HG SER A 221 118.985 -3.976 -12.260 1.00 0.00 H new ATOM 1709 N ASP A 222 120.528 -2.671 -8.422 1.00 0.00 N ATOM 1710 CA ASP A 222 121.326 -1.470 -8.174 1.00 0.00 C ATOM 1711 C ASP A 222 121.879 -1.470 -6.751 1.00 0.00 C ATOM 1712 O ASP A 222 121.282 -0.899 -5.838 1.00 0.00 O ATOM 1713 CB ASP A 222 120.486 -0.218 -8.426 1.00 0.00 C ATOM 1714 CG ASP A 222 120.147 -0.035 -9.892 1.00 0.00 C ATOM 1715 OD1 ASP A 222 120.564 -0.885 -10.707 1.00 0.00 O ATOM 1716 OD2 ASP A 222 119.466 0.957 -10.225 1.00 0.00 O ATOM 0 H ASP A 222 119.587 -2.648 -8.030 1.00 0.00 H new ATOM 0 HA ASP A 222 122.171 -1.468 -8.863 1.00 0.00 H new ATOM 0 HB2 ASP A 222 119.564 -0.280 -7.848 1.00 0.00 H new ATOM 0 HB3 ASP A 222 121.028 0.658 -8.069 1.00 0.00 H new ATOM 1721 N GLU A 223 123.011 -2.145 -6.571 1.00 0.00 N ATOM 1722 CA GLU A 223 123.646 -2.265 -5.261 1.00 0.00 C ATOM 1723 C GLU A 223 123.765 -0.933 -4.527 1.00 0.00 C ATOM 1724 O GLU A 223 124.148 -0.917 -3.358 1.00 0.00 O ATOM 1725 CB GLU A 223 125.026 -2.917 -5.370 1.00 0.00 C ATOM 1726 CG GLU A 223 125.004 -4.326 -5.941 1.00 0.00 C ATOM 1727 CD GLU A 223 124.190 -5.294 -5.103 1.00 0.00 C ATOM 1728 OE1 GLU A 223 122.961 -5.103 -4.997 1.00 0.00 O ATOM 1729 OE2 GLU A 223 124.784 -6.245 -4.552 1.00 0.00 O ATOM 0 H GLU A 223 123.511 -2.621 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 223 122.988 -2.904 -4.673 1.00 0.00 H new ATOM 0 HB2 GLU A 223 125.662 -2.292 -5.997 1.00 0.00 H new ATOM 0 HB3 GLU A 223 125.482 -2.945 -4.380 1.00 0.00 H new ATOM 0 HG2 GLU A 223 124.595 -4.296 -6.951 1.00 0.00 H new ATOM 0 HG3 GLU A 223 126.026 -4.695 -6.022 1.00 0.00 H new ATOM 1736 N ARG A 224 123.402 0.176 -5.156 1.00 0.00 N ATOM 1737 CA ARG A 224 123.459 1.446 -4.443 1.00 0.00 C ATOM 1738 C ARG A 224 122.486 1.358 -3.272 1.00 0.00 C ATOM 1739 O ARG A 224 122.733 1.873 -2.175 1.00 0.00 O ATOM 1740 CB ARG A 224 123.105 2.621 -5.358 1.00 0.00 C ATOM 1741 CG ARG A 224 124.010 2.739 -6.574 1.00 0.00 C ATOM 1742 CD ARG A 224 123.769 4.039 -7.325 1.00 0.00 C ATOM 1743 NE ARG A 224 124.235 5.198 -6.569 1.00 0.00 N ATOM 1744 CZ ARG A 224 125.512 5.414 -6.267 1.00 0.00 C ATOM 1745 NH1 ARG A 224 126.446 4.567 -6.679 1.00 0.00 N ATOM 1746 NH2 ARG A 224 125.859 6.479 -5.558 1.00 0.00 N ATOM 0 H ARG A 224 123.077 0.226 -6.121 1.00 0.00 H new ATOM 0 HA ARG A 224 124.473 1.626 -4.087 1.00 0.00 H new ATOM 0 HB2 ARG A 224 122.073 2.512 -5.692 1.00 0.00 H new ATOM 0 HB3 ARG A 224 123.158 3.546 -4.784 1.00 0.00 H new ATOM 0 HG2 ARG A 224 125.052 2.687 -6.259 1.00 0.00 H new ATOM 0 HG3 ARG A 224 123.836 1.895 -7.241 1.00 0.00 H new ATOM 0 HD2 ARG A 224 124.281 4.003 -8.287 1.00 0.00 H new ATOM 0 HD3 ARG A 224 122.705 4.146 -7.534 1.00 0.00 H new ATOM 0 HE ARG A 224 123.543 5.879 -6.255 1.00 0.00 H new ATOM 0 HH11 ARG A 224 126.185 3.748 -7.229 1.00 0.00 H new ATOM 0 HH12 ARG A 224 127.425 4.735 -6.446 1.00 0.00 H new ATOM 0 HH21 ARG A 224 125.146 7.136 -5.242 1.00 0.00 H new ATOM 0 HH22 ARG A 224 126.839 6.641 -5.328 1.00 0.00 H new ATOM 1760 N PHE A 225 121.410 0.614 -3.514 1.00 0.00 N ATOM 1761 CA PHE A 225 120.385 0.332 -2.524 1.00 0.00 C ATOM 1762 C PHE A 225 120.880 -0.685 -1.501 1.00 0.00 C ATOM 1763 O PHE A 225 120.745 -0.495 -0.294 1.00 0.00 O ATOM 1764 CB PHE A 225 119.156 -0.252 -3.232 1.00 0.00 C ATOM 1765 CG PHE A 225 118.352 0.771 -3.991 1.00 0.00 C ATOM 1766 CD1 PHE A 225 117.407 1.541 -3.334 1.00 0.00 C ATOM 1767 CD2 PHE A 225 118.540 0.969 -5.352 1.00 0.00 C ATOM 1768 CE1 PHE A 225 116.666 2.486 -4.015 1.00 0.00 C ATOM 1769 CE2 PHE A 225 117.800 1.913 -6.038 1.00 0.00 C ATOM 1770 CZ PHE A 225 116.862 2.672 -5.369 1.00 0.00 C ATOM 0 H PHE A 225 121.227 0.185 -4.421 1.00 0.00 H new ATOM 0 HA PHE A 225 120.136 1.260 -2.010 1.00 0.00 H new ATOM 0 HB2 PHE A 225 119.481 -1.031 -3.922 1.00 0.00 H new ATOM 0 HB3 PHE A 225 118.514 -0.730 -2.492 1.00 0.00 H new ATOM 0 HD1 PHE A 225 117.248 1.400 -2.275 1.00 0.00 H new ATOM 0 HD2 PHE A 225 119.273 0.378 -5.881 1.00 0.00 H new ATOM 0 HE1 PHE A 225 115.933 3.080 -3.489 1.00 0.00 H new ATOM 0 HE2 PHE A 225 117.956 2.057 -7.097 1.00 0.00 H new ATOM 0 HZ PHE A 225 116.282 3.410 -5.903 1.00 0.00 H new ATOM 1780 N THR A 226 121.430 -1.780 -2.011 1.00 0.00 N ATOM 1781 CA THR A 226 121.927 -2.871 -1.180 1.00 0.00 C ATOM 1782 C THR A 226 123.048 -2.458 -0.237 1.00 0.00 C ATOM 1783 O THR A 226 123.079 -2.891 0.912 1.00 0.00 O ATOM 1784 CB THR A 226 122.436 -4.008 -2.066 1.00 0.00 C ATOM 1785 OG1 THR A 226 121.388 -4.542 -2.854 1.00 0.00 O ATOM 1786 CG2 THR A 226 123.057 -5.152 -1.285 1.00 0.00 C ATOM 0 H THR A 226 