USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 717 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 192 THR OG1 : rot -15:sc= 1.43 USER MOD Set 1.2: A 197 ASN : amide:sc= -0.585 X(o=0.85,f=0.36) USER MOD Set 2.1: A 179 CYS SG : rot 2:sc= -0.563 USER MOD Set 2.2: A 214 CYS SG : rot -128:sc= 0.0568 USER MOD Set 3.1: A 150 TYR OH : rot 180:sc= -0.152 USER MOD Set 3.2: A 154 MET CE :methyl 175:sc= -0.0216 (180deg=-0.0993) USER MOD Set 4.1: A 129 MET CE :methyl -160:sc= -0.0285 (180deg=-0.462) USER MOD Set 4.2: A 163 TYR OH : rot 171:sc= 1.1 USER MOD Single : A 128 TYR OH : rot 177:sc= 1.14 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -177:sc= 0 (180deg=-0.0188) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl 180:sc= -0.595 (180deg=-0.595) USER MOD Single : A 140 HIS :FLIP no HD1:sc= -0.232 F(o=-0.89,f=-0.23) USER MOD Single : A 143 ASN : amide:sc= 0.763 K(o=0.76,f=-0.25) USER MOD Single : A 149 TYR OH : rot 46:sc= 1.24 USER MOD Single : A 153 ASN : amide:sc= 0.432 X(o=0.43,f=-0.014) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 17:sc= 0.108 USER MOD Single : A 159 ASN : amide:sc= -0.131 K(o=-0.13,f=-3.8!) USER MOD Single : A 160 GLN : amide:sc= 0.436 X(o=0.44,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 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=-0.047) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 177 HIS : no HD1:sc= -0.177 X(o=-0.18,f=0.0046) USER MOD Single : A 181 ASN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 183 THR OG1 : rot 82:sc= 1.87 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.382 K(o=-0.38,f=-1.6) USER MOD Single : A 187 HIS : no HD1:sc= -0.311 X(o=-0.31,f=-0.25) USER MOD Single : A 188 THR OG1 : rot 96:sc= 1.26 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 120:sc= 1.13 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 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -166:sc= 1.27 (180deg=0.753) USER MOD Single : A 205 MET CE :methyl 148:sc= -0.144 (180deg=-1.18) USER MOD Single : A 206 MET CE :methyl 170:sc= -2.42! (180deg=-2.49) USER MOD Single : A 212 GLN : amide:sc= -0.0298 X(o=-0.03,f=-0.49) USER MOD Single : A 213 MET CE :methyl -153:sc= 0 (180deg=-0.0188) USER MOD Single : A 216 THR OG1 : rot 82:sc= 0.945 USER MOD Single : A 217 GLN : amide:sc= -0.0767 K(o=-0.077,f=-3.2!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.0176 X(o=-0.018,f=-0.00079) USER MOD Single : A 220 LYS NZ :NH3+ -132:sc= 0.318 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 80 N TYR A 128 16.106 -4.848 7.943 1.00 0.00 N ATOM 81 CA TYR A 128 15.535 -3.702 7.259 1.00 0.00 C ATOM 82 C TYR A 128 15.050 -2.735 8.337 1.00 0.00 C ATOM 83 O TYR A 128 14.509 -3.179 9.352 1.00 0.00 O ATOM 84 CB TYR A 128 14.409 -4.245 6.366 1.00 0.00 C ATOM 85 CG TYR A 128 14.910 -4.685 5.008 1.00 0.00 C ATOM 86 CD1 TYR A 128 15.466 -5.965 4.841 1.00 0.00 C ATOM 87 CD2 TYR A 128 14.843 -3.805 3.913 1.00 0.00 C ATOM 88 CE1 TYR A 128 15.920 -6.374 3.574 1.00 0.00 C ATOM 89 CE2 TYR A 128 15.322 -4.191 2.649 1.00 0.00 C ATOM 90 CZ TYR A 128 15.861 -5.487 2.469 1.00 0.00 C ATOM 91 OH TYR A 128 16.318 -5.875 1.240 1.00 0.00 O ATOM 0 HA TYR A 128 16.235 -3.159 6.624 1.00 0.00 H new ATOM 0 HB2 TYR A 128 13.929 -5.088 6.864 1.00 0.00 H new ATOM 0 HB3 TYR A 128 13.648 -3.475 6.237 1.00 0.00 H new ATOM 0 HD1 TYR A 128 15.545 -6.634 5.685 1.00 0.00 H new ATOM 0 HD2 TYR A 128 14.418 -2.821 4.045 1.00 0.00 H new ATOM 0 HE1 TYR A 128 16.316 -7.370 3.442 1.00 0.00 H new ATOM 0 HE2 TYR A 128 15.279 -3.501 1.819 1.00 0.00 H new ATOM 0 HH TYR A 128 16.155 -5.160 0.590 1.00 0.00 H new ATOM 101 N MET A 129 15.236 -1.428 8.178 1.00 0.00 N ATOM 102 CA MET A 129 14.497 -0.470 8.999 1.00 0.00 C ATOM 103 C MET A 129 13.043 -0.519 8.530 1.00 0.00 C ATOM 104 O MET A 129 12.801 -0.892 7.387 1.00 0.00 O ATOM 105 CB MET A 129 15.073 0.949 8.876 1.00 0.00 C ATOM 106 CG MET A 129 16.574 0.970 9.196 1.00 0.00 C ATOM 107 SD MET A 129 17.224 2.545 9.821 1.00 0.00 S ATOM 108 CE MET A 129 16.836 3.629 8.425 1.00 0.00 C ATOM 0 H MET A 129 15.878 -1.012 7.503 1.00 0.00 H new ATOM 0 HA MET A 129 14.576 -0.733 10.054 1.00 0.00 H new ATOM 0 HB2 MET A 129 14.909 1.324 7.866 1.00 0.00 H new ATOM 0 HB3 MET A 129 14.545 1.619 9.555 1.00 0.00 H new ATOM 0 HG2 MET A 129 16.780 0.195 9.934 1.00 0.00 H new ATOM 0 HG3 MET A 129 17.123 0.704 8.293 1.00 0.00 H new ATOM 0 HE1 MET A 129 17.459 4.522 8.473 1.00 0.00 H new ATOM 0 HE2 MET A 129 17.029 3.102 7.491 1.00 0.00 H new ATOM 0 HE3 MET A 129 15.786 3.917 8.469 1.00 0.00 H new ATOM 118 N LEU A 130 12.079 -0.151 9.379 1.00 0.00 N ATOM 119 CA LEU A 130 10.651 -0.038 9.034 1.00 0.00 C ATOM 120 C LEU A 130 10.200 1.432 9.089 1.00 0.00 C ATOM 121 O LEU A 130 9.013 1.738 9.136 1.00 0.00 O ATOM 122 CB LEU A 130 9.820 -1.014 9.898 1.00 0.00 C ATOM 123 CG LEU A 130 8.280 -0.950 9.798 1.00 0.00 C ATOM 124 CD1 LEU A 130 7.766 -1.028 8.356 1.00 0.00 C ATOM 125 CD2 LEU A 130 7.652 -2.056 10.647 1.00 0.00 C ATOM 0 H LEU A 130 12.271 0.084 10.353 1.00 0.00 H new ATOM 0 HA LEU A 130 10.479 -0.346 8.003 1.00 0.00 H new ATOM 0 HB2 LEU A 130 10.128 -2.028 9.644 1.00 0.00 H new ATOM 0 HB3 LEU A 130 10.093 -0.850 10.941 1.00 0.00 H new ATOM 0 HG LEU A 130 7.980 0.025 10.182 1.00 0.00 H new ATOM 0 HD11 LEU A 130 6.677 -0.978 8.355 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.168 -0.194 7.781 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.086 -1.968 7.906 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.566 -2.002 10.570 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.993 -3.027 10.289 1.00 0.00 H new ATOM 0 HD23 LEU A 130 7.948 -1.928 11.688 1.00 0.00 H new ATOM 137 N GLY A 131 11.138 2.375 9.095 1.00 0.00 N ATOM 138 CA GLY A 131 10.807 3.789 9.098 1.00 0.00 C ATOM 139 C GLY A 131 9.939 4.149 10.291 1.00 0.00 C ATOM 140 O GLY A 131 10.100 3.600 11.386 1.00 0.00 O ATOM 0 H GLY A 131 12.139 2.179 9.098 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.723 4.379 9.121 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.286 4.045 8.176 1.00 0.00 H new ATOM 144 N SER A 132 9.005 5.061 10.068 1.00 0.00 N ATOM 145 CA SER A 132 8.002 5.516 11.014 1.00 0.00 C ATOM 146 C SER A 132 6.724 5.755 10.214 1.00 0.00 C ATOM 147 O SER A 132 6.785 5.902 8.987 1.00 0.00 O ATOM 148 CB SER A 132 8.465 6.825 11.657 1.00 0.00 C ATOM 149 OG SER A 132 9.772 6.735 12.201 1.00 0.00 O ATOM 0 H SER A 132 8.924 5.531 9.166 1.00 0.00 H new ATOM 0 HA SER A 132 7.838 4.784 11.805 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.440 7.620 10.912 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.766 7.105 12.445 1.00 0.00 H new ATOM 0 HG SER A 132 10.021 7.596 12.598 1.00 0.00 H new ATOM 155 N ALA A 133 5.575 5.835 10.888 1.00 0.00 N ATOM 156 CA ALA A 133 4.331 6.170 10.210 1.00 0.00 C ATOM 157 C ALA A 133 4.453 7.544 9.549 1.00 0.00 C ATOM 158 O ALA A 133 5.198 8.402 10.037 1.00 0.00 O ATOM 159 CB ALA A 133 3.158 6.163 11.192 1.00 0.00 C ATOM 0 H ALA A 133 5.484 5.674 11.891 1.00 0.00 H new ATOM 0 HA ALA A 133 4.141 5.418 9.444 1.00 0.00 H new ATOM 0 HB1 ALA A 133 2.239 6.416 10.663 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.060 5.172 11.635 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.338 6.896 11.978 1.00 0.00 H new ATOM 165 N MET A 134 3.685 7.750 8.484 1.00 0.00 N ATOM 166 CA MET A 134 3.429 9.028 7.847 1.00 0.00 C ATOM 167 C MET A 134 1.956 9.071 7.440 1.00 0.00 C ATOM 168 O MET A 134 1.261 8.044 7.443 1.00 0.00 O ATOM 169 CB MET A 134 4.333 9.221 6.624 1.00 0.00 C ATOM 170 CG MET A 134 5.803 9.376 7.025 1.00 0.00 C ATOM 171 SD MET A 134 6.900 9.960 5.707 1.00 0.00 S ATOM 172 CE MET A 134 6.874 8.489 4.655 1.00 0.00 C ATOM 0 H MET A 134 3.199 6.983 8.019 1.00 0.00 H new ATOM 0 HA MET A 134 3.649 9.838 8.543 1.00 0.00 H new ATOM 0 HB2 MET A 134 4.226 8.368 5.954 1.00 0.00 H new ATOM 0 HB3 MET A 134 4.012 10.103 6.070 1.00 0.00 H new ATOM 0 HG2 MET A 134 5.864 10.071 7.862 1.00 0.00 H new ATOM 0 HG3 MET A 134 6.170 8.414 7.382 1.00 0.00 H new ATOM 0 HE1 MET A 134 7.542 8.637 3.807 1.00 0.00 H new ATOM 0 HE2 MET A 134 7.204 7.624 5.231 1.00 0.00 H new ATOM 0 HE3 MET A 134 5.860 8.319 4.293 1.00 0.00 H new ATOM 182 N SER A 135 1.488 10.261 7.071 1.00 0.00 N ATOM 183 CA SER A 135 0.145 10.482 6.565 1.00 0.00 C ATOM 184 C SER A 135 0.101 10.161 5.068 1.00 0.00 C ATOM 185 O SER A 135 1.131 10.124 4.384 1.00 0.00 O ATOM 186 CB SER A 135 -0.237 11.945 6.840 1.00 0.00 C ATOM 187 OG SER A 135 -1.583 12.240 6.500 1.00 0.00 O ATOM 0 H SER A 135 2.047 11.113 7.118 1.00 0.00 H new ATOM 0 HA SER A 135 -0.572 9.829 7.063 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.078 12.164 7.896 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.427 12.600 6.276 1.00 0.00 H new ATOM 0 HG SER A 135 -1.771 13.181 6.697 1.00 0.00 H new ATOM 193 N ARG A 136 -1.123 10.011 4.563 1.00 0.00 N ATOM 194 CA ARG A 136 -1.507 9.809 3.176 1.00 0.00 C ATOM 195 C ARG A 136 -0.697 10.699 2.224 1.00 0.00 C ATOM 196 O ARG A 136 -0.787 11.926 2.349 1.00 0.00 O ATOM 197 CB ARG A 136 -3.034 9.991 3.049 1.00 0.00 C ATOM 198 CG ARG A 136 -3.692 11.263 3.640 1.00 0.00 C ATOM 199 CD ARG A 136 -4.864 10.919 4.581 1.00 0.00 C ATOM 200 NE ARG A 136 -5.685 12.094 4.933 1.00 0.00 N ATOM 201 CZ ARG A 136 -6.716 12.105 5.793 1.00 0.00 C ATOM 202 NH1 ARG A 136 -7.043 11.023 6.484 1.00 0.00 N ATOM 203 NH2 ARG A 136 -7.437 13.209 5.957 1.00 0.00 N ATOM 0 H ARG A 136 -1.940 10.030 5.173 1.00 0.00 H new ATOM 0 HA ARG A 136 -1.267 8.791 2.870 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.282 9.955 1.988 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.508 9.128 3.517 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -2.944 11.838 4.186 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -4.051 11.896 2.829 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.497 10.170 4.105 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.471 10.471 5.493 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.448 12.978 4.482 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.508 10.162 6.367 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.830 11.051 7.133 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.208 14.051 5.429 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.220 13.214 6.611 1.00 0.00 H new ATOM 217 N PRO A 137 0.125 10.147 1.306 1.00 0.00 N ATOM 218 CA PRO A 137 0.758 10.922 0.242 1.00 0.00 C ATOM 219 C PRO A 137 -0.280 11.498 -0.730 1.00 0.00 C ATOM 220 O PRO A 137 -1.486 11.534 -0.464 1.00 0.00 O ATOM 221 CB PRO A 137 1.795 10.007 -0.429 1.00 0.00 C ATOM 222 CG PRO A 137 1.422 8.601 0.001 1.00 0.00 C ATOM 223 CD PRO A 137 0.558 8.758 1.253 1.00 0.00 C ATOM 0 HA PRO A 137 1.267 11.799 0.641 1.00 0.00 H new ATOM 0 HB2 PRO A 137 1.766 10.108 -1.514 1.00 0.00 H new ATOM 0 HB3 PRO A 137 2.807 10.260 -0.113 1.00 0.00 H new ATOM 0 HG2 PRO A 137 0.876 8.084 -0.788 1.00 0.00 H new ATOM 0 HG3 PRO A 137 2.312 8.009 0.213 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -0.301 8.088 1.214 1.00 0.00 H new