USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 805 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 177 HIS :FLIP no HD1:sc= -0.69 F(o=-1.7,f=-1.1) USER MOD Set 1.2: A 181 ASN : amide:sc= -0.41 X(o=-1.1,f=-1.3) USER MOD Set 2.1: A 171 ASN : amide:sc= 0.426 K(o=-0.16,f=-4.7!) USER MOD Set 2.2: A 174 ASN : amide:sc= -0.586 K(o=-0.16,f=-7.2!) USER MOD Set 3.1: A 138 MET CE :methyl -104:sc= -0.296 (180deg=-1.06) USER MOD Set 3.2: A 154 MET CE :methyl -171:sc=-0.00129 (180deg=-0.0892) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl 162:sc= -1.4 (180deg=-2.66!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0048 USER MOD Single : A 134 MET CE :methyl 176:sc= -0.583 (180deg=-0.597) USER MOD Single : A 135 SER OG : rot 180:sc= -0.0182 USER MOD Single : A 140 HIS : no HD1:sc= -0.163 X(o=-0.16,f=-0.081) USER MOD Single : A 143 ASN : amide:sc= 0.72 K(o=0.72,f=-0.09) USER MOD Single : A 149 TYR OH : rot 45:sc= 1.21 USER MOD Single : A 150 TYR OH : rot 152:sc= 1.24 USER MOD Single : A 153 ASN : amide:sc= 0.56 K(o=0.56,f=-0.61) USER MOD Single : A 155 TYR OH : rot -58:sc= 0.76 USER MOD Single : A 157 TYR OH : rot 30:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.308 X(o=-0.31,f=0.15) USER MOD Single : A 160 GLN : amide:sc= 0.946 K(o=0.95,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot -101:sc= 1.29 USER MOD Single : A 168 GLN : amide:sc= -0.3 X(o=-0.3,f=-0.67) USER MOD Single : A 170 SER OG : rot -95:sc= 0.00172 USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 82:sc= 0.836 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -1.37 K(o=-1.4,f=-5.5!) USER MOD Single : A 187 HIS : no HE2:sc= 1 K(o=1,f=-5.1!) USER MOD Single : A 188 THR OG1 : rot -11:sc= -0.155 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 83:sc= 1.19 USER MOD Single : A 192 THR OG1 : rot 69:sc= 0.353 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.0053) USER MOD Single : A 199 THR OG1 : rot -87:sc= 1.12 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -175:sc= -0.476 (180deg=-0.537) USER MOD Single : A 206 MET CE :methyl -161:sc= -0.276 (180deg=-0.441) USER MOD Single : A 212 GLN : amide:sc=-0.00744 X(o=-0.0074,f=-0.28) USER MOD Single : A 213 MET CE :methyl 177:sc= -0.115 (180deg=-0.139) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= 0.41 K(o=0.41,f=-4.2!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 126:sc= 0.0143 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.455 F(o=-1,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.917 -12.723 -1.749 1.00 0.00 N ATOM 66 CA LEU A 125 8.703 -12.145 -3.089 1.00 0.00 C ATOM 67 C LEU A 125 9.949 -12.080 -3.969 1.00 0.00 C ATOM 68 O LEU A 125 9.878 -11.678 -5.129 1.00 0.00 O ATOM 69 CB LEU A 125 8.056 -10.781 -2.977 1.00 0.00 C ATOM 70 CG LEU A 125 6.629 -10.790 -2.422 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.230 -9.343 -2.148 1.00 0.00 C ATOM 72 CD2 LEU A 125 5.629 -11.416 -3.405 1.00 0.00 C ATOM 0 HA LEU A 125 8.033 -12.837 -3.599 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.675 -10.152 -2.337 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.044 -10.318 -3.964 1.00 0.00 H new ATOM 0 HG LEU A 125 6.608 -11.393 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.215 -9.314 -1.751 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.917 -8.908 -1.422 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.273 -8.772 -3.075 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.631 -11.400 -2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.627 -10.846 -4.334 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.918 -12.446 -3.612 1.00 0.00 H new ATOM 84 N GLY A 126 11.040 -12.600 -3.435 1.00 0.00 N ATOM 85 CA GLY A 126 12.385 -12.629 -3.989 1.00 0.00 C ATOM 86 C GLY A 126 13.332 -11.725 -3.201 1.00 0.00 C ATOM 87 O GLY A 126 14.238 -11.133 -3.793 1.00 0.00 O ATOM 0 H GLY A 126 11.006 -13.053 -2.522 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.763 -13.651 -3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.358 -12.310 -5.031 1.00 0.00 H new ATOM 91 N GLY A 127 13.108 -11.566 -1.889 1.00 0.00 N ATOM 92 CA GLY A 127 13.910 -10.696 -1.032 1.00 0.00 C ATOM 93 C GLY A 127 13.210 -9.403 -0.618 1.00 0.00 C ATOM 94 O GLY A 127 13.886 -8.461 -0.206 1.00 0.00 O ATOM 0 H GLY A 127 12.356 -12.045 -1.393 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.190 -11.247 -0.134 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.834 -10.445 -1.552 1.00 0.00 H new ATOM 98 N TYR A 128 11.885 -9.301 -0.774 1.00 0.00 N ATOM 99 CA TYR A 128 11.206 -8.039 -0.538 1.00 0.00 C ATOM 100 C TYR A 128 11.141 -7.767 0.961 1.00 0.00 C ATOM 101 O TYR A 128 10.974 -8.661 1.802 1.00 0.00 O ATOM 102 CB TYR A 128 9.813 -8.008 -1.163 1.00 0.00 C ATOM 103 CG TYR A 128 9.771 -7.824 -2.675 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.444 -8.729 -3.513 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.989 -6.804 -3.254 1.00 0.00 C ATOM 106 CE1 TYR A 128 10.270 -8.706 -4.900 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.801 -6.772 -4.656 1.00 0.00 C ATOM 108 CZ TYR A 128 9.420 -7.741 -5.478 1.00 0.00 C ATOM 109 OH TYR A 128 9.204 -7.705 -6.821 1.00 0.00 O ATOM 0 H TYR A 128 11.277 -10.069 -1.058 1.00 0.00 H new ATOM 0 HA TYR A 128 11.780 -7.249 -1.023 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.303 -8.938 -0.914 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.246 -7.200 -0.701 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.110 -9.458 -3.076 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.535 -6.049 -2.629 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.783 -9.422 -5.524 1.00 0.00 H new ATOM 0 HE2 TYR A 128 8.183 -6.005 -5.099 1.00 0.00 H new ATOM 0 HH TYR A 128 8.589 -6.972 -7.034 1.00 0.00 H new ATOM 119 N MET A 129 11.262 -6.487 1.255 1.00 0.00 N ATOM 120 CA MET A 129 11.275 -5.897 2.577 1.00 0.00 C ATOM 121 C MET A 129 9.841 -5.562 2.958 1.00 0.00 C ATOM 122 O MET A 129 8.979 -5.508 2.083 1.00 0.00 O ATOM 123 CB MET A 129 12.130 -4.623 2.548 1.00 0.00 C ATOM 124 CG MET A 129 13.527 -4.738 1.910 1.00 0.00 C ATOM 125 SD MET A 129 14.885 -5.321 2.956 1.00 0.00 S ATOM 126 CE MET A 129 14.193 -6.870 3.581 1.00 0.00 C ATOM 0 H MET A 129 11.361 -5.783 0.523 1.00 0.00 H new ATOM 0 HA MET A 129 11.698 -6.586 3.308 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.574 -3.853 2.012 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.252 -4.273 3.573 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.451 -5.409 1.055 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.800 -3.757 1.522 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.996 -7.497 3.969 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.482 -6.655 4.379 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.683 -7.393 2.772 1.00 0.00 H new ATOM 136 N LEU A 130 9.577 -5.309 4.239 1.00 0.00 N ATOM 137 CA LEU A 130 8.267 -4.896 4.730 1.00 0.00 C ATOM 138 C LEU A 130 8.419 -3.661 5.616 1.00 0.00 C ATOM 139 O LEU A 130 9.327 -3.564 6.450 1.00 0.00 O ATOM 140 CB LEU A 130 7.546 -6.080 5.396 1.00 0.00 C ATOM 141 CG LEU A 130 6.200 -5.716 6.064 1.00 0.00 C ATOM 142 CD1 LEU A 130 5.079 -5.548 5.038 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.795 -6.811 7.050 1.00 0.00 C ATOM 0 H LEU A 130 10.279 -5.387 4.975 1.00 0.00 H new ATOM 0 HA LEU A 130 7.621 -4.597 3.904 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.368 -6.850 4.645 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.205 -6.514 6.148 1.00 0.00 H new ATOM 0 HG LEU A 130 6.344 -4.767 6.580 1.00 0.00 H new ATOM 0 HD11 LEU A 130 4.152 -5.293 5.551 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.340 -4.751 4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.945 -6.480 4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.846 -6.548 7.517 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.688 -7.757 6.519 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.562 -6.911 7.818 1.00 0.00 H new ATOM 155 N GLY A 131 7.539 -2.691 5.378 1.00 0.00 N ATOM 156 CA GLY A 131 7.495 -1.403 6.037 1.00 0.00 C ATOM 157 C GLY A 131 6.868 -1.487 7.421 1.00 0.00 C ATOM 158 O GLY A 131 6.313 -2.512 7.831 1.00 0.00 O ATOM 0 H GLY A 131 6.801 -2.796 4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.506 -1.005 6.122 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.927 -0.703 5.425 1.00 0.00 H new ATOM 162 N SER A 132 6.917 -0.367 8.130 1.00 0.00 N ATOM 163 CA SER A 132 6.227 -0.191 9.389 1.00 0.00 C ATOM 164 C SER A 132 4.742 -0.015 9.114 1.00 0.00 C ATOM 165 O SER A 132 4.347 0.313 7.991 1.00 0.00 O ATOM 166 CB SER A 132 6.777 1.044 10.111 1.00 0.00 C ATOM 167 OG SER A 132 8.155 1.264 9.892 1.00 0.00 O ATOM 0 H SER A 132 7.447 0.454 7.837 1.00 0.00 H new ATOM 0 HA SER A 132 6.381 -1.064 10.023 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.221 1.923 9.783 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.601 0.936 11.181 1.00 0.00 H new ATOM 0 HG SER A 132 8.440 2.066 10.378 1.00 0.00 H new ATOM 173 N ALA A 133 3.914 -0.215 10.138 1.00 0.00 N ATOM 174 CA ALA A 133 2.503 0.096 10.042 1.00 0.00 C ATOM 175 C ALA A 133 2.323 1.601 9.900 1.00 0.00 C ATOM 176 O ALA A 133 3.076 2.385 10.491 1.00 0.00 O ATOM 177 CB ALA A 133 1.770 -0.414 11.274 1.00 0.00 C ATOM 0 H ALA A 133 4.203 -0.591 11.041 1.00 0.00 H new ATOM 0 HA ALA A 133 2.083 -0.396 9.164 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.710 -0.175 11.192 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.894 -1.494 11.350 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.181 0.061 12.165 1.00 0.00 H new ATOM 183 N MET A 134 1.327 1.952 9.093 1.00 0.00 N ATOM 184 CA MET A 134 0.997 3.302 8.675 1.00 0.00 C ATOM 185 C MET A 134 -0.475 3.601 8.936 1.00 0.00 C ATOM 186 O MET A 134 -1.297 2.691 9.141 1.00 0.00 O ATOM 187 CB MET A 134 1.284 3.468 7.174 1.00 0.00 C ATOM 188 CG MET A 134 2.703 3.057 6.775 1.00 0.00 C ATOM 189 SD MET A 134 2.826 2.369 5.113 1.00 0.00 S ATOM 190 CE MET A 134 4.194 3.361 4.500 1.00 0.00 C ATOM 0 H MET A 134 0.695 1.259 8.693 1.00 0.00 H new ATOM 0 HA MET A 134 1.609 3.997 9.249 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.569 2.872 6.607 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.124 4.509 6.894 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.356 3.927 6.847 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.072 2.322 7.490 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.465 3.027 3.498 1.00 0.00 H new ATOM 0 HE2 MET A 134 3.897 4.409 4.465 1.00 0.00 H new ATOM 0 HE3 MET A 134 5.051 3.249 5.164 1.00 0.00 H new ATOM 200 N SER A 135 -0.824 4.886 8.854 1.00 0.00 N ATOM 201 CA SER A 135 -2.197 5.339 8.960 1.00 0.00 C ATOM 202 C SER A 135 -2.894 5.387 7.603 1.00 0.00 C ATOM 203 O SER A 135 -2.296 5.188 6.539 1.00 0.00 O ATOM 204 CB SER A 135 -2.249 6.666 9.726 1.00 0.00 C ATOM 205 OG SER A 135 -3.576 6.893 10.164 1.00 0.00 O ATOM 0 H SER A 135 -0.152 5.640 8.711 1.00 0.00 H new ATOM 0 HA SER A 135 -2.766 4.610 9.537 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.571 6.635 10.579 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.919 7.484 9.085 1.00 0.00 H new ATOM 0 HG SER A 135 -3.618 7.739 10.657 1.00 0.00 H new ATOM 211 N ARG A 136 -4.202 5.627 7.667 1.00 0.00 N ATOM 212 CA ARG A 136 -5.065 5.761 6.518 1.00 0.00 C ATOM 213 C ARG A 136 -4.854 7.165 5.945 1.00 0.00 C ATOM 214 O ARG A 136 -5.017 8.139 6.686 1.00 0.00 O ATOM 215 CB ARG A 136 -6.531 5.526 6.914 1.00 0.00 C ATOM 216 CG ARG A 136 -6.875 4.034 7.039 1.00 0.00 C ATOM 217 CD ARG A 136 -7.330 3.598 8.438 1.00 0.00 C ATOM 218 NE ARG A 136 -6.329 3.749 9.508 1.00 0.00 N ATOM 219 CZ ARG A 136 -5.140 3.149 9.648 1.00 0.00 C ATOM 220 NH1 ARG A 136 -4.536 2.483 8.670 1.00 0.00 N ATOM 221 NH2 ARG A 136 -4.540 3.250 10.824 1.00 0.00 N ATOM 0 H ARG A 136 -4.696 5.735 8.553 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.822 5.014 5.762 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.732 6.022 7.863 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.183 5.985 6.170 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.663 3.795 6.324 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.000 3.448 6.757 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.215 4.174 8.709 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.632 2.552 8.393 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.577 4.405 10.249 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.979 2.409 7.754 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.629 2.046 8.835 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -4.985 3.770 11.580 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -3.633 2.808 10.973 1.00 0.00 H new ATOM 235 N PRO A 137 -4.522 7.294 4.654 1.00 0.00 N ATOM 236 CA PRO A 137 -4.510 8.577 3.960 1.00 0.00 C ATOM 237 C PRO A 137 -5.926 9.157 3.880 1.00 0.00 C ATOM 238 O PRO A 137 -6.898 8.399 3.933 1.00 0.00 O ATOM 239 CB PRO A 137 -3.903 8.287 2.572 1.00 0.00 C ATOM 240 CG PRO A 137 -4.152 6.793 2.368 1.00 0.00 C ATOM 241 CD PRO A 137 -4.182 6.199 3.771 1.00 0.00 C ATOM 0 HA PRO A 137 -3.920 9.331 4.481 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.382 8.882 1.794 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.839 