121.544 -1.937 -3.012 1.00 0.00 H new ATOM 0 HA THR A 226 121.084 -3.190 -0.567 1.00 0.00 H new ATOM 0 HB THR A 226 123.208 -3.558 -2.691 1.00 0.00 H new ATOM 0 HG1 THR A 226 121.756 -4.897 -3.690 1.00 0.00 H new ATOM 0 HG21 THR A 226 123.396 -5.923 -1.977 1.00 0.00 H new ATOM 0 HG22 THR A 226 123.906 -4.782 -0.710 1.00 0.00 H new ATOM 0 HG23 THR A 226 122.316 -5.574 -0.607 1.00 0.00 H new ATOM 1794 N ARG A 227 123.994 -1.659 -0.720 1.00 0.00 N ATOM 1795 CA ARG A 227 125.125 -1.259 0.108 1.00 0.00 C ATOM 1796 C ARG A 227 124.706 -0.311 1.225 1.00 0.00 C ATOM 1797 O ARG A 227 125.247 -0.369 2.332 1.00 0.00 O ATOM 1798 CB ARG A 227 126.208 -0.603 -0.755 1.00 0.00 C ATOM 1799 CG ARG A 227 127.443 -0.175 0.026 1.00 0.00 C ATOM 1800 CD ARG A 227 128.256 0.863 -0.735 1.00 0.00 C ATOM 1801 NE ARG A 227 128.715 0.364 -2.029 1.00 0.00 N ATOM 1802 CZ ARG A 227 129.567 -0.646 -2.170 1.00 0.00 C ATOM 1803 NH1 ARG A 227 130.066 -1.250 -1.100 1.00 0.00 N ATOM 1804 NH2 ARG A 227 129.925 -1.049 -3.381 1.00 0.00 N ATOM 0 H ARG A 227 124.001 -1.280 -1.667 1.00 0.00 H new ATOM 0 HA ARG A 227 125.525 -2.161 0.571 1.00 0.00 H new ATOM 0 HB2 ARG A 227 126.508 -1.301 -1.537 1.00 0.00 H new ATOM 0 HB3 ARG A 227 125.784 0.269 -1.252 1.00 0.00 H new ATOM 0 HG2 ARG A 227 127.141 0.234 0.990 1.00 0.00 H new ATOM 0 HG3 ARG A 227 128.065 -1.047 0.231 1.00 0.00 H new ATOM 0 HD2 ARG A 227 127.651 1.757 -0.886 1.00 0.00 H new ATOM 0 HD3 ARG A 227 129.117 1.159 -0.135 1.00 0.00 H new ATOM 0 HE ARG A 227 128.361 0.816 -2.872 1.00 0.00 H new ATOM 0 HH11 ARG A 227 129.796 -0.940 -0.167 1.00 0.00 H new ATOM 0 HH12 ARG A 227 130.720 -2.025 -1.210 1.00 0.00 H new ATOM 0 HH21 ARG A 227 129.546 -0.584 -4.206 1.00 0.00 H new ATOM 0 HH22 ARG A 227 130.579 -1.824 -3.488 1.00 0.00 H new ATOM 1818 N ASN A 228 123.736 0.552 0.946 1.00 0.00 N ATOM 1819 CA ASN A 228 123.279 1.488 1.964 1.00 0.00 C ATOM 1820 C ASN A 228 122.422 0.748 2.987 1.00 0.00 C ATOM 1821 O ASN A 228 122.501 1.009 4.187 1.00 0.00 O ATOM 1822 CB ASN A 228 122.504 2.646 1.334 1.00 0.00 C ATOM 1823 CG ASN A 228 121.056 2.285 1.081 1.00 0.00 C ATOM 1824 OD1 ASN A 228 120.273 2.119 2.015 1.00 0.00 O ATOM 1825 ND2 ASN A 228 120.699 2.141 -0.183 1.00 0.00 N ATOM 0 H ASN A 228 123.261 0.623 0.046 1.00 0.00 H new ATOM 0 HA ASN A 228 124.146 1.913 2.470 1.00 0.00 H new ATOM 0 HB2 ASN A 228 122.552 3.515 1.991 1.00 0.00 H new ATOM 0 HB3 ASN A 228 122.977 2.930 0.394 1.00 0.00 H new ATOM 0 HD21 ASN A 228 119.740 1.882 -0.416 1.00 0.00 H new ATOM 0 HD22 ASN A 228 121.382 2.289 -0.926 1.00 0.00 H new ATOM 1832 N ILE A 229 121.616 -0.188 2.501 1.00 0.00 N ATOM 1833 CA ILE A 229 120.755 -0.985 3.365 1.00 0.00 C ATOM 1834 C ILE A 229 121.537 -2.042 4.132 1.00 0.00 C ATOM 1835 O ILE A 229 121.331 -2.236 5.330 1.00 0.00 O ATOM 1836 CB ILE A 229 119.655 -1.696 2.559 1.00 0.00 C ATOM 1837 CG1 ILE A 229 118.742 -0.668 1.897 1.00 0.00 C ATOM 1838 CG2 ILE A 229 118.854 -2.624 3.464 1.00 0.00 C ATOM 1839 CD1 ILE A 229 117.777 -1.273 0.908 1.00 0.00 C ATOM 0 H ILE A 229 121.541 -0.414 1.509 1.00 0.00 H new ATOM 0 HA ILE A 229 120.307 -0.284 4.070 1.00 0.00 H new ATOM 0 HB ILE A 229 120.121 -2.297 1.778 1.00 0.00 H new ATOM 0 HG12 ILE A 229 118.179 -0.143 2.668 1.00 0.00 H new ATOM 0 HG13 ILE A 229 119.354 0.076 1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 229 118.079 -3.121 2.881 1.00 0.00 H new ATOM 0 HG22 ILE A 229 119.518 -3.372 3.897 1.00 0.00 H new ATOM 0 HG23 ILE A 229 118.392 -2.044 4.262 1.00 0.00 H new ATOM 0 HD11 ILE A 229 117.159 -0.487 0.475 1.00 0.00 H new ATOM 0 HD12 ILE A 229 118.334 -1.774 0.116 1.00 0.00 H new ATOM 0 HD13 ILE A 229 117.140 -1.996 1.417 1.00 0.00 H new ATOM 1851 N ASP A 230 122.403 -2.757 3.420 1.00 0.00 N ATOM 1852 CA ASP A 230 123.177 -3.834 4.024 1.00 0.00 C ATOM 1853 C ASP A 230 124.276 -3.318 4.944 1.00 0.00 C ATOM 1854 O ASP A 230 124.879 -4.097 5.681 1.00 0.00 O ATOM 1855 CB ASP A 230 123.738 -4.767 2.952 1.00 0.00 C ATOM 1856 CG ASP A 230 124.549 -5.890 3.528 1.00 0.00 C ATOM 1857 OD1 ASP A 230 125.584 -5.604 4.164 1.00 0.00 O ATOM 1858 OD2 ASP A 230 124.152 -7.057 3.340 1.00 0.00 O ATOM 0 H ASP A 230 122.585 -2.610 2.427 1.00 0.00 H new ATOM 0 HA ASP A 230 122.494 -4.406 4.652 1.00 0.00 H new ATOM 0 HB2 ASP A 230 122.915 -5.181 2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 230 124.358 -4.192 2.264 1.00 0.00 H new ATOM 1863 N ALA A 231 124.521 -2.017 4.949 1.00 0.00 N ATOM 1864 CA ALA A 231 125.534 -1.479 5.843 1.00 0.00 C ATOM 1865 C ALA A 231 125.271 -1.981 7.266 1.00 0.00 C ATOM 1866 O ALA A 231 126.177 -2.037 8.097 1.00 0.00 O ATOM 1867 CB ALA A 231 125.531 0.042 5.800 1.00 0.00 C ATOM 0 H ALA A 231 124.047 -1.331 4.362 1.00 0.00 H new ATOM 0 HA ALA A 231 126.517 -1.820 5.520 1.00 0.00 H new ATOM 0 HB1 ALA A 231 126.295 0.427 6.475 1.00 0.00 H new ATOM 0 HB2 ALA A 231 125.742 0.378 4.785 1.00 0.00 H new ATOM 0 HB3 ALA A 231 124.554 0.413 6.109 1.00 0.00 H new ATOM 1873 N ALA A 232 124.013 -2.351 7.527 1.00 0.00 N ATOM 1874 CA ALA A 232 123.599 -2.858 8.838 1.00 0.00 C ATOM 1875 C ALA A 232 123.801 -4.370 8.958 1.00 0.00 C ATOM 1876 O ALA A 232 123.995 -4.881 10.061 1.00 0.00 O ATOM 1877 CB ALA A 232 122.142 -2.504 9.115 1.00 0.00 C ATOM 0 H ALA A 232 123.259 -2.308 6.841 1.00 0.00 H new ATOM 0 HA ALA A 232 124.234 -2.377 9.582 1.00 0.00 H new ATOM 0 HB1 ALA A 232 121.854 -2.889 10.093 1.00 0.00 H new ATOM 0 HB2 ALA A 232 122.022 -1.421 9.102 1.00 0.00 H new ATOM 0 HB3 ALA A 232 121.507 -2.949 8.348 1.00 0.00 H new ATOM 1883 N LYS A 233 123.771 -5.089 7.837 1.00 0.00 N ATOM 1884 CA LYS A 233 123.974 -6.538 7.882 1.00 0.00 C ATOM 1885 C LYS A 233 124.363 -7.103 6.525 1.00 0.00 C ATOM 1886 O LYS A 233 123.596 -6.997 5.571 1.00 0.00 O ATOM 1887 CB LYS A 233 122.723 -7.253 8.384 1.00 0.00 C ATOM 1888 CG LYS A 233 122.921 -8.763 8.504 1.00 0.00 C ATOM 1889 CD LYS A 233 122.197 -9.533 7.427 1.00 0.00 C ATOM 1890 CE LYS A 233 120.719 -9.701 7.755 1.00 0.00 C ATOM 1891 NZ LYS A 233 119.988 -8.409 7.835 1.00 0.00 N ATOM 0 H LYS A 233 123.612 -4.704 6.906 1.00 0.00 H new ATOM 0 HA LYS A 233 124.796 -6.713 8.577 1.00 0.00 H new ATOM 0 HB2 LYS A 233 122.443 -6.848 9.356 1.00 0.00 H new ATOM 0 HB3 LYS A 233 121.895 -7.051 7.704 1.00 0.00 H new ATOM 0 HG2 LYS A 233 123.986 -8.991 8.454 1.00 0.00 H new ATOM 0 HG3 LYS A 233 122.569 -9.095 9.481 1.00 0.00 H new ATOM 0 HD2 LYS A 233 122.302 -9.014 6.474 1.00 0.00 H new ATOM 0 HD3 LYS A 233 122.658 -10.514 7.308 1.00 0.00 H new ATOM 0 HE2 LYS A 233 120.253 -10.328 6.995 1.00 0.00 H new ATOM 0 HE3 LYS A 233 120.621 -10.226 8.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 119.043 -8.569 8.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 120.516 -7.748 8.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 119.892 -8.005 6.882 1.00 0.00 H new ATOM 1905 N PRO A 234 125.549 -7.737 6.412 1.00 0.00 N ATOM 1906 CA PRO A 234 125.983 -8.325 5.147 1.00 0.00 C ATOM 1907 C PRO A 234 125.121 -9.521 4.778 1.00 0.00 C ATOM 1908 O PRO A 234 125.076 -10.507 5.514 1.00 0.00 O ATOM 1909 CB PRO A 234 127.423 -8.742 5.429 1.00 0.00 C ATOM 1910 CG PRO A 234 127.473 -8.967 6.897 1.00 0.00 C ATOM 1911 CD PRO A 234 126.538 -7.953 7.492 1.00 0.00 C ATOM 0 HA PRO A 234 125.900 -7.639 4.304 1.00 0.00 H new ATOM 0 HB2 PRO A 234 127.687 -9.646 4.881 1.00 0.00 H new ATOM 0 HB3 PRO A 234 128.126 -7.967 5.123 1.00 0.00 H new ATOM 0 HG2 PRO A 234 127.163 -9.981 7.149 1.00 0.00 H new ATOM 0 HG3 PRO A 234 128.486 -8.838 7.279 1.00 0.00 H new ATOM 0 HD2 PRO A 234 126.067 -8.324 8.402 1.00 0.00 H new ATOM 0 HD3 PRO A 234 127.057 -7.031 7.754 1.00 0.00 H new ATOM 1919 N GLY A 235 124.414 -9.434 3.658 1.00 0.00 N ATOM 1920 CA GLY A 235 123.544 -10.516 3.248 1.00 0.00 C ATOM 1921 C GLY A 235 122.123 -10.293 3.727 1.00 0.00 C ATOM 1922 O GLY A 235 121.554 -11.145 4.403 1.00 0.00 O ATOM 0 H GLY A 235 124.429 -8.633 3.027 1.00 0.00 H new ATOM 0 HA2 GLY A 235 123.554 -10.602 2.161 1.00 0.00 H new ATOM 0 HA3 GLY A 235 123.920 -11.458 3.646 1.00 0.00 H new ATOM 1926 N LEU A 236 121.552 -9.134 3.384 1.00 0.00 N ATOM 1927 CA LEU A 236 120.187 -8.800 3.800 1.00 0.00 C ATOM 1928 C LEU A 236 119.345 -8.300 2.629 1.00 0.00 C ATOM 1929 O LEU A 236 118.154 -8.598 2.546 1.00 0.00 O ATOM 1930 CB LEU A 236 120.205 -7.731 4.891 1.00 0.00 C ATOM 1931 CG LEU A 236 118.830 -7.204 5.318 1.00 0.00 C ATOM 1932 CD1 LEU A 236 117.962 -8.325 5.889 1.00 0.00 C ATOM 1933 CD2 LEU A 236 118.983 -6.058 6.319 1.00 0.00 C ATOM 0 H LEU A 236 122.010 -8.416 2.823 1.00 0.00 H new ATOM 0 HA LEU A 236 119.739 -9.716 4.186 1.00 0.00 H new ATOM 0 HB2 LEU A 236 120.707 -8.139 5.768 1.00 0.00 H new ATOM 0 HB3 LEU A 236 120.805 -6.891 4.543 1.00 0.00 H new ATOM 0 HG LEU A 236 118.324 -6.817 4.434 1.00 0.00 H new ATOM 0 HD11 LEU A 236 116.993 -7.921 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 236 117.819 -9.096 5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 236 118.454 -8.758 6.760 1.00 0.00 H new ATOM 0 HD21 LEU A 236 117.997 -5.696 6.611 1.00 0.00 H new ATOM 0 HD22 LEU A 236 119.515 -6.414 7.201 1.00 0.00 H new ATOM 0 HD23 LEU A 236 119.546 -5.246 5.859 1.00 0.00 H new ATOM 1945 N ALA A 