ATOM 0 HD3 PRO A 137 1.125 8.497 2.147 1.00 0.00 H new ATOM 231 N MET A 138 0.196 12.009 -1.862 1.00 0.00 N ATOM 232 CA MET A 138 -0.606 12.537 -2.947 1.00 0.00 C ATOM 233 C MET A 138 -0.260 11.695 -4.168 1.00 0.00 C ATOM 234 O MET A 138 0.923 11.564 -4.492 1.00 0.00 O ATOM 235 CB MET A 138 -0.341 14.037 -3.135 1.00 0.00 C ATOM 236 CG MET A 138 -0.739 14.844 -1.886 1.00 0.00 C ATOM 237 SD MET A 138 0.600 15.788 -1.101 1.00 0.00 S ATOM 238 CE MET A 138 1.695 14.476 -0.510 1.00 0.00 C ATOM 0 H MET A 138 1.197 12.066 -2.050 1.00 0.00 H new ATOM 0 HA MET A 138 -1.676 12.470 -2.750 1.00 0.00 H new ATOM 0 HB2 MET A 138 0.716 14.196 -3.350 1.00 0.00 H new ATOM 0 HB3 MET A 138 -0.900 14.401 -3.997 1.00 0.00 H new ATOM 0 HG2 MET A 138 -1.534 15.537 -2.161 1.00 0.00 H new ATOM 0 HG3 MET A 138 -1.155 14.157 -1.149 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.556 14.919 -0.009 1.00 0.00 H new ATOM 0 HE2 MET A 138 1.155 13.840 0.191 1.00 0.00 H new ATOM 0 HE3 MET A 138 2.035 13.878 -1.355 1.00 0.00 H new ATOM 248 N ILE A 139 -1.262 11.063 -4.780 1.00 0.00 N ATOM 249 CA ILE A 139 -1.108 10.241 -5.974 1.00 0.00 C ATOM 250 C ILE A 139 -1.958 10.885 -7.076 1.00 0.00 C ATOM 251 O ILE A 139 -2.964 11.552 -6.803 1.00 0.00 O ATOM 252 CB ILE A 139 -1.477 8.754 -5.710 1.00 0.00 C ATOM 253 CG1 ILE A 139 -0.841 8.115 -4.451 1.00 0.00 C ATOM 254 CG2 ILE A 139 -1.101 7.893 -6.930 1.00 0.00 C ATOM 255 CD1 ILE A 139 0.673 7.956 -4.483 1.00 0.00 C ATOM 0 H ILE A 139 -2.225 11.112 -4.449 1.00 0.00 H new ATOM 0 HA ILE A 139 -0.065 10.209 -6.288 1.00 0.00 H new ATOM 0 HB ILE A 139 -2.552 8.772 -5.530 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -1.106 8.722 -3.585 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -1.288 7.132 -4.300 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -1.363 6.853 -6.736 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -1.644 8.247 -7.806 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -0.029 7.969 -7.113 1.00 0.00 H new ATOM 0 HD11 ILE A 139 1.011 7.499 -3.553 1.00 0.00 H new ATOM 0 HD12 ILE A 139 0.954 7.320 -5.323 1.00 0.00 H new ATOM 0 HD13 ILE A 139 1.139 8.935 -4.597 1.00 0.00 H new ATOM 267 N HIS A 140 -1.533 10.672 -8.319 1.00 0.00 N ATOM 268 CA HIS A 140 -2.065 11.234 -9.545 1.00 0.00 C ATOM 269 C HIS A 140 -2.017 10.095 -10.560 1.00 0.00 C ATOM 270 O HIS A 140 -1.060 9.946 -11.325 1.00 0.00 O ATOM 271 CB HIS A 140 -1.270 12.489 -9.974 1.00 0.00 C ATOM 272 CG HIS A 140 0.237 12.352 -10.025 1.00 0.00 C ATOM 273 ND1 HIS A 140 1.062 11.900 -9.029 1.00 0.00 N flip ATOM 274 CD2 HIS A 140 1.032 12.633 -11.113 1.00 0.00 C flip ATOM 275 CE1 HIS A 140 2.345 11.776 -9.562 1.00 0.00 C flip ATOM 276 NE2 HIS A 140 2.285 12.255 -10.817 1.00 0.00 N flip ATOM 0 H HIS A 140 -0.745 10.052 -8.503 1.00 0.00 H new ATOM 0 HA HIS A 140 -3.088 11.595 -9.437 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -1.618 12.792 -10.962 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -1.515 13.299 -9.287 1.00 0.00 H new ATOM 0 HD2 HIS A 140 0.705 13.079 -12.041 1.00 0.00 H new ATOM 0 HE1 HIS A 140 3.215 11.374 -9.065 1.00 0.00 H new ATOM 0 HE2 HIS A 140 3.079 12.322 -11.454 1.00 0.00 H new ATOM 284 N PHE A 141 -3.012 9.212 -10.498 1.00 0.00 N ATOM 285 CA PHE A 141 -3.160 8.094 -11.421 1.00 0.00 C ATOM 286 C PHE A 141 -3.470 8.580 -12.839 1.00 0.00 C ATOM 287 O PHE A 141 -3.281 7.827 -13.793 1.00 0.00 O ATOM 288 CB PHE A 141 -4.288 7.171 -10.947 1.00 0.00 C ATOM 289 CG PHE A 141 -4.085 6.592 -9.561 1.00 0.00 C ATOM 290 CD1 PHE A 141 -4.532 7.284 -8.417 1.00 0.00 C ATOM 291 CD2 PHE A 141 -3.400 5.373 -9.411 1.00 0.00 C ATOM 292 CE1 PHE A 141 -4.213 6.800 -7.136 1.00 0.00 C ATOM 293 CE2 PHE A 141 -3.122 4.871 -8.136 1.00 0.00 C ATOM 294 CZ PHE A 141 -3.471 5.611 -7.004 1.00 0.00 C ATOM 0 H PHE A 141 -3.748 9.256 -9.793 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.216 7.550 -11.439 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -5.225 7.727 -10.961 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -4.393 6.351 -11.658 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -5.119 8.184 -8.524 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -3.087 4.822 -10.285 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -4.536 7.338 -6.257 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.638 3.912 -8.027 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.171 5.270 -6.024 1.00 0.00 H new ATOM 304 N GLY A 142 -3.950 9.819 -12.979 1.00 0.00 N ATOM 305 CA GLY A 142 -4.559 10.323 -14.193 1.00 0.00 C ATOM 306 C GLY A 142 -5.942 9.717 -14.394 1.00 0.00 C ATOM 307 O GLY A 142 -6.402 9.657 -15.531 1.00 0.00 O ATOM 0 H GLY A 142 -3.921 10.508 -12.228 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -4.636 11.409 -14.143 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -3.926 10.088 -15.048 1.00 0.00 H new ATOM 311 N ASN A 143 -6.607 9.228 -13.340 1.00 0.00 N ATOM 312 CA ASN A 143 -7.972 8.715 -13.414 1.00 0.00 C ATOM 313 C ASN A 143 -8.879 9.598 -12.571 1.00 0.00 C ATOM 314 O ASN A 143 -8.489 10.685 -12.150 1.00 0.00 O ATOM 315 CB ASN A 143 -7.995 7.236 -12.994 1.00 0.00 C ATOM 316 CG ASN A 143 -8.051 6.334 -14.203 1.00 0.00 C ATOM 317 OD1 ASN A 143 -9.007 6.402 -14.969 1.00 0.00 O ATOM 318 ND2 ASN A 143 -7.094 5.446 -14.352 1.00 0.00 N ATOM 0 H ASN A 143 -6.204 9.179 -12.404 1.00 0.00 H new ATOM 0 HA ASN A 143 -8.349 8.750 -14.436 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -7.107 7.007 -12.405 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -8.858 7.049 -12.355 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -7.130 4.782 -15.126 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -6.315 5.421 -13.694 1.00 0.00 H new ATOM 325 N ASP A 144 -10.122 9.176 -12.380 1.00 0.00 N ATOM 326 CA ASP A 144 -11.011 9.755 -11.384 1.00 0.00 C ATOM 327 C ASP A 144 -11.465 8.634 -10.463 1.00 0.00 C ATOM 328 O ASP A 144 -11.341 8.749 -9.244 1.00 0.00 O ATOM 329 CB ASP A 144 -12.177 10.461 -12.090 1.00 0.00 C ATOM 330 CG ASP A 144 -13.164 10.989 -11.058 1.00 0.00 C ATOM 331 OD1 ASP A 144 -14.083 10.238 -10.660 1.00 0.00 O ATOM 332 OD2 ASP A 144 -13.025 12.153 -10.632 1.00 0.00 O ATOM 0 H ASP A 144 -10.544 8.417 -12.916 1.00 0.00 H new ATOM 0 HA ASP A 144 -10.510 10.512 -10.781 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -11.801 11.282 -12.700 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -12.679 9.767 -12.764 1.00 0.00 H new ATOM 337 N TRP A 145 -11.963 7.522 -11.017 1.00 0.00 N ATOM 338 CA TRP A 145 -12.494 6.462 -10.167 1.00 0.00 C ATOM 339 C TRP A 145 -11.389 5.829 -9.297 1.00 0.00 C ATOM 340 O TRP A 145 -11.669 5.383 -8.185 1.00 0.00 O ATOM 341 CB TRP A 145 -13.266 5.422 -10.986 1.00 0.00 C ATOM 342 CG TRP A 145 -12.436 4.254 -11.373 1.00 0.00 C ATOM 343 CD1 TRP A 145 -11.441 4.285 -12.277 1.00 0.00 C ATOM 344 CD2 TRP A 145 -12.336 2.967 -10.706 1.00 0.00 C ATOM 345 NE1 TRP A 145 -10.797 3.064 -12.290 1.00 0.00 N ATOM 346 CE2 TRP A 145 -11.260 2.241 -11.288 1.00 0.00 C ATOM 347 CE3 TRP A 145 -13.002 2.379 -9.613 1.00 0.00 C ATOM 348 CZ2 TRP A 145 -10.857 0.991 -10.799 1.00 0.00 C ATOM 349 CZ3 TRP A 145 -12.618 1.117 -9.128 1.00 0.00 C ATOM 350 CH2 TRP A 145 -11.530 0.438 -9.700 1.00 0.00 C ATOM 0 H TRP A 145 -12.008 7.339 -12.020 1.00 0.00 H new ATOM 0 HA TRP A 145 -13.210 6.912 -9.480 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -14.123 5.076 -10.408 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -13.659 5.895 -11.886 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -11.186 5.132 -12.896 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -10.070 2.804 -12.957 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -13.819 2.905 -9.141 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -10.039 0.460 -11.263 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -13.163 0.667 -8.311 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -11.211 -0.510 -9.293 1.00 0.00 H new ATOM 361 N GLU A 146 -10.144 5.804 -9.790 1.00 0.00 N ATOM 362 CA GLU A 146 -8.982 5.253 -9.099 1.00 0.00 C ATOM 363 C GLU A 146 -8.671 6.078 -7.849 1.00 0.00 C ATOM 364 O GLU A 146 -8.408 5.510 -6.794 1.00 0.00 O ATOM 365 CB GLU A 146 -7.795 5.226 -10.074 1.00 0.00 C ATOM 366 CG GLU A 146 -7.966 4.103 -11.113 1.00 0.00 C ATOM 367 CD GLU A 146 -6.652 3.679 -11.776 1.00 0.00 C ATOM 368 OE1 GLU A 146 -5.826 4.543 -12.126 1.00 0.00 O ATOM 369 OE2 GLU A 146 -6.481 2.471 -12.063 1.00 0.00 O ATOM 0 H GLU A 146 -9.916 6.180 -10.710 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.186 4.234 -8.770 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -7.713 6.187 -10.581 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.868 5.078 -9.521 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -8.416 3.236 -10.629 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -8.662 4.435 -11.883 1.00 0.00 H new ATOM 376 N ASP A 147 -8.770 7.405 -7.927 1.00 0.00 N ATOM 377 CA ASP A 147 -8.524 8.301 -6.801 1.00 0.00 C ATOM 378 C ASP A 147 -9.507 7.977 -5.675 1.00 0.00 C ATOM 379 O ASP A 147 -9.088 7.735 -4.542 1.00 0.00 O ATOM 380 CB ASP A 147 -8.622 9.781 -7.222 1.00 0.00 C ATOM 381 CG ASP A 147 -7.535 10.198 -8.218 1.00 0.00 C ATOM 382 OD1 ASP A 147 -7.438 9.577 -9.300 1.00 0.00 O ATOM 383 OD2 ASP A 147 -6.771 11.153 -7.936 1.00 0.00 O ATOM 0 H ASP A 147 -9.027 7.892 -8.785 1.00 0.00 H new ATOM 0 HA ASP A 147 -7.507 8.145 -6.443 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -9.601 9.962 -7.666 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -8.553 10.410 -6.334 1.00 0.00 H new ATOM 388 N ARG A 148 -10.812 7.913 -5.969 1.00 0.00 N ATOM 389 CA ARG A 148 -11.826 7.489 -5.028 1.00 0.00 C ATOM 390 C ARG A 148 -11.592 6.051 -4.552 1.00 0.00 C ATOM 391 O ARG A 148 -11.799 5.807 -3.365 1.00 0.00 O ATOM 392 CB ARG A 148 -13.200 7.709 -5.681 1.00 0.00 C ATOM 393 CG ARG A 148 -14.315 7.174 -4.797 1.00 0.00 C ATOM 394 CD ARG A 148 -15.723 7.405 -5.358 1.00 0.00 C ATOM 395 NE ARG A 148 -16.720 7.129 -4.312 1.00 0.00 N ATOM 396 CZ ARG A 148 -18.035 6.940 -4.448 1.00 0.00 C ATOM 397 NH1 ARG A 148 -18.651 6.888 -5.621 1.00 0.00 N ATOM 398 NH2 ARG A 148 -18.761 6.816 -3.351 1.00 0.00 N ATOM 0 H ARG A 148 -11.186 8.161 -6.885 1.00 0.00 H new ATOM 0 HA ARG A 148 -11.778 8.087 -4.118 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -13.354 8.773 -5.863 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -13.230 7.212 -6.651 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -14.165 6.105 -4.649 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -14.244 7.645 -3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -15.822 8.433 -5.708 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -15.894 6.758 -6.218 1.00 0.00 H new ATOM 0 HE ARG A 148 -16.360 7.075 -3.359 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -18.116 6.995 -6.483 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -19.660 6.741 -5.661 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -18.314 6.866 -2.435 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.768 