USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 864 hydrogens (0 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 Set 1.1: A 19 CYS SG : rot 30:sc= -4.02! USER MOD Set 1.2: A 21 MET CE :methyl -154:sc= -4 (180deg=-1.09) USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0716 (180deg=0) USER MOD Single : A 2 SER OG : rot -57:sc= 0.261 USER MOD Single : A 3 SER OG : rot 10:sc= 0.597 USER MOD Single : A 5 SER OG : rot 142:sc= 0.0988 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 172:sc= -0.0278 (180deg=-0.104) USER MOD Single : A 10 SER OG : rot 24:sc= 1.12 USER MOD Single : A 11 ASN : amide:sc= 0.138 K(o=0.14,f=-2.2!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -6.85! C(o=-6.9!,f=-6.1!) USER MOD Single : A 29 LYS NZ :NH3+ 148:sc= 0.0153 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -6.71! C(o=-6.7!,f=-7.2!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.376 X(o=-0.38,f=-0.38) USER MOD Single : A 46 ASN : amide:sc= -2.47! C(o=-2.5!,f=-2.4!) USER MOD Single : A 51 THR OG1 : rot -29:sc= 2.15 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 CYS SG : rot -89:sc= 0.248 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -1.42 X(o=-1.4,f=-1) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.348 K(o=-0.35,f=-2.3!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= -1.58! C(o=-1.6!,f=-4.6!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 CYS SG : rot 55:sc= 0.221 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -85:sc= 1.24 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 73:sc= 0.779 USER MOD Single : A 93 GLN : amide:sc= -0.16 K(o=-0.16,f=-1) USER MOD Single : A 97 MET CE :methyl -161:sc= -0.98 (180deg=-2.1) USER MOD Single : A 99 HIS : no HD1:sc= -0.0709 X(o=-0.071,f=0) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 101 CYS SG : rot -74:sc= 0.218 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.876 6.522 -11.399 1.00 0.00 N ATOM 2 CA GLY A 1 -11.806 7.167 -10.662 1.00 0.00 C ATOM 3 C GLY A 1 -11.227 8.356 -11.402 1.00 0.00 C ATOM 4 O GLY A 1 -11.396 8.483 -12.615 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.772 6.640 -10.884 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.958 6.954 -12.341 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.666 5.509 -11.500 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.183 7.494 -9.693 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.015 6.443 -10.468 1.00 0.00 H new ATOM 8 N SER A 2 -10.544 9.232 -10.671 1.00 0.00 N ATOM 9 CA SER A 2 -9.944 10.420 -11.265 1.00 0.00 C ATOM 10 C SER A 2 -11.011 11.313 -11.891 1.00 0.00 C ATOM 11 O SER A 2 -10.809 11.882 -12.964 1.00 0.00 O ATOM 12 CB SER A 2 -8.912 10.022 -12.322 1.00 0.00 C ATOM 13 OG SER A 2 -8.115 11.131 -12.700 1.00 0.00 O ATOM 0 H SER A 2 -10.393 9.141 -9.666 1.00 0.00 H new ATOM 0 HA SER A 2 -9.446 10.979 -10.473 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.275 9.228 -11.932 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.421 9.620 -13.198 1.00 0.00 H new ATOM 0 HG SER A 2 -8.692 11.849 -13.034 1.00 0.00 H new ATOM 19 N SER A 3 -12.148 11.431 -11.212 1.00 0.00 N ATOM 20 CA SER A 3 -13.249 12.251 -11.702 1.00 0.00 C ATOM 21 C SER A 3 -14.134 12.717 -10.550 1.00 0.00 C ATOM 22 O SER A 3 -14.096 12.154 -9.457 1.00 0.00 O ATOM 23 CB SER A 3 -14.084 11.468 -12.718 1.00 0.00 C ATOM 24 OG SER A 3 -13.397 11.337 -13.950 1.00 0.00 O ATOM 0 H SER A 3 -12.330 10.969 -10.321 1.00 0.00 H new ATOM 0 HA SER A 3 -12.826 13.129 -12.190 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.314 10.480 -12.320 1.00 0.00 H new ATOM 0 HB3 SER A 3 -15.035 11.976 -12.880 1.00 0.00 H new ATOM 0 HG SER A 3 -12.470 11.637 -13.841 1.00 0.00 H new ATOM 30 N GLY A 4 -14.932 13.749 -10.805 1.00 0.00 N ATOM 31 CA GLY A 4 -15.816 14.274 -9.781 1.00 0.00 C ATOM 32 C GLY A 4 -15.073 14.664 -8.518 1.00 0.00 C ATOM 33 O GLY A 4 -15.432 14.236 -7.421 1.00 0.00 O ATOM 0 H GLY A 4 -14.982 14.231 -11.703 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.343 15.144 -10.172 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.571 13.526 -9.539 1.00 0.00 H new ATOM 37 N SER A 5 -14.033 15.478 -8.672 1.00 0.00 N ATOM 38 CA SER A 5 -13.234 15.921 -7.536 1.00 0.00 C ATOM 39 C SER A 5 -12.767 17.361 -7.729 1.00 0.00 C ATOM 40 O SER A 5 -11.984 17.655 -8.631 1.00 0.00 O ATOM 41 CB SER A 5 -12.025 15.002 -7.346 1.00 0.00 C ATOM 42 OG SER A 5 -11.627 14.958 -5.987 1.00 0.00 O ATOM 0 H SER A 5 -13.724 15.844 -9.573 1.00 0.00 H new ATOM 0 HA SER A 5 -13.859 15.876 -6.644 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.271 13.997 -7.689 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.196 15.355 -7.960 1.00 0.00 H new ATOM 0 HG SER A 5 -11.343 14.048 -5.758 1.00 0.00 H new ATOM 48 N SER A 6 -13.255 18.253 -6.873 1.00 0.00 N ATOM 49 CA SER A 6 -12.892 19.664 -6.950 1.00 0.00 C ATOM 50 C SER A 6 -12.364 20.163 -5.609 1.00 0.00 C ATOM 51 O SER A 6 -13.136 20.497 -4.711 1.00 0.00 O ATOM 52 CB SER A 6 -14.099 20.500 -7.379 1.00 0.00 C ATOM 53 OG SER A 6 -13.763 21.874 -7.465 1.00 0.00 O ATOM 0 H SER A 6 -13.902 18.024 -6.119 1.00 0.00 H new ATOM 0 HA SER A 6 -12.102 19.771 -7.694 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.463 20.150 -8.345 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.911 20.365 -6.665 1.00 0.00 H new ATOM 0 HG SER A 6 -14.551 22.387 -7.742 1.00 0.00 H new ATOM 59 N GLY A 7 -11.041 20.210 -5.481 1.00 0.00 N ATOM 60 CA GLY A 7 -10.431 20.669 -4.247 1.00 0.00 C ATOM 61 C GLY A 7 -9.506 19.634 -3.637 1.00 0.00 C ATOM 62 O GLY A 7 -9.871 18.952 -2.679 1.00 0.00 O ATOM 0 H GLY A 7 -10.381 19.938 -6.210 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.870 21.583 -4.441 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.213 20.920 -3.530 1.00 0.00 H new ATOM 66 N LYS A 8 -8.306 19.515 -4.194 1.00 0.00 N ATOM 67 CA LYS A 8 -7.325 18.556 -3.700 1.00 0.00 C ATOM 68 C LYS A 8 -6.468 19.172 -2.599 1.00 0.00 C ATOM 69 O LYS A 8 -6.150 20.361 -2.639 1.00 0.00 O ATOM 70 CB LYS A 8 -6.432 18.073 -4.846 1.00 0.00 C ATOM 71 CG LYS A 8 -7.068 16.986 -5.696 1.00 0.00 C ATOM 72 CD LYS A 8 -6.569 17.037 -7.130 1.00 0.00 C ATOM 73 CE LYS A 8 -7.166 15.917 -7.968 1.00 0.00 C ATOM 74 NZ LYS A 8 -8.639 16.069 -8.130 1.00 0.00 N ATOM 0 H LYS A 8 -7.989 20.071 -4.988 1.00 0.00 H new ATOM 0 HA LYS A 8 -7.864 17.705 -3.283 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.182 18.921 -5.483 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.496 17.698 -4.433 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.845 16.009 -5.266 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.152 17.100 -5.683 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.826 18.000 -7.572 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -5.482 16.961 -7.141 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -6.692 15.906 -8.950 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.950 14.957 -7.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.987 15.368 -8.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.106 15.919 -7.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.853 17.026 -8.475 1.00 0.00 H new ATOM 88 N ILE A 9 -6.097 18.355 -1.618 1.00 0.00 N ATOM 89 CA ILE A 9 -5.275 18.820 -0.508 1.00 0.00 C ATOM 90 C ILE A 9 -3.868 19.176 -0.977 1.00 0.00 C ATOM 91 O ILE A 9 -3.315 20.205 -0.589 1.00 0.00 O ATOM 92 CB ILE A 9 -5.180 17.760 0.605 1.00 0.00 C ATOM 93 CG1 ILE A 9 -6.570 17.449 1.163 1.00 0.00 C ATOM 94 CG2 ILE A 9 -4.253 18.237 1.713 1.00 0.00 C ATOM 95 CD1 ILE A 9 -7.293 16.354 0.411 1.00 0.00 C ATOM 0 H ILE A 9 -6.353 17.369 -1.570 1.00 0.00 H new ATOM 0 HA ILE A 9 -5.759 19.711 -0.109 1.00 0.00 H new ATOM 0 HB ILE A 9 -4.766 16.845 0.181 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -6.476 17.159 2.209 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -7.174 18.356 1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.196 17.477 2.492 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -3.258 18.413 1.304 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.640 19.164 2.137 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.271 16.187 0.862 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.419 16.650 -0.630 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.710 15.434 0.458 1.00 0.00 H new ATOM 107 N SER A 10 -3.295 18.319 -1.816 1.00 0.00 N ATOM 108 CA SER A 10 -1.952 18.541 -2.337 1.00 0.00 C ATOM 109 C SER A 10 -1.698 17.681 -3.571 1.00 0.00 C ATOM 110 O SER A 10 -2.569 16.927 -4.005 1.00 0.00 O ATOM 111 CB SER A 10 -0.907 18.232 -1.263 1.00 0.00 C ATOM 112 OG SER A 10 -0.742 19.329 -0.382 1.00 0.00 O ATOM 0 H SER A 10 -3.740 17.464 -2.149 1.00 0.00 H new ATOM 0 HA SER A 10 -1.870 19.590 -2.623 1.00 0.00 H new ATOM 0 HB2 SER A 10 -1.211 17.351 -0.698 1.00 0.00 H new ATOM 0 HB3 SER A 10 0.046 17.995 -1.736 1.00 0.00 H new ATOM 0 HG SER A 10 -1.553 19.879 -0.389 1.00 0.00 H new ATOM 118 N ASN A 11 -0.499 17.800 -4.132 1.00 0.00 N ATOM 119 CA ASN A 11 -0.130 17.034 -5.317 1.00 0.00 C ATOM 120 C ASN A 11 1.126 16.207 -5.061 1.00 0.00 C ATOM 121 O ASN A 11 1.878 15.899 -5.986 1.00 0.00 O ATOM 122 CB ASN A 11 0.096 17.971 -6.506 1.00 0.00 C ATOM 123 CG ASN A 11 0.690 19.302 -6.088 1.00 0.00 C ATOM 124 OD1 ASN A 11 1.504 19.369 -5.166 1.00 0.00 O ATOM 125 ND2 ASN A 11 0.285 20.369 -6.765 1.00 0.00 N ATOM 0 H ASN A 11 0.233 18.419 -3.785 1.00 0.00 H new ATOM 0 HA ASN A 11 -0.950 16.354 -5.549 1.00 0.00 H new ATOM 0 HB2 ASN A 11 0.760 17.489 -7.224 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -0.852 18.143 -7.015 1.00 0.00 H new ATOM 0 HD21 ASN A 11 0.650 21.292 -6.529 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -0.391 20.266 -7.522 1.00 0.00 H new ATOM 132 N ILE A 12 1.346 15.851 -3.800 1.00 0.00 N ATOM 133 CA ILE A 12 2.510 15.059 -3.423 1.00 0.00 C ATOM 134 C ILE A 12 2.563 13.751 -4.206 1.00 0.00 C ATOM 135 O ILE A 12 3.636 13.290 -4.593 1.00 0.00 O ATOM 136 CB ILE A 12 2.510 14.742 -1.915 1.00 0.00 C ATOM 137 CG1 ILE A 12 1.235 13.989 -1.530 1.00 0.00 C ATOM 138 CG2 ILE A 12 2.641 16.022 -1.105 1.00 0.00 C ATOM 139 CD1 ILE A 12 1.103 13.745 -0.043 1.00 0.00 C ATOM 0 H ILE A 12 0.734 16.098 -3.023 1.00 0.00 H new ATOM 0 HA ILE A 12 3.389 15.657 -3.661 1.00 0.00 H new ATOM 0 HB ILE A 12 3.366 14.105 -1.692 1.00 0.00 H new ATOM 0 HG12 ILE A 12 0.370 14.555 -1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 12 1.217 13.031 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 12 2.639 15.782 -0.042 1.00 0.00 H new ATOM 0 HG22 ILE A 12 3.575 16.522 -1.363 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.803 16.682 -1.329 1.00 0.00 H new ATOM 0 HD11 ILE A 12 0.176 13.207 0.157 1.00 0.00 H new ATOM 0 HD12 ILE A 12 1.949 13.152 0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 12 1.088 14.700 0.483 1.00 0.00 H new ATOM 151 N PHE A 13 1.396 13.160 -4.438 1.00 0.00 N ATOM 152 CA PHE A 13 1.308 11.905 -5.176 1.00 0.00 C ATOM 153 C PHE A 13 0.982 12.160 -6.645 1.00 0.00 C ATOM 154 O PHE A 13 0.508 11.269 -7.349 1.00 0.00 O ATOM 155 CB PHE A 13 0.244 10.997 -4.556 1.00 0.00 C ATOM 156 CG PHE A 13 0.529 10.628 -3.128 1.00 0.00 C ATOM 157 CD1 PHE A 13 1.807 10.263 -2.734 1.00 0.00 C ATOM 158 CD2 PHE A 13 -0.480 10.647 -2.179 1.00 0.00 C ATOM 159 CE1 PHE A 13 2.073 9.924 -1.421 1.00 0.00 C ATOM 160 CE2 PHE A 13 -0.220 10.309 -0.864 1.00 0.00 C ATOM 161 CZ PHE A 13 1.057 9.946 -0.485 1.00 0.00 C ATOM 0 H PHE A 13 0.498 13.530 -4.126 1.00 0.00 H new ATOM 0 HA PHE A 13 2.277 11.409 -5.117 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.723 11.497 -4.608 1.00 0.00 H new ATOM 0 HB3 PHE A 13 0.165 10.086 -5.149 1.00 0.00 H new ATOM 0 HD1 PHE A 13 2.604 10.243 -3.462 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -1.481 10.929 -2.470 1.00 0.00 H new ATOM 0 HE1 PHE A 13 3.073 9.642 -1.127 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -1.015 10.329 -0.134 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.261 9.680 0.541 1.00 0.00 H new ATOM 171 N GLU A 14 1.238 13.383 -7.098 1.00 0.00 N ATOM 172 CA GLU A 14 0.970 13.756 -8.482 1.00 0.00 C ATOM 173 C GLU A 14 1.712 12.836 -9.447 1.00 0.00 C ATOM 174 O GLU A 14 2.908 12.590 -9.291 1.00 0.00 O ATOM 175 CB GLU A 14 1.379 15.210 -8.730 1.00 0.00 C ATOM 176 CG GLU A 14 1.626 15.530 -10.195 1.00 0.00 C ATOM 177 CD GLU A 14 1.686 17.022 -10.463 1.00 0.00 C ATOM 178 OE1 GLU A 14 2.737 17.634 -10.179 1.00 0.00 O ATOM 179 OE2 GLU A 14 0.682 17.577 -10.957 1.00 0.00 O ATOM 0 H GLU A 14 1.630 14.132 -6.527 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.101 13.652 -8.659 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.598 15.868 -8.349 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.284 15.426 -8.162 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.562 15.070 -10.511 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.834 15.088 -10.799 1.00 0.00 H new ATOM 186 N ASP A 15 0.993 12.330 -10.443 1.00 0.00 N ATOM 187 CA ASP A 15 1.583 11.437 -11.434 1.00 0.00 C ATOM 188 C ASP A 15 2.110 10.166 -10.775 1.00 0.00 C ATOM 189 O ASP A 15 3.143 9.629 -11.176 1.00 0.00 O ATOM 190 CB ASP A 15 2.713 12.145 -12.182 