8.522 2.544 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -5.093 6.618 1.846 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -3.364 6.341 1.765 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.917 5.397 3.841 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -3.216 5.769 4.035 1.00 0.00 H new ATOM 249 N MET A 138 -6.064 10.475 3.727 1.00 0.00 N ATOM 250 CA MET A 138 -7.283 11.115 3.255 1.00 0.00 C ATOM 251 C MET A 138 -7.149 11.252 1.749 1.00 0.00 C ATOM 252 O MET A 138 -6.340 12.046 1.266 1.00 0.00 O ATOM 253 CB MET A 138 -7.469 12.480 3.928 1.00 0.00 C ATOM 254 CG MET A 138 -8.543 12.510 5.012 1.00 0.00 C ATOM 255 SD MET A 138 -8.707 11.089 6.127 1.00 0.00 S ATOM 256 CE MET A 138 -10.103 10.197 5.375 1.00 0.00 C ATOM 0 H MET A 138 -5.315 11.136 3.933 1.00 0.00 H new ATOM 0 HA MET A 138 -8.163 10.523 3.505 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.520 12.787 4.366 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.721 13.216 3.165 1.00 0.00 H new ATOM 0 HG2 MET A 138 -8.365 13.392 5.627 1.00 0.00 H new ATOM 0 HG3 MET A 138 -9.504 12.654 4.519 1.00 0.00 H new ATOM 0 HE1 MET A 138 -11.002 10.363 5.968 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.264 10.563 4.361 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.880 9.131 5.345 1.00 0.00 H new ATOM 266 N ILE A 139 -7.897 10.436 1.019 1.00 0.00 N ATOM 267 CA ILE A 139 -7.965 10.502 -0.432 1.00 0.00 C ATOM 268 C ILE A 139 -8.972 11.613 -0.770 1.00 0.00 C ATOM 269 O ILE A 139 -9.809 11.992 0.062 1.00 0.00 O ATOM 270 CB ILE A 139 -8.382 9.147 -1.025 1.00 0.00 C ATOM 271 CG1 ILE A 139 -7.675 7.957 -0.355 1.00 0.00 C ATOM 272 CG2 ILE A 139 -8.149 9.073 -2.550 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.223 7.701 -0.745 1.00 0.00 C ATOM 0 H ILE A 139 -8.479 9.702 1.423 1.00 0.00 H new ATOM 0 HA ILE A 139 -6.991 10.728 -0.866 1.00 0.00 H new ATOM 0 HB ILE A 139 -9.451 9.074 -0.824 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -7.714 8.105 0.724 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -8.248 7.056 -0.575 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -8.460 8.095 -2.919 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.732 9.850 -3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -7.091 9.222 -2.764 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.847 6.835 -0.200 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.162 7.510 -1.816 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.620 8.575 -0.497 1.00 0.00 H new ATOM 285 N HIS A 140 -8.946 12.095 -2.006 1.00 0.00 N ATOM 286 CA HIS A 140 -9.871 13.081 -2.524 1.00 0.00 C ATOM 287 C HIS A 140 -10.285 12.727 -3.951 1.00 0.00 C ATOM 288 O HIS A 140 -10.137 13.489 -4.902 1.00 0.00 O ATOM 289 CB HIS A 140 -9.279 14.489 -2.372 1.00 0.00 C ATOM 290 CG HIS A 140 -8.055 14.788 -3.206 1.00 0.00 C ATOM 291 ND1 HIS A 140 -7.991 15.614 -4.310 1.00 0.00 N ATOM 292 CD2 HIS A 140 -6.835 14.196 -3.065 1.00 0.00 C ATOM 293 CE1 HIS A 140 -6.765 15.500 -4.844 1.00 0.00 C ATOM 294 NE2 HIS A 140 -6.013 14.656 -4.110 1.00 0.00 N ATOM 0 H HIS A 140 -8.255 11.797 -2.694 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.792 13.075 -1.941 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -10.052 15.215 -2.624 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -9.026 14.644 -1.323 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -6.551 13.499 -2.290 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.429 16.011 -5.734 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -5.040 14.401 -4.279 1.00 0.00 H new ATOM 302 N PHE A 141 -10.873 11.545 -4.069 1.00 0.00 N ATOM 303 CA PHE A 141 -11.517 11.009 -5.263 1.00 0.00 C ATOM 304 C PHE A 141 -12.372 12.032 -6.021 1.00 0.00 C ATOM 305 O PHE A 141 -12.355 12.084 -7.251 1.00 0.00 O ATOM 306 CB PHE A 141 -12.425 9.863 -4.824 1.00 0.00 C ATOM 307 CG PHE A 141 -11.708 8.706 -4.175 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.161 7.706 -4.994 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.611 8.609 -2.772 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.485 6.624 -4.416 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.963 7.494 -2.201 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.350 6.531 -3.024 1.00 0.00 C ATOM 0 H PHE A 141 -10.917 10.893 -3.286 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.726 10.693 -5.944 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.166 10.252 -4.126 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.969 9.494 -5.694 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.261 7.771 -6.067 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -12.028 9.380 -2.141 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.065 5.856 -5.048 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.937 7.379 -1.127 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.779 5.726 -2.586 1.00 0.00 H new ATOM 322 N GLY A 142 -13.191 12.787 -5.294 1.00 0.00 N ATOM 323 CA GLY A 142 -14.097 13.816 -5.778 1.00 0.00 C ATOM 324 C GLY A 142 -15.523 13.400 -5.465 1.00 0.00 C ATOM 325 O GLY A 142 -16.366 14.240 -5.128 1.00 0.00 O ATOM 0 H GLY A 142 -13.240 12.686 -4.280 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.870 14.771 -5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.971 13.955 -6.852 1.00 0.00 H new ATOM 329 N ASN A 143 -15.799 12.093 -5.516 1.00 0.00 N ATOM 330 CA ASN A 143 -17.125 11.597 -5.238 1.00 0.00 C ATOM 331 C ASN A 143 -17.289 11.463 -3.743 1.00 0.00 C ATOM 332 O ASN A 143 -16.415 10.916 -3.067 1.00 0.00 O ATOM 333 CB ASN A 143 -17.346 10.226 -5.856 1.00 0.00 C ATOM 334 CG ASN A 143 -17.102 10.256 -7.346 1.00 0.00 C ATOM 335 OD1 ASN A 143 -17.933 10.717 -8.117 1.00 0.00 O ATOM 336 ND2 ASN A 143 -15.930 9.819 -7.755 1.00 0.00 N ATOM 0 H ASN A 143 -15.116 11.372 -5.748 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.845 12.297 -5.661 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.679 9.501 -5.390 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.365 9.894 -5.658 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.688 9.858 -8.745 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.263 9.441 -7.082 1.00 0.00 H new ATOM 343 N ASP A 144 -18.453 11.866 -3.263 1.00 0.00 N ATOM 344 CA ASP A 144 -18.897 11.605 -1.905 1.00 0.00 C ATOM 345 C ASP A 144 -19.178 10.116 -1.683 1.00 0.00 C ATOM 346 O ASP A 144 -19.006 9.629 -0.570 1.00 0.00 O ATOM 347 CB ASP A 144 -20.163 12.421 -1.669 1.00 0.00 C ATOM 348 CG ASP A 144 -20.648 12.365 -0.229 1.00 0.00 C ATOM 349 OD1 ASP A 144 -19.846 12.635 0.688 1.00 0.00 O ATOM 350 OD2 ASP A 144 -21.877 12.227 -0.032 1.00 0.00 O ATOM 0 H ASP A 144 -19.128 12.393 -3.817 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.114 11.890 -1.202 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -19.975 13.459 -1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.952 12.055 -2.326 1.00 0.00 H new ATOM 355 N TRP A 145 -19.576 9.369 -2.727 1.00 0.00 N ATOM 356 CA TRP A 145 -19.777 7.926 -2.596 1.00 0.00 C ATOM 357 C TRP A 145 -18.443 7.217 -2.406 1.00 0.00 C ATOM 358 O TRP A 145 -18.372 6.307 -1.587 1.00 0.00 O ATOM 359 CB TRP A 145 -20.598 7.334 -3.750 1.00 0.00 C ATOM 360 CG TRP A 145 -20.052 7.487 -5.134 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.403 8.459 -5.997 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.117 6.632 -5.859 1.00 0.00 C ATOM 363 NE1 TRP A 145 -19.706 8.306 -7.176 1.00 0.00 N ATOM 364 CE2 TRP A 145 -18.855 7.225 -7.128 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.442 5.428 -5.571 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -17.919 6.694 -8.031 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.564 4.842 -6.507 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.281 5.483 -7.724 1.00 0.00 C ATOM 0 H TRP A 145 -19.762 9.740 -3.659 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.375 7.757 -1.701 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.732 6.270 -3.557 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.588 7.789 -3.727 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.122 9.240 -5.796 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -19.808 8.919 -7.985 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.600 4.946 -4.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.693 7.212 -8.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.105 3.890 -6.285 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.578 5.047 -8.418 1.00 0.00 H new ATOM 379 N GLU A 146 -17.388 7.641 -3.111 1.00 0.00 N ATOM 380 CA GLU A 146 -16.060 7.088 -2.868 1.00 0.00 C ATOM 381 C GLU A 146 -15.569 7.461 -1.480 1.00 0.00 C ATOM 382 O GLU A 146 -15.089 6.592 -0.769 1.00 0.00 O ATOM 383 CB GLU A 146 -15.045 7.572 -3.909 1.00 0.00 C ATOM 384 CG GLU A 146 -15.354 6.918 -5.250 1.00 0.00 C ATOM 385 CD GLU A 146 -14.192 6.958 -6.224 1.00 0.00 C ATOM 386 OE1 GLU A 146 -13.385 6.008 -6.271 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.142 7.924 -7.022 1.00 0.00 O ATOM 0 H GLU A 146 -17.430 8.352 -3.841 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.147 6.004 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.090 8.657 -4.001 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.033 7.320 -3.592 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.641 5.880 -5.082 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.212 7.417 -5.700 1.00 0.00 H new ATOM 394 N ASP A 147 -15.692 8.725 -1.077 1.00 0.00 N ATOM 395 CA ASP A 147 -15.161 9.187 0.207 1.00 0.00 C ATOM 396 C ASP A 147 -15.827 8.437 1.371 1.00 0.00 C ATOM 397 O ASP A 147 -15.152 7.957 2.285 1.00 0.00 O ATOM 398 CB ASP A 147 -15.348 10.702 0.328 1.00 0.00 C ATOM 399 CG ASP A 147 -14.091 11.422 0.819 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.444 10.998 1.804 1.00 0.00 O ATOM 401 OD2 ASP A 147 -13.723 12.430 0.169 1.00 0.00 O ATOM 0 H ASP A 147 -16.156 9.451 -1.623 1.00 0.00 H new ATOM 0 HA ASP A 147 -14.094 8.971 0.254 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.635 11.106 -0.643 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.169 10.907 1.015 1.00 0.00 H new ATOM 406 N ARG A 148 -17.151 8.244 1.289 1.00 0.00 N ATOM 407 CA ARG A 148 -17.915 7.402 2.191 1.00 0.00 C ATOM 408 C ARG A 148 -17.400 5.976 2.129 1.00 0.00 C ATOM 409 O ARG A 148 -17.068 5.432 3.172 1.00 0.00 O ATOM 410 CB ARG A 148 -19.408 7.450 1.815 1.00 0.00 C ATOM 411 CG ARG A 148 -20.250 6.548 2.724 1.00 0.00 C ATOM 412 CD ARG A 148 -21.699 6.451 2.247 1.00 0.00 C ATOM 413 NE ARG A 148 -22.374 7.753 2.266 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.639 7.992 1.917 1.00 0.00 C ATOM 415 NH1 ARG A 148 -24.473 6.993 1.633 1.00 0.00 N ATOM 416 NH2 ARG A 148 -24.037 9.258 1.877 1.00 0.00 N ATOM 0 H ARG A 148 -17.726 8.685 0.571 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.799 7.771 3.210 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.768 8.476 1.886 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.532 7.139 0.778 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.810 5.551 2.754 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -20.228 6.937 3.742 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.721 6.046 1.235 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -22.243 5.752 2.882 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.823 8.553 2.576 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -24.147 6.028 1.681 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.437 7.193 1.368 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -23.383 10.006 2.108 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.997 9.483 1.615 1.00 0.00 H new ATOM 430 N TYR A 149 -17.413 5.341 0.956 1.00 0.00 N ATOM 431 CA TYR A 149 -17.084 3.928 0.804 1.00 0.00 C ATOM 432 C TYR A 149 -15.684 3.649 1.351 1.00 0.00 C ATOM 433 O TYR A 149 -15.463 2.637 2.024 1.00 0.00 O ATOM 434 CB TYR A 149 -17.202 3.532 -0.675 1.00 0.00 C ATOM 435 CG TYR A 149 -16.955 2.059 -0.952 1.00 0.00 C ATOM 436 CD1 TYR A 149 -15.671 1.501 -0.801 1.00 0.00 C ATOM 437 CD2 TYR A 149 -18.018 1.242 -1.374 1.00 0.00 C ATOM 438 CE1 TYR A 149 -15.478 0.115 -0.916 1.00 0.00 C ATOM 439 CE2 TYR A 149 -17.817 -0.135 -1.562 1.00 0.00 C ATOM 440 CZ TYR A 149 -16.562 -0.715 -1.275 1.00 0.00 C ATOM 441 OH TYR A 149 -16.408 -2.062 -1.344 1.00 0.00 O ATOM 0 H TYR A 149 -17.655 5.800 0.078 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.786 3.323 1.378 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.199 3.794 -1.030 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.492 4.122 -1.254 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -14.828 2.144 -0.595 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -18.991 1.674 -1.554 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -14.504 -0.314 -0.731 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.625 -0.752 -1.927 1.00 0.00 H new ATOM 0 HH TYR A 149 -15.911 -2.375 -0.559 1.00 0.00 H new ATOM 451 N TYR A 150 -14.745 4.545 1.051 1.00 0.00 N ATOM 452 CA TYR A 150 -13.391 4.541 1.557 1.00 0.00 C ATOM 453 C TYR A 150 -13.443 4.471 3.078 1.00 0.00 C ATOM 454 O TYR A 150 -12.939 3.509 3.654 1.00 0.00 O ATOM 455 CB TYR A 150 -12.636 5.780 1.054 1.00 0.00 C ATOM 456 CG TYR A 150 -11.229 