6.671 -3.420 1.00 0.00 H new ATOM 412 N TYR A 149 -11.182 5.119 -5.422 1.00 0.00 N ATOM 413 CA TYR A 149 -10.918 3.737 -5.028 1.00 0.00 C ATOM 414 C TYR A 149 -9.886 3.758 -3.915 1.00 0.00 C ATOM 415 O TYR A 149 -10.154 3.232 -2.839 1.00 0.00 O ATOM 416 CB TYR A 149 -10.441 2.858 -6.203 1.00 0.00 C ATOM 417 CG TYR A 149 -10.103 1.415 -5.830 1.00 0.00 C ATOM 418 CD1 TYR A 149 -8.873 1.080 -5.222 1.00 0.00 C ATOM 419 CD2 TYR A 149 -11.019 0.386 -6.115 1.00 0.00 C ATOM 420 CE1 TYR A 149 -8.590 -0.254 -4.863 1.00 0.00 C ATOM 421 CE2 TYR A 149 -10.733 -0.949 -5.793 1.00 0.00 C ATOM 422 CZ TYR A 149 -9.529 -1.273 -5.141 1.00 0.00 C ATOM 423 OH TYR A 149 -9.284 -2.566 -4.816 1.00 0.00 O ATOM 0 H TYR A 149 -11.026 5.304 -6.413 1.00 0.00 H new ATOM 0 HA TYR A 149 -11.850 3.287 -4.685 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -11.217 2.848 -6.969 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -9.559 3.319 -6.648 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -8.143 1.852 -5.030 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -11.958 0.628 -6.590 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -7.657 -0.497 -4.376 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -11.437 -1.728 -6.046 1.00 0.00 H new ATOM 0 HH TYR A 149 -8.937 -2.613 -3.901 1.00 0.00 H new ATOM 433 N TYR A 150 -8.726 4.375 -4.159 1.00 0.00 N ATOM 434 CA TYR A 150 -7.660 4.507 -3.178 1.00 0.00 C ATOM 435 C TYR A 150 -8.209 5.124 -1.885 1.00 0.00 C ATOM 436 O TYR A 150 -7.994 4.556 -0.815 1.00 0.00 O ATOM 437 CB TYR A 150 -6.475 5.281 -3.790 1.00 0.00 C ATOM 438 CG TYR A 150 -5.751 6.185 -2.820 1.00 0.00 C ATOM 439 CD1 TYR A 150 -4.710 5.700 -2.007 1.00 0.00 C ATOM 440 CD2 TYR A 150 -6.183 7.514 -2.695 1.00 0.00 C ATOM 441 CE1 TYR A 150 -4.132 6.542 -1.039 1.00 0.00 C ATOM 442 CE2 TYR A 150 -5.640 8.346 -1.709 1.00 0.00 C ATOM 443 CZ TYR A 150 -4.625 7.855 -0.867 1.00 0.00 C ATOM 444 OH TYR A 150 -4.094 8.675 0.072 1.00 0.00 O ATOM 0 H TYR A 150 -8.504 4.801 -5.059 1.00 0.00 H new ATOM 0 HA TYR A 150 -7.272 3.526 -2.903 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -5.763 4.565 -4.201 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -6.841 5.881 -4.623 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -4.356 4.686 -2.125 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -6.939 7.898 -3.364 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -3.314 6.186 -0.430 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -5.998 9.359 -1.595 1.00 0.00 H new ATOM 0 HH TYR A 150 -4.554 9.540 0.049 1.00 0.00 H new ATOM 454 N ARG A 151 -8.961 6.227 -1.967 1.00 0.00 N ATOM 455 CA ARG A 151 -9.466 6.943 -0.793 1.00 0.00 C ATOM 456 C ARG A 151 -10.367 6.081 0.089 1.00 0.00 C ATOM 457 O ARG A 151 -10.471 6.361 1.281 1.00 0.00 O ATOM 458 CB ARG A 151 -10.239 8.191 -1.236 1.00 0.00 C ATOM 459 CG ARG A 151 -9.339 9.347 -1.703 1.00 0.00 C ATOM 460 CD ARG A 151 -10.149 10.391 -2.481 1.00 0.00 C ATOM 461 NE ARG A 151 -11.308 10.858 -1.705 1.00 0.00 N ATOM 462 CZ ARG A 151 -11.301 11.820 -0.768 1.00 0.00 C ATOM 463 NH1 ARG A 151 -10.233 12.586 -0.561 1.00 0.00 N ATOM 464 NH2 ARG A 151 -12.380 12.019 -0.018 1.00 0.00 N ATOM 0 H ARG A 151 -9.237 6.649 -2.854 1.00 0.00 H new ATOM 0 HA ARG A 151 -8.596 7.221 -0.198 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -10.915 7.919 -2.047 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -10.858 8.537 -0.408 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -8.866 9.817 -0.840 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -8.539 8.959 -2.333 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -9.510 11.238 -2.729 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -10.489 9.962 -3.423 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.203 10.408 -1.897 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -9.391 12.450 -1.121 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -10.256 13.309 0.158 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -13.210 11.442 -0.155 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.378 12.749 0.695 1.00 0.00 H new ATOM 478 N GLU A 152 -11.020 5.059 -0.458 1.00 0.00 N ATOM 479 CA GLU A 152 -11.903 4.173 0.298 1.00 0.00 C ATOM 480 C GLU A 152 -11.170 2.914 0.767 1.00 0.00 C ATOM 481 O GLU A 152 -11.697 2.164 1.588 1.00 0.00 O ATOM 482 CB GLU A 152 -13.114 3.800 -0.576 1.00 0.00 C ATOM 483 CG GLU A 152 -14.168 4.915 -0.649 1.00 0.00 C ATOM 484 CD GLU A 152 -15.100 4.956 0.572 1.00 0.00 C ATOM 485 OE1 GLU A 152 -14.635 5.076 1.728 1.00 0.00 O ATOM 486 OE2 GLU A 152 -16.338 4.951 0.380 1.00 0.00 O ATOM 0 H GLU A 152 -10.951 4.820 -1.447 1.00 0.00 H new ATOM 0 HA GLU A 152 -12.243 4.699 1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -12.770 3.567 -1.584 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -13.576 2.896 -0.180 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -13.663 5.876 -0.743 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -14.767 4.780 -1.549 1.00 0.00 H new ATOM 493 N ASN A 153 -9.961 2.655 0.265 1.00 0.00 N ATOM 494 CA ASN A 153 -9.279 1.361 0.362 1.00 0.00 C ATOM 495 C ASN A 153 -7.909 1.461 1.043 1.00 0.00 C ATOM 496 O ASN A 153 -7.343 0.449 1.449 1.00 0.00 O ATOM 497 CB ASN A 153 -9.171 0.761 -1.045 1.00 0.00 C ATOM 498 CG ASN A 153 -10.459 0.057 -1.478 1.00 0.00 C ATOM 499 OD1 ASN A 153 -10.936 -0.880 -0.839 1.00 0.00 O ATOM 500 ND2 ASN A 153 -11.089 0.502 -2.551 1.00 0.00 N ATOM 0 H ASN A 153 -9.414 3.357 -0.233 1.00 0.00 H new ATOM 0 HA ASN A 153 -9.869 0.703 1.000 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -8.935 1.552 -1.757 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -8.345 0.051 -1.072 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -11.965 0.069 -2.844 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -10.700 1.278 -3.086 1.00 0.00 H new ATOM 507 N MET A 154 -7.407 2.683 1.237 1.00 0.00 N ATOM 508 CA MET A 154 -6.107 3.014 1.816 1.00 0.00 C ATOM 509 C MET A 154 -5.853 2.386 3.192 1.00 0.00 C ATOM 510 O MET A 154 -4.706 2.124 3.543 1.00 0.00 O ATOM 511 CB MET A 154 -5.980 4.549 1.881 1.00 0.00 C ATOM 512 CG MET A 154 -7.021 5.226 2.795 1.00 0.00 C ATOM 513 SD MET A 154 -7.442 6.942 2.381 1.00 0.00 S ATOM 514 CE MET A 154 -5.834 7.739 2.570 1.00 0.00 C ATOM 0 H MET A 154 -7.932 3.518 0.977 1.00 0.00 H new ATOM 0 HA MET A 154 -5.342 2.585 1.169 1.00 0.00 H new ATOM 0 HB2 MET A 154 -4.981 4.806 2.233 1.00 0.00 H new ATOM 0 HB3 MET A 154 -6.077 4.954 0.874 1.00 0.00 H new ATOM 0 HG2 MET A 154 -7.935 4.633 2.774 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.648 5.201 3.819 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.907 8.783 2.264 1.00 0.00 H new ATOM 0 HE2 MET A 154 -5.523 7.688 3.613 1.00 0.00 H new ATOM 0 HE3 MET A 154 -5.099 7.229 1.947 1.00 0.00 H new ATOM 524 N TYR A 155 -6.909 2.145 3.974 1.00 0.00 N ATOM 525 CA TYR A 155 -6.834 1.677 5.358 1.00 0.00 C ATOM 526 C TYR A 155 -6.149 0.310 5.508 1.00 0.00 C ATOM 527 O TYR A 155 -5.675 -0.007 6.593 1.00 0.00 O ATOM 528 CB TYR A 155 -8.250 1.643 5.967 1.00 0.00 C ATOM 529 CG TYR A 155 -9.191 0.601 5.378 1.00 0.00 C ATOM 530 CD1 TYR A 155 -9.776 0.804 4.114 1.00 0.00 C ATOM 531 CD2 TYR A 155 -9.467 -0.588 6.083 1.00 0.00 C ATOM 532 CE1 TYR A 155 -10.593 -0.186 3.548 1.00 0.00 C ATOM 533 CE2 TYR A 155 -10.315 -1.565 5.527 1.00 0.00 C ATOM 534 CZ TYR A 155 -10.883 -1.371 4.250 1.00 0.00 C ATOM 535 OH TYR A 155 -11.697 -2.312 3.697 1.00 0.00 O ATOM 0 H TYR A 155 -7.868 2.274 3.650 1.00 0.00 H new ATOM 0 HA TYR A 155 -6.207 2.385 5.900 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -8.162 1.463 7.038 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -8.703 2.627 5.845 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -9.595 1.724 3.578 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -9.026 -0.751 7.055 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -11.005 -0.037 2.561 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -10.532 -2.467 6.080 1.00 0.00 H new ATOM 0 HH TYR A 155 -11.791 -3.067 4.315 1.00 0.00 H new ATOM 545 N ARG A 156 -6.090 -0.501 4.447 1.00 0.00 N ATOM 546 CA ARG A 156 -5.504 -1.843 4.505 1.00 0.00 C ATOM 547 C ARG A 156 -3.998 -1.830 4.253 1.00 0.00 C ATOM 548 O ARG A 156 -3.356 -2.873 4.393 1.00 0.00 O ATOM 549 CB ARG A 156 -6.218 -2.743 3.484 1.00 0.00 C ATOM 550 CG ARG A 156 -7.671 -2.991 3.897 1.00 0.00 C ATOM 551 CD ARG A 156 -8.517 -3.614 2.792 1.00 0.00 C ATOM 552 NE ARG A 156 -8.030 -4.932 2.346 1.00 0.00 N ATOM 553 CZ ARG A 156 -8.404 -5.509 1.194 1.00 0.00 C ATOM 554 NH1 ARG A 156 -9.045 -4.808 0.266 1.00 0.00 N ATOM 555 NH2 ARG A 156 -8.122 -6.785 0.959 1.00 0.00 N ATOM 0 H ARG A 156 -6.446 -0.246 3.526 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.645 -2.235 5.512 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -6.190 -2.276 2.499 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -5.692 -3.694 3.401 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -7.686 -3.645 4.769 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -8.121 -2.046 4.200 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -9.543 -3.716 3.146 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -8.540 -2.937 1.938 1.00 0.00 H new ATOM 0 HE ARG A 156 -7.373 -5.432 2.945 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -9.257 -3.823 0.426 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -9.326 -5.254 -0.607 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -7.618 -7.333 1.656 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -8.409 -7.217 0.081 1.00 0.00 H new ATOM 569 N TYR A 157 -3.440 -0.701 3.815 1.00 0.00 N ATOM 570 CA TYR A 157 -2.060 -0.607 3.358 1.00 0.00 C ATOM 571 C TYR A 157 -1.153 -0.208 4.534 1.00 0.00 C ATOM 572 O TYR A 157 -1.653 0.135 5.613 1.00 0.00 O ATOM 573 CB TYR A 157 -2.007 0.380 2.173 1.00 0.00 C ATOM 574 CG TYR A 157 -2.940 0.087 1.000 1.00 0.00 C ATOM 575 CD1 TYR A 157 -3.454 -1.207 0.764 1.00 0.00 C ATOM 576 CD2 TYR A 157 -3.287 1.134 0.121 1.00 0.00 C ATOM 577 CE1 TYR A 157 -4.354 -1.442 -0.287 1.00 0.00 C ATOM 578 CE2 TYR A 157 -4.159 0.903 -0.959 1.00 0.00 C ATOM 579 CZ TYR A 157 -4.713 -0.382 -1.147 1.00 0.00 C ATOM 580 OH TYR A 157 -5.598 -0.587 -2.155 1.00 0.00 O ATOM 0 H TYR A 157 -3.944 0.184 3.768 1.00 0.00 H new ATOM 0 HA TYR A 157 -1.688 -1.567 3.001 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -2.235 1.377 2.549 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -0.984 0.407 1.797 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -3.151 -2.026 1.400 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -2.880 2.122 0.278 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -4.769 -2.428 -0.437 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -4.403 1.704 -1.641 1.00 0.00 H new ATOM 0 HH TYR A 157 -6.094 -1.416 -1.991 1.00 0.00 H new ATOM 590 N PRO A 158 0.185 -0.265 4.388 1.00 0.00 N ATOM 591 CA PRO A 158 1.095 0.199 5.427 1.00 0.00 C ATOM 592 C PRO A 158 0.927 1.698 5.704 1.00 0.00 C ATOM 593 O PRO A 158 0.332 2.443 4.920 