1.00 0.00 C ATOM 191 CG ASP A 15 2.228 13.360 -12.949 1.00 0.00 C ATOM 192 OD1 ASP A 15 1.145 13.278 -13.566 1.00 0.00 O ATOM 193 OD2 ASP A 15 2.931 14.392 -12.933 1.00 0.00 O ATOM 0 H ASP A 15 0.002 12.523 -10.586 1.00 0.00 H new ATOM 0 HA ASP A 15 0.805 11.160 -12.146 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.480 12.451 -11.470 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.181 11.445 -12.874 1.00 0.00 H new ATOM 198 N VAL A 16 1.394 9.690 -9.761 1.00 0.00 N ATOM 199 CA VAL A 16 1.790 8.483 -9.046 1.00 0.00 C ATOM 200 C VAL A 16 0.631 7.498 -8.948 1.00 0.00 C ATOM 201 O VAL A 16 -0.501 7.883 -8.657 1.00 0.00 O ATOM 202 CB VAL A 16 2.292 8.810 -7.627 1.00 0.00 C ATOM 203 CG1 VAL A 16 2.949 7.590 -6.999 1.00 0.00 C ATOM 204 CG2 VAL A 16 3.256 9.986 -7.662 1.00 0.00 C ATOM 0 H VAL A 16 0.537 10.122 -9.416 1.00 0.00 H new ATOM 0 HA VAL A 16 2.602 8.030 -9.615 1.00 0.00 H new ATOM 0 HB VAL A 16 1.436 9.089 -7.012 1.00 0.00 H new ATOM 0 HG11 VAL A 16 3.298 7.840 -5.997 1.00 0.00 H new ATOM 0 HG12 VAL A 16 2.225 6.777 -6.939 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.796 7.278 -7.610 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.601 10.204 -6.651 1.00 0.00 H new ATOM 0 HG22 VAL A 16 4.110 9.737 -8.291 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.748 10.861 -8.068 1.00 0.00 H new ATOM 214 N GLU A 17 0.922 6.224 -9.192 1.00 0.00 N ATOM 215 CA GLU A 17 -0.098 5.183 -9.132 1.00 0.00 C ATOM 216 C GLU A 17 -0.064 4.466 -7.785 1.00 0.00 C ATOM 217 O GLU A 17 0.979 4.391 -7.135 1.00 0.00 O ATOM 218 CB GLU A 17 0.104 4.174 -10.264 1.00 0.00 C ATOM 219 CG GLU A 17 -1.122 3.321 -10.545 1.00 0.00 C ATOM 220 CD GLU A 17 -1.013 2.553 -11.848 1.00 0.00 C ATOM 221 OE1 GLU A 17 -1.084 3.189 -12.920 1.00 0.00 O ATOM 222 OE2 GLU A 17 -0.855 1.315 -11.794 1.00 0.00 O ATOM 0 H GLU A 17 1.854 5.888 -9.433 1.00 0.00 H new ATOM 0 HA GLU A 17 -1.072 5.657 -9.248 1.00 0.00 H new ATOM 0 HB2 GLU A 17 0.379 4.710 -11.172 1.00 0.00 H new ATOM 0 HB3 GLU A 17 0.940 3.522 -10.013 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.267 2.618 -9.725 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.005 3.960 -10.577 1.00 0.00 H new ATOM 229 N PHE A 18 -1.212 3.940 -7.372 1.00 0.00 N ATOM 230 CA PHE A 18 -1.315 3.230 -6.102 1.00 0.00 C ATOM 231 C PHE A 18 -2.310 2.077 -6.203 1.00 0.00 C ATOM 232 O PHE A 18 -3.382 2.218 -6.794 1.00 0.00 O ATOM 233 CB PHE A 18 -1.741 4.190 -4.990 1.00 0.00 C ATOM 234 CG PHE A 18 -0.830 5.374 -4.839 1.00 0.00 C ATOM 235 CD1 PHE A 18 -0.970 6.482 -5.659 1.00 0.00 C ATOM 236 CD2 PHE A 18 0.168 5.380 -3.877 1.00 0.00 C ATOM 237 CE1 PHE A 18 -0.133 7.574 -5.523 1.00 0.00 C ATOM 238 CE2 PHE A 18 1.007 6.468 -3.736 1.00 0.00 C ATOM 239 CZ PHE A 18 0.857 7.566 -4.560 1.00 0.00 C ATOM 0 H PHE A 18 -2.084 3.992 -7.898 1.00 0.00 H new ATOM 0 HA PHE A 18 -0.334 2.820 -5.862 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -2.752 4.543 -5.193 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.777 3.647 -4.046 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -1.742 6.493 -6.414 1.00 0.00 H new ATOM 0 HD2 PHE A 18 0.291 4.524 -3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -0.253 8.432 -6.168 1.00 0.00 H new ATOM 0 HE2 PHE A 18 1.780 6.460 -2.982 1.00 0.00 H new ATOM 0 HZ PHE A 18 1.513 8.417 -4.452 1.00 0.00 H new ATOM 249 N CYS A 19 -1.947 0.939 -5.623 1.00 0.00 N ATOM 250 CA CYS A 19 -2.807 -0.240 -5.648 1.00 0.00 C ATOM 251 C CYS A 19 -3.054 -0.763 -4.237 1.00 0.00 C ATOM 252 O CYS A 19 -2.163 -1.339 -3.612 1.00 0.00 O ATOM 253 CB CYS A 19 -2.178 -1.337 -6.509 1.00 0.00 C ATOM 254 SG CYS A 19 -3.265 -2.750 -6.814 1.00 0.00 S ATOM 0 H CYS A 19 -1.064 0.807 -5.130 1.00 0.00 H new ATOM 0 HA CYS A 19 -3.765 0.048 -6.082 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -1.881 -0.908 -7.466 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -1.269 -1.690 -6.022 1.00 0.00 H new ATOM 0 HG CYS A 19 -4.503 -2.353 -6.816 1.00 0.00 H new ATOM 260 N VAL A 20 -4.269 -0.556 -3.739 1.00 0.00 N ATOM 261 CA VAL A 20 -4.634 -1.006 -2.401 1.00 0.00 C ATOM 262 C VAL A 20 -5.267 -2.392 -2.441 1.00 0.00 C ATOM 263 O VAL A 20 -6.109 -2.677 -3.292 1.00 0.00 O ATOM 264 CB VAL A 20 -5.612 -0.026 -1.727 1.00 0.00 C ATOM 265 CG1 VAL A 20 -6.230 -0.656 -0.488 1.00 0.00 C ATOM 266 CG2 VAL A 20 -4.905 1.275 -1.377 1.00 0.00 C ATOM 0 H VAL A 20 -5.017 -0.079 -4.242 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.714 -1.047 -1.819 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.414 0.200 -2.429 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -6.918 0.051 -0.025 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.772 -1.558 -0.771 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.443 -0.913 0.221 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.611 1.956 -0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.082 1.069 -0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.515 1.733 -2.286 1.00 0.00 H new ATOM 276 N MET A 21 -4.856 -3.251 -1.514 1.00 0.00 N ATOM 277 CA MET A 21 -5.385 -4.609 -1.442 1.00 0.00 C ATOM 278 C MET A 21 -6.409 -4.734 -0.318 1.00 0.00 C ATOM 279 O MET A 21 -7.441 -5.387 -0.476 1.00 0.00 O ATOM 280 CB MET A 21 -4.250 -5.611 -1.227 1.00 0.00 C ATOM 281 CG MET A 21 -3.320 -5.741 -2.423 1.00 0.00 C ATOM 282 SD MET A 21 -4.156 -6.383 -3.886 1.00 0.00 S ATOM 283 CE MET A 21 -3.437 -5.356 -5.165 1.00 0.00 C ATOM 0 H MET A 21 -4.159 -3.031 -0.803 1.00 0.00 H new ATOM 0 HA MET A 21 -5.880 -4.830 -2.388 1.00 0.00 H new ATOM 0 HB2 MET A 21 -3.669 -5.308 -0.356 1.00 0.00 H new ATOM 0 HB3 MET A 21 -4.677 -6.588 -1.001 1.00 0.00 H new ATOM 0 HG2 MET A 21 -2.891 -4.765 -2.653 1.00 0.00 H new ATOM 0 HG3 MET A 21 -2.491 -6.400 -2.164 1.00 0.00 H new ATOM 0 HE1 MET A 21 -4.128 -5.283 -6.004 1.00 0.00 H new ATOM 0 HE2 MET A 21 -3.244 -4.360 -4.766 1.00 0.00 H new ATOM 0 HE3 MET A 21 -2.501 -5.799 -5.504 1.00 0.00 H new ATOM 293 N SER A 22 -6.117 -4.105 0.816 1.00 0.00 N ATOM 294 CA SER A 22 -7.010 -4.150 1.967 1.00 0.00 C ATOM 295 C SER A 22 -6.557 -3.170 3.045 1.00 0.00 C ATOM 296 O SER A 22 -5.373 -2.856 3.156 1.00 0.00 O ATOM 297 CB SER A 22 -7.066 -5.567 2.541 1.00 0.00 C ATOM 298 OG SER A 22 -7.946 -5.634 3.649 1.00 0.00 O ATOM 0 H SER A 22 -5.268 -3.558 0.962 1.00 0.00 H new ATOM 0 HA SER A 22 -8.007 -3.861 1.634 1.00 0.00 H new ATOM 0 HB2 SER A 22 -7.395 -6.263 1.769 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.067 -5.879 2.847 1.00 0.00 H new ATOM 0 HG SER A 22 -7.965 -6.550 3.996 1.00 0.00 H new ATOM 304 N GLY A 23 -7.511 -2.690 3.838 1.00 0.00 N ATOM 305 CA GLY A 23 -7.191 -1.751 4.897 1.00 0.00 C ATOM 306 C GLY A 23 -7.219 -2.393 6.270 1.00 0.00 C ATOM 307 O GLY A 23 -6.977 -3.592 6.408 1.00 0.00 O ATOM 0 H GLY A 23 -8.499 -2.935 3.766 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -6.202 -1.328 4.717 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.901 -0.924 4.872 1.00 0.00 H new ATOM 311 N THR A 24 -7.515 -1.593 7.290 1.00 0.00 N ATOM 312 CA THR A 24 -7.571 -2.089 8.659 1.00 0.00 C ATOM 313 C THR A 24 -8.879 -1.693 9.334 1.00 0.00 C ATOM 314 O THR A 24 -9.698 -0.982 8.753 1.00 0.00 O ATOM 315 CB THR A 24 -6.392 -1.559 9.497 1.00 0.00 C ATOM 316 OG1 THR A 24 -6.461 -0.132 9.592 1.00 0.00 O ATOM 317 CG2 THR A 24 -5.063 -1.967 8.881 1.00 0.00 C ATOM 0 H THR A 24 -7.720 -0.598 7.193 1.00 0.00 H new ATOM 0 HA THR A 24 -7.508 -3.176 8.605 1.00 0.00 H new ATOM 0 HB THR A 24 -6.460 -1.993 10.494 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.709 0.197 10.128 1.00 0.00 H new ATOM 0 HG21 THR A 24 -4.246 -1.581 9.490 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.001 -3.054 8.837 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.988 -1.558 7.873 1.00 0.00 H new ATOM 325 N ASP A 25 -9.068 -2.157 10.565 1.00 0.00 N ATOM 326 CA ASP A 25 -10.276 -1.849 11.320 1.00 0.00 C ATOM 327 C ASP A 25 -10.519 -0.344 11.368 1.00 0.00 C ATOM 328 O ASP A 25 -11.635 0.123 11.139 1.00 0.00 O ATOM 329 CB ASP A 25 -10.171 -2.407 12.741 1.00 0.00 C ATOM 330 CG ASP A 25 -11.373 -2.050 13.593 1.00 0.00 C ATOM 331 OD1 ASP A 25 -12.438 -2.675 13.408 1.00 0.00 O ATOM 332 OD2 ASP A 25 -11.249 -1.145 14.445 1.00 0.00 O ATOM 0 H ASP A 25 -8.400 -2.747 11.060 1.00 0.00 H new ATOM 0 HA ASP A 25 -11.120 -2.319 10.815 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -10.070 -3.491 12.696 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -9.267 -2.022 13.213 1.00 0.00 H new ATOM 337 N SER A 26 -9.466 0.411 11.668 1.00 0.00 N ATOM 338 CA SER A 26 -9.566 1.863 11.751 1.00 0.00 C ATOM 339 C SER A 26 -9.927 2.461 10.395 1.00 0.00 C ATOM 340 O SER A 26 -10.903 3.201 10.272 1.00 0.00 O ATOM 341 CB SER A 26 -8.247 2.458 12.249 1.00 0.00 C ATOM 342 OG SER A 26 -8.129 2.331 13.655 1.00 0.00 O ATOM 0 H SER A 26 -8.535 0.041 11.857 1.00 0.00 H new ATOM 0 HA SER A 26 -10.358 2.108 12.459 1.00 0.00 H new ATOM 0 HB2 SER A 26 -7.411 1.954 11.764 1.00 0.00 H new ATOM 0 HB3 SER A 26 -8.191 3.510 11.970 1.00 0.00 H new ATOM 0 HG SER A 26 -7.277 2.717 13.948 1.00 0.00 H new ATOM 348 N GLN A 27 -9.133 2.135 9.381 1.00 0.00 N ATOM 349 CA GLN A 27 -9.368 2.641 8.034 1.00 0.00 C ATOM 350 C GLN A 27 -9.763 1.510 7.089 1.00 0.00 C ATOM 351 O GLN A 27 -9.033 0.535 6.910 1.00 0.00 O ATOM 352 CB GLN A 27 -8.119 3.349 7.506 1.00 0.00 C ATOM 353 CG GLN A 27 -7.789 4.634 8.248 1.00 0.00 C ATOM 354 CD GLN A 27 -6.886 5.554 7.450 1.00 0.00 C ATOM 355 OE1 GLN A 27 -5.850 5.132 6.935 1.00 0.00 O ATOM 356 NE2 GLN A 27 -7.276 6.819 7.341 1.00 0.00 N ATOM 0 H GLN A 27 -8.322 1.523 9.466 1.00 0.00 H new ATOM 0 HA GLN A 27 -10.190 3.356 8.080 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -7.269 2.670 7.577 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -8.259 3.575 6.449 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -8.714 5.158 8.488 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -7.307 4.389 9.194 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.142 7.126 7.784 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -6.709 7.484 6.814 1.00 0.00 H new ATOM 365 N PRO A 28 -10.945 1.641 6.470 1.00 0.00 N ATOM 366 CA PRO A 28 -11.463 0.640 5.533 1.00 0.00 C ATOM 367 C PRO A 28 -10.674 0.602 4.229 1.00 0.00 C ATOM 368 O PRO A 28 -9.944 1.540 3.906 1.00 0.00 O ATOM 369 CB PRO A 28 -12.899 1.105 5.276 1.00 0.00 C ATOM 370 CG PRO A 28 -12.876 2.571 5.541 1.00 0.00 C ATOM 371 CD PRO A 28 -11.867 2.778 6.636 1.00 0.00 C ATOM 0 HA PRO A 28 -11.393 -0.370 5.936 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.207 0.893 4.252 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -13.604 0.595 5.933 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.598 3.125 4.645 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.860 2.928 5.844 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.351 3.732 6.532 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.336 2.775 7.620 1.00 0.00 H new ATOM 379 N LYS A 29 -10.825 -0.487 3.483 1.00 0.00 N ATOM 380 CA LYS A 29 -10.127 -0.646 2.213 1.00 0.00 C ATOM 381 C LYS A 29 -10.226 0.624 1.374 1.00 0.00 C ATOM 382 O LYS A 29 -9.221 1.232 1.005 1.00 0.00 O ATOM 383 CB LYS A 29 -10.707 -1.830 1.434 1.00 0.00 C ATOM 384 CG LYS A 29 -10.630 -1.663 -0.073 1.00 0.00 C ATOM 385 CD LYS A 29 -10.493 -3.003 -0.776 1.00 0.00 C ATOM 386 CE LYS A 29 -10.833 -2.894 -2.255 1.00 0.00 C ATOM 387 NZ LYS A 29 -9.682 -2.388 -3.053 1.00 0.00 N ATOM 0 H LYS A 29 -11.425 -1.272 3.736 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.076 -0.838 2.427 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -10.174 -2.737 1.718 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -11.749 -1.969 1.723 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.525 -1.154 -0.430 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -9.780 -1.029 -0.327 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -9.474 -3.372 -0.662 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -11.151 -3.732 -0.303 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -11.134 -3.872 -2.631 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -11.685 -2.227 -2.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.708 -2.807 -4.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -9.741 -1.352 -3.