USER MOD reduce.3.24.130724 H: found=0, std=0, add=496, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 347 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 254 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 256 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 243 LYS NZ :NH3+ -152:sc= -1.43 (180deg=-3.02!) USER MOD Set 2.2: A 266 ASN : amide:sc= 0.359 K(o=-1.1,f=-4.2) USER MOD Single : A 223 CYS SG : rot 180:sc= 0.134 USER MOD Single : A 229 HIS : no HE2:sc= -2.13! C(o=-2.1!,f=-5!) USER MOD Single : A 230 THR OG1 : rot 180:sc= 0 USER MOD Single : A 233 THR OG1 : rot 180:sc= -0.0815 USER MOD Single : A 235 SER OG : rot 180:sc= 0 USER MOD Single : A 237 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 THR OG1 : rot 180:sc= 0 USER MOD Single : A 241 SER OG : rot 77:sc= 1.15 USER MOD Single : A 245 LYS NZ :NH3+ 167:sc= -0.808 (180deg=-1.45!) USER MOD Single : A 246 LYS NZ :NH3+ 166:sc= -0.0205 (180deg=-0.181) USER MOD Single : A 255 LYS NZ :NH3+ -163:sc= 1.25 (180deg=1.22) USER MOD Single : A 258 MET CE :methyl -163:sc= -0.0772 (180deg=-0.456) USER MOD Single : A 260 MET CE :methyl 161:sc= -0.106 (180deg=-0.586) USER MOD Single : A 262 THR OG1 : rot 180:sc= 0 USER MOD Single : A 264 MET CE :methyl 163:sc= -0.0726 (180deg=-0.513) USER MOD Single : A 267 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 268 LYS NZ :NH3+ 132:sc= 0.153 (180deg=-0.14) USER MOD Single : A 271 ASN : amide:sc= -0.183 K(o=-0.18,f=-1.5!) USER MOD Single : A 273 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 TYR OH : rot 180:sc= 0 USER MOD Single : A 281 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 220 -0.594 18.583 -7.571 1.00 0.00 N ATOM 2 CA GLY A 220 0.467 18.711 -6.551 1.00 0.00 C ATOM 3 C GLY A 220 1.500 17.617 -6.676 1.00 0.00 C ATOM 4 O GLY A 220 1.240 16.598 -7.317 1.00 0.00 O ATOM 0 HA2 GLY A 220 0.952 19.682 -6.651 1.00 0.00 H new ATOM 0 HA3 GLY A 220 0.021 18.678 -5.557 1.00 0.00 H new ATOM 7 N PRO A 221 2.696 17.804 -6.082 1.00 0.00 N ATOM 8 CA PRO A 221 3.772 16.802 -6.110 1.00 0.00 C ATOM 9 C PRO A 221 3.317 15.457 -5.551 1.00 0.00 C ATOM 10 O PRO A 221 2.388 15.389 -4.736 1.00 0.00 O ATOM 11 CB PRO A 221 4.864 17.407 -5.211 1.00 0.00 C ATOM 12 CG PRO A 221 4.190 18.504 -4.459 1.00 0.00 C ATOM 13 CD PRO A 221 3.095 19.005 -5.345 1.00 0.00 C ATOM 0 HA PRO A 221 4.108 16.599 -7.127 1.00 0.00 H new ATOM 0 HB2 PRO A 221 5.274 16.659 -4.532 1.00 0.00 H new ATOM 0 HB3 PRO A 221 5.695 17.789 -5.804 1.00 0.00 H new ATOM 0 HG2 PRO A 221 3.789 18.139 -3.513 1.00 0.00 H new ATOM 0 HG3 PRO A 221 4.893 19.302 -4.220 1.00 0.00 H new ATOM 0 HD2 PRO A 221 2.267 19.420 -4.770 1.00 0.00 H new ATOM 0 HD3 PRO A 221 3.444 19.792 -6.013 1.00 0.00 H new ATOM 21 N PHE A 222 3.967 14.401 -5.974 1.00 0.00 N ATOM 22 CA PHE A 222 3.598 13.074 -5.541 1.00 0.00 C ATOM 23 C PHE A 222 4.326 12.688 -4.272 1.00 0.00 C ATOM 24 O PHE A 222 5.551 12.741 -4.201 1.00 0.00 O ATOM 25 CB PHE A 222 3.872 12.047 -6.636 1.00 0.00 C ATOM 26 CG PHE A 222 3.024 12.225 -7.863 1.00 0.00 C ATOM 27 CD1 PHE A 222 1.778 11.624 -7.951 1.00 0.00 C ATOM 28 CD2 PHE A 222 3.468 12.994 -8.926 1.00 0.00 C ATOM 29 CE1 PHE A 222 0.993 11.786 -9.074 1.00 0.00 C ATOM 30 CE2 PHE A 222 2.687 13.158 -10.054 1.00 0.00 C ATOM 31 CZ PHE A 222 1.448 12.554 -10.128 1.00 0.00 C ATOM 0 H PHE A 222 4.756 14.434 -6.619 1.00 0.00 H new ATOM 0 HA PHE A 222 2.528 13.085 -5.332 1.00 0.00 H new ATOM 0 HB2 PHE A 222 4.923 12.105 -6.921 1.00 0.00 H new ATOM 0 HB3 PHE A 222 3.706 11.048 -6.233 1.00 0.00 H new ATOM 0 HD1 PHE A 222 1.417 11.022 -7.130 1.00 0.00 H new ATOM 0 HD2 PHE A 222 4.436 13.471 -8.873 1.00 0.00 H new ATOM 0 HE1 PHE A 222 0.024 11.313 -9.129 1.00 0.00 H new ATOM 0 HE2 PHE A 222 3.046 13.758 -10.877 1.00 0.00 H new ATOM 0 HZ PHE A 222 0.836 12.682 -11.008 1.00 0.00 H new ATOM 37 N CYS A 223 3.562 12.317 -3.269 1.00 0.00 N ATOM 38 CA CYS A 223 4.115 11.856 -2.010 1.00 0.00 C ATOM 39 C CYS A 223 4.472 10.383 -2.122 1.00 0.00 C ATOM 40 O CYS A 223 5.244 9.841 -1.320 1.00 0.00 O ATOM 41 CB CYS A 223 3.096 12.072 -0.897 1.00 0.00 C ATOM 42 SG CYS A 223 1.428 11.515 -1.322 1.00 0.00 S ATOM 0 H CYS A 223 2.543 12.325 -3.300 1.00 0.00 H new ATOM 0 HA CYS A 223 5.017 12.420 -1.776 1.00 0.00 H new ATOM 0 HB2 CYS A 223 3.429 11.544 -0.003 1.00 0.00 H new ATOM 0 HB3 CYS A 223 3.063 13.132 -0.647 1.00 0.00 H new ATOM 0 HG CYS A 223 0.629 11.734 -0.320 1.00 0.00 H new ATOM 48 N GLY A 224 3.911 9.747 -3.137 1.00 0.00 N ATOM 49 CA GLY A 224 4.145 8.353 -3.364 1.00 0.00 C ATOM 50 C GLY A 224 2.918 7.536 -3.078 1.00 0.00 C ATOM 51 O GLY A 224 2.368 7.602 -1.985 1.00 0.00 O ATOM 0 H GLY A 224 3.288 10.188 -3.814 1.00 0.00 H new ATOM 0 HA2 GLY A 224 4.454 8.198 -4.398 1.00 0.00 H new ATOM 0 HA3 GLY A 224 4.965 8.013 -2.732 1.00 0.00 H new ATOM 55 N ARG A 225 2.461 6.796 -4.066 1.00 0.00 N ATOM 56 CA ARG A 225 1.314 5.927 -3.893 1.00 0.00 C ATOM 57 C ARG A 225 1.639 4.560 -4.441 1.00 0.00 C ATOM 58 O ARG A 225 2.431 4.433 -5.376 1.00 0.00 O ATOM 59 CB ARG A 225 0.066 6.500 -4.565 1.00 0.00 C ATOM 60 CG ARG A 225 -0.364 7.846 -4.000 1.00 0.00 C ATOM 61 CD ARG A 225 -1.772 8.207 -4.423 1.00 0.00 C ATOM 62 NE ARG A 225 -2.768 7.297 -3.851 1.00 0.00 N ATOM 63 CZ ARG A 225 -4.065 7.593 -3.722 1.00 0.00 C ATOM 64 NH1 ARG A 225 -4.523 8.775 -4.111 1.00 0.00 N ATOM 65 NH2 ARG A 225 -4.904 6.707 -3.206 1.00 0.00 N ATOM 0 H ARG A 225 2.868 6.778 -5.001 1.00 0.00 H new ATOM 0 HA ARG A 225 1.094 5.849 -2.828 1.00 0.00 H new ATOM 0 HB2 ARG A 225 0.255 6.607 -5.633 1.00 0.00 H new ATOM 0 HB3 ARG A 225 -0.754 5.790 -4.456 1.00 0.00 H new ATOM 0 HG2 ARG A 225 -0.307 7.819 -2.912 1.00 0.00 H new ATOM 0 HG3 ARG A 225 0.327 8.619 -4.336 1.00 0.00 H new ATOM 0 HD2 ARG A 225 -1.993 9.228 -4.112 1.00 0.00 H new ATOM 0 HD3 ARG A 225 -1.841 8.183 -5.511 1.00 0.00 H new ATOM 0 HE ARG A 225 -2.452 6.381 -3.532 1.00 0.00 H new ATOM 0 HH11 ARG A 225 -3.885 9.463 -4.511 1.00 0.00 H new ATOM 0 HH12 ARG A 225 -5.514 8.996 -4.011 1.00 0.00 H new ATOM 0 HH21 ARG A 225 -4.561 5.795 -2.905 1.00 0.00 H new ATOM 0 HH22 ARG A 225 -5.893 6.937 -3.109 1.00 0.00 H new ATOM 68 N ALA A 226 1.046 3.542 -3.872 1.00 0.00 N ATOM 69 CA ALA A 226 1.373 2.195 -4.261 1.00 0.00 C ATOM 70 C ALA A 226 0.156 1.387 -4.667 1.00 0.00 C ATOM 71 O ALA A 226 -0.864 1.377 -3.975 1.00 0.00 O ATOM 72 CB ALA A 226 2.116 1.502 -3.138 1.00 0.00 C ATOM 0 H ALA A 226 0.338 3.619 -3.142 1.00 0.00 H new ATOM 0 HA ALA A 226 2.012 2.260 -5.142 1.00 0.00 H new ATOM 0 HB1 ALA A 226 2.361 0.483 -3.438 1.00 0.00 H new ATOM 0 HB2 ALA A 226 3.035 2.046 -2.919 1.00 0.00 H new ATOM 0 HB3 ALA A 226 1.488 1.477 -2.247 1.00 0.00 H new ATOM 78 N ARG A 227 0.270 0.719 -5.803 1.00 0.00 N ATOM 79 CA ARG A 227 -0.764 -0.169 -6.283 1.00 0.00 C ATOM 80 C ARG A 227 -0.467 -1.569 -5.776 1.00 0.00 C ATOM 81 O ARG A 227 0.576 -2.148 -6.093 1.00 0.00 O ATOM 82 CB ARG A 227 -0.809 -0.159 -7.814 1.00 0.00 C ATOM 83 CG ARG A 227 -1.949 -0.975 -8.407 1.00 0.00 C ATOM 84 CD ARG A 227 -1.938 -0.929 -9.932 1.00 0.00 C ATOM 85 NE ARG A 227 -2.032 0.446 -10.453 1.00 0.00 N ATOM 86 CZ ARG A 227 -3.094 0.938 -11.115 1.00 0.00 C ATOM 87 NH1 ARG A 227 -4.164 0.178 -11.325 1.00 0.00 N ATOM 88 NH2 ARG A 227 -3.082 2.191 -11.569 1.00 0.00 N ATOM 0 H ARG A 227 1.084 0.780 -6.415 1.00 0.00 H new ATOM 0 HA ARG A 227 -1.735 0.163 -5.916 1.00 0.00 H new ATOM 0 HB2 ARG A 227 -0.897 0.872 -8.158 1.00 0.00 H new ATOM 0 HB3 ARG A 227 0.136 -0.543 -8.197 1.00 0.00 H new ATOM 0 HG2 ARG A 227 -1.869 -2.009 -8.073 1.00 0.00 H new ATOM 0 HG3 ARG A 227 -2.901 -0.593 -8.038 1.00 0.00 H new ATOM 0 HD2 ARG A 227 -1.023 -1.392 -10.300 1.00 0.00 H new ATOM 0 HD3 ARG A 227 -2.771 -1.518 -10.317 1.00 0.00 H new ATOM 0 HE ARG A 227 -1.237 1.067 -10.301 1.00 0.00 H new ATOM 0 HH11 ARG A 227 -4.182 -0.783 -10.983 1.00 0.00 H new ATOM 0 HH12 ARG A 227 -4.967 0.556 -11.828 1.00 0.00 H new ATOM 0 HH21 ARG A 227 -2.265 2.781 -11.415 1.00 0.00 H new ATOM 0 HH22 ARG A 227 -3.890 2.559 -12.071 1.00 0.00 H new ATOM 91 N VAL A 228 -1.352 -2.092 -4.962 1.00 0.00 N ATOM 92 CA VAL A 228 -1.154 -3.403 -4.374 1.00 0.00 C ATOM 93 C VAL A 228 -1.428 -4.546 -5.376 1.00 0.00 C ATOM 94 O VAL A 228 -2.344 -4.466 -6.205 1.00 0.00 O ATOM 95 CB VAL A 228 -2.003 -3.570 -3.092 1.00 0.00 C ATOM 96 CG1 VAL A 228 -3.470 -3.423 -3.394 1.00 0.00 C ATOM 97 CG2 VAL A 228 -1.714 -4.892 -2.410 1.00 0.00 C ATOM 0 H VAL A 228 -2.220 -1.631 -4.689 1.00 0.00 H new ATOM 0 HA VAL A 228 -0.101 -3.471 -4.099 1.00 0.00 H new ATOM 0 HB VAL A 228 -1.723 -2.775 -2.401 1.00 0.00 H new ATOM 0 HG11 VAL A 228 -4.045 -3.545 -2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 228 -3.658 -2.434 -3.811 1.00 0.00 H new ATOM 0 HG13 VAL A 228 -3.771 -4.184 -4.114 1.00 0.00 H new ATOM 0 HG21 VAL A 228 -2.326 -4.980 -1.512 1.00 0.00 H new ATOM 0 HG22 VAL A 228 -1.948 -5.711 -3.090 1.00 0.00 H new ATOM 0 HG23 VAL A 228 -0.660 -4.937 -2.136 1.00 0.00 H new ATOM 107 N HIS A 229 -0.636 -5.615 -5.255 1.00 0.00 N ATOM 108 CA HIS A 229 -0.717 -6.764 -6.164 1.00 0.00 C ATOM 109 C HIS A 229 -1.481 -7.914 -5.519 1.00 0.00 C ATOM 110 O HIS A 229 -2.183 -8.668 -6.194 1.00 0.00 O ATOM 111 CB HIS A 229 0.682 -7.279 -6.544 1.00 0.00 C ATOM 112 CG HIS A 229 1.559 -6.306 -7.263 1.00 0.00 C ATOM 113 ND1 HIS A 229 1.374 -5.951 -8.576 1.00 0.00 N ATOM 114 CD2 HIS A 229 2.663 -5.646 -6.852 1.00 0.00 C ATOM 115 CE1 HIS A 229 2.326 -5.123 -8.944 1.00 0.00 C ATOM 116 NE2 HIS A 229 3.122 -4.919 -7.916 1.00 0.00 N ATOM 0 H HIS A 229 0.075 -5.709 -4.530 1.00 0.00 H new ATOM 0 HA HIS A 229 -1.237 -6.420 -7.058 1.00 0.00 H new ATOM 0 HB2 HIS A 229 1.192 -7.595 -5.634 1.00 0.00 H new ATOM 0 HB3 HIS A 229 0.565 -8.165 -7.168 1.00 0.00 H new ATOM 0 HD1 HIS A 229 0.615 -6.279 -9.174 1.00 0.00 H new ATOM 0 HD2 HIS A 229 3.102 -5.685 -5.866 1.00 0.00 H new ATOM 0 HE1 HIS A 229 2.436 -4.684 -9.925 1.00 0.00 H new ATOM 121 N THR A 230 -1.364 -8.026 -4.213 1.00 0.00 N ATOM 122 CA THR A 230 -1.944 -9.140 -3.500 1.00 0.00 C ATOM 123 C THR A 230 -2.748 -8.641 -2.310 1.00 0.00 C ATOM 124 O THR A 230 -2.313 -7.736 -1.603 1.00 0.00 O ATOM 125 CB THR A 230 -0.836 -10.103 -3.006 1.00 0.00 C ATOM 126 OG1 THR A 230 0.095 -10.360 -4.069 1.00 0.00 O ATOM 127 CG2 THR A 230 -1.432 -11.421 -2.538 1.00 0.00 C ATOM 0 H THR A 230 -0.870 -7.356 -3.623 1.00 0.00 H new ATOM 0 HA THR A 230 -2.604 -9.676 -4.182 1.00 0.00 H new ATOM 0 HB THR A 230 -0.324 -9.630 -2.168 1.00 0.00 H new ATOM 0 HG1 THR A 230 0.795 -10.968 -3.751 1.00 0.00 H new ATOM 0 HG21 THR A 230 -0.634 -12.080 -2.196 1.00 0.00 H new ATOM 0 HG22 THR A 230 -2.126 -11.236 -1.718 1.00 0.00 H new ATOM 0 HG23 THR A 230 -1.964 -11.893 -3.364 1.00 0.00 H new ATOM 134 N ASP A 231 -3.919 -9.225 -2.099 1.00 0.00 N ATOM 135 CA ASP A 231 -4.785 -8.828 -0.999 1.00 0.00 C ATOM 136 C ASP A 231 -4.090 -9.032 0.344 1.00 0.00 C ATOM 137 O ASP A 231 -3.303 -9.970 0.525 1.00 0.00 O ATOM 138 CB ASP A 231 -6.120 -9.596 -1.038 1.00 0.00 C ATOM 139 CG ASP A 231 -5.975 -11.076 -0.725 1.00 0.00 C ATOM 140 OD1 ASP A 231 -5.308 -11.793 -1.504 1.00 0.00 O ATOM 141 OD2 ASP A 231 -6.540 -11.531 0.299 1.00 0.00 O ATOM 0 H ASP A 231 -4.292 -9.978 -2.677 1.00 0.00 H new ATOM 0 HA ASP A 231 -5.001 -7.766 -1.115 1.00 0.00 H new ATOM 0 HB2 ASP A 231 -6.810 -9.147 -0.323 1.00 0.00 H new ATOM 0 HB3 ASP A 231 -6.567 -9.483 -2.026 1.00 0.00 H new ATOM 144 N PHE A 232 -4.387 -8.154 1.271 1.00 0.00 N ATOM 145 CA PHE A 232 -3.788 -8.192 2.586 1.00 0.00 C ATOM 146 C PHE A 232 -4.860 -7.946 3.626 1.00 0.00 C ATOM 147 O PHE A 232 -5.418 -6.849 3.722 1.00 0.00 O ATOM 148 CB PHE A 232 -2.666 -7.151 2.694 1.00 0.00 C ATOM 149 CG PHE A 232 -1.893 -7.193 3.985 1.00 0.00 C ATOM 150 CD1 PHE A 232 -0.792 -8.021 4.117 1.00 0.00 C ATOM 151 CD2 PHE A 232 -2.263 -6.400 5.059 1.00 0.00 C ATOM 152 CE1 PHE A 232 -0.075 -8.059 5.295 1.00 0.00 C ATOM 153 CE2 PHE A 232 -1.551 -6.432 6.240 1.00 0.00 C ATOM 154 CZ PHE A 232 -0.455 -7.263 6.358 1.00 0.00 C ATOM 0 H PHE A 232 -5.051 -7.392 1.136 1.00 0.00 H new ATOM 0 HA PHE A 232 -3.345 -9.173 2.758 1.00 0.00 H new ATOM 0 HB2 PHE A 232 -1.972 -7.297 1.866 1.00 0.00 H new ATOM 0 HB3 PHE A 232 -3.098 -6.157 2.577 1.00 0.00 H new ATOM 0 HD1 PHE A 232 -0.491 -8.645 3.288 1.00 0.00 H new ATOM 0 HD2 PHE A 232 -3.120 -5.748 4.970 1.00 0.00 H new ATOM 0 HE1 PHE A 232 0.782 -8.710 5.386 1.00 0.00 H new ATOM 0 HE2 PHE A 232 -1.850 -5.809 7.070 1.00 0.00 H new ATOM 0 HZ PHE A 232 0.105 -7.291 7.281 1.00 0.00 H new ATOM 160 N THR A 233 -5.147 -8.959 4.401 1.00 0.00 N ATOM 161 CA THR A 233 -6.205 -8.890 5.378 1.00 0.00 C ATOM 162 C THR A 233 -5.925 -9.862 6.514 1.00 0.00 C ATOM 163 O THR A 233 -6.157 -11.068 6.372 1.00 0.00 O ATOM 164 CB THR A 233 -7.589 -9.203 4.751 1.00 0.00 C ATOM 165 OG1 THR A 233 -7.851 -8.296 3.669 1.00 0.00 O ATOM 166 CG2 THR A 233 -8.702 -9.079 5.790 1.00 0.00 C ATOM 0 H THR A 233 -4.657 -9.853 4.374 1.00 0.00 H new ATOM 0 HA THR A 233 -6.235 -7.870 5.762 1.00 0.00 H new ATOM 0 HB THR A 233 -7.568 -10.228 4.380 1.00 0.00 H new ATOM 0 HG1 THR A 233 -8.725 -8.499 3.276 1.00 0.00 H new ATOM 0 HG21 THR A 233 -9.661 -9.304 5.324 1.00 0.00 H new ATOM 0 HG22 THR A 233 -8.520 -9.782 6.603 1.00 0.00 H new ATOM 0 HG23 THR A 233 -8.719 -8.063 6.185 1.00 0.00 H new ATOM 173 N PRO A 234 -5.377 -9.371 7.633 1.00 0.00 N ATOM 174 CA PRO A 234 -5.111 -10.208 8.799 1.00 0.00 C ATOM 175 C PRO A 234 -6.418 -10.756 9.358 1.00 0.00 C ATOM 176 O PRO A 234 -6.700 -11.952 9.262 1.00 0.00 O ATOM 177 CB PRO A 234 -4.448 -9.242 9.804 1.00 0.00 C ATOM 178 CG PRO A 234 -3.998 -8.082 8.984 1.00 0.00 C ATOM 179 CD PRO A 234 -4.969 -7.975 7.848 1.00 0.00 C ATOM 0 HA PRO A 234 -4.484 -11.070 8.574 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -5.152 -8.931 10.575 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -3.608 -9.716 10.312 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -3.988 -7.167 9.576 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -2.983 -8.235 8.616 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -5.818 -7.340 8.101 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -4.505 -7.548 6.959 1.00 0.00 H new ATOM 187 N SER A 235 -7.207 -9.874 9.930 1.00 0.00 N ATOM 188 CA SER A 235 -8.509 -10.219 10.426 1.00 0.00 C ATOM 189 C SER A 235 -9.461 -9.058 10.170 1.00 0.00 C ATOM 190 O SER A 235 -9.043 -7.899 10.213 1.00 0.00 O ATOM 191 CB SER A 235 -8.446 -10.527 11.929 1.00 0.00 C ATOM 192 OG SER A 235 -9.665 -11.090 12.391 1.00 