1.00 0.00 O ATOM 594 CB PRO A 158 2.509 -0.086 4.907 1.00 0.00 C ATOM 595 CG PRO A 158 2.312 -1.134 3.818 1.00 0.00 C ATOM 596 CD PRO A 158 0.939 -0.782 3.256 1.00 0.00 C ATOM 0 HA PRO A 158 0.892 -0.312 6.368 1.00 0.00 H new ATOM 0 HB2 PRO A 158 2.975 0.816 4.510 1.00 0.00 H new ATOM 0 HB3 PRO A 158 3.157 -0.456 5.702 1.00 0.00 H new ATOM 0 HG2 PRO A 158 3.088 -1.076 3.055 1.00 0.00 H new ATOM 0 HG3 PRO A 158 2.337 -2.146 4.221 1.00 0.00 H new ATOM 0 HD2 PRO A 158 1.017 -0.039 2.462 1.00 0.00 H new ATOM 0 HD3 PRO A 158 0.453 -1.658 2.826 1.00 0.00 H new ATOM 604 N ASN A 159 1.535 2.168 6.792 1.00 0.00 N ATOM 605 CA ASN A 159 1.772 3.589 7.073 1.00 0.00 C ATOM 606 C ASN A 159 3.270 3.903 7.180 1.00 0.00 C ATOM 607 O ASN A 159 3.645 5.075 7.192 1.00 0.00 O ATOM 608 CB ASN A 159 1.001 4.040 8.332 1.00 0.00 C ATOM 609 CG ASN A 159 1.413 3.339 9.624 1.00 0.00 C ATOM 610 OD1 ASN A 159 2.085 2.318 9.622 1.00 0.00 O ATOM 611 ND2 ASN A 159 0.972 3.814 10.770 1.00 0.00 N ATOM 0 H ASN A 159 1.888 1.555 7.526 1.00 0.00 H new ATOM 0 HA ASN A 159 1.388 4.162 6.229 1.00 0.00 H new ATOM 0 HB2 ASN A 159 1.138 5.114 8.459 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.063 3.872 8.168 1.00 0.00 H new ATOM 0 HD21 ASN A 159 1.192 3.331 11.641 1.00 0.00 H new ATOM 0 HD22 ASN A 159 0.410 4.665 10.787 1.00 0.00 H new ATOM 618 N GLN A 160 4.131 2.884 7.203 1.00 0.00 N ATOM 619 CA GLN A 160 5.591 2.964 7.196 1.00 0.00 C ATOM 620 C GLN A 160 6.101 2.105 6.028 1.00 0.00 C ATOM 621 O GLN A 160 5.291 1.487 5.326 1.00 0.00 O ATOM 622 CB GLN A 160 6.199 2.543 8.550 1.00 0.00 C ATOM 623 CG GLN A 160 5.249 2.593 9.756 1.00 0.00 C ATOM 624 CD GLN A 160 5.868 2.399 11.139 1.00 0.00 C ATOM 625 OE1 GLN A 160 5.157 2.466 12.140 1.00 0.00 O ATOM 626 NE2 GLN A 160 7.165 2.199 11.269 1.00 0.00 N ATOM 0 H GLN A 160 3.804 1.918 7.229 1.00 0.00 H new ATOM 0 HA GLN A 160 5.909 3.997 7.053 1.00 0.00 H new ATOM 0 HB2 GLN A 160 6.581 1.527 8.455 1.00 0.00 H new ATOM 0 HB3 GLN A 160 7.054 3.186 8.758 1.00 0.00 H new ATOM 0 HG2 GLN A 160 4.740 3.557 9.746 1.00 0.00 H new ATOM 0 HG3 GLN A 160 4.485 1.828 9.617 1.00 0.00 H new ATOM 0 HE21 GLN A 160 7.758 2.143 10.441 1.00 0.00 H new ATOM 0 HE22 GLN A 160 7.575 2.100 12.198 1.00 0.00 H new ATOM 635 N VAL A 161 7.415 2.034 5.812 1.00 0.00 N ATOM 636 CA VAL A 161 8.013 1.285 4.704 1.00 0.00 C ATOM 637 C VAL A 161 9.301 0.618 5.184 1.00 0.00 C ATOM 638 O VAL A 161 9.917 1.108 6.130 1.00 0.00 O ATOM 639 CB VAL A 161 8.278 2.228 3.509 1.00 0.00 C ATOM 640 CG1 VAL A 161 6.979 2.605 2.776 1.00 0.00 C ATOM 641 CG2 VAL A 161 8.989 3.525 3.922 1.00 0.00 C ATOM 0 H VAL A 161 8.101 2.499 6.406 1.00 0.00 H new ATOM 0 HA VAL A 161 7.326 0.509 4.367 1.00 0.00 H new ATOM 0 HB VAL A 161 8.929 1.663 2.842 1.00 0.00 H new ATOM 0 HG11 VAL A 161 7.211 3.269 1.943 1.00 0.00 H new ATOM 0 HG12 VAL A 161 6.499 1.702 2.398 1.00 0.00 H new ATOM 0 HG13 VAL A 161 6.305 3.112 3.467 1.00 0.00 H new ATOM 0 HG21 VAL A 161 9.149 4.148 3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 161 8.373 4.064 4.642 1.00 0.00 H new ATOM 0 HG23 VAL A 161 9.950 3.284 4.376 1.00 0.00 H new ATOM 651 N TYR A 162 9.733 -0.459 4.527 1.00 0.00 N ATOM 652 CA TYR A 162 10.920 -1.210 4.874 1.00 0.00 C ATOM 653 C TYR A 162 12.058 -0.860 3.916 1.00 0.00 C ATOM 654 O TYR A 162 11.873 -0.968 2.706 1.00 0.00 O ATOM 655 CB TYR A 162 10.603 -2.694 4.764 1.00 0.00 C ATOM 656 CG TYR A 162 9.816 -3.315 5.907 1.00 0.00 C ATOM 657 CD1 TYR A 162 10.407 -3.474 7.174 1.00 0.00 C ATOM 658 CD2 TYR A 162 8.508 -3.786 5.691 1.00 0.00 C ATOM 659 CE1 TYR A 162 9.713 -4.136 8.206 1.00 0.00 C ATOM 660 CE2 TYR A 162 7.803 -4.445 6.713 1.00 0.00 C ATOM 661 CZ TYR A 162 8.415 -4.648 7.973 1.00 0.00 C ATOM 662 OH TYR A 162 7.766 -5.315 8.971 1.00 0.00 O ATOM 0 H TYR A 162 9.245 -0.837 3.715 1.00 0.00 H new ATOM 0 HA TYR A 162 11.227 -0.964 5.890 1.00 0.00 H new ATOM 0 HB2 TYR A 162 10.045 -2.854 3.841 1.00 0.00 H new ATOM 0 HB3 TYR A 162 11.544 -3.236 4.666 1.00 0.00 H new ATOM 0 HD1 TYR A 162 11.398 -3.086 7.356 1.00 0.00 H new ATOM 0 HD2 TYR A 162 8.040 -3.640 4.729 1.00 0.00 H new ATOM 0 HE1 TYR A 162 10.173 -4.253 9.176 1.00 0.00 H new ATOM 0 HE2 TYR A 162 6.797 -4.796 6.537 1.00 0.00 H new ATOM 0 HH TYR A 162 6.885 -5.602 8.653 1.00 0.00 H new ATOM 672 N TYR A 163 13.226 -0.472 4.428 1.00 0.00 N ATOM 673 CA TYR A 163 14.370 -0.004 3.627 1.00 0.00 C ATOM 674 C TYR A 163 15.702 -0.077 4.399 1.00 0.00 C ATOM 675 O TYR A 163 15.686 -0.194 5.627 1.00 0.00 O ATOM 676 CB TYR A 163 14.102 1.444 3.175 1.00 0.00 C ATOM 677 CG TYR A 163 13.900 2.453 4.292 1.00 0.00 C ATOM 678 CD1 TYR A 163 12.661 2.544 4.947 1.00 0.00 C ATOM 679 CD2 TYR A 163 14.944 3.306 4.685 1.00 0.00 C ATOM 680 CE1 TYR A 163 12.487 3.430 6.021 1.00 0.00 C ATOM 681 CE2 TYR A 163 14.788 4.190 5.760 1.00 0.00 C ATOM 682 CZ TYR A 163 13.561 4.245 6.454 1.00 0.00 C ATOM 683 OH TYR A 163 13.414 5.064 7.528 1.00 0.00 O ATOM 0 H TYR A 163 13.413 -0.472 5.431 1.00 0.00 H new ATOM 0 HA TYR A 163 14.469 -0.664 2.765 1.00 0.00 H new ATOM 0 HB2 TYR A 163 14.938 1.774 2.558 1.00 0.00 H new ATOM 0 HB3 TYR A 163 13.216 1.449 2.540 1.00 0.00 H new ATOM 0 HD1 TYR A 163 11.836 1.927 4.622 1.00 0.00 H new ATOM 0 HD2 TYR A 163 15.882 3.280 4.150 1.00 0.00 H new ATOM 0 HE1 TYR A 163 11.531 3.491 6.519 1.00 0.00 H new ATOM 0 HE2 TYR A 163 15.606 4.829 6.057 1.00 0.00 H new ATOM 0 HH TYR A 163 14.285 5.440 7.774 1.00 0.00 H new ATOM 693 N ARG A 164 16.855 0.017 3.712 1.00 0.00 N ATOM 694 CA ARG A 164 18.162 0.259 4.330 1.00 0.00 C ATOM 695 C ARG A 164 18.415 1.766 4.478 1.00 0.00 C ATOM 696 O ARG A 164 17.955 2.515 3.619 1.00 0.00 O ATOM 697 CB ARG A 164 19.268 -0.373 3.465 1.00 0.00 C ATOM 698 CG ARG A 164 19.470 0.224 2.063 1.00 0.00 C ATOM 699 CD ARG A 164 20.579 -0.575 1.376 1.00 0.00 C ATOM 700 NE ARG A 164 21.075 0.065 0.144 1.00 0.00 N ATOM 701 CZ ARG A 164 20.725 -0.262 -1.109 1.00 0.00 C ATOM 702 NH1 ARG A 164 19.750 -1.144 -1.330 1.00 0.00 N ATOM 703 NH2 ARG A 164 21.342 0.293 -2.152 1.00 0.00 N ATOM 0 H ARG A 164 16.901 -0.075 2.697 1.00 0.00 H new ATOM 0 HA ARG A 164 18.172 -0.195 5.321 1.00 0.00 H new ATOM 0 HB2 ARG A 164 20.210 -0.296 4.007 1.00 0.00 H new ATOM 0 HB3 ARG A 164 19.049 -1.435 3.355 1.00 0.00 H new ATOM 0 HG2 ARG A 164 18.546 0.170 1.487 1.00 0.00 H new ATOM 0 HG3 ARG A 164 19.742 1.277 2.131 1.00 0.00 H new ATOM 0 HD2 ARG A 164 21.409 -0.704 2.071 1.00 0.00 H new ATOM 0 HD3 ARG A 164 20.206 -1.571 1.136 1.00 0.00 H new ATOM 0 HE ARG A 164 21.745 0.826 0.254 1.00 0.00 H new ATOM 0 HH11 ARG A 164 19.264 -1.575 -0.543 1.00 0.00 H new ATOM 0 HH12 ARG A 164 19.490 -1.388 -2.286 1.00 0.00 H new ATOM 0 HH21 ARG A 164 22.087 0.973 -2.001 1.00 0.00 H new ATOM 0 HH22 ARG A 164 21.069 0.038 -3.101 1.00 0.00 H new ATOM 717 N PRO A 165 19.190 2.236 5.470 1.00 0.00 N ATOM 718 CA PRO A 165 19.575 3.643 5.554 1.00 0.00 C ATOM 719 C PRO A 165 20.420 4.069 4.343 1.00 0.00 C ATOM 720 O PRO A 165 20.943 3.228 3.604 1.00 0.00 O ATOM 721 CB PRO A 165 20.340 3.781 6.877 1.00 0.00 C ATOM 722 CG PRO A 165 20.897 2.379 7.111 1.00 0.00 C ATOM 723 CD PRO A 165 19.816 1.468 6.532 1.00 0.00 C ATOM 0 HA PRO A 165 18.707 4.302 5.535 1.00 0.00 H new ATOM 0 HB2 PRO A 165 21.135 4.523 6.806 1.00 0.00 H new ATOM 0 HB3 PRO A 165 19.684 4.094 7.690 1.00 0.00 H new ATOM 0 HG2 PRO A 165 21.854 2.237 6.608 1.00 0.00 H new ATOM 0 HG3 PRO A 165 21.062 2.184 8.171 1.00 0.00 H new ATOM 0 HD2 PRO A 165 20.247 0.544 6.147 1.00 0.00 H new ATOM 0 HD3 PRO A 165 19.089 1.188 7.294 1.00 0.00 H new ATOM 731 N VAL A 166 20.561 5.389 4.166 1.00 0.00 N ATOM 732 CA VAL A 166 21.303 6.033 3.084 1.00 0.00 C ATOM 733 C VAL A 166 22.731 5.494 3.021 1.00 0.00 C ATOM 734 O VAL A 166 23.032 4.783 2.064 1.00 0.00 O ATOM 735 CB VAL A 166 21.237 7.581 3.169 1.00 0.00 C ATOM 736 CG1 VAL A 166 20.295 8.111 2.092 1.00 0.00 C ATOM 737 CG2 VAL A 166 20.733 8.163 4.497 1.00 0.00 C ATOM 0 H VAL A 166 20.140 6.064 4.804 1.00 0.00 H new ATOM 0 HA VAL A 166 20.822 5.777 2.140 1.00 0.00 H new ATOM 0 HB VAL A 166 22.275 7.892 3.049 1.00 0.00 H new ATOM 0 HG11 VAL A 166 20.249 9.198 2.152 1.00 0.00 H new ATOM 0 HG12 VAL A 166 20.664 7.817 1.109 1.00 0.00 H new ATOM 0 HG13 VAL A 166 19.298 7.697 2.244 1.00 0.00 H new ATOM 0 HG21 VAL A 166 20.730 9.251 4.439 1.00 0.00 H new ATOM 0 HG22 VAL A 166 19.721 7.807 4.689 1.00 0.00 H new ATOM 0 HG23 VAL A 166 21.390 7.844 5.306 1.00 0.00 H new ATOM 822 N GLN A 172 19.834 5.145 -6.217 1.00 0.00 N ATOM 823 CA GLN A 172 18.577 5.340 -5.519 1.00 0.00 C ATOM 824 C GLN A 172 17.433 4.600 -6.192 1.00 0.00 C ATOM 825 O GLN A 172 16.543 4.129 -5.509 1.00 0.00 O ATOM 826 CB GLN A 172 18.195 6.809 -5.350 1.00 0.00 C ATOM 827 CG GLN A 172 18.145 7.718 -6.584 1.00 0.00 C ATOM 828 CD GLN A 172 17.366 8.980 -6.241 1.00 0.00 C ATOM 829 OE1 GLN A 172 17.932 10.010 -5.891 1.00 0.00 O ATOM 830 NE2 GLN A 172 16.048 8.908 -6.287 1.00 0.00 N ATOM 0 HA GLN A 172 18.744 4.924 -4.525 1.00 0.00 H new ATOM 0 HB2 GLN A 172 17.212 6.840 -4.880 1.00 0.00 H new ATOM 0 HB3 GLN A 172 18.899 7.252 -4.645 1.00 0.00 H new ATOM 0 HG2 GLN A 172 19.155 7.975 -6.903 1.00 0.00 H new ATOM 0 HG3 GLN A 172 17.670 7.197 -7.416 1.00 0.00 H new ATOM 0 HE21 GLN A 172 15.594 8.043 -6.581 1.00 0.00 H new ATOM 0 HE22 GLN A 172 15.484 9.718 -6.029 1.00 0.00 H new ATOM 839 N ASN A 173 17.441 4.483 -7.515 1.00 0.00 N ATOM 840 CA ASN A 173 16.347 3.854 -8.253 1.00 0.00 C ATOM 841 C ASN A 173 16.179 2.388 -7.859 1.00 0.00 C ATOM 842 O ASN A 173 15.084 1.915 -7.554 1.00 0.00 O ATOM 843 CB ASN A 173 16.646 3.927 -9.744 1.00 0.00 C ATOM 844 CG ASN A 173 15.569 3.175 -10.518 1.00 0.00 C ATOM 845 OD1 ASN A 173 14.381 3.327 -10.271 1.00 0.00 O ATOM 846 ND2 ASN A 173 15.964 2.289 -11.405 1.00 0.00 N ATOM 0 H ASN A 173 18.201 4.819 -8.106 1.00 0.00 H new ATOM 0 HA ASN A 173 15.426 4.386 -8.014 1.00 0.00 H new ATOM 0 HB2 ASN A 173 16.682 4.967 -10.068 1.00 0.00 H new ATOM 0 HB3 ASN A 173 17.625 3.495 -9.951 1.00 0.00 H new ATOM 0 HD21 ASN A 173 15.276 1.718 -11.897 1.00 0.00 H new ATOM 0 HD22 ASN A 173 16.958 2.172 -11.602 1.00 0.00 H new ATOM 853 N ASN A 174 17.299 1.672 -7.877 1.00 0.00 N ATOM 854 CA ASN A 174 17.359 0.274 -7.467 1.00 0.00 C ATOM 855 C ASN A 174 17.038 0.129 -5.988 1.00 0.00 C ATOM 856 O ASN A 174 16.462 -0.876 -5.593 1.00 0.00 O ATOM 857 CB ASN A 174 18.751 -0.298 -7.724 1.00 0.00 C ATOM 858 CG ASN A 174 18.905 -0.781 -9.157 1.00 0.00 C ATOM 859 OD1 ASN A 174 18.728 -0.034 -10.117 1.00 0.00 O ATOM 860 ND2 ASN A 174 19.192 -2.049 -9.340 1.00 0.00 N ATOM 0 H ASN A 174 18.197 2.049 -8.179 1.00 0.00 H new ATOM 0 HA ASN A 174 16.621 -0.273 -8.053 1.00 0.00 H new ATOM 0 HB2 ASN A 174 19.502 0.464 -7.514 1.00 0.00 H new ATOM 0 HB3 ASN A 174 18.936 -1.126 -7.039 1.00 0.00 H new ATOM 0 HD21 ASN A 174 19.270 -2.423 -10.286 1.00 0.00 H new ATOM 0 HD22 ASN A 174 19.337 -2.660 -8.536 1.00 0.00 H new ATOM 867 N PHE A 175 17.407 1.109 -5.167 1.00 0.00 N ATOM 868 CA PHE A 175 17.058 1.144 -3.757 1.00 0.00 C ATOM 869 C PHE A 175 15.543 1.352 -3.571 1.00 