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.792 -2.651 -2.584 1.00 0.00 H new ATOM 401 N PRO A 30 -11.464 1.037 1.068 1.00 0.00 N ATOM 402 CA PRO A 30 -11.723 2.241 0.272 1.00 0.00 C ATOM 403 C PRO A 30 -11.377 3.520 1.026 1.00 0.00 C ATOM 404 O PRO A 30 -11.813 4.609 0.653 1.00 0.00 O ATOM 405 CB PRO A 30 -13.228 2.171 0.000 1.00 0.00 C ATOM 406 CG PRO A 30 -13.777 1.359 1.122 1.00 0.00 C ATOM 407 CD PRO A 30 -12.708 0.362 1.475 1.00 0.00 C ATOM 0 HA PRO A 30 -11.114 2.270 -0.632 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -13.673 3.166 -0.024 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -13.435 1.706 -0.964 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -14.020 1.990 1.977 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -14.697 0.856 0.825 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -12.710 0.131 2.540 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -12.846 -0.580 0.944 1.00 0.00 H new ATOM 415 N ASP A 31 -10.590 3.381 2.087 1.00 0.00 N ATOM 416 CA ASP A 31 -10.184 4.527 2.893 1.00 0.00 C ATOM 417 C ASP A 31 -8.978 5.227 2.275 1.00 0.00 C ATOM 418 O ASP A 31 -8.978 6.445 2.096 1.00 0.00 O ATOM 419 CB ASP A 31 -9.856 4.083 4.320 1.00 0.00 C ATOM 420 CG ASP A 31 -9.715 5.254 5.272 1.00 0.00 C ATOM 421 OD1 ASP A 31 -10.748 5.714 5.803 1.00 0.00 O ATOM 422 OD2 ASP A 31 -8.573 5.711 5.487 1.00 0.00 O ATOM 0 H ASP A 31 -10.220 2.487 2.409 1.00 0.00 H new ATOM 0 HA ASP A 31 -11.015 5.232 2.922 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -10.641 3.418 4.680 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -8.929 3.509 4.315 1.00 0.00 H new ATOM 427 N LEU A 32 -7.951 4.448 1.951 1.00 0.00 N ATOM 428 CA LEU A 32 -6.737 4.993 1.353 1.00 0.00 C ATOM 429 C LEU A 32 -6.960 5.334 -0.117 1.00 0.00 C ATOM 430 O LEU A 32 -6.303 6.219 -0.665 1.00 0.00 O ATOM 431 CB LEU A 32 -5.586 3.995 1.488 1.00 0.00 C ATOM 432 CG LEU A 32 -5.509 3.234 2.812 1.00 0.00 C ATOM 433 CD1 LEU A 32 -4.913 1.851 2.599 1.00 0.00 C ATOM 434 CD2 LEU A 32 -4.695 4.017 3.831 1.00 0.00 C ATOM 0 H LEU A 32 -7.935 3.438 2.092 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.479 5.909 1.884 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.664 3.269 0.679 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.648 4.531 1.345 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.521 3.115 3.200 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -4.866 1.324 3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.537 1.289 1.904 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.908 1.947 2.188 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -4.651 3.460 4.767 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.685 4.168 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.165 4.985 4.006 1.00 0.00 H new ATOM 446 N GLU A 33 -7.892 4.627 -0.749 1.00 0.00 N ATOM 447 CA GLU A 33 -8.202 4.857 -2.155 1.00 0.00 C ATOM 448 C GLU A 33 -8.799 6.246 -2.361 1.00 0.00 C ATOM 449 O GLU A 33 -8.430 6.960 -3.292 1.00 0.00 O ATOM 450 CB GLU A 33 -9.173 3.791 -2.667 1.00 0.00 C ATOM 451 CG GLU A 33 -8.677 2.369 -2.467 1.00 0.00 C ATOM 452 CD GLU A 33 -9.405 1.368 -3.344 1.00 0.00 C ATOM 453 OE1 GLU A 33 -10.653 1.396 -3.366 1.00 0.00 O ATOM 454 OE2 GLU A 33 -8.725 0.558 -4.008 1.00 0.00 O ATOM 0 H GLU A 33 -8.445 3.891 -0.310 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.272 4.793 -2.721 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -10.129 3.908 -2.157 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.355 3.957 -3.729 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -7.609 2.327 -2.683 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -8.802 2.088 -1.421 1.00 0.00 H new ATOM 461 N ASN A 34 -9.725 6.621 -1.484 1.00 0.00 N ATOM 462 CA ASN A 34 -10.375 7.924 -1.569 1.00 0.00 C ATOM 463 C ASN A 34 -9.388 9.046 -1.257 1.00 0.00 C ATOM 464 O ASN A 34 -9.193 9.957 -2.062 1.00 0.00 O ATOM 465 CB ASN A 34 -11.561 7.990 -0.605 1.00 0.00 C ATOM 466 CG ASN A 34 -11.153 8.445 0.783 1.00 0.00 C ATOM 467 OD1 ASN A 34 -10.853 9.619 1.000 1.00 0.00 O ATOM 468 ND2 ASN A 34 -11.141 7.515 1.730 1.00 0.00 N ATOM 0 H ASN A 34 -10.042 6.041 -0.707 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.737 8.056 -2.589 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.311 8.673 -1.003 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -12.028 7.007 -0.540 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -10.875 7.761 2.683 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -11.397 6.554 1.504 1.00 0.00 H new ATOM 475 N ARG A 35 -8.769 8.972 -0.084 1.00 0.00 N ATOM 476 CA ARG A 35 -7.804 9.981 0.336 1.00 0.00 C ATOM 477 C ARG A 35 -6.725 10.175 -0.726 1.00 0.00 C ATOM 478 O ARG A 35 -6.619 11.244 -1.329 1.00 0.00 O ATOM 479 CB ARG A 35 -7.160 9.580 1.665 1.00 0.00 C ATOM 480 CG ARG A 35 -8.068 9.785 2.867 1.00 0.00 C ATOM 481 CD ARG A 35 -7.266 10.051 4.131 1.00 0.00 C ATOM 482 NE ARG A 35 -8.128 10.294 5.285 1.00 0.00 N ATOM 483 CZ ARG A 35 -8.764 11.441 5.498 1.00 0.00 C ATOM 484 NH1 ARG A 35 -8.635 12.444 4.641 1.00 0.00 N ATOM 485 NH2 ARG A 35 -9.531 11.586 6.571 1.00 0.00 N ATOM 0 H ARG A 35 -8.918 8.224 0.593 1.00 0.00 H new ATOM 0 HA ARG A 35 -8.335 10.924 0.468 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -6.868 8.531 1.616 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -6.247 10.159 1.806 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -8.740 10.622 2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -8.691 8.902 3.009 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.618 9.199 4.335 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -6.618 10.913 3.974 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.248 9.542 5.964 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -8.046 12.337 3.815 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -9.125 13.323 4.807 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -9.633 10.817 7.233 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -10.019 12.467 6.734 1.00 0.00 H new ATOM 499 N ILE A 36 -5.927 9.136 -0.948 1.00 0.00 N ATOM 500 CA ILE A 36 -4.857 9.193 -1.937 1.00 0.00 C ATOM 501 C ILE A 36 -5.265 10.036 -3.140 1.00 0.00 C ATOM 502 O ILE A 36 -4.599 11.013 -3.480 1.00 0.00 O ATOM 503 CB ILE A 36 -4.463 7.785 -2.422 1.00 0.00 C ATOM 504 CG1 ILE A 36 -3.768 7.011 -1.299 1.00 0.00 C ATOM 505 CG2 ILE A 36 -3.563 7.878 -3.644 1.00 0.00 C ATOM 506 CD1 ILE A 36 -3.656 5.527 -1.568 1.00 0.00 C ATOM 0 H ILE A 36 -6.001 8.245 -0.457 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.999 9.653 -1.447 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.368 7.247 -2.703 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.769 7.421 -1.150 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.317 7.163 -0.370 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.293 6.875 -3.974 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.090 8.395 -4.446 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.659 8.431 -3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.153 5.042 -0.731 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.653 5.103 -1.688 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.081 5.365 -2.480 1.00 0.00 H new ATOM 518 N ALA A 37 -6.365 9.653 -3.779 1.00 0.00 N ATOM 519 CA ALA A 37 -6.864 10.376 -4.942 1.00 0.00 C ATOM 520 C ALA A 37 -6.918 11.877 -4.674 1.00 0.00 C ATOM 521 O ALA A 37 -6.535 12.682 -5.522 1.00 0.00 O ATOM 522 CB ALA A 37 -8.240 9.859 -5.335 1.00 0.00 C ATOM 0 H ALA A 37 -6.928 8.846 -3.511 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.174 10.205 -5.768 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.600 10.408 -6.205 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.175 8.798 -5.577 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.932 10.000 -4.505 1.00 0.00 H new ATOM 528 N GLU A 38 -7.397 12.245 -3.490 1.00 0.00 N ATOM 529 CA GLU A 38 -7.502 13.649 -3.112 1.00 0.00 C ATOM 530 C GLU A 38 -6.130 14.317 -3.115 1.00 0.00 C ATOM 531 O GLU A 38 -6.019 15.533 -3.277 1.00 0.00 O ATOM 532 CB GLU A 38 -8.143 13.782 -1.729 1.00 0.00 C ATOM 533 CG GLU A 38 -9.578 13.284 -1.673 1.00 0.00 C ATOM 534 CD GLU A 38 -10.528 14.154 -2.473 1.00 0.00 C ATOM 535 OE1 GLU A 38 -10.708 13.881 -3.678 1.00 0.00 O ATOM 536 OE2 GLU A 38 -11.092 15.106 -1.894 1.00 0.00 O ATOM 0 H GLU A 38 -7.718 11.591 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 38 -8.133 14.150 -3.846 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.546 13.226 -1.006 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.118 14.829 -1.425 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -9.620 12.263 -2.052 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -9.907 13.252 -0.634 1.00 0.00 H new ATOM 543 N PHE A 39 -5.087 13.514 -2.933 1.00 0.00 N ATOM 544 CA PHE A 39 -3.722 14.026 -2.913 1.00 0.00 C ATOM 545 C PHE A 39 -3.095 13.958 -4.303 1.00 0.00 C ATOM 546 O PHE A 39 -1.874 14.008 -4.448 1.00 0.00 O ATOM 547 CB PHE A 39 -2.872 13.234 -1.918 1.00 0.00 C ATOM 548 CG PHE A 39 -3.048 13.676 -0.494 1.00 0.00 C ATOM 549 CD1 PHE A 39 -4.059 13.145 0.291 1.00 0.00 C ATOM 550 CD2 PHE A 39 -2.203 14.624 0.061 1.00 0.00 C ATOM 551 CE1 PHE A 39 -4.223 13.550 1.602 1.00 0.00 C ATOM 552 CE2 PHE A 39 -2.362 15.032 1.372 1.00 0.00 C ATOM 553 CZ PHE A 39 -3.374 14.495 2.143 1.00 0.00 C ATOM 0 H PHE A 39 -5.161 12.506 -2.797 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.757 15.070 -2.600 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -3.126 12.177 -1.996 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.822 13.330 -2.193 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -4.727 12.406 -0.127 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.411 15.049 -0.538 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.015 13.128 2.203 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.695 15.770 1.793 1.00 0.00 H new ATOM 0 HZ PHE A 39 -3.501 14.814 3.167 1.00 0.00 H new ATOM 563 N GLY A 40 -3.940 13.843 -5.322 1.00 0.00 N ATOM 564 CA GLY A 40 -3.452 13.769 -6.687 1.00 0.00 C ATOM 565 C GLY A 40 -2.789 12.441 -6.994 1.00 0.00 C ATOM 566 O GLY A 40 -1.745 12.395 -7.644 1.00 0.00 O ATOM 0 H GLY A 40 -4.955 13.800 -5.227 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.283 13.925 -7.376 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.740 14.576 -6.859 1.00 0.00 H new ATOM 570 N GLY A 41 -3.396 11.355 -6.523 1.00 0.00 N ATOM 571 CA GLY A 41 -2.843 10.035 -6.760 1.00 0.00 C ATOM 572 C GLY A 41 -3.799 9.132 -7.513 1.00 0.00 C ATOM 573 O GLY A 41 -5.016 9.305 -7.439 1.00 0.00 O ATOM 0 H GLY A 41 -4.261 11.367 -5.982 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.916 10.129 -7.325 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.589 9.574 -5.805 1.00 0.00 H new ATOM 577 N TYR A 42 -3.250 8.167 -8.242 1.00 0.00 N ATOM 578 CA TYR A 42 -4.062 7.236 -9.016 1.00 0.00 C ATOM 579 C TYR A 42 -4.275 5.933 -8.252 1.00 0.00 C ATOM 580 O TYR A 42 -3.340 5.383 -7.668 1.00 0.00 O ATOM 581 CB TYR A 42 -3.400 6.948 -10.364 1.00 0.00 C ATOM 582 CG TYR A 42 -4.384 6.620 -11.464 1.00 0.00 C ATOM 583 CD1 TYR A 42 -5.036 7.628 -12.163 1.00 0.00 C ATOM 584 CD2 TYR A 42 -4.663 5.302 -11.804 1.00 0.00 C ATOM 585 CE1 TYR A 42 -5.937 7.333 -13.169 1.00 0.00 C ATOM 586 CE2 TYR A 42 -5.561 4.997 -12.808 1.00 0.00 C ATOM 587 CZ TYR A 42 -6.196 6.017 -13.488 1.00 0.00 C ATOM 588 OH TYR A 42 -7.092 5.718 -14.488 1.00 0.00 O ATOM 0 H TYR A 42 -2.245 8.009 -8.313 1.00 0.00 H new ATOM 0 HA TYR A 42 -5.034 7.698 -9.188 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.810 7.815 -10.662 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -2.706 6.115 -10.248 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -4.835 8.660 -11.916 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -4.169 4.502 -11.274 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -6.435 8.129 -13.702 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -5.765 3.967 -13.060 1.00 0.00 H new ATOM 0 HH TYR A 42 -7.159 4.745 -14.587 1.00 0.00 H new ATOM 598 N ILE A 43 -5.511 5.445 -8.260 1.00 0.00 N ATOM 599 CA ILE A 43 -5.846 4.206 -7.570 1.00 0.00 C ATOM 600 C ILE A 43 -6.264 3.122 -8.558 1.00 0.00 C ATOM 601 O ILE A 43 -7.158 3.326 -9.380 1.00 0.00 O ATOM 602 CB ILE A 43 -6.980 4.419 -6.550 1.00 0.00 C ATOM 603 CG1 ILE A 43 -6.538 5.396 -5.459 1.00 0.00 C ATOM 604 CG2 ILE A 43 -7.401 3.090 -5.940 1.00 0.00 C ATOM 605 CD1 ILE A 43 -5.155 5.110 -4.917 1.00 0.00 C ATOM 0 H ILE A 43 -6.296 5.889 -8.736 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.948 3.886 -7.042 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.838 4.847 -7.068 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.560 6.410 -5.859 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.255 5.361 -4.639 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.203 3.257 -5.221 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.753 2.423 -6.727 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -6.549 2.636 -5.434 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.907 5.841 -4.148 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.133 4.109 -4.487 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.427 5.173 -5.726 1.00 0.00 H new ATOM 617 N VAL A 44 -5.612 1.967 -8.471 1.00 0.00 N ATOM 618 CA VAL A 44 -5.917 0.848 -9.356 1.00 0.00 C ATOM 619 C VAL A 44 -6.414 -0.357 -8.565 1.00 0.00 C ATOM 620 O VAL A 44 -6.539 -0.301 -7.342 1.00 0.00 O ATOM 621 CB VAL A 44 -4.685 0.434 -10.182 1.00 0.00 C ATOM 622 CG1 VAL A 44 -4.249 1.570 -11.096 1.00 0.00 C ATOM 623 CG2 VAL A 44 -3.548 0.009 -9.266 1.00 0.00 C ATOM 0 H VAL A 44 -4.869 1.781 -7.797 1.00 0.00 H new ATOM 0 HA VAL A 44 -6.702 1.184 -10.033 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.956 -0.418 -10.805 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.377 1.259 -11.672 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -5.062 1.822 -11.776 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.995 2.443 -10.495 