USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 570 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 123 MET CE :methyl -121:sc= -10.6! (180deg=-6.6!) USER MOD Set 1.2: A 125 ASN : amide:sc= -9.96! C(o=-21!,f=-27!) USER MOD Set 2.1: A 122 LYS NZ :NH3+ -163:sc= -0.413 (180deg=-0.0248) USER MOD Set 2.2: A 124 MET CE :methyl -111:sc= -1.03 (180deg=-4.36!) USER MOD Set 3.1: A 114 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 126 GLN : amide:sc= -5.78! C(o=-5.8!,f=-8.8!) USER MOD Single : A 81 HIS : no HE2:sc= -14.4! C(o=-14!,f=-18!) USER MOD Single : A 85 SER OG : rot -80:sc= -2.66! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 131:sc= -1.07! USER MOD Single : A 92 TYR OH : rot 152:sc= 0.146 USER MOD Single : A 94 THR OG1 : rot 39:sc= 0.114 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -7.46! C(o=-7.5!,f=-6.1!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.342 K(o=-0.34,f=-3.7!) USER MOD Single : A 116 CYS SG : rot -169:sc= -2 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 85:sc= -2.48! USER MOD Single : A 144 GLN : amide:sc= 0.0607 X(o=0.061,f=-0.081) USER MOD ----------------------------------------------------------------- ATOM 46 N GLY A 80 11.983 9.208 -3.528 1.00 0.00 N ATOM 47 CA GLY A 80 11.117 8.050 -3.413 1.00 0.00 C ATOM 48 C GLY A 80 9.858 8.181 -4.247 1.00 0.00 C ATOM 49 O GLY A 80 9.903 8.665 -5.378 1.00 0.00 O ATOM 0 HA2 GLY A 80 11.664 7.159 -3.724 1.00 0.00 H new ATOM 0 HA3 GLY A 80 10.843 7.908 -2.368 1.00 0.00 H new ATOM 53 N HIS A 81 8.732 7.750 -3.689 1.00 0.00 N ATOM 54 CA HIS A 81 7.455 7.822 -4.389 1.00 0.00 C ATOM 55 C HIS A 81 6.304 7.430 -3.470 1.00 0.00 C ATOM 56 O HIS A 81 6.229 6.292 -3.004 1.00 0.00 O ATOM 57 CB HIS A 81 7.473 6.912 -5.619 1.00 0.00 C ATOM 58 CG HIS A 81 7.561 5.455 -5.282 1.00 0.00 C ATOM 59 ND1 HIS A 81 6.690 4.512 -5.787 1.00 0.00 N ATOM 60 CD2 HIS A 81 8.423 4.780 -4.485 1.00 0.00 C ATOM 61 CE1 HIS A 81 7.013 3.321 -5.313 1.00 0.00 C ATOM 62 NE2 HIS A 81 8.061 3.458 -4.522 1.00 0.00 N ATOM 0 H HIS A 81 8.678 7.347 -2.754 1.00 0.00 H new ATOM 0 HA HIS A 81 7.304 8.853 -4.708 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.571 7.088 -6.205 1.00 0.00 H new ATOM 0 HB3 HIS A 81 8.320 7.183 -6.249 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.918 4.704 -6.426 1.00 0.00 H new ATOM 0 HD2 HIS A 81 9.243 5.204 -3.925 1.00 0.00 H new ATOM 0 HE1 HIS A 81 6.506 2.394 -5.535 1.00 0.00 H new ATOM 71 N ILE A 82 5.409 8.377 -3.211 1.00 0.00 N ATOM 72 CA ILE A 82 4.262 8.128 -2.348 1.00 0.00 C ATOM 73 C ILE A 82 3.102 7.533 -3.137 1.00 0.00 C ATOM 74 O ILE A 82 2.657 8.106 -4.131 1.00 0.00 O ATOM 75 CB ILE A 82 3.787 9.420 -1.654 1.00 0.00 C ATOM 76 CG1 ILE A 82 4.867 9.944 -0.706 1.00 0.00 C ATOM 77 CG2 ILE A 82 2.488 9.170 -0.902 1.00 0.00 C ATOM 78 CD1 ILE A 82 6.211 10.141 -1.369 1.00 0.00 C ATOM 0 H ILE A 82 5.456 9.324 -3.587 1.00 0.00 H new ATOM 0 HA ILE A 82 4.586 7.416 -1.589 1.00 0.00 H new ATOM 0 HB ILE A 82 3.603 10.177 -2.416 1.00 0.00 H new ATOM 0 HG12 ILE A 82 4.538 10.893 -0.283 1.00 0.00 H new ATOM 0 HG13 ILE A 82 4.980 9.247 0.124 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.165 10.091 -0.417 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.720 8.840 -1.602 1.00 0.00 H new ATOM 0 HG23 ILE A 82 2.647 8.399 -0.148 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.927 10.514 -0.637 1.00 0.00 H new ATOM 0 HD12 ILE A 82 6.563 9.190 -1.768 1.00 0.00 H new ATOM 0 HD13 ILE A 82 6.114 10.862 -2.181 1.00 0.00 H new ATOM 90 N VAL A 83 2.618 6.380 -2.691 1.00 0.00 N ATOM 91 CA VAL A 83 1.511 5.706 -3.359 1.00 0.00 C ATOM 92 C VAL A 83 0.174 6.091 -2.736 1.00 0.00 C ATOM 93 O VAL A 83 -0.121 5.724 -1.599 1.00 0.00 O ATOM 94 CB VAL A 83 1.667 4.176 -3.302 1.00 0.00 C ATOM 95 CG1 VAL A 83 0.802 3.511 -4.363 1.00 0.00 C ATOM 96 CG2 VAL A 83 3.127 3.780 -3.469 1.00 0.00 C ATOM 0 H VAL A 83 2.975 5.892 -1.869 1.00 0.00 H new ATOM 0 HA VAL A 83 1.530 6.028 -4.400 1.00 0.00 H new ATOM 0 HB VAL A 83 1.331 3.832 -2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.925 2.429 -4.308 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.244 3.766 -4.192 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.104 3.860 -5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.217 2.695 -3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.493 4.136 -4.432 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.719 4.225 -2.669 1.00 0.00 H new ATOM 106 N ARG A 84 -0.632 6.835 -3.488 1.00 0.00 N ATOM 107 CA ARG A 84 -1.940 7.268 -3.010 1.00 0.00 C ATOM 108 C ARG A 84 -3.050 6.431 -3.635 1.00 0.00 C ATOM 109 O ARG A 84 -3.118 6.282 -4.855 1.00 0.00 O ATOM 110 CB ARG A 84 -2.159 8.748 -3.332 1.00 0.00 C ATOM 111 CG ARG A 84 -2.043 9.074 -4.811 1.00 0.00 C ATOM 112 CD ARG A 84 -1.092 10.235 -5.053 1.00 0.00 C ATOM 113 NE ARG A 84 -1.556 11.108 -6.127 1.00 0.00 N ATOM 114 CZ ARG A 84 -1.460 10.804 -7.417 1.00 0.00 C ATOM 115 NH1 ARG A 84 -0.917 9.653 -7.791 1.00 0.00 N ATOM 116 NH2 ARG A 84 -1.905 11.651 -8.334 1.00 0.00 N ATOM 0 H ARG A 84 -0.402 7.150 -4.430 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.969 7.130 -1.929 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -3.147 9.045 -2.980 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.431 9.343 -2.780 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.691 8.195 -5.352 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.028 9.320 -5.209 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -0.986 10.814 -4.136 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -0.104 9.848 -5.302 1.00 0.00 H new ATOM 0 HE ARG A 84 -1.978 12.001 -5.873 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.572 8.999 -7.088 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -0.844 9.421 -8.782 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -2.322 12.538 -8.050 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -1.831 11.416 -9.324 1.00 0.00 H new ATOM 130 N SER A 85 -3.919 5.885 -2.790 1.00 0.00 N ATOM 131 CA SER A 85 -5.027 5.062 -3.260 1.00 0.00 C ATOM 132 C SER A 85 -5.635 5.645 -4.532 1.00 0.00 C ATOM 133 O SER A 85 -6.443 6.572 -4.478 1.00 0.00 O ATOM 134 CB SER A 85 -6.098 4.944 -2.175 1.00 0.00 C ATOM 135 OG SER A 85 -6.614 3.625 -2.108 1.00 0.00 O ATOM 0 H SER A 85 -3.877 5.998 -1.777 1.00 0.00 H new ATOM 0 HA SER A 85 -4.640 4.069 -3.486 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.674 5.221 -1.210 1.00 0.00 H new ATOM 0 HB3 SER A 85 -6.907 5.644 -2.381 1.00 0.00 H new ATOM 0 HG SER A 85 -7.277 3.496 -2.819 1.00 0.00 H new ATOM 141 N PRO A 86 -5.252 5.102 -5.697 1.00 0.00 N ATOM 142 CA PRO A 86 -5.760 5.566 -6.991 1.00 0.00 C ATOM 143 C PRO A 86 -7.282 5.586 -7.037 1.00 0.00 C ATOM 144 O PRO A 86 -7.890 6.587 -7.415 1.00 0.00 O ATOM 145 CB PRO A 86 -5.208 4.537 -7.981 1.00 0.00 C ATOM 146 CG PRO A 86 -4.001 3.974 -7.315 1.00 0.00 C ATOM 147 CD PRO A 86 -4.294 3.992 -5.840 1.00 0.00 C ATOM 0 HA PRO A 86 -5.453 6.589 -7.207 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.942 3.759 -8.192 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.953 5.002 -8.933 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -3.802 2.960 -7.661 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -3.116 4.568 -7.544 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -4.720 3.047 -5.503 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -3.391 4.162 -5.253 1.00 0.00 H new ATOM 155 N MET A 87 -7.894 4.473 -6.646 1.00 0.00 N ATOM 156 CA MET A 87 -9.348 4.360 -6.638 1.00 0.00 C ATOM 157 C MET A 87 -9.861 4.068 -5.232 1.00 0.00 C ATOM 158 O MET A 87 -9.196 3.393 -4.446 1.00 0.00 O ATOM 159 CB MET A 87 -9.799 3.258 -7.599 1.00 0.00 C ATOM 160 CG MET A 87 -11.295 3.257 -7.867 1.00 0.00 C ATOM 161 SD MET A 87 -11.849 1.756 -8.696 1.00 0.00 S ATOM 162 CE MET A 87 -13.078 2.421 -9.817 1.00 0.00 C ATOM 0 H MET A 87 -7.405 3.635 -6.330 1.00 0.00 H new ATOM 0 HA MET A 87 -9.765 5.312 -6.967 1.00 0.00 H new ATOM 0 HB2 MET A 87 -9.269 3.373 -8.545 1.00 0.00 H new ATOM 0 HB3 MET A 87 -9.511 2.290 -7.189 1.00 0.00 H new ATOM 0 HG2 MET A 87 -11.830 3.365 -6.923 1.00 0.00 H new ATOM 0 HG3 MET A 87 -11.551 4.122 -8.479 1.00 0.00 H new ATOM 0 HE1 MET A 87 -13.513 1.611 -10.402 1.00 0.00 H new ATOM 0 HE2 MET A 87 -13.862 2.917 -9.245 1.00 0.00 H new ATOM 0 HE3 MET A 87 -12.608 3.140 -10.487 1.00 0.00 H new ATOM 172 N VAL A 88 -11.048 4.580 -4.921 1.00 0.00 N ATOM 173 CA VAL A 88 -11.648 