237 119.959 -7.550 1.725 1.00 0.00 N ATOM 1946 CA ALA A 237 119.239 -7.032 0.571 1.00 0.00 C ATOM 1947 C ALA A 237 118.527 -8.161 -0.162 1.00 0.00 C ATOM 1948 O ALA A 237 117.409 -7.997 -0.650 1.00 0.00 O ATOM 1949 CB ALA A 237 120.190 -6.306 -0.365 1.00 0.00 C ATOM 0 H ALA A 237 120.944 -7.289 1.767 1.00 0.00 H new ATOM 0 HA ALA A 237 118.490 -6.322 0.920 1.00 0.00 H new ATOM 0 HB1 ALA A 237 119.636 -5.925 -1.223 1.00 0.00 H new ATOM 0 HB2 ALA A 237 120.657 -5.475 0.164 1.00 0.00 H new ATOM 0 HB3 ALA A 237 120.960 -6.997 -0.708 1.00 0.00 H new ATOM 1955 N ALA A 238 119.190 -9.309 -0.229 1.00 0.00 N ATOM 1956 CA ALA A 238 118.634 -10.479 -0.896 1.00 0.00 C ATOM 1957 C ALA A 238 117.514 -11.107 -0.074 1.00 0.00 C ATOM 1958 O ALA A 238 116.528 -11.593 -0.628 1.00 0.00 O ATOM 1959 CB ALA A 238 119.727 -11.499 -1.177 1.00 0.00 C ATOM 0 H ALA A 238 120.117 -9.455 0.172 1.00 0.00 H new ATOM 0 HA ALA A 238 118.207 -10.153 -1.844 1.00 0.00 H new ATOM 0 HB1 ALA A 238 119.295 -12.367 -1.675 1.00 0.00 H new ATOM 0 HB2 ALA A 238 120.486 -11.052 -1.819 1.00 0.00 H new ATOM 0 HB3 ALA A 238 120.184 -11.810 -0.238 1.00 0.00 H new ATOM 1965 N TYR A 239 117.666 -11.102 1.248 1.00 0.00 N ATOM 1966 CA TYR A 239 116.653 -11.683 2.120 1.00 0.00 C ATOM 1967 C TYR A 239 115.381 -10.860 2.089 1.00 0.00 C ATOM 1968 O TYR A 239 114.275 -11.399 2.139 1.00 0.00 O ATOM 1969 CB TYR A 239 117.169 -11.828 3.550 1.00 0.00 C ATOM 1970 CG TYR A 239 116.186 -12.512 4.476 1.00 0.00 C ATOM 1971 CD1 TYR A 239 116.108 -13.899 4.528 1.00 0.00 C ATOM 1972 CD2 TYR A 239 115.329 -11.776 5.287 1.00 0.00 C ATOM 1973 CE1 TYR A 239 115.208 -14.532 5.364 1.00 0.00 C ATOM 1974 CE2 TYR A 239 114.426 -12.404 6.127 1.00 0.00 C ATOM 1975 CZ TYR A 239 114.371 -13.781 6.161 1.00 0.00 C ATOM 1976 OH TYR A 239 113.474 -14.410 6.993 1.00 0.00 O ATOM 0 H TYR A 239 118.472 -10.707 1.733 1.00 0.00 H new ATOM 0 HA TYR A 239 116.425 -12.681 1.746 1.00 0.00 H new ATOM 0 HB2 TYR A 239 118.100 -12.395 3.537 1.00 0.00 H new ATOM 0 HB3 TYR A 239 117.403 -10.840 3.946 1.00 0.00 H new ATOM 0 HD1 TYR A 239 116.761 -14.492 3.905 1.00 0.00 H new ATOM 0 HD2 TYR A 239 115.369 -10.697 5.261 1.00 0.00 H new ATOM 0 HE1 TYR A 239 115.161 -15.611 5.393 1.00 0.00 H new ATOM 0 HE2 TYR A 239 113.768 -11.819 6.752 1.00 0.00 H new ATOM 0 HH TYR A 239 113.823 -15.290 7.245 1.00 0.00 H new ATOM 1986 N MET A 240 115.542 -9.555 1.967 1.00 0.00 N ATOM 1987 CA MET A 240 114.395 -8.673 1.883 1.00 0.00 C ATOM 1988 C MET A 240 113.613 -9.031 0.629 1.00 0.00 C ATOM 1989 O MET A 240 112.387 -9.118 0.642 1.00 0.00 O ATOM 1990 CB MET A 240 114.836 -7.217 1.838 1.00 0.00 C ATOM 1991 CG MET A 240 115.466 -6.730 3.127 1.00 0.00 C ATOM 1992 SD MET A 240 115.882 -4.977 3.081 1.00 0.00 S ATOM 1993 CE MET A 240 116.344 -4.700 4.788 1.00 0.00 C ATOM 0 H MET A 240 116.447 -9.087 1.924 1.00 0.00 H new ATOM 0 HA MET A 240 113.767 -8.798 2.765 1.00 0.00 H new ATOM 0 HB2 MET A 240 115.549 -7.088 1.024 1.00 0.00 H new ATOM 0 HB3 MET A 240 113.973 -6.592 1.607 1.00 0.00 H new ATOM 0 HG2 MET A 240 114.780 -6.915 3.954 1.00 0.00 H new ATOM 0 HG3 MET A 240 116.368 -7.308 3.326 1.00 0.00 H new ATOM 0 HE1 MET A 240 115.750 -3.883 5.198 1.00 0.00 H new ATOM 0 HE2 MET A 240 116.163 -5.606 5.366 1.00 0.00 H new ATOM 0 HE3 MET A 240 117.402 -4.441 4.841 1.00 0.00 H new ATOM 2003 N ARG A 241 114.352 -9.239 -0.454 1.00 0.00 N ATOM 2004 CA ARG A 241 113.764 -9.596 -1.735 1.00 0.00 C ATOM 2005 C ARG A 241 112.919 -10.870 -1.642 1.00 0.00 C ATOM 2006 O ARG A 241 111.790 -10.891 -2.124 1.00 0.00 O ATOM 2007 CB ARG A 241 114.862 -9.756 -2.794 1.00 0.00 C ATOM 2008 CG ARG A 241 114.379 -10.303 -4.135 1.00 0.00 C ATOM 2009 CD ARG A 241 113.974 -11.773 -4.048 1.00 0.00 C ATOM 2010 NE ARG A 241 114.379 -12.530 -5.231 1.00 0.00 N ATOM 2011 CZ ARG A 241 113.917 -12.297 -6.453 1.00 0.00 C ATOM 2012 NH1 ARG A 241 113.024 -11.343 -6.655 1.00 0.00 N ATOM 2013 NH2 ARG A 241 114.347 -13.024 -7.475 1.00 0.00 N ATOM 0 H ARG A 241 115.369 -9.165 -0.468 1.00 0.00 H new ATOM 0 HA ARG A 241 113.097 -8.786 -2.030 1.00 0.00 H new ATOM 0 HB2 ARG A 241 115.332 -8.787 -2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 241 115.632 -10.420 -2.402 1.00 0.00 H new ATOM 0 HG2 ARG A 241 113.529 -9.714 -4.481 1.00 0.00 H new ATOM 0 HG3 ARG A 241 115.169 -10.189 -4.877 1.00 0.00 H new ATOM 0 HD2 ARG A 241 114.424 -12.220 -3.162 1.00 0.00 H new ATOM 0 HD3 ARG A 241 112.893 -11.843 -3.927 1.00 0.00 H new ATOM 0 HE ARG A 241 115.057 -13.282 -5.110 1.00 0.00 H new ATOM 0 HH11 ARG A 241 112.689 -10.784 -5.871 1.00 0.00 