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.686 -0.280 -9.867 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.275 0.840 -8.615 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.867 -0.838 -8.658 1.00 0.00 H new ATOM 633 N GLN A 45 -6.695 -1.447 -9.273 1.00 0.00 N ATOM 634 CA GLN A 45 -7.178 -2.667 -8.637 1.00 0.00 C ATOM 635 C GLN A 45 -6.076 -3.718 -8.568 1.00 0.00 C ATOM 636 O GLN A 45 -5.972 -4.459 -7.591 1.00 0.00 O ATOM 637 CB GLN A 45 -8.382 -3.222 -9.400 1.00 0.00 C ATOM 638 CG GLN A 45 -9.637 -2.375 -9.257 1.00 0.00 C ATOM 639 CD GLN A 45 -9.909 -1.974 -7.820 1.00 0.00 C ATOM 640 OE1 GLN A 45 -10.414 -2.768 -7.027 1.00 0.00 O ATOM 641 NE2 GLN A 45 -9.574 -0.735 -7.478 1.00 0.00 N ATOM 0 H GLN A 45 -6.596 -1.510 -10.286 1.00 0.00 H new ATOM 0 HA GLN A 45 -7.483 -2.421 -7.620 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -8.126 -3.302 -10.457 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.592 -4.231 -9.046 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.537 -1.478 -9.868 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.492 -2.930 -9.643 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -9.158 -0.110 -8.168 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.733 -0.408 -6.525 1.00 0.00 H new ATOM 650 N ASN A 46 -5.256 -3.778 -9.612 1.00 0.00 N ATOM 651 CA ASN A 46 -4.161 -4.740 -9.670 1.00 0.00 C ATOM 652 C ASN A 46 -2.848 -4.049 -10.025 1.00 0.00 C ATOM 653 O ASN A 46 -2.797 -3.154 -10.869 1.00 0.00 O ATOM 654 CB ASN A 46 -4.469 -5.833 -10.696 1.00 0.00 C ATOM 655 CG ASN A 46 -3.682 -7.104 -10.440 1.00 0.00 C ATOM 656 OD1 ASN A 46 -2.660 -7.354 -11.079 1.00 0.00 O ATOM 657 ND2 ASN A 46 -4.157 -7.915 -9.501 1.00 0.00 N ATOM 0 H ASN A 46 -5.329 -3.172 -10.429 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.057 -5.194 -8.685 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.535 -6.058 -10.674 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.242 -5.463 -11.696 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -3.671 -8.785 -9.285 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.008 -7.667 -8.996 1.00 0.00 H new ATOM 664 N PRO A 47 -1.759 -4.474 -9.368 1.00 0.00 N ATOM 665 CA PRO A 47 -0.425 -3.912 -9.598 1.00 0.00 C ATOM 666 C PRO A 47 0.134 -4.287 -10.966 1.00 0.00 C ATOM 667 O PRO A 47 0.124 -5.455 -11.352 1.00 0.00 O ATOM 668 CB PRO A 47 0.420 -4.536 -8.485 1.00 0.00 C ATOM 669 CG PRO A 47 -0.281 -5.805 -8.144 1.00 0.00 C ATOM 670 CD PRO A 47 -1.746 -5.538 -8.349 1.00 0.00 C ATOM 0 HA PRO A 47 -0.434 -2.822 -9.584 1.00 0.00 H new ATOM 0 HB2 PRO A 47 1.440 -4.725 -8.821 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.486 -3.876 -7.620 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.059 -6.622 -8.780 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.078 -6.098 -7.114 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -2.273 -6.429 -8.691 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -2.229 -5.217 -7.426 1.00 0.00 H new ATOM 678 N GLY A 48 0.622 -3.288 -11.695 1.00 0.00 N ATOM 679 CA GLY A 48 1.180 -3.534 -13.012 1.00 0.00 C ATOM 680 C GLY A 48 2.545 -2.900 -13.192 1.00 0.00 C ATOM 681 O GLY A 48 3.248 -2.605 -12.226 1.00 0.00 O ATOM 0 H GLY A 48 0.641 -2.313 -11.397 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.258 -4.609 -13.175 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.500 -3.145 -13.770 1.00 0.00 H new ATOM 685 N PRO A 49 2.939 -2.683 -14.456 1.00 0.00 N ATOM 686 CA PRO A 49 4.232 -2.079 -14.789 1.00 0.00 C ATOM 687 C PRO A 49 4.296 -0.603 -14.412 1.00 0.00 C ATOM 688 O PRO A 49 5.367 -0.077 -14.106 1.00 0.00 O ATOM 689 CB PRO A 49 4.321 -2.247 -16.308 1.00 0.00 C ATOM 690 CG PRO A 49 2.905 -2.327 -16.764 1.00 0.00 C ATOM 691 CD PRO A 49 2.151 -3.010 -15.657 1.00 0.00 C ATOM 0 HA PRO A 49 5.053 -2.547 -14.246 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.839 -1.406 -16.770 1.00 0.00 H new ATOM 0 HB3 PRO A 49 4.874 -3.147 -16.575 1.00 0.00 H new ATOM 0 HG2 PRO A 49 2.500 -1.333 -16.956 1.00 0.00 H new ATOM 0 HG3 PRO A 49 2.826 -2.889 -17.695 1.00 0.00 H new ATOM 0 HD2 PRO A 49 1.128 -2.641 -15.580 1.00 0.00 H new ATOM 0 HD3 PRO A 49 2.090 -4.086 -15.817 1.00 0.00 H new ATOM 699 N ASP A 50 3.145 0.060 -14.435 1.00 0.00 N ATOM 700 CA ASP A 50 3.071 1.476 -14.094 1.00 0.00 C ATOM 701 C ASP A 50 2.535 1.666 -12.679 1.00 0.00 C ATOM 702 O ASP A 50 1.737 2.569 -12.421 1.00 0.00 O ATOM 703 CB ASP A 50 2.182 2.217 -15.094 1.00 0.00 C ATOM 704 CG ASP A 50 2.881 2.467 -16.416 1.00 0.00 C ATOM 705 OD1 ASP A 50 3.340 1.487 -17.039 1.00 0.00 O ATOM 706 OD2 ASP A 50 2.968 3.643 -16.827 1.00 0.00 O ATOM 0 H ASP A 50 2.250 -0.360 -14.686 1.00 0.00 H new ATOM 0 HA ASP A 50 4.079 1.889 -14.140 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.276 1.637 -15.269 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.872 3.170 -14.664 1.00 0.00 H new ATOM 711 N THR A 51 2.977 0.809 -11.763 1.00 0.00 N ATOM 712 CA THR A 51 2.540 0.881 -10.375 1.00 0.00 C ATOM 713 C THR A 51 3.707 1.200 -9.447 1.00 0.00 C ATOM 714 O THR A 51 4.829 0.744 -9.667 1.00 0.00 O ATOM 715 CB THR A 51 1.885 -0.438 -9.923 1.00 0.00 C ATOM 716 OG1 THR A 51 0.706 -0.690 -10.696 1.00 0.00 O ATOM 717 CG2 THR A 51 1.527 -0.386 -8.445 1.00 0.00 C ATOM 0 H THR A 51 3.638 0.057 -11.958 1.00 0.00 H new ATOM 0 HA THR A 51 1.803 1.682 -10.317 1.00 0.00 H new ATOM 0 HB THR A 51 2.601 -1.245 -10.079 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.314 0.162 -10.981 1.00 0.00 H new ATOM 0 HG21 THR A 51 1.066 -1.328 -8.149 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.431 -0.224 -7.857 1.00 0.00 H new ATOM 0 HG23 THR A 51 0.828 0.431 -8.269 1.00 0.00 H new ATOM 725 N TYR A 52 3.435 1.984 -8.410 1.00 0.00 N ATOM 726 CA TYR A 52 4.463 2.365 -7.450 1.00 0.00 C ATOM 727 C TYR A 52 4.704 1.249 -6.438 1.00 0.00 C ATOM 728 O TYR A 52 5.826 0.764 -6.286 1.00 0.00 O ATOM 729 CB TYR A 52 4.061 3.650 -6.723 1.00 0.00 C ATOM 730 CG TYR A 52 5.164 4.233 -5.868 1.00 0.00 C ATOM 731 CD1 TYR A 52 6.435 4.445 -6.388 1.00 0.00 C ATOM 732 CD2 TYR A 52 4.934 4.572 -4.540 1.00 0.00 C ATOM 733 CE1 TYR A 52 7.445 4.976 -5.611 1.00 0.00 C ATOM 734 CE2 TYR A 52 5.939 5.105 -3.756 1.00 0.00 C ATOM 735 CZ TYR A 52 7.192 5.305 -4.295 1.00 0.00 C ATOM 736 OH TYR A 52 8.196 5.836 -3.517 1.00 0.00 O ATOM 0 H TYR A 52 2.511 2.368 -8.213 1.00 0.00 H new ATOM 0 HA TYR A 52 5.389 2.540 -7.998 1.00 0.00 H new ATOM 0 HB2 TYR A 52 3.752 4.392 -7.459 1.00 0.00 H new ATOM 0 HB3 TYR A 52 3.195 3.446 -6.094 1.00 0.00 H new ATOM 0 HD1 TYR A 52 6.636 4.190 -7.418 1.00 0.00 H new ATOM 0 HD2 TYR A 52 3.954 4.416 -4.114 1.00 0.00 H new ATOM 0 HE1 TYR A 52 8.428 5.133 -6.031 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.744 5.364 -2.726 1.00 0.00 H new ATOM 0 HH TYR A 52 7.853 6.013 -2.616 1.00 0.00 H new ATOM 746 N CYS A 53 3.642 0.847 -5.748 1.00 0.00 N ATOM 747 CA CYS A 53 3.736 -0.212 -4.749 1.00 0.00 C ATOM 748 C CYS A 53 2.350 -0.708 -4.351 1.00 0.00 C ATOM 749 O CYS A 53 1.336 -0.167 -4.790 1.00 0.00 O ATOM 750 CB CYS A 53 4.487 0.288 -3.514 1.00 0.00 C ATOM 751 SG CYS A 53 3.642 1.615 -2.624 1.00 0.00 S ATOM 0 H CYS A 53 2.707 1.238 -5.862 1.00 0.00 H new ATOM 0 HA CYS A 53 4.287 -1.044 -5.188 1.00 0.00 H new ATOM 0 HB2 CYS A 53 4.644 -0.549 -2.834 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.473 0.640 -3.819 1.00 0.00 H new ATOM 0 HG CYS A 53 3.998 2.764 -3.118 1.00 0.00 H new ATOM 757 N VAL A 54 2.315 -1.743 -3.517 1.00 0.00 N ATOM 758 CA VAL A 54 1.053 -2.313 -3.059 1.00 0.00 C ATOM 759 C VAL A 54 0.860 -2.090 -1.564 1.00 0.00 C ATOM 760 O VAL A 54 1.747 -2.386 -0.762 1.00 0.00 O ATOM 761 CB VAL A 54 0.979 -3.823 -3.356 1.00 0.00 C ATOM 762 CG1 VAL A 54 -0.308 -4.414 -2.802 1.00 0.00 C ATOM 763 CG2 VAL A 54 1.092 -4.078 -4.852 1.00 0.00 C ATOM 0 H VAL A 54 3.146 -2.204 -3.145 1.00 0.00 H new ATOM 0 HA VAL A 54 0.259 -1.804 -3.605 1.00 0.00 H new ATOM 0 HB VAL A 54 1.818 -4.314 -2.863 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.342 -5.481 -3.021 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.342 -4.264 -1.723 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.163 -3.921 -3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.038 -5.150 -5.044 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.275 -3.575 -5.370 1.00 0.00 H new ATOM 0 HG23 VAL A 54 2.044 -3.692 -5.216 1.00 0.00 H new ATOM 773 N ILE A 55 -0.305 -1.568 -1.195 1.00 0.00 N ATOM 774 CA ILE A 55 -0.615 -1.307 0.205 1.00 0.00 C ATOM 775 C ILE A 55 -1.458 -2.430 0.800 1.00 0.00 C ATOM 776 O ILE A 55 -2.576 -2.684 0.354 1.00 0.00 O ATOM 777 CB ILE A 55 -1.364 0.027 0.377 1.00 0.00 C ATOM 778 CG1 ILE A 55 -0.591 1.162 -0.300 1.00 0.00 C ATOM 779 CG2 ILE A 55 -1.576 0.330 1.853 1.00 0.00 C ATOM 780 CD1 ILE A 55 0.835 1.295 0.187 1.00 0.00 C ATOM 0 H ILE A 55 -1.049 -1.318 -1.846 1.00 0.00 H new ATOM 0 HA ILE A 55 0.337 -1.251 0.733 1.00 0.00 H new ATOM 0 HB ILE A 55 -2.340 -0.058 -0.100 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.585 0.995 -1.377 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.115 2.102 -0.126 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -2.107 1.276 1.958 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -2.163 -0.468 2.307 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.610 0.399 2.353 1.00 0.00 H new ATOM 0 HD11 ILE A 55 1.323 2.118 -0.335 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.836 1.493 1.259 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.375 0.369 -0.011 1.00 0.00 H new ATOM 792 N ALA A 56 -0.914 -3.099 1.812 1.00 0.00 N ATOM 793 CA ALA A 56 -1.617 -4.192 2.471 1.00 0.00 C ATOM 794 C ALA A 56 -1.288 -4.238 3.959 1.00 0.00 C ATOM 795 O ALA A 56 -0.142 -4.465 4.345 1.00 0.00 O ATOM 796 CB ALA A 56 -1.269 -5.518 1.810 1.00 0.00 C ATOM 0 H ALA A 56 0.012 -2.903 2.193 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.688 -4.017 2.368 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.801 -6.326 2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.561 -5.489 0.760 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -0.195 -5.690 1.883 1.00 0.00 H new ATOM 802 N GLY A 57 -2.302 -4.021 4.792 1.00 0.00 N ATOM 803 CA GLY A 57 -2.100 -4.041 6.228 1.00 0.00 C ATOM 804 C GLY A 57 -1.850 -5.439 6.759 1.00 0.00 C ATOM 805 O GLY A 57 -1.107 -5.621 7.724 1.00 0.00 O ATOM 0 H GLY A 57 -3.260 -3.832 4.497 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.254 -3.403 6.482 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.976 -3.620 6.721 1.00 0.00 H new ATOM 809 N SER A 58 -2.474 -6.430 6.129 1.00 0.00 N ATOM 810 CA SER A 58 -2.319 -7.818 6.548 1.00 0.00 C ATOM 811 C SER A 58 -1.860 -8.689 5.382 1.00 0.00 C ATOM 812 O SER A 58 -1.675 -8.203 4.267 1.00 0.00 O ATOM 813 CB SER A 58 -3.638 -8.353 7.109 1.00 0.00 C ATOM 814 OG SER A 58 -4.563 -8.624 6.070 1.00 0.00 O ATOM 0 H SER A 58 -3.091 -6.297 5.328 1.00 0.00 H new ATOM 0 HA SER A 58 -1.558 -7.854 7.328 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.451 -9.263 7.680 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.065 -7.625 7.799 1.00 0.00 H new ATOM 0 HG SER A 58 -5.397 -8.966 6.455 1.00 0.00 H new ATOM 820 N GLU A 59 -1.677 -9.978 5.650 1.00 0.00 N ATOM 821 CA GLU A 59 -1.238 -10.916 4.624 1.00 0.00 C ATOM 822 C GLU A 59 -2.386 -11.822 4.188 1.00 0.00 C ATOM 823 O GLU A 59 -2.664 -12.839 4.823 1.00 0.00 O ATOM 824 CB GLU A 59 -0.074 -11.764 5.141 1.00 0.00 C ATOM 825 CG GLU A 59 1.264 -11.043 5.112 1.00 0.00 C ATOM 826 CD GLU A 59 1.289 -9.823 6.013 1.00 0.00 C ATOM 827 OE1 GLU A 59 1.123 -9.987 7.240 1.00 0.00 O ATOM 828 OE2 GLU A 59 1.474 -8.704 5.490 1.00 0.00 O ATOM 0 H GLU A 59 -1.826 -10.396 6.568 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.904 -10.340 3.761 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -0.288 -12.075 6.164 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -0.002 -12.671 4.541 1.00 0.00 H new ATOM 0 HG2 GLU A 59 2.051 -11.732 5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 59 1.487 -10.739 4.089 1.00 0.00 H new ATOM 835 N ASN A 60 -3.050 -11.444 3.101 1.00 0.00 N ATOM 836 CA ASN A 60 -4.169 -12.221 2.580 1.00 0.00 C ATOM 837 C ASN A 60 -3.817 -12.849 1.235 1.00 0.00 C ATOM 838 O ASN A 60 -2.811 -12.495 0.619 1.00 0.00 O ATOM 839 CB ASN A 60 -5.408 -11.334 2.433 1.00 0.00 C ATOM 840 CG ASN A 60 -6.666 -12.138 2.166 1.00 0.00 C ATOM 841 OD1 ASN A 60 -7.276 -12.680 3.088 1.00 0.00 O ATOM 842 ND2 ASN A 60 -7.060 -12.218 0.901 1.00 0.00 N ATOM 0 H ASN A 60 -2.833 -10.605 2.564 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.384 -13.021 3.288 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.541 -10.747 3.342 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -5.251 -10.628 1.618 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -7.900 -12.745 0.661 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.523 -11.753 0.169 1.00 0.00 H new ATOM 849 N ILE A 61 -4.651 -13.780 0.787 1.00 0.00 N ATOM 850 CA ILE A 61 -4.428 -14.456 -0.486 1.00 0.00 C ATOM 851 C ILE A 61 -3.928 -13.480 -1.546 1.00 0.00 C ATOM 852 O ILE A 61 -2.800 -13.592 -2.025 1.00 0.00 O ATOM 853 CB ILE A 61 -5.712 -15.136 -0.995 1.00 0.00 C ATOM 854 CG1 ILE A 61 -6.173 -16.209 -0.006 1.00 0.00 C ATOM 855 CG2 ILE A 61 -5.481 -15.741 -2.371 1.00 0.00 C ATOM 856 CD1 ILE A 61 -5.033 -16.936 0.672 1.00 0.00 C ATOM 0 H ILE A 61 -5.487 -14.084 1.286 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.669 -15.218 -0.310 1.00 0.00 H new ATOM 0 HB ILE A 61 -6.496 -14.383 -1.078 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.801 -15.745 0.755 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.794 -16.934 -0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.398 -16.218 -2.717 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.194 -14.956 -3.070 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.685 -16.484 -2.313 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.434 -17.681 1.359 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.418 -17.429 -0.080 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.425 -16.222 1.227 1.00 0.00 H new ATOM 868 N ARG A 62 -4.776 -12.522 -1.907 1.00 0.00 N ATOM 869 CA ARG A 62 -4.420 -11.526 -2.910 1.00 0.00 C ATOM 870 C ARG A 62 -3.001 -11.013 -2.688 1.00 0.00 C ATOM 871 O ARG A 62 -2.138 -11.144 -3.557 1.00 0.00 O ATOM 872 CB ARG A 62 -5.408 -10.358 -2.873 1.00 0.00 C ATOM 873 CG ARG A 62 -6.853 -10.776 -3.092 1.00 0.00 C ATOM 874 CD ARG A 62 -7.220 -10.759 -4.567 1.00 0.00 C ATOM 875 NE ARG A 62 -8.653 -10.565 -4.772 1.00 0.00 N ATOM 876 CZ ARG A 62 -9.290 -10.913 -5.885 1.00 0.00 C ATOM 877 NH1 ARG A 62 -8.624 -11.470 -6.887 1.00 0.00 N ATOM 878 NH2 ARG A 62 -10.596 -10.705 -5.997 1.00 0.00 N ATOM 0 H ARG A 62 -5.714 -12.415 -1.520 1.00 0.00 H new ATOM 0 HA ARG A 62 -4.466 -12.001 -3.890 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -5.326 -9.854 -1.910 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.129 -9.632 -3.637 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -7.009 -11.777 -2.689 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -7.514 -10.105 -2.544 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -6.671 -9.962 -5.068 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -6.912 -11.697 -5.028 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.194 -10.139 -4.020 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.620 -11.632 -6.805 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -9.115 -11.736 -7.740 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.112 -10.277 -5.228 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.084 -10.973 -6.852 1.00 0.00 H new ATOM 892 N VAL A 63 -2.765 -10.427 -1.518 1.00 0.00 N ATOM 893 CA VAL A 63 -1.451 -9.895 -1.180 1.00 0.00 C ATOM 894 C VAL A 63 -0.346 -10.870 -1.570 1.00 0.00 C ATOM 895 O VAL A 63 0.697 -10.471 -2.088 1.00 0.00 O ATOM 896 CB VAL A 63 -1.340 -9.585 0.324 1.00 0.00 C ATOM 897 CG1 VAL A 63 0.058 -9.093 0.667 1.00 0.00 C ATOM 898 CG2 VAL A 63 -2.389 -8.564 0.737 1.00 0.00 C ATOM 0 H VAL A 63 -3.468 -10.309 -0.788 1.00 0.00 H new ATOM 0 HA VAL A 63 -1.330 -8.970 -1.743 1.00 0.00 H new ATOM 0 HB VAL A 63 -1.522 -10.505 0.880 1.00 0.00 H new ATOM 0 HG11 VAL A 63 0.117 -8.879 1.734 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.787 -9.861 0.410 1.00 0.00 H new ATOM 0 HG13 VAL A 63 0.273 -8.186 0.103 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -2.295 -8.357 1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.241 -7.642 0.174 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -3.383 -8.960 0.530 1.00 0.00 H new ATOM 908 N LYS A 64 -0.581 -12.154 -1.317 1.00 0.00 N ATOM 909 CA LYS A 64 0.393 -13.189 -1.643 1.00 0.00 C ATOM 910 C LYS A 64 0.794 -13.116 -3.113 1.00 0.00 C ATOM 911 O LYS A 64 1.963 -12.914 -3.437 1.00 0.00 O ATOM 912 CB LYS A 64 -0.179 -14.573 -1.327 1.00 0.00 C ATOM 913 CG LYS A 64 0.877 -15.593 -0.939 1.00 0.00 C ATOM 914 CD LYS A 64 0.378 -17.015 -1.138 1.00 0.00 C ATOM 915 CE LYS A 64 1.314 -18.028 -0.497 1.00 0.00 C ATOM 916 NZ LYS A 64 0.702 -19.384 -0.431 1.00 0.00 N ATOM 0 H LYS A 64 -1.438 -12.502 -0.887 1.00 0.00 H new ATOM 0 HA LYS A 64 1.282 -13.022 -1.034 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.900 -14.482 -0.515 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -0.724 -14.939 -2.197 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.775 -15.434 -1.537 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.159 -15.448 0.104 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.619 -17.116 -0.708 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.288 -17.225 -2.204 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.242 -18.076 -1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.573 -17.697 0.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 1.371 -20.046 0.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.171 -19.344 0.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 0.478 -19.711 -1.392 1.00 0.00 H new ATOM 930 N ASN A 65 -0.185 -13.280 -3.997 1.00 0.00 N ATOM 931 CA ASN A 65 0.067 -13.232 -5.433 1.00 0.00 C ATOM 932 C ASN A 65 1.072 -12.136 -5.772 1.00 0.00 C ATOM 933 O ASN A 65 2.028 -12.364 -6.515 1.00 0.00 O ATOM 934 CB ASN A 65 -1.240 -12.995 -6.193 1.00 0.00 C ATOM 935 CG ASN A 65 -1.969 -14.287 -6.507 1.00 0.00 C ATOM 936 OD1 ASN A 65 -2.011 -14.726 -7.656 1.00 0.00 O ATOM 937 ND2 ASN A 65 -2.548 -14.903 -5.483 1.00 0.00 N ATOM 0 H ASN A 65 -1.159 -13.447 -3.745 1.00 0.00 H new ATOM 0 HA ASN A 65 0.487 -14.191 -5.736 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -1.889 -12.349 -5.601 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -1.026 -12.467 -7.122 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -3.053 -15.776 -5.633 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -2.488 -14.503 -4.547 1.00 0.00 H new ATOM 944 N ILE A 66 0.849 -10.946 -5.224 1.00 0.00 N ATOM 945 CA ILE A 66 1.736 -9.815 -5.468 1.00 0.00 C ATOM 946 C ILE A 66 3.134 -10.086 -4.922 1.00 0.00 C ATOM 947 O ILE A 66 4.133 -9.681 -5.518 1.00 0.00 O ATOM 948 CB ILE A 66 1.190 -8.524 -4.830 1.00 0.00 C ATOM 949 CG1 ILE A 66 -0.065 -8.055 -5.571 1.00 0.00 C ATOM 950 CG2 ILE A 66 2.254 -7.437 -4.840 1.00 0.00 C ATOM 951 CD1 ILE A 66 -1.293 -8.881 -5.260 1.00 0.00 C ATOM 0 H ILE A 66 0.062 -10.740 -4.608 1.00 0.00 H new ATOM 0 HA ILE A 66 1.789 -9.683 -6.549 1.00 0.00 H new ATOM 0 HB ILE A 66 0.922 -8.733 -3.794 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.262 -7.014 -5.313 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.123 -8.088 -6.644 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.853 -6.531 -4.386 1.00 0.00 H new ATOM 0 HG22 ILE A 66 3.123 -7.773 -4.274 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.550 -7.227 -5.868 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.144 -8.492 -5.819 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.115 -9.918 -5.544 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.506 -8.828 -4.192 1.00 0.00 H new ATOM 963 N ILE A 67 3.198 -10.774 -3.787 1.00 0.00 N ATOM 964 CA ILE A 67 4.474 -11.102 -3.163 1.00 0.00 C ATOM 965 C ILE A 67 5.227 -12.153 -3.971 1.00 0.00 C ATOM 966 O ILE A 67 6.387 -11.958 -4.337 1.00 0.00 O ATOM 967 CB ILE A 67 4.281 -11.616 -1.725 1.00 0.00 C ATOM 968 CG1 ILE A 67 3.721 -10.506 -0.833 1.00 0.00 C ATOM 969 CG2 ILE A 67 5.597 -12.137 -1.167 1.00 0.00 C ATOM 970 CD1 ILE A 67 3.517 -10.930 0.605 1.00 0.00 C ATOM 0 H ILE A 67 2.381 -11.115 -3.281 1.00 0.00 H new ATOM 0 HA ILE A 67 5.058 -10.182 -3.136 1.00 0.00 H new ATOM 0 HB ILE A 67 3.565 -12.438 -1.743 1.00 0.00 H new ATOM 0 HG12 ILE A 67 4.400 -9.653 -0.859 1.00 0.00 H new ATOM 0 HG13 ILE A 67 2.769 -10.168 -1.242 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.444 -12.497 -0.150 1.00 0.00 H new ATOM 0 HG22 ILE A 67 5.958 -12.955 -1.791 1.00 0.00 H new ATOM 0 HG23 ILE A 67 6.333 -11.333 -1.161 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.118 -10.093 1.178 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.815 -11.763 0.643 1.00 0.00 H new ATOM 0 HD13 ILE A 67 4.471 -11.240 1.032 1.00 0.00 H new ATOM 982 N LEU A 68 4.560 -13.268 -4.247 1.00 0.00 N ATOM 983 CA LEU A 68 5.165 -14.351 -5.014 1.00 0.00 C ATOM 984 C LEU A 68 5.929 -13.806 -6.217 1.00 0.00 C ATOM 985 O LEU A 68 7.083 -14.169 -6.448 1.00 0.00 O ATOM 986 CB LEU A 68 4.091 -15.335 -5.481 1.00 0.00 C ATOM 987 CG LEU A 68 3.116 -15.822 -4.409 1.00 0.00 C ATOM 988 CD1 LEU A 68 2.117 -16.804 -5.002 1.00 0.00 C ATOM 989 CD2 LEU A 68 3.871 -16.460 -3.252 1.00 0.00 C ATOM 0 H LEU A 68 3.600 -13.446 -3.951 1.00 0.00 H new ATOM 0 HA LEU A 68 5.869 -14.872 -4.365 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.517 -14.864 -6.279 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.586 -16.204 -5.915 1.00 0.00 H new ATOM 0 HG LEU A 68 2.566 -14.962 -4.028 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.431 -17.140 -4.224 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.553 -16.315 -5.796 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.650 -17.662 -5.411 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.161 -16.801 -2.498 1.00 0.00 H new ATOM 0 HD22 LEU A 68 4.447 -17.310 -3.618 1.00 0.00 H new ATOM 0 HD23 LEU A 68 4.546 -15.727 -2.810 1.00 0.00 H new ATOM 1001 N SER A 69 5.279 -12.933 -6.978 1.00 0.00 N ATOM 1002 CA SER A 69 5.896 -12.338 -8.158 1.00 0.00 C ATOM 1003 C SER A 69 7.263 -11.752 -7.819 1.00 0.00 C ATOM 1004 O SER A 69 8.193 -11.812 -8.623 1.00 0.00 O ATOM 1005 CB SER A 69 4.992 -11.250 -8.739 1.00 0.00 C ATOM 1006 OG SER A 69 4.048 -11.799 -9.643 1.00 0.00 O ATOM 0 H SER A 69 4.324 -12.621 -6.799 1.00 0.00 H new ATOM 0 HA SER A 69 6.031 -13.123 -8.902 1.00 0.00 H new ATOM 0 HB2 SER A 69 4.470 -10.737 -7.931 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.599 -10.504 -9.251 1.00 0.00 H new ATOM 0 HG SER A 69 3.481 -11.083 -9.999 1.00 0.00 H new ATOM 1012 N ASN A 70 7.377 -11.186 -6.622 1.00 0.00 N ATOM 1013 CA ASN A 70 8.630 -10.588 -6.176 1.00 0.00 C ATOM 1014 C ASN A 70 9.076 -9.484 -7.130 1.00 0.00 C ATOM 1015 O ASN A 70 10.215 -9.475 -7.598 1.00 0.00 O ATOM 1016 CB ASN A 70 9.719 -11.656 -6.069 1.00 0.00 C ATOM 1017 CG ASN A 70 10.749 -11.328 -5.005 1.00 0.00 C ATOM 1018 OD1 ASN A 70 10.524 -10.470 -4.152 1.00 0.00 O ATOM 1019 ND2 ASN A 70 11.887 -12.011 -5.053 1.00 0.00 N ATOM 0 H ASN A 70 6.617 -11.129 -5.944 1.00 0.00 H new ATOM 0 HA ASN A 70 8.464 -10.148 -5.193 1.00 0.00 H new ATOM 0 HB2 ASN A 70 9.259 -12.618 -5.841 1.00 0.00 H new ATOM 0 HB3 ASN A 70 10.217 -11.761 -7.033 1.00 0.00 H new ATOM 0 HD21 ASN A 70 12.618 -11.833 -4.364 1.00 0.00 H new ATOM 0 HD22 ASN A 70 12.030 -12.714 -5.779 1.00 0.00 H new ATOM 1026 N LYS A 71 8.171 -8.553 -7.413 1.00 0.00 N ATOM 1027 CA LYS A 71 8.470 -7.442 -8.309 1.00 0.00 C ATOM 1028 C LYS A 71 8.202 -6.105 -7.627 1.00 0.00 C ATOM 1029 O LYS A 71 8.935 -5.136 -7.827 1.00 0.00 O ATOM 1030 CB LYS A 71 7.635 -7.552 -9.587 1.00 0.00 C ATOM 1031 CG LYS A 71 8.082 -8.670 -10.512 1.00 0.00 C ATOM 1032 CD LYS A 71 9.422 -8.358 -11.157 1.00 0.00 C ATOM 1033 CE LYS A 71 9.898 -9.504 -12.037 1.00 0.00 C ATOM 1034 NZ LYS A 71 10.686 -10.505 -11.265 1.00 0.00 N ATOM 0 H LYS A 71 7.224 -8.546 -7.035 1.00 0.00 H new ATOM 0 HA LYS A 71 9.528 -7.491 -8.568 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.591 -7.711 -9.316 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.684 -6.605 -10.125 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.156 -9.601 -9.950 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.331 -8.824 -11.287 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.337 -7.450 -11.755 1.00 0.00 H new ATOM 0 HD3 LYS A 71 10.163 -8.161 -10.382 1.00 0.00 H new ATOM 0 HE2 LYS A 71 9.038 -9.993 -12.494 1.00 0.00 H new ATOM 0 HE3 LYS A 71 10.508 -9.109 -12.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 10.992 -11.270 -11.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 11.521 -10.044 -10.