4.374 -3.609 1.00 0.00 C ATOM 174 C VAL A 88 -11.677 2.895 -3.243 1.00 0.00 C ATOM 175 O VAL A 88 -11.537 2.029 -4.107 1.00 0.00 O ATOM 176 CB VAL A 88 -13.082 4.932 -3.550 1.00 0.00 C ATOM 177 CG1 VAL A 88 -13.773 4.495 -2.268 1.00 0.00 C ATOM 178 CG2 VAL A 88 -13.069 6.450 -3.668 1.00 0.00 C ATOM 0 H VAL A 88 -11.612 5.140 -5.560 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.027 4.912 -2.892 1.00 0.00 H new ATOM 0 HB VAL A 88 -13.644 4.530 -4.393 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -14.785 4.899 -2.244 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.816 3.406 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -13.214 4.866 -1.409 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -14.091 6.827 -3.624 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -12.490 6.874 -2.847 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -12.616 6.737 -4.617 1.00 0.00 H new ATOM 188 N GLY A 89 -11.861 2.613 -1.958 1.00 0.00 N ATOM 189 CA GLY A 89 -11.907 1.238 -1.499 1.00 0.00 C ATOM 190 C GLY A 89 -11.584 1.110 -0.024 1.00 0.00 C ATOM 191 O GLY A 89 -12.305 1.635 0.824 1.00 0.00 O ATOM 0 H GLY A 89 -11.979 3.313 -1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.899 0.828 -1.688 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -11.200 0.641 -2.076 1.00 0.00 H new ATOM 195 N THR A 90 -10.496 0.412 0.284 1.00 0.00 N ATOM 196 CA THR A 90 -10.079 0.219 1.666 1.00 0.00 C ATOM 197 C THR A 90 -8.652 -0.315 1.733 1.00 0.00 C ATOM 198 O THR A 90 -8.328 -1.328 1.113 1.00 0.00 O ATOM 199 CB THR A 90 -11.031 -0.743 2.378 1.00 0.00 C ATOM 200 OG1 THR A 90 -12.361 -0.555 1.929 1.00 0.00 O ATOM 201 CG2 THR A 90 -11.028 -0.584 3.883 1.00 0.00 C ATOM 0 H THR A 90 -9.888 -0.029 -0.406 1.00 0.00 H new ATOM 0 HA THR A 90 -10.110 1.186 2.168 1.00 0.00 H new ATOM 0 HB THR A 90 -10.669 -1.742 2.134 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.752 -1.422 1.693 1.00 0.00 H new ATOM 0 HG21 THR A 90 -11.725 -1.296 4.325 1.00 0.00 H new ATOM 0 HG22 THR A 90 -10.025 -0.771 4.267 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.332 0.430 4.142 1.00 0.00 H new ATOM 209 N PHE A 91 -7.803 0.373 2.488 1.00 0.00 N ATOM 210 CA PHE A 91 -6.410 -0.034 2.633 1.00 0.00 C ATOM 211 C PHE A 91 -6.265 -1.121 3.692 1.00 0.00 C ATOM 212 O PHE A 91 -7.202 -1.404 4.439 1.00 0.00 O ATOM 213 CB PHE A 91 -5.539 1.170 2.998 1.00 0.00 C ATOM 214 CG PHE A 91 -4.071 0.853 3.039 1.00 0.00 C ATOM 215 CD1 PHE A 91 -3.425 0.352 1.914 1.00 0.00 C ATOM 216 CD2 PHE A 91 -3.336 1.051 4.202 1.00 0.00 C ATOM 217 CE1 PHE A 91 -2.071 0.054 1.950 1.00 0.00 C ATOM 218 CE2 PHE A 91 -1.983 0.755 4.243 1.00 0.00 C ATOM 219 CZ PHE A 91 -1.350 0.255 3.116 1.00 0.00 C ATOM 0 H PHE A 91 -8.054 1.214 3.008 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.077 -0.438 1.677 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.711 1.967 2.274 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.848 1.551 3.971 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.983 0.193 1.003 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.825 1.440 5.083 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.579 -0.334 1.070 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -1.422 0.914 5.152 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.296 0.022 3.147 1.00 0.00 H new ATOM 229 N TYR A 92 -5.084 -1.727 3.752 1.00 0.00 N ATOM 230 CA TYR A 92 -4.816 -2.784 4.719 1.00 0.00 C ATOM 231 C TYR A 92 -3.325 -2.881 5.020 1.00 0.00 C ATOM 232 O TYR A 92 -2.523 -2.117 4.483 1.00 0.00 O ATOM 233 CB TYR A 92 -5.331 -4.122 4.196 1.00 0.00 C ATOM 234 CG TYR A 92 -6.805 -4.343 4.448 1.00 0.00 C ATOM 235 CD1 TYR A 92 -7.331 -4.259 5.736 1.00 0.00 C ATOM 236 CD2 TYR A 92 -7.674 -4.635 3.398 1.00 0.00 C ATOM 237 CE1 TYR A 92 -8.682 -4.461 5.971 1.00 0.00 C ATOM 238 CE2 TYR A 92 -9.026 -4.838 3.624 1.00 0.00 C ATOM 239 CZ TYR A 92 -9.525 -4.750 4.911 1.00 0.00 C ATOM 240 OH TYR A 92 -10.867 -4.950 5.140 1.00 0.00 O ATOM 0 H TYR A 92 -4.297 -1.504 3.142 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.338 -2.538 5.644 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.141 -4.181 3.124 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -4.766 -4.928 4.665 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.676 -4.033 6.564 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.287 -4.704 2.392 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -9.075 -4.393 6.975 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -9.686 -5.064 2.800 1.00 0.00 H new ATOM 0 HH TYR A 92 -11.376 -4.697 4.342 1.00 0.00 H new ATOM 250 N ARG A 93 -2.959 -3.823 5.882 1.00 0.00 N ATOM 251 CA ARG A 93 -1.562 -4.016 6.253 1.00 0.00 C ATOM 252 C ARG A 93 -1.252 -5.491 6.482 1.00 0.00 C ATOM 253 O ARG A 93 -0.203 -5.835 7.024 1.00 0.00 O ATOM 254 CB ARG A 93 -1.234 -3.219 7.516 1.00 0.00 C ATOM 255 CG ARG A 93 -0.692 -1.828 7.236 1.00 0.00 C ATOM 256 CD ARG A 93 -0.657 -0.980 8.497 1.00 0.00 C ATOM 257 NE ARG A 93 0.271 -1.515 9.491 1.00 0.00 N ATOM 258 CZ ARG A 93 0.453 -0.976 10.692 1.00 0.00 C ATOM 259 NH1 ARG A 93 -0.226 0.106 11.046 1.00 0.00 N ATOM 260 NH2 ARG A 93 1.315 -1.520 11.542 1.00 0.00 N ATOM 0 H ARG A 93 -3.609 -4.464 6.336 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.945 -3.658 5.429 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.134 -3.133 8.125 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.503 -3.773 8.105 1.00 0.00 H new ATOM 0 HG2 ARG A 93 0.312 -1.905 6.820 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.312 -1.339 6.485 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -0.366 0.039 8.241 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -1.657 -0.927 8.926 1.00 0.00 H new ATOM 0 HE ARG A 93 0.808 -2.348 9.250 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.890 0.527 10.396 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.085 0.518 11.968 1.00 0.00 H new ATOM 0 HH21 ARG A 93 1.839 -2.353 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.454 -1.105 12.463 1.00 0.00 H new ATOM 274 N THR A 94 -2.170 -6.360 6.069 1.00 0.00 N ATOM 275 CA THR A 94 -1.987 -7.796 6.237 1.00 0.00 C ATOM 276 C THR A 94 -2.737 -8.573 5.162 1.00 0.00 C ATOM 277 O THR A 94 -3.933 -8.370 4.956 1.00 0.00 O ATOM 278 CB THR A 94 -2.467 -8.232 7.622 1.00 0.00 C ATOM 279 OG1 THR A 94 -3.782 -7.770 7.865 1.00 0.00 O ATOM 280 CG2 THR A 94 -1.588 -7.728 8.747 1.00 0.00 C ATOM 0 H THR A 94 -3.045 -6.095 5.617 1.00 0.00 H new ATOM 0 HA THR A 94 -0.923 -8.013 6.140 1.00 0.00 H new ATOM 0 HB THR A 94 -2.427 -9.321 7.611 1.00 0.00 H new ATOM 0 HG1 THR A 94 -4.310 -7.839 7.042 1.00 0.00 H new ATOM 0 HG21 THR A 94 -1.985 -8.073 9.702 1.00 0.00 H new ATOM 0 HG22 THR A 94 -0.575 -8.109 8.616 1.00 0.00 H new ATOM 0 HG23 THR A 94 -1.570 -6.638 8.734 1.00 0.00 H new ATOM 288 N PRO A 95 -2.039 -9.479 4.462 1.00 0.00 N ATOM 289 CA PRO A 95 -2.638 -10.297 3.404 1.00 0.00 C ATOM 290 C PRO A 95 -3.781 -11.161 3.921 1.00 0.00 C ATOM 291 O PRO A 95 -4.473 -10.791 4.869 1.00 0.00 O ATOM 292 CB PRO A 95 -1.482 -11.182 2.925 1.00 0.00 C ATOM 293 CG PRO A 95 -0.244 -10.490 3.382 1.00 0.00 C ATOM 294 CD PRO A 95 -0.611 -9.778 4.652 1.00 0.00 C ATOM 0 HA PRO A 95 -3.072 -9.680 2.617 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -1.552 -12.184 3.348 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.494 -11.292 1.841 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.561 -11.204 3.554 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.110 -9.786 2.629 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -0.443 -10.403 5.529 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -0.023 -8.870 4.790 1.00 0.00 H new ATOM 349 N LYS A 100 1.118 -12.144 8.273 1.00 0.00 N ATOM 350 CA LYS A 100 1.850 -11.297 9.209 1.00 0.00 C ATOM 351 C LYS A 100 1.468 -9.831 9.033 1.00 0.00 C ATOM 352 O LYS A 100 0.835 -9.235 9.904 1.00 0.00 O ATOM 353 CB LYS A 100 3.357 -11.469 9.012 1.00 0.00 C ATOM 354 CG LYS A 100 4.113 -11.735 10.304 1.00 0.00 C ATOM 355 CD LYS A 100 5.491 -12.315 10.034 1.00 0.00 C ATOM 356 CE LYS A 100 6.443 -11.262 9.492 1.00 0.00 C ATOM 357 NZ LYS A 100 7.834 -11.778 9.367 1.00 0.00 N ATOM 0 HA LYS A 100 1.584 -11.603 10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 100 3.533 -12.294 8.321 1.00 0.00 H new ATOM 0 HB3 LYS A 100 3.759 -10.570 8.544 1.00 0.00 H new ATOM 0 HG2 LYS A 100 4.212 -10.807 10.867 1.00 0.00 H new ATOM 0 HG3 LYS A 100 3.542 -12.425 10.925 1.00 0.00 H new ATOM 0 HD2 LYS A 100 5.897 -12.734 10.955 1.00 0.00 H new ATOM 0 HD3 LYS A 100 5.408 -13.134 9.320 1.00 0.00 H new ATOM 0 HE2 LYS A 100 6.093 -10.924 8.517 1.00 0.00 H new ATOM 0 HE3 LYS A 100 6.436 -10.394 10.