USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 662 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 174 ASN : amide:sc= -1.14 K(o=-1.2,f=-3.9!) USER MOD Set 1.2: A 199 MET CE :methyl -177:sc= -0.102 (180deg=-0.111) USER MOD Set 2.1: A 149 TYR OH : rot 170:sc= 0.00527 USER MOD Set 2.2: A 202 HIS : no HD1:sc= -0.0418 X(o=-0.037,f=-0.017) USER MOD Single : A 147 GLN : amide:sc= -5.22! K(o=-5.2!,f=-0.22) USER MOD Single : A 150 GLN : amide:sc= 0.894 K(o=0.89,f=-0.5) USER MOD Single : A 155 CYS SG : rot -120:sc= -1.03 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot -24:sc= 0.788 USER MOD Single : A 162 TYR OH : rot -62:sc= 0.23 USER MOD Single : A 166 HIS : no HE2:sc= -1.42 K(o=-1.4,f=-4.2!) USER MOD Single : A 169 GLN : amide:sc= -0.112 K(o=-0.11,f=-1) USER MOD Single : A 171 THR OG1 : rot -93:sc= -0.0848! USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -0.608 K(o=-0.61,f=-3.6) USER MOD Single : A 192 THR OG1 : rot 180:sc= -0.933 USER MOD Single : A 194 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 HIS : no HE2:sc= -1.41 K(o=-1.4,f=-6.8!) USER MOD Single : A 203 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 LYS NZ :NH3+ 168:sc= 0.894 (180deg=0.766) USER MOD Single : A 215 SER OG : rot -79:sc= 1.28 USER MOD Single : A 217 GLN : amide:sc= -0.0993 X(o=-0.099,f=-0.25) USER MOD Single : A 221 TYR OH : rot 36:sc= 1.24 USER MOD Single : A 224 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 146 3.792 15.427 -1.754 1.00 72.34 N ATOM 66 CA LEU A 146 2.939 14.320 -1.653 1.00 44.32 C ATOM 67 C LEU A 146 3.089 13.788 -0.254 1.00 24.31 C ATOM 68 O LEU A 146 4.164 13.868 0.323 1.00 24.34 O ATOM 69 CB LEU A 146 3.304 13.244 -2.699 1.00 12.35 C ATOM 70 CG LEU A 146 3.114 13.588 -4.207 1.00 64.13 C ATOM 71 CD1 LEU A 146 4.094 14.651 -4.704 1.00 34.12 C ATOM 72 CD2 LEU A 146 3.246 12.343 -5.049 1.00 33.15 C ATOM 0 HA LEU A 146 1.906 14.605 -1.851 1.00 44.32 H new ATOM 0 HB2 LEU A 146 4.349 12.974 -2.548 1.00 12.35 H new ATOM 0 HB3 LEU A 146 2.711 12.355 -2.483 1.00 12.35 H new ATOM 0 HG LEU A 146 2.111 14.002 -4.307 1.00 64.13 H new ATOM 0 HD11 LEU A 146 3.912 14.848 -5.761 1.00 34.12 H new ATOM 0 HD12 LEU A 146 3.954 15.570 -4.134 1.00 34.12 H new ATOM 0 HD13 LEU A 146 5.115 14.294 -4.572 1.00 34.12 H new ATOM 0 HD21 LEU A 146 3.111 12.599 -6.100 1.00 33.15 H new ATOM 0 HD22 LEU A 146 4.236 11.910 -4.905 1.00 33.15 H new ATOM 0 HD23 LEU A 146 2.487 11.620 -4.751 1.00 33.15 H new ATOM 84 N GLN A 147 2.029 13.300 0.302 1.00 33.22 N ATOM 85 CA GLN A 147 2.041 12.822 1.649 1.00 14.44 C ATOM 86 C GLN A 147 2.368 11.364 1.649 1.00 62.22 C ATOM 87 O GLN A 147 1.729 10.588 0.933 1.00 2.52 O ATOM 88 CB GLN A 147 0.703 13.075 2.383 1.00 14.54 C ATOM 89 CG GLN A 147 0.517 14.456 3.068 1.00 5.52 C ATOM 90 CD GLN A 147 0.222 15.669 2.163 1.00 73.14 C ATOM 91 OE1 GLN A 147 -0.466 16.596 2.578 1.00 24.50 O ATOM 92 NE2 GLN A 147 0.743 15.703 0.977 1.00 1.51 N ATOM 0 H GLN A 147 1.126 13.220 -0.165 1.00 33.22 H new ATOM 0 HA GLN A 147 2.803 13.379 2.194 1.00 14.44 H new ATOM 0 HB2 GLN A 147 -0.106 12.943 1.665 1.00 14.54 H new ATOM 0 HB3 GLN A 147 0.584 12.303 3.143 1.00 14.54 H new ATOM 0 HG2 GLN A 147 -0.298 14.367 3.787 1.00 5.52 H new ATOM 0 HG3 GLN A 147 1.421 14.673 3.637 1.00 5.52 H new ATOM 0 HE21 GLN A 147 1.313 14.924 0.648 1.00 1.51 H new ATOM 0 HE22 GLN A 147 0.584 16.509 0.373 1.00 1.51 H new ATOM 101 N PRO A 148 3.432 10.982 2.354 1.00 13.50 N ATOM 102 CA PRO A 148 3.786 9.597 2.523 1.00 5.42 C ATOM 103 C PRO A 148 2.713 8.856 3.312 1.00 23.34 C ATOM 104 O PRO A 148 2.373 9.236 4.439 1.00 63.05 O ATOM 105 CB PRO A 148 5.096 9.640 3.320 1.00 14.01 C ATOM 106 CG PRO A 148 5.615 11.018 3.142 1.00 34.33 C ATOM 107 CD PRO A 148 4.415 11.883 2.983 1.00 4.04 C ATOM 0 HA PRO A 148 3.885 9.075 1.571 1.00 5.42 H new ATOM 0 HB2 PRO A 148 4.924 9.417 4.373 1.00 14.01 H new ATOM 0 HB3 PRO A 148 5.806 8.901 2.950 1.00 14.01 H new ATOM 0 HG2 PRO A 148 6.209 11.327 4.002 1.00 34.33 H new ATOM 0 HG3 PRO A 148 6.263 11.083 2.268 1.00 34.33 H new ATOM 0 HD2 PRO A 148 4.060 12.260 3.942 1.00 4.04 H new ATOM 0 HD3 PRO A 148 4.624 12.751 2.357 1.00 4.04 H new ATOM 115 N TYR A 149 2.151 7.876 2.693 1.00 41.03 N ATOM 116 CA TYR A 149 1.162 7.005 3.308 1.00 50.31 C ATOM 117 C TYR A 149 1.663 5.599 3.274 1.00 62.13 C ATOM 118 O TYR A 149 2.513 5.266 2.464 1.00 20.31 O ATOM 119 CB TYR A 149 -0.201 7.077 2.593 1.00 12.32 C ATOM 120 CG TYR A 149 -0.880 8.394 2.768 1.00 44.32 C ATOM 121 CD1 TYR A 149 -1.426 8.732 3.987 1.00 1.31 C ATOM 122 CD2 TYR A 149 -0.949 9.311 1.737 1.00 40.33 C ATOM 123 CE1 TYR A 149 -2.015 9.947 4.187 1.00 33.42 C ATOM 124 CE2 TYR A 149 -1.549 10.534 1.921 1.00 54.41 C ATOM 125 CZ TYR A 149 -2.078 10.850 3.152 1.00 74.43 C ATOM 126 OH TYR A 149 -2.636 12.086 3.356 1.00 71.30 O ATOM 0 H TYR A 149 2.359 7.638 1.723 1.00 41.03 H new ATOM 0 HA TYR A 149 1.014 7.339 4.335 1.00 50.31 H new ATOM 0 HB2 TYR A 149 -0.058 6.886 1.529 1.00 12.32 H new ATOM 0 HB3 TYR A 149 -0.848 6.287 2.974 1.00 12.32 H new ATOM 0 HD1 TYR A 149 -1.387 8.022 4.800 1.00 1.31 H new ATOM 0 HD2 TYR A 149 -0.526 9.064 0.774 1.00 40.33 H new ATOM 0 HE1 TYR A 149 -2.429 10.198 5.152 1.00 33.42 H new ATOM 0 HE2 TYR A 149 -1.605 11.241 1.107 1.00 54.41 H new ATOM 0 HH TYR A 149 -2.460 12.657 2.579 1.00 71.30 H new ATOM 136 N GLN A 150 1.204 4.798 4.161 1.00 61.14 N ATOM 137 CA GLN A 150 1.579 3.416 4.194 1.00 31.04 C ATOM 138 C GLN A 150 0.322 2.607 4.273 1.00 2.11 C ATOM 139 O GLN A 150 -0.465 2.780 5.186 1.00 63.02 O ATOM 140 CB GLN A 150 2.447 3.112 5.412 1.00 34.04 C ATOM 141 CG GLN A 150 3.619 4.062 5.595 1.00 53.41 C ATOM 142 CD GLN