5.866 1.597 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.284 4.882 1.255 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.887 6.889 2.499 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.016 4.884 1.857 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.617 6.906 3.092 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.683 5.893 2.786 1.00 0.00 C ATOM 462 OH TYR A 150 -7.468 5.895 3.388 1.00 0.00 O ATOM 0 H TYR A 150 -14.925 5.325 0.419 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.845 3.671 1.192 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.600 5.761 -0.035 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -13.187 6.676 1.339 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.534 4.124 0.528 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.603 7.662 2.735 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.298 4.116 1.610 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.353 7.694 3.782 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.221 6.814 3.624 1.00 0.00 H new ATOM 472 N ARG A 151 -14.090 5.448 3.720 1.00 0.00 N ATOM 473 CA ARG A 151 -14.213 5.538 5.173 1.00 0.00 C ATOM 474 C ARG A 151 -14.917 4.305 5.763 1.00 0.00 C ATOM 475 O ARG A 151 -14.400 3.730 6.716 1.00 0.00 O ATOM 476 CB ARG A 151 -14.899 6.864 5.526 1.00 0.00 C ATOM 477 CG ARG A 151 -13.928 8.046 5.328 1.00 0.00 C ATOM 478 CD ARG A 151 -14.654 9.396 5.264 1.00 0.00 C ATOM 479 NE ARG A 151 -15.142 9.838 6.581 1.00 0.00 N ATOM 480 CZ ARG A 151 -15.645 11.044 6.867 1.00 0.00 C ATOM 481 NH1 ARG A 151 -15.814 11.964 5.925 1.00 0.00 N ATOM 482 NH2 ARG A 151 -15.985 11.341 8.114 1.00 0.00 N ATOM 0 H ARG A 151 -14.552 6.214 3.231 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.224 5.537 5.632 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.781 7.002 4.900 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -15.243 6.838 6.560 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.208 8.062 6.146 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.362 7.897 4.409 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.978 10.149 4.859 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -15.495 9.320 4.575 1.00 0.00 H new ATOM 0 HE ARG A 151 -15.092 9.163 7.344 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.558 11.758 4.959 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.199 12.877 6.167 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -15.863 10.650 8.854 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -16.369 12.260 8.333 1.00 0.00 H new ATOM 496 N GLU A 152 -16.019 3.846 5.168 1.00 0.00 N ATOM 497 CA GLU A 152 -16.809 2.663 5.541 1.00 0.00 C ATOM 498 C GLU A 152 -15.972 1.380 5.600 1.00 0.00 C ATOM 499 O GLU A 152 -16.405 0.394 6.195 1.00 0.00 O ATOM 500 CB GLU A 152 -17.939 2.449 4.511 1.00 0.00 C ATOM 501 CG GLU A 152 -19.236 3.206 4.807 1.00 0.00 C ATOM 502 CD GLU A 152 -20.160 2.418 5.741 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.972 1.599 5.239 1.00 0.00 O ATOM 504 OE2 GLU A 152 -20.083 2.642 6.971 1.00 0.00 O ATOM 0 H GLU A 152 -16.414 4.321 4.356 1.00 0.00 H new ATOM 0 HA GLU A 152 -17.206 2.856 6.538 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.576 2.750 3.528 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.162 1.384 4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.999 4.169 5.259 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.757 3.413 3.872 1.00 0.00 H new ATOM 511 N ASN A 153 -14.793 1.359 4.974 1.00 0.00 N ATOM 512 CA ASN A 153 -13.932 0.188 4.903 1.00 0.00 C ATOM 513 C ASN A 153 -12.507 0.534 5.325 1.00 0.00 C ATOM 514 O ASN A 153 -11.628 -0.316 5.212 1.00 0.00 O ATOM 515 CB ASN A 153 -13.973 -0.401 3.484 1.00 0.00 C ATOM 516 CG ASN A 153 -15.332 -1.002 3.154 1.00 0.00 C ATOM 517 OD1 ASN A 153 -15.614 -2.153 3.485 1.00 0.00 O ATOM 518 ND2 ASN A 153 -16.209 -0.227 2.535 1.00 0.00 N ATOM 0 H ASN A 153 -14.408 2.173 4.495 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.299 -0.566 5.599 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.737 0.380 2.761 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -13.205 -1.168 3.388 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -17.142 -0.581 2.323 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.952 0.724 2.271 1.00 0.00 H new ATOM 525 N MET A 154 -12.247 1.750 5.824 1.00 0.00 N ATOM 526 CA MET A 154 -10.888 2.261 5.979 1.00 0.00 C ATOM 527 C MET A 154 -10.053 1.401 6.926 1.00 0.00 C ATOM 528 O MET A 154 -8.848 1.261 6.739 1.00 0.00 O ATOM 529 CB MET A 154 -10.896 3.748 6.363 1.00 0.00 C ATOM 530 CG MET A 154 -11.348 4.048 7.798 1.00 0.00 C ATOM 531 SD MET A 154 -11.804 5.777 8.138 1.00 0.00 S ATOM 532 CE MET A 154 -10.527 6.708 7.252 1.00 0.00 C ATOM 0 H MET A 154 -12.972 2.400 6.129 1.00 0.00 H new ATOM 0 HA MET A 154 -10.394 2.191 5.010 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.892 4.148 6.224 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.550 4.282 5.674 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.204 3.414 8.030 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.546 3.763 8.479 1.00 0.00 H new ATOM 0 HE1 MET A 154 -10.600 7.764 7.512 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.543 6.333 7.532 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.669 6.588 6.178 1.00 0.00 H new ATOM 542 N TYR A 155 -10.706 0.791 7.912 1.00 0.00 N ATOM 543 CA TYR A 155 -10.126 -0.130 8.878 1.00 0.00 C ATOM 544 C TYR A 155 -9.672 -1.466 8.260 1.00 0.00 C ATOM 545 O TYR A 155 -8.798 -2.119 8.826 1.00 0.00 O ATOM 546 CB TYR A 155 -11.148 -0.353 10.013 1.00 0.00 C ATOM 547 CG TYR A 155 -12.604 -0.029 9.717 1.00 0.00 C ATOM 548 CD1 TYR A 155 -13.422 -0.978 9.083 1.00 0.00 C ATOM 549 CD2 TYR A 155 -13.139 1.224 10.073 1.00 0.00 C ATOM 550 CE1 TYR A 155 -14.769 -0.688 8.817 1.00 0.00 C ATOM 551 CE2 TYR A 155 -14.493 1.513 9.831 1.00 0.00 C ATOM 552 CZ TYR A 155 -15.318 0.554 9.205 1.00 0.00 C ATOM 553 OH TYR A 155 -16.635 0.826 8.987 1.00 0.00 O ATOM 0 H TYR A 155 -11.704 0.935 8.064 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.214 0.321 9.270 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -11.091 -1.398 10.317 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.837 0.246 10.869 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -13.012 -1.936 8.799 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -12.505 1.967 10.535 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -15.388 -1.417 8.314 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -14.902 2.469 10.124 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.832 0.742 8.031 1.00 0.00 H new ATOM 563 N ARG A 156 -10.246 -1.891 7.128 1.00 0.00 N ATOM 564 CA ARG A 156 -9.955 -3.187 6.498 1.00 0.00 C ATOM 565 C ARG A 156 -8.700 -3.126 5.627 1.00 0.00 C ATOM 566 O ARG A 156 -8.062 -4.146 5.374 1.00 0.00 O ATOM 567 CB ARG A 156 -11.184 -3.648 5.684 1.00 0.00 C ATOM 568 CG ARG A 156 -12.315 -4.109 6.616 1.00 0.00 C ATOM 569 CD ARG A 156 -13.746 -3.994 6.063 1.00 0.00 C ATOM 570 NE ARG A 156 -14.180 -5.157 5.272 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.563 -6.362 5.726 1.00 0.00 C ATOM 572 NH1 ARG A 156 -14.474 -6.699 7.011 1.00 0.00 N ATOM 573 NH2 ARG A 156 -15.071 -7.251 4.884 1.00 0.00 N ATOM 0 H ARG A 156 -10.934 -1.339 6.617 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.752 -3.917 7.281 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.536 -2.831 5.054 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.900 -4.463 5.019 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.135 -5.150 6.883 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.257 -3.529 7.537 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.436 -3.857 6.896 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.813 -3.100 5.442 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.191 -5.033 4.260 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.105 -6.032 7.689 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -14.775 -7.624 7.318 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.170 -7.019 3.896 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.363 -8.167 5.224 1.00 0.00 H new ATOM 587 N TYR A 157 -8.339 -1.943 5.138 1.00 0.00 N ATOM 588 CA TYR A 157 -7.165 -1.772 4.301 1.00 0.00 C ATOM 589 C TYR A 157 -5.874 -2.078 5.080 1.00 0.00 C ATOM 590 O TYR A 157 -5.841 -1.925 6.306 1.00 0.00 O ATOM 591 CB TYR A 157 -7.153 -0.341 3.750 1.00 0.00 C ATOM 592 CG TYR A 157 -8.372 0.038 2.921 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.961 -0.870 2.012 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.954 1.303 3.110 1.00 0.00 C ATOM 595 CE1 TYR A 157 -10.159 -0.541 1.352 1.00 0.00 C ATOM 596 CE2 TYR A 157 -10.155 1.635 2.462 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.774 0.707 1.596 1.00 0.00 C ATOM 598 OH TYR A 157 -11.962 1.017 1.012 1.00 0.00 O ATOM 0 H TYR A 157 -8.854 -1.080 5.313 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.209 -2.478 3.472 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.070 0.354 4.586 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.261 -0.211 3.138 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.488 -1.822 1.823 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.475 2.023 3.757 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.607 -1.240 0.661 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.606 2.602 2.626 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.480 0.197 0.868 1.00 0.00 H new ATOM 608 N PRO A 158 -4.793 -2.463 4.373 1.00 0.00 N ATOM 609 CA PRO A 158 -3.503 -2.734 4.991 1.00 0.00 C ATOM 610 C PRO A 158 -2.938 -1.494 5.680 1.00 0.00 C ATOM 611 O PRO A 158 -3.249 -0.358 5.315 1.00 0.00 O ATOM 612 CB PRO A 158 -2.571 -3.196 3.860 1.00 0.00 C ATOM 613 CG PRO A 158 -3.277 -2.799 2.566 1.00 0.00 C ATOM 614 CD PRO A 158 -4.751 -2.733 2.944 1.00 0.00 C ATOM 0 HA PRO A 158 -3.602 -3.495 5.765 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.594 -2.719 3.937 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.405 -4.272 3.903 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.918 -1.839 2.196 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.101 -3.530 1.777 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.261 -1.949 2.385 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.255 -3.671 2.710 1.00 0.00 H new ATOM 622 N ASN A 159 -2.011 -1.721 6.614 1.00 0.00 N ATOM 623 CA ASN A 159 -1.241 -0.658 7.247 1.00 0.00 C ATOM 624 C ASN A 159 0.199 -0.676 6.785 1.00 0.00 C ATOM 625 O ASN A 159 0.845 0.358 6.837 1.00 0.00 O ATOM 626 CB ASN A 159 -1.169 -0.837 8.766 1.00 0.00 C ATOM 627 CG ASN A 159 -2.512 -0.737 9.440 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.267 -1.700 9.447 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.804 0.410 10.021 1.00 0.00 N ATOM 0 H ASN A 159 -1.775 -2.654 6.951 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.749 0.267 6.975 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.729 -1.809 8.990 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.503 -0.081 9.183 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.694 0.524 10.505 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.139 1.183 9.986 1.00 0.00 H new ATOM 636 N GLN A 160 0.747 -1.834 6.426 1.00 0.00 N ATOM 637 CA GLN A 160 2.145 -1.952 6.045 1.00 0.00 C ATOM 638 C GLN A 160 2.196 -2.260 4.559 1.00 0.00 C ATOM 639 O GLN A 160 1.245 -2.839 4.013 1.00 0.00 O ATOM 640 CB GLN A 160 2.809 -3.101 6.816 1.00 0.00 C ATOM 641 CG GLN A 160 2.842 -2.960 8.336 1.00 0.00 C ATOM 642 CD GLN A 160 3.322 -4.225 9.039 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.515 -5.064 9.443 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.625 -4.357 9.221 1.00 0.00 N ATOM 0 H GLN A 160 0.232 -2.714 6.392 1.00 0.00 H new ATOM 0 HA GLN A 160 2.672 -1.026 6.273 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.288 -4.026 6.569 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.833 -3.207 6.459 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.496 -2.131 8.605 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.844 -2.708 8.694 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.264 -3.642 8.873 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.992 -5.174 9.710 1.00 0.00 H new ATOM 653 N VAL A 161 3.324 -1.931 3.938 1.00 0.00 N ATOM 654 CA VAL A 161 3.555 -2.170 2.519 1.00 0.00 C ATOM 655 C VAL A 161 4.883 -2.896 2.393 1.00 0.00 C ATOM 656 O VAL A 161 5.803 -2.625 3.170 1.00 0.00 O ATOM 657 CB VAL A 161 3.532 -0.835 1.742 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.188 -0.108 1.899 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.642 0.134 2.181 1.00 0.00 C ATOM 0 H VAL A 161 4.111 -1.487 4.411 1.00 0.00 H new ATOM 0 HA VAL A 161 2.769 -2.787 2.084 1.00 0.00 H new ATOM 0 HB VAL A 161 3.693 -1.115 0.701 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.212 0.826 1.338 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.386 -0.740 1.518 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.011 0.106 2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.574 1.053 1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.525 0.365 3.240 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.615 -0.328 2.016 1.00 0.00 H new ATOM 669 N TYR A 162 4.975 -3.847 1.468 1.00 0.00 N ATOM 670 CA TYR A 162 6.262 -4.422 1.112 1.00 0.00 C ATOM 671 C TYR A 162 7.007 -3.424 0.232 1.00 0.00 C ATOM 672 O TYR A 162 6.364 -2.597 -0.417 1.00 0.00 O ATOM 673 CB TYR A 162 6.060 -5.755 0.391 1.00 0.00 C ATOM 674 CG TYR A 162 5.560 -6.848 1.310 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.483 -7.608 2.050 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.179 -7.071 1.476 1.00 0.00 C ATOM 677 CE1 TYR A 162 6.027 -8.515 3.017 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.717 -8.053 2.360 1.00 0.00 C ATOM 679 CZ TYR A 162 4.642 -8.739 3.183 1.00 0.00 C ATOM 680 OH TYR A 162 4.231 -9.605 4.146 1.00 0.00 O ATOM 0 H TYR A 162 4.180 -4.231 0.957 1.00 0.00 H new ATOM 0 HA TYR A 162 6.851 -4.620 2.007 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.349 -5.618 -0.424 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.003 -6.067 -0.058 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.542 -7.493 1.874 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.470 -6.479 0.916 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.736 -9.044 3.637 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.664 -8.285 2.414 1.00 0.00 H new ATOM 0 HH TYR A 162 3.252 -9.657 4.143 1.00 0.00 H new ATOM 690 N TYR A 163 8.328 -3.533 0.112 1.00 0.00 N ATOM 691 CA TYR A 163 9.106 -2.752 -0.841 1.00 0.00 C ATOM 692 C TYR A 163 10.348 -3.534 -1.256 1.00 0.00 C ATOM 693 O TYR A 163 10.706 -4.514 -0.605 1.00 0.00 O ATOM 694 CB TYR A 163 9.471 -1.393 -0.229 1.00 0.00 C ATOM 695 CG TYR A 163 10.286 -1.446 1.049 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.650 -1.529 2.302 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.687 -1.362 0.982 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.419 -1.545 3.482 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.457 -1.382 2.151 1.00 0.00 C ATOM 700 CZ TYR A 163 11.827 -1.466 3.405 1.00 0.00 C ATOM 701 OH TYR A 163 12.588 -1.387 4.527 1.00 0.00 O ATOM 0 H TYR A 163 8.890 -4.170 0.677 1.00 0.00 H new ATOM 0 HA TYR A 163 8.512 -2.565 -1.736 1.00 0.00 H new ATOM 0 HB2 TYR A 163 10.028 -0.819 -0.970 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.550 -0.846 -0.029 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.573 -1.580 2.359 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.174 -1.281 0.021 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.933 -1.618 4.444 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.534 -1.333 2.090 1.00 0.00 H new ATOM 0 HH TYR A 163 12.870 -0.459 4.666 1.00 0.00 H new ATOM 711 N ARG A 164 11.042 -3.105 -2.312 1.00 0.00 N ATOM 712 CA ARG A 164 12.420 -3.544 -2.568 1.00 0.00 C ATOM 713 C ARG A 164 13.409 -2.454 -2.178 1.00 0.00 C ATOM 714 O ARG A 164 13.040 -1.279 -2.219 1.00 0.00 O ATOM 715 CB ARG A 164 12.632 -3.879 -4.041 1.00 0.00 C ATOM 716 CG ARG A 164 11.976 -5.215 -4.386 1.00 0.00 C ATOM 717 CD ARG A 164 12.207 -5.570 -5.850 1.00 0.00 C ATOM 718 NE ARG A 164 11.328 -4.790 -6.727 1.00 0.00 N ATOM 719 CZ ARG A 164 10.827 -5.182 -7.899 1.00 0.00 C ATOM 720 NH1 ARG A 164 11.307 -6.245 -8.536 1.00 0.00 N ATOM 721 NH2 ARG A 164 9.837 -4.478 -8.421 1.00 0.00 N ATOM 0 H ARG A 164 10.674 -2.454 -3.005 1.00 0.00 H new ATOM 0 HA ARG A 164 12.588 -4.437 -1.967 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.212 -3.089 -4.664 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.699 -3.924 -4.260 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.382 -6.000 -3.748 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.906 -5.163 -4.184 1.00 0.00 H new ATOM 0 HD2 ARG A 164 13.248 -5.382 -6.113 1.00 0.00 H new ATOM 0 HD3 ARG A 164 12.027 -6.634 -6.002 1.00 0.00 H new ATOM 0 HE ARG A 164 11.075 -3.855 -6.409 1.00 0.00 H new ATOM 0 HH11 ARG A 164 12.075 -6.780 -8.129 1.00 0.00 H new ATOM 0 HH12 ARG A 164 10.908 -6.526 -9.432 1.00 0.00 H new ATOM 0 HH21 ARG A 164 9.478 -3.660 -7.928 1.00 0.00 H new ATOM 0 HH22 ARG A 164 9.433 -4.753 -9.316 1.00 0.00 H new ATOM 735 N PRO A 165 14.661 -2.813 -1.851 1.00 0.00 N ATOM 736 CA PRO A 165 15.705 -1.844 -1.561 1.00 0.00 C ATOM 737 C PRO A 165 15.912 -0.828 -2.688 1.00 0.00 C ATOM 738 O PRO A 165 15.742 -1.173 -3.861 1.00 0.00 O ATOM 739 CB PRO A 165 16.968 -2.673 -1.327 1.00 0.00 C ATOM 740 CG PRO A 165 16.442 -4.033 -0.873 1.00 0.00 C ATOM 741 CD PRO A 165 15.157 -4.172 -1.678 1.00 0.00 C ATOM 0 HA PRO A 165 15.436 -1.240 -0.695 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.563 -2.759 -2.236 1.00 0.00 H new ATOM 0 HB3 PRO A 165 17.608 -2.220 -0.570 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.147 -4.835 -1.092 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.254 -4.058 0.200 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.346 -4.647 -2.641 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.430 -4.792 -1.154 1.00 0.00 H new ATOM 749 N VAL A 166 16.345 0.395 -2.373 1.00 0.00 N ATOM 750 CA VAL A 166 16.576 1.441 -3.360 1.00 0.00 C ATOM 751 C VAL A 166 18.050 1.512 -3.741 1.00 0.00 C ATOM 752 O VAL A 166 18.862 2.158 -3.081 1.00 0.00 O ATOM 753 CB VAL A 166 16.001 2.799 -2.909 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.597 2.926 -3.496 1.00 0.00 C ATOM 755 CG2 VAL A 166 15.938 3.045 -1.397 1.00 0.00 C ATOM 0 H VAL A 166 16.546 0.685 -1.416 1.00 0.00 H new ATOM 0 HA VAL A 166 16.028 1.178 -4.265 1.00 0.00 H new ATOM 0 HB VAL A 166 16.697 3.554 -3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.161 3.879 -3.195 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.652 2.880 -4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.974 2.110 -3.129 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.516 4.032 -1.206 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.310 2.286 -0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.943 2.993 -0.978 1.00 0.00 H new ATOM 765 N ASP A 167 18.375 0.848 -4.851 1.00 0.00 N ATOM 766 CA ASP A 167 19.646 1.027 -5.539 1.00 0.00 C ATOM 767 C ASP A 167 19.443 0.793 -7.026 1.00 0.00 C ATOM 768 O ASP A 167 19.650 1.692 -7.835 1.00 0.00 O ATOM 769 CB ASP A 167 20.707 0.040 -5.037 1.00 0.00 C ATOM 770 CG ASP A 167 21.531 0.564 -3.882 1.00 0.00 C ATOM 771 OD1 ASP A 167 22.134 1.650 -4.013 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.618 -0.146 -2.852 1.00 0.00 O ATOM 0 H ASP A 167 17.758 0.169 -5.297 1.00 0.00 H new ATOM 0 HA ASP A 167 19.993 2.041 -5.342 1.00 0.00 H new ATOM 0 HB2 ASP A 167 20.215 -0.883 -4.731 1.00 0.00 H new ATOM 0 HB3 ASP A 167 21.374 -0.213 -5.862 1.00 0.00 H new ATOM 777 N GLN A 168 19.036 -0.424 -7.389 1.00 0.00 N ATOM 778 CA GLN A 168 19.069 -0.903 -8.761 1.00 0.00 C ATOM 779 C GLN A 168 17.901 -0.295 -9.528 1.00 0.00 C ATOM 780 O GLN A 168 18.081 0.144 -10.664 1.00 0.00 O ATOM 781 CB GLN A 168 19.000 -2.444 -8.812 1.00 0.00 C ATOM 782 CG GLN A 168 20.280 -3.174 -8.360 1.00 0.00 C ATOM 783 CD GLN A 168 20.625 -3.012 -6.878 1.00 0.00 C ATOM 784 OE1 GLN A 168 21.723 -2.615 -6.523 1.00 0.00 O ATOM 785 NE2 GLN A 168 19.723 -3.326 -5.960 1.00 0.00 N ATOM 0 H GLN A 168 18.671 -1.109 -6.727 1.00 0.00 H new ATOM 0 HA GLN A 168 20.009 -0.599 -9.221 1.00 0.00 H new ATOM 0 HB2 GLN A 168 18.172 -2.775 -8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.769 -2.748 -9.833 1.00 0.00 H new ATOM 0 HG2 GLN A 168 20.171 -4.236 -8.579 1.00 0.00 H new ATOM 0 HG3 GLN A 168 21.118 -2.810 -8.955 1.00 0.00 H new ATOM 0 HE21 GLN A 168 18.801 -3.659 -6.243 1.00 0.00 H new ATOM 0 HE22 GLN A 168 19.950 -3.235 -4.970 1.00 0.00 H new ATOM 794 N ALA A 169 16.706 -0.313 -8.929 1.00 0.00 N ATOM 795 CA ALA A 169 15.488 0.183 -9.551 1.00 0.00 C ATOM 796 C ALA A 169 15.323 1.686 -9.299 1.00 0.00 C ATOM 797 O ALA A 169 15.440 2.458 -10.247 1.00 0.00 O ATOM 798 CB ALA A 169 14.287 -0.632 -9.058 1.00 0.00 C ATOM 0 H ALA A 169 16.562 -0.678 -7.987 1.00 0.00 H new ATOM 0 HA ALA A 169 15.552 0.055 -10.632 1.00 0.00 H new ATOM 0 HB1 ALA A 169 13.377 -0.258 -9.526 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.426 -1.680 -9.322 1.00 0.00 H new ATOM 0 HB3 ALA A 169 14.203 -0.538 -7.975 1.00 0.00 H new ATOM 804 N SER A 170 15.005 2.060 -8.054 1.00 0.00 N ATOM 805 CA SER A 170 14.781 3.412 -7.531 1.00 0.00 C ATOM 806 C SER A 170 14.029 4.382 -8.457 1.00 0.00 C ATOM 807 O SER A 170 14.602 5.040 -9.327 1.00 0.00 O ATOM 808 CB SER A 170 16.076 4.003 -6.963 1.00 0.00 C ATOM 809 OG SER A 170 17.244 3.650 -7.673 1.00 0.00 O ATOM 0 H SER A 170 14.887 1.360 -7.321 1.00 0.00 H new ATOM 0 HA SER A 170 14.073 3.280 -6.713 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.989 5.089 -6.950 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.184 3.679 -5.928 1.00 0.00 H new ATOM 0 HG SER A 170 17.666 2.876 -7.244 1.00 0.00 H new ATOM 815 N ASN A 171 12.710 4.487 -8.273 1.00 0.00 N ATOM 816 CA ASN A 171 11.883 5.507 -8.915 1.00 0.00 C ATOM 817 C ASN A 171 10.614 5.698 -8.084 1.00 0.00 C ATOM 818 O ASN A 171 10.314 4.845 -7.254 1.00 0.00 O ATOM 819 CB ASN A 171 11.491 5.033 -10.317 1.00 0.00 C ATOM 820 CG ASN A 171 10.968 6.136 -11.214 1.00 0.00 C ATOM 821 OD1 ASN A 171 11.019 7.310 -10.864 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.387 5.772 -12.339 1.00 0.00 N ATOM 0 H ASN A 171 12.183 3.858 -7.667 1.00 0.00 H new ATOM 0 HA ASN A 171 12.435 6.444 -8.986 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.359 4.574 -10.790 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.729 4.258 -10.228 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.964 6.475 -12.945 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.360 4.787 -12.604 1.00 0.00 H new ATOM 829 N GLN A 172 9.794 6.705 -8.387 1.00 0.00 N ATOM 830 CA GLN A 172 8.492 6.922 -7.750 1.00 0.00 C ATOM 831 C GLN A 172 7.401 6.233 -8.572 1.00 0.00 C ATOM 832 O GLN A 172 6.239 6.234 -8.185 1.00 0.00 O ATOM 833 CB GLN A 172 8.193 8.429 -7.554 1.00 0.00 C ATOM 834 CG GLN A 172 6.984 8.650 -6.618 1.00 0.00 C ATOM 835 CD GLN A 172 6.824 10.076 -6.100 1.00 0.00 C ATOM 836 OE1 GLN A 172 6.574 11.007 -6.857 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.911 10.267 -4.789 1.00 0.00 N ATOM 0 H GLN A 172 10.019 7.405 -9.094 1.00 0.00 H new ATOM 0 HA GLN A 172 8.513 6.481 -6.754 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.071 8.924 -7.139 1.00 0.00 H new ATOM 0 HB3 GLN A 172 7.994 8.890 -8.521 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.075 8.368 -7.150 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.076 7.977 -5.765 1.00 0.00 H new ATOM 0 HE21 GLN A 172 7.120 9.482 -4.172 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.769 11.199 -4.399 1.00 0.00 H new ATOM 846 N ASN A 173 7.749 5.652 -9.720 1.00 0.00 N ATOM 847 CA ASN A 173 6.799 4.974 -10.574 1.00 0.00 C ATOM 848 C ASN A 173 6.846 3.484 -10.282 1.00 0.00 C ATOM 849 O ASN A 173 5.895 2.906 -9.775 1.00 0.00 O ATOM 850 CB ASN A 173 7.144 5.260 -12.034 1.00 0.00 C ATOM 851 CG ASN A 173 5.875 5.296 -12.852 1.00 0.00 C ATOM 852 OD1 ASN A 173 5.339 4.257 -13.225 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.423 6.493 -13.175 1.00 0.00 N ATOM 0 H ASN A 173 8.704 5.643 -10.077 1.00 0.00 H new ATOM 0 HA ASN A 173 5.788 5.333 -10.382 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.669 6.212 -12.115 1.00 0.00 H new ATOM 0 HB3 ASN A 173 7.815 4.492 -12.418 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.592 6.584 -13.760 1.00 0.00 H new ATOM 0 HD22 ASN A 173 5.904 7.327 -12.840 1.00 0.00 H new ATOM 860 N ASN A 174 7.984 2.847 -10.566 1.00 0.00 N ATOM 861 CA ASN A 174 8.048 1.389 -10.635 1.00 0.00 C ATOM 862 C ASN A 174 8.026 0.783 -9.243 1.00 0.00 C ATOM 863 O ASN A 174 7.278 -0.161 -9.006 1.00 0.00 O ATOM 864 CB ASN A 174 9.275 0.893 -11.402 1.00 0.00 C ATOM 865 CG ASN A 174 10.479 1.796 -11.332 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.538 2.793 -12.043 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.436 1.501 -10.475 1.00 0.00 N ATOM 0 H ASN A 174 8.870 3.318 -10.751 1.00 0.00 H new ATOM 0 HA ASN A 174 7.165 1.063 -11.184 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.553 -0.088 -11.017 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.001 0.759 -12.448 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.251 2.109 -10.391 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.362 0.665 -9.895 1.00 0.00 H new ATOM 874 N PHE A 175 8.807 1.356 -8.321 1.00 0.00 N ATOM 875 CA PHE A 175 8.795 0.995 -6.905 1.00 0.00 C ATOM 876 C PHE A 175 7.359 0.995 -6.373 1.00 0.00 C ATOM 877 O PHE A 175 7.019 0.156 -5.546 1.00 0.00 O ATOM 878 CB PHE A 175 9.657 2.011 -6.126 1.00 0.00 C ATOM 879 CG PHE A 175 9.799 1.814 -4.621 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.721 2.096 -3.756 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.038 1.438 -4.064 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.872 1.994 -2.362 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.192 1.356 -2.667 1.00 0.00 C ATOM 884 CZ PHE A 175 10.114 1.643 -1.814 1.00 0.00 C ATOM 0 H PHE A 175 9.474 2.094 -8.544 1.00 0.00 H new ATOM 0 HA PHE A 175 9.205 -0.006 -6.776 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.657 2.005 -6.561 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.241 3.004 -6.296 