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 10.096 -10.901 -10.506 1.00 0.00 H new ATOM 1048 N HIS A 72 7.148 -6.059 -6.818 1.00 0.00 N ATOM 1049 CA HIS A 72 6.784 -4.841 -6.104 1.00 0.00 C ATOM 1050 C HIS A 72 7.048 -4.988 -4.609 1.00 0.00 C ATOM 1051 O HIS A 72 7.462 -6.050 -4.143 1.00 0.00 O ATOM 1052 CB HIS A 72 5.312 -4.504 -6.343 1.00 0.00 C ATOM 1053 CG HIS A 72 5.078 -3.676 -7.569 1.00 0.00 C ATOM 1054 ND1 HIS A 72 5.734 -3.895 -8.762 1.00 0.00 N ATOM 1055 CD2 HIS A 72 4.254 -2.624 -7.783 1.00 0.00 C ATOM 1056 CE1 HIS A 72 5.324 -3.013 -9.656 1.00 0.00 C ATOM 1057 NE2 HIS A 72 4.425 -2.231 -9.087 1.00 0.00 N ATOM 0 H HIS A 72 6.531 -6.852 -6.641 1.00 0.00 H new ATOM 0 HA HIS A 72 7.401 -4.028 -6.486 1.00 0.00 H new ATOM 0 HB2 HIS A 72 4.745 -5.431 -6.427 1.00 0.00 H new ATOM 0 HB3 HIS A 72 4.924 -3.971 -5.475 1.00 0.00 H new ATOM 0 HD1 HIS A 72 6.428 -4.624 -8.928 1.00 0.00 H new ATOM 0 HD2 HIS A 72 3.586 -2.177 -7.062 1.00 0.00 H new ATOM 0 HE1 HIS A 72 5.666 -2.943 -10.678 1.00 0.00 H new ATOM 1065 N ASP A 73 6.806 -3.917 -3.862 1.00 0.00 N ATOM 1066 CA ASP A 73 7.017 -3.927 -2.419 1.00 0.00 C ATOM 1067 C ASP A 73 5.692 -3.798 -1.675 1.00 0.00 C ATOM 1068 O ASP A 73 4.791 -3.080 -2.109 1.00 0.00 O ATOM 1069 CB ASP A 73 7.958 -2.791 -2.012 1.00 0.00 C ATOM 1070 CG ASP A 73 7.516 -1.449 -2.561 1.00 0.00 C ATOM 1071 OD1 ASP A 73 6.632 -0.818 -1.946 1.00 0.00 O ATOM 1072 OD2 ASP A 73 8.055 -1.030 -3.608 1.00 0.00 O ATOM 0 H ASP A 73 6.463 -3.030 -4.232 1.00 0.00 H new ATOM 0 HA ASP A 73 7.473 -4.880 -2.150 1.00 0.00 H new ATOM 0 HB2 ASP A 73 8.008 -2.737 -0.925 1.00 0.00 H new ATOM 0 HB3 ASP A 73 8.965 -3.012 -2.367 1.00 0.00 H new ATOM 1077 N VAL A 74 5.579 -4.500 -0.551 1.00 0.00 N ATOM 1078 CA VAL A 74 4.364 -4.464 0.253 1.00 0.00 C ATOM 1079 C VAL A 74 4.505 -3.492 1.419 1.00 0.00 C ATOM 1080 O VAL A 74 5.322 -3.697 2.317 1.00 0.00 O ATOM 1081 CB VAL A 74 4.014 -5.860 0.803 1.00 0.00 C ATOM 1082 CG1 VAL A 74 2.809 -5.783 1.728 1.00 0.00 C ATOM 1083 CG2 VAL A 74 3.759 -6.833 -0.338 1.00 0.00 C ATOM 0 H VAL A 74 6.314 -5.100 -0.177 1.00 0.00 H new ATOM 0 HA VAL A 74 3.561 -4.127 -0.402 1.00 0.00 H new ATOM 0 HB VAL A 74 4.862 -6.227 1.381 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.577 -6.778 2.107 1.00 0.00 H new ATOM 0 HG12 VAL A 74 3.034 -5.120 2.564 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.952 -5.395 1.177 1.00 0.00 H new ATOM 0 HG21 VAL A 74 3.513 -7.814 0.068 1.00 0.00 H new ATOM 0 HG22 VAL A 74 2.928 -6.473 -0.944 1.00 0.00 H new ATOM 0 HG23 VAL A 74 4.653 -6.910 -0.957 1.00 0.00 H new ATOM 1093 N VAL A 75 3.703 -2.432 1.399 1.00 0.00 N ATOM 1094 CA VAL A 75 3.737 -1.428 2.455 1.00 0.00 C ATOM 1095 C VAL A 75 2.421 -1.394 3.224 1.00 0.00 C ATOM 1096 O VAL A 75 1.359 -1.686 2.673 1.00 0.00 O ATOM 1097 CB VAL A 75 4.023 -0.025 1.887 1.00 0.00 C ATOM 1098 CG1 VAL A 75 4.517 0.906 2.984 1.00 0.00 C ATOM 1099 CG2 VAL A 75 5.032 -0.106 0.751 1.00 0.00 C ATOM 0 H VAL A 75 3.022 -2.247 0.663 1.00 0.00 H new ATOM 0 HA VAL A 75 4.543 -1.709 3.132 1.00 0.00 H new ATOM 0 HB VAL A 75 3.094 0.383 1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.714 1.892 2.563 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.757 0.988 3.761 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.435 0.506 3.415 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.222 0.894 0.361 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.963 -0.535 1.121 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.634 -0.736 -0.045 1.00 0.00 H new ATOM 1109 N LYS A 76 2.497 -1.035 4.501 1.00 0.00 N ATOM 1110 CA LYS A 76 1.312 -0.961 5.347 1.00 0.00 C ATOM 1111 C LYS A 76 0.511 0.303 5.052 1.00 0.00 C ATOM 1112 O LYS A 76 1.053 1.329 4.641 1.00 0.00 O ATOM 1113 CB LYS A 76 1.712 -0.990 6.824 1.00 0.00 C ATOM 1114 CG LYS A 76 1.874 -2.394 7.383 1.00 0.00 C ATOM 1115 CD LYS A 76 2.851 -2.421 8.546 1.00 0.00 C ATOM 1116 CE LYS A 76 3.196 -3.846 8.951 1.00 0.00 C ATOM 1117 NZ LYS A 76 2.252 -4.377 9.972 1.00 0.00 N ATOM 0 H LYS A 76 3.368 -0.791 4.973 1.00 0.00 H new ATOM 0 HA LYS A 76 0.686 -1.826 5.129 1.00 0.00 H new ATOM 0 HB2 LYS A 76 2.649 -0.448 6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.958 -0.461 7.407 1.00 0.00 H new ATOM 0 HG2 LYS A 76 0.905 -2.770 7.712 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.225 -3.062 6.596 1.00 0.00 H new ATOM 0 HD2 LYS A 76 3.762 -1.889 8.270 1.00 0.00 H new ATOM 0 HD3 LYS A 76 2.420 -1.894 9.397 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.177 -4.488 8.071 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.212 -3.875 9.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.521 -5.350 10.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 2.288 -3.779 10.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 1.286 -4.373 9.587 1.00 0.00 H new ATOM 1131 N PRO A 77 -0.811 0.230 5.266 1.00 0.00 N ATOM 1132 CA PRO A 77 -1.715 1.360 5.030 1.00 0.00 C ATOM 1133 C PRO A 77 -1.514 2.483 6.042 1.00 0.00 C ATOM 1134 O PRO A 77 -2.152 3.531 5.955 1.00 0.00 O ATOM 1135 CB PRO A 77 -3.106 0.741 5.188 1.00 0.00 C ATOM 1136 CG PRO A 77 -2.898 -0.437 6.076 1.00 0.00 C ATOM 1137 CD PRO A 77 -1.526 -0.962 5.754 1.00 0.00 C ATOM 0 HA PRO A 77 -1.547 1.820 4.056 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -3.807 1.450 5.629 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -3.518 0.442 4.224 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.970 -0.152 7.126 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -3.658 -1.198 5.899 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -1.043 -1.389 6.633 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.563 -1.746 4.998 1.00 0.00 H new ATOM 1145 N ALA A 78 -0.623 2.256 7.002 1.00 0.00 N ATOM 1146 CA ALA A 78 -0.336 3.250 8.029 1.00 0.00 C ATOM 1147 C ALA A 78 0.605 4.328 7.502 1.00 0.00 C ATOM 1148 O ALA A 78 0.365 5.521 7.689 1.00 0.00 O ATOM 1149 CB ALA A 78 0.259 2.582 9.259 1.00 0.00 C ATOM 0 H ALA A 78 -0.088 1.392 7.090 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.274 3.729 8.308 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.468 3.336 10.017 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -0.449 1.855 9.656 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.185 2.076 8.986 1.00 0.00 H new ATOM 1155 N TRP A 79 1.677 3.900 6.845 1.00 0.00 N ATOM 1156 CA TRP A 79 2.655 4.830 6.292 1.00 0.00 C ATOM 1157 C TRP A 79 1.967 5.950 5.520 1.00 0.00 C ATOM 1158 O TRP A 79 2.400 7.103 5.560 1.00 0.00 O ATOM 1159 CB TRP A 79 3.633 4.090 5.377 1.00 0.00 C ATOM 1160 CG TRP A 79 4.253 4.970 4.335 1.00 0.00 C ATOM 1161 CD1 TRP A 79 5.170 5.961 4.540 1.00 0.00 C ATOM 1162 CD2 TRP A 79 4.001 4.939 2.926 1.00 0.00 C ATOM 1163 NE1 TRP A 79 5.503 6.548 3.343 1.00 0.00 N ATOM 1164 CE2 TRP A 79 4.800 5.938 2.337 1.00 0.00 C ATOM 1165 CE3 TRP A 79 3.180 4.162 2.104 1.00 0.00 C ATOM 1166 CZ2 TRP A 79 4.799 6.181 0.966 1.00 0.00 C ATOM 1167 CZ3 TRP A 79 3.179 4.404 0.743 1.00 0.00 C ATOM 1168 CH2 TRP A 79 3.985 5.406 0.185 1.00 0.00 C ATOM 0 H TRP A 79 1.891 2.916 6.682 1.00 0.00 H new ATOM 0 HA TRP A 79 3.207 5.272 7.121 1.00 0.00 H new ATOM 0 HB2 TRP A 79 4.422 3.646 5.984 1.00 0.00 H new ATOM 0 HB3 TRP A 79 3.110 3.270 4.885 1.00 0.00 H new ATOM 0 HD1 TRP A 79 5.574 6.242 5.501 1.00 0.00 H new ATOM 0 HE1 TRP A 79 6.166 7.314 3.223 1.00 0.00 H new ATOM 0 HE3 TRP A 79 2.557 3.386 2.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 5.418 6.953 0.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 2.547 3.811 0.099 1.00 0.00 H new ATOM 0 HH2 TRP A 79 3.963 5.570 -0.882 1.00 0.00 H new ATOM 1179 N LEU A 80 0.892 5.606 4.818 1.00 0.00 N ATOM 1180 CA LEU A 80 0.143 6.583 4.037 1.00 0.00 C ATOM 1181 C LEU A 80 -0.374 7.710 4.926 1.00 0.00 C ATOM 1182 O LEU A 80 -0.325 8.883 4.552 1.00 0.00 O ATOM 1183 CB LEU A 80 -1.027 5.905 3.322 1.00 0.00 C ATOM 1184 CG LEU A 80 -0.673 5.103 2.069 1.00 0.00 C ATOM 1185 CD1 LEU A 80 -1.780 4.114 1.738 1.00 0.00 C ATOM 1186 CD2 LEU A 80 -0.418 6.034 0.893 1.00 0.00 C ATOM 0 H LEU A 80 0.520 4.657 4.774 1.00 0.00 H new ATOM 0 HA LEU A 80 0.816 7.011 3.294 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -1.521 5.238 4.028 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.752 6.671 3.046 1.00 0.00 H new ATOM 0 HG LEU A 80 0.241 4.542 2.267 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.511 3.552 0.844 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.914 3.425 2.572 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.710 4.655 1.561 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.168 5.445 0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.313 6.623 0.694 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.410 6.702 1.131 1.00 0.00 H new ATOM 1198 N LEU A 81 -0.868 7.347 6.105 1.00 0.00 N ATOM 1199 CA LEU A 81 -1.392 8.328 7.049 1.00 0.00 C ATOM 1200 C LEU A 81 -0.385 9.448 7.287 1.00 0.00 C ATOM 1201 O LEU A 81 -0.707 10.626 7.141 1.00 0.00 O ATOM 1202 CB LEU A 81 -1.742 7.651 8.376 1.00 0.00 C ATOM 1203 CG LEU A 81 -2.999 6.780 8.374 1.00 0.00 C ATOM 1204 CD1 LEU A 81 -3.163 6.077 9.713 1.00 0.00 C ATOM 1205 CD2 LEU A 81 -4.228 7.620 8.057 1.00 0.00 C ATOM 0 H LEU A 81 -0.917 6.381 6.430 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.295 8.762 6.620 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.897 7.033 8.680 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.861 8.424 9.135 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.892 6.021 7.599 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.063 5.462 9.693 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.295 5.445 9.901 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.249 6.820 10.506 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.114 6.985 8.060 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.339 8.401 8.810 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.113 8.077 7.074 1.00 0.00 H new ATOM 1217 N GLU A 82 0.837 9.071 7.651 1.00 0.00 N ATOM 1218 CA GLU A 82 1.892 10.045 7.907 1.00 0.00 C ATOM 1219 C GLU A 82 1.889 11.141 6.845 1.00 0.00 C ATOM 1220 O GLU A 82 2.245 12.288 7.121 1.00 0.00 O ATOM 1221 CB GLU A 82 3.257 9.354 7.939 1.00 0.00 C ATOM 1222 CG GLU A 82 3.594 8.734 9.284 1.00 0.00 C ATOM 1223 CD GLU A 82 3.416 9.705 10.435 1.00 0.00 C ATOM 1224 OE1 GLU A 82 4.077 10.764 10.427 1.00 0.00 O ATOM 1225 OE2 GLU A 82 2.614 9.405 11.344 1.00 0.00 O ATOM 0 H GLU A 82 1.121 8.099 7.775 1.00 0.00 H new ATOM 0 HA GLU A 82 1.702 10.503 8.878 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.280 8.577 7.175 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.028 10.079 7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.960 7.863 9.447 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.625 8.380 9.269 1.00 0.00 H new ATOM 1232 N CYS A 83 1.486 10.781 5.632 1.00 0.00 N ATOM 1233 CA CYS A 83 1.438 11.733 4.528 1.00 0.00 C ATOM 1234 C CYS A 83 0.147 12.544 4.566 1.00 0.00 C ATOM 1235 O CYS A 83 0.131 13.722 4.207 1.00 0.00 O ATOM 1236 CB CYS A 83 1.556 11.001 3.190 1.00 0.00 C ATOM 1237 SG CYS A 83 2.638 9.553 3.234 1.00 0.00 S ATOM 0 H CYS A 83 1.188 9.837 5.388 1.00 0.00 H new ATOM 0 HA CYS A 83 2.279 12.418 4.634 1.00 0.00 H new ATOM 0 HB2 CYS A 83 0.562 10.689 2.870 1.00 0.00 H new ATOM 0 HB3 CYS A 83 1.929 11.697 2.439 1.00 0.00 H new ATOM 0 HG CYS A 83 2.242 8.743 4.171 1.00 0.00 H new ATOM 1243 N PHE A 84 -0.934 11.906 5.002 1.00 0.00 N ATOM 1244 CA PHE A 84 -2.231 12.568 5.084 1.00 0.00 C ATOM 1245 C PHE A 84 -2.255 13.577 6.228 1.00 0.00 C ATOM 1246 O PHE A 84 -3.054 14.514 6.229 1.00 0.00 O ATOM 1247 CB PHE A 84 -3.343 11.535 5.277 1.00 0.00 C ATOM 1248 CG PHE A 84 -3.348 10.458 4.230 1.00 0.00 C ATOM 1249 CD1 PHE A 84 -2.994 10.743 2.921 1.00 0.00 C ATOM 1250 CD2 PHE A 84 -3.707 9.159 4.555 1.00 0.00 C ATOM 1251 CE1 PHE A 84 -2.999 9.754 1.956 1.00 0.00 C ATOM 1252 CE2 PHE A 84 -3.713 8.166 3.594 1.00 0.00 C ATOM 1253 CZ PHE A 84 -3.358 8.463 2.293 1.00 0.00 C ATOM 0 H PHE A 84 -0.938 10.932 5.304 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.398 13.102 4.148 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.235 11.075 6.259 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.307 12.044 5.268 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -2.711 11.750 2.652 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.985 8.920 5.571 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -2.722 9.990 0.939 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.995 7.158 3.860 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.361 7.688 1.541 1.00 0.00 H new ATOM 1263 N LYS A 85 -1.374 13.379 7.203 1.00 0.00 N ATOM 1264 CA LYS A 85 -1.292 14.270 8.354 1.00 0.00 C ATOM 1265 C LYS A 85 -0.236 15.349 8.133 1.00 0.00 C ATOM 1266 O LYS A 85 -0.388 16.484 8.585 1.00 0.00 O ATOM 1267 CB LYS A 85 -0.965 13.474 9.619 1.00 0.00 C ATOM 1268 CG LYS A 85 -0.553 14.342 10.795 1.00 0.00 C ATOM 1269 CD LYS A 85 -0.791 13.637 12.120 1.00 0.00 C ATOM 1270 CE LYS A 85 -0.206 14.423 13.283 1.00 0.00 C ATOM 1271 NZ LYS A 85 -1.166 15.434 13.807 1.00 0.00 N ATOM 0 H LYS A 85 -0.706 12.608 7.219 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.261 14.754 8.477 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.836 12.884 9.902 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.162 12.771 9.398 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.502 14.602 10.705 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -1.114 15.276 10.773 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -1.861 13.501 12.274 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -0.344 12.643 12.090 1.00 0.00 H new ATOM 0 HE2 LYS A 85 0.071 13.736 14.083 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.708 14.922 12.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -0.730 15.949 14.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -1.411 16.105 13.