0.00 C ATOM 870 O PHE A 175 14.938 0.622 -2.794 1.00 0.00 O ATOM 871 CB PHE A 175 17.922 2.211 -3.076 1.00 0.00 C ATOM 872 CG PHE A 175 17.325 2.737 -1.798 1.00 0.00 C ATOM 873 CD1 PHE A 175 17.490 2.030 -0.597 1.00 0.00 C ATOM 874 CD2 PHE A 175 16.515 3.884 -1.835 1.00 0.00 C ATOM 875 CE1 PHE A 175 16.848 2.478 0.568 1.00 0.00 C ATOM 876 CE2 PHE A 175 15.864 4.311 -0.672 1.00 0.00 C ATOM 877 CZ PHE A 175 16.033 3.620 0.536 1.00 0.00 C ATOM 0 H PHE A 175 17.963 1.909 -5.470 1.00 0.00 H new ATOM 0 HA PHE A 175 17.270 0.189 -3.277 1.00 0.00 H new ATOM 0 HB2 PHE A 175 18.905 1.791 -2.863 1.00 0.00 H new ATOM 0 HB3 PHE A 175 18.073 3.041 -3.766 1.00 0.00 H new ATOM 0 HD1 PHE A 175 18.108 1.145 -0.569 1.00 0.00 H new ATOM 0 HD2 PHE A 175 16.395 4.434 -2.757 1.00 0.00 H new ATOM 0 HE1 PHE A 175 16.982 1.940 1.495 1.00 0.00 H new ATOM 0 HE2 PHE A 175 15.225 5.181 -0.705 1.00 0.00 H new ATOM 0 HZ PHE A 175 15.541 3.963 1.434 1.00 0.00 H new ATOM 887 N VAL A 176 14.912 2.271 -4.310 1.00 0.00 N ATOM 888 CA VAL A 176 13.471 2.505 -4.362 1.00 0.00 C ATOM 889 C VAL A 176 12.793 1.185 -4.721 1.00 0.00 C ATOM 890 O VAL A 176 11.885 0.758 -4.017 1.00 0.00 O ATOM 891 CB VAL A 176 13.134 3.662 -5.336 1.00 0.00 C ATOM 892 CG1 VAL A 176 11.633 3.760 -5.665 1.00 0.00 C ATOM 893 CG2 VAL A 176 13.543 5.021 -4.746 1.00 0.00 C ATOM 0 H VAL A 176 15.426 2.906 -4.921 1.00 0.00 H new ATOM 0 HA VAL A 176 13.091 2.830 -3.393 1.00 0.00 H new ATOM 0 HB VAL A 176 13.692 3.433 -6.244 1.00 0.00 H new ATOM 0 HG11 VAL A 176 11.464 4.590 -6.351 1.00 0.00 H new ATOM 0 HG12 VAL A 176 11.301 2.832 -6.130 1.00 0.00 H new ATOM 0 HG13 VAL A 176 11.070 3.928 -4.747 1.00 0.00 H new ATOM 0 HG21 VAL A 176 13.294 5.814 -5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 176 13.009 5.187 -3.811 1.00 0.00 H new ATOM 0 HG23 VAL A 176 14.616 5.027 -4.557 1.00 0.00 H new ATOM 903 N HIS A 177 13.241 0.515 -5.786 1.00 0.00 N ATOM 904 CA HIS A 177 12.686 -0.771 -6.184 1.00 0.00 C ATOM 905 C HIS A 177 12.820 -1.765 -5.020 1.00 0.00 C ATOM 906 O HIS A 177 11.838 -2.410 -4.667 1.00 0.00 O ATOM 907 CB HIS A 177 13.367 -1.230 -7.486 1.00 0.00 C ATOM 908 CG HIS A 177 12.724 -2.381 -8.227 1.00 0.00 C ATOM 909 ND1 HIS A 177 13.013 -2.755 -9.524 1.00 0.00 N ATOM 910 CD2 HIS A 177 11.813 -3.283 -7.744 1.00 0.00 C ATOM 911 CE1 HIS A 177 12.321 -3.869 -9.802 1.00 0.00 C ATOM 912 NE2 HIS A 177 11.587 -4.236 -8.738 1.00 0.00 N ATOM 0 H HIS A 177 13.993 0.849 -6.389 1.00 0.00 H new ATOM 0 HA HIS A 177 11.620 -0.699 -6.401 1.00 0.00 H new ATOM 0 HB2 HIS A 177 13.416 -0.376 -8.162 1.00 0.00 H new ATOM 0 HB3 HIS A 177 14.394 -1.510 -7.251 1.00 0.00 H new ATOM 0 HD2 HIS A 177 11.352 -3.261 -6.768 1.00 0.00 H new ATOM 0 HE1 HIS A 177 12.349 -4.395 -10.745 1.00 0.00 H new ATOM 0 HE2 HIS A 177 10.981 -5.054 -8.670 1.00 0.00 H new ATOM 920 N ASP A 178 13.989 -1.852 -4.377 1.00 0.00 N ATOM 921 CA ASP A 178 14.234 -2.742 -3.240 1.00 0.00 C ATOM 922 C ASP A 178 13.196 -2.497 -2.146 1.00 0.00 C ATOM 923 O ASP A 178 12.498 -3.424 -1.755 1.00 0.00 O ATOM 924 CB ASP A 178 15.659 -2.530 -2.685 1.00 0.00 C ATOM 925 CG ASP A 178 16.356 -3.754 -2.074 1.00 0.00 C ATOM 926 OD1 ASP A 178 16.097 -4.172 -0.921 1.00 0.00 O ATOM 927 OD2 ASP A 178 17.349 -4.206 -2.692 1.00 0.00 O ATOM 0 H ASP A 178 14.804 -1.297 -4.637 1.00 0.00 H new ATOM 0 HA ASP A 178 14.147 -3.774 -3.581 1.00 0.00 H new ATOM 0 HB2 ASP A 178 16.285 -2.152 -3.493 1.00 0.00 H new ATOM 0 HB3 ASP A 178 15.614 -1.750 -1.925 1.00 0.00 H new ATOM 932 N CYS A 179 13.061 -1.265 -1.649 1.00 0.00 N ATOM 933 CA CYS A 179 12.169 -0.981 -0.530 1.00 0.00 C ATOM 934 C CYS A 179 10.691 -1.111 -0.900 1.00 0.00 C ATOM 935 O CYS A 179 9.908 -1.616 -0.090 1.00 0.00 O ATOM 936 CB CYS A 179 12.479 0.389 0.062 1.00 0.00 C ATOM 937 SG CYS A 179 12.476 1.810 -1.037 1.00 0.00 S ATOM 0 H CYS A 179 13.560 -0.450 -2.006 1.00 0.00 H new ATOM 0 HA CYS A 179 12.355 -1.740 0.230 1.00 0.00 H new ATOM 0 HB2 CYS A 179 11.756 0.580 0.855 1.00 0.00 H new ATOM 0 HB3 CYS A 179 13.461 0.334 0.532 1.00 0.00 H new ATOM 0 HG CYS A 179 12.157 1.429 -2.238 1.00 0.00 H new ATOM 942 N VAL A 180 10.312 -0.729 -2.122 1.00 0.00 N ATOM 943 CA VAL A 180 8.968 -0.968 -2.650 1.00 0.00 C ATOM 944 C VAL A 180 8.703 -2.474 -2.657 1.00 0.00 C ATOM 945 O VAL A 180 7.666 -2.888 -2.148 1.00 0.00 O ATOM 946 CB VAL A 180 8.762 -0.279 -4.029 1.00 0.00 C ATOM 947 CG1 VAL A 180 7.441 -0.630 -4.759 1.00 0.00 C ATOM 948 CG2 VAL A 180 8.760 1.248 -3.841 1.00 0.00 C ATOM 0 H VAL A 180 10.930 -0.245 -2.773 1.00 0.00 H new ATOM 0 HA VAL A 180 8.222 -0.507 -2.003 1.00 0.00 H new ATOM 0 HB VAL A 180 9.584 -0.647 -4.642 1.00 0.00 H new ATOM 0 HG11 VAL A 180 7.398 -0.097 -5.709 1.00 0.00 H new ATOM 0 HG12 VAL A 180 7.401 -1.704 -4.943 1.00 0.00 H new ATOM 0 HG13 VAL A 180 6.594 -0.336 -4.139 1.00 0.00 H new ATOM 0 HG21 VAL A 180 8.616 1.733 -4.806 1.00 0.00 H new ATOM 0 HG22 VAL A 180 7.950 1.531 -3.168 1.00 0.00 H new ATOM 0 HG23 VAL A 180 9.712 1.563 -3.415 1.00 0.00 H new ATOM 958 N ASN A 181 9.641 -3.291 -3.151 1.00 0.00 N ATOM 959 CA ASN A 181 9.513 -4.732 -3.315 1.00 0.00 C ATOM 960 C ASN A 181 9.368 -5.343 -1.945 1.00 0.00 C ATOM 961 O ASN A 181 8.488 -6.156 -1.737 1.00 0.00 O ATOM 962 CB ASN A 181 10.752 -5.347 -3.999 1.00 0.00 C ATOM 963 CG ASN A 181 10.634 -6.865 -4.120 1.00 0.00 C ATOM 964 OD1 ASN A 181 10.129 -7.389 -5.107 1.00 0.00 O ATOM 965 ND2 ASN A 181 11.090 -7.619 -3.132 1.00 0.00 N ATOM 0 H ASN A 181 10.549 -2.943 -3.459 1.00 0.00 H new ATOM 0 HA ASN A 181 8.647 -4.934 -3.945 1.00 0.00 H new ATOM 0 HB2 ASN A 181 10.874 -4.911 -4.991 1.00 0.00 H new ATOM 0 HB3 ASN A 181 11.646 -5.096 -3.428 1.00 0.00 H new ATOM 0 HD21 ASN A 181 11.021 -8.635 -3.192 1.00 0.00 H new ATOM 0 HD22 ASN A 181 11.510 -7.184 -2.311 1.00 0.00 H new ATOM 972 N ILE A 182 10.243 -4.972 -1.016 1.00 0.00 N ATOM 973 CA ILE A 182 10.284 -5.530 0.316 1.00 0.00 C ATOM 974 C ILE A 182 9.024 -5.145 1.096 1.00 0.00 C ATOM 975 O ILE A 182 8.469 -5.996 1.785 1.00 0.00 O ATOM 976 CB ILE A 182 11.598 -5.091 0.982 1.00 0.00 C ATOM 977 CG1 ILE A 182 12.833 -5.745 0.324 1.00 0.00 C ATOM 978 CG2 ILE A 182 11.579 -5.388 2.478 1.00 0.00 C ATOM 979 CD1 ILE A 182 12.936 -7.262 0.441 1.00 0.00 C ATOM 0 H ILE A 182 10.955 -4.260 -1.179 1.00 0.00 H new ATOM 0 HA ILE A 182 10.280 -6.620 0.292 1.00 0.00 H new ATOM 0 HB ILE A 182 11.679 -4.014 0.837 1.00 0.00 H new ATOM 0 HG12 ILE A 182 12.837 -5.482 -0.734 1.00 0.00 H new ATOM 0 HG13 ILE A 182 13.728 -5.306 0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 182 12.520 -5.068 2.925 1.00 0.00 H new ATOM 0 HG22 ILE A 182 10.754 -4.850 2.945 1.00 0.00 H new ATOM 0 HG23 ILE A 182 11.449 -6.459 2.635 1.00 0.00 H new ATOM 0 HD11 ILE A 182 13.842 -7.605 -0.058 1.00 0.00 H new ATOM 0 HD12 ILE A 182 12.972 -7.544 1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 182 12.067 -7.723 -0.028 1.00 0.00 H new ATOM 991 N THR A 183 8.556 -3.899 1.025 1.00 0.00 N ATOM 992 CA THR A 183 7.329 -3.524 1.720 1.00 0.00 C ATOM 993 C THR A 183 6.134 -4.281 1.131 1.00 0.00 C ATOM 994 O THR A 183 5.344 -4.847 1.890 1.00 0.00 O ATOM 995 CB THR A 183 7.128 -2.004 1.688 1.00 0.00 C ATOM 996 OG1 THR A 183 8.303 -1.339 2.116 1.00 0.00 O ATOM 997 CG2 THR A 183 5.980 -1.603 2.620 1.00 0.00 C ATOM 0 H THR A 183 9.001 -3.145 0.502 1.00 0.00 H new ATOM 0 HA THR A 183 7.412 -3.810 2.769 1.00 0.00 H new ATOM 0 HB THR A 183 6.895 -1.718 0.662 1.00 0.00 H new ATOM 0 HG1 THR A 183 8.938 -1.284 1.371 1.00 0.00 H new ATOM 0 HG21 THR A 183 5.847 -0.522 2.589 1.00 0.00 H new ATOM 0 HG22 THR A 183 5.061 -2.091 2.296 1.00 0.00 H new ATOM 0 HG23 THR A 183 6.214 -1.910 3.639 1.00 0.00 H new ATOM 1005 N ILE A 184 6.014 -4.320 -0.200 1.00 0.00 N ATOM 1006 CA ILE A 184 4.952 -5.039 -0.892 1.00 0.00 C ATOM 1007 C ILE A 184 5.031 -6.518 -0.548 1.00 0.00 C ATOM 1008 O ILE A 184 4.024 -7.087 -0.147 1.00 0.00 O ATOM 1009 CB ILE A 184 5.016 -4.713 -2.401 1.00 0.00 C ATOM 1010 CG1 ILE A 184 4.161 -3.447 -2.600 1.00 0.00 C ATOM 1011 CG2 ILE A 184 4.619 -5.829 -3.370 1.00 0.00 C ATOM 1012 CD1 ILE A 184 4.389 -2.743 -3.931 1.00 0.00 C ATOM 0 H ILE A 184 6.662 -3.846 -0.830 1.00 0.00 H new ATOM 0 HA ILE A 184 3.965 -4.717 -0.561 1.00 0.00 H new ATOM 0 HB ILE A 184 6.064 -4.568 -2.663 1.00 0.00 H new ATOM 0 HG12 ILE A 184 3.108 -3.717 -2.520 1.00 0.00 H new ATOM 0 HG13 ILE A 184 4.373 -2.748 -1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 184 4.708 -5.470 -4.395 1.00 0.00 H new ATOM 0 HG22 ILE A 184 5.277 -6.686 -3.227 1.00 0.00 H new ATOM 0 HG23 ILE A 184 3.588 -6.128 -3.179 1.00 0.00 H new ATOM 0 HD11 ILE A 184 3.749 -1.863 -3.991 1.00 0.00 H new ATOM 0 HD12 ILE A 184 5.433 -2.439 -4.008 1.00 0.00 H new ATOM 0 HD13 ILE A 184 4.148 -3.423 -4.748 1.00 0.00 H new ATOM 1024 N LYS A 185 6.213 -7.127 -0.616 1.00 0.00 N ATOM 1025 CA LYS A 185 6.492 -8.472 -0.170 1.00 0.00 C ATOM 1026 C LYS A 185 5.924 -8.621 1.223 1.00 0.00 C ATOM 1027 O LYS A 185 5.046 -9.446 1.398 1.00 0.00 O ATOM 1028 CB LYS A 185 7.990 -8.739 -0.257 1.00 0.00 C ATOM 1029 CG LYS A 185 8.380 -10.086 0.350 1.00 0.00 C ATOM 1030 CD LYS A 185 9.845 -9.982 0.740 1.00 0.00 C ATOM 1031 CE LYS A 185 10.442 -11.297 1.247 1.00 0.00 C ATOM 1032 NZ LYS A 185 11.695 -11.627 0.541 1.00 0.00 N ATOM 0 H LYS A 185 7.036 -6.665 -1.004 1.00 0.00 H new ATOM 0 HA LYS A 185 6.020 -9.222 -0.804 1.00 0.00 H new ATOM 0 HB2 LYS A 185 8.301 -8.711 -1.301 1.00 0.00 H new ATOM 0 HB3 LYS A 185 8.528 -7.943 0.257 1.00 0.00 H new ATOM 0 HG2 LYS A 185 7.763 -10.312 1.220 1.00 0.00 H new ATOM 0 HG3 LYS A 185 8.227 -10.892 -0.367 1.00 0.00 H new ATOM 0 HD2 LYS A 185 10.418 -9.642 -0.123 1.00 0.00 H new ATOM 0 HD3 LYS A 185 9.953 -9.222 1.514 1.00 0.00 H new ATOM 0 HE2 LYS A 185 10.634 -11.222 2.317 1.00 0.00 H new ATOM 0 HE3 LYS A 185 9.721 -12.103 1.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 12.074 -12.523 0.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 11.505 -11.722 -0.