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.769 2.394 -4.169 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.872 1.212 -4.711 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.031 2.186 -1.713 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.146 1.070 -2.248 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.241 1.594 -0.743 1.00 0.00 H new ATOM 894 N VAL A 176 6.542 1.954 -6.815 1.00 0.00 N ATOM 895 CA VAL A 176 5.253 2.318 -6.243 1.00 0.00 C ATOM 896 C VAL A 176 4.110 1.552 -6.931 1.00 0.00 C ATOM 897 O VAL A 176 3.147 1.159 -6.271 1.00 0.00 O ATOM 898 CB VAL A 176 5.147 3.854 -6.377 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.799 4.423 -5.923 1.00 0.00 C ATOM 900 CG2 VAL A 176 6.234 4.543 -5.524 1.00 0.00 C ATOM 0 H VAL A 176 6.779 2.526 -7.626 1.00 0.00 H new ATOM 0 HA VAL A 176 5.170 2.039 -5.193 1.00 0.00 H new ATOM 0 HB VAL A 176 5.269 4.054 -7.441 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.801 5.506 -6.047 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.000 3.990 -6.525 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.636 4.178 -4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.147 5.625 -5.628 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.104 4.268 -4.477 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.219 4.224 -5.863 1.00 0.00 H new ATOM 910 N HIS A 177 4.207 1.303 -8.237 1.00 0.00 N ATOM 911 CA HIS A 177 3.307 0.459 -9.012 1.00 0.00 C ATOM 912 C HIS A 177 3.410 -0.972 -8.484 1.00 0.00 C ATOM 913 O HIS A 177 2.419 -1.540 -8.030 1.00 0.00 O ATOM 914 CB HIS A 177 3.693 0.594 -10.495 1.00 0.00 C ATOM 915 CG HIS A 177 2.905 -0.247 -11.470 1.00 0.00 C ATOM 916 ND1 HIS A 177 2.671 -1.593 -11.388 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 2.378 0.185 -12.666 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 2.033 -1.990 -12.567 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 1.842 -0.873 -13.289 1.00 0.00 N flip ATOM 0 H HIS A 177 4.951 1.705 -8.807 1.00 0.00 H new ATOM 0 HA HIS A 177 2.264 0.759 -8.915 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.587 1.640 -10.782 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.748 0.340 -10.599 1.00 0.00 H new ATOM 0 HD2 HIS A 177 2.394 1.199 -13.037 1.00 0.00 H new ATOM 0 HE1 HIS A 177 1.750 -2.995 -12.843 1.00 0.00 H new ATOM 0 HE2 HIS A 177 1.357 -0.836 -14.186 1.00 0.00 H new ATOM 927 N ASP A 178 4.605 -1.564 -8.550 1.00 0.00 N ATOM 928 CA ASP A 178 4.891 -2.911 -8.074 1.00 0.00 C ATOM 929 C ASP A 178 4.476 -3.072 -6.618 1.00 0.00 C ATOM 930 O ASP A 178 3.896 -4.088 -6.262 1.00 0.00 O ATOM 931 CB ASP A 178 6.386 -3.199 -8.218 1.00 0.00 C ATOM 932 CG ASP A 178 6.659 -4.695 -8.273 1.00 0.00 C ATOM 933 OD1 ASP A 178 6.722 -5.341 -7.210 1.00 0.00 O ATOM 934 OD2 ASP A 178 6.863 -5.214 -9.398 1.00 0.00 O ATOM 0 H ASP A 178 5.422 -1.102 -8.949 1.00 0.00 H new ATOM 0 HA ASP A 178 4.320 -3.619 -8.675 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.764 -2.725 -9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.925 -2.759 -7.379 1.00 0.00 H new ATOM 939 N CYS A 179 4.716 -2.050 -5.793 1.00 0.00 N ATOM 940 CA CYS A 179 4.319 -2.054 -4.388 1.00 0.00 C ATOM 941 C CYS A 179 2.813 -2.197 -4.201 1.00 0.00 C ATOM 942 O CYS A 179 2.378 -2.928 -3.306 1.00 0.00 O ATOM 943 CB CYS A 179 4.802 -0.785 -3.697 1.00 0.00 C ATOM 944 SG CYS A 179 4.410 -0.678 -1.946 1.00 0.00 S ATOM 0 H CYS A 179 5.192 -1.196 -6.084 1.00 0.00 H new ATOM 0 HA CYS A 179 4.788 -2.927 -3.934 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.883 -0.713 -3.817 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.367 0.076 -4.205 1.00 0.00 H new ATOM 949 N VAL A 180 2.023 -1.501 -5.019 1.00 0.00 N ATOM 950 CA VAL A 180 0.578 -1.643 -5.030 1.00 0.00 C ATOM 951 C VAL A 180 0.246 -3.077 -5.436 1.00 0.00 C ATOM 952 O VAL A 180 -0.346 -3.775 -4.617 1.00 0.00 O ATOM 953 CB VAL A 180 -0.050 -0.518 -5.881 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.507 -0.781 -6.264 1.00 0.00 C ATOM 955 CG2 VAL A 180 -0.004 0.785 -5.069 1.00 0.00 C ATOM 0 H VAL A 180 2.375 -0.821 -5.693 1.00 0.00 H new ATOM 0 HA VAL A 180 0.127 -1.506 -4.047 1.00 0.00 H new ATOM 0 HB VAL A 180 0.525 -0.460 -6.805 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.882 0.050 -6.861 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.570 -1.702 -6.844 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -2.109 -0.880 -5.360 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.444 1.593 -5.653 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.567 0.658 -4.144 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.031 1.030 -4.832 1.00 0.00 H new ATOM 965 N ASN A 181 0.683 -3.548 -6.615 1.00 0.00 N ATOM 966 CA ASN A 181 0.501 -4.929 -7.081 1.00 0.00 C ATOM 967 C ASN A 181 0.795 -5.946 -5.982 1.00 0.00 C ATOM 968 O ASN A 181 0.025 -6.889 -5.795 1.00 0.00 O ATOM 969 CB ASN A 181 1.434 -5.235 -8.271 1.00 0.00 C ATOM 970 CG ASN A 181 0.873 -4.843 -9.624 1.00 0.00 C ATOM 971 OD1 ASN A 181 -0.336 -4.861 -9.851 1.00 0.00 O ATOM 972 ND2 ASN A 181 1.752 -4.472 -10.532 1.00 0.00 N ATOM 0 H ASN A 181 1.184 -2.964 -7.285 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.543 -5.014 -7.383 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.380 -4.715 -8.119 1.00 0.00 H new ATOM 0 HB3 ASN A 181 1.655 -6.302 -8.278 1.00 0.00 H new ATOM 0 HD21 ASN A 181 1.438 -4.187 -11.460 1.00 0.00 H new ATOM 0 HD22 ASN A 181 2.747 -4.470 -10.308 1.00 0.00 H new ATOM 979 N ILE A 182 1.925 -5.788 -5.298 1.00 0.00 N ATOM 980 CA ILE A 182 2.402 -6.690 -4.273 1.00 0.00 C ATOM 981 C ILE A 182 1.515 -6.611 -3.035 1.00 0.00 C ATOM 982 O ILE A 182 0.928 -7.622 -2.662 1.00 0.00 O ATOM 983 CB ILE A 182 3.917 -6.437 -4.029 1.00 0.00 C ATOM 984 CG1 ILE A 182 4.840 -7.241 -4.982 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.353 -6.760 -2.608 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.358 -8.638 -5.404 1.00 0.00 C ATOM 0 H ILE A 182 2.551 -4.998 -5.454 1.00 0.00 H new ATOM 0 HA ILE A 182 2.324 -7.728 -4.595 1.00 0.00 H new ATOM 0 HB ILE A 182 4.027 -5.370 -4.224 1.00 0.00 H new ATOM 0 HG12 ILE A 182 4.994 -6.649 -5.884 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.812 -7.349 -4.501 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.420 -6.563 -2.501 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.797 -6.138 -1.907 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.155 -7.811 -2.397 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.093 -9.091 -6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.234 -9.263 -4.519 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.404 -8.552 -5.924 1.00 0.00 H new ATOM 998 N THR A 183 1.397 -5.461 -2.380 1.00 0.00 N ATOM 999 CA THR A 183 0.713 -5.391 -1.093 1.00 0.00 C ATOM 1000 C THR A 183 -0.756 -5.806 -1.289 1.00 0.00 C ATOM 1001 O THR A 183 -1.290 -6.576 -0.485 1.00 0.00 O ATOM 1002 CB THR A 183 0.857 -3.966 -0.551 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.217 -3.553 -0.543 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.290 -3.797 0.855 1.00 0.00 C ATOM 0 H THR A 183 1.763 -4.570 -2.716 1.00 0.00 H new ATOM 0 HA THR A 183 1.149 -6.073 -0.363 1.00 0.00 H new ATOM 0 HB THR A 183 0.276 -3.340 -1.229 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.469 -3.240 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.424 -2.765 1.180 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.772 -4.041 0.851 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.813 -4.464 1.541 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.378 -5.395 -2.404 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.685 -5.877 -2.833 1.00 0.00 C ATOM 1014 C ILE A 184 -2.651 -7.394 -2.925 1.00 0.00 C ATOM 1015 O ILE A 184 -3.508 -8.039 -2.330 1.00 0.00 O ATOM 1016 CB ILE A 184 -3.099 -5.214 -4.165 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.533 -3.769 -3.853 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -4.198 -5.968 -4.923 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.985 -2.972 -5.069 1.00 0.00 C ATOM 0 H ILE A 184 -0.974 -4.706 -3.039 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.443 -5.600 -2.101 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.240 -5.234 -4.836 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.347 -3.795 -3.128 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.701 -3.247 -3.380 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.432 -5.439 -5.847 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.852 -6.974 -5.159 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.092 -6.028 -4.303 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.273 -1.967 -4.759 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.168 -2.910 -5.788 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.839 -3.467 -5.532 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.690 -7.992 -3.635 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.579 -9.439 -3.756 1.00 0.00 C ATOM 1033 C LYS A 185 -1.525 -10.108 -2.387 1.00 0.00 C ATOM 1034 O LYS A 185 -2.135 -11.170 -2.210 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.370 -9.788 -4.631 1.00 0.00 C ATOM 1036 CG LYS A 185 -0.036 -11.279 -4.714 1.00 0.00 C ATOM 1037 CD LYS A 185 0.275 -11.615 -6.175 1.00 0.00 C ATOM 1038 CE LYS A 185 0.923 -12.984 -6.384 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.894 -13.355 -7.813 1.00 0.00 N ATOM 0 H LYS A 185 -0.968 -7.480 -4.142 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.471 -9.829 -4.245 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.552 -9.416 -5.639 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.501 -9.257 -4.247 1.00 0.00 H new ATOM 0 HG2 LYS A 185 0.818 -11.514 -4.079 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.874 -11.877 -4.356 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.650 -11.573 -6.750 1.00 0.00 H new ATOM 0 HD3 LYS A 185 0.936 -10.848 -6.579 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.953 -12.964 -6.028 1.00 0.00 H new ATOM 0 HE3 LYS A 185 0.397 -13.736 -5.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 1.338 -14.287 -7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.092 -13.394 -8.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.416 -12.646 -8.366 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.884 -9.516 -1.383 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.822 -10.127 -0.073 1.00 0.00 C ATOM 1055 C GLN A 186 -2.200 -10.046 0.552 1.00 0.00 C ATOM 1056 O GLN A 186 -2.703 -11.025 1.101 1.00 0.00 O ATOM 1057 CB GLN A 186 0.277 -9.481 0.784 1.00 0.00 C ATOM 1058 CG GLN A 186 1.607 -10.162 0.469 1.00 0.00 C ATOM 1059 CD GLN A 186 2.289 -9.517 -0.714 1.00 0.00 C ATOM 1060 OE1 GLN A 186 2.726 -8.390 -0.610 1.00 0.00 O ATOM 1061 NE2 GLN A 186 2.381 -10.200 -1.845 1.00 0.00 N ATOM 0 H GLN A 186 -0.405 -8.619 -1.458 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.544 -11.178 -0.149 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.340 -8.413 0.575 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.041 -9.585 1.843 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.260 -10.110 1.340 1.00 0.00 H new ATOM 0 HG3 GLN A 186 1.437 -11.218 0.261 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.004 -11.146 -1.902 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.829 -9.780 -2.659 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.871 -8.929 0.365 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.260 -8.798 0.709 1.00 0.00 C ATOM 1072 C HIS A 187 -5.204 -9.699 -0.126 1.00 0.00 C ATOM 1073 O HIS A 187 -6.273 -10.013 0.383 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.570 -7.303 0.731 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.411 -6.778 2.139 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.424 -6.422 3.000 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.252 -6.828 2.868 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -4.892 -6.274 4.226 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -3.567 -6.525 4.198 1.00 0.00 N ATOM 0 H HIS A 187 -2.460 -8.084 -0.033 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.461 -9.197 1.703 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.900 -6.772 0.055 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.586 -7.126 0.378 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.405 -6.293 2.752 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.269 -7.060 2.485 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -5.447 -5.994 5.109 1.00 0.00 H new ATOM 1087 N THR A 188 -4.803 -10.246 -1.290 1.00 0.00 N ATOM 1088 CA THR A 188 -5.663 -11.076 -2.154 1.00 0.00 C ATOM 1089 C THR A 188 -5.538 -12.567 -1.858 1.00 0.00 C ATOM 1090 O THR A 188 -6.402 -13.364 -2.211 1.00 0.00 O ATOM 1091 CB THR A 188 -5.345 -10.912 -3.655 1.00 0.00 C ATOM 1092 OG1 THR A 188 -4.052 -11.316 -4.046 1.00 0.00 O ATOM 1093 CG2 THR A 188 -5.743 -9.577 -4.279 1.00 0.00 C ATOM 0 H THR A 188 -3.861 -10.122 -1.661 1.00 0.00 H new ATOM 0 HA THR A 188 -6.669 -10.720 -1.931 1.00 0.00 H new ATOM 0 HB THR A 188 -6.028 -11.642 -4.090 1.00 0.00 H new ATOM 0 HG1 THR A 188 -3.505 -11.478 -3.249 1.00 0.00 H new ATOM 0 HG21 THR A 188 -5.472 -9.574 -5.335 1.00 0.00 H new ATOM 0 HG22 THR