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 8.450 -11.028 8.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 8.179 -12.077 10.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 7.846 -12.591 8.718 1.00 0.00 H new ATOM 371 N ALA A 101 1.862 -9.256 7.902 1.00 0.00 N ATOM 372 CA ALA A 101 1.567 -7.860 7.608 1.00 0.00 C ATOM 373 C ALA A 101 2.271 -7.404 6.335 1.00 0.00 C ATOM 374 O ALA A 101 3.479 -7.587 6.183 1.00 0.00 O ATOM 375 CB ALA A 101 1.975 -6.984 8.779 1.00 0.00 C ATOM 0 H ALA A 101 2.388 -9.737 7.173 1.00 0.00 H new ATOM 0 HA ALA A 101 0.493 -7.765 7.449 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.751 -5.942 8.550 1.00 0.00 H new ATOM 0 HB2 ALA A 101 1.424 -7.287 9.669 1.00 0.00 H new ATOM 0 HB3 ALA A 101 3.044 -7.093 8.960 1.00 0.00 H new ATOM 381 N PHE A 102 1.509 -6.809 5.424 1.00 0.00 N ATOM 382 CA PHE A 102 2.058 -6.323 4.165 1.00 0.00 C ATOM 383 C PHE A 102 3.274 -5.436 4.408 1.00 0.00 C ATOM 384 O PHE A 102 3.767 -5.337 5.532 1.00 0.00 O ATOM 385 CB PHE A 102 0.991 -5.552 3.385 1.00 0.00 C ATOM 386 CG PHE A 102 0.064 -6.440 2.605 1.00 0.00 C ATOM 387 CD1 PHE A 102 0.545 -7.220 1.560 1.00 0.00 C ATOM 388 CD2 PHE A 102 -1.290 -6.497 2.916 1.00 0.00 C ATOM 389 CE1 PHE A 102 -0.306 -8.042 0.839 1.00 0.00 C ATOM 390 CE2 PHE A 102 -2.147 -7.318 2.198 1.00 0.00 C ATOM 391 CZ PHE A 102 -1.654 -8.091 1.159 1.00 0.00 C ATOM 0 H PHE A 102 0.507 -6.652 5.535 1.00 0.00 H new ATOM 0 HA PHE A 102 2.375 -7.184 3.577 1.00 0.00 H new ATOM 0 HB2 PHE A 102 0.406 -4.951 4.081 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.481 -4.860 2.700 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.594 -7.185 1.307 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -1.678 -5.896 3.725 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.080 -8.643 0.029 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -3.197 -7.355 2.448 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.319 -8.731 0.599 1.00 0.00 H new ATOM 401 N ILE A 103 3.758 -4.793 3.349 1.00 0.00 N ATOM 402 CA ILE A 103 4.919 -3.918 3.453 1.00 0.00 C ATOM 403 C ILE A 103 4.603 -2.677 4.281 1.00 0.00 C ATOM 404 O ILE A 103 4.000 -1.724 3.787 1.00 0.00 O ATOM 405 CB ILE A 103 5.417 -3.478 2.063 1.00 0.00 C ATOM 406 CG1 ILE A 103 5.476 -4.677 1.116 1.00 0.00 C ATOM 407 CG2 ILE A 103 6.782 -2.817 2.175 1.00 0.00 C ATOM 408 CD1 ILE A 103 6.027 -5.930 1.762 1.00 0.00 C ATOM 0 H ILE A 103 3.364 -4.862 2.411 1.00 0.00 H new ATOM 0 HA ILE A 103 5.702 -4.492 3.948 1.00 0.00 H new ATOM 0 HB ILE A 103 4.715 -2.751 1.655 1.00 0.00 H new ATOM 0 HG12 ILE A 103 4.474 -4.882 0.740 1.00 0.00 H new ATOM 0 HG13 ILE A 103 6.093 -4.420 0.255 1.00 0.00 H new ATOM 0 HG21 ILE A 103 7.121 -2.512 1.185 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.710 -1.941 2.820 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.495 -3.524 2.600 1.00 0.00 H new ATOM 0 HD11 ILE A 103 6.040 -6.740 1.033 1.00 0.00 H new ATOM 0 HD12 ILE A 103 7.041 -5.742 2.114 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.397 -6.212 2.606 1.00 0.00 H new ATOM 420 N GLU A 104 5.015 -2.697 5.544 1.00 0.00 N ATOM 421 CA GLU A 104 4.779 -1.574 6.444 1.00 0.00 C ATOM 422 C GLU A 104 6.015 -0.687 6.545 1.00 0.00 C ATOM 423 O GLU A 104 6.911 -0.755 5.703 1.00 0.00 O ATOM 424 CB GLU A 104 4.385 -2.076 7.834 1.00 0.00 C ATOM 425 CG GLU A 104 4.139 -3.575 7.898 1.00 0.00 C ATOM 426 CD GLU A 104 3.535 -4.010 9.218 1.00 0.00 C ATOM 427 OE1 GLU A 104 2.830 -3.193 9.847 1.00 0.00 O ATOM 428 OE2 GLU A 104 3.768 -5.168 9.625 1.00 0.00 O ATOM 0 H GLU A 104 5.514 -3.479 5.968 1.00 0.00 H new ATOM 0 HA GLU A 104 3.960 -0.983 6.034 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.173 -1.816 8.541 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.483 -1.555 8.156 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.474 -3.865 7.085 1.00 0.00 H new ATOM 0 HG3 GLU A 104 5.081 -4.101 7.743 1.00 0.00 H new ATOM 435 N VAL A 105 6.056 0.144 7.580 1.00 0.00 N ATOM 436 CA VAL A 105 7.180 1.045 7.794 1.00 0.00 C ATOM 437 C VAL A 105 8.441 0.274 8.172 1.00 0.00 C ATOM 438 O VAL A 105 8.370 -0.782 8.799 1.00 0.00 O ATOM 439 CB VAL A 105 6.873 2.073 8.896 1.00 0.00 C ATOM 440 CG1 VAL A 105 7.761 3.298 8.749 1.00 0.00 C ATOM 441 CG2 VAL A 105 5.403 2.462 8.867 1.00 0.00 C ATOM 0 H VAL A 105 5.322 0.212 8.285 1.00 0.00 H new ATOM 0 HA VAL A 105 7.347 1.569 6.853 1.00 0.00 H new ATOM 0 HB VAL A 105 7.085 1.616 9.863 1.00 0.00 H new ATOM 0 HG11 VAL A 105 7.528 4.013 9.538 1.00 0.00 H new ATOM 0 HG12 VAL A 105 8.807 3.001 8.826 1.00 0.00 H new ATOM 0 HG13 VAL A 105 7.586 3.760 7.777 1.00 0.00 H new ATOM 0 HG21 VAL A 105 5.204 3.190 9.653 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.161 2.899 7.898 1.00 0.00 H new ATOM 0 HG23 VAL A 105 4.789 1.576 9.029 1.00 0.00 H new ATOM 451 N GLY A 106 9.593 0.811 7.785 1.00 0.00 N ATOM 452 CA GLY A 106 10.853 0.160 8.092 1.00 0.00 C ATOM 453 C GLY A 106 11.038 -1.136 7.328 1.00 0.00 C ATOM 454 O GLY A 106 12.010 -1.858 7.543 1.00 0.00 O ATOM 0 H GLY A 106 9.677 1.684 7.265 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.675 0.837 7.857 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.902 -0.042 9.162 1.00 0.00 H new ATOM 458 N GLN A 107 10.101 -1.430 6.432 1.00 0.00 N ATOM 459 CA GLN A 107 10.164 -2.647 5.633 1.00 0.00 C ATOM 460 C GLN A 107 10.703 -2.344 4.233 1.00 0.00 C ATOM 461 O GLN A 107 10.468 -1.263 3.694 1.00 0.00 O ATOM 462 CB GLN A 107 8.775 -3.283 5.534 1.00 0.00 C ATOM 463 CG GLN A 107 8.792 -4.805 5.498 1.00 0.00 C ATOM 464 CD GLN A 107 9.605 -5.352 4.342 1.00 0.00 C ATOM 465 OE1 GLN A 107 10.682 -5.916 4.536 1.00 0.00 O ATOM 466 NE2 GLN A 107 9.093 -5.187 3.129 1.00 0.00 N ATOM 0 H GLN A 107 9.290 -0.842 6.242 1.00 0.00 H new ATOM 0 HA GLN A 107 10.842 -3.347 6.121 1.00 0.00 H new ATOM 0 HB2 GLN A 107 8.176 -2.957 6.384 1.00 0.00 H new ATOM 0 HB3 GLN A 107 8.281 -2.914 4.635 1.00 0.00 H new ATOM 0 HG2 GLN A 107 9.201 -5.182 6.435 1.00 0.00 H new ATOM 0 HG3 GLN A 107 7.769 -5.174 5.425 1.00 0.00 H new ATOM 0 HE21 GLN A 107 8.197 -4.714 3.014 1.00 0.00 H new ATOM 0 HE22 GLN A 107 9.595 -5.534 2.312 1.00 0.00 H new ATOM 475 N LYS A 108 11.425 -3.300 3.646 1.00 0.00 N ATOM 476 CA LYS A 108 11.986 -3.116 2.313 1.00 0.00 C ATOM 477 C LYS A 108 11.377 -4.107 1.326 1.00 0.00 C ATOM 478 O LYS A 108 11.048 -5.237 1.688 1.00 0.00 O ATOM 479 CB LYS A 108 13.506 -3.283 2.348 1.00 0.00 C ATOM 480 CG LYS A 108 14.152 -3.256 0.973 1.00 0.00 C ATOM 481 CD LYS A 108 15.275 -2.236 0.905 1.00 0.00 C ATOM 482 CE LYS A 108 16.438 -2.742 0.067 1.00 0.00 C ATOM 483 NZ LYS A 108 17.521 -3.319 0.911 1.00 0.00 N ATOM 0 H LYS A 108 11.632 -4.203 4.072 1.00 0.00 H new ATOM 0 HA LYS A 108 11.747 -2.106 1.982 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.937 -2.489 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 108 13.748 -4.227 2.836 1.00 0.00 H new ATOM 0 HG2 LYS A 108 14.543 -4.245 0.734 1.00 0.00 H new ATOM 0 HG3 LYS A 108 13.399 -3.020 0.221 1.00 0.00 H new ATOM 0 HD2 LYS A 108 14.897 -1.306 0.481 1.00 0.00 H new ATOM 0 HD3 LYS A 108 15.623 -2.009 1.913 1.00 0.00 H new ATOM 0 HE2 LYS A 108 16.080 -3.498 -0.631 1.00 0.00 H new ATOM 0 HE3 LYS A 108 16.840 -1.922 -0.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 18.295 -3.653 0.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 17.880 -2.591 1.