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 12.390 -10.869 0.694 1.00 0.00 H new ATOM 1046 N GLN A 186 6.375 -7.857 2.214 1.00 0.00 N ATOM 1047 CA GLN A 186 5.929 -8.050 3.581 1.00 0.00 C ATOM 1048 C GLN A 186 4.410 -7.952 3.689 1.00 0.00 C ATOM 1049 O GLN A 186 3.813 -8.875 4.230 1.00 0.00 O ATOM 1050 CB GLN A 186 6.652 -7.093 4.544 1.00 0.00 C ATOM 1051 CG GLN A 186 7.692 -7.798 5.435 1.00 0.00 C ATOM 1052 CD GLN A 186 8.547 -8.823 4.685 1.00 0.00 C ATOM 1053 OE1 GLN A 186 9.320 -8.482 3.802 1.00 0.00 O ATOM 1054 NE2 GLN A 186 8.398 -10.098 5.015 1.00 0.00 N ATOM 0 H GLN A 186 7.048 -7.101 2.091 1.00 0.00 H new ATOM 0 HA GLN A 186 6.198 -9.062 3.884 1.00 0.00 H new ATOM 0 HB2 GLN A 186 7.148 -6.313 3.966 1.00 0.00 H new ATOM 0 HB3 GLN A 186 5.915 -6.600 5.178 1.00 0.00 H new ATOM 0 HG2 GLN A 186 8.346 -7.048 5.880 1.00 0.00 H new ATOM 0 HG3 GLN A 186 7.176 -8.298 6.255 1.00 0.00 H new ATOM 0 HE21 GLN A 186 7.747 -10.361 5.755 1.00 0.00 H new ATOM 0 HE22 GLN A 186 8.934 -10.817 4.529 1.00 0.00 H new ATOM 1063 N HIS A 187 3.743 -6.919 3.173 1.00 0.00 N ATOM 1064 CA HIS A 187 2.286 -6.888 3.297 1.00 0.00 C ATOM 1065 C HIS A 187 1.608 -8.037 2.517 1.00 0.00 C ATOM 1066 O HIS A 187 0.557 -8.512 2.950 1.00 0.00 O ATOM 1067 CB HIS A 187 1.724 -5.491 2.997 1.00 0.00 C ATOM 1068 CG HIS A 187 1.326 -4.728 4.247 1.00 0.00 C ATOM 1069 ND1 HIS A 187 1.976 -4.720 5.468 1.00 0.00 N ATOM 1070 CD2 HIS A 187 0.216 -3.935 4.376 1.00 0.00 C ATOM 1071 CE1 HIS A 187 1.257 -3.955 6.305 1.00 0.00 C ATOM 1072 NE2 HIS A 187 0.186 -3.433 5.683 1.00 0.00 N ATOM 0 H HIS A 187 4.164 -6.127 2.687 1.00 0.00 H new ATOM 0 HA HIS A 187 2.032 -7.081 4.339 1.00 0.00 H new ATOM 0 HB2 HIS A 187 2.471 -4.916 2.450 1.00 0.00 H new ATOM 0 HB3 HIS A 187 0.855 -5.588 2.346 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -0.510 -3.732 3.603 1.00 0.00 H new ATOM 0 HE1 HIS A 187 1.506 -3.782 7.341 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -0.507 -2.800 6.082 1.00 0.00 H new ATOM 1080 N THR A 188 2.230 -8.566 1.467 1.00 0.00 N ATOM 1081 CA THR A 188 1.768 -9.672 0.614 1.00 0.00 C ATOM 1082 C THR A 188 2.351 -11.041 1.057 1.00 0.00 C ATOM 1083 O THR A 188 2.191 -12.061 0.379 1.00 0.00 O ATOM 1084 CB THR A 188 2.098 -9.326 -0.848 1.00 0.00 C ATOM 1085 OG1 THR A 188 1.764 -7.973 -1.111 1.00 0.00 O ATOM 1086 CG2 THR A 188 1.361 -10.155 -1.903 1.00 0.00 C ATOM 0 H THR A 188 3.137 -8.211 1.163 1.00 0.00 H new ATOM 0 HA THR A 188 0.689 -9.785 0.716 1.00 0.00 H new ATOM 0 HB THR A 188 3.163 -9.540 -0.935 1.00 0.00 H new ATOM 0 HG1 THR A 188 2.564 -7.414 -1.017 1.00 0.00 H new ATOM 0 HG21 THR A 188 1.666 -9.831 -2.898 1.00 0.00 H new ATOM 0 HG22 THR A 188 1.606 -11.209 -1.774 1.00 0.00 H new ATOM 0 HG23 THR A 188 0.286 -10.016 -1.789 1.00 0.00 H new ATOM 1094 N VAL A 189 3.076 -11.098 2.176 1.00 0.00 N ATOM 1095 CA VAL A 189 3.674 -12.315 2.729 1.00 0.00 C ATOM 1096 C VAL A 189 3.363 -12.367 4.212 1.00 0.00 C ATOM 1097 O VAL A 189 2.605 -13.229 4.638 1.00 0.00 O ATOM 1098 CB VAL A 189 5.190 -12.356 2.467 1.00 0.00 C ATOM 1099 CG1 VAL A 189 5.887 -13.499 3.221 1.00 0.00 C ATOM 1100 CG2 VAL A 189 5.492 -12.503 0.970 1.00 0.00 C ATOM 0 H VAL A 189 3.269 -10.271 2.741 1.00 0.00 H new ATOM 0 HA VAL A 189 3.251 -13.192 2.239 1.00 0.00 H new ATOM 0 HB VAL A 189 5.580 -11.407 2.834 1.00 0.00 H new ATOM 0 HG11 VAL A 189 6.954 -13.482 3.001 1.00 0.00 H new ATOM 0 HG12 VAL A 189 5.735 -13.373 4.293 1.00 0.00 H new ATOM 0 HG13 VAL A 189 5.466 -14.453 2.905 1.00 0.00 H new ATOM 0 HG21 VAL A 189 6.571 -12.529 0.817 1.00 0.00 H new ATOM 0 HG22 VAL A 189 5.051 -13.428 0.599 1.00 0.00 H new ATOM 0 HG23 VAL A 189 5.069 -11.657 0.429 1.00 0.00 H new ATOM 1110 N THR A 190 3.922 -11.443 4.989 1.00 0.00 N ATOM 1111 CA THR A 190 3.845 -11.364 6.436 1.00 0.00 C ATOM 1112 C THR A 190 2.387 -11.409 6.909 1.00 0.00 C ATOM 1113 O THR A 190 2.120 -11.959 7.975 1.00 0.00 O ATOM 1114 CB THR A 190 4.669 -10.139 6.909 1.00 0.00 C ATOM 1115 OG1 THR A 190 5.640 -10.521 7.853 1.00 0.00 O ATOM 1116 CG2 THR A 190 3.886 -8.947 7.466 1.00 0.00 C ATOM 0 H THR A 190 4.475 -10.683 4.594 1.00 0.00 H new ATOM 0 HA THR A 190 4.297 -12.236 6.909 1.00 0.00 H new ATOM 0 HB THR A 190 5.117 -9.780 5.983 1.00 0.00 H new ATOM 0 HG1 THR A 190 6.149 -9.733 8.136 1.00 0.00 H new ATOM 0 HG21 THR A 190 4.581 -8.160 7.760 1.00 0.00 H new ATOM 0 HG22 THR A 190 3.209 -8.566 6.701 1.00 0.00 H new ATOM 0 HG23 THR A 190 3.309 -9.264 8.335 1.00 0.00 H new ATOM 1124 N THR A 191 1.451 -10.926 6.090 1.00 0.00 N ATOM 1125 CA THR A 191 0.019 -10.922 6.354 1.00 0.00 C ATOM 1126 C THR A 191 -0.642 -12.104 5.601 1.00 0.00 C ATOM 1127 O THR A 191 -1.506 -12.810 6.122 1.00 0.00 O ATOM 1128 CB THR A 191 -0.548 -9.554 5.889 1.00 0.00 C ATOM 1129 OG1 THR A 191 0.443 -8.575 5.627 1.00 0.00 O ATOM 1130 CG2 THR A 191 -1.367 -8.915 7.005 1.00 0.00 C ATOM 0 H THR A 191 1.684 -10.511 5.188 1.00 0.00 H new ATOM 0 HA THR A 191 -0.191 -11.049 7.416 1.00 0.00 H new ATOM 0 HB THR A 191 -1.110 -9.797 4.987 1.00 0.00 H new ATOM 0 HG1 THR A 191 0.385 -8.294 4.690 1.00 0.00 H new ATOM 0 HG21 THR A 191 -1.759 -7.956 6.666 1.00 0.00 H new ATOM 0 HG22 THR A 191 -2.195 -9.572 7.270 1.00 0.00 H new ATOM 0 HG23 THR A 191 -0.733 -8.759 7.878 1.00 0.00 H new ATOM 1138 N THR A 192 -0.214 -12.364 4.367 1.00 0.00 N ATOM 1139 CA THR A 192 -0.831 -13.300 3.424 1.00 0.00 C ATOM 1140 C THR A 192 -0.650 -14.760 3.831 1.00 0.00 C ATOM 1141 O THR A 192 -1.531 -15.592 3.607 1.00 0.00 O ATOM 1142 CB THR A 192 -0.212 -12.995 2.056 1.00 0.00 C ATOM 1143 OG1 THR A 192 -0.523 -11.651 1.733 1.00 0.00 O ATOM 1144 CG2 THR A 192 -0.621 -13.889 0.882 1.00 0.00 C ATOM 0 H THR A 192 0.611 -11.907 3.978 1.00 0.00 H new ATOM 0 HA THR A 192 -1.912 -13.164 3.404 1.00 0.00 H new ATOM 0 HB THR A 192 0.853 -13.193 2.178 1.00 0.00 H new ATOM 0 HG1 THR A 192 -1.237 -11.330 2.322 1.00 0.00 H new ATOM 0 HG21 THR A 192 -0.108 -13.560 -0.022 1.00 0.00 H new ATOM 0 HG22 THR A 192 -0.348 -14.922 1.099 1.00 0.00 H new ATOM 0 HG23 THR A 192 -1.699 -13.823 0.732 1.00 0.00 H new ATOM 1152 N THR A 193 0.458 -15.041 4.501 1.00 0.00 N ATOM 1153 CA THR A 193 0.778 -16.288 5.169 1.00 0.00 C ATOM 1154 C THR A 193 -0.383 -16.727 6.063 1.00 0.00 C ATOM 1155 O THR A 193 -0.749 -17.901 6.056 1.00 0.00 O ATOM 1156 CB THR A 193 2.102 -16.060 5.916 1.00 0.00 C ATOM 1157 OG1 THR A 193 2.670 -17.260 6.381 1.00 0.00 O ATOM 1158 CG2 THR A 193 2.019 -15.039 7.054 1.00 0.00 C ATOM 0 H THR A 193 1.207 -14.355 4.597 1.00 0.00 H new ATOM 0 HA THR A 193 0.913 -17.114 4.471 1.00 0.00 H new ATOM 0 HB THR A 193 2.760 -15.630 5.161 1.00 0.00 H new ATOM 0 HG1 THR A 193 3.510 -17.065 6.847 1.00 0.00 H new ATOM 0 HG21 THR A 193 2.996 -14.940 7.526 1.00 0.00 H new ATOM 0 HG22 THR A 193 1.710 -14.073 6.654 1.00 0.00 H new ATOM 0 HG23 THR A 193 1.292 -15.376 7.793 1.00 0.00 H new ATOM 1166 N LYS A 194 -1.028 -15.781 6.753 1.00 0.00 N ATOM 1167 CA LYS A 194 -2.148 -16.067 7.633 1.00 0.00 C ATOM 1168 C LYS A 194 -3.345 -16.267 6.717 1.00 0.00 C ATOM 1169 O LYS A 194 -3.761 -17.395 6.455 1.00 0.00 O ATOM 1170 CB LYS A 194 -2.338 -14.979 8.699 1.00 0.00 C ATOM 1171 CG LYS A 194 -1.010 -14.440 9.282 1.00 0.00 C ATOM 1172 CD LYS A 194 -0.852 -12.935 9.151 1.00 0.00 C ATOM 1173 CE LYS A 194 -0.451 -12.277 10.475 1.00 0.00 C ATOM 1174 NZ LYS A 194 -0.517 -10.801 10.422 1.00 0.00 N ATOM 0 H LYS A 194 -0.781 -14.792 6.711 1.00 0.00 H new ATOM 0 HA LYS A 194 -1.985 -16.965 8.229 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -2.896 -14.150 8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -2.944 -15.380 9.511 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -0.949 -14.712 10.336 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -0.177 -14.929 8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -0.098 -12.715 8.395 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -1.789 -12.502 8.802 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -1.106 -12.638 11.268 1.00 0.00 H new ATOM 0 HE3 LYS A 194 0.563 -12.582 10.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -0.236 -10.408 11.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 0.128 -10.451 9.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.489 -10.505 10.201 1.00 0.00 H new ATOM 1188 N GLY A 195 -3.786 -15.179 6.089 1.00 0.00 N ATOM 1189 CA GLY A 195 -4.776 -15.195 5.031 1.00 0.00 C ATOM 1190 C GLY A 195 -5.209 -13.777 4.684 1.00 0.00 C ATOM 1191 O GLY A 195 -6.398 -13.545 4.444 1.00 0.00 O ATOM 0 H GLY A 195 -3.452 -14.242 6.313 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -4.364 -15.682 4.147 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -5.641 -15.780 5.343 1.00 0.00 H new ATOM 1195 N GLU A 196 -4.278 -12.821 4.720 1.00 0.00 N ATOM 1196 CA GLU A 196 -4.539 -11.425 4.417 1.00 0.00 C ATOM 1197 C GLU A 196 -3.886 -11.045 3.108 1.00 0.00 C ATOM 1198 O GLU A 196 -2.665 -10.904 3.024 1.00 0.00 O ATOM 1199 CB GLU A 196 -4.092 -10.541 5.567 1.00 0.00 C ATOM 1200 CG GLU A 196 -4.361 -9.049 5.282 1.00 0.00 C ATOM 1201 CD GLU A 196 -4.578 -8.191 6.537 1.00 0.00 C ATOM 1202 OE1 GLU A 196 -4.619 -8.733 7.674 1.00 0.00 O ATOM 1203 OE2 GLU A 196 -4.705 -6.955 6.380 1.00 0.00 O ATOM 0 H GLU A 196 -3.306 -13.006 4.966 1.00 0.00 H new ATOM 0 HA GLU A 196 -5.612 -11.274 4.298 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -4.614 -10.837 6.477 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -3.027 -10.690 5.747 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -3.521 -8.642 4.720 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -5.241 -8.967 4.644 1.00 0.00 H new ATOM 1210 N ASN A 197 -4.713 -10.901 2.082 1.00 0.00 N ATOM 1211 CA ASN A 197 -4.306 -10.464 0.764 1.00 0.00 C ATOM 1212 C ASN A 197 -5.189 -9.315 0.301 1.00 0.00 C ATOM 1213 O ASN A 197 -6.040 -8.813 1.046 1.00 0.00 O ATOM 1214 CB ASN A 197 -4.328 -11.647 -0.222 1.00 0.00 C ATOM 1215 CG ASN A 197 -3.194 -11.576 -1.234 1.00 0.00 C ATOM 1216 OD1 ASN A 197 -3.403 -11.685 -2.438 1.00 0.00 O ATOM 1217 ND2 ASN A 197 -1.970 -11.371 -0.786 1.00 0.00 N ATOM 0 H ASN A 197 -5.713 -11.092 2.151 1.00 0.00 H new ATOM 0 HA ASN A 197 -3.281 -10.096 0.803 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -4.258 -12.582 0.334 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -5.282 -11.660 -0.749 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -1.192 -11.302 -1.442 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -1.802 -11.281 0.216 1.00 0.00 H new ATOM 1224 N PHE A 198 -4.972 -8.906 -0.942 1.00 0.00 N ATOM 1225 CA PHE A 198 -5.601 -7.778 -1.596 1.00 0.00 C ATOM 1226 C PHE A 198 -5.906 -8.203 -3.032 1.00 0.00 C ATOM 1227 O PHE A 198 -5.467 -9.286 -3.441 1.00 0.00 O ATOM 1228 CB PHE A 198 -4.653 -6.576 -1.551 1.00 0.00 C ATOM 1229 CG PHE A 198 -3.783 -6.432 -0.320 1.00 0.00 C ATOM 1230 CD1 PHE A 198 -2.531 -7.075 -0.264 1.00 0.00 C ATOM 1231 CD2 PHE A 198 -4.230 -5.661 0.768 1.00 0.00 C ATOM 1232 CE1 PHE A 198 -1.749 -6.977 0.900 1.00 0.00 C ATOM 1233 CE2 PHE A 198 -3.422 -5.523 1.907 1.00 0.00 C ATOM 1234 CZ PHE A 198 -2.192 -6.199 1.984 1.00 0.00 C ATOM 0 H PHE A 198 -4.311 -9.386 -1.553 1.00 0.00 H new ATOM 0 HA PHE A 198 -6.526 -7.483 -1.100 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -4.001 -6.626 -2.423 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -5.250 -5.670 -1.652 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -2.173 -7.641 -1.112 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -5.194 -5.176 0.727 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -0.806 -7.500 0.962 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -3.746 -4.897 2.725 1.00 0.00 H new ATOM 0 HZ PHE A 198 -1.587 -6.121 2.876 1.00 0.00 H new ATOM 1244 N THR A 199 -6.644 -7.410 -3.801 1.00 0.00 N ATOM 1245 CA THR A 199 -6.865 -7.726 -5.207 1.00 0.00 C ATOM 1246 C THR A 199 -5.745 -7.148 -6.058 1.00 0.00 C ATOM 1247 O THR A 199 -5.037 -6.249 -5.628 1.00 0.00 O ATOM 1248 CB THR A 199 -8.228 -7.199 -5.658 1.00 0.00 C ATOM 1249 OG1 THR A 199 -8.353 -5.818 -5.377 1.00 0.00 O ATOM 1250 CG2 THR A 199 -9.332 -8.013 -4.979 1.00 0.00 C ATOM 0 H THR A 199 -7.095 -6.553 -3.479 