0.00 O ATOM 0 H SER A 235 -6.957 -8.894 10.062 1.00 0.00 H new ATOM 0 HA SER A 235 -8.868 -11.109 9.910 1.00 0.00 H new ATOM 0 HB2 SER A 235 -7.626 -11.217 12.127 1.00 0.00 H new ATOM 0 HB3 SER A 235 -8.233 -9.612 12.481 1.00 0.00 H new ATOM 0 HG SER A 235 -9.596 -11.278 13.350 1.00 0.00 H new ATOM 198 N PRO A 236 -10.742 -9.331 9.862 1.00 0.00 N ATOM 199 CA PRO A 236 -11.747 -8.276 9.731 1.00 0.00 C ATOM 200 C PRO A 236 -11.978 -7.613 11.084 1.00 0.00 C ATOM 201 O PRO A 236 -12.449 -6.487 11.175 1.00 0.00 O ATOM 202 CB PRO A 236 -13.013 -9.025 9.283 1.00 0.00 C ATOM 203 CG PRO A 236 -12.532 -10.348 8.794 1.00 0.00 C ATOM 204 CD PRO A 236 -11.300 -10.662 9.588 1.00 0.00 C ATOM 0 HA PRO A 236 -11.455 -7.490 9.034 1.00 0.00 H new ATOM 0 HB2 PRO A 236 -13.714 -9.142 10.109 1.00 0.00 H new ATOM 0 HB3 PRO A 236 -13.535 -8.480 8.496 1.00 0.00 H new ATOM 0 HG2 PRO A 236 -13.293 -11.116 8.935 1.00 0.00 H new ATOM 0 HG3 PRO A 236 -12.310 -10.312 7.728 1.00 0.00 H new ATOM 0 HD2 PRO A 236 -11.537 -11.198 10.507 1.00 0.00 H new ATOM 0 HD3 PRO A 236 -10.604 -11.285 9.026 1.00 0.00 H new ATOM 212 N TYR A 237 -11.609 -8.336 12.131 1.00 0.00 N ATOM 213 CA TYR A 237 -11.741 -7.872 13.501 1.00 0.00 C ATOM 214 C TYR A 237 -10.437 -7.234 13.972 1.00 0.00 C ATOM 215 O TYR A 237 -10.173 -7.132 15.171 1.00 0.00 O ATOM 216 CB TYR A 237 -12.125 -9.043 14.408 1.00 0.00 C ATOM 217 CG TYR A 237 -13.443 -9.684 14.034 1.00 0.00 C ATOM 218 CD1 TYR A 237 -13.507 -10.675 13.062 1.00 0.00 C ATOM 219 CD2 TYR A 237 -14.622 -9.290 14.646 1.00 0.00 C ATOM 220 CE1 TYR A 237 -14.711 -11.253 12.713 1.00 0.00 C ATOM 221 CE2 TYR A 237 -15.828 -9.861 14.301 1.00 0.00 C ATOM 222 CZ TYR A 237 -15.870 -10.842 13.336 1.00 0.00 C ATOM 223 OH TYR A 237 -17.076 -11.408 12.986 1.00 0.00 O ATOM 0 H TYR A 237 -11.206 -9.270 12.051 1.00 0.00 H new ATOM 0 HA TYR A 237 -12.526 -7.118 13.548 1.00 0.00 H new ATOM 0 HB2 TYR A 237 -11.339 -9.797 14.369 1.00 0.00 H new ATOM 0 HB3 TYR A 237 -12.179 -8.692 15.439 1.00 0.00 H new ATOM 0 HD1 TYR A 237 -12.600 -10.998 12.572 1.00 0.00 H new ATOM 0 HD2 TYR A 237 -14.596 -8.523 15.406 1.00 0.00 H new ATOM 0 HE1 TYR A 237 -14.745 -12.023 11.956 1.00 0.00 H new ATOM 0 HE2 TYR A 237 -16.738 -9.540 14.786 1.00 0.00 H new ATOM 0 HH TYR A 237 -17.793 -11.007 13.520 1.00 0.00 H new ATOM 229 N ASP A 238 -9.645 -6.779 13.016 1.00 0.00 N ATOM 230 CA ASP A 238 -8.370 -6.152 13.306 1.00 0.00 C ATOM 231 C ASP A 238 -8.363 -4.742 12.769 1.00 0.00 C ATOM 232 O ASP A 238 -8.725 -4.502 11.613 1.00 0.00 O ATOM 233 CB ASP A 238 -7.203 -6.939 12.698 1.00 0.00 C ATOM 234 CG ASP A 238 -5.843 -6.390 13.115 1.00 0.00 C ATOM 235 OD1 ASP A 238 -5.418 -5.343 12.575 1.00 0.00 O ATOM 236 OD2 ASP A 238 -5.192 -7.009 13.985 1.00 0.00 O ATOM 0 H ASP A 238 -9.868 -6.834 12.022 1.00 0.00 H new ATOM 0 HA ASP A 238 -8.241 -6.139 14.388 1.00 0.00 H new ATOM 0 HB2 ASP A 238 -7.277 -7.983 13.001 1.00 0.00 H new ATOM 0 HB3 ASP A 238 -7.282 -6.916 11.611 1.00 0.00 H new ATOM 239 N THR A 239 -7.978 -3.815 13.604 1.00 0.00 N ATOM 240 CA THR A 239 -7.902 -2.433 13.215 1.00 0.00 C ATOM 241 C THR A 239 -6.552 -1.860 13.590 1.00 0.00 C ATOM 242 O THR A 239 -6.379 -0.653 13.682 1.00 0.00 O ATOM 243 CB THR A 239 -9.038 -1.595 13.849 1.00 0.00 C ATOM 244 OG1 THR A 239 -9.149 -1.877 15.256 1.00 0.00 O ATOM 245 CG2 THR A 239 -10.366 -1.885 13.162 1.00 0.00 C ATOM 0 H THR A 239 -7.709 -3.996 14.571 1.00 0.00 H new ATOM 0 HA THR A 239 -8.024 -2.385 12.133 1.00 0.00 H new ATOM 0 HB THR A 239 -8.794 -0.541 13.716 1.00 0.00 H new ATOM 0 HG1 THR A 239 -9.871 -1.338 15.642 1.00 0.00 H new ATOM 0 HG21 THR A 239 -11.152 -1.286 13.622 1.00 0.00 H new ATOM 0 HG22 THR A 239 -10.291 -1.634 12.104 1.00 0.00 H new ATOM 0 HG23 THR A 239 -10.607 -2.943 13.268 1.00 0.00 H new ATOM 252 N ASP A 240 -5.592 -2.742 13.793 1.00 0.00 N ATOM 253 CA ASP A 240 -4.240 -2.338 14.145 1.00 0.00 C ATOM 254 C ASP A 240 -3.366 -2.372 12.914 1.00 0.00 C ATOM 255 O ASP A 240 -2.330 -1.706 12.841 1.00 0.00 O ATOM 256 CB ASP A 240 -3.661 -3.255 15.225 1.00 0.00 C ATOM 257 CG ASP A 240 -4.389 -3.133 16.543 1.00 0.00 C ATOM 258 OD1 ASP A 240 -5.391 -3.852 16.744 1.00 0.00 O ATOM 259 OD2 ASP A 240 -3.961 -2.321 17.390 1.00 0.00 O ATOM 0 H ASP A 240 -5.723 -3.751 13.720 1.00 0.00 H new ATOM 0 HA ASP A 240 -4.271 -1.323 14.542 1.00 0.00 H new ATOM 0 HB2 ASP A 240 -3.709 -4.289 14.882 1.00 0.00 H new ATOM 0 HB3 ASP A 240 -2.608 -3.016 15.373 1.00 0.00 H new ATOM 262 N SER A 241 -3.801 -3.140 11.943 1.00 0.00 N ATOM 263 CA SER A 241 -3.103 -3.284 10.691 1.00 0.00 C ATOM 264 C SER A 241 -3.820 -2.453 9.627 1.00 0.00 C ATOM 265 O SER A 241 -4.775 -1.733 9.935 1.00 0.00 O ATOM 266 CB SER A 241 -3.117 -4.762 10.294 1.00 0.00 C ATOM 267 OG SER A 241 -2.950 -5.589 11.436 1.00 0.00 O ATOM 0 H SER A 241 -4.659 -3.688 12.003 1.00 0.00 H new ATOM 0 HA SER A 241 -2.073 -2.939 10.783 1.00 0.00 H new ATOM 0 HB2 SER A 241 -4.058 -5.002 9.799 1.00 0.00 H new ATOM 0 HB3 SER A 241 -2.320 -4.959 9.576 1.00 0.00 H new ATOM 0 HG SER A 241 -3.794 -5.635 11.933 1.00 0.00 H new ATOM 273 N LEU A 242 -3.375 -2.542 8.393 1.00 0.00 N ATOM 274 CA LEU A 242 -4.044 -1.860 7.314 1.00 0.00 C ATOM 275 C LEU A 242 -4.731 -2.897 6.452 1.00 0.00 C ATOM 276 O LEU A 242 -4.076 -3.762 5.871 1.00 0.00 O ATOM 277 CB LEU A 242 -3.054 -1.031 6.484 1.00 0.00 C ATOM 278 CG LEU A 242 -3.670 -0.174 5.371 1.00 0.00 C ATOM 279 CD1 LEU A 242 -4.651 0.838 5.945 1.00 0.00 C ATOM 280 CD2 LEU A 242 -2.582 0.528 4.574 1.00 0.00 C ATOM 0 H LEU A 242 -2.554 -3.080 8.115 1.00 0.00 H new ATOM 0 HA LEU A 242 -4.780 -1.166 7.720 1.00 0.00 H new ATOM 0 HB2 LEU A 242 -2.503 -0.376 7.159 1.00 0.00 H new ATOM 0 HB3 LEU A 242 -2.328 -1.709 6.035 1.00 0.00 H new ATOM 0 HG LEU A 242 -4.219 -0.834 4.699 1.00 0.00 H new ATOM 0 HD11 LEU A 242 -5.074 1.434 5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 242 -5.451 0.313 6.467 1.00 0.00 H new ATOM 0 HD13 LEU A 242 -4.131 1.493 6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 242 -3.038 1.131 3.789 1.00 0.00 H new ATOM 0 HD22 LEU A 242 -2.004 1.172 5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 242 -1.923 -0.215 4.124 1.00 0.00 H new ATOM 292 N LYS A 243 -6.037 -2.829 6.383 1.00 0.00 N ATOM 293 CA LYS A 243 -6.802 -3.811 5.647 1.00 0.00 C ATOM 294 C LYS A 243 -6.992 -3.353 4.216 1.00 0.00 C ATOM 295 O LYS A 243 -7.660 -2.352 3.960 1.00 0.00 O ATOM 296 CB LYS A 243 -8.153 -4.038 6.331 1.00 0.00 C ATOM 297 CG LYS A 243 -8.986 -5.158 5.722 1.00 0.00 C ATOM 298 CD LYS A 243 -10.255 -5.433 6.537 1.00 0.00 C ATOM 299 CE LYS A 243 -11.385 -4.436 6.239 1.00 0.00 C ATOM 300 NZ LYS A 243 -11.032 -3.027 6.568 1.00 0.00 N ATOM 0 H LYS A 243 -6.597 -2.102 6.829 1.00 0.00 H new ATOM 0 HA LYS A 243 -6.259 -4.756 5.635 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -7.981 -4.261 7.384 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -8.727 -3.112 6.291 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -9.260 -4.893 4.701 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -8.387 -6.067 5.665 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -10.604 -6.444 6.326 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -10.014 -5.394 7.599 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -11.647 -4.500 5.183 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -12.271 -4.723 6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -11.896 -2.499 6.