A 150 4.484 3.728 6.781 1.00 73.13 C ATOM 143 OE1 GLN A 150 4.632 2.568 7.154 1.00 20.15 O ATOM 144 NE2 GLN A 150 5.045 4.734 7.395 1.00 60.12 N ATOM 0 H GLN A 150 0.552 5.075 4.895 1.00 61.14 H new ATOM 0 HA GLN A 150 2.154 3.173 3.301 1.00 31.04 H new ATOM 0 HB2 GLN A 150 1.824 3.145 6.306 1.00 34.04 H new ATOM 0 HB3 GLN A 150 2.828 2.094 5.327 1.00 34.04 H new ATOM 0 HG2 GLN A 150 4.231 4.048 4.693 1.00 53.41 H new ATOM 0 HG3 GLN A 150 3.239 5.077 5.707 1.00 53.41 H new ATOM 0 HE21 GLN A 150 4.899 5.685 7.055 1.00 60.12 H new ATOM 0 HE22 GLN A 150 5.630 4.570 8.214 1.00 60.12 H new ATOM 153 N VAL A 151 0.121 1.771 3.330 1.00 22.42 N ATOM 154 CA VAL A 151 -1.035 0.909 3.326 1.00 61.13 C ATOM 155 C VAL A 151 -0.548 -0.476 3.643 1.00 43.43 C ATOM 156 O VAL A 151 0.277 -1.029 2.922 1.00 51.44 O ATOM 157 CB VAL A 151 -1.776 0.919 1.957 1.00 44.42 C ATOM 158 CG1 VAL A 151 -2.977 -0.028 1.974 1.00 13.23 C ATOM 159 CG2 VAL A 151 -2.229 2.329 1.605 1.00 20.22 C ATOM 0 H VAL A 151 0.742 1.651 2.530 1.00 22.42 H new ATOM 0 HA VAL A 151 -1.756 1.262 4.064 1.00 61.13 H new ATOM 0 HB VAL A 151 -1.076 0.572 1.197 1.00 44.42 H new ATOM 0 HG11 VAL A 151 -3.476 -0.001 1.005 1.00 13.23 H new ATOM 0 HG12 VAL A 151 -2.637 -1.043 2.179 1.00 13.23 H new ATOM 0 HG13 VAL A 151 -3.675 0.284 2.750 1.00 13.23 H new ATOM 0 HG21 VAL A 151 -2.745 2.316 0.645 1.00 20.22 H new ATOM 0 HG22 VAL A 151 -2.906 2.697 2.376 1.00 20.22 H new ATOM 0 HG23 VAL A 151 -1.361 2.985 1.542 1.00 20.22 H new ATOM 169 N ARG A 152 -0.997 -1.002 4.730 1.00 50.31 N ATOM 170 CA ARG A 152 -0.536 -2.262 5.200 1.00 53.01 C ATOM 171 C ARG A 152 -1.677 -3.266 5.183 1.00 51.25 C ATOM 172 O ARG A 152 -2.692 -3.075 5.839 1.00 43.34 O ATOM 173 CB ARG A 152 0.072 -2.063 6.591 1.00 23.01 C ATOM 174 CG ARG A 152 0.692 -3.288 7.200 1.00 44.32 C ATOM 175 CD ARG A 152 1.557 -2.928 8.400 1.00 3.12 C ATOM 176 NE ARG A 152 0.807 -2.243 9.459 1.00 2.21 N ATOM 177 CZ ARG A 152 1.266 -1.193 10.164 1.00 73.43 C ATOM 178 NH1 ARG A 152 2.394 -0.574 9.797 1.00 0.12 N ATOM 179 NH2 ARG A 152 0.578 -0.740 11.215 1.00 63.25 N ATOM 0 H ARG A 152 -1.702 -0.565 5.324 1.00 50.31 H new ATOM 0 HA ARG A 152 0.240 -2.669 4.551 1.00 53.01 H new ATOM 0 HB2 ARG A 152 0.831 -1.283 6.530 1.00 23.01 H new ATOM 0 HB3 ARG A 152 -0.706 -1.698 7.261 1.00 23.01 H new ATOM 0 HG2 ARG A 152 -0.091 -3.981 7.508 1.00 44.32 H new ATOM 0 HG3 ARG A 152 1.297 -3.802 6.453 1.00 44.32 H new ATOM 0 HD2 ARG A 152 2.002 -3.836 8.806 1.00 3.12 H new ATOM 0 HD3 ARG A 152 2.378 -2.290 8.072 1.00 3.12 H new ATOM 0 HE ARG A 152 -0.128 -2.587 9.676 1.00 2.21 H new ATOM 0 HH11 ARG A 152 2.910 -0.898 8.979 1.00 0.12 H new ATOM 0 HH12 ARG A 152 2.737 0.222 10.335 1.00 0.12 H new ATOM 0 HH21 ARG A 152 -0.297 -1.190 11.484 1.00 63.25 H new ATOM 0 HH22 ARG A 152 0.927 0.056 11.748 1.00 63.25 H new ATOM 193 N VAL A 153 -1.511 -4.302 4.408 1.00 63.14 N ATOM 194 CA VAL A 153 -2.529 -5.309 4.223 1.00 44.20 C ATOM 195 C VAL A 153 -2.002 -6.679 4.633 1.00 14.52 C ATOM 196 O VAL A 153 -0.871 -7.049 4.306 1.00 11.23 O ATOM 197 CB VAL A 153 -3.055 -5.344 2.737 1.00 62.12 C ATOM 198 CG1 VAL A 153 -1.910 -5.479 1.741 1.00 61.23 C ATOM 199 CG2 VAL A 153 -4.035 -6.485 2.534 1.00 24.05 C ATOM 0 H VAL A 153 -0.656 -4.476 3.879 1.00 63.14 H new ATOM 0 HA VAL A 153 -3.371 -5.046 4.863 1.00 44.20 H new ATOM 0 HB VAL A 153 -3.564 -4.397 2.558 1.00 62.12 H new ATOM 0 HG11 VAL A 153 -2.310 -5.500 0.727 1.00 61.23 H new ATOM 0 HG12 VAL A 153 -1.234 -4.631 1.847 1.00 61.23 H new ATOM 0 HG13 VAL A 153 -1.366 -6.403 1.935 1.00 61.23 H new ATOM 0 HG21 VAL A 153 -4.383 -6.487 1.501 1.00 24.05 H new ATOM 0 HG22 VAL A 153 -3.541 -7.432 2.752 1.00 24.05 H new ATOM 0 HG23 VAL A 153 -4.886 -6.357 3.203 1.00 24.05 H new ATOM 209 N ILE A 154 -2.796 -7.398 5.361 1.00 22.32 N ATOM 210 CA ILE A 154 -2.465 -8.730 5.761 1.00 2.20 C ATOM 211 C ILE A 154 -3.307 -9.669 4.915 1.00 35.52 C ATOM 212 O ILE A 154 -4.539 -9.625 4.980 1.00 31.53 O ATOM 213 CB ILE A 154 -2.779 -8.960 7.265 1.00 72.31 C ATOM 214 CG1 ILE A 154 -2.020 -7.940 8.132 1.00 71.02 C ATOM 215 CG2 ILE A 154 -2.423 -10.387 7.674 1.00 74.24 C ATOM 216 CD1 ILE A 154 -2.331 -8.026 9.613 1.00 35.31 C ATOM 0 H ILE A 154 -3.702 -7.074 5.698 1.00 22.32 H new ATOM 0 HA ILE A 154 -1.399 -8.908 5.619 1.00 2.20 H new ATOM 0 HB ILE A 154 -3.848 -8.817 7.422 1.00 72.31 H new ATOM 0 HG12 ILE A 154 -0.949 -8.084 7.989 1.00 71.02 H new ATOM 0 HG13 ILE A 154 -2.256 -6.935 7.781 1.00 71.02 H new ATOM 0 HG21 ILE A 154 -2.650 -10.530 8.731 1.00 74.24 H new ATOM 0 HG22 ILE A 154 -3.005 -11.092 7.080 1.00 74.24 H new ATOM 0 HG23 ILE A 154 -1.360 -10.560 7.504 1.00 74.24 H new ATOM 0 HD11 ILE A 154 -1.754 -7.273 10.150 1.00 35.31 H new ATOM 0 HD12 ILE A 154 -3.395 -7.850 9.772 1.00 35.31 H new ATOM 0 HD13 ILE A 154 -2.068 -9.017 9.983 1.00 35.31 H new ATOM 228 N CYS A 155 -2.675 -10.484 4.125 1.00 33.22 N ATOM 229 CA CYS A 155 -3.373 -11.369 3.248 1.00 55.34 C ATOM 230 C CYS A 155 -2.640 -12.673 3.185 1.00 51.05 C ATOM 231 O CYS A 155 -1.568 -12.801 3.758 1.00 24.53 O ATOM 232 CB CYS A 155 -3.521 -10.746 1.850 1.00 33.15 C ATOM 233 SG CYS A 155 -1.972 -10.269 1.064 1.00 41.14 S ATOM 0 H CYS A 155 -1.659 -10.553 4.072 1.00 33.22 H new ATOM 0 HA CYS A 155 -4.378 -11.544 3.632 1.00 55.34 H new ATOM 0 HB2 CYS A 155 -4.035 -11.457 1.204 1.00 33.15 H new ATOM 0 HB3 CYS A 155 -4.159 -9.866 1.926 1.00 33.15 H new ATOM 0 HG CYS A 155 -1.984 -8.992 0.820 1.00 41.14 H new ATOM 239 N ARG A 156 -3.234 -13.642 2.574 1.00 64.21 N ATOM 240 CA ARG A 156 -2.584 -14.935 2.395 1.00 71.45 C ATOM 241 C ARG A 156 -1.463 -14.831 1.333 1.00 50.33 C ATOM 242 O ARG A 156 -1.547 -13.999 0.434 1.00 54.01 O ATOM 243 CB ARG A 156 -3.610 -16.013 2.041 1.00 4.14 C ATOM 244 CG ARG A 156 -4.402 -15.732 0.791 1.00 71.22 C ATOM 245 CD ARG A 156 -5.412 -16.815 0.546 1.00 3.02 C ATOM 246 NE ARG A 156 -6.282 -16.492 -0.590 1.00 72.32 N ATOM 247 CZ ARG A 156 -7.414 -17.133 -0.900 1.00 61.42 C ATOM 248 NH1 ARG A 156 -7.770 -18.228 -0.242 1.00 11.12 N ATOM 249 NH2 ARG A 156 -8.178 -16.673 -1.882 1.00 64.24 N ATOM 0 H ARG A 156 -4.174 -13.581 2.182 1.00 64.21 H new ATOM 0 HA ARG A 156 -2.120 -15.230 3.336 1.00 71.45 H new ATOM 0 HB2 ARG A 156 -3.092 -16.965 1.922 1.00 4.14 H new ATOM 0 HB3 ARG A 156 -4.301 -16.128 2.876 1.00 4.14 H new ATOM 0 HG2 ARG A 156 -4.908 -14.771 0.884 1.00 71.22 H new ATOM 0 HG3 ARG A 156 -3.728 -15.657 -0.063 1.00 71.22 H new ATOM 0 HD2 ARG A 156 -4.898 -17.757 0.355 1.00 3.02 H new ATOM 0 HD3 ARG A 156 -6.018 -16.958 1.441 1.00 3.02 H new ATOM 0 HE ARG A 156 -6.001 -15.717 -1.191 1.00 72.32 H new ATOM 0 HH11 ARG A 156 -7.179 -18.588 0.507 1.00 11.12 H new ATOM 0 HH12 ARG A 156 -8.635 -18.710 -0.485 1.00 11.12 H new ATOM 0 HH21 ARG A 156 -7.901 -15.836 -2.395 1.00 64.24 H new ATOM 0 HH22 ARG A 156 -9.043 -17.156 -2.124 1.00 64.24 H new ATOM 263 N PRO A 157 -0.393 -15.646 1.443 1.00 71.24 N ATOM 264 CA PRO A 157 0.776 -15.595 0.524 1.00 31.35 C ATOM 265 C PRO A 157 0.450 -15.683 -0.973 1.00 12.05 C ATOM 266 O PRO A 157 1.061 -14.984 -1.777 1.00 55.24 O ATOM 267 CB PRO A 157 1.653 -16.755 0.980 1.00 45.52 C ATOM 268 CG PRO A 157 1.296 -16.937 2.413 1.00 31.52 C ATOM 269 CD PRO A 157 -0.178 -16.656 2.507 1.00 14.42 C ATOM 0 HA PRO A 157 1.259 -14.620 0.591 1.00 31.35 H new ATOM 0 HB2 PRO A 157 1.454 -17.657 0.402 1.00 45.52 H new ATOM 0 HB3 PRO A 157 2.712 -16.526 0.859 1.00 45.52 H new ATOM 0 HG2 PRO A 157 1.523 -17.949 2.747 1.00 31.52 H new ATOM 0 HG3 PRO A 157 1.865 -16.257 3.047 1.00 31.52 H new ATOM 0 HD2 PRO A 157 -0.772 -17.554 2.337 1.00 14.42 H new ATOM 0 HD3 PRO A 157 -0.454 -16.273 3.489 1.00 14.42 H new ATOM 277 N LYS A 158 -0.524 -16.496 -1.343 1.00 52.51 N ATOM 278 CA LYS A 158 -0.929 -16.601 -2.746 1.00 23.15 C ATOM 279 C LYS A 158 -1.556 -15.308 -3.225 1.00 30.43 C ATOM 280 O LYS A 158 -1.561 -15.009 -4.424 1.00 12.15 O ATOM 281 CB LYS A 158 -1.905 -17.753 -2.959 1.00 35.35 C ATOM 282 CG LYS A 158 -1.289 -19.124 -2.821 1.00 35.21 C ATOM 283 CD LYS A 158 -2.346 -20.200 -2.855 1.00 24.20 C ATOM 284 CE LYS A 158 -1.731 -21.582 -2.761 1.00 14.41 C ATOM 285 NZ LYS A 158 -2.758 -22.642 -2.681 1.00 21.44 N ATOM 0 H LYS A 158 -1.049 -17.091 -0.702 1.00 52.51 H new ATOM 0 HA LYS A 158 -0.029 -16.798 -3.328 1.00 23.15 H new ATOM 0 HB2 LYS A 158 -2.720 -17.660 -2.241 1.00 35.35 H new ATOM 0 HB3 LYS A 158 -2.343 -17.663 -3.953 1.00 35.35 H new ATOM 0 HG2 LYS A 158 -0.573 -19.287 -3.627 1.00 35.21 H new ATOM 0 HG3 LYS A 158 -0.734 -19.184 -1.885 1.00 35.21 H new ATOM 0 HD2 LYS A 158 -3.043 -20.053 -2.030 1.00 24.20 H new ATOM 0 HD3 LYS A 158 -2.921 -20.118 -3.777 1.00 24.20 H new ATOM 0 HE2 LYS A 158 -1.097 -21.756 -3.630 1.00 14.41 H new ATOM 0 HE3 LYS A 158 -1.088 -21.633 -1.882 1.00 14.41 H new ATOM 0 HZ1 LYS A 158 -2.294 -23.571 -2.618 1.00 21.44 H new ATOM 0 HZ2 LYS A 158 -3.347 -22.491 -1.837 1.00 21.44 H new ATOM 0 HZ3 LYS A 158 -3.356 -22.611 -3.531 1.00 21.44 H new ATOM 299 N ALA A 159 -2.021 -14.514 -2.281 1.00 3.51 N ATOM 300 CA ALA A 159 -2.687 -13.301 -2.605 1.00 2.13 C ATOM 301 C ALA A 159 -1.677 -12.202 -2.771 1.00 63.23 C ATOM 302 O ALA A 159 -1.810 -11.394 -3.665 1.00 22.30 O ATOM 303 CB ALA A 159 -3.744 -12.936 -1.570 1.00 52.23 C ATOM 0 H ALA A 159 -1.941 -14.702 -1.282 1.00 3.51 H new ATOM 0 HA ALA A 159 -3.216 -13.440 -3.548 1.00 2.13 H new ATOM 0 HB1 ALA A 159 -4.228 -12.002 -1.858 1.00 52.23 H new ATOM 0 HB2 ALA A 159 -4.490 -13.729 -1.516 1.00 52.23 H new ATOM 0 HB3 ALA A 159 -3.272 -12.815 -0.595 1.00 52.23 H new ATOM 309 N GLU A 160 -0.629 -12.242 -1.936 1.00 34.12 N ATOM 310 CA GLU A 160 0.485 -11.262 -1.908 1.00 5.34 C ATOM 311 C GLU A 160 0.951 -10.940 -3.302 1.00 23.24 C ATOM 312 O GLU A 160 1.007 -9.774 -3.703 1.00 50.12 O ATOM 313 CB GLU A 160 1.647 -11.870 -1.049 1.00 62.50 C ATOM 314 CG GLU A 160 2.998 -11.095 -0.941 1.00 25.21 C ATOM 315 CD GLU A 160 3.843 -11.064 -2.212 1.00 51.22 C ATOM 316 OE1 GLU A 160 3.995 -12.123 -2.876 1.00 52.12 O ATOM 317 OE2 GLU A 160 4.362 -9.982 -2.574 1.00 32.41 O ATOM 0 H GLU A 160 -0.523 -12.977 -1.237 1.00 34.12 H new ATOM 0 HA GLU A 160 0.148 -10.326 -1.462 1.00 5.34 H new ATOM 0 HB2 GLU A 160 1.268 -12.012 -0.037 1.00 62.50 H new ATOM 0 HB3 GLU A 160 1.867 -12.860 -1.448 1.00 62.50 H new ATOM 0 HG2 GLU A 160 2.785 -10.069 -0.643 1.00 25.21 H new ATOM 0 HG3 GLU A 160 3.590 -11.542 -0.143 1.00 25.21 H new ATOM 324 N THR A 161 1.196 -11.971 -4.036 1.00 50.44 N ATOM 325 CA THR A 161 1.762 -11.873 -5.335 1.00 53.35 C ATOM 326 C THR A 161 0.854 -11.081 -6.317 1.00 64.41 C ATOM 327 O THR A 161 1.344 -10.247 -7.094 1.00 42.21 O ATOM 328 CB THR A 161 2.095 -13.281 -5.823 1.00 44.25 C ATOM 329 OG1 THR A 161 2.842 -13.944 -4.776 1.00 33.44 O ATOM 330 CG2 THR A 161 2.928 -13.258 -7.087 1.00 51.22 C ATOM 0 H THR A 161 1.003 -12.928 -3.741 1.00 50.44 H new ATOM 0 HA THR A 161 2.684 -11.293 -5.291 1.00 53.35 H new ATOM 0 HB THR A 161 1.167 -13.805 -6.051 1.00 44.25 H new ATOM 0 HG1 THR A 161 3.276 -13.273 -4.209 1.00 33.44 H new ATOM 0 HG21 THR A 161 3.143 -14.280 -7.400 1.00 51.22 H new ATOM 0 HG22 THR A 161 2.378 -12.745 -7.876 1.00 51.22 H new ATOM 0 HG23 THR A 161 3.864 -12.733 -6.896 1.00 51.22 H new ATOM 338 N TYR A 162 -0.456 -11.295 -6.267 1.00 74.14 N ATOM 339 CA TYR A 162 -1.321 -10.506 -7.113 1.00 23.12 C ATOM 