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -2.028 14.955 14.138 1.00 0.00 H new ATOM 1285 N THR A 86 0.835 14.988 7.432 1.00 0.00 N ATOM 1286 CA THR A 86 1.915 15.924 7.150 1.00 0.00 C ATOM 1287 C THR A 86 1.832 16.445 5.720 1.00 0.00 C ATOM 1288 O THR A 86 2.663 17.246 5.291 1.00 0.00 O ATOM 1289 CB THR A 86 3.294 15.274 7.369 1.00 0.00 C ATOM 1290 OG1 THR A 86 3.630 14.450 6.247 1.00 0.00 O ATOM 1291 CG2 THR A 86 3.302 14.437 8.640 1.00 0.00 C ATOM 0 H THR A 86 0.977 14.053 7.049 1.00 0.00 H new ATOM 0 HA THR A 86 1.800 16.757 7.844 1.00 0.00 H new ATOM 0 HB THR A 86 4.034 16.068 7.471 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.229 13.563 6.361 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.286 13.988 8.774 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.074 15.073 9.496 1.00 0.00 H new ATOM 0 HG23 THR A 86 2.552 13.650 8.562 1.00 0.00 H new ATOM 1299 N LYS A 87 0.825 15.985 4.985 1.00 0.00 N ATOM 1300 CA LYS A 87 0.632 16.405 3.603 1.00 0.00 C ATOM 1301 C LYS A 87 1.968 16.509 2.874 1.00 0.00 C ATOM 1302 O LYS A 87 2.197 17.445 2.108 1.00 0.00 O ATOM 1303 CB LYS A 87 -0.094 17.752 3.554 1.00 0.00 C ATOM 1304 CG LYS A 87 -1.504 17.704 4.116 1.00 0.00 C ATOM 1305 CD LYS A 87 -1.509 17.884 5.625 1.00 0.00 C ATOM 1306 CE LYS A 87 -2.925 17.966 6.172 1.00 0.00 C ATOM 1307 NZ LYS A 87 -3.445 19.361 6.159 1.00 0.00 N ATOM 0 H LYS A 87 0.130 15.321 5.324 1.00 0.00 H new ATOM 0 HA LYS A 87 0.023 15.652 3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.485 18.488 4.111 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -0.135 18.095 2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -2.108 18.485 3.653 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -1.966 16.750 3.861 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -0.985 17.051 6.093 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -0.964 18.791 5.886 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -3.581 17.329 5.579 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -2.943 17.581 7.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.413 19.374 6.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -2.834 19.965 6.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -3.452 19.720 5.183 1.00 0.00 H new ATOM 1321 N SER A 88 2.846 15.541 3.116 1.00 0.00 N ATOM 1322 CA SER A 88 4.160 15.525 2.484 1.00 0.00 C ATOM 1323 C SER A 88 4.587 14.098 2.155 1.00 0.00 C ATOM 1324 O SER A 88 4.129 13.141 2.780 1.00 0.00 O ATOM 1325 CB SER A 88 5.196 16.182 3.398 1.00 0.00 C ATOM 1326 OG SER A 88 4.922 17.561 3.572 1.00 0.00 O ATOM 0 H SER A 88 2.671 14.757 3.745 1.00 0.00 H new ATOM 0 HA SER A 88 4.096 16.090 1.554 1.00 0.00 H new ATOM 0 HB2 SER A 88 5.198 15.684 4.367 1.00 0.00 H new ATOM 0 HB3 SER A 88 6.192 16.057 2.973 1.00 0.00 H new ATOM 0 HG SER A 88 4.143 17.669 4.157 1.00 0.00 H new ATOM 1332 N PHE A 89 5.467 13.963 1.169 1.00 0.00 N ATOM 1333 CA PHE A 89 5.957 12.654 0.754 1.00 0.00 C ATOM 1334 C PHE A 89 6.881 12.058 1.813 1.00 0.00 C ATOM 1335 O PHE A 89 8.038 12.458 1.939 1.00 0.00 O ATOM 1336 CB PHE A 89 6.695 12.761 -0.582 1.00 0.00 C ATOM 1337 CG PHE A 89 6.619 11.511 -1.411 1.00 0.00 C ATOM 1338 CD1 PHE A 89 7.457 10.438 -1.149 1.00 0.00 C ATOM 1339 CD2 PHE A 89 5.711 11.408 -2.452 1.00 0.00 C ATOM 1340 CE1 PHE A 89 7.389 9.286 -1.910 1.00 0.00 C ATOM 1341 CE2 PHE A 89 5.638 10.259 -3.215 1.00 0.00 C ATOM 1342 CZ PHE A 89 6.479 9.197 -2.945 1.00 0.00 C ATOM 0 H PHE A 89 5.856 14.745 0.642 1.00 0.00 H new ATOM 0 HA PHE A 89 5.098 11.994 0.634 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.279 13.591 -1.152 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.742 12.998 -0.392 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.171 10.503 -0.341 1.00 0.00 H new ATOM 0 HD2 PHE A 89 5.052 12.236 -2.670 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.047 8.457 -1.695 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.924 10.191 -4.022 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.425 8.299 -3.542 1.00 0.00 H new ATOM 1352 N VAL A 90 6.360 11.100 2.572 1.00 0.00 N ATOM 1353 CA VAL A 90 7.137 10.448 3.620 1.00 0.00 C ATOM 1354 C VAL A 90 7.870 9.225 3.081 1.00 0.00 C ATOM 1355 O VAL A 90 7.315 8.415 2.338 1.00 0.00 O ATOM 1356 CB VAL A 90 6.242 10.018 4.798 1.00 0.00 C ATOM 1357 CG1 VAL A 90 7.085 9.460 5.934 1.00 0.00 C ATOM 1358 CG2 VAL A 90 5.394 11.187 5.276 1.00 0.00 C ATOM 0 H VAL A 90 5.403 10.758 2.481 1.00 0.00 H new ATOM 0 HA VAL A 90 7.865 11.178 3.974 1.00 0.00 H new ATOM 0 HB VAL A 90 5.573 9.229 4.454 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.435 9.162 6.757 1.00 0.00 H new ATOM 0 HG12 VAL A 90 7.644 8.594 5.581 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.781 10.224 6.280 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.768 10.866 6.108 1.00 0.00 H new ATOM 0 HG22 VAL A 90 6.044 11.998 5.603 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.762 11.536 4.460 1.00 0.00 H new ATOM 1368 N PRO A 91 9.148 9.085 3.462 1.00 0.00 N ATOM 1369 CA PRO A 91 9.985 7.962 3.029 1.00 0.00 C ATOM 1370 C PRO A 91 9.551 6.641 3.655 1.00 0.00 C ATOM 1371 O PRO A 91 8.831 6.623 4.653 1.00 0.00 O ATOM 1372 CB PRO A 91 11.382 8.352 3.519 1.00 0.00 C ATOM 1373 CG PRO A 91 11.139 9.266 4.670 1.00 0.00 C ATOM 1374 CD PRO A 91 9.874 10.012 4.347 1.00 0.00 C ATOM 0 HA PRO A 91 9.925 7.800 1.953 1.00 0.00 H new ATOM 0 HB2 PRO A 91 11.954 7.475 3.824 1.00 0.00 H new ATOM 0 HB3 PRO A 91 11.953 8.848 2.734 1.00 0.00 H new ATOM 0 HG2 PRO A 91 11.035 8.705 5.599 1.00 0.00 H new ATOM 0 HG3 PRO A 91 11.974 9.954 4.805 1.00 0.00 H new ATOM 0 HD2 PRO A 91 9.302 10.241 5.246 1.00 0.00 H new ATOM 0 HD3 PRO A 91 10.082 10.960 3.852 1.00 0.00 H new ATOM 1382 N TRP A 92 9.995 5.538 3.062 1.00 0.00 N ATOM 1383 CA TRP A 92 9.652 4.212 3.562 1.00 0.00 C ATOM 1384 C TRP A 92 10.386 3.915 4.865 1.00 0.00 C ATOM 1385 O TRP A 92 11.531 4.325 5.049 1.00 0.00 O ATOM 1386 CB TRP A 92 9.991 3.147 2.518 1.00 0.00 C ATOM 1387 CG TRP A 92 8.871 2.877 1.559 1.00 0.00 C ATOM 1388 CD1 TRP A 92 7.533 2.980 1.812 1.00 0.00 C ATOM 1389 CD2 TRP A 92 8.992 2.459 0.195 1.00 0.00 C ATOM 1390 NE1 TRP A 92 6.815 2.650 0.688 1.00 0.00 N ATOM 1391 CE2 TRP A 92 7.687 2.328 -0.318 1.00 0.00 C ATOM 1392 CE3 TRP A 92 10.076 2.184 -0.643 1.00 0.00 C ATOM 1393 CZ2 TRP A 92 7.440 1.933 -1.630 1.00 0.00 C ATOM 1394 CZ3 TRP A 92 9.829 1.792 -1.945 1.00 0.00 C ATOM 1395 CH2 TRP A 92 8.519 1.670 -2.428 1.00 0.00 C ATOM 0 H TRP A 92 10.593 5.536 2.235 1.00 0.00 H new ATOM 0 HA TRP A 92 8.580 4.191 3.757 1.00 0.00 H new ATOM 0 HB2 TRP A 92 10.871 3.465 1.958 1.00 0.00 H new ATOM 0 HB3 TRP A 92 10.255 2.220 3.027 1.00 0.00 H new ATOM 0 HD1 TRP A 92 7.102 3.277 2.757 1.00 0.00 H new ATOM 0 HE1 TRP A 92 5.798 2.646 0.615 1.00 0.00 H new ATOM 0 HE3 TRP A 92 11.089 2.276 -0.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 6.431 1.838 -2.004 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 10.659 1.576 -2.601 1.00 0.00 H new ATOM 0 HH2 TRP A 92 8.358 1.362 -3.451 1.00 0.00 H new ATOM 1406 N GLN A 93 9.718 3.200 5.766 1.00 0.00 N ATOM 1407 CA GLN A 93 10.309 2.850 7.052 1.00 0.00 C ATOM 1408 C GLN A 93 10.252 1.344 7.285 1.00 0.00 C ATOM 1409 O GLN A 93 9.434 0.631 6.703 1.00 0.00 O ATOM 1410 CB GLN A 93 9.586 3.580 8.185 1.00 0.00 C ATOM 1411 CG GLN A 93 10.013 5.030 8.345 1.00 0.00 C ATOM 1412 CD GLN A 93 9.273 5.738 9.462 1.00 0.00 C ATOM 1413 OE1 GLN A 93 9.045 5.168 10.530 1.00 0.00 O ATOM 1414 NE2 GLN A 93 8.893 6.987 9.223 1.00 0.00 N ATOM 0 H GLN A 93 8.769 2.853 5.629 1.00 0.00 H new ATOM 0 HA GLN A 93 11.354 3.159 7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.512 3.544 8.002 1.00 0.00 H new ATOM 0 HB3 GLN A 93 9.767 3.051 9.121 1.00 0.00 H new ATOM 0 HG2 GLN A 93 11.084 5.069 8.542 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.842 5.560 7.408 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.103 7.421 8.324 1.00 0.00 H new ATOM 0 HE22 GLN A 93 8.391 7.513 9.938 1.00 0.00 H new ATOM 1423 N PRO A 94 11.142 0.845 8.156 1.00 0.00 N ATOM 1424 CA PRO A 94 11.213 -0.581 8.486 1.00 0.00 C ATOM 1425 C PRO A 94 10.010 -1.050 9.297 1.00 0.00 C ATOM 1426 O PRO A 94 9.831 -2.246 9.525 1.00 0.00 O ATOM 1427 CB PRO A 94 12.493 -0.689 9.318 1.00 0.00 C ATOM 1428 CG PRO A 94 12.679 0.667 9.906 1.00 0.00 C ATOM 1429 CD PRO A 94 12.146 1.636 8.887 1.00 0.00 C ATOM 0 HA PRO A 94 11.214 -1.206 7.593 1.00 0.00 H new ATOM 0 HB2 PRO A 94 12.397 -1.447 10.095 1.00 0.00 H new ATOM 0 HB3 PRO A 94 13.344 -0.972 8.699 1.00 0.00 H new ATOM 0 HG2 PRO A 94 12.143 0.760 10.851 1.00 0.00 H new ATOM 0 HG3 PRO A 94 13.731 0.861 10.116 1.00 0.00 H new ATOM 0 HD2 PRO A 94 11.701 2.512 9.360 1.00 0.00 H new ATOM 0 HD3 PRO A 94 12.933 1.996 8.225 1.00 0.00 H new ATOM 1437 N ARG A 95 9.187 -0.100 9.729 1.00 0.00 N ATOM 1438 CA ARG A 95 8.000 -0.416 10.515 1.00 0.00 C ATOM 1439 C ARG A 95 6.754 -0.431 9.635 1.00 0.00 C ATOM 1440 O ARG A 95 5.734 -1.019 9.995 1.00 0.00 O ATOM 1441 CB ARG A 95 7.827 0.599 11.646 1.00 0.00 C ATOM 1442 CG ARG A 95 7.638 2.027 11.160 1.00 0.00 C ATOM 1443 CD ARG A 95 7.421 2.986 12.320 1.00 0.00 C ATOM 1444 NE ARG A 95 6.189 2.695 13.048 1.00 0.00 N ATOM 1445 CZ ARG A 95 6.106 1.796 14.022 1.00 0.00 C ATOM 1446 NH1 ARG A 95 7.177 1.104 14.383 1.00 0.00 N ATOM 1447 NH2 ARG A 95 4.948 1.588 14.637 1.00 0.00 N ATOM 0 H ARG A 95 9.320 0.895 9.548 1.00 0.00 H new ATOM 0 HA ARG A 95 8.132 -1.409 10.944 1.00 0.00 H new ATOM 0 HB2 ARG A 95 6.966 0.313 12.251 1.00 0.00 H new ATOM 0 HB3 ARG A 95 8.701 0.558 12.296 1.00 0.00 H new ATOM 0 HG2 ARG A 95 8.513 2.337 10.589 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.784 2.073 10.484 1.00 0.00 H new ATOM 0 HD2 ARG A 95 8.268 2.926 13.003 1.00 0.00 H new ATOM 0 HD3 ARG A 95 7.387 4.008 11.944 1.00 0.00 H new ATOM 0 HE ARG A 95 5.346 3.210 12.795 1.00 0.00 H new ATOM 0 HH11 ARG A 95 8.068 1.261 13.912 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.110 0.414 15.131 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.122 2.119 14.361 1.00 0.00 H new ATOM 0 HH22 ARG A 95 4.885 0.897 15.385 1.00 0.00 H new ATOM 1461 N PHE A 96 6.843 0.220 8.480 1.00 0.00 N ATOM 1462 CA PHE A 96 5.722 0.283 7.549 1.00 0.00 C ATOM 1463 C PHE A 96 5.852 -0.787 6.469 1.00 0.00 C ATOM 1464 O PHE A 96 4.871 -1.429 6.095 1.00 0.00 O ATOM 1465 CB PHE A 96 5.644 1.668 6.904 1.00 0.00 C ATOM 1466 CG PHE A 96 5.556 2.789 7.900 1.00 0.00 C ATOM 1467 CD1 PHE A 96 4.863 2.625 9.088 1.00 0.00 C ATOM 1468 CD2 PHE A 96 6.167 4.007 7.648 1.00 0.00 C ATOM 1469 CE1 PHE A 96 4.781 3.654 10.007 1.00 0.00 C ATOM 1470 CE2 PHE A 96 6.089 5.039 8.563 1.00 0.00 C ATOM 1471 CZ PHE A 96 5.394 4.863 9.744 1.00 0.00 C ATOM 0 H PHE A 96 7.680 0.712 8.166 1.00 0.00 H new ATOM 0 HA PHE A 96 4.805 0.099 8.110 1.00 0.00 H new ATOM 0 HB2 PHE A 96 6.523 1.818 6.277 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.774 1.706 6.248 1.00 0.00 H new ATOM 0 HD1 PHE A 96 4.381 1.682 9.299 1.00 0.00 H new ATOM 0 HD2 PHE A 96 6.710 4.151 6.726 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.238 3.513 10.930 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.571 5.983 8.355 1.00 0.00 H new ATOM 0 HZ PHE A 96 5.330 5.669 10.460 1.00 0.00 H new ATOM 1481 N MET A 97 7.070 -0.972 5.971 1.00 0.00 N ATOM 1482 CA MET A 97 7.329 -1.964 4.933 1.00 0.00 C ATOM 1483 C MET A 97 7.243 -3.378 5.500 1.00 0.00 C ATOM 1484 O MET A 97 7.662 -3.630 6.630 1.00 0.00 O ATOM 1485 CB MET A 97 8.707 -1.735 4.311 1.00 0.00 C ATOM 1486 CG MET A 97 8.938 -0.302 3.857 1.00 0.00 C ATOM 1487 SD MET A 97 8.053 0.096 2.337 1.00 0.00 S ATOM 1488 CE MET A 97 8.903 -0.957 1.164 1.00 0.00 C ATOM 0 H MET A 97 7.893 -0.448 6.269 1.00 0.00 H new ATOM 0 HA MET A 97 6.567 -1.853 4.161 1.00 0.00 H new ATOM 0 HB2 MET A 97 9.474 -2.006 5.037 1.00 0.00 H new ATOM 0 HB3 MET A 97 8.827 -2.402 3.457 1.00 0.00 H new ATOM 0 HG2 MET A 97 8.622 0.380 4.646 1.00 0.00 H new ATOM 0 HG3 MET A 97 10.005 -0.141 3.704 1.00 0.00 H new ATOM 0 HE1 MET A 97 8.719 -0.597 0.152 1.00 0.00 H new ATOM 0 HE2 MET A 97 9.974 -0.938 1.367 1.00 0.00 H new ATOM 0 HE3 MET A 97 8.534 -1.978 1.258 1.00 0.00 H new ATOM 1498 N ILE A 98 6.697 -4.295 4.708 1.00 0.00 N ATOM 1499 CA ILE A 98 6.557 -5.683 5.132 1.00 0.00 C ATOM 1500 C ILE A 98 7.459 -6.600 4.314 1.00 0.00 C ATOM 1501 O ILE A 98 8.063 -7.531 4.847 1.00 0.00 O ATOM 1502 CB ILE A 98 5.100 -6.166 5.004 1.00 0.00 C ATOM 1503 CG1 ILE A 98 4.181 -5.325 5.892 1.00 0.00 C ATOM 1504 CG2 ILE A 98 4.997 -7.639 5.370 1.00 0.00 C ATOM 1505 CD1 ILE A 98 2.722 -5.408 5.502 1.00 0.00 C ATOM 0 H ILE A 98 6.345 -4.102 3.770 1.00 0.00 H new ATOM 0 HA ILE A 98 6.854 -5.725 6.180 1.00 0.00 H new ATOM 0 HB ILE A 98 4.782 -6.046 3.968 1.00 0.00 H new ATOM 0 HG12 ILE A 98 4.291 -5.651 6.926 1.00 0.00 H new ATOM 0 HG13 ILE A 98 4.501 -4.284 5.850 1.00 0.00 H new ATOM 0 HG21 ILE A 98 3.962 -7.966 5.275 1.00 0.00 H new ATOM 0 HG22 ILE A 98 5.626 -8.225 4.700 1.00 0.00 H new ATOM 0 HG23 ILE A 98 5.330 -7.783 6.398 1.00 0.00 H new ATOM 0 HD11 ILE A 98 2.130 -4.787 6.174 1.00 0.00 H new ATOM 0 HD12 ILE A 98 2.598 -5.055 4.478 1.00 0.00 H new ATOM 0 HD13 ILE A 98 2.385 -6.442 5.572 1.00 0.00 H new ATOM 1517 N HIS A 99 7.547 -6.331 3.015 1.00 0.00 N ATOM 1518 CA HIS A 99 8.378 -7.131 2.123 1.00 0.00 C ATOM 1519 C HIS A 99 8.932 -6.278 0.985 1.00 0.00 C ATOM 1520 O HIS A 99 8.192 -5.546 0.329 1.00 0.00 O ATOM 1521 CB HIS A 99 7.573 -8.300 1.554 1.00 0.00 C ATOM 1522 CG HIS A 99 8.393 -9.250 0.736 1.00 0.00 C ATOM 1523 ND1 HIS A 99 8.895 -10.433 1.236 1.00 0.00 N ATOM 1524 CD2 HIS A 99 8.797 -9.187 -0.554 1.00 0.00 C ATOM 1525 CE1 HIS A 99 9.574 -11.056 0.288 1.00 0.00 C ATOM 1526 NE2 HIS A 99 