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -10.383 -3.012 7.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -10.570 -2.584 5.748 1.00 0.00 H new ATOM 303 N ILE A 244 -6.391 -4.075 3.291 1.00 0.00 N ATOM 304 CA ILE A 244 -6.469 -3.733 1.884 1.00 0.00 C ATOM 305 C ILE A 244 -6.871 -4.947 1.055 1.00 0.00 C ATOM 306 O ILE A 244 -6.976 -6.063 1.567 1.00 0.00 O ATOM 307 CB ILE A 244 -5.114 -3.187 1.355 1.00 0.00 C ATOM 308 CG1 ILE A 244 -4.004 -4.217 1.576 1.00 0.00 C ATOM 309 CG2 ILE A 244 -4.762 -1.869 2.033 1.00 0.00 C ATOM 310 CD1 ILE A 244 -2.651 -3.795 1.045 1.00 0.00 C ATOM 0 H ILE A 244 -5.839 -4.909 3.491 1.00 0.00 H new ATOM 0 HA ILE A 244 -7.226 -2.955 1.786 1.00 0.00 H new ATOM 0 HB ILE A 244 -5.211 -3.004 0.285 1.00 0.00 H new ATOM 0 HG12 ILE A 244 -3.916 -4.417 2.644 1.00 0.00 H new ATOM 0 HG13 ILE A 244 -4.293 -5.154 1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 244 -3.810 -1.505 1.648 1.00 0.00 H new ATOM 0 HG22 ILE A 244 -5.541 -1.135 1.828 1.00 0.00 H new ATOM 0 HG23 ILE A 244 -4.683 -2.023 3.109 1.00 0.00 H new ATOM 0 HD11 ILE A 244 -1.922 -4.581 1.242 1.00 0.00 H new ATOM 0 HD12 ILE A 244 -2.719 -3.624 -0.029 1.00 0.00 H new ATOM 0 HD13 ILE A 244 -2.337 -2.876 1.539 1.00 0.00 H new ATOM 321 N LYS A 245 -7.103 -4.721 -0.208 1.00 0.00 N ATOM 322 CA LYS A 245 -7.455 -5.772 -1.135 1.00 0.00 C ATOM 323 C LYS A 245 -6.409 -5.800 -2.237 1.00 0.00 C ATOM 324 O LYS A 245 -5.287 -5.362 -2.024 1.00 0.00 O ATOM 325 CB LYS A 245 -8.841 -5.492 -1.717 1.00 0.00 C ATOM 326 CG LYS A 245 -9.973 -5.609 -0.706 1.00 0.00 C ATOM 327 CD LYS A 245 -11.294 -5.066 -1.253 1.00 0.00 C ATOM 328 CE LYS A 245 -11.414 -3.543 -1.082 1.00 0.00 C ATOM 329 NZ LYS A 245 -10.418 -2.780 -1.887 1.00 0.00 N ATOM 0 H LYS A 245 -7.054 -3.794 -0.632 1.00 0.00 H new ATOM 0 HA LYS A 245 -7.483 -6.739 -0.632 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -8.849 -4.488 -2.142 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -9.027 -6.186 -2.537 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -10.100 -6.654 -0.425 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -9.706 -5.066 0.200 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -11.378 -5.318 -2.310 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -12.124 -5.553 -0.742 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -12.418 -3.230 -1.368 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -11.289 -3.291 -0.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -10.684 -1.775 -1.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -9.475 -2.881 -1.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -10.399 -3.151 -2.858 1.00 0.00 H new ATOM 332 N LYS A 246 -6.754 -6.326 -3.394 1.00 0.00 N ATOM 333 CA LYS A 246 -5.839 -6.302 -4.519 1.00 0.00 C ATOM 334 C LYS A 246 -6.321 -5.249 -5.509 1.00 0.00 C ATOM 335 O LYS A 246 -7.521 -4.952 -5.556 1.00 0.00 O ATOM 336 CB LYS A 246 -5.741 -7.684 -5.191 1.00 0.00 C ATOM 337 CG LYS A 246 -7.011 -8.130 -5.897 1.00 0.00 C ATOM 338 CD LYS A 246 -6.849 -9.508 -6.517 1.00 0.00 C ATOM 339 CE LYS A 246 -8.082 -9.907 -7.318 1.00 0.00 C ATOM 340 NZ LYS A 246 -8.282 -9.040 -8.512 1.00 0.00 N ATOM 0 H LYS A 246 -7.652 -6.772 -3.581 1.00 0.00 H new ATOM 0 HA LYS A 246 -4.839 -6.050 -4.167 1.00 0.00 H new ATOM 0 HB2 LYS A 246 -4.925 -7.666 -5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 246 -5.481 -8.425 -4.435 1.00 0.00 H new ATOM 0 HG2 LYS A 246 -7.838 -8.144 -5.187 1.00 0.00 H new ATOM 0 HG3 LYS A 246 -7.270 -7.409 -6.673 1.00 0.00 H new ATOM 0 HD2 LYS A 246 -5.974 -9.516 -7.166 1.00 0.00 H new ATOM 0 HD3 LYS A 246 -6.670 -10.243 -5.732 1.00 0.00 H new ATOM 0 HE2 LYS A 246 -7.986 -10.945 -7.637 1.00 0.00 H new ATOM 0 HE3 LYS A 246 -8.963 -9.850 -6.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 246 -8.976 -9.481 -9.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 246 -8.632 -8.109 -8.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 246 -7.378 -8.924 -9.012 1.00 0.00 H new ATOM 343 N GLY A 247 -5.415 -4.693 -6.302 1.00 0.00 N ATOM 344 CA GLY A 247 -5.805 -3.640 -7.225 1.00 0.00 C ATOM 345 C GLY A 247 -6.258 -2.363 -6.524 1.00 0.00 C ATOM 346 O GLY A 247 -7.111 -1.632 -7.041 1.00 0.00 O ATOM 0 H GLY A 247 -4.427 -4.947 -6.325 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -4.964 -3.409 -7.879 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -6.612 -4.004 -7.861 1.00 0.00 H new ATOM 350 N ASP A 248 -5.699 -2.096 -5.352 1.00 0.00 N ATOM 351 CA ASP A 248 -6.015 -0.875 -4.608 1.00 0.00 C ATOM 352 C ASP A 248 -4.914 0.142 -4.800 1.00 0.00 C ATOM 353 O ASP A 248 -3.787 -0.211 -5.178 1.00 0.00 O ATOM 354 CB ASP A 248 -6.203 -1.141 -3.098 1.00 0.00 C ATOM 355 CG ASP A 248 -7.593 -1.620 -2.730 1.00 0.00 C ATOM 356 OD1 ASP A 248 -8.579 -0.962 -3.120 1.00 0.00 O ATOM 357 OD2 ASP A 248 -7.708 -2.638 -2.015 1.00 0.00 O ATOM 0 H ASP A 248 -5.023 -2.706 -4.892 1.00 0.00 H new ATOM 0 HA ASP A 248 -6.958 -0.493 -5.000 1.00 0.00 H new ATOM 0 HB2 ASP A 248 -5.475 -1.886 -2.776 1.00 0.00 H new ATOM 0 HB3 ASP A 248 -5.987 -0.225 -2.548 1.00 0.00 H new ATOM 360 N ILE A 249 -5.222 1.394 -4.518 1.00 0.00 N ATOM 361 CA ILE A 249 -4.265 2.472 -4.662 1.00 0.00 C ATOM 362 C ILE A 249 -3.997 3.093 -3.297 1.00 0.00 C ATOM 363 O ILE A 249 -4.704 4.002 -2.858 1.00 0.00 O ATOM 364 CB ILE A 249 -4.769 3.568 -5.642 1.00 0.00 C ATOM 365 CG1 ILE A 249 -5.218 2.946 -6.974 1.00 0.00 C ATOM 366 CG2 ILE A 249 -3.683 4.613 -5.885 1.00 0.00 C ATOM 367 CD1 ILE A 249 -4.115 2.234 -7.732 1.00 0.00 C ATOM 0 H ILE A 249 -6.139 1.690 -4.184 1.00 0.00 H new ATOM 0 HA ILE A 249 -3.347 2.054 -5.076 1.00 0.00 H new ATOM 0 HB ILE A 249 -5.628 4.059 -5.185 1.00 0.00 H new ATOM 0 HG12 ILE A 249 -6.024 2.238 -6.778 1.00 0.00 H new ATOM 0 HG13 ILE A 249 -5.630 3.731 -7.608 1.00 0.00 H new ATOM 0 HG21 ILE A 249 -4.055 5.371 -6.574 1.00 0.00 H new ATOM 0 HG22 ILE A 249 -3.412 5.083 -4.940 1.00 0.00 H new ATOM 0 HG23 ILE A 249 -2.805 4.132 -6.316 1.00 0.00 H new ATOM 0 HD11 ILE A 249 -4.516 1.825 -8.659 1.00 0.00 H new ATOM 0 HD12 ILE A 249 -3.317 2.940 -7.963 1.00 0.00 H new ATOM 0 HD13 ILE A 249 -3.717 1.424 -7.120 1.00 0.00 H new ATOM 378 N ILE A 250 -2.992 2.588 -2.627 1.00 0.00 N ATOM 379 CA ILE A 250 -2.663 3.031 -1.286 1.00 0.00 C ATOM 380 C ILE A 250 -1.877 4.329 -1.318 1.00 0.00 C ATOM 381 O ILE A 250 -0.936 4.477 -2.102 1.00 0.00 O ATOM 382 CB ILE A 250 -1.831 1.964 -0.534 1.00 0.00 C ATOM 383 CG1 ILE A 250 -2.526 0.603 -0.598 1.00 0.00 C ATOM 384 CG2 ILE A 250 -1.607 2.380 0.920 1.00 0.00 C ATOM 385 CD1 ILE A 250 -1.718 -0.520 0.013 1.00 0.00 C ATOM 0 H ILE A 250 -2.377 1.860 -2.990 1.00 0.00 H new ATOM 0 HA ILE A 250 -3.606 3.190 -0.762 1.00 0.00 H new ATOM 0 HB ILE A 250 -0.859 1.882 -1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -3.485 0.670 -0.085 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -2.738 0.362 -1.640 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -1.020 1.616 1.431 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -1.071 3.329 0.949 