340 C TYR A 162 -1.742 -9.200 -6.457 1.00 25.51 C ATOM 341 O TYR A 162 -2.040 -8.238 -7.137 1.00 74.24 O ATOM 342 CB TYR A 162 -2.503 -11.267 -7.758 1.00 54.31 C ATOM 343 CG TYR A 162 -3.520 -11.909 -6.845 1.00 75.22 C ATOM 344 CD1 TYR A 162 -4.586 -11.185 -6.326 1.00 34.45 C ATOM 345 CD2 TYR A 162 -3.449 -13.258 -6.562 1.00 51.43 C ATOM 346 CE1 TYR A 162 -5.546 -11.798 -5.546 1.00 65.41 C ATOM 347 CE2 TYR A 162 -4.392 -13.872 -5.781 1.00 43.31 C ATOM 348 CZ TYR A 162 -5.439 -13.143 -5.278 1.00 24.25 C ATOM 349 OH TYR A 162 -6.391 -13.766 -4.521 1.00 72.43 O ATOM 0 H TYR A 162 -0.921 -11.981 -5.673 1.00 74.14 H new ATOM 0 HA TYR A 162 -0.692 -10.251 -7.966 1.00 23.12 H new ATOM 0 HB2 TYR A 162 -3.032 -10.571 -8.409 1.00 54.31 H new ATOM 0 HB3 TYR A 162 -2.088 -12.047 -8.396 1.00 54.31 H new ATOM 0 HD1 TYR A 162 -4.665 -10.128 -6.536 1.00 34.45 H new ATOM 0 HD2 TYR A 162 -2.634 -13.841 -6.964 1.00 51.43 H new ATOM 0 HE1 TYR A 162 -6.373 -11.227 -5.150 1.00 65.41 H new ATOM 0 HE2 TYR A 162 -4.311 -14.926 -5.562 1.00 43.31 H new ATOM 0 HH TYR A 162 -6.409 -13.368 -3.626 1.00 72.43 H new ATOM 359 N VAL A 163 -1.727 -9.154 -5.129 1.00 54.12 N ATOM 360 CA VAL A 163 -2.077 -7.941 -4.409 1.00 23.14 C ATOM 361 C VAL A 163 -1.034 -6.872 -4.684 1.00 1.05 C ATOM 362 O VAL A 163 -1.370 -5.740 -4.959 1.00 41.24 O ATOM 363 CB VAL A 163 -2.254 -8.178 -2.867 1.00 62.50 C ATOM 364 CG1 VAL A 163 -2.400 -6.864 -2.110 1.00 61.44 C ATOM 365 CG2 VAL A 163 -3.485 -9.030 -2.606 1.00 71.34 C ATOM 0 H VAL A 163 -1.476 -9.943 -4.533 1.00 54.12 H new ATOM 0 HA VAL A 163 -3.048 -7.605 -4.773 1.00 23.14 H new ATOM 0 HB VAL A 163 -1.359 -8.689 -2.513 1.00 62.50 H new ATOM 0 HG11 VAL A 163 -2.520 -7.068 -1.046 1.00 61.44 H new ATOM 0 HG12 VAL A 163 -1.509 -6.255 -2.264 1.00 61.44 H new ATOM 0 HG13 VAL A 163 -3.275 -6.328 -2.478 1.00 61.44 H new ATOM 0 HG21 VAL A 163 -3.598 -9.188 -1.533 1.00 71.34 H new ATOM 0 HG22 VAL A 163 -4.368 -8.521 -2.993 1.00 71.34 H new ATOM 0 HG23 VAL A 163 -3.373 -9.993 -3.105 1.00 71.34 H new ATOM 375 N ARG A 164 0.219 -7.278 -4.678 1.00 35.15 N ATOM 376 CA ARG A 164 1.339 -6.389 -4.963 1.00 25.43 C ATOM 377 C ARG A 164 1.211 -5.801 -6.373 1.00 11.10 C ATOM 378 O ARG A 164 1.374 -4.590 -6.578 1.00 51.01 O ATOM 379 CB ARG A 164 2.638 -7.170 -4.822 1.00 1.35 C ATOM 380 CG ARG A 164 3.899 -6.361 -5.003 1.00 51.44 C ATOM 381 CD ARG A 164 5.101 -7.239 -4.781 1.00 1.30 C ATOM 382 NE ARG A 164 6.360 -6.505 -4.871 1.00 63.33 N ATOM 383 CZ ARG A 164 7.427 -6.760 -4.110 1.00 41.12 C ATOM 384 NH1 ARG A 164 7.369 -7.711 -3.177 1.00 2.35 N ATOM 385 NH2 ARG A 164 8.544 -6.075 -4.284 1.00 12.21 N ATOM 0 H ARG A 164 0.496 -8.238 -4.475 1.00 35.15 H new ATOM 0 HA ARG A 164 1.337 -5.560 -4.255 1.00 25.43 H new ATOM 0 HB2 ARG A 164 2.660 -7.631 -3.835 1.00 1.35 H new ATOM 0 HB3 ARG A 164 2.637 -7.980 -5.552 1.00 1.35 H new ATOM 0 HG2 ARG A 164 3.928 -5.935 -6.006 1.00 51.44 H new ATOM 0 HG3 ARG A 164 3.911 -5.527 -4.301 1.00 51.44 H new ATOM 0 HD2 ARG A 164 5.028 -7.707 -3.799 1.00 1.30 H new ATOM 0 HD3 ARG A 164 5.100 -8.042 -5.518 1.00 1.30 H new ATOM 0 HE ARG A 164 6.428 -5.752 -5.556 1.00 63.33 H new ATOM 0 HH11 ARG A 164 6.509 -8.244 -3.045 1.00 2.35 H new ATOM 0 HH12 ARG A 164 8.184 -7.906 -2.596 1.00 2.35 H new ATOM 0 HH21 ARG A 164 8.592 -5.350 -5.000 1.00 12.21 H new ATOM 0 HH22 ARG A 164 9.358 -6.271 -3.702 1.00 12.21 H new ATOM 399 N ALA A 165 0.877 -6.662 -7.325 1.00 4.03 N ATOM 400 CA ALA A 165 0.695 -6.261 -8.708 1.00 55.01 C ATOM 401 C ALA A 165 -0.505 -5.341 -8.840 1.00 20.03 C ATOM 402 O ALA A 165 -0.475 -4.366 -9.591 1.00 41.44 O ATOM 403 CB ALA A 165 0.556 -7.481 -9.605 1.00 24.34 C ATOM 0 H ALA A 165 0.725 -7.657 -7.157 1.00 4.03 H new ATOM 0 HA ALA A 165 1.578 -5.709 -9.030 1.00 55.01 H new ATOM 0 HB1 ALA A 165 0.420 -7.160 -10.638 1.00 24.34 H new ATOM 0 HB2 ALA A 165 1.456 -8.092 -9.530 1.00 24.34 H new ATOM 0 HB3 ALA A 165 -0.308 -8.067 -9.291 1.00 24.34 H new ATOM 409 N HIS A 166 -1.532 -5.632 -8.080 1.00 34.32 N ATOM 410 CA HIS A 166 -2.732 -4.831 -8.061 1.00 65.54 C ATOM 411 C HIS A 166 -2.419 -3.460 -7.491 1.00 31.43 C ATOM 412 O HIS A 166 -2.800 -2.450 -8.070 1.00 20.01 O ATOM 413 CB HIS A 166 -3.840 -5.553 -7.261 1.00 2.21 C ATOM 414 CG HIS A 166 -5.180 -4.864 -7.205 1.00 50.31 C ATOM 415 ND1 HIS A 166 -6.205 -5.110 -8.088 1.00 61.42 N ATOM 416 CD2 HIS A 166 -5.666 -3.963 -6.317 1.00 43.11 C ATOM 417 CE1 HIS A 166 -7.255 -4.376 -7.721 1.00 10.15 C ATOM 418 NE2 HIS A 166 -6.981 -3.659 -6.649 1.00 53.33 N ATOM 0 H HIS A 166 -1.559 -6.436 -7.453 1.00 34.32 H new ATOM 0 HA HIS A 166 -3.103 -4.694 -9.077 1.00 65.54 H new ATOM 0 HB2 HIS A 166 -3.983 -6.544 -7.692 1.00 2.21 H new ATOM 0 HB3 HIS A 166 -3.486 -5.697 -6.240 1.00 2.21 H new ATOM 0 HD1 HIS A 166 -6.168 -5.744 -8.886 1.00 61.42 H new ATOM 0 HD2 HIS A 166 -5.119 -3.547 -5.484 1.00 43.11 H new ATOM 0 HE1 HIS A 166 -8.205 -4.369 -8.234 1.00 10.15 H new ATOM 426 N ILE A 167 -1.669 -3.435 -6.393 1.00 2.31 N ATOM 427 CA ILE A 167 -1.290 -2.186 -5.744 1.00 10.24 C ATOM 428 C ILE A 167 -0.554 -1.296 -6.709 1.00 54.12 C ATOM 429 O ILE A 167 -0.925 -0.151 -6.884 1.00 63.31 O ATOM 430 CB ILE A 167 -0.402 -2.392 -4.465 1.00 12.12 C ATOM 431 CG1 ILE A 167 -1.168 -3.145 -3.376 1.00 63.11 C ATOM 432 CG2 ILE A 167 0.102 -1.047 -3.922 1.00 63.21 C ATOM 433 CD1 ILE A 167 -0.347 -3.453 -2.132 1.00 13.33 C ATOM 0 H ILE A 167 -1.310 -4.272 -5.933 1.00 2.31 H new ATOM 0 HA ILE A 167 -2.222 -1.720 -5.425 1.00 10.24 H new ATOM 0 HB ILE A 167 0.459 -2.993 -4.758 1.00 12.12 H new ATOM 0 HG12 ILE A 167 -2.038 -2.556 -3.086 1.00 63.11 H new ATOM 0 HG13 ILE A 167 -1.541 -4.081 -3.792 1.00 