H new ATOM 0 HH12 ARG A 241 112.671 -11.166 -7.595 1.00 0.00 H new ATOM 0 HH21 ARG A 241 115.033 -13.763 -7.322 1.00 0.00 H new ATOM 0 HH22 ARG A 241 113.991 -12.844 -8.414 1.00 0.00 H new ATOM 2027 N ASP A 242 113.448 -11.945 -1.054 1.00 0.00 N ATOM 2028 CA ASP A 242 112.672 -13.187 -0.972 1.00 0.00 C ATOM 2029 C ASP A 242 111.531 -13.054 0.033 1.00 0.00 C ATOM 2030 O ASP A 242 110.439 -13.581 -0.179 1.00 0.00 O ATOM 2031 CB ASP A 242 113.564 -14.381 -0.614 1.00 0.00 C ATOM 2032 CG ASP A 242 114.423 -14.848 -1.774 1.00 0.00 C ATOM 2033 OD1 ASP A 242 114.215 -14.361 -2.903 1.00 0.00 O ATOM 2034 OD2 ASP A 242 115.292 -15.717 -1.554 1.00 0.00 O ATOM 0 H ASP A 242 114.379 -11.985 -0.640 1.00 0.00 H new ATOM 0 HA ASP A 242 112.244 -13.370 -1.958 1.00 0.00 H new ATOM 0 HB2 ASP A 242 114.209 -14.108 0.222 1.00 0.00 H new ATOM 0 HB3 ASP A 242 112.938 -15.207 -0.277 1.00 0.00 H new ATOM 2039 N ALA A 243 111.790 -12.337 1.119 1.00 0.00 N ATOM 2040 CA ALA A 243 110.790 -12.116 2.155 1.00 0.00 C ATOM 2041 C ALA A 243 109.640 -11.263 1.630 1.00 0.00 C ATOM 2042 O ALA A 243 108.468 -11.558 1.862 1.00 0.00 O ATOM 2043 CB ALA A 243 111.436 -11.429 3.352 1.00 0.00 C ATOM 0 H ALA A 243 112.691 -11.896 1.306 1.00 0.00 H new ATOM 0 HA ALA A 243 110.389 -13.083 2.459 1.00 0.00 H new ATOM 0 HB1 ALA A 243 110.686 -11.265 4.126 1.00 0.00 H new ATOM 0 HB2 ALA A 243 112.233 -12.059 3.747 1.00 0.00 H new ATOM 0 HB3 ALA A 243 111.852 -10.471 3.041 1.00 0.00 H new ATOM 2049 N ILE A 244 110.000 -10.198 0.924 1.00 0.00 N ATOM 2050 CA ILE A 244 109.023 -9.279 0.356 1.00 0.00 C ATOM 2051 C ILE A 244 108.271 -9.904 -0.817 1.00 0.00 C ATOM 2052 O ILE A 244 107.044 -9.830 -0.887 1.00 0.00 O ATOM 2053 CB ILE A 244 109.683 -7.958 -0.090 1.00 0.00 C ATOM 2054 CG1 ILE A 244 108.627 -6.869 -0.266 1.00 0.00 C ATOM 2055 CG2 ILE A 244 110.464 -8.156 -1.377 1.00 0.00 C ATOM 2056 CD1 ILE A 244 107.934 -6.485 1.027 1.00 0.00 C ATOM 0 H ILE A 244 110.970 -9.949 0.730 1.00 0.00 H new ATOM 0 HA ILE A 244 108.305 -9.061 1.147 1.00 0.00 H new ATOM 0 HB ILE A 244 110.380 -7.643 0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 244 109.097 -5.984 -0.694 1.00 0.00 H new ATOM 0 HG13 ILE A 244 107.880 -7.211 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 244 110.921 -7.212 -1.674 1.00 0.00 H new ATOM 0 HG22 ILE A 244 111.242 -8.903 -1.219 1.00 0.00 H new ATOM 0 HG23 ILE A 244 109.790 -8.496 -2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 244 107.197 -5.707 0.828 1.00 0.00 H new ATOM 0 HD12 ILE A 244 107.435 -7.359 1.446 1.00 0.00 H new ATOM 0 HD13 ILE A 244 108.671 -6.113 1.738 1.00 0.00 H new ATOM 2068 N LEU A 245 109.010 -10.513 -1.743 1.00 0.00 N ATOM 2069 CA LEU A 245 108.400 -11.138 -2.914 1.00 0.00 C ATOM 2070 C LEU A 245 107.410 -12.223 -2.485 1.00 0.00 C ATOM 2071 O LEU A 245 106.273 -12.268 -2.955 1.00 0.00 O ATOM 2072 CB LEU A 245 109.477 -11.728 -3.830 1.00 0.00 C ATOM 2073 CG LEU A 245 109.069 -11.899 -5.295 1.00 0.00 C ATOM 2074 CD1 LEU A 245 110.096 -12.734 -6.041 1.00 0.00 C ATOM 2075 CD2 LEU A 245 107.686 -12.522 -5.400 1.00 0.00 C ATOM 0 H LEU A 245 110.027 -10.587 -1.705 1.00 0.00 H new ATOM 0 HA LEU A 245 107.857 -10.374 -3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 245 110.357 -11.087 -3.788 1.00 0.00 H new ATOM 0 HB3 LEU A 245 109.772 -12.701 -3.436 1.00 0.00 H new ATOM 0 HG LEU A 245 109.031 -10.913 -5.757 1.00 0.00 H new ATOM 0 HD11 LEU A 245 109.789 -12.845 -7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 245 111.066 -12.239 -6.000 1.00 0.00 H new ATOM 0 HD13 LEU A 245 110.171 -13.718 -5.578 1.00 0.00 H new ATOM 0 HD21 LEU A 245 107.416 -12.634 -6.450 1.00 0.00 H new ATOM 0 HD22 LEU A 245 107.690 -13.501 -4.920 1.00 0.00 H new ATOM 0 HD23 LEU A 245 106.959 -11.878 -4.905 1.00 0.00 H new ATOM 2087 N ALA A 246 107.849 -13.067 -1.559 1.00 0.00 N ATOM 2088 CA ALA A 246 107.014 -14.139 -1.017 1.00 0.00 C ATOM 2089 C ALA A 246 105.771 -13.568 -0.350 1.00 0.00 C ATOM 2090 O ALA A 246 104.658 -14.067 -0.536 1.00 0.00 O ATOM 2091 CB ALA A 246 107.812 -14.956 -0.013 1.00 0.00 C ATOM 0 H ALA A 246 108.788 -13.031 -1.163 1.00 0.00 H new ATOM 0 HA ALA A 246 106.699 -14.783 -1.838 1.00 0.00 H new ATOM 0 HB1 ALA A 246 107.185 -15.753 0.388 1.00 0.00 H new ATOM 0 HB2 ALA A 246 108.681 -15.391 -0.507 1.00 0.00 H new ATOM 0 HB3 ALA A 246 108.142 -14.310 0.801 1.00 0.00 H new ATOM 2097 N ASN A 247 105.972 -12.515 0.426 1.00 0.00 N ATOM 2098 CA ASN A 247 104.882 -11.859 1.128 1.00 0.00 C ATOM 2099 C ASN A 247 103.770 -11.455 0.172 1.00 0.00 C ATOM 2100 O ASN A 247 102.590 -11.588 