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -2.570 2.492 1.419 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -2.274 -1.454 -0.069 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -0.769 -0.615 -0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -1.528 -0.302 1.064 1.00 0.00 H new ATOM 396 N ASP A 251 -2.283 5.275 -0.491 1.00 0.00 N ATOM 397 CA ASP A 251 -1.556 6.525 -0.348 1.00 0.00 C ATOM 398 C ASP A 251 -0.427 6.301 0.638 1.00 0.00 C ATOM 399 O ASP A 251 -0.520 5.416 1.475 1.00 0.00 O ATOM 400 CB ASP A 251 -2.485 7.639 0.144 1.00 0.00 C ATOM 401 CG ASP A 251 -1.751 8.943 0.385 1.00 0.00 C ATOM 402 OD1 ASP A 251 -1.306 9.568 -0.593 1.00 0.00 O ATOM 403 OD2 ASP A 251 -1.623 9.352 1.556 1.00 0.00 O ATOM 0 H ASP A 251 -3.115 5.202 0.094 1.00 0.00 H new ATOM 0 HA ASP A 251 -1.156 6.835 -1.313 1.00 0.00 H new ATOM 0 HB2 ASP A 251 -3.274 7.800 -0.590 1.00 0.00 H new ATOM 0 HB3 ASP A 251 -2.969 7.322 1.068 1.00 0.00 H new ATOM 406 N ILE A 252 0.624 7.083 0.550 1.00 0.00 N ATOM 407 CA ILE A 252 1.771 6.871 1.418 1.00 0.00 C ATOM 408 C ILE A 252 2.267 8.177 2.019 1.00 0.00 C ATOM 409 O ILE A 252 2.412 9.184 1.321 1.00 0.00 O ATOM 410 CB ILE A 252 2.937 6.175 0.672 1.00 0.00 C ATOM 411 CG1 ILE A 252 2.433 4.952 -0.101 1.00 0.00 C ATOM 412 CG2 ILE A 252 4.005 5.751 1.667 1.00 0.00 C ATOM 413 CD1 ILE A 252 3.442 4.391 -1.072 1.00 0.00 C ATOM 0 H ILE A 252 0.714 7.862 -0.102 1.00 0.00 H new ATOM 0 HA ILE A 252 1.430 6.218 2.221 1.00 0.00 H new ATOM 0 HB ILE A 252 3.364 6.882 -0.039 1.00 0.00 H new ATOM 0 HG12 ILE A 252 2.154 4.174 0.609 1.00 0.00 H new ATOM 0 HG13 ILE A 252 1.530 5.225 -0.646 1.00 0.00 H new ATOM 0 HG21 ILE A 252 4.822 5.262 1.137 1.00 0.00 H new ATOM 0 HG22 ILE A 252 4.385 6.629 2.189 1.00 0.00 H new ATOM 0 HG23 ILE A 252 3.575 5.057 2.389 1.00 0.00 H new ATOM 0 HD11 ILE A 252 3.015 3.528 -1.582 1.00 0.00 H new ATOM 0 HD12 ILE A 252 3.704 5.153 -1.806 1.00 0.00 H new ATOM 0 HD13 ILE A 252 4.338 4.086 -0.531 1.00 0.00 H new ATOM 424 N ILE A 253 2.513 8.159 3.320 1.00 0.00 N ATOM 425 CA ILE A 253 3.021 9.325 4.023 1.00 0.00 C ATOM 426 C ILE A 253 4.478 9.094 4.459 1.00 0.00 C ATOM 427 O ILE A 253 5.248 10.037 4.631 1.00 0.00 O ATOM 428 CB ILE A 253 2.131 9.672 5.254 1.00 0.00 C ATOM 429 CG1 ILE A 253 2.646 10.927 5.971 1.00 0.00 C ATOM 430 CG2 ILE A 253 2.051 8.492 6.217 1.00 0.00 C ATOM 431 CD1 ILE A 253 1.795 11.353 7.150 1.00 0.00 C ATOM 0 H ILE A 253 2.367 7.342 3.914 1.00 0.00 H new ATOM 0 HA ILE A 253 2.990 10.172 3.338 1.00 0.00 H new ATOM 0 HB ILE A 253 1.125 9.882 4.891 1.00 0.00 H new ATOM 0 HG12 ILE A 253 3.663 10.744 6.317 1.00 0.00 H new ATOM 0 HG13 ILE A 253 2.695 11.748 5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 253 1.424 8.759 7.068 1.00 0.00 H new ATOM 0 HG22 ILE A 253 1.620 7.632 5.704 1.00 0.00 H new ATOM 0 HG23 ILE A 253 3.052 8.240 6.568 1.00 0.00 H new ATOM 0 HD11 ILE A 253 2.224 12.246 7.604 1.00 0.00 H new ATOM 0 HD12 ILE A 253 0.783 11.569 6.809 1.00 0.00 H new ATOM 0 HD13 ILE A 253 1.766 10.550 7.887 1.00 0.00 H new ATOM 442 N CYS A 254 4.847 7.831 4.591 1.00 0.00 N ATOM 443 CA CYS A 254 6.196 7.473 5.007 1.00 0.00 C ATOM 444 C CYS A 254 6.635 6.160 4.382 1.00 0.00 C ATOM 445 O CYS A 254 6.009 5.119 4.595 1.00 0.00 O ATOM 446 CB CYS A 254 6.283 7.386 6.532 1.00 0.00 C ATOM 447 SG CYS A 254 7.953 7.107 7.172 1.00 0.00 S ATOM 0 H CYS A 254 4.233 7.035 4.417 1.00 0.00 H new ATOM 0 HA CYS A 254 6.869 8.257 4.659 1.00 0.00 H new ATOM 0 HB2 CYS A 254 5.893 8.310 6.959 1.00 0.00 H new ATOM 0 HB3 CYS A 254 5.636 6.579 6.875 1.00 0.00 H new ATOM 0 HG CYS A 254 7.917 7.052 8.470 1.00 0.00 H new ATOM 453 N LYS A 255 7.705 6.212 3.604 1.00 0.00 N ATOM 454 CA LYS A 255 8.243 5.019 2.973 1.00 0.00 C ATOM 455 C LYS A 255 9.450 4.501 3.742 1.00 0.00 C ATOM 456 O LYS A 255 10.535 5.074 3.666 1.00 0.00 O ATOM 457 CB LYS A 255 8.640 5.279 1.505 1.00 0.00 C ATOM 458 CG LYS A 255 7.471 5.563 0.565 1.00 0.00 C ATOM 459 CD LYS A 255 7.028 7.022 0.610 1.00 0.00 C ATOM 460 CE LYS A 255 8.044 7.930 -0.060 1.00 0.00 C ATOM 461 NZ LYS A 255 7.625 9.350 -0.039 1.00 0.00 N ATOM 0 H LYS A 255 8.218 7.069 3.395 1.00 0.00 H new ATOM 0 HA LYS A 255 7.455 4.266 2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 255 9.327 6.125 1.474 1.00 0.00 H new ATOM 0 HB3 LYS A 255 9.185 4.412 1.132 1.00 0.00 H new ATOM 0 HG2 LYS A 255 7.757 5.305 -0.454 1.00 0.00 H new ATOM 0 HG3 LYS A 255 6.630 4.923 0.832 1.00 0.00 H new ATOM 0 HD2 LYS A 255 6.062 7.126 0.115 1.00 0.00 H new ATOM 0 HD3 LYS A 255 6.890 7.330 1.646 1.00 0.00 H new ATOM 0 HE2 LYS A 255 9.006 7.829 0.443 1.00 0.00 H new ATOM 0 HE3 LYS A 255 8.189 7.611 -1.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 8.179 9.886 -0.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 6.614 9.417 -0.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 7.787 9.746 0.909 1.00 0.00 H new ATOM 464 N THR A 256 9.247 3.446 4.508 1.00 0.00 N ATOM 465 CA THR A 256 10.324 2.812 5.246 1.00 0.00 C ATOM 466 C THR A 256 10.842 1.600 4.460 1.00 0.00 C ATOM 467 O THR A 256 10.215 0.539 4.449 1.00 0.00 O ATOM 468 CB THR A 256 9.844 2.360 6.643 1.00 0.00 C ATOM 469 OG1 THR A 256 9.271 3.478 7.338 1.00 0.00 O ATOM 470 CG2 THR A 256 11.000 1.786 7.461 1.00 0.00 C ATOM 0 H THR A 256 8.336 3.006 4.636 1.00 0.00 H new ATOM 0 HA THR A 256 11.127 3.537 5.377 1.00 0.00 H new ATOM 0 HB THR A 256 9.094 1.579 6.514 1.00 0.00 H new ATOM 0 HG1 THR A 256 8.965 3.191 8.224 1.00 0.00 H new ATOM 0 HG21 THR A 256 10.634 1.476 8.440 1.00 0.00 H new ATOM 0 HG22 THR A 256 11.421 0.925 6.941 1.00 0.00 H new ATOM 0 HG23 THR A 256 11.770 2.547 7.586 1.00 0.00 H new ATOM 477 N PRO A 257 11.997 1.744 3.787 1.00 0.00 N ATOM 478 CA PRO A 257 12.562 0.694 2.918 1.00 0.00 C ATOM 479 C PRO A 257 13.117 -0.519 3.685 1.00 0.00 C ATOM 480 O PRO A 257 14.089 -1.142 3.257 1.00 0.00 O ATOM 481 CB PRO A 257 13.685 1.424 2.177 1.00 0.00 C ATOM 482 CG PRO A 257 14.100 2.515 3.099 1.00 0.00 C ATOM 483 CD PRO A 257 12.856 2.946 3.825 1.00 0.00 C ATOM 0 HA PRO A 257 11.798 0.264 2.270 1.00 0.00 H new ATOM 0 HB2 PRO A 257 14.516 0.753 1.958 1.00 0.00 H new ATOM 0 HB3 PRO A 257 13.337 1.822 1.224 1.00 0.00 H new ATOM 0 HG2 PRO A 257 14.858 2.165 3.800 1.00 0.00 H new ATOM 0 HG3 PRO A 257 14.536 3.347 2.546 1.00 0.00 H new ATOM 0 HD2 PRO A 257 13.074 3.250 4.849 1.00 0.00 H new ATOM 0 HD3 PRO A 257 12.379 3.795 3.335 1.00 0.00 H new ATOM 491 N MET A 258 12.489 -0.857 4.797 1.00 0.00 N ATOM 492 CA MET A 258 12.894 -2.012 5.578 1.00 0.00 C ATOM 493 C MET A 258 11.864 -3.133 5.443 1.00 0.00 C ATOM 494 O MET A 258 12.201 -4.316 5.509 1.00 0.00 O ATOM 495 CB MET A 258 13.068 -1.635 7.051 1.00 0.00 C ATOM 496 CG MET A 258 13.604 -2.768 7.915 1.00 0.00 C ATOM 497 SD MET A 258 13.673 -2.347 9.668 1.00 0.00 S ATOM 498 CE MET A 258 14.800 -0.953 9.650 1.00 0.00 C ATOM 0 H MET A 258 11.694 -0.346 5.180 1.00 0.00 H new ATOM 0 HA MET A 258 13.852 -2.364 5.194 1.00 0.00 H new ATOM 0 HB2 MET A 258 13.746 -0.785 7.121 1.00 0.00 H new ATOM 0 HB3 MET A 258 12.107 -1.310 7.449 1.00 0.00 H new ATOM 0 HG2 MET A 258 12.974 -3.647 7.783 1.00 0.00 H new ATOM 0 HG3 MET A 258 14.603 -3.037 7.572 1.00 0.00 H new ATOM 0 HE1 MET A 258 15.176 -0.776 10.658 1.00 