9.529 -10.320 -0.808 1.00 0.00 N ATOM 0 H HIS A 99 7.053 -5.565 2.557 1.00 0.00 H new ATOM 0 HA HIS A 99 9.215 -7.523 2.701 1.00 0.00 H new ATOM 0 HB2 HIS A 99 7.111 -8.847 2.376 1.00 0.00 H new ATOM 0 HB3 HIS A 99 6.764 -7.908 0.938 1.00 0.00 H new ATOM 0 HD2 HIS A 99 8.583 -8.393 -1.254 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.079 -12.005 0.392 1.00 0.00 H new ATOM 0 HE2 HIS A 99 9.967 -10.555 -1.699 1.00 0.00 H new ATOM 1534 N MET A 100 10.238 -6.377 0.760 1.00 0.00 N ATOM 1535 CA MET A 100 10.890 -5.615 -0.299 1.00 0.00 C ATOM 1536 C MET A 100 11.772 -6.518 -1.155 1.00 0.00 C ATOM 1537 O MET A 100 12.526 -7.340 -0.633 1.00 0.00 O ATOM 1538 CB MET A 100 11.728 -4.484 0.301 1.00 0.00 C ATOM 1539 CG MET A 100 10.950 -3.590 1.253 1.00 0.00 C ATOM 1540 SD MET A 100 10.934 -4.221 2.942 1.00 0.00 S ATOM 1541 CE MET A 100 12.003 -3.037 3.756 1.00 0.00 C ATOM 0 H MET A 100 10.865 -6.977 1.296 1.00 0.00 H new ATOM 0 HA MET A 100 10.115 -5.187 -0.935 1.00 0.00 H new ATOM 0 HB2 MET A 100 12.577 -4.914 0.832 1.00 0.00 H new ATOM 0 HB3 MET A 100 12.133 -3.875 -0.507 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.387 -2.592 1.246 1.00 0.00 H new ATOM 0 HG3 MET A 100 9.925 -3.491 0.896 1.00 0.00 H new ATOM 0 HE1 MET A 100 12.093 -3.293 4.812 1.00 0.00 H new ATOM 0 HE2 MET A 100 12.989 -3.058 3.292 1.00 0.00 H new ATOM 0 HE3 MET A 100 11.579 -2.038 3.660 1.00 0.00 H new ATOM 1551 N CYS A 101 11.672 -6.359 -2.470 1.00 0.00 N ATOM 1552 CA CYS A 101 12.461 -7.162 -3.399 1.00 0.00 C ATOM 1553 C CYS A 101 13.882 -7.355 -2.880 1.00 0.00 C ATOM 1554 O CYS A 101 14.360 -6.616 -2.019 1.00 0.00 O ATOM 1555 CB CYS A 101 12.493 -6.499 -4.777 1.00 0.00 C ATOM 1556 SG CYS A 101 11.130 -6.983 -5.861 1.00 0.00 S ATOM 0 H CYS A 101 11.053 -5.682 -2.917 1.00 0.00 H new ATOM 0 HA CYS A 101 11.990 -8.141 -3.486 1.00 0.00 H new ATOM 0 HB2 CYS A 101 12.474 -5.417 -4.648 1.00 0.00 H new ATOM 0 HB3 CYS A 101 13.436 -6.745 -5.265 1.00 0.00 H new ATOM 0 HG CYS A 101 11.332 -8.190 -6.299 1.00 0.00 H new ATOM 1562 N PRO A 102 14.574 -8.372 -3.413 1.00 0.00 N ATOM 1563 CA PRO A 102 15.950 -8.687 -3.018 1.00 0.00 C ATOM 1564 C PRO A 102 16.945 -7.634 -3.492 1.00 0.00 C ATOM 1565 O PRO A 102 18.111 -7.645 -3.098 1.00 0.00 O ATOM 1566 CB PRO A 102 16.219 -10.027 -3.708 1.00 0.00 C ATOM 1567 CG PRO A 102 15.296 -10.043 -4.877 1.00 0.00 C ATOM 1568 CD PRO A 102 14.066 -9.294 -4.444 1.00 0.00 C ATOM 0 HA PRO A 102 16.066 -8.719 -1.935 1.00 0.00 H new ATOM 0 HB2 PRO A 102 17.259 -10.108 -4.024 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.023 -10.864 -3.038 1.00 0.00 H new ATOM 0 HG2 PRO A 102 15.756 -9.569 -5.744 1.00 0.00 H new ATOM 0 HG3 PRO A 102 15.049 -11.065 -5.165 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.610 -8.756 -5.275 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.306 -9.966 -4.044 1.00 0.00 H new ATOM 1576 N SER A 103 16.476 -6.723 -4.340 1.00 0.00 N ATOM 1577 CA SER A 103 17.326 -5.664 -4.871 1.00 0.00 C ATOM 1578 C SER A 103 17.183 -4.388 -4.048 1.00 0.00 C ATOM 1579 O SER A 103 18.115 -3.589 -3.950 1.00 0.00 O ATOM 1580 CB SER A 103 16.975 -5.383 -6.333 1.00 0.00 C ATOM 1581 OG SER A 103 17.542 -6.358 -7.191 1.00 0.00 O ATOM 0 H SER A 103 15.512 -6.698 -4.674 1.00 0.00 H new ATOM 0 HA SER A 103 18.361 -6.000 -4.812 1.00 0.00 H new ATOM 0 HB2 SER A 103 15.892 -5.373 -6.455 1.00 0.00 H new ATOM 0 HB3 SER A 103 17.336 -4.394 -6.613 1.00 0.00 H new ATOM 0 HG SER A 103 17.301 -6.156 -8.119 1.00 0.00 H new ATOM 1587 N THR A 104 16.007 -4.203 -3.455 1.00 0.00 N ATOM 1588 CA THR A 104 15.739 -3.024 -2.641 1.00 0.00 C ATOM 1589 C THR A 104 16.071 -3.282 -1.175 1.00 0.00 C ATOM 1590 O THR A 104 16.596 -2.408 -0.484 1.00 0.00 O ATOM 1591 CB THR A 104 14.266 -2.588 -2.752 1.00 0.00 C ATOM 1592 OG1 THR A 104 14.011 -2.051 -4.055 1.00 0.00 O ATOM 1593 CG2 THR A 104 13.928 -1.548 -1.695 1.00 0.00 C ATOM 0 H THR A 104 15.225 -4.855 -3.524 1.00 0.00 H new ATOM 0 HA THR A 104 16.376 -2.226 -3.021 1.00 0.00 H new ATOM 0 HB THR A 104 13.638 -3.464 -2.591 1.00 0.00 H new ATOM 0 HG1 THR A 104 13.072 -1.778 -4.118 1.00 0.00 H new ATOM 0 HG21 THR A 104 12.883 -1.256 -1.793 1.00 0.00 H new ATOM 0 HG22 THR A 104 14.095 -1.969 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 104 14.564 -0.673 -1.829 1.00 0.00 H new ATOM 1601 N LYS A 105 15.762 -4.486 -0.706 1.00 0.00 N ATOM 1602 CA LYS A 105 16.030 -4.860 0.677 1.00 0.00 C ATOM 1603 C LYS A 105 17.509 -4.694 1.010 1.00 0.00 C ATOM 1604 O LYS A 105 17.862 -4.166 2.064 1.00 0.00 O ATOM 1605 CB LYS A 105 15.599 -6.307 0.928 1.00 0.00 C ATOM 1606 CG LYS A 105 15.583 -6.690 2.398 1.00 0.00 C ATOM 1607 CD LYS A 105 15.282 -8.168 2.586 1.00 0.00 C ATOM 1608 CE LYS A 105 16.527 -9.020 2.388 1.00 0.00 C ATOM 1609 NZ LYS A 105 16.222 -10.475 2.475 1.00 0.00 N ATOM 0 H LYS A 105 15.325 -5.220 -1.264 1.00 0.00 H new ATOM 0 HA LYS A 105 15.454 -4.198 1.324 1.00 0.00 H new ATOM 0 HB2 LYS A 105 14.603 -6.458 0.511 1.00 0.00 H new ATOM 0 HB3 LYS A 105 16.274 -6.976 0.394 1.00 0.00 H new ATOM 0 HG2 LYS A 105 16.548 -6.454 2.847 1.00 0.00 H new ATOM 0 HG3 LYS A 105 14.834 -6.096 2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 105 14.881 -8.334 3.586 1.00 0.00 H new ATOM 0 HD3 LYS A 105 14.512 -8.477 1.879 1.00 0.00 H new ATOM 0 HE2 LYS A 105 16.968 -8.799 1.416 1.00 0.00 H new ATOM 0 HE3 LYS A 105 17.270 -8.759 3.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 17.095 -11.022 2.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 15.825 -10.691 3.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 15.532 -10.730 1.739 1.00 0.00 H new ATOM 1623 N GLU A 106 18.369 -5.147 0.103 1.00 0.00 N ATOM 1624 CA GLU A 106 19.810 -5.047 0.301 1.00 0.00 C ATOM 1625 C GLU A 106 20.213 -3.620 0.660 1.00 0.00 C ATOM 1626 O GLU A 106 21.062 -3.400 1.524 1.00 0.00 O ATOM 1627 CB GLU A 106 20.553 -5.497 -0.958 1.00 0.00 C ATOM 1628 CG GLU A 106 20.635 -4.425 -2.032 1.00 0.00 C ATOM 1629 CD GLU A 106 21.569 -4.805 -3.165 1.00 0.00 C ATOM 1630 OE1 GLU A 106 22.791 -4.889 -2.925 1.00 0.00 O ATOM 1631 OE2 GLU A 106 21.076 -5.019 -4.293 1.00 0.00 O ATOM 0 H GLU A 106 18.093 -5.586 -0.775 1.00 0.00 H new ATOM 0 HA GLU A 106 20.083 -5.702 1.129 1.00 0.00 H new ATOM 0 HB2 GLU A 106 21.563 -5.803 -0.684 1.00 0.00 H new ATOM 0 HB3 GLU A 106 20.055 -6.375 -1.370 1.00 0.00 H new ATOM 0 HG2 GLU A 106 19.638 -4.241 -2.434 1.00 0.00 H new ATOM 0 HG3 GLU A 106 20.975 -3.492 -1.583 1.00 0.00 H new ATOM 1638 N HIS A 107 19.597 -2.651 -0.012 1.00 0.00 N ATOM 1639 CA HIS A 107 19.891 -1.244 0.235 1.00 0.00 C ATOM 1640 C HIS A 107 19.655 -0.889 1.700 1.00 0.00 C ATOM 1641 O HIS A 107 20.505 -0.276 2.346 1.00 0.00 O ATOM 1642 CB HIS A 107 19.028 -0.356 -0.662 1.00 0.00 C ATOM 1643 CG HIS A 107 19.313 1.106 -0.510 1.00 0.00 C ATOM 1644 ND1 HIS A 107 20.474 1.697 -0.963 1.00 0.00 N ATOM 1645 CD2 HIS A 107 18.580 2.098 0.046 1.00 0.00 C ATOM 1646 CE1 HIS A 107 20.443 2.989 -0.690 1.00 0.00 C ATOM 1647 NE2 HIS A 107 19.304 3.258 -0.078 1.00 0.00 N ATOM 0 H HIS A 107 18.892 -2.815 -0.731 1.00 0.00 H new ATOM 0 HA HIS A 107 20.942 -1.071 0.002 1.00 0.00 H new ATOM 0 HB2 HIS A 107 19.185 -0.642 -1.702 1.00 0.00 H new ATOM 0 HB3 HIS A 107 17.977 -0.538 -0.437 1.00 0.00 H new ATOM 0 HD2 HIS A 107 17.606 1.996 0.502 1.00 0.00 H new ATOM 0 HE1 HIS A 107 21.217 3.704 -0.927 1.00 0.00 H new ATOM 0 HE2 HIS A 107 19.010 4.178 0.249 1.00 0.00 H new ATOM 1655 N PHE A 108 18.495 -1.277 2.219 1.00 0.00 N ATOM 1656 CA PHE A 108 18.146 -0.998 3.607 1.00 0.00 C ATOM 1657 C PHE A 108 19.142 -1.653 4.560 1.00 0.00 C ATOM 1658 O PHE A 108 19.572 -1.045 5.539 1.00 0.00 O ATOM 1659 CB PHE A 108 16.731 -1.495 3.910 1.00 0.00 C ATOM 1660 CG PHE A 108 15.667 -0.466 3.655 1.00 0.00 C ATOM 1661 CD1 PHE A 108 15.252 -0.185 2.363 1.00 0.00 C ATOM 1662 CD2 PHE A 108 15.082 0.219 4.707 1.00 0.00 C ATOM 1663 CE1 PHE A 108 14.273 0.762 2.126 1.00 0.00 C ATOM 1664 CE2 PHE A 108 14.103 1.167 4.476 1.00 0.00 C ATOM 1665 CZ PHE A 108 13.697 1.438 3.184 1.00 0.00 C ATOM 0 H PHE A 108 17.780 -1.786 1.699 1.00 0.00 H new ATOM 0 HA PHE A 108 18.184 0.081 3.755 1.00 0.00 H new ATOM 0 HB2 PHE A 108 16.526 -2.376 3.302 1.00 0.00 H new ATOM 0 HB3 PHE A 108 16.680 -1.808 4.953 1.00 0.00 H new ATOM 0 HD1 PHE A 108 15.698 -0.711 1.532 1.00 0.00 H new ATOM 0 HD2 PHE A 108 15.394 0.010 5.720 1.00 0.00 H new ATOM 0 HE1 PHE A 108 13.959 0.973 1.114 1.00 0.00 H new ATOM 0 HE2 PHE A 108 13.656 1.695 5.305 1.00 0.00 H new ATOM 0 HZ PHE A 108 12.931 2.177 3.001 1.00 0.00 H new ATOM 1675 N ALA A 109 19.503 -2.898 4.265 1.00 0.00 N ATOM 1676 CA ALA A 109 20.449 -3.636 5.094 1.00 0.00 C ATOM 1677 C ALA A 109 21.699 -2.807 5.371 1.00 0.00 C ATOM 1678 O ALA A 109 22.334 -2.955 6.415 1.00 0.00 O ATOM 1679 CB ALA A 109 20.822 -4.950 4.426 1.00 0.00 C ATOM 0 H ALA A 109 19.155 -3.416 3.459 1.00 0.00 H new ATOM 0 HA ALA A 109 19.968 -3.850 6.048 1.00 0.00 H new ATOM 0 HB1 ALA A 109 21.529 -5.491 5.056 1.00 0.00 H new ATOM 0 HB2 ALA A 109 19.926 -5.554 4.285 1.00 0.00 H new ATOM 0 HB3 ALA A 109 21.279 -4.749 3.457 1.00 0.00 H new ATOM 1685 N ARG A 110 22.046 -1.936 4.429 1.00 0.00 N ATOM 1686 CA ARG A 110 23.222 -1.086 4.571 1.00 0.00 C ATOM 1687 C ARG A 110 23.018 -0.059 5.681 1.00 0.00 C ATOM 1688 O ARG A 110 23.945 0.252 6.429 1.00 0.00 O ATOM 1689 CB ARG A 110 23.525 -0.373 3.252 1.00 0.00 C ATOM 1690 CG ARG A 110 23.692 -1.319 2.074 1.00 0.00 C ATOM 1691 CD ARG A 110 25.026 -2.047 2.129 1.00 0.00 C ATOM 1692 NE ARG A 110 26.142 -1.173 1.778 1.00 0.00 N ATOM 1693 CZ ARG A 110 27.402 -1.586 1.696 1.00 0.00 C ATOM 1694 NH1 ARG A 110 27.704 -2.854 1.938 1.00 0.00 N ATOM 1695 NH2 ARG A 110 28.362 -0.730 1.371 1.00 0.00 N ATOM 0 H ARG A 110 21.530 -1.800 3.560 1.00 0.00 H new ATOM 0 HA ARG A 110 24.068 -1.720 4.836 1.00 0.00 H new ATOM 0 HB2 ARG A 110 22.719 0.327 3.034 1.00 0.00 H new ATOM 0 HB3 ARG A 110 24.436 0.215 3.367 1.00 0.00 H new ATOM 0 HG2 ARG A 110 22.880 -2.046 2.071 1.00 0.00 H new ATOM 0 HG3 ARG A 110 23.621 -0.758 1.142 1.00 0.00 H new ATOM 0 HD2 ARG A 110 25.180 -2.446 3.131 1.00 0.00 H new ATOM 0 HD3 ARG A 110 25.003 -2.897 1.447 1.00 0.00 H new ATOM 0 HE ARG A 110 25.943 -0.191 1.585 1.00 0.00 H new ATOM 0 HH11 ARG A 110 26.968 -3.515 2.188 1.00 0.00 H new ATOM 0 HH12 ARG A 110 28.672 -3.169 1.874 1.00 0.00 H new ATOM 0 HH21 ARG A 110 28.133 0.246 1.184 1.00 0.00 H new ATOM 0 HH22 ARG A 110 29.329 -1.048 1.308 1.00 0.00 H new ATOM 1709 N GLU A 111 21.800 0.464 5.781 1.00 0.00 N ATOM 1710 CA GLU A 111 21.477 1.457 6.799 1.00 0.00 C ATOM 1711 C GLU A 111 21.361 0.808 8.175 1.00 0.00 C ATOM 1712 O GLU A 111 21.862 1.338 9.167 1.00 0.00 O ATOM 1713 CB GLU A 111 20.170 2.172 6.449 1.00 0.00 C ATOM 1714 CG GLU A 111 20.365 3.412 5.593 1.00 0.00 C ATOM 1715 CD GLU A 111 19.154 4.324 5.603 1.00 0.00 C ATOM 1716 OE1 GLU A 111 18.021 3.806 5.693 1.00 0.00 O ATOM 1717 OE2 GLU A 111 19.339 5.557 5.522 1.00 0.00 O ATOM 0 H GLU A 111 21.021 0.217 5.170 1.00 0.00 H new ATOM 0 HA GLU A 111 22.286 2.187 6.827 1.00 0.00 H new ATOM 0 HB2 GLU A 111 19.515 1.477 5.923 1.00 0.00 H new ATOM 0 HB3 GLU A 111 19.662 2.454 7.371 1.00 0.00 H new ATOM 0 HG2 GLU A 111 21.234 3.964 5.952 1.00 0.00 H new ATOM 0 HG3 GLU A 111 20.580 3.111 4.568 1.00 0.00 H new ATOM 1724 N TYR A 112 20.698 -0.342 8.226 1.00 0.00 N ATOM 1725 CA TYR A 112 20.513 -1.062 9.480 1.00 0.00 C ATOM 1726 C TYR A 112 21.774 -0.998 10.336 1.00 0.00 C ATOM 1727 O TYR A 112 21.728 -0.601 11.500 1.00 0.00 O ATOM 1728 CB TYR A 112 20.144 -2.521 9.205 1.00 0.00 C ATOM 1729 CG TYR A 112 18.656 -2.753 9.065 1.00 0.00 C ATOM 1730 CD1 TYR A 112 17.911 -2.058 8.120 1.00 0.00 C ATOM 1731 CD2 TYR A 112 17.996 -3.666 9.877 1.00 0.00 C ATOM 1732 CE1 TYR A 112 16.552 -2.266 7.988 1.00 0.00 C ATOM 1733 CE2 TYR A 112 16.637 -3.882 9.752 1.00 0.00 C ATOM 1734 CZ TYR A 112 15.919 -3.179 8.806 1.00 0.00 C ATOM 1735 OH TYR A 112 14.566 -3.390 8.680 1.00 0.00 O ATOM 0 H TYR A 112 20.280 -0.795 7.414 1.00 0.00 H new ATOM 0 HA TYR A 112 19.700 -0.585 10.027 1.00 0.00 H new ATOM 0 HB2 TYR A 112 20.642 -2.847 8.292 1.00 0.00 H new ATOM 0 HB3 TYR A 112 20.526 -3.142 10.015 1.00 0.00 H new ATOM 0 HD1 TYR A 112 18.403 -1.343 7.478 1.00 0.00 H new ATOM 0 HD2 TYR A 112 18.555 -4.217 10.619 1.00 0.00 H new ATOM 0 HE1 TYR A 112 15.988 -1.717 7.249 1.00 0.00 H new ATOM 0 HE2 TYR A 112 16.140 -4.597 10.391 1.00 0.00 H new ATOM 0 HH TYR A 112 14.278 -4.065 9.330 1.00 0.00 H new ATOM 1745 N ASP A 113 22.900 -1.391 9.750 1.00 0.00 N ATOM 1746 CA ASP A 113 24.175 -1.378 10.457 1.00 0.00 C ATOM 1747 C ASP A 113 25.192 -0.507 9.725 1.00 0.00 C ATOM 1748 O ASP A 113 26.172 -0.050 10.316 1.00 0.00 O ATOM 1749 CB ASP A 113 24.716 -2.801 10.605 1.00 0.00 C ATOM 1750 CG ASP A 113 25.763 -2.911 11.695 1.00 0.00 C ATOM 1751 OD1 ASP A 113 26.955 -2.688 11.397 1.00 0.00 O ATOM 1752 OD2 ASP A 113 25.392 -3.222 12.846 1.00 0.00 O ATOM 0 H ASP A 113 22.955 -1.723 8.787 1.00 0.00 H new ATOM 0 HA ASP A 113 24.009 -0.957 11.449 1.00 0.00 H new ATOM 0 HB2 ASP A 113 23.892 -3.479 10.827 1.00 0.00 H new ATOM 0 HB3 ASP A 113 25.147 -3.123 9.657 1.00 0.00 H new TER 1757 ASP A 113