63.11 H new ATOM 0 HG21 ILE A 167 0.714 -1.218 -3.037 1.00 63.21 H new ATOM 0 HG22 ILE A 167 0.699 -0.547 -4.685 1.00 63.21 H new ATOM 0 HG23 ILE A 167 -0.749 -0.419 -3.659 1.00 63.21 H new ATOM 0 HD11 ILE A 167 -0.965 -3.988 -1.411 1.00 13.33 H new ATOM 0 HD12 ILE A 167 0.509 -4.071 -2.405 1.00 13.33 H new ATOM 0 HD13 ILE A 167 0.004 -2.522 -1.688 1.00 13.33 H new ATOM 445 N VAL A 168 0.430 -1.842 -7.386 1.00 20.34 N ATOM 446 CA VAL A 168 1.273 -1.038 -8.250 1.00 14.32 C ATOM 447 C VAL A 168 0.493 -0.489 -9.455 1.00 11.03 C ATOM 448 O VAL A 168 0.748 0.629 -9.920 1.00 64.01 O ATOM 449 CB VAL A 168 2.597 -1.776 -8.665 1.00 53.30 C ATOM 450 CG1 VAL A 168 2.339 -2.989 -9.535 1.00 45.25 C ATOM 451 CG2 VAL A 168 3.583 -0.843 -9.336 1.00 51.12 C ATOM 0 H VAL A 168 0.668 -2.833 -7.358 1.00 20.34 H new ATOM 0 HA VAL A 168 1.592 -0.175 -7.665 1.00 14.32 H new ATOM 0 HB VAL A 168 3.043 -2.128 -7.735 1.00 53.30 H new ATOM 0 HG11 VAL A 168 3.287 -3.461 -9.792 1.00 45.25 H new ATOM 0 HG12 VAL A 168 1.716 -3.700 -8.993 1.00 45.25 H new ATOM 0 HG13 VAL A 168 1.828 -2.681 -10.447 1.00 45.25 H new ATOM 0 HG21 VAL A 168 4.483 -1.397 -9.605 1.00 51.12 H new ATOM 0 HG22 VAL A 168 3.133 -0.423 -10.235 1.00 51.12 H new ATOM 0 HG23 VAL A 168 3.845 -0.036 -8.651 1.00 51.12 H new ATOM 461 N GLN A 169 -0.490 -1.237 -9.918 1.00 72.52 N ATOM 462 CA GLN A 169 -1.300 -0.767 -11.013 1.00 71.33 C ATOM 463 C GLN A 169 -2.330 0.242 -10.532 1.00 15.45 C ATOM 464 O GLN A 169 -2.521 1.294 -11.151 1.00 53.45 O ATOM 465 CB GLN A 169 -2.000 -1.919 -11.737 1.00 35.43 C ATOM 466 CG GLN A 169 -1.066 -2.958 -12.325 1.00 43.11 C ATOM 467 CD GLN A 169 -0.108 -2.387 -13.341 1.00 32.33 C ATOM 468 OE1 GLN A 169 0.984 -1.949 -13.000 1.00 25.55 O ATOM 469 NE2 GLN A 169 -0.484 -2.414 -14.588 1.00 50.53 N ATOM 0 H GLN A 169 -0.741 -2.157 -9.557 1.00 72.52 H new ATOM 0 HA GLN A 169 -0.628 -0.280 -11.720 1.00 71.33 H new ATOM 0 HB2 GLN A 169 -2.676 -2.412 -11.038 1.00 35.43 H new ATOM 0 HB3 GLN A 169 -2.614 -1.507 -12.538 1.00 35.43 H new ATOM 0 HG2 GLN A 169 -0.497 -3.423 -11.520 1.00 43.11 H new ATOM 0 HG3 GLN A 169 -1.657 -3.745 -12.794 1.00 43.11 H new ATOM 0 HE21 GLN A 169 -1.401 -2.786 -14.836 1.00 50.53 H new ATOM 0 HE22 GLN A 169 0.138 -2.063 -15.316 1.00 50.53 H new ATOM 478 N ARG A 170 -2.952 -0.041 -9.410 1.00 35.01 N ATOM 479 CA ARG A 170 -4.020 0.795 -8.938 1.00 50.15 C ATOM 480 C ARG A 170 -3.496 2.090 -8.352 1.00 21.41 C ATOM 481 O ARG A 170 -4.166 3.108 -8.426 1.00 33.31 O ATOM 482 CB ARG A 170 -4.940 0.044 -7.974 1.00 4.35 C ATOM 483 CG ARG A 170 -5.584 -1.198 -8.595 1.00 32.55 C ATOM 484 CD ARG A 170 -6.536 -0.868 -9.740 1.00 73.11 C ATOM 485 NE ARG A 170 -7.780 -0.260 -9.265 1.00 74.45 N ATOM 486 CZ ARG A 170 -8.583 0.550 -9.964 1.00 32.24 C ATOM 487 NH1 ARG A 170 -8.247 0.973 -11.186 1.00 70.55 N ATOM 488 NH2 ARG A 170 -9.729 0.927 -9.427 1.00 75.34 N ATOM 0 H ARG A 170 -2.735 -0.840 -8.814 1.00 35.01 H new ATOM 0 HA ARG A 170 -4.630 1.068 -9.799 1.00 50.15 H new ATOM 0 HB2 ARG A 170 -4.369 -0.253 -7.095 1.00 4.35 H new ATOM 0 HB3 ARG A 170 -5.725 0.719 -7.632 1.00 4.35 H new ATOM 0 HG2 ARG A 170 -4.801 -1.862 -8.961 1.00 32.55 H new ATOM 0 HG3 ARG A 170 -6.128 -1.742 -7.823 1.00 32.55 H new ATOM 0 HD2 ARG A 170 -6.044 -0.188 -10.436 1.00 73.11 H new ATOM 0 HD3 ARG A 170 -6.766 -1.779 -10.293 1.00 73.11 H new ATOM 0 HE ARG A 170 -8.062 -0.475 -8.309 1.00 74.45 H new ATOM 0 HH11 ARG A 170 -7.364 0.679 -11.603 1.00 70.55 H new ATOM 0 HH12 ARG A 170 -8.874 1.590 -11.702 1.00 70.55 H new ATOM 0 HH21 ARG A 170 -9.988 0.601 -8.496 1.00 75.34 H new ATOM 0 HH22 ARG A 170 -10.356 1.544 -9.943 1.00 75.34 H new ATOM 502 N THR A 171 -2.285 2.077 -7.822 1.00 73.40 N ATOM 503 CA THR A 171 -1.704 3.292 -7.320 1.00 53.43 C ATOM 504 C THR A 171 -1.329 4.208 -8.469 1.00 62.35 C ATOM 505 O THR A 171 -1.601 5.405 -8.417 1.00 23.35 O ATOM 506 CB THR A 171 -0.492 3.029 -6.426 1.00 53.20 C ATOM 507 OG1 THR A 171 0.380 2.103 -7.075 1.00 74.21 O ATOM 508 CG2 THR A 171 -0.929 2.487 -5.071 1.00 61.12 C ATOM 0 H THR A 171 -1.699 1.247 -7.732 1.00 73.40 H new ATOM 0 HA THR A 171 -2.457 3.781 -6.702 1.00 53.43 H new ATOM 0 HB THR A 171 0.037 3.967 -6.257 1.00 53.20 H new ATOM 0 HG1 THR A 171 0.168 1.193 -6.780 1.00 74.21 H new ATOM 0 HG21 THR A 171 -0.051 2.307 -4.451 1.00 61.12 H new ATOM 0 HG22 THR A 171 -1.577 3.213 -4.580 1.00 61.12 H new ATOM 0 HG23 THR A 171 -1.472 1.552 -5.211 1.00 61.12 H new ATOM 516 N SER A 172 -0.783 3.622 -9.548 1.00 21.13 N ATOM 517 CA SER A 172 -0.401 4.395 -10.703 1.00 54.04 C ATOM 518 C SER A 172 -1.655 5.019 -11.335 1.00 13.33 C ATOM 519 O SER A 172 -1.644 6.180 -11.782 1.00 34.23 O ATOM 520 CB SER A 172 0.339 3.503 -11.712 1.00 52.21 C ATOM 521 OG SER A 172 0.848 4.251 -12.810 1.00 43.24 O ATOM 0 H SER A 172 -0.604 2.621 -9.628 1.00 21.13 H new ATOM 0 HA SER A 172 0.275 5.196 -10.403 1.00 54.04 H new ATOM 0 HB2 SER A 172 1.160 2.991 -11.210 1.00 52.21 H new ATOM 0 HB3 SER A 172 -0.339 2.733 -12.081 1.00 52.21 H new ATOM 0 HG SER A 172 1.313 3.649 -13.428 1.00 43.24 H new ATOM 527 N SER A 173 -2.737 4.260 -11.320 1.00 72.41 N ATOM 528 CA SER A 173 -4.005 4.688 -11.852 1.00 5.20 C ATOM 529 C SER A 173 -4.612 5.814 -10.968 1.00 34.10 C ATOM 530 O SER A 173 -5.155 6.793 -11.481 1.00 24.23 O ATOM 531 CB SER A 173 -4.943 3.474 -11.905 1.00 3.41 C ATOM 532 OG SER A 173 -6.121 3.728 -12.659 1.00 13.13 O ATOM 0 H SER A 173 -2.752 3.317 -10.931 1.00 72.41 H new ATOM 0 HA SER A 173 -3.871 5.092 -12.855 1.00 5.20 H new ATOM 0 HB2 SER A 173 -4.412 2.628 -12.341 1.00 3.41 H new ATOM 0 HB3 SER A 173 -5.220 3.188 -10.890 1.00 3.41 H new ATOM 0 HG SER A 173 -6.685 