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 17.145 -4.117 1.461 1.00 0.00 H new ATOM 497 N VAL A 109 11.230 -3.678 0.077 1.00 0.00 N ATOM 498 CA VAL A 109 10.660 -4.528 -0.961 1.00 0.00 C ATOM 499 C VAL A 109 11.194 -4.150 -2.339 1.00 0.00 C ATOM 500 O VAL A 109 11.137 -2.988 -2.741 1.00 0.00 O ATOM 501 CB VAL A 109 9.123 -4.440 -0.977 1.00 0.00 C ATOM 502 CG1 VAL A 109 8.672 -2.999 -1.162 1.00 0.00 C ATOM 503 CG2 VAL A 109 8.549 -5.330 -2.069 1.00 0.00 C ATOM 0 H VAL A 109 11.498 -2.746 -0.241 1.00 0.00 H new ATOM 0 HA VAL A 109 10.956 -5.551 -0.729 1.00 0.00 H new ATOM 0 HB VAL A 109 8.747 -4.793 -0.017 1.00 0.00 H new ATOM 0 HG11 VAL A 109 7.583 -2.957 -1.171 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.052 -2.391 -0.341 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.058 -2.616 -2.107 1.00 0.00 H new ATOM 0 HG21 VAL A 109 7.462 -5.255 -2.065 1.00 0.00 H new ATOM 0 HG22 VAL A 109 8.932 -5.010 -3.038 1.00 0.00 H new ATOM 0 HG23 VAL A 109 8.842 -6.364 -1.887 1.00 0.00 H new ATOM 513 N ASN A 110 11.711 -5.141 -3.059 1.00 0.00 N ATOM 514 CA ASN A 110 12.254 -4.914 -4.393 1.00 0.00 C ATOM 515 C ASN A 110 11.161 -5.029 -5.450 1.00 0.00 C ATOM 516 O ASN A 110 10.156 -5.712 -5.246 1.00 0.00 O ATOM 517 CB ASN A 110 13.371 -5.915 -4.687 1.00 0.00 C ATOM 518 CG ASN A 110 12.924 -7.352 -4.503 1.00 0.00 C ATOM 519 OD1 ASN A 110 11.773 -7.616 -4.152 1.00 0.00 O ATOM 520 ND2 ASN A 110 13.832 -8.292 -4.737 1.00 0.00 N ATOM 0 H ASN A 110 11.765 -6.109 -2.741 1.00 0.00 H new ATOM 0 HA ASN A 110 12.663 -3.904 -4.426 1.00 0.00 H new ATOM 0 HB2 ASN A 110 13.721 -5.775 -5.710 1.00 0.00 H new ATOM 0 HB3 ASN A 110 14.217 -5.714 -4.030 1.00 0.00 H new ATOM 0 HD21 ASN A 110 13.587 -9.276 -4.628 1.00 0.00 H new ATOM 0 HD22 ASN A 110 14.774 -8.030 -5.026 1.00 0.00 H new ATOM 527 N VAL A 111 11.361 -4.358 -6.579 1.00 0.00 N ATOM 528 CA VAL A 111 10.389 -4.387 -7.666 1.00 0.00 C ATOM 529 C VAL A 111 10.019 -5.821 -8.031 1.00 0.00 C ATOM 530 O VAL A 111 10.891 -6.652 -8.284 1.00 0.00 O ATOM 531 CB VAL A 111 10.925 -3.673 -8.922 1.00 0.00 C ATOM 532 CG1 VAL A 111 9.988 -3.893 -10.100 1.00 0.00 C ATOM 533 CG2 VAL A 111 11.113 -2.187 -8.652 1.00 0.00 C ATOM 0 H VAL A 111 12.186 -3.788 -6.765 1.00 0.00 H new ATOM 0 HA VAL A 111 9.502 -3.862 -7.311 1.00 0.00 H new ATOM 0 HB VAL A 111 11.896 -4.099 -9.174 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.382 -3.382 -10.979 1.00 0.00 H new ATOM 0 HG12 VAL A 111 9.908 -4.960 -10.307 1.00 0.00 H new ATOM 0 HG13 VAL A 111 9.002 -3.495 -9.860 1.00 0.00 H new ATOM 0 HG21 VAL A 111 11.492 -1.699 -9.550 1.00 0.00 H new ATOM 0 HG22 VAL A 111 10.157 -1.744 -8.374 1.00 0.00 H new ATOM 0 HG23 VAL A 111 11.825 -2.052 -7.838 1.00 0.00 H new ATOM 543 N GLY A 112 8.721 -6.103 -8.054 1.00 0.00 N ATOM 544 CA GLY A 112 8.259 -7.437 -8.389 1.00 0.00 C ATOM 545 C GLY A 112 7.715 -8.182 -7.187 1.00 0.00 C ATOM 546 O GLY A 112 7.330 -9.346 -7.291 1.00 0.00 O ATOM 0 H GLY A 112 7.981 -5.432 -7.847 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.483 -7.368 -9.151 1.00 0.00 H new ATOM 0 HA3 GLY A 112 9.082 -8.005 -8.822 1.00 0.00 H new ATOM 550 N ASP A 113 7.685 -7.509 -6.040 1.00 0.00 N ATOM 551 CA ASP A 113 7.186 -8.114 -4.811 1.00 0.00 C ATOM 552 C ASP A 113 5.823 -7.542 -4.436 1.00 0.00 C ATOM 553 O ASP A 113 5.394 -6.524 -4.980 1.00 0.00 O ATOM 554 CB ASP A 113 8.176 -7.894 -3.670 1.00 0.00 C ATOM 555 CG ASP A 113 8.817 -9.186 -3.203 1.00 0.00 C ATOM 556 OD1 ASP A 113 8.123 -10.224 -3.194 1.00 0.00 O ATOM 557 OD2 ASP A 113 10.014 -9.160 -2.846 1.00 0.00 O ATOM 0 H ASP A 113 8.001 -6.545 -5.937 1.00 0.00 H new ATOM 0 HA ASP A 113 7.075 -9.185 -4.983 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.954 -7.203 -3.996 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.662 -7.423 -2.832 1.00 0.00 H new ATOM 562 N THR A 114 5.146 -8.203 -3.502 1.00 0.00 N ATOM 563 CA THR A 114 3.830 -7.760 -3.053 1.00 0.00 C ATOM 564 C THR A 114 3.915 -6.398 -2.372 1.00 0.00 C ATOM 565 O THR A 114 4.994 -5.955 -1.980 1.00 0.00 O ATOM 566 CB THR A 114 3.224 -8.785 -2.093 1.00 0.00 C ATOM 567 OG1 THR A 114 3.205 -10.073 -2.682 1.00 0.00 O ATOM 568 CG2 THR A 114 1.809 -8.449 -1.676 1.00 0.00 C ATOM 0 H THR A 114 5.487 -9.047 -3.041 1.00 0.00 H new ATOM 0 HA THR A 114 3.188 -7.668 -3.929 1.00 0.00 H new ATOM 0 HB THR A 114 3.860 -8.765 -1.208 1.00 0.00 H new ATOM 0 HG1 THR A 114 2.815 -10.715 -2.052 1.00 0.00 H new ATOM 0 HG21 THR A 114 1.438 -9.216 -0.996 1.00 0.00 H new ATOM 0 HG22 THR A 114 1.798 -7.482 -1.174 1.00 0.00 H new ATOM 0 HG23 THR A 114 1.170 -8.407 -2.558 1.00 0.00 H new ATOM 576 N LEU A 115 2.769 -5.739 -2.235 1.00 0.00 N ATOM 577 CA LEU A 115 2.711 -4.427 -1.602 1.00 0.00 C ATOM 578 C LEU A 115 1.546 -4.349 -0.621 1.00 0.00 C ATOM 579 O LEU A 115 1.744 -4.352 0.596 1.00 0.00 O ATOM 580 CB LEU A 115 2.574 -3.331 -2.661 1.00 0.00 C ATOM 581 CG LEU A 115 2.373 -1.919 -2.108 1.00 0.00 C ATOM 582 CD1 LEU A 115 3.710 -1.211 -1.955 1.00 0.00 C ATOM 583 CD2 LEU A 115 1.445 -1.121 -3.010 1.00 0.00 C ATOM 0 H LEU A 115 1.867 -6.093 -2.554 1.00 0.00 H new ATOM 0 HA LEU A 115 3.639 -4.276 -1.051 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.467 -3.337 -3.286 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.731 -3.575 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 115 1.912 -1.997 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.548 -0.208 -1.560 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.343 -1.773 -1.268 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.199 -1.144 -2.927 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.313 -0.119 -2.601 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.878 -1.052 -4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.477 -1.619 -3.068 1.00 0.00 H new ATOM 595 N CYS A 116 0.332 -4.278 -1.156 1.00 0.00 N ATOM 596 CA CYS A 116 -0.866 -4.199 -0.329 1.00 0.00 C ATOM 597 C CYS A 116 -2.125 -4.335 -1.182 1.00 0.00 C ATOM 598 O CYS A 116 -2.066 -4.256 -2.409 1.00 0.00 O ATOM 599 CB CYS A 116 -0.895 -2.876 0.439 1.00 0.00 C ATOM 600 SG CYS A 116 -0.395 -3.019 2.171 1.00 0.00 S ATOM 0 H CYS A 116 0.152 -4.274 -2.160 1.00 0.00 H new ATOM 0 HA CYS A 116 -0.841 -5.023 0.384 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -0.238 -2.164 -0.060 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -1.903 -2.465 0.396 1.00 0.00 H new ATOM 0 HG CYS A 116 -0.663 -1.909 2.793 1.00 0.00 H new ATOM 606 N ILE A 117 -3.261 -4.541 -0.524 1.00 0.00 N ATOM 607 CA ILE A 117 -4.532 -4.691 -1.222 1.00 0.00 C ATOM 608 C ILE A 117 -5.416 -3.462 -1.040 1.00 0.00 C ATOM 609 O ILE A 117 -5.483 -2.887 0.045 1.00 0.00 O ATOM 610 CB ILE A 117 -5.306 -5.931 -0.725 1.00 0.00 C ATOM 611 CG1 ILE A 117 -4.597 -7.214 -1.145 1.00 0.00 C ATOM 612 CG2 ILE A 117 -6.727 -5.921 -1.262 1.00 0.00 C ATOM 613 CD1 ILE A 117 -4.515 -8.243 -0.039 1.00 0.00 C ATOM 0 H ILE A 117 -3.327 -4.608 0.492 1.00 0.00 H new ATOM 0 HA ILE A 117 -4.292 -4.812 -2.278 1.00 0.00 H new ATOM 0 HB ILE A 117 -5.341 -5.895 0.364 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -5.120 -7.648 -1.997 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -3.589 -6.971 -1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.258 -6.802 -0.902 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -7.240 -5.023 -0.918 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -6.704 -5.931 -2.352 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -3.999 -9.131 -0.405 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -3.966 -7.827 0.805 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -5.521 -8.514 0.281 1.00 0.00 H new ATOM 625 N VAL A 118 -6.106 -3.076 -2.108 1.00 0.00 N ATOM 626 CA VAL A 118 -7.001 -1.929 -2.066 1.00 0.00 C ATOM 627 C VAL A 118 -8.391 -2.363 -1.617 1.00 0.00 C ATOM 628 O VAL A 118 -9.164 -1.568 -1.083 1.00 0.00 O ATOM 629 CB VAL A 118 -7.108 -1.243 -3.441 1.00 0.00 C ATOM 630 CG1 VAL A 118 -7.795 0.107 -3.315 1.00 0.00 C ATOM 631 CG2 VAL A 118 -5.731 -1.092 -4.070 1.00 0.00 C ATOM 0 H VAL A 118 -6.061 -3.543 -3.014 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.585 -1.216 -1.354 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.714 -1.872 -4.093 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.861 0.575 -4.297 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.798 -0.031 -2.911 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.220 0.747 -2.646 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -5.826 -0.605 -5.041 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -5.099 -0.486 -3.421 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.280 -2.076 -4.200 1.00 0.00 H new ATOM 641 N GLU A 119 -8.693 -3.638 -1.838 1.00 0.00 N ATOM 642 CA GLU A 119 -9.981 -4.206 -1.460 1.00 0.00 C ATOM 643 C GLU A 119 -11.135 -3.392 -2.034 1.00 0.00 C ATOM 644 O GLU A 119 -12.148 -3.180 -1.369 1.00 0.00 O ATOM 645 CB GLU A 119 -10.103 -4.281 0.062 1.00 0.00 C ATOM 646 CG GLU A 119 -11.458 -4.781 0.541 1.00 0.00 C ATOM 647 CD GLU A 119 -12.186 -3.762 1.396 1.00 0.00 C ATOM 648 OE1 GLU A 119 -12.447 -2.647 0.897 1.00 0.00 O ATOM 649 OE2 GLU A 119 -12.496 -4.080 2.564 1.00 0.00 O ATOM 0 H GLU A 119 -8.057 -4.302 -2.281 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.035 -5.213 -1.874 