0.00 H new ATOM 0 HE2 MET A 258 15.635 -1.169 8.984 1.00 0.00 H new ATOM 0 HE3 MET A 258 14.275 -0.065 9.298 1.00 0.00 H new ATOM 508 N GLY A 259 10.607 -2.754 5.245 1.00 0.00 N ATOM 509 CA GLY A 259 9.557 -3.742 5.108 1.00 0.00 C ATOM 510 C GLY A 259 8.169 -3.138 5.171 1.00 0.00 C ATOM 511 O GLY A 259 7.351 -3.348 4.274 1.00 0.00 O ATOM 0 H GLY A 259 10.298 -1.784 5.177 1.00 0.00 H new ATOM 0 HA2 GLY A 259 9.678 -4.264 4.159 1.00 0.00 H new ATOM 0 HA3 GLY A 259 9.660 -4.487 5.897 1.00 0.00 H new ATOM 515 N MET A 260 7.902 -2.381 6.221 1.00 0.00 N ATOM 516 CA MET A 260 6.589 -1.782 6.406 1.00 0.00 C ATOM 517 C MET A 260 6.583 -0.311 6.026 1.00 0.00 C ATOM 518 O MET A 260 7.494 0.434 6.371 1.00 0.00 O ATOM 519 CB MET A 260 6.097 -1.952 7.854 1.00 0.00 C ATOM 520 CG MET A 260 5.606 -3.359 8.198 1.00 0.00 C ATOM 521 SD MET A 260 6.918 -4.603 8.212 1.00 0.00 S ATOM 522 CE MET A 260 7.952 -4.003 9.550 1.00 0.00 C ATOM 0 H MET A 260 8.574 -2.166 6.958 1.00 0.00 H new ATOM 0 HA MET A 260 5.905 -2.309 5.740 1.00 0.00 H new ATOM 0 HB2 MET A 260 6.908 -1.688 8.533 1.00 0.00 H new ATOM 0 HB3 MET A 260 5.288 -1.245 8.034 1.00 0.00 H new ATOM 0 HG2 MET A 260 5.127 -3.338 9.177 1.00 0.00 H new ATOM 0 HG3 MET A 260 4.844 -3.655 7.477 1.00 0.00 H new ATOM 0 HE1 MET A 260 8.594 -4.810 9.904 1.00 0.00 H new ATOM 0 HE2 MET A 260 8.569 -3.179 9.192 1.00 0.00 H new ATOM 0 HE3 MET A 260 7.322 -3.655 10.369 1.00 0.00 H new ATOM 532 N TRP A 261 5.558 0.086 5.294 1.00 0.00 N ATOM 533 CA TRP A 261 5.365 1.473 4.899 1.00 0.00 C ATOM 534 C TRP A 261 4.145 2.042 5.595 1.00 0.00 C ATOM 535 O TRP A 261 3.206 1.310 5.899 1.00 0.00 O ATOM 536 CB TRP A 261 5.180 1.591 3.381 1.00 0.00 C ATOM 537 CG TRP A 261 6.444 1.464 2.596 1.00 0.00 C ATOM 538 CD1 TRP A 261 7.664 1.121 3.070 1.00 0.00 C ATOM 539 CD2 TRP A 261 6.607 1.685 1.194 1.00 0.00 C ATOM 540 NE1 TRP A 261 8.584 1.123 2.056 1.00 0.00 N ATOM 541 CE2 TRP A 261 7.962 1.462 0.892 1.00 0.00 C ATOM 542 CE3 TRP A 261 5.741 2.049 0.165 1.00 0.00 C ATOM 543 CZ2 TRP A 261 8.471 1.591 -0.393 1.00 0.00 C ATOM 544 CZ3 TRP A 261 6.246 2.174 -1.114 1.00 0.00 C ATOM 545 CH2 TRP A 261 7.601 1.948 -1.381 1.00 0.00 C ATOM 0 H TRP A 261 4.832 -0.545 4.955 1.00 0.00 H new ATOM 0 HA TRP A 261 6.253 2.034 5.189 1.00 0.00 H new ATOM 0 HB2 TRP A 261 4.482 0.821 3.051 1.00 0.00 H new ATOM 0 HB3 TRP A 261 4.722 2.554 3.156 1.00 0.00 H new ATOM 0 HD1 TRP A 261 7.881 0.880 4.100 1.00 0.00 H new ATOM 0 HE1 TRP A 261 9.576 0.906 2.156 1.00 0.00 H new ATOM 0 HE3 TRP A 261 4.695 2.230 0.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 261 9.516 1.415 -0.602 1.00 0.00 H new ATOM 0 HZ3 TRP A 261 5.584 2.451 -1.922 1.00 0.00 H new ATOM 0 HH2 TRP A 261 7.966 2.059 -2.391 1.00 0.00 H new ATOM 551 N THR A 262 4.165 3.331 5.863 1.00 0.00 N ATOM 552 CA THR A 262 3.028 3.983 6.472 1.00 0.00 C ATOM 553 C THR A 262 2.178 4.637 5.388 1.00 0.00 C ATOM 554 O THR A 262 2.620 5.588 4.723 1.00 0.00 O ATOM 555 CB THR A 262 3.477 5.048 7.483 1.00 0.00 C ATOM 556 OG1 THR A 262 4.543 4.522 8.286 1.00 0.00 O ATOM 557 CG2 THR A 262 2.321 5.454 8.389 1.00 0.00 C ATOM 0 H THR A 262 4.955 3.946 5.669 1.00 0.00 H new ATOM 0 HA THR A 262 2.444 3.231 7.003 1.00 0.00 H new ATOM 0 HB THR A 262 3.818 5.926 6.934 1.00 0.00 H new ATOM 0 HG1 THR A 262 4.832 5.201 8.931 1.00 0.00 H new ATOM 0 HG21 THR A 262 2.662 6.209 9.097 1.00 0.00 H new ATOM 0 HG22 THR A 262 1.511 5.862 7.785 1.00 0.00 H new ATOM 0 HG23 THR A 262 1.962 4.581 8.934 1.00 0.00 H new ATOM 564 N GLY A 263 0.973 4.137 5.210 1.00 0.00 N ATOM 565 CA GLY A 263 0.116 4.652 4.178 1.00 0.00 C ATOM 566 C GLY A 263 -1.316 4.778 4.616 1.00 0.00 C ATOM 567 O GLY A 263 -1.644 4.502 5.765 1.00 0.00 O ATOM 0 H GLY A 263 0.573 3.381 5.765 1.00 0.00 H new ATOM 0 HA2 GLY A 263 0.482 5.629 3.863 1.00 0.00 H new ATOM 0 HA3 GLY A 263 0.168 3.997 3.309 1.00 0.00 H new ATOM 571 N MET A 264 -2.169 5.166 3.695 1.00 0.00 N ATOM 572 CA MET A 264 -3.573 5.371 3.990 1.00 0.00 C ATOM 573 C MET A 264 -4.452 4.710 2.942 1.00 0.00 C ATOM 574 O MET A 264 -4.258 4.897 1.738 1.00 0.00 O ATOM 575 CB MET A 264 -3.895 6.867 4.098 1.00 0.00 C ATOM 576 CG MET A 264 -5.349 7.160 4.458 1.00 0.00 C ATOM 577 SD MET A 264 -5.678 8.922 4.690 1.00 0.00 S ATOM 578 CE MET A 264 -5.263 9.566 3.068 1.00 0.00 C ATOM 0 H MET A 264 -1.913 5.348 2.725 1.00 0.00 H new ATOM 0 HA MET A 264 -3.784 4.905 4.952 1.00 0.00 H new ATOM 0 HB2 MET A 264 -3.247 7.315 4.851 1.00 0.00 H new ATOM 0 HB3 MET A 264 -3.661 7.349 3.149 1.00 0.00 H new ATOM 0 HG2 MET A 264 -5.997 6.776 3.670 1.00 0.00 H new ATOM 0 HG3 MET A 264 -5.606 6.625 5.372 1.00 0.00 H new ATOM 0 HE1 MET A 264 -5.689 10.562 2.952 1.00 0.00 H new ATOM 0 HE2 MET A 264 -4.179 9.621 2.965 1.00 0.00 H new ATOM 0 HE3 MET A 264 -5.668 8.907 2.300 1.00 0.00 H new ATOM 588 N LEU A 265 -5.403 3.929 3.414 1.00 0.00 N ATOM 589 CA LEU A 265 -6.334 3.215 2.564 1.00 0.00 C ATOM 590 C LEU A 265 -7.588 2.927 3.382 1.00 0.00 C ATOM 591 O LEU A 265 -7.493 2.752 4.584 1.00 0.00 O ATOM 592 CB LEU A 265 -5.682 1.904 2.051 1.00 0.00 C ATOM 593 CG LEU A 265 -6.294 1.242 0.788 1.00 0.00 C ATOM 594 CD1 LEU A 265 -7.602 0.530 1.095 1.00 0.00 C ATOM 595 CD2 LEU A 265 -6.494 2.266 -0.320 1.00 0.00 C ATOM 0 H LEU A 265 -5.553 3.771 4.410 1.00 0.00 H new ATOM 0 HA LEU A 265 -6.599 3.811 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 265 -4.631 2.109 1.847 1.00 0.00 H new ATOM 0 HB3 LEU A 265 -5.713 1.175 2.861 1.00 0.00 H new ATOM 0 HG LEU A 265 -5.583 0.490 0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 265 -7.995 0.081 0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 265 -7.427 -0.250 1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 265 -8.323 1.247 1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 265 -6.924 1.777 -1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 265 -7.168 3.049 0.026 1.00 0.00 H new ATOM 0 HD23 LEU A 265 -5.533 2.706 -0.587 1.00 0.00 H new ATOM 607 N ASN A 266 -8.750 2.971 2.734 1.00 0.00 N ATOM 608 CA ASN A 266 -10.075 2.701 3.361 1.00 0.00 C ATOM 609 C ASN A 266 -10.344 3.581 4.603 1.00 0.00 C ATOM 610 O ASN A 266 -11.014 3.169 5.551 1.00 0.00 O ATOM 611 CB ASN A 266 -10.325 1.153 3.609 1.00 0.00 C ATOM 612 CG ASN A 266 -10.045 0.593 5.030 1.00 0.00 C ATOM 613 OD1 ASN A 266 -10.776 -0.277 5.509 1.00 0.00 O ATOM 614 ND2 ASN A 266 -8.998 1.033 5.680 1.00 0.00 N ATOM 0 H ASN A 266 -8.816 3.197 1.742 1.00 0.00 H new ATOM 0 HA ASN A 266 -10.828 3.004 2.633 1.00 0.00 H new ATOM 0 HB2 ASN A 266 -11.365 0.938 3.363 1.00 0.00 H new ATOM 0 HB3 ASN A 266 -9.709 0.597 2.902 1.00 0.00 H new ATOM 0 HD21 ASN A 266 -8.774 0.656 6.601 1.00 0.00 H new ATOM 0 HD22 ASN A 266 -8.406 1.753 5.266 1.00 0.00 H new ATOM 621 N ASN A 267 -9.845 4.825 4.539 1.00 0.00 N ATOM 622 CA ASN A 267 -10.027 5.839 5.601 1.00 0.00 C ATOM 623 C ASN A 267 -9.160 5.587 6.817 1.00 0.00 C ATOM 624 O ASN A 267 -9.363 6.201 7.868 1.00 0.00 O ATOM 625 CB ASN A 267 -11.498 5.984 6.022 1.00 0.00 C ATOM 626 CG ASN A 267 -12.266 6.928 5.131 1.00 0.00 C ATOM 627 OD1 ASN A 267 -12.890 6.517 4.154 1.00 0.00 O ATOM 628 ND2 ASN A 267 -12.223 8.205 5.454 1.00 0.00 N ATOM 0 H ASN A 267 -9.300 5.162 3.746 1.00 0.00 H new ATOM 0 HA ASN A 267 -9.702 