0.486 1.00 0.00 O ATOM 2101 CB ASN A 247 105.404 -10.618 1.844 1.00 0.00 C ATOM 2102 CG ASN A 247 104.316 -9.904 2.623 1.00 0.00 C ATOM 2103 OD1 ASN A 247 103.723 -10.468 3.543 1.00 0.00 O ATOM 2104 ND2 ASN A 247 104.045 -8.657 2.255 1.00 0.00 N ATOM 0 H ASN A 247 106.887 -12.094 0.586 1.00 0.00 H new ATOM 0 HA ASN A 247 104.475 -12.566 1.851 1.00 0.00 H new ATOM 0 HB2 ASN A 247 106.207 -10.904 2.524 1.00 0.00 H new ATOM 0 HB3 ASN A 247 105.834 -9.933 1.113 1.00 0.00 H new ATOM 0 HD21 ASN A 247 103.321 -8.128 2.741 1.00 0.00 H new ATOM 0 HD22 ASN A 247 104.561 -8.228 1.487 1.00 0.00 H new ATOM 2111 N ALA A 248 104.152 -10.949 -0.994 1.00 0.00 N ATOM 2112 CA ALA A 248 103.180 -10.515 -1.978 1.00 0.00 C ATOM 2113 C ALA A 248 102.384 -11.689 -2.526 1.00 0.00 C ATOM 2114 O ALA A 248 101.234 -11.533 -2.926 1.00 0.00 O ATOM 2115 CB ALA A 248 103.880 -9.780 -3.106 1.00 0.00 C ATOM 0 H ALA A 248 105.125 -10.831 -1.277 1.00 0.00 H new ATOM 0 HA ALA A 248 102.479 -9.839 -1.488 1.00 0.00 H new ATOM 0 HB1 ALA A 248 103.144 -9.457 -3.842 1.00 0.00 H new ATOM 0 HB2 ALA A 248 104.399 -8.909 -2.706 1.00 0.00 H new ATOM 0 HB3 ALA A 248 104.600 -10.445 -3.582 1.00 0.00 H new ATOM 2121 N VAL A 249 103.006 -12.867 -2.544 1.00 0.00 N ATOM 2122 CA VAL A 249 102.372 -14.081 -3.048 1.00 0.00 C ATOM 2123 C VAL A 249 101.136 -14.468 -2.263 1.00 0.00 C ATOM 2124 O VAL A 249 100.122 -14.866 -2.835 1.00 0.00 O ATOM 2125 CB VAL A 249 103.340 -15.272 -2.961 1.00 0.00 C ATOM 2126 CG1 VAL A 249 102.790 -16.479 -3.708 1.00 0.00 C ATOM 2127 CG2 VAL A 249 104.696 -14.880 -3.493 1.00 0.00 C ATOM 0 H VAL A 249 103.960 -13.005 -2.211 1.00 0.00 H new ATOM 0 HA VAL A 249 102.094 -13.859 -4.078 1.00 0.00 H new ATOM 0 HB VAL A 249 103.447 -15.553 -1.913 1.00 0.00 H new ATOM 0 HG11 VAL A 249 103.495 -17.307 -3.630 1.00 0.00 H new ATOM 0 HG12 VAL A 249 101.835 -16.773 -3.272 1.00 0.00 H new ATOM 0 HG13 VAL A 249 102.646 -16.223 -4.758 1.00 0.00 H new ATOM 0 HG21 VAL A 249 105.373 -15.732 -3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 249 104.603 -14.571 -4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 249 105.093 -14.054 -2.903 1.00 0.00 H new ATOM 2137 N ARG A 250 101.245 -14.417 -0.946 1.00 0.00 N ATOM 2138 CA ARG A 250 100.143 -14.833 -0.093 1.00 0.00 C ATOM 2139 C ARG A 250 99.156 -13.696 0.138 1.00 0.00 C ATOM 2140 O ARG A 250 97.980 -13.937 0.411 1.00 0.00 O ATOM 2141 CB ARG A 250 100.674 -15.348 1.247 1.00 0.00 C ATOM 2142 CG ARG A 250 102.093 -15.893 1.186 1.00 0.00 C ATOM 2143 CD ARG A 250 102.137 -17.294 0.614 1.00 0.00 C ATOM 2144 NE ARG A 250 101.492 -17.381 -0.692 1.00 0.00 N ATOM 2145 CZ ARG A 250 101.379 -18.513 -1.381 1.00 0.00 C ATOM 2146 NH1 ARG A 250 101.875 -19.641 -0.891 1.00 0.00 N ATOM 2147 NH2 ARG A 250 100.770 -18.518 -2.559 1.00 0.00 N ATOM 0 H ARG A 250 102.075 -14.096 -0.448 1.00 0.00 H new ATOM 0 HA ARG A 250 99.614 -15.638 -0.603 1.00 0.00 H new ATOM 0 HB2 ARG A 250 100.639 -14.538 1.975 1.00 0.00 H new ATOM 0 HB3 ARG A 250 100.011 -16.132 1.611 1.00 0.00 H new ATOM 0 HG2 ARG A 250 102.709 -15.233 0.576 1.00 0.00 H new ATOM 0 HG3 ARG A 250 102.524 -15.896 2.187 1.00 0.00 H new ATOM 0 HD2 ARG A 250 103.175 -17.615 0.526 1.00 0.00 H new ATOM 0 HD3 ARG A 250 101.648 -17.981 1.304 1.00 0.00 H new ATOM 0 HE ARG A 250 101.107 -16.528 -1.098 1.00 0.00 H new ATOM 0 HH11 ARG A 250 102.344 -19.641 0.015 1.00 0.00 H new ATOM 0 HH12 ARG A 250 101.788 -20.509 -1.420 1.00 0.00 H new ATOM 0 HH21 ARG A 250 100.387 -17.652 -2.939 1.00 0.00 H new ATOM 0 HH22 ARG A 250 100.685 -19.388 -3.085 1.00 0.00 H new ATOM 2161 N HIS A 251 99.629 -12.462 0.049 1.00 0.00 N ATOM 2162 CA HIS A 251 98.781 -11.299 0.271 1.00 0.00 C ATOM 2163 C HIS A 251 98.127 -10.819 -1.023 1.00 0.00 C ATOM 2164 O HIS A 251 97.360 -9.857 -1.015 1.00 0.00 O ATOM 2165 CB HIS A 251 99.637 -10.192 0.879 1.00 0.00 C ATOM 2166 CG HIS A 251 100.382 -10.654 2.091 1.00 0.00 C ATOM 2167 ND1 HIS A 251 101.030 -11.870 2.145 1.00 0.00 N ATOM 2168 CD2 HIS A 251 100.584 -10.069 3.295 1.00 0.00 C ATOM 2169 CE1 HIS A 251 101.597 -12.017 3.326 1.00 0.00 C ATOM 2170 NE2 HIS A 251 101.343 -10.937 4.045 1.00 0.00 N ATOM 0 H HIS A 251 100.599 -12.239 -0.176 1.00 0.00 H new ATOM 0 HA HIS A 251 97.973 -11.572 0.950 1.00 0.00 H new ATOM 0 HB2 HIS A 251 100.347 -9.833 0.134 1.00 0.00 H new ATOM 0 HB3 HIS A 251 99.001 -9.348 1.146 1.00 0.00 H new ATOM 0 HD2 HIS A 251 100.218 -9.102 3.608 1.00 0.00 H new ATOM 0 HE1 HIS A 251 102.171 -12.873 3.650 1.00 0.00 H new ATOM 0 HE2 HIS A 251 101.659 -10.774 5.001 1.00 0.00 H new ATOM 2179 N THR