A 188 -6.819 -9.435 -4.180 1.00 0.00 H new ATOM 0 HG23 THR A 188 -5.222 -8.767 -3.768 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.395 -12.966 -1.310 1.00 0.00 N ATOM 1102 CA VAL A 189 -3.984 -14.365 -1.284 1.00 0.00 C ATOM 1103 C VAL A 189 -3.354 -14.700 0.042 1.00 0.00 C ATOM 1104 O VAL A 189 -3.677 -15.702 0.662 1.00 0.00 O ATOM 1105 CB VAL A 189 -3.052 -14.640 -2.484 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -1.534 -14.554 -2.265 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -3.406 -16.006 -3.067 1.00 0.00 C ATOM 0 H VAL A 189 -3.729 -12.330 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 189 -4.850 -15.019 -1.384 1.00 0.00 H new ATOM 0 HB VAL A 189 -3.244 -13.808 -3.161 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.019 -14.773 -3.200 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -1.271 -13.550 -1.932 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -1.234 -15.278 -1.507 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.757 -16.218 -3.917 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -3.269 -16.773 -2.305 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.445 -16.003 -3.396 1.00 0.00 H new ATOM 1117 N THR A 190 -2.490 -13.819 0.522 1.00 0.00 N ATOM 1118 CA THR A 190 -1.911 -14.003 1.848 1.00 0.00 C ATOM 1119 C THR A 190 -2.978 -13.729 2.936 1.00 0.00 C ATOM 1120 O THR A 190 -2.775 -14.101 4.094 1.00 0.00 O ATOM 1121 CB THR A 190 -0.601 -13.196 1.915 1.00 0.00 C ATOM 1122 OG1 THR A 190 0.376 -13.857 1.123 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.035 -12.897 3.293 1.00 0.00 C ATOM 0 H THR A 190 -2.177 -12.984 0.026 1.00 0.00 H new ATOM 0 HA THR A 190 -1.618 -15.033 2.051 1.00 0.00 H new ATOM 0 HB THR A 190 -0.862 -12.209 1.534 1.00 0.00 H new ATOM 0 HG1 THR A 190 1.217 -13.354 1.154 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.887 -12.324 3.191 1.00 0.00 H new ATOM 0 HG22 THR A 190 -0.760 -12.320 3.867 1.00 0.00 H new ATOM 0 HG23 THR A 190 0.175 -13.833 3.811 1.00 0.00 H new ATOM 1131 N THR A 191 -4.150 -13.193 2.567 1.00 0.00 N ATOM 1132 CA THR A 191 -5.151 -12.664 3.487 1.00 0.00 C ATOM 1133 C THR A 191 -6.562 -13.188 3.140 1.00 0.00 C ATOM 1134 O THR A 191 -7.185 -13.816 3.995 1.00 0.00 O ATOM 1135 CB THR A 191 -4.984 -11.134 3.488 1.00 0.00 C ATOM 1136 OG1 THR A 191 -3.621 -10.780 3.685 1.00 0.00 O ATOM 1137 CG2 THR A 191 -5.818 -10.409 4.530 1.00 0.00 C ATOM 0 H THR A 191 -4.430 -13.116 1.589 1.00 0.00 H new ATOM 0 HA THR A 191 -5.009 -13.014 4.510 1.00 0.00 H new ATOM 0 HB THR A 191 -5.342 -10.816 2.509 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.145 -10.823 2.829 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.638 -9.336 4.458 1.00 0.00 H new ATOM 0 HG22 THR A 191 -6.875 -10.612 4.356 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.541 -10.758 5.525 1.00 0.00 H new ATOM 1145 N THR A 192 -7.052 -13.068 1.891 1.00 0.00 N ATOM 1146 CA THR A 192 -8.391 -13.572 1.507 1.00 0.00 C ATOM 1147 C THR A 192 -8.586 -15.095 1.681 1.00 0.00 C ATOM 1148 O THR A 192 -9.701 -15.600 1.603 1.00 0.00 O ATOM 1149 CB THR A 192 -8.686 -13.139 0.058 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.514 -11.741 -0.062 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.027 -13.521 -0.567 1.00 0.00 C ATOM 0 H THR A 192 -6.541 -12.626 1.127 1.00 0.00 H new ATOM 0 HA THR A 192 -9.106 -13.128 2.200 1.00 0.00 H new ATOM 0 HB THR A 192 -7.965 -13.724 -0.513 1.00 0.00 H new ATOM 0 HG1 THR A 192 -7.563 -11.520 0.023 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.074 -13.141 -1.587 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.127 -14.606 -0.579 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.838 -13.089 0.019 1.00 0.00 H new ATOM 1159 N THR A 193 -7.524 -15.844 1.966 1.00 0.00 N ATOM 1160 CA THR A 193 -7.576 -17.290 2.167 1.00 0.00 C ATOM 1161 C THR A 193 -7.564 -17.635 3.668 1.00 0.00 C ATOM 1162 O THR A 193 -7.489 -18.807 4.031 1.00 0.00 O ATOM 1163 CB THR A 193 -6.459 -17.924 1.318 1.00 0.00 C ATOM 1164 OG1 THR A 193 -6.792 -19.226 0.898 1.00 0.00 O ATOM 1165 CG2 THR A 193 -5.090 -17.930 1.994 1.00 0.00 C ATOM 0 H THR A 193 -6.586 -15.456 2.066 1.00 0.00 H new ATOM 0 HA THR A 193 -8.514 -17.722 1.819 1.00 0.00 H new ATOM 0 HB THR A 193 -6.377 -17.276 0.445 1.00 0.00 H new ATOM 0 HG1 THR A 193 -6.059 -19.594 0.361 1.00 0.00 H new ATOM 0 HG21 THR A 193 -4.359 -18.393 1.331 1.00 0.00 H new ATOM 0 HG22 THR A 193 -4.786 -16.906 2.210 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.146 -18.496 2.924 1.00 0.00 H new ATOM 1173 N LYS A 194 -7.609 -16.621 4.546 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.630 -16.768 5.997 1.00 0.00 C ATOM 1175 C LYS A 194 -8.926 -16.234 6.617 1.00 0.00 C ATOM 1176 O LYS A 194 -9.088 -16.357 7.836 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.424 -16.047 6.622 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.042 -16.494 6.113 1.00 0.00 C ATOM 1179 CD LYS A 194 -3.997 -16.198 7.201 1.00 0.00 C ATOM 1180 CE LYS A 194 -2.555 -16.229 6.686 1.00 0.00 C ATOM 1181 NZ LYS A 194 -1.591 -16.355 7.796 1.00 0.00 N ATOM 0 H LYS A 194 -7.632 -15.646 4.248 1.00 0.00 H new ATOM 0 HA LYS A 194 -7.575 -17.835 6.211 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.529 -14.977 6.440 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.457 -16.192 7.702 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.052 -17.558 5.878 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -4.789 -15.967 5.193 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -4.200 -15.217 7.632 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -4.104 -16.927 8.004 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -2.431 -17.065 5.997 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -2.348 -15.319 6.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -0.623 -16.373 7.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.695 -15.545 8.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.775 -17.236 8.317 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.834 -15.677 5.814 1.00 0.00 N ATOM 1196 CA GLY A 195 -11.094 -15.115 6.279 1.00 0.00 C ATOM 1197 C GLY A 195 -11.402 -13.722 5.734 1.00 0.00 C ATOM 1198 O GLY A 195 -12.488 -13.211 6.012 1.00 0.00 O ATOM 0 H GLY A 195 -9.708 -15.605 4.804 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.904 -15.789 5.999 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.078 -15.071 7.368 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.509 -13.093 4.963 1.00 0.00 N ATOM 1203 CA GLU A 196 -10.833 -11.818 4.316 1.00 0.00 C ATOM 1204 C GLU A 196 -11.562 -12.076 2.992 1.00 0.00 C ATOM 1205 O GLU A 196 -11.448 -13.173 2.458 1.00 0.00 O ATOM 1206 CB GLU A 196 -9.534 -11.028 4.083 1.00 0.00 C ATOM 1207 CG GLU A 196 -9.517 -9.723 4.881 1.00 0.00 C ATOM 1208 CD GLU A 196 -9.299 -9.936 6.382 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -10.264 -10.310 7.090 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -8.152 -9.732 6.840 1.00 0.00 O ATOM 0 H GLU A 196 -9.569 -13.440 4.773 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.492 -11.232 4.957 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.679 -11.641 4.368 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -9.428 -10.807 3.021 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.728 -9.078 4.494 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.461 -9.199 4.728 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.233 -11.073 2.402 1.00 0.00 N ATOM 1218 CA ASN A 197 -12.811 -11.185 1.049 1.00 0.00 C ATOM 1219 C ASN A 197 -13.084 -9.802 0.451 1.00 0.00 C ATOM 1220 O ASN A 197 -14.234 -9.394 0.251 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.075 -12.063 1.055 1.00 0.00 C ATOM 1222 CG ASN A 197 -14.452 -12.601 -0.328 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -14.540 -13.800 -0.537 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.667 -11.756 -1.322 1.00 0.00 N ATOM 0 H ASN A 197 -12.390 -10.167 2.844 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.078 -11.678 0.410 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -13.921 -12.902 1.733 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -14.909 -11.483 1.450 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.903 -12.109 -2.249 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.597 -10.751 -1.161 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.013 -9.070 0.165 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.068 -7.798 -0.561 1.00 0.00 C ATOM 1233 C PHE A 198 -12.786 -7.996 -1.903 1.00 0.00 C ATOM 1234 O PHE A 198 -12.618 -9.035 -2.550 1.00 0.00 O ATOM 1235 CB PHE A 198 -10.646 -7.250 -0.780 1.00 0.00 C ATOM 1236 CG PHE A 198 -9.870 -7.006 0.500 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.193 -5.911 1.327 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -8.851 -7.897 0.887 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -9.539 -5.739 2.558 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.214 -7.736 2.130 1.00 0.00 C ATOM 1241 CZ PHE A 198 -8.573 -6.669 2.975 1.00 0.00 C ATOM 0 H PHE A 198 -11.068 -9.344 0.433 1.00 0.00 H new ATOM 0 HA PHE A 198 -12.627 -7.072 0.029 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.090 -7.952 -1.401 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.711 -6.315 -1.336 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -10.945 -5.203 1.013 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.559 -8.703 0.230 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.779 -4.892 3.184 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.448 -8.432 2.437 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.106 -6.566 3.943 1.00 0.00 H new ATOM 1251 N THR A 199 -13.583 -7.013 -2.309 1.00 0.00 N ATOM 1252 CA THR A 199 -14.299 -6.967 -3.583 1.00 0.00 C ATOM 1253 C THR A 199 -13.450 -6.294 -4.657 1.00 0.00 C ATOM 1254 O THR A 199 -12.286 -5.969 -4.413 1.00 0.00 O ATOM 1255 CB THR A 199 -15.649 -6.267 -3.382 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.523 -4.955 -2.866 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.520 -7.121 -2.472 1.00 0.00 C ATOM 0 H THR A 199 -13.756 -6.188 -1.734 1.00 0.00 H new ATOM 0 HA THR A 199 -14.494 -7.981 -3.932 1.00 0.00 H new ATOM 0 HB THR A 199 -16.116 -6.160 -4.361 1.00 0.00 H new ATOM 0 HG1 THR A 199 -15.489 -4.990 -1.887 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.482 -6.630 -2.324 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.677 -8.097 -2.930 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.025 -7.248 -1.509 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.997 -6.081 -5.856 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.361 -5.245 -6.842 1.00 0.00 C ATOM 1267 C GLU A 200 -13.241 -3.835 -6.269 1.00 0.00 C ATOM 1268 O GLU A 200 -12.147 -3.299 -6.188 1.00 0.00 O ATOM 1269 CB GLU A 200 -14.177 -5.304 -8.141 1.00 0.00 C ATOM 1270 CG GLU A 200 -13.264 -4.782 -9.253 1.00 0.00 C ATOM 1271 CD GLU A 200 -13.837 -4.749 -10.674 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -14.999 -5.151 -10.899 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -13.074 -4.334 -11.585 1.00 0.00 O ATOM 0 H GLU A 200 -14.884 -6.485 -6.156 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.355 -5.588 -7.082 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.499 -6.324 -8.351 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.078 -4.695 -8.061 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.956 -3.770 -8.990 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -12.363 -5.396 -9.266 1.00 0.00 H new ATOM 1280 N THR A 201 -14.338 -3.251 -5.785 1.00 0.00 N ATOM 1281 CA THR A 201 -14.335 -1.886 -5.273 1.00 0.00 C ATOM 1282 C THR A 201 -13.375 -1.719 -4.085 1.00 0.00 C ATOM 1283 O THR A 201 -12.726 -0.679 -3.972 1.00 0.00 O ATOM 1284 CB THR A 201 -15.772 -1.485 -4.930 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.586 -1.697 -6.069 1.00 0.00 O ATOM 1286 CG2 THR A 201 -15.914 -0.009 -4.555 1.00 0.00 C ATOM 0 H THR A 201 -15.247 -3.710 -5.738 1.00 0.00 H new ATOM 0 HA THR A 201 -13.959 -1.212 -6.043 1.00 0.00 H new ATOM 0 HB THR A 201 -16.068 -2.090 -4.073 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.510 -1.445 -5.862 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.957 0.209 -4.324 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.296 0.206 -3.683 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.591 0.611 -5.391 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.242 -2.728 -3.218 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.302 -2.650 -2.097 1.00 0.00 C ATOM 1296 C ASP A 202 -10.868 -2.660 -2.621 1.00 0.00 C ATOM 1297 O ASP A 202 -10.036 -1.895 -2.137 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.470 -3.806 -1.108 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.849 -3.880 -0.462 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -14.375 -2.838 -0.023 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.443 -4.984 -0.504 1.00 0.00 O ATOM 0 H ASP A 202 -13.768 -3.600 -3.270 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.516 -1.720 -1.570 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.273 -4.744 -1.626 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.719 -3.711 -0.324 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.567 -3.492 -3.624 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.248 -3.507 -4.252 1.00 0.00 C ATOM 1308 C VAL A 203 -9.008 -2.177 -4.976 1.00 0.00 C ATOM 1309 O VAL A 203 -7.939 -1.598 -4.814 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.083 -4.757 -5.147 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.789 -4.731 -5.976 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.025 -6.021 -4.268 1.00 0.00 C ATOM 0 H VAL A 203 -11.225 -4.165 -4.017 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.468 -3.591 -3.495 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.939 -4.762 -5.822 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.728 -5.634 -6.584 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.790 -3.855 -6.625 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.929 -4.685 -5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.909 -6.900 -4.902 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.178 -5.951 -3.586 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -9.947 -6.107 -3.694 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.991 -1.634 -5.699 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.905 -0.354 -6.405 1.00 0.00 C ATOM 1324 C LYS A 204 -9.581 0.794 -5.455 1.00 0.00 C ATOM 1325 O LYS A 204 -8.837 1.697 -5.849 1.00 0.00 O ATOM 1326 CB LYS A 204 -11.224 -0.072 -7.142 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.486 -1.052 -8.298 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.820 -0.592 -9.588 1.00 0.00 C ATOM 1329 CE LYS A 204 -11.079 -1.590 -10.710 1.00 0.00 C ATOM 1330 NZ LYS A 204 -10.536 -1.081 -11.983 1.00 0.00 N ATOM 0 H LYS A 204 -10.897 -2.088 -5.812 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.092 -0.426 -7.127 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.050 -0.126 -6.432 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.206 0.946 -7.532 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -11.114 -2.040 -8.029 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.560 -1.148 -8.457 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.202 0.389 -9.871 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.747 -0.483 -9.431 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -10.619 -2.548 -10.467 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -12.150 -1.767 -10.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -10.719 -1.771 -12.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -10.994 -0.178 -12.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -9.511 -0.935 -11.889 1.00 0.00 H new ATOM 1344 N MET A 205 -10.117 0.769 -4.234 1.00 0.00 N ATOM 1345 CA MET A 205 -9.745 1.683 -3.160 1.00 0.00 C ATOM 1346 C MET A 205 -8.302 1.415 -2.736 1.00 0.00 C ATOM 1347 O MET A 205 -7.517 2.348 -2.548 1.00 0.00 O ATOM 1348 CB MET A 205 -10.683 1.478 -1.960 1.00 0.00 C ATOM 1349 CG MET A 205 -12.064 2.080 -2.200 1.00 0.00 C ATOM 1350 SD MET A 205 -12.052 3.866 -1.954 1.00 0.00 S ATOM 1351 CE MET A 205 -13.700 4.292 -2.548 1.00 0.00 C ATOM 0 H MET A 205 -10.836 0.099 -3.961 1.00 0.00 H new ATOM 0 HA MET A 205 -9.832 2.710 -3.514 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.783 0.412 -1.757 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.240 1.931 -1.073 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.391 1.853 -3.215 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.785 1.622 -1.523 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.819 5.376 -2.546 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.830 3.915 -3.562 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.449 3.844 -1.895 1.00 0.00 H new ATOM 1361 N MET A 206 -7.941 0.142 -2.570 1.00 0.00 N ATOM 1362 CA MET A 206 -6.623 -0.277 -2.123 1.00 0.00 C ATOM 1363 C MET A 206 -5.519 0.196 -3.075 1.00 0.00 C ATOM 1364 O MET A 206 -4.438 0.546 -2.597 1.00 0.00 O ATOM 1365 CB MET A 206 -6.593 -1.799 -1.919 1.00 0.00 C ATOM 1366 CG MET A 206 -5.467 -2.192 -0.961 1.00 0.00 C ATOM 1367 SD MET A 206 -5.293 -3.955 -0.550 1.00 0.00 S ATOM 1368 CE MET A 206 -7.018 -4.521 -0.461 1.00 0.00 C ATOM 0 H MET A 206 -8.573 -0.638 -2.748 1.00 0.00 H new ATOM 0 HA MET A 206 -6.422 0.198 -1.163 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.550 -2.137 -1.522 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.452 -2.297 -2.878 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.525 -1.852 -1.391 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.609 -1.642 -0.031 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.066 -5.456 0.097 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.623 -3.767 0.042 1.00 0.00 H new ATOM 0 HE3 MET A 206 -7.401 -4.680 -1.469 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.791 0.279 -4.386 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.836 0.784 -5.374 1.00 0.00 C ATOM 1380 C GLU A 207 -4.405 2.219 -5.052 1.00 0.00 C ATOM 1381 O GLU A 207 -3.274 2.600 -5.354 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.372 0.692 -6.820 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.879 -0.702 -7.220 1.00 0.00 C ATOM 1384 CD GLU A 207 -6.087 -0.924 -8.720 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -7.016 -0.331 -9.319 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -5.406 -1.790 -9.315 1.00 0.00 O ATOM 0 H GLU A 207 -6.684 -0.004 -4.789 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.962 0.136 -5.312 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.184 1.409 -6.940 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.580 0.989 -7.508 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.170 -1.445 -6.856 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.824 -0.886 -6.709 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.277 3.002 -4.405 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.943 4.344 -3.942 1.00 0.00 C ATOM 1395 C ARG A 208 -4.274 4.277 -2.579 1.00 0.00 C ATOM 1396 O ARG A 208 -3.245 4.919 -2.367 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.179 5.244 -3.831 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.756 5.729 -5.157 1.00 0.00 C ATOM 1399 CD ARG A 208 -7.700 4.740 -5.831 1.00 0.00 C ATOM 1400 NE ARG A 208 -8.272 5.364 -7.032 1.00 0.00 N ATOM 1401 CZ ARG A 208 -9.378 5.040 -7.708 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -10.114 3.992 -7.373 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -9.746 5.810 -8.723 1.00 0.00 N ATOM 0 H ARG A 208 -6.233 2.718 -4.190 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.267 4.772 -4.682 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.956 4.701 -3.293 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.921 6.114 -3.227 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.290 6.664 -4.987 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.934 5.950 -5.838 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.163 3.830 -6.099 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.494 4.450 -5.143 1.00 0.00 H new ATOM 0 HE ARG A 208 -7.750 6.158 -7.403 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -9.841 3.409 -6.582 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -10.954 3.767 -7.906 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -9.189 6.627 -8.971 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -10.586 5.585 -9.255 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.869 3.548 -1.632 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.427 3.580 -0.242 1.00 0.00 C ATOM 1419 C VAL A 209 -2.959 3.146 -0.135 1.00 0.00 C ATOM 1420 O VAL A 209 -2.156 3.813 0.519 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.413 2.785 0.645 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.053 1.316 0.895 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.573 3.454 2.009 1.00 0.00 C ATOM 0 H VAL A 209 -5.660 2.928 -1.806 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.447 4.599 0.143 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.336 2.792 0.065 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.813 0.858 1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.006 0.786 -0.056 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.084 1.258 1.391 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.271 2.878 2.617 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.605 3.496 2.509 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.957 4.465 1.875 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.586 2.059 -0.817 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.226 1.554 -0.795 1.00 0.00 C ATOM 1435 C VAL A 210 -0.315 2.459 -1.623 1.00 0.00 C ATOM 1436 O VAL A 210 0.863 2.533 -1.294 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.193 0.088 -1.263 1.00 0.00 C ATOM 1438 CG1 VAL A 210 0.224 -0.455 -1.488 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -1.897 -0.835 -0.258 1.00 0.00 C ATOM 0 H VAL A 210 -3.223 1.511 -1.396 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.847 1.568 0.227 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.716 0.091 -2.219 1.00 0.00 H new ATOM 0 HG11 VAL A 210 0.168 -1.493 -1.816 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.725 0.141 -2.251 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.787 -0.399 -0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -1.856 -1.863 -0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.398 -0.769 0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -2.938 -0.529 -0.150 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.812 3.182 -2.634 1.00 0.00 N ATOM 1450 CA GLU A 211 0.003 4.103 -3.401 1.00 0.00 C ATOM 1451 C GLU A 211 0.482 5.168 -2.430 1.00 0.00 C ATOM 1452 O GLU A 211 1.676 5.283 -2.215 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.777 4.689 -4.590 1.00 0.00 C ATOM 1454 CG GLU A 211 0.056 5.751 -5.306 1.00 0.00 C ATOM 1455 CD GLU A 211 -0.742 6.491 -6.375 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.054 5.888 -7.421 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -1.020 7.701 -6.184 1.00 0.00 O ATOM 0 H GLU A 211 -1.786 3.138 -2.934 1.00 0.00 H new ATOM 0 HA GLU A 211 0.858 3.597 -3.849 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.040 3.894 -5.287 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.711 5.127 -4.239 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.432 6.468 -4.576 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.924 5.279 -5.766 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.433 5.894 -1.792 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.138 6.926 -0.805 1.00 0.00 C ATOM 1466 C GLN A 212 0.847 6.441 0.260 1.00 0.00 C ATOM 1467 O GLN A 212 1.804 7.130 0.603 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.461 7.304 -0.141 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.416 8.025 -1.095 1.00 0.00 C ATOM 1470 CD GLN A 212 -2.034 9.487 -1.257 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -1.811 10.198 -0.286 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.918 9.964 -2.476 1.00 0.00 N ATOM 0 H GLN A 212 -1.433 5.775 -1.954 1.00 0.00 H new ATOM 0 HA GLN A 212 0.327 7.777 -1.302 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.944 6.403 0.237 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.262 7.943 0.719 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.402 7.533 -2.068 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.435 7.953 -0.716 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -2.106 9.363 -3.279 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.640 10.935 -2.619 1.00 0.00 H new ATOM 1481 N MET A 213 0.616 5.240 0.783 1.00 0.00 N ATOM 1482 CA MET A 213 1.488 4.635 1.774 1.00 0.00 C ATOM 1483 C MET A 213 2.885 4.408 1.189 1.00 0.00 C ATOM 1484 O MET A 213 3.874 4.815 1.794 1.00 0.00 O ATOM 1485 CB MET A 213 0.825 3.345 2.273 1.00 0.00 C ATOM 1486 CG MET A 213 -0.207 3.662 3.368 1.00 0.00 C ATOM 1487 SD MET A 213 -1.622 2.530 3.564 1.00 0.00 S ATOM 1488 CE MET A 213 -0.858 0.906 3.337 1.00 0.00 C ATOM 0 H MET A 213 -0.184 4.661 0.528 1.00 0.00 H new ATOM 0 HA MET A 213 1.627 5.297 2.629 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.338 2.834 1.442 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.583 2.667 2.664 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.320 3.706 4.321 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.602 4.660 3.176 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.607 0.128 3.486 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.453 0.832 2.328 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.053 0.778 4.061 1.00 0.00 H new ATOM 1498 N CYS A 214 2.990 3.778 0.020 1.00 0.00 N ATOM 1499 CA CYS A 214 4.264 3.420 -0.584 1.00 0.00 C ATOM 1500 C CYS A 214 4.970 4.605 -1.248 1.00 0.00 C ATOM 1501 O CYS A 214 6.184 4.554 -1.400 1.00 0.00 O ATOM 1502 CB CYS A 214 4.079 2.250 -1.549 1.00 0.00 C ATOM 1503 SG CYS A 214 5.378 1.010 -1.385 1.00 0.00 S ATOM 0 H CYS A 214 2.182 3.501 -0.537 1.00 0.00 H new ATOM 0 HA CYS A 214 4.928 3.105 0.221 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.111 1.784 -1.368 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.066 2.625 -2.572 1.00 0.00 H new ATOM 1508 N VAL A 215 