6.779 5.155 1.00 0.00 H new ATOM 0 HB2 ASN A 267 -11.975 5.004 6.004 1.00 0.00 H new ATOM 0 HB3 ASN A 267 -11.544 6.342 7.050 1.00 0.00 H new ATOM 0 HD21 ASN A 267 -12.719 8.892 4.886 1.00 0.00 H new ATOM 0 HD22 ASN A 267 -11.694 8.507 6.272 1.00 0.00 H new ATOM 635 N LYS A 268 -8.186 4.720 6.686 1.00 0.00 N ATOM 636 CA LYS A 268 -7.305 4.442 7.792 1.00 0.00 C ATOM 637 C LYS A 268 -5.849 4.522 7.374 1.00 0.00 C ATOM 638 O LYS A 268 -5.465 4.016 6.321 1.00 0.00 O ATOM 639 CB LYS A 268 -7.598 3.070 8.407 1.00 0.00 C ATOM 640 CG LYS A 268 -6.666 2.724 9.558 1.00 0.00 C ATOM 641 CD LYS A 268 -6.967 1.362 10.143 1.00 0.00 C ATOM 642 CE LYS A 268 -5.931 0.980 11.187 1.00 0.00 C ATOM 643 NZ LYS A 268 -5.892 1.942 12.321 1.00 0.00 N ATOM 0 H LYS A 268 -7.985 4.199 5.832 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.490 5.207 8.547 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -8.628 3.050 8.762 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -7.512 2.306 7.635 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -5.634 2.748 9.208 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -6.756 3.481 10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -7.959 1.367 10.594 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -6.981 0.616 9.349 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -6.152 -0.018 11.567 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -4.947 0.933 10.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -5.907 1.420 13.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -5.022 2.510 12.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -6.719 2.570 12.272 1.00 0.00 H new ATOM 646 N VAL A 269 -5.056 5.184 8.189 1.00 0.00 N ATOM 647 CA VAL A 269 -3.629 5.249 7.983 1.00 0.00 C ATOM 648 C VAL A 269 -2.961 4.168 8.837 1.00 0.00 C ATOM 649 O VAL A 269 -3.291 4.004 10.014 1.00 0.00 O ATOM 650 CB VAL A 269 -3.060 6.660 8.336 1.00 0.00 C ATOM 651 CG1 VAL A 269 -3.376 7.042 9.773 1.00 0.00 C ATOM 652 CG2 VAL A 269 -1.558 6.729 8.077 1.00 0.00 C ATOM 0 H VAL A 269 -5.384 5.691 9.011 1.00 0.00 H new ATOM 0 HA VAL A 269 -3.415 5.076 6.928 1.00 0.00 H new ATOM 0 HB VAL A 269 -3.550 7.382 7.683 1.00 0.00 H new ATOM 0 HG11 VAL A 269 -2.966 8.029 9.986 1.00 0.00 H new ATOM 0 HG12 VAL A 269 -4.456 7.060 9.916 1.00 0.00 H new ATOM 0 HG13 VAL A 269 -2.933 6.311 10.450 1.00 0.00 H new ATOM 0 HG21 VAL A 269 -1.190 7.723 8.332 1.00 0.00 H new ATOM 0 HG22 VAL A 269 -1.049 5.985 8.690 1.00 0.00 H new ATOM 0 HG23 VAL A 269 -1.361 6.528 7.024 1.00 0.00 H new ATOM 662 N GLY A 270 -2.064 3.413 8.251 1.00 0.00 N ATOM 663 CA GLY A 270 -1.425 2.345 8.983 1.00 0.00 C ATOM 664 C GLY A 270 -0.192 1.843 8.288 1.00 0.00 C ATOM 665 O GLY A 270 0.406 2.559 7.485 1.00 0.00 O ATOM 0 H GLY A 270 -1.762 3.515 7.282 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -1.161 2.697 9.980 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -2.129 1.522 9.111 1.00 0.00 H new ATOM 669 N ASN A 271 0.184 0.614 8.575 1.00 0.00 N ATOM 670 CA ASN A 271 1.373 0.033 7.989 1.00 0.00 C ATOM 671 C ASN A 271 1.034 -1.169 7.125 1.00 0.00 C ATOM 672 O ASN A 271 -0.063 -1.729 7.215 1.00 0.00 O ATOM 673 CB ASN A 271 2.411 -0.341 9.070 1.00 0.00 C ATOM 674 CG ASN A 271 1.863 -1.257 10.162 1.00 0.00 C ATOM 675 OD1 ASN A 271 0.953 -2.053 9.936 1.00 0.00 O ATOM 676 ND2 ASN A 271 2.428 -1.158 11.346 1.00 0.00 N ATOM 0 H ASN A 271 -0.319 -0.003 9.213 1.00 0.00 H new ATOM 0 HA ASN A 271 1.820 0.791 7.346 1.00 0.00 H new ATOM 0 HB2 ASN A 271 3.260 -0.830 8.591 1.00 0.00 H new ATOM 0 HB3 ASN A 271 2.787 0.573 9.530 1.00 0.00 H new ATOM 0 HD21 ASN A 271 2.114 -1.753 12.113 1.00 0.00 H new ATOM 0 HD22 ASN A 271 3.181 -0.486 11.497 1.00 0.00 H new ATOM 683 N PHE A 272 1.988 -1.567 6.309 1.00 0.00 N ATOM 684 CA PHE A 272 1.828 -2.678 5.389 1.00 0.00 C ATOM 685 C PHE A 272 3.175 -3.010 4.784 1.00 0.00 C ATOM 686 O PHE A 272 4.052 -2.150 4.721 1.00 0.00 O ATOM 687 CB PHE A 272 0.814 -2.336 4.272 1.00 0.00 C ATOM 688 CG PHE A 272 1.214 -1.168 3.400 1.00 0.00 C ATOM 689 CD1 PHE A 272 0.920 0.132 3.780 1.00 0.00 C ATOM 690 CD2 PHE A 272 1.881 -1.374 2.203 1.00 0.00 C ATOM 691 CE1 PHE A 272 1.284 1.201 2.987 1.00 0.00 C ATOM 692 CE2 PHE A 272 2.247 -0.307 1.405 1.00 0.00 C ATOM 693 CZ PHE A 272 1.948 0.981 1.798 1.00 0.00 C ATOM 0 H PHE A 272 2.906 -1.125 6.264 1.00 0.00 H new ATOM 0 HA PHE A 272 1.442 -3.538 5.936 1.00 0.00 H new ATOM 0 HB2 PHE A 272 0.677 -3.214 3.641 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -0.151 -2.118 4.729 1.00 0.00 H new ATOM 0 HD1 PHE A 272 0.399 0.311 4.709 1.00 0.00 H new ATOM 0 HD2 PHE A 272 2.118 -2.380 1.890 1.00 0.00 H new ATOM 0 HE1 PHE A 272 1.049 2.209 3.297 1.00 0.00 H new ATOM 0 HE2 PHE A 272 2.767 -0.481 0.474 1.00 0.00 H new ATOM 0 HZ PHE A 272 2.233 1.816 1.176 1.00 0.00 H new ATOM 699 N LYS A 273 3.351 -4.238 4.357 1.00 0.00 N ATOM 700 CA LYS A 273 4.602 -4.637 3.748 1.00 0.00 C ATOM 701 C LYS A 273 4.593 -4.299 2.268 1.00 0.00 C ATOM 702 O LYS A 273 3.837 -4.887 1.485 1.00 0.00 O ATOM 703 CB LYS A 273 4.871 -6.122 3.975 1.00 0.00 C ATOM 704 CG LYS A 273 4.996 -6.489 5.444 1.00 0.00 C ATOM 705 CD LYS A 273 5.333 -7.956 5.631 1.00 0.00 C ATOM 706 CE LYS A 273 5.479 -8.300 7.105 1.00 0.00 C ATOM 707 NZ LYS A 273 5.816 -9.728 7.315 1.00 0.00 N ATOM 0 H LYS A 273 2.650 -4.976 4.418 1.00 0.00 H new ATOM 0 HA LYS A 273 5.412 -4.083 4.221 1.00 0.00 H new ATOM 0 HB2 LYS A 273 4.064 -6.703 3.529 1.00 0.00 H new ATOM 0 HB3 LYS A 273 5.789 -6.402 3.458 1.00 0.00 H new ATOM 0 HG2 LYS A 273 5.769 -5.876 5.907 1.00 0.00 H new ATOM 0 HG3 LYS A 273 4.061 -6.263 5.956 1.00 0.00 H new ATOM 0 HD2 LYS A 273 4.551 -8.572 5.186 1.00 0.00 H new ATOM 0 HD3 LYS A 273 6.259 -8.189 5.106 1.00 0.00 H new ATOM 0 HE2 LYS A 273 6.256 -7.676 7.547 1.00 0.00 H new ATOM 0 HE3 LYS A 273 4.549 -8.067 7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 5.906 -9.917 8.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 5.063 -10.325 6.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 6.716 -9.945 6.842 1.00 0.00 H new ATOM 710 N PHE A 274 5.436 -3.340 1.889 1.00 0.00 N ATOM 711 CA PHE A 274 5.500 -2.840 0.509 1.00 0.00 C ATOM 712 C PHE A 274 5.824 -3.935 -0.509 1.00 0.00 C ATOM 713 O PHE A 274 5.697 -3.726 -1.709 1.00 0.00 O ATOM 714 CB PHE A 274 6.506 -1.689 0.384 1.00 0.00 C ATOM 715 CG PHE A 274 7.955 -2.102 0.454 1.00 0.00 C ATOM 716 CD1 PHE A 274 8.593 -2.245 1.671 1.00 0.00 C ATOM 717 CD2 PHE A 274 8.677 -2.335 -0.706 1.00 0.00 C ATOM 718 CE1 PHE A 274 9.923 -2.615 1.734 1.00 0.00 C ATOM 719 CE2 PHE A 274 10.004 -2.703 -0.650 1.00 0.00 C ATOM 720 CZ PHE A 274 10.629 -2.844 0.570 1.00 0.00 C ATOM 0 H PHE A 274 6.093 -2.887 2.524 1.00 0.00 H new ATOM 0 HA PHE A 274 4.502 -2.470 0.276 1.00 0.00 H new ATOM 0 HB2 PHE A 274 6.335 -1.177 -0.563 1.00 0.00 H new ATOM 0 HB3 PHE A 274 6.310 -0.967 1.177 1.00 0.00 H new ATOM 0 HD1 PHE A 274 8.046 -2.065 2.584 1.00 0.00 H new ATOM 0 HD2 PHE A 274 8.194 -2.227 -1.666 1.00 0.00 H new ATOM 0 HE1 PHE A 274 10.409 -2.725 2.692 1.00 0.00 H new ATOM 0 HE2 PHE A 274 10.554 -2.881 -1.562 1.00 0.00 H new ATOM 0 HZ PHE A 274 11.669 -3.133 0.615 1.00 0.00 H new ATOM 726 N ILE A 275 6.232 -5.094 -0.027 1.00 0.00 N ATOM 727 