A 252 98.426 -11.499 -2.130 1.00 0.00 N ATOM 2180 CA THR A 252 97.853 -11.148 -3.431 1.00 0.00 C ATOM 2181 C THR A 252 96.819 -12.186 -3.861 1.00 0.00 C ATOM 2182 O THR A 252 97.171 -13.220 -4.428 1.00 0.00 O ATOM 2183 CB THR A 252 98.950 -11.059 -4.492 1.00 0.00 C ATOM 2184 OG1 THR A 252 98.417 -10.611 -5.726 1.00 0.00 O ATOM 2185 CG2 THR A 252 99.632 -12.387 -4.745 1.00 0.00 C ATOM 0 H THR A 252 99.062 -12.296 -2.153 1.00 0.00 H new ATOM 0 HA THR A 252 97.367 -10.178 -3.333 1.00 0.00 H new ATOM 0 HB THR A 252 99.683 -10.354 -4.100 1.00 0.00 H new ATOM 0 HG1 THR A 252 99.134 -10.559 -6.392 1.00 0.00 H new ATOM 0 HG21 THR A 252 100.401 -12.262 -5.507 1.00 0.00 H new ATOM 0 HG22 THR A 252 100.090 -12.742 -3.822 1.00 0.00 H new ATOM 0 HG23 THR A 252 98.896 -13.114 -5.088 1.00 0.00 H new ATOM 2193 N PRO A 253 95.529 -11.940 -3.596 1.00 0.00 N ATOM 2194 CA PRO A 253 94.470 -12.870 -3.958 1.00 0.00 C ATOM 2195 C PRO A 253 93.911 -12.605 -5.353 1.00 0.00 C ATOM 2196 O PRO A 253 94.645 -12.030 -6.184 1.00 0.00 O ATOM 2197 CB PRO A 253 93.429 -12.582 -2.890 1.00 0.00 C ATOM 2198 CG PRO A 253 93.537 -11.110 -2.668 1.00 0.00 C ATOM 2199 CD PRO A 253 94.988 -10.751 -2.909 1.00 0.00 C ATOM 2200 OXT PRO A 253 92.744 -12.975 -5.602 1.00 0.00 O ATOM 0 HA PRO A 253 94.805 -13.907 -3.997 1.00 0.00 H new ATOM 0 HB2 PRO A 253 92.429 -12.863 -3.221 1.00 0.00 H new ATOM 0 HB3 PRO A 253 93.631 -13.139 -1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 253 92.883 -10.565 -3.349 1.00 0.00 H new ATOM 0 HG3 PRO A 253 93.234 -10.846 -1.655 1.00 0.00 H new ATOM 0 HD2 PRO A 253 95.083 -9.855 -3.523 1.00 0.00 H new ATOM 0 HD3 PRO A 253 95.513 -10.554 -1.974 1.00 0.00 H new TER 2208 PRO A 253 ATOM 2209 CA SER B 501 111.645 3.658 -9.013 1.00 0.00 C ATOM 2210 C SER B 501 111.704 4.822 -8.150 1.00 0.00 C ATOM 2211 CB SER B 501 111.137 3.782 -10.280 1.00 0.00 C HETATM 2213 N BB9 B 502 112.793 5.524 -7.743 1.00 0.00 N HETATM 2214 CA BB9 B 502 112.437 6.657 -6.992 1.00 0.00 C HETATM 2215 C BB9 B 502 113.414 7.551 -6.463 1.00 0.00 C HETATM 2216 O BB9 B 502 113.073 8.539 -5.812 1.00 0.00 O HETATM 2217 CB BB9 B 502 111.103 6.790 -6.840 1.00 0.00 C HETATM 2218 SG BB9 B 502 110.293 5.533 -7.613 1.00 0.00 S HETATM 0 HN1 BB9 B 502 113.776 5.321 -7.924 1.00 0.00 H new HETATM 0 HB BB9 B 502 110.618 7.598 -6.293 1.00 0.00 H new ATOM 2220 N THR B 503 114.641 7.057 -6.389 1.00 0.00 N ATOM 2221 CA THR B 503 115.645 7.657 -5.525 1.00 0.00 C ATOM 2222 C THR B 503 117.004 7.007 -5.740 1.00 0.00 C ATOM 2223 O THR B 503 117.921 7.213 -4.946 1.00 0.00 O ATOM 2224 CB THR B 503 115.232 7.500 -4.055 1.00 0.00 C ATOM 2225 OG1 THR B 503 116.015 8.338 -3.223 1.00 0.00 O ATOM 2226 CG2 THR B 503 115.361 6.061 -3.546 1.00 0.00 C ATOM 0 H THR B 503 114.964 6.245 -6.915 1.00 0.00 H new ATOM 0 HA THR B 503 115.720 8.715 -5.775 1.00 0.00 H new ATOM 0 HB THR B 503 114.181 7.785 -4.011 1.00 0.00 H new ATOM 0 HG1 THR B 503 115.838 8.124 -2.283 1.00 0.00 H new ATOM 0 HG21 THR B 503 115.054 6.016 -2.501 1.00 0.00 H new ATOM 0 HG22 THR B 503 114.723 5.406 -4.140 1.00 0.00 H new ATOM 0 HG23 THR B 503 116.397 5.735 -3.634 1.00 0.00 H new HETATM 2233 N DBU B 504 117.001 5.977 -6.578 1.00 0.00 N HETATM 2234 CA DBU B 504 118.102 5.109 -6.524 1.00 0.00 C HETATM 2235 CB DBU B 504 118.495 4.497 -7.637 1.00 0.00 C HETATM 2236 CG DBU B 504 117.711 4.597 -8.911 1.00 0.00 C HETATM 2237 C DBU B 504 118.818 4.834 -5.267 1.00 0.00 C HETATM 0 HG3 DBU B 504 116.708 4.200 -8.753 1.00 0.00 H new HETATM 0 HG2 DBU B 504 117.644 5.641 -9.216 1.00 0.00 H new HETATM 0 HG1 DBU B 504 118.210 4.023 -9.691 1.00 0.00 H new HETATM 0 HB DBU B 504 119.411 3.907 -7.623 1.00 0.00 H new HETATM 0 H DBU B 504 116.515 6.130 -7.462 1.00 0.00 H new HETATM 2243 N BB9 B 505 118.312 4.731 -4.012 1.00 0.00 N HETATM 2244 CA BB9 B 505 119.310 4.465 -3.061 1.00 0.00 C HETATM 2245 C BB9 B 505 119.014 4.276 -1.680 1.00 0.00 C HETATM 2246 O BB9 B 505 119.902 4.060 -0.859 1.00 0.00 O HETATM 2247 CB BB9 B 505 120.538 4.370 -3.604 1.00 0.00 C HETATM 2248 SG BB9 B 505 120.472 4.604 -5.270 1.00 0.00 S HETATM 0 HN1 BB9 B 505 117.336 4.795 -3.723 1.00 0.00 H new HETATM 0 HB BB9 B 505 121.450 4.169 -3.042 1.00 0.00 H new HETATM 2250 N 3GL B 506 117.733 4.320 -1.348 1.00 0.00 N HETATM 2251 CA 3GL B 506 117.298 4.122 0.027 1.00 0.00 C HETATM 2252 C 3GL B 506 116.135 3.135 -0.019 1.00 0.00 C HETATM 2253 CB 3GL B 506 116.937 5.479 0.677 1.00 0.00 C HETATM 2254 CG 3GL B 506 115.480 5.876 0.578 1.00 0.00 C HETATM 2255 OH 3GL B 506 114.929 5.403 -0.633 1.00 0.00 O HETATM 2256 CD 3GL B 506 115.278 