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.325 -4.939 0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.921 -3.292 0.482 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -12.074 -5.032 -0.322 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -11.321 -5.699 1.113 1.00 0.00 H new ATOM 656 N ALA A 120 -10.980 -2.946 -3.275 1.00 0.00 N ATOM 657 CA ALA A 120 -12.016 -2.164 -3.937 1.00 0.00 C ATOM 658 C ALA A 120 -13.205 -3.046 -4.300 1.00 0.00 C ATOM 659 O ALA A 120 -13.111 -3.893 -5.187 1.00 0.00 O ATOM 660 CB ALA A 120 -11.456 -1.487 -5.179 1.00 0.00 C ATOM 0 H ALA A 120 -10.148 -3.112 -3.842 1.00 0.00 H new ATOM 0 HA ALA A 120 -12.360 -1.393 -3.247 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -12.242 -0.907 -5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -10.638 -0.825 -4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -11.086 -2.244 -5.871 1.00 0.00 H new ATOM 666 N MET A 121 -14.319 -2.846 -3.602 1.00 0.00 N ATOM 667 CA MET A 121 -15.525 -3.631 -3.847 1.00 0.00 C ATOM 668 C MET A 121 -15.214 -5.122 -3.802 1.00 0.00 C ATOM 669 O MET A 121 -15.746 -5.903 -4.590 1.00 0.00 O ATOM 670 CB MET A 121 -16.140 -3.261 -5.199 1.00 0.00 C ATOM 671 CG MET A 121 -15.372 -3.809 -6.391 1.00 0.00 C ATOM 672 SD MET A 121 -16.439 -4.162 -7.801 1.00 0.00 S ATOM 673 CE MET A 121 -15.998 -5.865 -8.140 1.00 0.00 C ATOM 0 H MET A 121 -14.412 -2.149 -2.864 1.00 0.00 H new ATOM 0 HA MET A 121 -16.245 -3.403 -3.061 1.00 0.00 H new ATOM 0 HB2 MET A 121 -17.164 -3.633 -5.236 1.00 0.00 H new ATOM 0 HB3 MET A 121 -16.192 -2.175 -5.280 1.00 0.00 H new ATOM 0 HG2 MET A 121 -14.609 -3.090 -6.689 1.00 0.00 H new ATOM 0 HG3 MET A 121 -14.853 -4.721 -6.096 1.00 0.00 H new ATOM 0 HE1 MET A 121 -16.576 -6.228 -8.990 1.00 0.00 H new ATOM 0 HE2 MET A 121 -14.935 -5.926 -8.372 1.00 0.00 H new ATOM 0 HE3 MET A 121 -16.215 -6.478 -7.265 1.00 0.00 H new ATOM 683 N LYS A 122 -14.345 -5.509 -2.872 1.00 0.00 N ATOM 684 CA LYS A 122 -13.957 -6.905 -2.720 1.00 0.00 C ATOM 685 C LYS A 122 -13.207 -7.394 -3.953 1.00 0.00 C ATOM 686 O LYS A 122 -13.537 -8.435 -4.522 1.00 0.00 O ATOM 687 CB LYS A 122 -15.188 -7.778 -2.475 1.00 0.00 C ATOM 688 CG LYS A 122 -14.865 -9.125 -1.851 1.00 0.00 C ATOM 689 CD LYS A 122 -13.990 -8.973 -0.618 1.00 0.00 C ATOM 690 CE LYS A 122 -14.456 -7.820 0.258 1.00 0.00 C ATOM 691 NZ LYS A 122 -13.562 -7.598 1.391 1.00 0.00 N ATOM 0 H LYS A 122 -13.897 -4.873 -2.212 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.294 -6.981 -1.858 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.879 -7.242 -1.824 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.702 -7.940 -3.422 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.791 -9.633 -1.581 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -14.358 -9.754 -2.583 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.007 -9.898 -0.042 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.957 -8.806 -0.922 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.515 -6.911 -0.341 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -15.462 -8.027 0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -14.046 -7.019 2.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.296 -8.513 1.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.706 -7.104 1.066 1.00 0.00 H new ATOM 702 N MET A 123 -12.199 -6.634 -4.361 1.00 0.00 N ATOM 703 CA MET A 123 -11.400 -6.983 -5.529 1.00 0.00 C ATOM 704 C MET A 123 -10.096 -7.657 -5.112 1.00 0.00 C ATOM 705 O MET A 123 -9.463 -8.351 -5.907 1.00 0.00 O ATOM 706 CB MET A 123 -11.115 -5.727 -6.363 1.00 0.00 C ATOM 707 CG MET A 123 -9.802 -5.775 -7.128 1.00 0.00 C ATOM 708 SD MET A 123 -9.691 -4.503 -8.399 1.00 0.00 S ATOM 709 CE MET A 123 -9.504 -3.032 -7.393 1.00 0.00 C ATOM 0 H MET A 123 -11.915 -5.770 -3.899 1.00 0.00 H new ATOM 0 HA MET A 123 -11.964 -7.690 -6.138 1.00 0.00 H new ATOM 0 HB2 MET A 123 -11.931 -5.581 -7.071 1.00 0.00 H new ATOM 0 HB3 MET A 123 -11.107 -4.860 -5.703 1.00 0.00 H new ATOM 0 HG2 MET A 123 -8.974 -5.657 -6.429 1.00 0.00 H new ATOM 0 HG3 MET A 123 -9.691 -6.756 -7.591 1.00 0.00 H new ATOM 0 HE1 MET A 123 -10.319 -2.340 -7.606 1.00 0.00 H new ATOM 0 HE2 MET A 123 -9.527 -3.307 -6.339 1.00 0.00 H new ATOM 0 HE3 MET A 123 -8.552 -2.553 -7.622 1.00 0.00 H new ATOM 719 N MET A 124 -9.698 -7.449 -3.860 1.00 0.00 N ATOM 720 CA MET A 124 -8.470 -8.036 -3.343 1.00 0.00 C ATOM 721 C MET A 124 -7.306 -7.783 -4.293 1.00 0.00 C ATOM 722 O MET A 124 -6.445 -8.643 -4.478 1.00 0.00 O ATOM 723 CB MET A 124 -8.650 -9.540 -3.124 1.00 0.00 C ATOM 724 CG MET A 124 -9.966 -9.904 -2.456 1.00 0.00 C ATOM 725 SD MET A 124 -9.826 -10.017 -0.662 1.00 0.00 S ATOM 726 CE MET A 124 -10.496 -8.432 -0.168 1.00 0.00 C ATOM 0 H MET A 124 -10.209 -6.878 -3.187 1.00 0.00 H new ATOM 0 HA MET A 124 -8.245 -7.563 -2.387 1.00 0.00 H new ATOM 0 HB2 MET A 124 -8.587 -10.049 -4.086 1.00 0.00 H new ATOM 0 HB3 MET A 124 -7.827 -9.911 -2.513 1.00 0.00 H new ATOM 0 HG2 MET A 124 -10.718 -9.157 -2.712 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.317 -10.858 -2.850 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.699 -7.812 0.242 1.00 0.00 H new ATOM 0 HE2 MET A 124 -10.933 -7.936 -1.034 1.00 0.00 H new ATOM 0 HE3 MET A 124 -11.265 -8.582 0.590 1.00 0.00 H new ATOM 736 N ASN A 125 -7.284 -6.597 -4.891 1.00 0.00 N ATOM 737 CA ASN A 125 -6.219 -6.234 -5.820 1.00 0.00 C ATOM 738 C ASN A 125 -4.955 -5.854 -5.060 1.00 0.00 C ATOM 739 O ASN A 125 -4.709 -4.678 -4.789 1.00 0.00 O ATOM 740 CB ASN A 125 -6.655 -5.076 -6.720 1.00 0.00 C ATOM 741 CG ASN A 125 -7.205 -3.903 -5.933 1.00 0.00 C ATOM 742 OD1 ASN A 125 -7.925 -4.083 -4.951 1.00 0.00 O ATOM 743 ND2 ASN A 125 -6.865 -2.693 -6.362 1.00 0.00 N ATOM 0 H ASN A 125 -7.988 -5.873 -4.750 1.00 0.00 H new ATOM 0 HA ASN A 125 -6.007 -7.101 -6.446 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -5.805 -4.743 -7.315 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -7.414 -5.429 -7.418 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -7.203 -1.865 -5.872 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -6.266 -2.592 -7.181 1.00 0.00 H new ATOM 750 N GLN A 126 -4.158 -6.858 -4.715 1.00 0.00 N ATOM 751 CA GLN A 126 -2.921 -6.634 -3.982 1.00 0.00 C ATOM 752 C GLN A 126 -1.821 -6.124 -4.909 1.00 0.00 C ATOM 753 O GLN A 126 -1.333 -6.853 -5.773 1.00 0.00 O ATOM 754 CB GLN A 126 -2.478 -7.925 -3.292 1.00 0.00 C ATOM 755 CG GLN A 126 -1.998 -9.000 -4.254 1.00 0.00 C ATOM 756 CD GLN A 126 -0.511 -9.272 -4.130 1.00 0.00 C ATOM 757 OE1 GLN A 126 -0.024 -9.643 -3.062 1.00 0.00 O ATOM 758 NE2 GLN A 126 0.218 -9.090 -5.225 1.00 0.00 N ATOM 0 H GLN A 126 -4.348 -7.836 -4.932 1.00 0.00 H new ATOM 0 HA GLN A 126 -3.105 -5.872 -3.225 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -1.677 -7.694 -2.590 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.310 -8.318 -2.708 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -2.549 -9.922 -4.067 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -2.224 -8.695 -5.276 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -0.228 -8.782 -6.089 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.224 -9.259 -5.202 1.00 0.00 H new ATOM 767 N ILE A 127 -1.439 -4.865 -4.726 1.00 0.00 N ATOM 768 CA ILE A 127 -0.401 -4.253 -5.546 1.00 0.00 C ATOM 769 C ILE A 127 0.967 -4.857 -5.249 1.00 0.00 C ATOM 770 O ILE A 127 1.197 -5.401 -4.169 1.00 0.00 O ATOM 771 CB ILE A 127 -0.335 -2.730 -5.324 1.00 0.00 C ATOM 772 CG1 ILE A 127 -1.726 -2.110 -5.468 1.00 0.00 C ATOM 773 CG2 ILE A 127 0.639 -2.094 -6.304 1.00 0.00 C ATOM 774 CD1 ILE A 127 -2.560 -2.743 -6.561 1.00 0.00 C ATOM 0 H ILE A 127 -1.833 -4.248 -4.016 1.00 0.00 H new ATOM 0 HA ILE A 127 -0.664 -4.452 -6.585 1.00 0.00 H new ATOM 0 HB ILE A 127 0.023 -2.541 -4.312 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -2.255 -2.201 -4.520 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -1.621 -1.045 -5.673 1.00 0.00 H new ATOM 0 HG21 ILE A 127 0.675 -1.018 -6.135 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.632 -2.518 -6.156 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.309 -2.290 -7.324 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.533 -2.254 -6.606 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -2.052 -2.629 -7.519 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.697 -3.803 -6.347 1.00 0.00 H new ATOM 786 N GLU A 128 1.873 -4.755 -6.217 1.00 0.00 N ATOM 787 CA GLU A 128 3.221 -5.289 -6.065 1.00 0.00 C ATOM 788 C GLU A 128 4.265 -4.204 -6.310 1.00 0.00 C ATOM 789 O GLU A 128 4.427 -3.729 -7.434 1.00 0.00 O ATOM 790 CB GLU A 128 3.442 -6.454 -7.032 1.00 0.00 C ATOM 791 CG GLU A 128 2.256 -7.400 -7.125 1.00 0.00 C ATOM 792 CD GLU A 128 1.672 -7.469 -8.523 1.00 0.00 C ATOM 793 OE1 GLU A 128 2.020 -6.604 -9.354 1.00 0.00 O ATOM 794 OE2 GLU A 128 0.868 -8.388 -8.785 1.00 0.00 O ATOM 0 H GLU A 128 1.697 -4.307 -7.116 1.00 0.00 H new ATOM 0 HA GLU A 128 3.330 -5.650 -5.042 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.658 -6.056 -8.024 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.321 -7.016 -6.716 1.00 0.00 H new ATOM 0 HG2 GLU A 128 2.567 -8.398 -6.816 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.483 -7.077 -6.428 1.00 0.00 H new ATOM 801 N ALA A 129 4.970 -3.816 -5.251 1.00 0.00 N ATOM 802 CA ALA A 129 5.998 -2.787 -5.351 1.00 0.00 C ATOM 803 C ALA A 129 6.727 -2.864 -6.688 1.00 0.00 C ATOM 804 O ALA A 129 7.188 -3.930 -7.094 1.00 0.00 O ATOM 805 CB ALA A 129 6.986 -2.917 -4.201 1.00 0.00 C ATOM 0 H ALA A 129 4.847 -4.199 -4.314 1.00 0.00 H new ATOM 0 HA ALA A 129 5.510 -1.814 -5.290 1.00 0.00 H new ATOM 0 HB1 ALA A 129 7.749 -2.143 -4.287 1.00 0.00 H new ATOM 0 HB2 ALA A 129 6.459 -2.803 -3.254 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.459 -3.898 -4.237 1.00 0.00 H new ATOM 811 N ASP A 130 6.829 -1.727 -7.366 1.00 0.00 N ATOM 812 CA ASP A 130 7.503 -1.664 -8.659 1.00 0.00 C ATOM 813 C ASP A 130 8.461 -0.480 -8.716 1.00 0.00 C ATOM 814 O ASP A 130 8.587 0.181 -9.748 1.00 0.00 O ATOM 815 CB ASP A 130 6.477 -1.559 -9.789 1.00 0.00 C ATOM 816 CG ASP A 130 5.425 -0.502 -9.517 1.00 0.00 C ATOM 817 OD1 ASP A 130 5.314 -0.060 -8.354 1.00 0.00 O ATOM 818 OD2 ASP A 130 4.712 -0.115 -10.467 1.00 0.00 O ATOM 0 H ASP A 130 6.454 -0.835 -7.043 1.00 0.00 H new ATOM 0 HA ASP A 130 8.079 -2.581 -8.785 1.00 0.00 H new ATOM 0 HB2 ASP A 130 6.990 -1.325 -10.722 1.00 0.00 H new ATOM 0 HB3 ASP A 130 5.991 -2.525 -9.926 1.00 0.00 H new ATOM 823 N LYS A 131 9.135 -0.217 -7.602 1.00 0.00 N ATOM 824 CA LYS A 131 10.083 0.889 -7.526 1.00 0.00 C ATOM 825 C LYS A 131 11.420 0.420 -6.961 1.00 0.00 C ATOM 826 O LYS A 131 12.481 0.867 -7.398 1.00 0.00 O ATOM 827 CB LYS A 131 9.515 2.014 -6.659 1.00 0.00 C ATOM 828 CG LYS A 131 9.558 3.378 -7.328 1.00 0.00 C ATOM 829 CD LYS A 131 8.423 3.544 -8.327 1.00 0.00 C ATOM 830 CE LYS A 131 8.893 4.250 -9.589 1.00 0.00 C ATOM 831 NZ LYS A 131 8.924 5.729 -9.419 1.00 0.00 N ATOM 0 H LYS A 131 9.043 -0.754 -6.740 1.00 0.00 H new ATOM 0 HA LYS A 131 10.248 1.266 -8.535 1.00 0.00 H new ATOM 0 HB2 LYS A 131 8.483 1.777 -6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.074 2.059 -5.725 1.00 0.00 H new ATOM 0 HG2 LYS A 131 9.494 4.159 -6.570 1.00 0.00 H new ATOM 0 HG3 LYS A 131 10.514 3.505 -7.837 1.00 0.00 H new ATOM 0 HD2 LYS A 131 8.018 2.566 -8.585 1.00 0.00 H new ATOM 0 HD3 LYS A 131 7.614 4.114 -7.870 1.00 0.00 H new ATOM 0 HE2 LYS A 131 9.888 3.894 -9.855 1.00 0.00 H new ATOM 0 HE3 LYS A 131 8.231 3.993 -10.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 9.250 6.173 -10.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 7.969 6.072 -9.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 9.575 5.976 -8.646 1.00 0.00 H new ATOM 845 N SER A 132 11.361 -0.482 -5.988 1.00 0.00 N ATOM 846 CA SER A 132 12.567 -1.012 -5.363 1.00 0.00 C ATOM 847 C SER A 132 13.171 0.006 -4.401 1.00 0.00 C ATOM 848 O SER A 132 14.034 0.797 -4.781 1.00 0.00 O ATOM 849 CB SER A 132 13.595 -1.395 -6.429 1.00 0.00 C ATOM 850 OG SER A 132 14.643 -2.169 -5.872 1.00 0.00 O ATOM 0 H SER A 132 10.491 -0.862 -5.615 1.00 0.00 H new ATOM 0 HA SER A 132 12.292 -1.903 -4.798 1.00 0.00 H new ATOM 0 HB2 SER A 132 13.106 -1.958 -7.224 1.00 0.00 H new ATOM 0 HB3 SER A 132 14.006 -0.493 -6.883 1.00 0.00 H new ATOM 0 HG SER A 132 15.286 -2.402 -6.574 1.00 0.00 H new ATOM 856 N GLY A 133 12.711 -0.021 -3.155 1.00 0.00 N ATOM 857 CA GLY A 133 13.218 0.903 -2.158 1.00 0.00 C ATOM 858 C GLY A 133 12.740 0.566 -0.760 1.00 0.00 C ATOM 859 O GLY A 133 12.191 -0.511 -0.527 1.00 0.00 O ATOM 0 H GLY A 133 11.996 -0.666 -2.818 1.00 0.00 H new ATOM 0 HA2 GLY A 133 14.308 0.893 -2.178 1.00 0.00 H new ATOM 0 HA3 GLY A 133 12.904 1.915 -2.412 1.00 0.00 H new ATOM 863 N THR A 134 12.948 1.489 0.173 1.00 0.00 N ATOM 864 CA THR A 134 12.534 1.285 1.556 1.00 0.00 C ATOM 865 C THR A 134 11.278 2.091 1.871 1.00 0.00 C ATOM 866 O THR A 134 11.127 3.225 1.417 1.00 0.00 O ATOM 867 CB THR A 134 13.662 1.680 2.511 1.00 0.00 C ATOM 868 OG1 THR A 134 14.889 1.100 2.104 1.00 0.00 O ATOM 869 CG2 THR A 134 13.408 1.262 3.943 1.00 0.00 C ATOM 0 H THR A 134 13.401 2.386 -0.004 1.00 0.00 H new ATOM 0 HA THR A 134 12.308 0.227 1.690 1.00 0.00 H new ATOM 0 HB THR A 134 13.707 2.768 2.471 1.00 0.00 H new ATOM 0 HG1 THR A 134 15.598 1.365 2.726 1.00 0.00 H new ATOM 0 HG21 THR A 134 14.246 1.573 4.567 1.00 0.00 H new ATOM 0 HG22 THR A 134 12.493 1.733 4.303 1.00 0.00 H new ATOM 0 HG23 THR A 134 13.301 0.178 3.992 1.00 0.00 H new ATOM 877 N VAL A 135 10.380 1.498 2.651 1.00 0.00 N ATOM 878 CA VAL A 135 9.137 2.163 3.026 1.00 0.00 C ATOM 879 C VAL A 135 9.354 3.111 4.200 1.00 0.00 C ATOM 880 O VAL A 135 9.703 2.682 5.300 1.00 0.00 O ATOM 881 CB VAL A 135 8.044 1.144 3.401 1.00 0.00 C ATOM 882 CG1 VAL A 135 6.724 1.848 3.673 1.00 0.00 C ATOM 883 CG2 VAL A 135 7.883 0.104 2.301 1.00 0.00 C ATOM 0 H VAL A 135 10.489 0.560 3.035 1.00 0.00 H new ATOM 0 HA VAL A 135 8.809 2.733 2.156 1.00 0.00 H new ATOM 0 HB VAL A 135 8.351 0.632 4.313 1.00 0.00 H new ATOM 0 HG11 VAL A 135 5.966 1.110 3.936 1.00 0.00 H new ATOM 0 HG12 VAL A 135 6.849 2.550 4.498 1.00 0.00 H new ATOM 0 HG13 VAL A 135 6.410 2.389 2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 135 7.107 -0.607 2.583 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.601 0.598 1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 135 8.826 -0.425 2.160 1.00 0.00 H new ATOM 893 N LYS A 136 9.143 4.400 3.959 1.00 0.00 N ATOM 894 CA LYS A 136 9.314 5.409 4.998 1.00 0.00 C ATOM 895 C LYS A 136 8.217 5.293 6.052 1.00 0.00 C ATOM 896 O LYS A 136 8.474 5.441 7.247 1.00 0.00 O ATOM 897 CB LYS A 136 9.305 6.810 4.386 1.00 0.00 C ATOM 898 CG LYS A 136 10.568 7.605 4.666 1.00 0.00 C ATOM 899 CD LYS A 136 11.810 6.737 4.545 1.00 0.00 C ATOM 900 CE LYS A 136 12.474 6.524 5.896 1.00 0.00 C ATOM 901 NZ LYS A 136 13.910 6.918 5.877 1.00 0.00 N ATOM 0 H LYS A 136 8.853 4.771 3.054 1.00 0.00 H new ATOM 0 HA LYS A 136 10.277 5.239 5.480 1.00 0.00 H new ATOM 0 HB2 LYS A 136 9.171 6.725 3.308 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.447 7.360 4.772 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.636 8.439 3.968 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.517 8.031 5.668 1.00 0.00 H new ATOM 0 HD2 LYS A 136 11.541 5.772 4.115 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.517 7.205 3.860 1.00 0.00 H new ATOM 0 HE2 LYS A 136 11.948 7.104 6.654 1.00 0.00 H new ATOM 0 HE3 LYS A 136 12.389 5.475 6.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 14.326 6.758 6.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 14.417 6.347 5.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 13.990 7.925 5.630 1.00 0.00 H new ATOM 915 N ALA A 137 6.996 5.026 5.601 1.00 0.00 N ATOM 916 CA ALA A 137 5.862 4.889 6.506 1.00 0.00 C ATOM 917 C ALA A 137 4.540 4.928 5.748 1.00 0.00 C ATOM 918 O ALA A 137 4.512 5.152 4.538 1.00 0.00 O ATOM 919 CB ALA A 137 5.895 5.983 7.562 1.00 0.00 C ATOM 0 H ALA A 137 6.767 4.900 4.615 1.00 0.00 H new ATOM 0 HA ALA A 137 5.940 3.919 6.996 1.00 0.00 H new ATOM 0 HB1 ALA A 137 5.042 5.869 8.231 1.00 0.00 H new ATOM 0 HB2 ALA A 137 6.819 5.907 8.135 1.00 0.00 H new ATOM 0 HB3 ALA A 137 5.848 6.958 7.077 1.00 0.00 H new ATOM 925 N ILE A 138 3.446 4.709 6.469 1.00 0.00 N ATOM 926 CA ILE A 138 2.119 4.719 5.868 1.00 0.00 C ATOM 927 C ILE A 138 1.237 5.786 6.509 1.00 0.00 C ATOM 928 O ILE A 138 1.247 5.966 7.726 1.00 0.00 O ATOM 929 CB ILE A 138 1.428 3.345 6.004 1.00 0.00 C ATOM 930 CG1 ILE A 138 2.090 2.324 5.076 1.00 0.00 C ATOM 931 CG2 ILE A 138 -0.060 3.460 5.700 1.00 0.00 C ATOM 932 CD1 ILE A 138 1.257 1.079 4.853 1.00 0.00 C ATOM 0 H ILE A 138 3.453 4.522 7.472 1.00 0.00 H new ATOM 0 HA ILE A 138 2.251 4.946 4.810 1.00 0.00 H new ATOM 0 HB ILE A 138 1.539 3.002 7.033 1.00 0.00 H new ATOM 0 HG12 ILE A 138 2.289 2.795 4.114 1.00 0.00 H new ATOM 0 HG13 ILE