CA ILE A 275 6.559 -6.211 -0.898 1.00 0.00 C ATOM 728 C ILE A 275 5.343 -6.649 -1.721 1.00 0.00 C ATOM 729 O ILE A 275 5.489 -7.224 -2.794 1.00 0.00 O ATOM 730 CB ILE A 275 7.102 -7.417 -0.097 1.00 0.00 C ATOM 731 CG1 ILE A 275 6.052 -7.920 0.901 1.00 0.00 C ATOM 732 CG2 ILE A 275 8.391 -7.034 0.618 1.00 0.00 C ATOM 733 CD1 ILE A 275 6.497 -9.122 1.706 1.00 0.00 C ATOM 0 H ILE A 275 6.346 -5.288 0.968 1.00 0.00 H new ATOM 0 HA ILE A 275 7.339 -5.863 -1.576 1.00 0.00 H new ATOM 0 HB ILE A 275 7.321 -8.228 -0.792 1.00 0.00 H new ATOM 0 HG12 ILE A 275 5.798 -7.110 1.585 1.00 0.00 H new ATOM 0 HG13 ILE A 275 5.142 -8.175 0.358 1.00 0.00 H new ATOM 0 HG21 ILE A 275 8.764 -7.891 1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 275 9.137 -6.728 -0.116 1.00 0.00 H new ATOM 0 HG23 ILE A 275 8.196 -6.209 1.303 1.00 0.00 H new ATOM 0 HD11 ILE A 275 5.700 -9.418 2.389 1.00 0.00 H new ATOM 0 HD12 ILE A 275 6.723 -9.948 1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 275 7.389 -8.867 2.278 1.00 0.00 H new ATOM 744 N TYR A 276 4.143 -6.351 -1.218 1.00 0.00 N ATOM 745 CA TYR A 276 2.915 -6.725 -1.909 1.00 0.00 C ATOM 746 C TYR A 276 2.469 -5.634 -2.881 1.00 0.00 C ATOM 747 O TYR A 276 1.580 -5.855 -3.700 1.00 0.00 O ATOM 748 CB TYR A 276 1.785 -6.983 -0.902 1.00 0.00 C ATOM 749 CG TYR A 276 2.073 -8.073 0.109 1.00 0.00 C ATOM 750 CD1 TYR A 276 2.055 -9.411 -0.256 1.00 0.00 C ATOM 751 CD2 TYR A 276 2.351 -7.758 1.432 1.00 0.00 C ATOM 752 CE1 TYR A 276 2.311 -10.406 0.670 1.00 0.00 C ATOM 753 CE2 TYR A 276 2.608 -8.745 2.363 1.00 0.00 C ATOM 754 CZ TYR A 276 2.587 -10.066 1.977 1.00 0.00 C ATOM 755 OH TYR A 276 2.844 -11.054 2.904 1.00 0.00 O ATOM 0 H TYR A 276 3.999 -5.854 -0.339 1.00 0.00 H new ATOM 0 HA TYR A 276 3.126 -7.636 -2.469 1.00 0.00 H new ATOM 0 HB2 TYR A 276 1.575 -6.057 -0.367 1.00 0.00 H new ATOM 0 HB3 TYR A 276 0.881 -7.246 -1.451 1.00 0.00 H new ATOM 0 HD1 TYR A 276 1.838 -9.680 -1.279 1.00 0.00 H new ATOM 0 HD2 TYR A 276 2.367 -6.723 1.739 1.00 0.00 H new ATOM 0 HE1 TYR A 276 2.295 -11.444 0.371 1.00 0.00 H new ATOM 0 HE2 TYR A 276 2.824 -8.482 3.388 1.00 0.00 H new ATOM 0 HH TYR A 276 3.021 -10.645 3.777 1.00 0.00 H new ATOM 761 N VAL A 277 3.073 -4.457 -2.787 1.00 0.00 N ATOM 762 CA VAL A 277 2.645 -3.325 -3.603 1.00 0.00 C ATOM 763 C VAL A 277 3.697 -2.895 -4.629 1.00 0.00 C ATOM 764 O VAL A 277 4.768 -3.497 -4.742 1.00 0.00 O ATOM 765 CB VAL A 277 2.271 -2.104 -2.726 1.00 0.00 C ATOM 766 CG1 VAL A 277 1.281 -2.496 -1.640 1.00 0.00 C ATOM 767 CG2 VAL A 277 3.517 -1.467 -2.121 1.00 0.00 C ATOM 0 H VAL A 277 3.854 -4.260 -2.161 1.00 0.00 H new ATOM 0 HA VAL A 277 1.766 -3.674 -4.144 1.00 0.00 H new ATOM 0 HB VAL A 277 1.791 -1.365 -3.367 1.00 0.00 H new ATOM 0 HG11 VAL A 277 1.035 -1.621 -1.039 1.00 0.00 H new ATOM 0 HG12 VAL A 277 0.373 -2.887 -2.099 1.00 0.00 H new ATOM 0 HG13 VAL A 277 1.724 -3.261 -1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 277 3.228 -0.612 -1.510 1.00 0.00 H new ATOM 0 HG22 VAL A 277 4.035 -2.198 -1.501 1.00 0.00 H new ATOM 0 HG23 VAL A 277 4.180 -1.135 -2.920 1.00 0.00 H new ATOM 777 N ASP A 278 3.358 -1.853 -5.380 1.00 0.00 N ATOM 778 CA ASP A 278 4.242 -1.268 -6.385 1.00 0.00 C ATOM 779 C ASP A 278 4.102 0.249 -6.366 1.00 0.00 C ATOM 780 O ASP A 278 2.999 0.765 -6.223 1.00 0.00 O ATOM 781 CB ASP A 278 3.910 -1.805 -7.771 1.00 0.00 C ATOM 782 CG ASP A 278 4.797 -1.219 -8.847 1.00 0.00 C ATOM 783 OD1 ASP A 278 6.038 -1.266 -8.690 1.00 0.00 O ATOM 784 OD2 ASP A 278 4.262 -0.713 -9.846 1.00 0.00 O ATOM 0 H ASP A 278 2.454 -1.386 -5.309 1.00 0.00 H new ATOM 0 HA ASP A 278 5.271 -1.541 -6.149 1.00 0.00 H new ATOM 0 HB2 ASP A 278 4.013 -2.890 -7.771 1.00 0.00 H new ATOM 0 HB3 ASP A 278 2.868 -1.584 -8.003 1.00 0.00 H new ATOM 787 N VAL A 279 5.208 0.957 -6.530 1.00 0.00 N ATOM 788 CA VAL A 279 5.198 2.418 -6.455 1.00 0.00 C ATOM 789 C VAL A 279 4.794 3.024 -7.785 1.00 0.00 C ATOM 790 O VAL A 279 5.481 2.853 -8.792 1.00 0.00 O ATOM 791 CB VAL A 279 6.576 2.974 -6.039 1.00 0.00 C ATOM 792 CG1 VAL A 279 6.536 4.491 -5.921 1.00 0.00 C ATOM 793 CG2 VAL A 279 7.016 2.354 -4.732 1.00 0.00 C ATOM 0 H VAL A 279 6.124 0.549 -6.716 1.00 0.00 H new ATOM 0 HA VAL A 279 4.467 2.693 -5.695 1.00 0.00 H new ATOM 0 HB VAL A 279 7.299 2.714 -6.812 1.00 0.00 H new ATOM 0 HG11 VAL A 279 7.519 4.859 -5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 279 6.259 4.924 -6.883 1.00 0.00 H new ATOM 0 HG13 VAL A 279 5.801 4.778 -5.169 1.00 0.00 H new ATOM 0 HG21 VAL A 279 7.990 2.754 -4.449 1.00 0.00 H new ATOM 0 HG22 VAL A 279 6.288 2.588 -3.955 1.00 0.00 H new ATOM 0 HG23 VAL A 279 7.088 1.273 -4.848 1.00 0.00 H new ATOM 803 N ILE A 280 3.687 3.738 -7.785 1.00 0.00 N ATOM 804 CA ILE A 280 3.177 4.341 -9.000 1.00 0.00 C ATOM 805 C ILE A 280 2.760 5.785 -8.772 1.00 0.00 C ATOM 806 O ILE A 280 2.843 6.315 -7.661 1.00 0.00 O ATOM 807 CB ILE A 280 1.942 3.581 -9.538 1.00 0.00 C ATOM 808 CG1 ILE A 280 0.819 3.594 -8.495 1.00 0.00 C ATOM 809 CG2 ILE A 280 2.307 2.151 -9.927 1.00 0.00 C ATOM 810 CD1 ILE A 280 -0.523 3.183 -9.044 1.00 0.00 C ATOM 0 H ILE A 280 3.122 3.915 -6.955 1.00 0.00 H new ATOM 0 HA ILE A 280 3.991 4.293 -9.723 1.00 0.00 H new ATOM 0 HB ILE A 280 1.588 4.088 -10.436 1.00 0.00 H new ATOM 0 HG12 ILE A 280 1.087 2.925 -7.677 1.00 0.00 H new ATOM 0 HG13 ILE A 280 0.738 4.596 -8.074 1.00 0.00 H new ATOM 0 HG21 ILE A 280 1.421 1.639 -10.302 1.00 0.00 H new ATOM 0 HG22 ILE A 280 3.072 2.169 -10.703 1.00 0.00 H new ATOM 0 HG23 ILE A 280 2.689 1.623 -9.054 1.00 0.00 H new ATOM 0 HD11 ILE A 280 -1.267 3.216 -8.248 1.00 0.00 H new ATOM 0 HD12 ILE A 280 -0.814 3.866 -9.842 1.00 0.00 H new ATOM 0 HD13 ILE A 280 -0.459 2.169 -9.439 1.00 0.00 H new ATOM 821 N SER A 281 2.334 6.412 -9.842 1.00 0.00 N ATOM 822 CA SER A 281 1.795 7.750 -9.811 1.00 0.00 C ATOM 823 C SER A 281 0.633 7.830 -10.799 1.00 0.00 C ATOM 824 O SER A 281 0.067 8.901 -11.054 1.00 0.00 O ATOM 825 CB SER A 281 2.882 8.762 -10.167 1.00 0.00 C ATOM 826 OG SER A 281 4.002 8.611 -9.308 1.00 0.00 O ATOM 0 H SER A 281 2.353 5.999 -10.775 1.00 0.00 H new ATOM 0 HA SER A 281 1.435 7.986 -8.810 1.00 0.00 H new ATOM 0 HB2 SER A 281 3.190 8.624 -11.203 1.00 0.00 H new ATOM 0 HB3 SER A 281 2.486 9.774 -10.084 1.00 0.00 H new ATOM 0 HG SER A 281 4.690 9.265 -9.550 1.00 0.00 H new ATOM 832 N GLU A 282 0.278 6.670 -11.340 1.00 0.00 N ATOM 833 CA GLU A 282 -0.797 6.549 -12.296 1.00 0.00 C ATOM 834 C GLU A 282 -1.655 5.335 -11.943 1.00 0.00 C ATOM 835 O GLU A 282 -1.263 4.200 -12.288 1.00 0.00 O ATOM 836 CB GLU A 282 -0.228 6.409 -13.716 1.00 0.00 C ATOM 837 CG GLU A 282 -1.280 6.400 -14.818 1.00 0.00 C ATOM 838 CD GLU A 282 -2.025 7.712 -14.934 1.00 0.00 C ATOM 839 OE1 GLU A 282 -3.067 7.870 -14.268 1.00 0.00 O ATOM 840 OE2 GLU A 282 -1.580 8.587 -15.701 1.00 0.00 O ATOM 841 OXT GLU A 282 -2.708 5.521 -11.313 1.00 0.00 O ATOM 0 H GLU A 282 0.736 5.786 -11.121 1.00 0.00 H new ATOM 0 HA GLU A 282 -1.416 7.446 -12.261 1.00 0.00 H new ATOM 0 HB2 GLU A 282 0.465 7.230 -13.899 1.00 0.00 H new ATOM 0 HB3 GLU A 282 0.349 5.486 -13.774 1.00 0.00 H new ATOM 0 HG2 GLU A 282 -0.799 6.176 -15.770 1.00 0.00 H new ATOM 0 HG3 GLU A 282 -1.994 5.599 -14.625 1.00 0.00 H new TER 844 GLU A 282