2.926 -12.665 1.00 13.13 H new ATOM 538 N ASN A 174 -4.457 5.683 -9.642 1.00 43.33 N ATOM 539 CA ASN A 174 -5.037 6.621 -8.667 1.00 34.04 C ATOM 540 C ASN A 174 -4.079 7.812 -8.395 1.00 73.44 C ATOM 541 O ASN A 174 -4.207 8.530 -7.406 1.00 45.31 O ATOM 542 CB ASN A 174 -5.394 5.859 -7.361 1.00 43.31 C ATOM 543 CG ASN A 174 -6.331 6.619 -6.406 1.00 2.50 C ATOM 544 OD1 ASN A 174 -7.551 6.544 -6.529 1.00 12.31 O ATOM 545 ND2 ASN A 174 -5.785 7.314 -5.443 1.00 62.42 N ATOM 0 H ASN A 174 -3.926 4.924 -9.215 1.00 43.33 H new ATOM 0 HA ASN A 174 -5.952 7.043 -9.081 1.00 34.04 H new ATOM 0 HB2 ASN A 174 -5.860 4.910 -7.627 1.00 43.31 H new ATOM 0 HB3 ASN A 174 -4.471 5.623 -6.831 1.00 43.31 H new ATOM 0 HD21 ASN A 174 -6.375 7.809 -4.774 1.00 62.42 H new ATOM 0 HD22 ASN A 174 -4.769 7.362 -5.361 1.00 62.42 H new ATOM 552 N ASP A 175 -3.123 7.995 -9.303 1.00 42.34 N ATOM 553 CA ASP A 175 -2.158 9.137 -9.331 1.00 12.24 C ATOM 554 C ASP A 175 -1.123 9.068 -8.212 1.00 74.31 C ATOM 555 O ASP A 175 -0.347 10.009 -8.025 1.00 44.34 O ATOM 556 CB ASP A 175 -2.867 10.515 -9.246 1.00 54.13 C ATOM 557 CG ASP A 175 -4.028 10.691 -10.195 1.00 65.13 C ATOM 558 OD1 ASP A 175 -3.817 10.789 -11.409 1.00 13.51 O ATOM 559 OD2 ASP A 175 -5.192 10.778 -9.717 1.00 75.02 O ATOM 0 H ASP A 175 -2.978 7.342 -10.073 1.00 42.34 H new ATOM 0 HA ASP A 175 -1.653 9.043 -10.292 1.00 12.24 H new ATOM 0 HB2 ASP A 175 -3.224 10.661 -8.227 1.00 54.13 H new ATOM 0 HB3 ASP A 175 -2.134 11.297 -9.442 1.00 54.13 H new ATOM 564 N ILE A 176 -1.070 7.963 -7.520 1.00 31.34 N ATOM 565 CA ILE A 176 -0.215 7.802 -6.359 1.00 74.55 C ATOM 566 C ILE A 176 1.204 7.390 -6.788 1.00 12.45 C ATOM 567 O ILE A 176 1.378 6.592 -7.705 1.00 41.20 O ATOM 568 CB ILE A 176 -0.807 6.722 -5.406 1.00 54.21 C ATOM 569 CG1 ILE A 176 -2.217 7.130 -4.947 1.00 22.43 C ATOM 570 CG2 ILE A 176 0.097 6.502 -4.207 1.00 42.21 C ATOM 571 CD1 ILE A 176 -2.884 6.129 -4.021 1.00 21.35 C ATOM 0 H ILE A 176 -1.623 7.135 -7.743 1.00 31.34 H new ATOM 0 HA ILE A 176 -0.162 8.756 -5.835 1.00 74.55 H new ATOM 0 HB ILE A 176 -0.875 5.783 -5.956 1.00 54.21 H new ATOM 0 HG12 ILE A 176 -2.157 8.093 -4.440 1.00 22.43 H new ATOM 0 HG13 ILE A 176 -2.846 7.271 -5.826 1.00 22.43 H new ATOM 0 HG21 ILE A 176 -0.339 5.743 -3.557 1.00 42.21 H new ATOM 0 HG22 ILE A 176 1.078 6.169 -4.547 1.00 42.21 H new ATOM 0 HG23 ILE A 176 0.202 7.436 -3.655 1.00 42.21 H new ATOM 0 HD11 ILE A 176 -3.874 6.492 -3.745 1.00 21.35 H new ATOM 0 HD12 ILE A 176 -2.979 5.170 -4.530 1.00 21.35 H new ATOM 0 HD13 ILE A 176 -2.279 6.005 -3.123 1.00 21.35 H new ATOM 583 N THR A 177 2.190 7.956 -6.140 1.00 54.41 N ATOM 584 CA THR A 177 3.575 7.657 -6.398 1.00 24.34 C ATOM 585 C THR A 177 4.061 6.658 -5.328 1.00 55.44 C ATOM 586 O THR A 177 3.559 6.666 -4.205 1.00 74.43 O ATOM 587 CB THR A 177 4.368 8.963 -6.353 1.00 44.40 C ATOM 588 OG1 THR A 177 3.683 9.896 -7.195 1.00 74.11 O ATOM 589 CG2 THR A 177 5.788 8.778 -6.875 1.00 72.33 C ATOM 0 H THR A 177 2.050 8.650 -5.405 1.00 54.41 H new ATOM 0 HA THR A 177 3.714 7.206 -7.380 1.00 24.34 H new ATOM 0 HB THR A 177 4.439 9.311 -5.322 1.00 44.40 H new ATOM 0 HG1 THR A 177 4.161 10.751 -7.192 1.00 74.11 H new ATOM 0 HG21 THR A 177 6.320 9.728 -6.827 1.00 72.33 H new ATOM 0 HG22 THR A 177 6.307 8.040 -6.263 1.00 72.33 H new ATOM 0 HG23 THR A 177 5.754 8.433 -7.908 1.00 72.33 H new ATOM 597 N LEU A 178 4.983 5.796 -5.668 1.00 23.11 N ATOM 598 CA LEU A 178 5.376 4.718 -4.771 1.00 62.23 C ATOM 599 C LEU A 178 6.782 4.898 -4.229 1.00 10.25 C ATOM 600 O LEU A 178 7.669 5.423 -4.916 1.00 24.01 O ATOM 601 CB LEU A 178 5.336 3.382 -5.514 1.00 43.53 C ATOM 602 CG LEU A 178 4.044 3.041 -6.235 1.00 13.40 C ATOM 603 CD1 LEU A 178 4.174 1.721 -6.951 1.00 3.21 C ATOM 604 CD2 LEU A 178 2.895 2.996 -5.271 1.00 3.31 C ATOM 0 H LEU A 178 5.481 5.811 -6.558 1.00 23.11 H new ATOM 0 HA LEU A 178 4.672 4.735 -3.939 1.00 62.23 H new ATOM 0 HB2 LEU A 178 6.145 3.374 -6.244 1.00 43.53 H new ATOM 0 HB3 LEU A 178 5.546 2.588 -4.797 1.00 43.53 H new ATOM 0 HG LEU A 178 3.848 3.821 -6.971 1.00 13.40 H new ATOM 0 HD11 LEU A 178 3.239 1.491 -7.463 1.00 3.21 H new ATOM 0 HD12 LEU A 178 4.982 1.781 -7.680 1.00 3.21 H new ATOM 0 HD13 LEU A 178 4.395 0.935 -6.228 1.00 3.21 H new ATOM 0 HD21 LEU A 178 1.979 2.750 -5.808 1.00 3.31 H new ATOM 0 HD22 LEU A 178 3.086 2.237 -4.513 1.00 3.31 H new ATOM 0 HD23 LEU A 178 2.784 3.968 -4.791 1.00 3.31 H new ATOM 616 N ARG A 179 6.966 4.513 -2.985 1.00 3.22 N ATOM 617 CA ARG A 179 8.289 4.377 -2.419 1.00 5.33 C ATOM 618 C ARG A 179 8.744 2.966 -2.678 1.00 34.23 C ATOM 619 O ARG A 179 9.770 2.720 -3.315 1.00 2.52 O ATOM 620 CB ARG A 179 8.308 4.602 -0.910 1.00 61.02 C ATOM 621 CG ARG A 179 8.199 6.025 -0.437 1.00 51.13 C ATOM 622 CD ARG A 179 9.385 6.865 -0.893 1.00 54.21 C ATOM 623 NE ARG A 179 9.455 8.105 -0.126 1.00 2.04 N ATOM 624 CZ ARG A 179 9.778 9.309 -0.587 1.00 43.30 C ATOM 625 NH1 ARG A 179 10.054 9.499 -1.873 1.00 50.41 N ATOM 626 NH2 ARG A 179 9.823 10.333 0.254 1.00 0.01 N ATOM 0 H ARG A 179 6.208 4.287 -2.341 1.00 3.22 H new ATOM 0 HA ARG A 179 8.935 5.126 -2.877 1.00 5.33 H new ATOM 0 HB2 ARG A 179 7.488 4.034 -0.471 1.00 61.02 H new ATOM 0 HB3 ARG A 179 9.233 4.182 -0.515 1.00 61.02 H new ATOM 0 HG2 ARG A 179 7.276 6.464 -0.815 1.00 51.13 H new ATOM 0 HG3 ARG A 179 8.138 6.043 0.651 1.00 51.13 H new ATOM 0 HD2 ARG A 179 10.309 6.300 -0.768 1.00 54.21 H new ATOM 0 HD3 ARG A 179 9.291 7.092 -1.955 1.00 54.21 H new ATOM 0 HE ARG A 179 9.233 8.041 0.867 1.00 2.04 H new ATOM 0 HH11 ARG A 179 10.020 8.714 -2.523 1.00 50.41 H new ATOM 0 HH12 ARG A 179 10.300 10.430 -2.210 1.00 50.41 H new ATOM 0 HH21 ARG