A 138 3.054 2.036 5.495 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -0.529 2.481 5.801 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -0.521 4.157 6.399 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -0.196 3.824 4.682 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.788 0.400 4.186 1.00 0.00 H new ATOM 0 HD12 ILE A 138 1.080 0.584 5.808 1.00 0.00 H new ATOM 0 HD13 ILE A 138 0.303 1.355 4.405 1.00 0.00 H new ATOM 944 N LEU A 139 0.469 6.488 5.680 1.00 0.00 N ATOM 945 CA LEU A 139 -0.425 7.531 6.166 1.00 0.00 C ATOM 946 C LEU A 139 -1.860 7.027 6.196 1.00 0.00 C ATOM 947 O LEU A 139 -2.575 7.205 7.182 1.00 0.00 O ATOM 948 CB LEU A 139 -0.335 8.770 5.277 1.00 0.00 C ATOM 949 CG LEU A 139 0.778 9.751 5.643 1.00 0.00 C ATOM 950 CD1 LEU A 139 0.640 10.199 7.089 1.00 0.00 C ATOM 951 CD2 LEU A 139 2.141 9.120 5.405 1.00 0.00 C ATOM 0 H LEU A 139 0.449 6.352 4.669 1.00 0.00 H new ATOM 0 HA LEU A 139 -0.119 7.798 7.178 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -0.190 8.448 4.246 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -1.289 9.296 5.316 1.00 0.00 H new ATOM 0 HG LEU A 139 0.689 10.629 5.003 1.00 0.00 H new ATOM 0 HD11 LEU A 139 1.441 10.897 7.332 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.323 10.690 7.227 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.703 9.332 7.746 1.00 0.00 H new ATOM 0 HD21 LEU A 139 2.923 9.832 5.671 1.00 0.00 H new ATOM 0 HD22 LEU A 139 2.240 8.226 6.020 1.00 0.00 H new ATOM 0 HD23 LEU A 139 2.238 8.850 4.354 1.00 0.00 H new ATOM 963 N VAL A 140 -2.272 6.398 5.103 1.00 0.00 N ATOM 964 CA VAL A 140 -3.620 5.865 4.993 1.00 0.00 C ATOM 965 C VAL A 140 -4.010 5.097 6.249 1.00 0.00 C ATOM 966 O VAL A 140 -3.318 4.169 6.665 1.00 0.00 O ATOM 967 CB VAL A 140 -3.761 4.943 3.765 1.00 0.00 C ATOM 968 CG1 VAL A 140 -5.045 4.129 3.843 1.00 0.00 C ATOM 969 CG2 VAL A 140 -3.722 5.761 2.482 1.00 0.00 C ATOM 0 H VAL A 140 -1.690 6.245 4.280 1.00 0.00 H new ATOM 0 HA VAL A 140 -4.291 6.716 4.873 1.00 0.00 H new ATOM 0 HB VAL A 140 -2.921 4.248 3.760 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.122 3.486 2.966 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -5.032 3.514 4.743 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -5.901 4.803 3.876 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -3.823 5.097 1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -4.542 6.479 2.483 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -2.773 6.294 2.419 1.00 0.00 H new ATOM 979 N GLU A 141 -5.129 5.491 6.841 1.00 0.00 N ATOM 980 CA GLU A 141 -5.632 4.846 8.044 1.00 0.00 C ATOM 981 C GLU A 141 -6.040 3.416 7.734 1.00 0.00 C ATOM 982 O GLU A 141 -7.210 3.051 7.847 1.00 0.00 O ATOM 983 CB GLU A 141 -6.822 5.623 8.610 1.00 0.00 C ATOM 984 CG GLU A 141 -6.425 6.697 9.609 1.00 0.00 C ATOM 985 CD GLU A 141 -6.007 7.991 8.938 1.00 0.00 C ATOM 986 OE1 GLU A 141 -5.276 7.925 7.927 1.00 0.00 O ATOM 987 OE2 GLU A 141 -6.410 9.069 9.423 1.00 0.00 O ATOM 0 H GLU A 141 -5.709 6.260 6.504 1.00 0.00 H new ATOM 0 HA GLU A 141 -4.839 4.835 8.792 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -7.367 6.086 7.788 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.506 4.924 9.092 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.263 6.893 10.278 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -5.604 6.330 10.225 1.00 0.00 H new ATOM 994 N SER A 142 -5.057 2.621 7.333 1.00 0.00 N ATOM 995 CA SER A 142 -5.277 1.225 6.990 1.00 0.00 C ATOM 996 C SER A 142 -6.401 0.618 7.827 1.00 0.00 C ATOM 997 O SER A 142 -6.682 1.082 8.932 1.00 0.00 O ATOM 998 CB SER A 142 -3.981 0.450 7.192 1.00 0.00 C ATOM 999 OG SER A 142 -4.010 -0.790 6.509 1.00 0.00 O ATOM 0 H SER A 142 -4.088 2.926 7.237 1.00 0.00 H new ATOM 0 HA SER A 142 -5.580 1.164 5.945 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.140 1.044 6.835 1.00 0.00 H new ATOM 0 HB3 SER A 142 -3.820 0.278 8.256 1.00 0.00 H new ATOM 0 HG SER A 142 -3.735 -0.657 5.578 1.00 0.00 H new ATOM 1005 N GLY A 143 -7.051 -0.414 7.294 1.00 0.00 N ATOM 1006 CA GLY A 143 -8.144 -1.044 8.008 1.00 0.00 C ATOM 1007 C GLY A 143 -9.443 -0.282 7.829 1.00 0.00 C ATOM 1008 O GLY A 143 -10.499 -0.719 8.286 1.00 0.00 O ATOM 0 H GLY A 143 -6.840 -0.822 6.384 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -8.270 -2.067 7.652 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -7.900 -1.103 9.069 1.00 0.00 H new ATOM 1012 N GLN A 144 -9.357 0.865 7.160 1.00 0.00 N ATOM 1013 CA GLN A 144 -10.523 1.703 6.909 1.00 0.00 C ATOM 1014 C GLN A 144 -10.640 2.024 5.422 1.00 0.00 C ATOM 1015 O GLN A 144 -9.634 2.140 4.720 1.00 0.00 O ATOM 1016 CB GLN A 144 -10.419 2.998 7.722 1.00 0.00 C ATOM 1017 CG GLN A 144 -11.418 4.068 7.312 1.00 0.00 C ATOM 1018 CD GLN A 144 -10.837 5.467 7.385 1.00 0.00 C ATOM 1019 OE1 GLN A 144 -10.101 5.797 8.315 1.00 0.00 O ATOM 1020 NE2 GLN A 144 -11.163 6.296 6.401 1.00 0.00 N ATOM 0 H GLN A 144 -8.486 1.236 6.781 1.00 0.00 H new ATOM 0 HA GLN A 144 -11.417 1.160 7.216 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -10.564 2.765 8.777 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -9.411 3.399 7.620 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -11.758 3.872 6.295 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -12.294 4.008 7.958 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -11.776 5.980 5.650 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -10.800 7.249 6.396 1.00 0.00 H new ATOM 1029 N PRO A 145 -11.875 2.172 4.920 1.00 0.00 N ATOM 1030 CA PRO A 145 -12.127 2.480 3.508 1.00 0.00 C ATOM 1031 C PRO A 145 -11.459 3.781 3.071 1.00 0.00 C ATOM 1032 O PRO A 145 -11.624 4.820 3.709 1.00 0.00 O ATOM 1033 CB PRO A 145 -13.655 2.608 3.427 1.00 0.00 C ATOM 1034 CG PRO A 145 -14.109 2.793 4.835 1.00 0.00 C ATOM 1035 CD PRO A 145 -13.123 2.050 5.687 1.00 0.00 C ATOM 0 HA PRO A 145 -11.719 1.713 2.849 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -13.946 3.455 2.805 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -14.101 1.718 2.983 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -14.136 3.850 5.101 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -15.117 2.403 4.975 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -13.033 2.491 6.680 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -13.412 1.008 5.826 1.00 0.00 H new ATOM 1043 N VAL A 146 -10.705 3.714 1.978 1.00 0.00 N ATOM 1044 CA VAL A 146 -10.011 4.884 1.453 1.00 0.00 C ATOM 1045 C VAL A 146 -10.950 5.742 0.612 1.00 0.00 C ATOM 1046 O VAL A 146 -12.055 5.319 0.274 1.00 0.00 O ATOM 1047 CB VAL A 146 -8.796 4.481 0.596 1.00 0.00 C ATOM 1048 CG1 VAL A 146 -7.751 3.776 1.447 1.00 0.00 C ATOM 1049 CG2 VAL A 146 -9.231 3.600 -0.566 1.00 0.00 C ATOM 0 H VAL A 146 -10.559 2.861 1.439 1.00 0.00 H new ATOM 0 HA VAL A 146 -9.663 5.459 2.311 1.00 0.00 H new ATOM 0 HB VAL A 146 -8.347 5.386 0.188 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -6.901 3.499 0.824 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -7.417 4.444 2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -8.185 2.879 1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -8.360 3.325 -1.160 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -9.707 2.698 -0.181 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -9.939 4.145 -1.191 1.00 0.00 H new ATOM 1059 N GLU A 147 -10.504 6.949 0.276 1.00 0.00 N ATOM 1060 CA GLU A 147 -11.310 7.863 -0.526 1.00 0.00 C ATOM 1061 C GLU A 147 -10.450 8.609 -1.541 1.00 0.00 C ATOM 1062 O GLU A 147 -10.360 9.837 -1.510 1.00 0.00 O ATOM 1063 CB GLU A 147 -12.037 8.861 0.378 1.00 0.00 C ATOM 1064 CG GLU A 147 -13.352 9.359 -0.201 1.00 0.00 C ATOM 1065 CD GLU A 147 -13.198 9.923 -1.599 1.00 0.00 C ATOM 1066 OE1 GLU A 147 -13.089 9.123 -2.553 1.00 0.00 O ATOM 1067 OE2 GLU A 147 -13.186 11.163 -1.742 1.00 0.00 O ATOM 0 H GLU A 147 -9.591 7.316 0.546 1.00 0.00 H new ATOM 0 HA GLU A 147 -12.046 7.272 -1.071 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -12.229 8.392 1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -11.384 9.714 0.562 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -14.069 8.539 -0.221 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -13.765 10.127 0.453 1.00 0.00 H new ATOM 1074 N PHE A 148 -9.826 7.861 -2.444 1.00 0.00 N ATOM 1075 CA PHE A 148 -8.979 8.452 -3.473 1.00 0.00 C ATOM 1076 C PHE A 148 -7.846 9.266 -2.854 1.00 0.00 C ATOM 1077 O PHE A 148 -7.946 9.722 -1.713 1.00 0.00 