1.00 0.00 H new ATOM 0 HA THR A 199 -6.861 -8.809 -5.333 1.00 0.00 H new ATOM 0 HB THR A 199 -8.322 -7.314 -6.738 1.00 0.00 H new ATOM 0 HG1 THR A 199 -9.231 -5.502 -5.675 1.00 0.00 H new ATOM 0 HG21 THR A 199 -10.306 -7.641 -5.297 1.00 0.00 H new ATOM 0 HG22 THR A 199 -9.235 -9.062 -5.259 1.00 0.00 H new ATOM 0 HG23 THR A 199 -9.242 -7.916 -3.897 1.00 0.00 H new ATOM 1258 N GLU A 200 -5.646 -7.576 -7.313 1.00 0.00 N ATOM 1259 CA GLU A 200 -4.770 -6.996 -8.328 1.00 0.00 C ATOM 1260 C GLU A 200 -4.869 -5.464 -8.378 1.00 0.00 C ATOM 1261 O GLU A 200 -3.862 -4.776 -8.540 1.00 0.00 O ATOM 1262 CB GLU A 200 -5.231 -7.609 -9.647 1.00 0.00 C ATOM 1263 CG GLU A 200 -4.449 -7.182 -10.890 1.00 0.00 C ATOM 1264 CD GLU A 200 -5.191 -7.721 -12.108 1.00 0.00 C ATOM 1265 OE1 GLU A 200 -6.203 -7.092 -12.493 1.00 0.00 O ATOM 1266 OE2 GLU A 200 -4.869 -8.841 -12.568 1.00 0.00 O ATOM 0 H GLU A 200 -6.192 -8.363 -7.664 1.00 0.00 H new ATOM 0 HA GLU A 200 -3.724 -7.211 -8.109 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -5.175 -8.694 -9.561 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -6.280 -7.355 -9.796 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -4.371 -6.096 -10.939 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -3.432 -7.574 -10.856 1.00 0.00 H new ATOM 1273 N THR A 201 -6.082 -4.927 -8.218 1.00 0.00 N ATOM 1274 CA THR A 201 -6.308 -3.492 -8.156 1.00 0.00 C ATOM 1275 C THR A 201 -5.629 -2.925 -6.911 1.00 0.00 C ATOM 1276 O THR A 201 -4.803 -2.031 -7.042 1.00 0.00 O ATOM 1277 CB THR A 201 -7.816 -3.219 -8.185 1.00 0.00 C ATOM 1278 OG1 THR A 201 -8.336 -3.837 -9.348 1.00 0.00 O ATOM 1279 CG2 THR A 201 -8.131 -1.725 -8.240 1.00 0.00 C ATOM 0 H THR A 201 -6.933 -5.482 -8.128 1.00 0.00 H new ATOM 0 HA THR A 201 -5.869 -2.991 -9.019 1.00 0.00 H new ATOM 0 HB THR A 201 -8.263 -3.614 -7.273 1.00 0.00 H new ATOM 0 HG1 THR A 201 -9.303 -3.682 -9.396 1.00 0.00 H new ATOM 0 HG21 THR A 201 -9.211 -1.581 -8.259 1.00 0.00 H new ATOM 0 HG22 THR A 201 -7.715 -1.233 -7.361 1.00 0.00 H new ATOM 0 HG23 THR A 201 -7.692 -1.293 -9.139 1.00 0.00 H new ATOM 1287 N ASP A 202 -5.906 -3.442 -5.712 1.00 0.00 N ATOM 1288 CA ASP A 202 -5.230 -2.984 -4.501 1.00 0.00 C ATOM 1289 C ASP A 202 -3.717 -3.046 -4.687 1.00 0.00 C ATOM 1290 O ASP A 202 -3.019 -2.087 -4.371 1.00 0.00 O ATOM 1291 CB ASP A 202 -5.580 -3.860 -3.306 1.00 0.00 C ATOM 1292 CG ASP A 202 -7.036 -3.845 -2.870 1.00 0.00 C ATOM 1293 OD1 ASP A 202 -7.652 -2.755 -2.837 1.00 0.00 O ATOM 1294 OD2 ASP A 202 -7.558 -4.933 -2.541 1.00 0.00 O ATOM 0 H ASP A 202 -6.594 -4.178 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 202 -5.559 -1.961 -4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -5.303 -4.888 -3.541 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -4.966 -3.549 -2.461 1.00 0.00 H new ATOM 1299 N VAL A 203 -3.221 -4.155 -5.238 1.00 0.00 N ATOM 1300 CA VAL A 203 -1.811 -4.434 -5.471 1.00 0.00 C ATOM 1301 C VAL A 203 -1.187 -3.371 -6.380 1.00 0.00 C ATOM 1302 O VAL A 203 -0.092 -2.889 -6.074 1.00 0.00 O ATOM 1303 CB VAL A 203 -1.662 -5.883 -5.985 1.00 0.00 C ATOM 1304 CG1 VAL A 203 -0.225 -6.275 -6.327 1.00 0.00 C ATOM 1305 CG2 VAL A 203 -2.102 -6.897 -4.922 1.00 0.00 C ATOM 0 H VAL A 203 -3.824 -4.917 -5.547 1.00 0.00 H new ATOM 0 HA VAL A 203 -1.247 -4.370 -4.540 1.00 0.00 H new ATOM 0 HB VAL A 203 -2.283 -5.906 -6.880 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -0.203 -7.306 -6.680 1.00 0.00 H new ATOM 0 HG12 VAL A 203 0.156 -5.616 -7.107 1.00 0.00 H new ATOM 0 HG13 VAL A 203 0.399 -6.183 -5.438 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -1.986 -7.908 -5.313 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -1.486 -6.780 -4.030 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -3.147 -6.725 -4.666 1.00 0.00 H new ATOM 1315 N LYS A 204 -1.860 -2.958 -7.464 1.00 0.00 N ATOM 1316 CA LYS A 204 -1.312 -1.890 -8.302 1.00 0.00 C ATOM 1317 C LYS A 204 -1.304 -0.546 -7.579 1.00 0.00 C ATOM 1318 O LYS A 204 -0.354 0.223 -7.719 1.00 0.00 O ATOM 1319 CB LYS A 204 -1.916 -1.838 -9.711 1.00 0.00 C ATOM 1320 CG LYS A 204 -3.323 -1.264 -9.745 1.00 0.00 C ATOM 1321 CD LYS A 204 -3.869 -0.840 -11.121 1.00 0.00 C ATOM 1322 CE LYS A 204 -3.476 0.626 -11.370 1.00 0.00 C ATOM 1323 NZ LYS A 204 -4.069 1.241 -12.577 1.00 0.00 N ATOM 0 H LYS A 204 -2.756 -3.335 -7.772 1.00 0.00 H new ATOM 0 HA LYS A 204 -0.266 -2.144 -8.477 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -1.271 -1.237 -10.353 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -1.932 -2.845 -10.128 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -4.002 -2.005 -9.324 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -3.351 -0.396 -9.087 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -3.462 -1.480 -11.904 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -4.953 -0.952 -11.150 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -3.767 1.216 -10.501 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -2.390 0.686 -11.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -3.574 2.130 -12.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -3.975 0.588 -13.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -5.076 1.439 -12.407 1.00 0.00 H new ATOM 1337 N MET A 205 -2.347 -0.255 -6.804 1.00 0.00 N ATOM 1338 CA MET A 205 -2.491 1.038 -6.148 1.00 0.00 C ATOM 1339 C MET A 205 -1.466 1.134 -5.018 1.00 0.00 C ATOM 1340 O MET A 205 -0.914 2.201 -4.748 1.00 0.00 O ATOM 1341 CB MET A 205 -3.921 1.212 -5.621 1.00 0.00 C ATOM 1342 CG MET A 205 -4.981 1.048 -6.717 1.00 0.00 C ATOM 1343 SD MET A 205 -5.128 2.335 -7.961 1.00 0.00 S ATOM 1344 CE MET A 205 -6.254 3.382 -7.044 1.00 0.00 C ATOM 0 H MET A 205 -3.110 -0.905 -6.615 1.00 0.00 H new ATOM 0 HA MET A 205 -2.307 1.841 -6.862 1.00 0.00 H new ATOM 0 HB2 MET A 205 -4.104 0.482 -4.832 1.00 0.00 H new ATOM 0 HB3 MET A 205 -4.020 2.200 -5.171 1.00 0.00 H new ATOM 0 HG2 MET A 205 -4.783 0.108 -7.233 1.00 0.00 H new ATOM 0 HG3 MET A 205 -5.950 0.945 -6.229 1.00 0.00 H new ATOM 0 HE1 MET A 205 -6.068 4.426 -7.296 1.00 0.00 H new ATOM 0 HE2 MET A 205 -7.281 3.124 -7.301 1.00 0.00 H new ATOM 0 HE3 MET A 205 -6.100 3.234 -5.975 1.00 0.00 H new ATOM 1354 N MET A 206 -1.183 0.002 -4.373 1.00 0.00 N ATOM 1355 CA MET A 206 -0.084 -0.160 -3.442 1.00 0.00 C ATOM 1356 C MET A 206 1.230 0.216 -4.108 1.00 0.00 C ATOM 1357 O MET A 206 1.894 1.080 -3.561 1.00 0.00 O ATOM 1358 CB MET A 206 -0.023 -1.577 -2.859 1.00 0.00 C ATOM 1359 CG MET A 206 -0.988 -1.744 -1.679 1.00 0.00 C ATOM 1360 SD MET A 206 -0.764 -3.251 -0.694 1.00 0.00 S ATOM 1361 CE MET A 206 -1.031 -4.517 -1.964 1.00 0.00 C ATOM 0 H MET A 206 -1.733 -0.848 -4.493 1.00 0.00 H new ATOM 0 HA MET A 206 -0.258 0.516 -2.605 1.00 0.00 H new ATOM 0 HB2 MET A 206 -0.268 -2.301 -3.636 1.00 0.00 H new ATOM 0 HB3 MET A 206 0.994 -1.793 -2.531 1.00 0.00 H new ATOM 0 HG2 MET A 206 -0.882 -0.882 -1.021 1.00 0.00 H new ATOM 0 HG3 MET A 206 -2.008 -1.729 -2.062 1.00 0.00 H new ATOM 0 HE1 MET A 206 -0.756 -5.494 -1.567 1.00 0.00 H new ATOM 0 HE2 MET A 206 -2.082 -4.526 -2.254 1.00 0.00 H new ATOM 0 HE3 MET A 206 -0.416 -4.293 -2.836 1.00 0.00 H new ATOM 1371 N GLU A 207 1.608 -0.308 -5.279 1.00 0.00 N ATOM 1372 CA GLU A 207 2.864 0.095 -5.923 1.00 0.00 C ATOM 1373 C GLU A 207 3.006 1.613 -6.077 1.00 0.00 C ATOM 1374 O GLU A 207 4.131 2.115 -6.041 1.00 0.00 O ATOM 1375 CB GLU A 207 2.983 -0.546 -7.302 1.00 0.00 C ATOM 1376 CG GLU A 207 3.321 -2.035 -7.272 1.00 0.00 C ATOM 1377 CD GLU A 207 2.992 -2.712 -8.603 1.00 0.00 C ATOM 1378 OE1 GLU A 207 1.830 -3.133 -8.786 1.00 0.00 O ATOM 1379 OE2 GLU A 207 3.890 -2.853 -9.461 1.00 0.00 O ATOM 0 H GLU A 207 1.070 -1.004 -5.795 1.00 0.00 H new ATOM 0 HA GLU A 207 3.661 -0.249 -5.264 1.00 0.00 H new ATOM 0 HB2 GLU A 207 2.043 -0.409 -7.837 1.00 0.00 H new ATOM 0 HB3 GLU A 207 3.752 -0.021 -7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 207 4.380 -2.164 -7.049 1.00 0.00 H new ATOM 0 HG3 GLU A 207 2.765 -2.519 -6.469 1.00 0.00 H new ATOM 1386 N ARG A 208 1.906 2.359 -6.241 1.00 0.00 N ATOM 1387 CA ARG A 208 1.981 3.812 -6.331 1.00 0.00 C ATOM 1388 C ARG A 208 2.299 4.387 -4.960 1.00 0.00 C ATOM 1389 O ARG A 208 3.244 5.168 -4.815 1.00 0.00 O ATOM 1390 CB ARG A 208 0.651 4.400 -6.831 1.00 0.00 C ATOM 1391 CG ARG A 208 0.479 4.307 -8.343 1.00 0.00 C ATOM 1392 CD ARG A 208 1.002 5.539 -9.084 1.00 0.00 C ATOM 1393 NE ARG A 208 2.304 5.276 -9.733 1.00 0.00 N ATOM 1394 CZ ARG A 208 2.530 4.453 -10.766 1.00 0.00 C ATOM 1395 NH1 ARG A 208 1.521 3.940 -11.443 1.00 0.00 N ATOM 1396 NH2 ARG A 208 3.757 4.114 -11.136 1.00 0.00 N ATOM 0 H ARG A 208 0.962 1.978 -6.313 1.00 0.00 H new ATOM 0 HA ARG A 208 2.766 4.074 -7.040 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -0.174 3.878 -6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 208 0.588 5.445 -6.529 1.00 0.00 H new ATOM 0 HG2 ARG A 208 1.001 3.422 -8.708 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -0.578 4.172 -8.575 1.00 0.00 H new ATOM 0 HD2 ARG A 208 0.276 5.846 -9.837 1.00 0.00 H new ATOM 0 HD3 ARG A 208 1.105 6.368 -8.384 1.00 0.00 H new ATOM 0 HE ARG A 208 3.112 5.771 -9.356 1.00 0.00 H new ATOM 0 HH11 ARG A 208 0.562 4.169 -11.181 1.00 0.00 H new ATOM 0 HH12 ARG A 208 1.700 3.314 -12.228 1.00 0.00 H new ATOM 0 HH21 ARG A 208 4.562 4.482 -10.630 1.00 0.00 H new ATOM 0 HH22 ARG A 208 3.896 3.485 -11.927 1.00 0.00 H new ATOM 1410 N VAL A 209 1.479 4.041 -3.967 1.00 0.00 N ATOM 1411 CA VAL A 209 1.558 4.637 -2.645 1.00 0.00 C ATOM 1412 C VAL A 209 2.824 4.212 -1.926 1.00 0.00 C ATOM 1413 O VAL A 209 3.436 5.020 -1.228 1.00 0.00 O ATOM 1414 CB VAL A 209 0.276 4.320 -1.854 1.00 0.00 C ATOM 1415 CG1 VAL A 209 0.287 3.106 -0.927 1.00 0.00 C ATOM 1416 CG2 VAL A 209 -0.117 5.546 -1.043 1.00 0.00 C ATOM 0 H VAL A 209 0.744 3.340 -4.062 1.00 0.00 H new ATOM 0 HA VAL A 209 1.621 5.721 -2.739 1.00 0.00 H new ATOM 0 HB VAL A 209 -0.443 4.052 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -0.683 3.011 -0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 209 0.491 2.206 -1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 209 1.062 3.233 -0.171 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -1.025 5.333 -0.478 1.00 0.00 H new ATOM 0 HG22 VAL A 209 0.688 5.800 -0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -0.297 6.385 -1.715 1.00 0.00 H new ATOM 1426 N VAL A 210 3.203 2.946 -2.085 1.00 0.00 N ATOM 1427 CA VAL A 210 4.340 2.363 -1.429 1.00 0.00 C ATOM 1428 C VAL A 210 5.561 3.111 -1.960 1.00 0.00 C ATOM 1429 O VAL A 210 6.367 3.564 -1.156 1.00 0.00 O ATOM 1430 CB VAL A 210 4.400 0.829 -1.654 1.00 0.00 C ATOM 1431 CG1 VAL A 210 5.680 0.192 -1.091 1.00 0.00 C ATOM 1432 CG2 VAL A 210 3.208 0.085 -1.018 1.00 0.00 C ATOM 0 H VAL A 210 2.707 2.293 -2.691 1.00 0.00 H new ATOM 0 HA VAL A 210 4.287 2.469 -0.345 1.00 0.00 H new ATOM 0 HB VAL A 210 4.375 0.721 -2.738 1.00 0.00 H new ATOM 0 HG11 VAL A 210 5.665 -0.882 -1.278 1.00 0.00 H new ATOM 0 HG12 VAL A 210 6.550 0.633 -1.577 1.00 0.00 H new ATOM 0 HG13 VAL A 210 5.734 0.372 -0.017 1.00 0.00 H new ATOM 0 HG21 VAL A 210 3.303 -0.984 -1.208 1.00 0.00 H new ATOM 0 HG22 VAL A 210 3.199 0.264 0.057 1.00 0.00 H new ATOM 0 HG23 VAL A 210 2.278 0.449 -1.454 1.00 0.00 H new ATOM 1442 N GLU A 211 5.656 3.312 -3.286 1.00 0.00 N ATOM 1443 CA GLU A 211 6.695 4.133 -3.896 1.00 0.00 C ATOM 1444 C GLU A 211 6.674 5.531 -3.273 1.00 0.00 C ATOM 1445 O GLU A 211 7.676 5.924 -2.700 1.00 0.00 O ATOM 1446 CB GLU A 211 6.577 4.144 -5.434 1.00 0.00 C ATOM 1447 CG GLU A 211 7.743 4.883 -6.113 1.00 0.00 C ATOM 1448 CD GLU A 211 7.568 5.002 -7.632 1.00 0.00 C ATOM 1449 OE1 GLU A 211 6.679 5.784 -8.051 1.00 0.00 O ATOM 1450 OE2 GLU A 211 8.296 4.327 -8.405 1.00 0.00 O ATOM 0 H GLU A 211 5.008 2.904 -3.960 1.00 0.00 H new ATOM 0 HA GLU A 211 7.672 3.698 -3.687 1.00 0.00 H new ATOM 0 HB2 GLU A 211 6.541 3.118 -5.799 1.00 0.00 H new ATOM 0 HB3 GLU A 211 5.637 4.617 -5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 211 7.834 5.881 -5.683 1.00 0.00 H new ATOM 0 HG3 GLU A 211 8.674 4.358 -5.899 1.00 0.00 H new ATOM 1457 N GLN A 212 5.578 6.289 -3.340 1.00 0.00 N ATOM 1458 CA GLN A 212 5.571 7.677 -2.872 1.00 0.00 C ATOM 1459 C GLN A 212 5.932 7.825 -1.386 1.00 0.00 C ATOM 1460 O GLN A 212 6.644 8.771 -1.022 1.00 0.00 O ATOM 1461 CB GLN A 212 4.214 8.293 -3.216 1.00 0.00 C ATOM 1462 CG GLN A 212 4.134 8.516 -4.738 1.00 0.00 C ATOM 1463 CD GLN A 212 4.276 9.972 -5.167 1.00 0.00 C ATOM 1464 OE1 GLN A 212 4.831 10.814 -4.466 1.00 0.00 O ATOM 1465 NE2 GLN A 212 3.797 10.289 -6.354 1.00 0.00 N ATOM 0 H GLN A 212 4.685 5.966 -3.713 1.00 0.00 H new ATOM 0 HA GLN A 212 6.360 8.224 -3.388 1.00 0.00 H new ATOM 0 HB2 GLN A 212 3.409 7.635 -2.889 1.00 0.00 H new ATOM 0 HB3 GLN A 212 4.086 9.239 -2.690 1.00 0.00 H new ATOM 0 HG2 GLN A 212 4.915 7.929 -5.221 1.00 0.00 H new ATOM 0 HG3 GLN A 212 3.179 8.134 -5.100 1.00 0.00 H new ATOM 0 HE21 GLN A 212 3.339 9.579 -6.925 1.00 0.00 H new ATOM 0 HE22 GLN A 212 3.885 11.244 -6.701 1.00 0.00 H new ATOM 1474 N MET A 213 5.497 6.901 -0.523 1.00 0.00 N ATOM 1475 CA MET A 213 5.963 6.859 0.859 1.00 0.00 C ATOM 1476 C MET A 213 7.446 6.520 0.933 1.00 0.00 C ATOM 1477 O MET A 213 8.168 7.242 1.614 1.00 0.00 O ATOM 1478 CB MET A 213 5.170 5.850 1.685 1.00 0.00 C ATOM 1479 CG MET A 213 3.752 6.387 1.944 1.00 0.00 C ATOM 1480 SD MET A 213 2.815 5.674 3.324 1.00 0.00 S ATOM 1481 CE MET A 213 2.748 3.970 2.746 1.00 0.00 C ATOM 0 H MET A 213 4.823 6.174 -0.761 1.00 0.00 H new ATOM 0 HA MET A 213 5.806 7.854 1.275 1.00 0.00 H new ATOM 0 HB2 MET A 213 5.117 4.897 1.159 1.00 0.00 H new ATOM 0 HB3 MET A 213 5.677 5.663 2.632 1.00 0.00 H new ATOM 0 HG2 MET A 213 3.826 7.462 2.110 1.00 0.00 H new ATOM 0 HG3 MET A 213 3.169 6.244 1.034 1.00 0.00 H new ATOM 0 HE1 MET A 213 1.862 3.482 3.153 1.00 0.00 H new ATOM 0 HE2 MET A 213 2.701 3.957 1.657 1.00 0.00 H new ATOM 0 HE3 MET A 213 3.640 3.438 3.077 1.00 0.00 H new ATOM 1491 N CYS A 214 7.911 5.479 0.236 1.00 0.00 N ATOM 1492 CA CYS A 214 9.313 5.084 0.204 1.00 0.00 C ATOM 1493 C CYS A 214 10.188 6.247 -0.248 1.00 0.00 C ATOM 1494 O CYS A 214 11.206 6.535 0.377 1.00 0.00 O ATOM 1495 CB CYS A 214 9.527 3.874 -0.718 1.00 0.00 C ATOM 1496 SG CYS A 214 9.041 2.257 -0.061 1.00 0.00 S ATOM 0 H CYS A 214 7.310 4.880 -0.330 1.00 0.00 H new ATOM 0 HA CYS A 214 9.601 4.799 1.216 1.00 0.00 H new ATOM 0 HB2 CYS A 214 8.974 4.047 -1.641 1.00 0.00 H new ATOM 0 HB3 CYS A 214 10.583 3.830 -0.983 1.00 0.00 H new ATOM 0 HG CYS A 214 10.027 1.420 -0.195 1.00 0.00 H new ATOM 1501 N VAL A 215 9.786 6.924 -1.317 1.00 0.00 N ATOM 1502 CA VAL A 215 10.476 8.060 -1.917 1.00 0.00 C ATOM 1503 C VAL A 215 10.605 9.150 -0.858 1.00 0.00 C ATOM 1504 O VAL A 215 11.690 9.687 -0.655 1.00 0.00 O ATOM 1505 CB VAL A 215 9.672 8.521 -3.154 1.00 0.00 C ATOM 1506 CG1 VAL A 215 10.093 9.887 -3.709 1.00 0.00 C ATOM 1507 CG2 VAL A 215 9.808 7.522 -4.319 1.00 0.00 C ATOM 0 H VAL A 215 8.928 6.684 -1.813 1.00 0.00 H new ATOM 0 HA VAL A 215 11.480 7.802 -2.254 1.00 0.00 H new ATOM 0 HB VAL A 215 8.648 8.586 -2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 215 9.478 10.133 -4.575 1.00 0.00 H new ATOM 0 HG12 VAL A 215 9.959 10.649 -2.941 1.00 0.00 H new ATOM 0 HG13 VAL A 215 11.141 9.852 -4.006 1.00 0.00 H new ATOM 0 HG21 VAL A 215 9.230 7.877 -5.172 1.00 0.00 H new ATOM 0 HG22 VAL A 215 10.857 7.434 -4.602 1.00 0.00 H new ATOM 0 HG23 VAL A 215 9.433 6.547 -4.008 1.00 0.00 H new ATOM 1517 N THR A 216 9.516 9.458 -0.155 1.00 0.00 N ATOM 1518 CA THR A 216 9.543 10.472 0.878 1.00 0.00 C ATOM 1519 C THR A 216 10.424 10.041 2.044 1.00 0.00 C ATOM 1520 O THR A 216 11.283 10.818 2.434 1.00 0.00 O ATOM 1521 CB THR A 216 8.117 10.757 1.333 1.00 0.00 C ATOM 1522 OG1 THR A 216 7.366 11.209 0.223 1.00 0.00 O ATOM 1523 CG2 THR A 216 8.103 11.764 2.500 1.00 0.00 C ATOM 0 H THR A 216 8.607 9.015 -0.288 1.00 0.00 H new ATOM 0 HA THR A 216 9.976 11.388 0.475 1.00 0.00 H new ATOM 0 HB THR A 216 7.657 9.844 1.712 1.00 0.00 H new ATOM 0 HG1 THR A 216 7.069 10.440 -0.306 1.00 0.00 H new ATOM 0 HG21 THR A 216 7.074 11.951 2.807 1.00 0.00 H new ATOM 0 HG22 THR A 216 8.664 11.355 3.340 1.00 0.00 H new ATOM 0 HG23 THR A 216 8.562 12.699 2.179 1.00 0.00 H new ATOM 1531 N GLN A 217 10.216 8.855 2.626 1.00 0.00 N ATOM 1532 CA GLN A 217 10.965 8.430 3.799 1.00 0.00 C ATOM 1533 C GLN A 217 12.458 8.416 3.441 1.00 0.00 C ATOM 1534 O GLN A 217 13.260 8.958 4.189 1.00 0.00 O ATOM 1535 CB GLN A 217 10.410 7.087 4.328 1.00 0.00 C ATOM 1536 CG GLN A 217 10.709 6.846 5.823 1.00 0.00 C ATOM 1537 CD GLN A 217 9.460 6.456 6.630 1.00 0.00 C ATOM 1538 OE1 GLN A 217 8.935 5.351 6.527 1.00 0.00 O ATOM 1539 NE2 GLN A 217 8.936 7.340 7.461 1.00 0.00 N ATOM 0 H GLN A 217 9.531 8.175 2.297 1.00 0.00 H new ATOM 0 HA GLN A 217 10.847 9.127 4.629 1.00 0.00 H new ATOM 0 HB2 GLN A 217 9.331 7.062 4.172 1.00 0.00 H new ATOM 0 HB3 GLN A 217 10.836 6.271 3.744 1.00 0.00 H new ATOM 0 HG2 GLN A 217 11.456 6.057 5.916 1.00 0.00 H new ATOM 0 HG3 GLN A 217 11.144 7.749 6.251 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.360 8.263 7.558 1.00 0.00 H new ATOM 0 HE22 GLN A 217 8.107 7.100 8.005 1.00 0.00 H new ATOM 1548 N TYR A 218 12.830 7.924 2.255 1.00 0.00 N ATOM 1549 CA TYR A 218 14.169 8.069 1.712 1.00 0.00 C ATOM 1550 C TYR A 218 14.627 9.520 1.687 1.00 0.00 C ATOM 1551 O TYR A 218 15.647 9.816 2.298 1.00 0.00 O ATOM 1552 CB TYR A 218 14.227 7.468 0.313 1.00 0.00 C ATOM 1553 CG TYR A 218 15.520 7.740 -0.438 1.00 0.00 C ATOM 1554 CD1 TYR A 218 16.759 7.412 0.147 1.00 0.00 C ATOM 1555 CD2 TYR A 218 15.484 8.319 -1.722 1.00 0.00 C ATOM 1556 CE1 TYR A 218 17.955 7.688 -0.531 1.00 0.00 C ATOM 1557 CE2 TYR A 218 16.680 8.588 -2.411 1.00 0.00 C ATOM 1558 CZ TYR A 218 17.920 8.300 -1.802 1.00 0.00 C ATOM 1559 OH TYR A 218 19.072 8.631 -2.440 1.00 0.00 O ATOM 0 H TYR A 218 12.196 7.409 1.644 1.00 0.00 H new ATOM 0 HA TYR A 218 14.852 7.531 2.369 1.00 0.00 H new ATOM 0 HB2 TYR A 218 14.086 6.390 0.389 1.00 0.00 H new ATOM 0 HB3 TYR A 218 13.394 7.858 -0.271 1.00 0.00 H new ATOM 0 HD1 TYR A 218 16.788 6.946 1.121 1.00 0.00 H new ATOM 0 HD2 TYR A 218 14.535 8.557 -2.179 1.00 0.00 H new ATOM 0 HE1 TYR A 218 18.903 7.432 -0.081 1.00 0.00 H new ATOM 0 HE2 TYR A 218 16.650 9.014 -3.403 1.00 0.00 H new ATOM 0 HH TYR A 218 18.861 9.042 -3.304 1.00 0.00 H new ATOM 1569 N GLN A 219 13.924 10.421 0.993 1.00 0.00 N ATOM 1570 CA GLN A 219 14.326 11.822 0.906 1.00 0.00 C ATOM 1571 C GLN A 219 14.462 12.445 2.301 1.00 0.00 C ATOM 1572 O GLN A 219 15.400 13.200 2.532 1.00 0.00 O ATOM 1573 CB GLN A 219 13.368 12.632 0.015 1.00 0.00 C ATOM 1574 CG GLN A 219 13.527 12.321 -1.488 1.00 0.00 C ATOM 1575 CD GLN A 219 12.859 13.373 -2.376 1.00 0.00 C ATOM 1576 OE1 GLN A 219 13.186 14.557 -2.329 1.00 0.00 O ATOM 1577 NE2 GLN A 219 11.903 12.987 -3.202 1.00 0.00 N ATOM 0 H GLN A 219 13.070 10.200 0.482 1.00 0.00 H new ATOM 0 HA GLN A 219 15.307 11.855 0.433 1.00 0.00 H new ATOM 0 HB2 GLN A 219 12.341 12.426 0.315 1.00 0.00 H new ATOM 0 HB3 GLN A 219 13.541 13.696 0.180 1.00 0.00 H new ATOM 0 HG2 GLN A 219 14.587 12.262 -1.734 1.00 0.00 H new ATOM 0 HG3 GLN A 219 13.096 11.343 -1.701 1.00 0.00 H new ATOM 0 HE21 GLN A 219 11.630 12.005 -3.243 1.00 0.00 H new ATOM 0 HE22 GLN A 219 11.438 13.671 -3.799 1.00 0.00 H new ATOM 1586 N LYS A 220 13.595 12.093 3.254 1.00 0.00 N ATOM 1587 CA LYS A 220 13.653 12.555 4.635 1.00 0.00 C ATOM 1588 C LYS A 220 14.974 12.108 5.279 1.00 0.00 C ATOM 1589 O LYS A 220 15.731 12.954 5.759 1.00 0.00 O ATOM 1590 CB LYS A 220 12.418 12.072 5.413 1.00 0.00 C ATOM 1591 CG LYS A 220 11.159 12.853 4.994 1.00 0.00 C ATOM 1592 CD LYS A 220 9.887 12.287 5.635 1.00 0.00 C ATOM 1593 CE LYS A 220 9.744 12.811 7.062 1.00 0.00 C ATOM 1594 NZ LYS A 220 8.765 12.061 7.869 1.00 0.00 N ATOM 0 H LYS A 220 12.814 11.462 3.077 1.00 0.00 H new ATOM 0 HA LYS A 220 13.633 13.644 4.661 1.00 0.00 H new ATOM 0 HB2 LYS A 220 12.265 11.008 5.235 1.00 0.00 H new ATOM 0 HB3 LYS A 220 12.587 12.195 6.483 1.00 0.00 H new ATOM 0 HG2 LYS A 220 11.272 13.900 5.277 1.00 0.00 H new ATOM 0 HG3 LYS A 220 11.060 12.825 3.909 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.015 12.571 5.045 1.00 0.00 H new ATOM 0 HD3 LYS A 220 9.927 11.198 5.641 1.00 0.00 H new ATOM 0 HE2 LYS A 220 10.716 12.771 7.554 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.447 13.859 7.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.130 12.728 8.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.208 11.439 7.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 9.266 11.486 8.576 1.00 0.00 H new ATOM 1608 N GLU A 221 15.286 10.810 5.256 1.00 0.00 N ATOM 1609 CA GLU A 221 16.509 10.245 5.841 1.00 0.00 C ATOM 1610 C GLU A 221 17.747 10.821 5.135 1.00 0.00 C ATOM 1611 O GLU A 221 18.744 11.154 5.772 1.00 0.00 O ATOM 1612 CB GLU A 221 16.524 8.708 5.685 1.00 0.00 C ATOM 1613 CG GLU A 221 15.319 7.962 6.276 1.00 0.00 C ATOM 1614 CD GLU A 221 15.428 7.634 7.754 1.00 0.00 C ATOM 1615 OE1 GLU A 221 15.189 8.548 8.572 1.00 0.00 O ATOM 1616 OE2 GLU A 221 15.571 6.434 8.078 1.00 0.00 O ATOM 0 H GLU A 221 14.686 10.108 4.823 1.00 0.00 H new ATOM 0 HA GLU A 221 16.528 10.505 6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 221 16.589 8.471 4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 221 17.430 8.323 6.153 1.00 0.00 H new ATOM 0 HG2 GLU A 221 14.425 8.565 6.118 1.00 0.00 H new ATOM 0 HG3 GLU A 221 15.179 7.033 5.723 1.00 0.00 H new ATOM 1623 N SER A 222 17.685 10.947 3.811 1.00 0.00 N ATOM 1624 CA SER A 222 18.724 11.465 2.945 1.00 0.00 C ATOM 1625 C SER A 222 19.020 12.906 3.322 1.00 0.00 C ATOM 1626 O SER A 222 20.177 13.233 3.590 1.00 0.00 O ATOM 1627 CB SER A 222 18.265 11.261 1.492 1.00 0.00 C ATOM 1628 OG SER A 222 19.304 11.333 0.543 1.00 0.00 O ATOM 0 H SER A 222 16.853 10.671 3.289 1.00 0.00 H new ATOM 0 HA SER A 222 19.670 10.936 3.059 1.00 0.00 H new ATOM 0 HB2 SER A 222 17.779 10.289 1.409 1.00 0.00 H new ATOM 0 HB3 SER A 222 17.515 12.014 1.251 1.00 0.00 H new ATOM 0 HG SER A 222 18.937 11.192 -0.355 1.00 0.00 H new