A 179 9.611 10.191 1.242 1.00 0.01 H new ATOM 0 HH22 ARG A 179 10.070 11.262 -0.087 1.00 0.01 H new ATOM 640 N GLY A 180 7.932 2.058 -2.215 1.00 55.50 N ATOM 641 CA GLY A 180 8.184 0.654 -2.331 1.00 32.13 C ATOM 642 C GLY A 180 7.166 -0.120 -1.537 1.00 10.41 C ATOM 643 O GLY A 180 6.303 0.486 -0.877 1.00 14.12 O ATOM 0 H GLY A 180 7.059 2.280 -1.737 1.00 55.50 H new ATOM 0 HA2 GLY A 180 8.144 0.355 -3.378 1.00 32.13 H new ATOM 0 HA3 GLY A 180 9.187 0.426 -1.972 1.00 32.13 H new ATOM 647 N ILE A 181 7.240 -1.421 -1.600 1.00 54.44 N ATOM 648 CA ILE A 181 6.324 -2.287 -0.899 1.00 13.23 C ATOM 649 C ILE A 181 7.127 -3.288 -0.080 1.00 24.32 C ATOM 650 O ILE A 181 7.937 -4.039 -0.630 1.00 32.11 O ATOM 651 CB ILE A 181 5.384 -3.058 -1.888 1.00 72.41 C ATOM 652 CG1 ILE A 181 4.609 -2.069 -2.787 1.00 63.42 C ATOM 653 CG2 ILE A 181 4.409 -3.961 -1.120 1.00 1.20 C ATOM 654 CD1 ILE A 181 3.742 -2.725 -3.846 1.00 35.21 C ATOM 0 H ILE A 181 7.945 -1.918 -2.145 1.00 54.44 H new ATOM 0 HA ILE A 181 5.696 -1.674 -0.253 1.00 13.23 H new ATOM 0 HB ILE A 181 6.006 -3.688 -2.524 1.00 72.41 H new ATOM 0 HG12 ILE A 181 3.978 -1.443 -2.156 1.00 63.42 H new ATOM 0 HG13 ILE A 181 5.323 -1.409 -3.279 1.00 63.42 H new ATOM 0 HG21 ILE A 181 3.766 -4.486 -1.826 1.00 1.20 H new ATOM 0 HG22 ILE A 181 4.971 -4.686 -0.532 1.00 1.20 H new ATOM 0 HG23 ILE A 181 3.796 -3.352 -0.455 1.00 1.20 H new ATOM 0 HD11 ILE A 181 3.236 -1.956 -4.429 1.00 35.21 H new ATOM 0 HD12 ILE A 181 4.366 -3.328 -4.505 1.00 35.21 H new ATOM 0 HD13 ILE A 181 3.000 -3.363 -3.365 1.00 35.21 H new ATOM 666 N ARG A 182 6.921 -3.284 1.212 1.00 73.23 N ATOM 667 CA ARG A 182 7.608 -4.191 2.098 1.00 31.33 C ATOM 668 C ARG A 182 6.684 -5.361 2.399 1.00 54.22 C ATOM 669 O ARG A 182 5.533 -5.169 2.782 1.00 33.42 O ATOM 670 CB ARG A 182 8.085 -3.433 3.380 1.00 14.51 C ATOM 671 CG ARG A 182 8.894 -4.256 4.398 1.00 54.42 C ATOM 672 CD ARG A 182 8.021 -5.149 5.275 1.00 41.12 C ATOM 673 NE ARG A 182 8.817 -6.065 6.101 1.00 61.24 N ATOM 674 CZ ARG A 182 8.372 -6.702 7.199 1.00 63.41 C ATOM 675 NH1 ARG A 182 7.177 -6.413 7.710 1.00 72.25 N ATOM 676 NH2 ARG A 182 9.148 -7.582 7.806 1.00 75.31 N ATOM 0 H ARG A 182 6.272 -2.652 1.681 1.00 73.23 H new ATOM 0 HA ARG A 182 8.509 -4.589 1.631 1.00 31.33 H new ATOM 0 HB2 ARG A 182 8.691 -2.582 3.069 1.00 14.51 H new ATOM 0 HB3 ARG A 182 7.207 -3.031 3.886 1.00 14.51 H new ATOM 0 HG2 ARG A 182 9.616 -4.875 3.865 1.00 54.42 H new ATOM 0 HG3 ARG A 182 9.464 -3.578 5.034 1.00 54.42 H new ATOM 0 HD2 ARG A 182 7.401 -4.527 5.920 1.00 41.12 H new ATOM 0 HD3 ARG A 182 7.345 -5.726 4.644 1.00 41.12 H new ATOM 0 HE ARG A 182 9.783 -6.232 5.820 1.00 61.24 H new ATOM 0 HH11 ARG A 182 6.592 -5.704 7.269 1.00 72.25 H new ATOM 0 HH12 ARG A 182 6.847 -6.901 8.543 1.00 72.25 H new ATOM 0 HH21 ARG A 182 10.081 -7.776 7.442 1.00 75.31 H new ATOM 0 HH22 ARG A 182 8.814 -8.067 8.639 1.00 75.31 H new ATOM 690 N THR A 183 7.178 -6.547 2.210 1.00 44.11 N ATOM 691 CA THR A 183 6.401 -7.747 2.394 1.00 11.14 C ATOM 692 C THR A 183 7.064 -8.661 3.458 1.00 41.23 C ATOM 693 O THR A 183 8.259 -8.998 3.358 1.00 11.01 O ATOM 694 CB THR A 183 6.206 -8.472 1.008 1.00 23.43 C ATOM 695 OG1 THR A 183 5.558 -9.742 1.142 1.00 3.33 O ATOM 696 CG2 THR A 183 7.529 -8.636 0.261 1.00 43.22 C ATOM 0 H THR A 183 8.141 -6.716 1.921 1.00 44.11 H new ATOM 0 HA THR A 183 5.411 -7.493 2.771 1.00 11.14 H new ATOM 0 HB THR A 183 5.555 -7.824 0.421 1.00 23.43 H new ATOM 0 HG1 THR A 183 5.457 -10.153 0.258 1.00 3.33 H new ATOM 0 HG21 THR A 183 7.350 -9.140 -0.689 1.00 43.22 H new ATOM 0 HG22 THR A 183 7.966 -7.655 0.075 1.00 43.22 H new ATOM 0 HG23 THR A 183 8.216 -9.230 0.864 1.00 43.22 H new ATOM 704 N GLY A 184 6.317 -8.997 4.493 1.00 33.02 N ATOM 705 CA GLY A 184 6.831 -9.839 5.561 1.00 50.00 C ATOM 706 C GLY A 184 5.747 -10.734 6.136 1.00 24.24 C ATOM 707 O GLY A 184 4.603 -10.303 6.223 1.00 61.41 O ATOM 0 H GLY A 184 5.349 -8.700 4.618 1.00 33.02 H new ATOM 0 HA2 GLY A 184 7.647 -10.453 5.181 1.00 50.00 H new ATOM 0 HA3 GLY A 184 7.245 -9.213 6.352 1.00 50.00 H new ATOM 711 N PRO A 185 6.069 -11.991 6.521 1.00 23.41 N ATOM 712 CA PRO A 185 5.086 -12.961 7.071 1.00 24.21 C ATOM 713 C PRO A 185 4.357 -12.412 8.301 1.00 53.41 C ATOM 714 O PRO A 185 4.981 -11.831 9.191 1.00 44.43 O ATOM 715 CB PRO A 185 5.947 -14.170 7.462 1.00 10.20 C ATOM 716 CG PRO A 185 7.345 -13.659 7.495 1.00 73.25 C ATOM 717 CD PRO A 185 7.415 -12.575 6.467 1.00 74.20 C ATOM 0 HA PRO A 185 4.303 -13.195 6.350 1.00 24.21 H new ATOM 0 HB2 PRO A 185 5.650 -14.568 8.432 1.00 10.20 H new ATOM 0 HB3 PRO A 185 5.840 -14.979 6.740 1.00 10.20 H new ATOM 0 HG2 PRO A 185 7.596 -13.275 8.484 1.00 73.25 H new ATOM 0 HG3 PRO A 185 8.056 -14.454 7.272 1.00 73.25 H new ATOM 0 HD2 PRO A 185 8.185 -11.841 6.705 1.00 74.20 H new ATOM 0 HD3 PRO A 185 7.646 -12.970 5.478 1.00 74.20 H new ATOM 725 N ALA A 186 3.049 -12.611 8.361 1.00 22.31 N ATOM 726 CA ALA A 186 2.249 -12.036 9.438 1.00 73.43 C ATOM 727 C ALA A 186 2.098 -12.983 10.606 1.00 70.12 C ATOM 728 O ALA A 186 1.808 -12.565 11.727 1.00 1.33 O ATOM 729 CB ALA A 186 0.886 -11.622 8.928 1.00 52.10 C ATOM 0 H ALA A 186 2.520 -13.161 7.684 1.00 22.31 H new ATOM 0 HA ALA A 186 2.783 -11.155 9.794 1.00 73.43 H new ATOM 0 HB1 ALA A 186 0.305 -11.196 9.746 1.00 52.10 H new ATOM 0 HB2 ALA A 186 1.003 -10.878 8.140 1.00 52.10 H new ATOM 0 HB3 ALA A 186 0.366 -12.494 8.530 1.00 52.10 H new ATOM 735 N GLY A 187 2.322 -14.237 10.365 1.00 73.40 N ATOM 736 CA GLY A 187 2.130 -15.189 11.385 1.00 43.32 C ATOM 737 C GLY A 187 2.093 -16.594 10.893 1.00 54.35 C ATOM 738 O GLY A 187 3.112 -17.281 10.896 1.00 4.21 O ATOM 