O ATOM 1078 CB PHE A 148 -9.812 9.341 -4.394 1.00 0.00 C ATOM 1079 CG PHE A 148 -9.406 9.259 -5.839 1.00 0.00 C ATOM 1080 CD1 PHE A 148 -8.374 10.050 -6.330 1.00 0.00 C ATOM 1081 CD2 PHE A 148 -10.059 8.392 -6.707 1.00 0.00 C ATOM 1082 CE1 PHE A 148 -8.000 9.977 -7.663 1.00 0.00 C ATOM 1083 CE2 PHE A 148 -9.690 8.314 -8.041 1.00 0.00 C ATOM 1084 CZ PHE A 148 -8.659 9.107 -8.519 1.00 0.00 C ATOM 0 H PHE A 148 -9.891 6.844 -2.484 1.00 0.00 H new ATOM 0 HA PHE A 148 -8.540 7.641 -4.054 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -10.861 9.061 -4.304 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -9.728 10.375 -4.060 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -7.858 10.728 -5.666 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -10.863 7.772 -6.338 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -7.197 10.596 -8.034 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -10.205 7.637 -8.706 1.00 0.00 H new ATOM 0 HZ PHE A 148 -8.369 9.048 -9.558 1.00 0.00 H new ATOM 1094 N ASP A 149 -6.772 9.447 -3.615 1.00 0.00 N ATOM 1095 CA ASP A 149 -5.618 10.210 -3.148 1.00 0.00 C ATOM 1096 C ASP A 149 -5.287 9.872 -1.698 1.00 0.00 C ATOM 1097 O ASP A 149 -5.077 10.764 -0.875 1.00 0.00 O ATOM 1098 CB ASP A 149 -5.882 11.710 -3.286 1.00 0.00 C ATOM 1099 CG ASP A 149 -4.640 12.541 -3.033 1.00 0.00 C ATOM 1100 OD1 ASP A 149 -3.532 12.071 -3.370 1.00 0.00 O ATOM 1101 OD2 ASP A 149 -4.774 13.661 -2.498 1.00 0.00 O ATOM 0 H ASP A 149 -6.676 9.075 -4.560 1.00 0.00 H new ATOM 0 HA ASP A 149 -4.763 9.939 -3.768 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -6.258 11.919 -4.287 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -6.662 12.005 -2.584 1.00 0.00 H new ATOM 1106 N GLU A 150 -5.240 8.580 -1.391 1.00 0.00 N ATOM 1107 CA GLU A 150 -4.932 8.128 -0.040 1.00 0.00 C ATOM 1108 C GLU A 150 -3.554 7.474 0.013 1.00 0.00 C ATOM 1109 O GLU A 150 -3.393 6.310 -0.353 1.00 0.00 O ATOM 1110 CB GLU A 150 -5.999 7.143 0.444 1.00 0.00 C ATOM 1111 CG GLU A 150 -6.667 7.560 1.744 1.00 0.00 C ATOM 1112 CD GLU A 150 -7.451 8.851 1.608 1.00 0.00 C ATOM 1113 OE1 GLU A 150 -8.516 8.834 0.957 1.00 0.00 O ATOM 1114 OE2 GLU A 150 -6.999 9.880 2.153 1.00 0.00 O ATOM 0 H GLU A 150 -5.411 7.828 -2.059 1.00 0.00 H new ATOM 0 HA GLU A 150 -4.926 8.997 0.617 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -6.761 7.037 -0.328 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -5.542 6.162 0.578 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -7.336 6.766 2.076 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -5.907 7.680 2.516 1.00 0.00 H new ATOM 1121 N PRO A 151 -2.540 8.223 0.473 1.00 0.00 N ATOM 1122 CA PRO A 151 -1.166 7.722 0.578 1.00 0.00 C ATOM 1123 C PRO A 151 -1.087 6.393 1.321 1.00 0.00 C ATOM 1124 O PRO A 151 -0.812 6.355 2.522 1.00 0.00 O ATOM 1125 CB PRO A 151 -0.447 8.821 1.362 1.00 0.00 C ATOM 1126 CG PRO A 151 -1.229 10.058 1.087 1.00 0.00 C ATOM 1127 CD PRO A 151 -2.659 9.620 0.928 1.00 0.00 C ATOM 0 HA PRO A 151 -0.728 7.523 -0.400 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -0.424 8.596 2.428 1.00 0.00 H new ATOM 0 HB3 PRO A 151 0.588 8.927 1.037 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -1.129 10.772 1.904 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -0.870 10.553 0.185 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -3.208 9.691 1.867 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -3.189 10.235 0.201 1.00 0.00 H new ATOM 1135 N LEU A 152 -1.331 5.305 0.599 1.00 0.00 N ATOM 1136 CA LEU A 152 -1.291 3.969 1.184 1.00 0.00 C ATOM 1137 C LEU A 152 0.095 3.651 1.735 1.00 0.00 C ATOM 1138 O LEU A 152 0.237 3.253 2.891 1.00 0.00 O ATOM 1139 CB LEU A 152 -1.691 2.924 0.141 1.00 0.00 C ATOM 1140 CG LEU A 152 -3.006 3.207 -0.584 1.00 0.00 C ATOM 1141 CD1 LEU A 152 -3.098 2.386 -1.862 1.00 0.00 C ATOM 1142 CD2 LEU A 152 -4.190 2.913 0.327 1.00 0.00 C ATOM 0 H LEU A 152 -1.559 5.322 -0.395 1.00 0.00 H new ATOM 0 HA LEU A 152 -2.001 3.941 2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.894 2.848 -0.599 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -1.765 1.953 0.631 1.00 0.00 H new ATOM 0 HG LEU A 152 -3.032 4.263 -0.852 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -4.041 2.600 -2.365 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -2.269 2.644 -2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -3.051 1.325 -1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -5.119 3.120 -0.205 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -4.168 1.865 0.625 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -4.132 3.544 1.214 1.00 0.00 H new ATOM 1154 N VAL A 153 1.114 3.825 0.901 1.00 0.00 N ATOM 1155 CA VAL A 153 2.486 3.551 1.308 1.00 0.00 C ATOM 1156 C VAL A 153 3.460 4.531 0.664 1.00 0.00 C ATOM 1157 O VAL A 153 3.339 4.857 -0.517 1.00 0.00 O ATOM 1158 CB VAL A 153 2.906 2.115 0.938 1.00 0.00 C ATOM 1159 CG1 VAL A 153 4.372 1.886 1.265 1.00 0.00 C ATOM 1160 CG2 VAL A 153 2.027 1.100 1.652 1.00 0.00 C ATOM 0 H VAL A 153 1.016 4.154 -0.059 1.00 0.00 H new ATOM 0 HA VAL A 153 2.521 3.667 2.391 1.00 0.00 H new ATOM 0 HB VAL A 153 2.773 1.983 -0.136 1.00 0.00 H new ATOM 0 HG11 VAL A 153 4.650 0.867 0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 153 4.985 2.589 0.701 1.00 0.00 H new ATOM 0 HG13 VAL A 153 4.535 2.037 2.332 1.00 0.00 H new ATOM 0 HG21 VAL A 153 2.339 0.092 1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 153 2.124 1.229 2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 153 0.987 1.250 1.360 1.00 0.00 H new ATOM 1170 N VAL A 154 4.428 4.994 1.448 1.00 0.00 N ATOM 1171 CA VAL A 154 5.427 5.934 0.954 1.00 0.00 C ATOM 1172 C VAL A 154 6.829 5.344 1.060 1.00 0.00 C ATOM 1173 O VAL A 154 7.284 4.989 2.148 1.00 0.00 O ATOM 1174 CB VAL A 154 5.382 7.267 1.726 1.00 0.00 C ATOM 1175 CG1 VAL A 154 3.948 7.755 1.867 1.00 0.00 C ATOM 1176 CG2 VAL A 154 6.040 7.121 3.088 1.00 0.00 C ATOM 0 H VAL A 154 4.542 4.734 2.428 1.00 0.00 H new ATOM 0 HA VAL A 154 5.191 6.126 -0.093 1.00 0.00 H new ATOM 0 HB VAL A 154 5.941 8.011 1.159 1.00 0.00 H new ATOM 0 HG11 VAL A 154 3.937 8.697 2.415 1.00 0.00 H new ATOM 0 HG12 VAL A 154 3.516 7.905 0.878 1.00 0.00 H new ATOM 0 HG13 VAL A 154 3.363 7.013 2.410 1.00 0.00 H new ATOM 0 HG21 VAL A 154 5.998 8.073 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 154 5.514 6.361 3.666 1.00 0.00 H new ATOM 0 HG23 VAL A 154 7.081 6.824 2.959 1.00 0.00 H new ATOM 1186 N ILE A 155 7.508 5.238 -0.077 1.00 0.00 N ATOM 1187 CA ILE A 155 8.856 4.686 -0.109 1.00 0.00 C ATOM 1188 C ILE A 155 9.887 5.764 -0.426 1.00 0.00 C ATOM 1189 O ILE A 155 9.613 6.699 -1.178 1.00 0.00 O ATOM 1190 CB ILE A 155 8.973 3.558 -1.151 1.00 0.00 C ATOM 1191 CG1 ILE A 155 7.805 2.582 -1.009 1.00 0.00 C ATOM 1192 CG2 ILE A 155 10.302 2.831 -0.999 1.00 0.00 C ATOM 1193 CD1 ILE A 155 6.876 2.570 -2.204 1.00 0.00 C ATOM 0 H ILE A 155 7.147 5.527 -0.986 1.00 0.00 H new ATOM 0 HA ILE A 155 9.055 4.280 0.883 1.00 0.00 H new ATOM 0 HB ILE A 155 8.935 3.998 -2.148 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.199 1.577 -0.855 1.00 0.00 H new ATOM 0 HG13 ILE A 155 7.233 2.840 -0.118 1.00 0.00 H new ATOM 0 HG21 ILE A 155 10.369 2.037 -1.742 1.00 0.00 H new ATOM 0 HG22 ILE A 155 11.121 3.535 -1.145 1.00 0.00 H new ATOM 0 HG23 ILE A 155 10.369 2.400 -0.000 1.00 0.00 H new ATOM 0 HD11 ILE A 155 6.072 1.855 -2.032 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.453 3.564 -2.346 1.00 0.00 H new ATOM 0 HD13 ILE A 155 7.433 2.282 -3.095 1.00 0.00 H new ATOM 1205 N GLU A 156 11.074 5.625 0.155 1.00 0.00 N ATOM 1206 CA GLU A 156 12.149 6.586 -0.062 1.00 0.00 C ATOM 1207 C GLU A 156 13.462 5.874 -0.371 1.00 0.00 C ATOM 1208 O GLU A 156 13.493 4.628 -0.285 1.00 0.00 O ATOM 1209 CB GLU A 156 12.317 7.481 1.167 1.00 0.00 C ATOM 1210 CG GLU A 156 12.500 8.951 0.827 1.00 0.00 C ATOM 1211 CD GLU A 156 12.275 9.858 2.021 1.00 0.00 C ATOM 1212 OE1 GLU A 156 13.252 10.139 2.746 1.00 0.00 O ATOM 1213 OE2 GLU A 156 11.121 10.287 2.231 1.00 0.00 O ATOM 1214 OXT GLU A 156 14.448 6.568 -0.695 1.00 0.00 O ATOM 0 H GLU A 156 11.316 4.856 0.780 1.00 0.00 H new ATOM 0 HA GLU A 156 11.882 7.204 -0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.443 7.371 1.809 1.00 0.00 H new ATOM 0 HB3 GLU A 156 13.179 7.139 1.740 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.507 9.108 0.441 1.00 0.00 H new ATOM 0 HG3 GLU A 156 11.807 9.225 0.031 1.00 0.00 H new