7.376 0.617 1.00 0.00 C HETATM 2257 OE1 3GL B 506 114.622 7.946 1.642 1.00 0.00 O HETATM 2258 OE2 3GL B 506 115.857 8.094 -0.198 1.00 0.00 O HETATM 0 HB2C 3GL B 506 117.216 5.445 1.730 1.00 0.00 H new HETATM 0 HB1C 3GL B 506 117.541 6.258 0.212 1.00 0.00 H new HETATM 0 HN1 3GL B 506 117.262 3.829 -2.108 1.00 0.00 H new HETATM 0 HH 3GL B 506 114.118 4.887 -0.444 1.00 0.00 H new HETATM 0 HG 3GL B 506 114.985 5.433 1.442 1.00 0.00 H new HETATM 0 HA 3GL B 506 118.087 3.707 0.655 1.00 0.00 H new HETATM 2264 N BB9 B 507 115.136 3.069 -0.938 1.00 0.00 N HETATM 2265 CA BB9 B 507 114.317 1.946 -0.741 1.00 0.00 C HETATM 2266 C BB9 B 507 113.196 1.680 -1.593 1.00 0.00 C HETATM 2267 O BB9 B 507 112.480 0.693 -1.423 1.00 0.00 O HETATM 2268 CB BB9 B 507 114.705 1.189 0.314 1.00 0.00 C HETATM 2269 SG BB9 B 507 116.062 1.866 1.058 1.00 0.00 S HETATM 0 HN1 BB9 B 507 114.939 3.717 -1.701 1.00 0.00 H new HETATM 0 HB BB9 B 507 114.211 0.273 0.637 1.00 0.00 H new ATOM 2271 N CYS B 508 112.981 2.562 -2.571 1.00 0.00 N ATOM 2272 CA CYS B 508 111.874 2.410 -3.517 1.00 0.00 C ATOM 2273 C CYS B 508 112.436 2.299 -4.925 1.00 0.00 C ATOM 2274 CB CYS B 508 110.891 3.596 -3.424 1.00 0.00 C ATOM 2275 SG CYS B 508 111.649 5.231 -3.604 1.00 0.00 S ATOM 0 H CYS B 508 113.558 3.388 -2.729 1.00 0.00 H new ATOM 0 HA CYS B 508 111.320 1.505 -3.268 1.00 0.00 H new ATOM 0 HB2 CYS B 508 110.129 3.478 -4.194 1.00 0.00 H new ATOM 0 HB3 CYS B 508 110.381 3.552 -2.462 1.00 0.00 H new HETATM 2280 N BB9 B 509 111.773 2.453 -6.096 1.00 0.00 N HETATM 2281 CA BB9 B 509 112.621 2.269 -7.200 1.00 0.00 C HETATM 2282 C BB9 B 509 112.066 2.412 -8.586 1.00 0.00 C HETATM 2283 CB BB9 B 509 113.901 1.980 -6.850 1.00 0.00 C HETATM 2284 SG BB9 B 509 114.045 1.939 -5.167 1.00 0.00 S HETATM 0 HN1 BB9 B 509 110.790 2.682 -6.241 1.00 0.00 H new HETATM 0 HB BB9 B 509 114.716 1.801 -7.552 1.00 0.00 H new HETATM 2286 N MH6 B 510 111.984 1.322 -9.388 1.00 0.00 N HETATM 2287 CA MH6 B 510 111.476 1.470 -10.635 1.00 0.00 C HETATM 2288 C MH6 B 510 111.392 0.316 -11.515 1.00 0.00 C HETATM 2289 CB MH6 B 510 111.042 2.691 -11.112 1.00 0.00 C HETATM 2290 OG MH6 B 510 110.525 2.801 -12.384 1.00 0.00 O HETATM 0 HG MH6 B 510 111.045 3.457 -12.893 1.00 0.00 H new HETATM 2291 N BB9 B 511 110.404 -0.616 -11.608 1.00 0.00 N HETATM 2292 CA BB9 B 511 110.644 -1.541 -12.642 1.00 0.00 C HETATM 2293 C BB9 B 511 109.752 -2.624 -12.932 1.00 0.00 C HETATM 2294 O BB9 B 511 109.984 -3.418 -13.844 1.00 0.00 O HETATM 2295 CB BB9 B 511 111.799 -1.295 -13.302 1.00 0.00 C HETATM 2296 SG BB9 B 511 112.576 0.052 -12.658 1.00 0.00 S HETATM 0 HN1 BB9 B 511 109.568 -0.702 -11.030 1.00 0.00 H new HETATM 0 HB BB9 B 511 112.175 -1.888 -14.136 1.00 0.00 H new ATOM 2298 N ALA B 512 108.671 -2.725 -12.161 1.00 0.00 N ATOM 2299 CA ALA B 512 107.692 -3.792 -12.362 1.00 0.00 C ATOM 2300 C ALA B 512 106.720 -3.438 -13.483 1.00 0.00 C ATOM 2301 O ALA B 512 105.788 -4.189 -13.771 1.00 0.00 O ATOM 2302 CB ALA B 512 106.893 -4.058 -11.072 1.00 0.00 C ATOM 0 H ALA B 512 108.451 -2.086 -11.397 1.00 0.00 H new ATOM 0 HA ALA B 512 108.245 -4.690 -12.635 1.00 0.00 H new ATOM 0 HB1 ALA B 512 106.172 -4.856 -11.249 1.00 0.00 H new ATOM 0 HB2 ALA B 512 107.576 -4.356 -10.276 1.00 0.00 H new ATOM 0 HB3 ALA B 512 106.365 -3.151 -10.777 1.00 0.00 H new HETATM 2307 N NH2 B 513 106.939 -2.291 -14.117 1.00 0.00 N TER 2310 NH2 B 513 HETATM 2311 C NO1 B 601 111.543 5.817 -1.946 1.00 0.00 C HETATM 2312 O NO1 B 601 111.524 4.984 -1.041 1.00 0.00 O HETATM 2313 CB NO1 B 601 112.322 6.793 0.867 1.00 0.00 C HETATM 2314 CG NO1 B 601 112.574 7.563 -0.413 1.00 0.00 C HETATM 2315 CD1 NO1 B 601 112.082 7.195 -1.630 1.00 0.00 C HETATM 2316 NE1 NO1 B 601 112.215 8.223 -2.527 1.00 0.00 N HETATM 2317 CD2 NO1 B 601 113.212 8.845 -0.612 1.00 0.00 C HETATM 2318 CE2 NO1 B 601 112.933 9.232 -1.944 1.00 0.00 C HETATM 2319 CE3 NO1 B 601 113.954 9.739 0.193 1.00 0.00 C HETATM 2320 CZ2 NO1 B 601 113.356 10.450 -2.478 1.00 0.00 C HETATM 2321 CZ3 NO1 B 601 114.374 10.943 -0.345 1.00 0.00 C HETATM 2322 CH2 NO1 B 601 114.073 11.288 -1.668 1.00 0.00 C HETATM 2323 CF NO1 B 601 114.433 9.348 1.579 1.00 0.00 C HETATM 0 HB3C NO1 B 601 111.250 6.752 1.062 1.00 0.00 H new HETATM 0 HB2C NO1 B 601 112.711 5.780 0.765 1.00 0.00 H new HETATM 0 HB1C NO1 B 601 112.823 7.292 1.697 1.00 0.00 H new HETATM 0 HZ3 NO1 B 601 114.949 11.634 0.272 1.00 0.00 H new HETATM 0 HZ2 NO1 B 601 113.123 10.725 -3.507 1.00 0.00 H new HETATM 0 HH2 NO1 B 601 114.417 12.245 -2.061 1.00 0.00 H new HETATM 0 HE1 NO1 B 601 111.840 8.234 -3.475 1.00 0.00 H new