4.264 5.694 -1.562 1.00 0.00 N ATOM 1509 CA VAL A 215 4.831 6.996 -1.883 1.00 0.00 C ATOM 1510 C VAL A 215 5.675 7.411 -0.686 1.00 0.00 C ATOM 1511 O VAL A 215 6.862 7.684 -0.850 1.00 0.00 O ATOM 1512 CB VAL A 215 3.710 8.013 -2.201 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.189 9.473 -2.236 1.00 0.00 C ATOM 1514 CG2 VAL A 215 2.988 7.713 -3.523 1.00 0.00 C ATOM 0 H VAL A 215 3.245 5.688 -1.600 1.00 0.00 H new ATOM 0 HA VAL A 215 5.455 6.956 -2.776 1.00 0.00 H new ATOM 0 HB VAL A 215 3.015 7.894 -1.370 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.347 10.127 -2.465 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.605 9.743 -1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.955 9.586 -3.003 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.213 8.460 -3.692 1.00 0.00 H new ATOM 0 HG22 VAL A 215 3.705 7.742 -4.344 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.534 6.723 -3.473 1.00 0.00 H new ATOM 1524 N THR A 216 5.101 7.432 0.519 1.00 0.00 N ATOM 1525 CA THR A 216 5.882 7.780 1.691 1.00 0.00 C ATOM 1526 C THR A 216 6.972 6.743 1.940 1.00 0.00 C ATOM 1527 O THR A 216 8.090 7.145 2.231 1.00 0.00 O ATOM 1528 CB THR A 216 4.958 7.928 2.909 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.907 8.833 2.641 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.720 8.406 4.145 1.00 0.00 C ATOM 0 H THR A 216 4.121 7.216 0.700 1.00 0.00 H new ATOM 0 HA THR A 216 6.376 8.736 1.519 1.00 0.00 H new ATOM 0 HB THR A 216 4.547 6.939 3.110 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.331 8.909 3.431 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.031 8.498 4.984 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.500 7.686 4.393 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.174 9.376 3.940 1.00 0.00 H new ATOM 1538 N GLN A 217 6.693 5.438 1.843 1.00 0.00 N ATOM 1539 CA GLN A 217 7.702 4.419 2.119 1.00 0.00 C ATOM 1540 C GLN A 217 8.902 4.584 1.181 1.00 0.00 C ATOM 1541 O GLN A 217 10.029 4.592 1.664 1.00 0.00 O ATOM 1542 CB GLN A 217 7.084 3.006 2.090 1.00 0.00 C ATOM 1543 CG GLN A 217 7.557 2.155 3.277 1.00 0.00 C ATOM 1544 CD GLN A 217 9.023 1.761 3.134 1.00 0.00 C ATOM 1545 OE1 GLN A 217 9.478 1.471 2.037 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.777 1.750 4.221 1.00 0.00 N ATOM 0 H GLN A 217 5.781 5.068 1.577 1.00 0.00 H new ATOM 0 HA GLN A 217 8.083 4.555 3.131 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.997 3.084 2.108 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.352 2.510 1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.418 2.712 4.204 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.943 1.257 3.350 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.373 1.996 5.125 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.763 1.495 4.155 1.00 0.00 H new ATOM 1555 N TYR A 218 8.667 4.837 -0.109 1.00 0.00 N ATOM 1556 CA TYR A 218 9.698 5.213 -1.065 1.00 0.00 C ATOM 1557 C TYR A 218 10.497 6.404 -0.544 1.00 0.00 C ATOM 1558 O TYR A 218 11.711 6.293 -0.407 1.00 0.00 O ATOM 1559 CB TYR A 218 9.070 5.521 -2.431 1.00 0.00 C ATOM 1560 CG TYR A 218 10.037 6.070 -3.462 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.187 5.339 -3.816 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.800 7.332 -4.042 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.093 5.857 -4.758 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.692 7.846 -4.997 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.834 7.105 -5.370 1.00 0.00 C ATOM 1566 OH TYR A 218 12.633 7.578 -6.364 1.00 0.00 O ATOM 0 H TYR A 218 7.735 4.784 -0.521 1.00 0.00 H new ATOM 0 HA TYR A 218 10.385 4.376 -1.190 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.621 4.609 -2.823 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.262 6.239 -2.291 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.374 4.377 -3.362 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.931 7.905 -3.752 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.984 5.303 -5.013 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.504 8.810 -5.447 1.00 0.00 H new ATOM 0 HH TYR A 218 12.300 8.450 -6.664 1.00 0.00 H new ATOM 1576 N GLN A 219 9.842 7.529 -0.231 1.00 0.00 N ATOM 1577 CA GLN A 219 10.550 8.712 0.241 1.00 0.00 C ATOM 1578 C GLN A 219 11.364 8.436 1.505 1.00 0.00 C ATOM 1579 O GLN A 219 12.516 8.860 1.569 1.00 0.00 O ATOM 1580 CB GLN A 219 9.585 9.880 0.459 1.00 0.00 C ATOM 1581 CG GLN A 219 8.938 10.310 -0.861 1.00 0.00 C ATOM 1582 CD GLN A 219 8.322 11.690 -0.756 1.00 0.00 C ATOM 1583 OE1 GLN A 219 9.025 12.695 -0.662 1.00 0.00 O ATOM 1584 NE2 GLN A 219 7.008 11.767 -0.755 1.00 0.00 N ATOM 0 H GLN A 219 8.830 7.639 -0.297 1.00 0.00 H new ATOM 0 HA GLN A 219 11.257 8.990 -0.541 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.811 9.590 1.170 1.00 0.00 H new ATOM 0 HB3 GLN A 219 10.121 10.722 0.897 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.687 10.304 -1.653 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.171 9.589 -1.143 1.00 0.00 H new ATOM 0 HE21 GLN A 219 6.447 10.919 -0.834 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.550 12.675 -0.675 1.00 0.00 H new ATOM 1593 N LYS A 220 10.804 7.723 2.488 1.00 0.00 N ATOM 1594 CA LYS A 220 11.489 7.314 3.703 1.00 0.00 C ATOM 1595 C LYS A 220 12.746 6.535 3.345 1.00 0.00 C ATOM 1596 O LYS A 220 13.829 6.933 3.756 1.00 0.00 O ATOM 1597 CB LYS A 220 10.568 6.481 4.607 1.00 0.00 C ATOM 1598 CG LYS A 220 9.468 7.316 5.294 1.00 0.00 C ATOM 1599 CD LYS A 220 8.753 6.586 6.444 1.00 0.00 C ATOM 1600 CE LYS A 220 8.520 5.095 6.201 1.00 0.00 C ATOM 1601 NZ LYS A 220 7.999 4.440 7.418 1.00 0.00 N ATOM 0 H LYS A 220 9.834 7.409 2.452 1.00 0.00 H new ATOM 0 HA LYS A 220 11.772 8.207 4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.100 5.696 4.013 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.170 5.987 5.370 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.911 8.234 5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.729 7.608 4.548 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.341 6.705 7.354 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.791 7.067 6.620 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.815 4.962 5.381 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.454 4.621 5.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 7.848 3.428 7.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.685 4.550 8.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.097 4.880 7.690 1.00 0.00 H new ATOM 1615 N GLU A 221 12.622 5.450 2.585 1.00 0.00 N ATOM 1616 CA GLU A 221 13.748 4.593 2.249 1.00 0.00 C ATOM 1617 C GLU A 221 14.813 5.348 1.456 1.00 0.00 C ATOM 1618 O GLU A 221 15.998 5.169 1.734 1.00 0.00 O ATOM 1619 CB GLU A 221 13.255 3.370 1.468 1.00 0.00 C ATOM 1620 CG GLU A 221 12.466 2.386 2.344 1.00 0.00 C ATOM 1621 CD GLU A 221 13.269 1.727 3.471 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.499 1.569 3.311 1.00 0.00 O ATOM 1623 OE2 GLU A 221 12.644 1.287 4.474 1.00 0.00 O ATOM 0 H GLU A 221 11.735 5.143 2.186 1.00 0.00 H new ATOM 0 HA GLU A 221 14.212 4.261 3.178 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.625 3.701 0.643 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.110 2.855 1.030 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.619 2.914 2.783 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.057 1.603 1.705 1.00 0.00 H new ATOM 1630 N SER A 222 14.409 6.185 0.499 1.00 0.00 N ATOM 1631 CA SER A 222 15.303 7.035 -0.267 1.00 0.00 C ATOM 1632 C SER A 222 16.044 8.006 0.639 1.00 0.00 C ATOM 1633 O SER A 222 17.263 8.083 0.537 1.00 0.00 O ATOM 1634 CB SER A 222 14.522 7.820 -1.317 1.00 0.00 C ATOM 1635 OG SER A 222 14.325 7.040 -2.476 1.00 0.00 O ATOM 0 H SER A 222 13.429 6.288 0.234 1.00 0.00 H new ATOM 0 HA SER A 222 16.030 6.391 -0.761 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.558 8.124 -0.909 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.062 8.732 -1.573 1.00 0.00 H new ATOM 0 HG SER A 222 13.369 7.009 -2.691 1.00 0.00 H new ATOM 1641 N GLN A 223 15.357 8.753 1.509 1.00 0.00 N ATOM 1642 CA GLN A 223 15.982 9.681 2.428 1.00 0.00 C ATOM 1643 C GLN A 223 16.926 8.895 3.340 1.00 0.00 C ATOM 1644 O GLN A 223 18.078 9.261 3.489 1.00 0.00 O ATOM 1645 CB GLN A 223 14.891 10.491 3.149 1.00 0.00 C ATOM 1646 CG GLN A 223 15.265 10.951 4.563 1.00 0.00 C ATOM 1647 CD GLN A 223 14.925 9.930 5.660 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.745 9.330 5.625 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 15.723 9.690 6.558 1.00 0.00 N flip ATOM 0 H GLN A 223 14.341 8.722 1.588 1.00 0.00 H new ATOM 0 HA GLN A 223 16.600 10.422 1.921 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.651 11.368 2.548 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.986 9.886 3.206 1.00 0.00 H new ATOM 0 HG2 GLN A 223 16.334 11.162 4.595 1.00 0.00 H new ATOM 0 HG3 GLN A 223 14.749 11.887 4.779 1.00 0.00 H new ATOM 0 HE21 GLN A 223 16.629 10.159 6.574 1.00 0.00 H new ATOM 0 HE22 GLN A 223 15.482 9.022 7.290 1.00 0.00 H new ATOM 1658 N ALA A 224 16.488 7.790 3.924 1.00 0.00 N ATOM 1659 CA ALA A 224 17.290 7.006 4.838 1.00 0.00 C ATOM 1660 C ALA A 224 18.506 6.362 4.159 1.00 0.00 C ATOM 1661 O ALA A 224 19.491 6.073 4.833 1.00 0.00 O ATOM 1662 CB ALA A 224 16.371 5.972 5.466 1.00 0.00 C ATOM 0 H ALA A 224 15.553 7.412 3.772 1.00 0.00 H new ATOM 0 HA ALA A 224 17.715 7.654 5.605 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.939 5.357 6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.565 6.477 5.999 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.949 5.339 4.686 1.00 0.00 H new ATOM 1668 N ALA A 225 18.485 6.179 2.838 1.00 0.00 N ATOM 1669 CA ALA A 225 19.648 5.803 2.056 1.00 0.00 C ATOM 1670 C ALA A 225 20.524 7.038 1.826 1.00 0.00 C ATOM 1671 O ALA A 225 21.636 7.100 2.336 1.00 0.00 O ATOM 1672 CB ALA A 225 19.202 5.130 0.750 1.00 0.00 C ATOM 0 H ALA A 225 17.640 6.292 2.278 1.00 0.00 H new ATOM 0 HA ALA A 225 20.253 5.073 2.594 1.00 0.00 H new ATOM 0 HB1 ALA A 225 20.079 4.850 0.167 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.620 4.238 0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.590 5.824 0.174 1.00 0.00 H new ATOM 1678 N ALA A 226 20.008 8.033 1.100 1.00 0.00 N ATOM 1679 CA ALA A 226 20.723 9.213 0.630 1.00 0.00 C ATOM 1680 C ALA A 226 21.294 10.068 1.759 1.00 0.00 C ATOM 1681 O ALA A 226 22.389 10.619 1.632 1.00 0.00 O ATOM 1682 CB ALA A 226 19.782 10.057 -0.236 1.00 0.00 C ATOM 0 H ALA A 226 19.030 8.033 0.812 1.00 0.00 H new ATOM 0 HA ALA A 226 21.576 8.861 0.050 1.00 0.00 H new ATOM 0 HB1 ALA A 226 20.310 10.942 -0.591 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.446 9.468 -1.089 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.919 10.363 0.356 1.00 0.00 H new ATOM 1688 N ASP A 227 20.533 10.218 2.837 1.00 0.00 N ATOM 1689 CA ASP A 227 20.868 10.958 4.044 1.00 0.00 C ATOM 1690 C ASP A 227 21.542 10.053 5.074 1.00 0.00 C ATOM 1691 O ASP A 227 22.103 10.523 6.067 1.00 0.00 O ATOM 1692 CB ASP A 227 19.581 11.549 4.624 1.00 0.00 C ATOM 1693 CG ASP A 227 19.809 12.744 5.552 1.00 0.00 C ATOM 1694 OD1 ASP A 227 20.819 13.474 5.420 1.00 0.00 O ATOM 1695 OD2 ASP A 227 18.846 13.069 6.280 1.00 0.00 O ATOM 0 H ASP A 227 19.605 9.798 2.893 1.00 0.00 H new ATOM 0 HA ASP A 227 21.570 11.754 3.795 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.933 11.857 3.804 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.051 10.771 5.174 1.00 0.00 H new ATOM 1700 N GLY A 228 21.512 8.743 4.822 1.00 0.00 N ATOM 1701 CA GLY A 228 22.244 7.734 5.557 1.00 0.00 C ATOM 1702 C GLY A 228 21.474 7.219 6.770 1.00 0.00 C ATOM 1703 O GLY A 228 21.980 6.334 7.460 1.00 0.00 O ATOM 0 H GLY A 228 20.951 8.350 4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.471 6.899 4.894 1.00 0.00 H new ATOM 0 HA3 GLY A 228 23.197 8.148 5.885 1.00 0.00 H new ATOM 1707 N ARG A 229 20.281 7.749 7.050 1.00 0.00 N ATOM 1708 CA ARG A 229 19.533 7.572 8.293 1.00 0.00 C ATOM 1709 C ARG A 229 18.688 6.293 8.258 1.00 0.00 C ATOM 1710 O ARG A 229 17.481 6.351 8.491 1.00 0.00 O ATOM 1711 CB ARG A 229 18.649 8.816 8.496 1.00 0.00 C ATOM 1712 CG ARG A 229 19.384 10.171 8.482 1.00 0.00 C ATOM 1713 CD ARG A 229 19.314 10.929 9.812 1.00 0.00 C ATOM 1714 NE ARG A 229 20.519 10.739 10.636 1.00 0.00 N ATOM 1715 CZ ARG A 229 20.551 10.798 11.971 1.00 0.00 C ATOM 1716 NH1 ARG A 229 19.454 10.577 12.684 1.00 0.00 N ATOM 1717 NH2 ARG A 229 21.667 11.107 12.614 1.00 0.00 N ATOM 0 H ARG A 229 19.788 8.342 6.382 1.00 0.00 H new ATOM 0 HA ARG A 229 20.224 7.465 9.129 1.00 0.00 H new ATOM 0 HB2 ARG A 229 17.888 8.829 7.716 1.00 0.00 H new ATOM 0 HB3 ARG A 229 18.128 8.717 9.448 1.00 0.00 H new ATOM 0 HG2 ARG A 229 20.430 10.003 8.225 1.00 0.00 H new ATOM 0 HG3 ARG A 229 18.959 10.796 7.696 1.00 0.00 H new ATOM 0 HD2 ARG A 229 19.178 11.992 9.613 1.00 0.00 H new ATOM 0 HD3 ARG A 229 18.440 10.595 10.371 1.00 0.00 H new ATOM 0 HE ARG A 229 21.396 10.548 10.151 1.00 0.00 H new ATOM 0 HH11 ARG A 229 18.575 10.360 12.214 1.00 0.00 H new ATOM 0 HH12 ARG A 229 19.489 10.624 13.702 1.00 0.00 H new ATOM 0 HH21 ARG A 229 22.520 11.304 12.090 1.00 0.00 H new ATOM 0 HH22 ARG A 229 21.674 11.148 13.633 1.00 0.00 H new