0 H GLY A 187 2.637 -14.613 9.471 1.00 73.40 H new ATOM 0 HA2 GLY A 187 2.932 -15.091 12.117 1.00 43.32 H new ATOM 0 HA3 GLY A 187 1.196 -14.970 11.903 1.00 43.32 H new ATOM 742 N ASP A 188 0.953 -17.029 10.447 1.00 14.13 N ATOM 743 CA ASP A 188 0.805 -18.435 10.079 1.00 2.32 C ATOM 744 C ASP A 188 0.619 -18.609 8.603 1.00 10.53 C ATOM 745 O ASP A 188 1.523 -19.025 7.895 1.00 65.15 O ATOM 746 CB ASP A 188 -0.376 -19.115 10.809 1.00 13.21 C ATOM 747 CG ASP A 188 -0.265 -19.125 12.311 1.00 55.10 C ATOM 748 OD1 ASP A 188 0.412 -20.012 12.867 1.00 52.22 O ATOM 749 OD2 ASP A 188 -0.886 -18.256 12.971 1.00 51.12 O ATOM 0 H ASP A 188 0.118 -16.457 10.325 1.00 14.13 H new ATOM 0 HA ASP A 188 1.734 -18.915 10.388 1.00 2.32 H new ATOM 0 HB2 ASP A 188 -1.299 -18.607 10.530 1.00 13.21 H new ATOM 0 HB3 ASP A 188 -0.459 -20.143 10.457 1.00 13.21 H new ATOM 754 N ASP A 189 -0.536 -18.231 8.139 1.00 71.41 N ATOM 755 CA ASP A 189 -0.950 -18.481 6.772 1.00 64.22 C ATOM 756 C ASP A 189 -1.328 -17.156 6.140 1.00 73.33 C ATOM 757 O ASP A 189 -2.205 -17.036 5.285 1.00 34.03 O ATOM 758 CB ASP A 189 -2.117 -19.480 6.781 1.00 41.13 C ATOM 759 CG ASP A 189 -2.474 -20.038 5.421 1.00 4.51 C ATOM 760 OD1 ASP A 189 -1.573 -20.394 4.652 1.00 14.35 O ATOM 761 OD2 ASP A 189 -3.676 -20.175 5.119 1.00 41.11 O ATOM 0 H ASP A 189 -1.231 -17.735 8.697 1.00 71.41 H new ATOM 0 HA ASP A 189 -0.146 -18.921 6.181 1.00 64.22 H new ATOM 0 HB2 ASP A 189 -1.866 -20.307 7.445 1.00 41.13 H new ATOM 0 HB3 ASP A 189 -2.995 -18.990 7.201 1.00 41.13 H new ATOM 766 N ASN A 190 -0.610 -16.178 6.565 1.00 64.00 N ATOM 767 CA ASN A 190 -0.746 -14.818 6.158 1.00 13.24 C ATOM 768 C ASN A 190 0.579 -14.147 6.066 1.00 54.11 C ATOM 769 O ASN A 190 1.576 -14.580 6.661 1.00 42.05 O ATOM 770 CB ASN A 190 -1.643 -13.983 7.083 1.00 11.20 C ATOM 771 CG ASN A 190 -1.504 -14.299 8.581 1.00 4.13 C ATOM 772 OD1 ASN A 190 -0.474 -14.798 9.044 1.00 11.02 O ATOM 773 ND2 ASN A 190 -2.501 -13.961 9.350 1.00 12.31 N ATOM 0 H ASN A 190 0.135 -16.311 7.249 1.00 64.00 H new ATOM 0 HA ASN A 190 -1.222 -14.867 5.179 1.00 13.24 H new ATOM 0 HB2 ASN A 190 -1.418 -12.928 6.927 1.00 11.20 H new ATOM 0 HB3 ASN A 190 -2.682 -14.134 6.790 1.00 11.20 H new ATOM 0 HD21 ASN A 190 -2.440 -14.107 10.358 1.00 12.31 H new ATOM 0 HD22 ASN A 190 -3.342 -13.550 8.944 1.00 12.31 H new ATOM 780 N ILE A 191 0.563 -13.078 5.377 1.00 53.23 N ATOM 781 CA ILE A 191 1.714 -12.272 5.127 1.00 73.11 C ATOM 782 C ILE A 191 1.253 -10.813 5.028 1.00 22.22 C ATOM 783 O ILE A 191 0.117 -10.545 4.628 1.00 65.53 O ATOM 784 CB ILE A 191 2.444 -12.754 3.828 1.00 1.12 C ATOM 785 CG1 ILE A 191 3.745 -11.992 3.596 1.00 64.22 C ATOM 786 CG2 ILE A 191 1.535 -12.644 2.607 1.00 32.25 C ATOM 787 CD1 ILE A 191 4.599 -12.574 2.499 1.00 44.24 C ATOM 0 H ILE A 191 -0.286 -12.713 4.946 1.00 53.23 H new ATOM 0 HA ILE A 191 2.437 -12.361 5.938 1.00 73.11 H new ATOM 0 HB ILE A 191 2.694 -13.805 3.975 1.00 1.12 H new ATOM 0 HG12 ILE A 191 3.511 -10.956 3.351 1.00 64.22 H new ATOM 0 HG13 ILE A 191 4.318 -11.979 4.523 1.00 64.22 H new ATOM 0 HG21 ILE A 191 2.071 -12.986 1.722 1.00 32.25 H new ATOM 0 HG22 ILE A 191 0.649 -13.262 2.756 1.00 32.25 H new ATOM 0 HG23 ILE A 191 1.234 -11.605 2.470 1.00 32.25 H new ATOM 0 HD11 ILE A 191 5.507 -11.980 2.391 1.00 44.24 H new ATOM 0 HD12 ILE A 191 4.865 -13.601 2.751 1.00 44.24 H new ATOM 0 HD13 ILE A 191 4.044 -12.562 1.561 1.00 44.24 H new ATOM 799 N THR A 192 2.068 -9.906 5.452 1.00 63.04 N ATOM 800 CA THR A 192 1.719 -8.527 5.443 1.00 63.14 C ATOM 801 C THR A 192 2.493 -7.790 4.360 1.00 21.24 C ATOM 802 O THR A 192 3.713 -7.937 4.240 1.00 70.13 O ATOM 803 CB THR A 192 2.046 -7.897 6.796 1.00 2.21 C ATOM 804 OG1 THR A 192 1.530 -8.721 7.842 1.00 33.23 O ATOM 805 CG2 THR A 192 1.418 -6.533 6.913 1.00 54.15 C ATOM 0 H THR A 192 3.000 -10.103 5.816 1.00 63.04 H new ATOM 0 HA THR A 192 0.650 -8.447 5.244 1.00 63.14 H new ATOM 0 HB THR A 192 3.129 -7.806 6.878 1.00 2.21 H new ATOM 0 HG1 THR A 192 1.741 -8.318 8.710 1.00 33.23 H new ATOM 0 HG21 THR A 192 1.663 -6.102 7.884 1.00 54.15 H new ATOM 0 HG22 THR A 192 1.800 -5.887 6.122 1.00 54.15 H new ATOM 0 HG23 THR A 192 0.336 -6.621 6.818 1.00 54.15 H new ATOM 813 N LEU A 193 1.784 -7.036 3.579 1.00 32.21 N ATOM 814 CA LEU A 193 2.377 -6.200 2.568 1.00 31.20 C ATOM 815 C LEU A 193 2.112 -4.782 2.954 1.00 11.52 C ATOM 816 O LEU A 193 0.982 -4.434 3.276 1.00 43.44 O ATOM 817 CB LEU A 193 1.772 -6.420 1.162 1.00 21.41 C ATOM 818 CG LEU A 193 1.938 -7.784 0.481 1.00 4.32 C ATOM 819 CD1 LEU A 193 1.147 -8.868 1.196 1.00 22.24 C ATOM 820 CD2 LEU A 193 1.507 -7.677 -0.975 1.00 62.11 C ATOM 0 H LEU A 193 0.766 -6.979 3.621 1.00 32.21 H new ATOM 0 HA LEU A 193 3.438 -6.445 2.512 1.00 31.20 H new ATOM 0 HB2 LEU A 193 0.704 -6.215 1.229 1.00 21.41 H new ATOM 0 HB3 LEU A 193 2.200 -5.668 0.499 1.00 21.41 H new ATOM 0 HG LEU A 193 2.989 -8.069 0.530 1.00 4.32 H new ATOM 0 HD11 LEU A 193 1.290 -9.820 0.684 1.00 22.24 H new ATOM 0 HD12 LEU A 193 1.495 -8.954 2.225 1.00 22.24 H new ATOM 0 HD13 LEU A 193 0.088 -8.609 1.192 1.00 22.24 H new ATOM 0 HD21 LEU A 193 1.624 -8.645 -1.461 1.00 62.11 H new ATOM 0 HD22 LEU A 193 0.462 -7.371 -1.024 1.00 62.11 H new ATOM 0 HD23 LEU A 193 2.126 -6.938 -1.484 1.00 62.11 H new ATOM 832 N THR A 194 3.105 -3.982 2.970 1.00 71.34 N ATOM 833 CA THR A 194 2.901 -2.613 3.240 1.00 22.43 C ATOM 834 C THR A 194 3.466 -1.780 2.105 1.00 75.42 C ATOM 835 O THR A 194 4.657 -1.827 1.793 1.00 51.44 O ATOM 836 CB THR A 194 3.429 -2.183 4.641 1.00 11.41 C ATOM 837 OG1 THR A 194 3.061 -0.820 4.932 1.00 12.01 O ATOM 838 CG2 THR A 194 4.935 -2.349 4.761 1.00 11.51 C ATOM 0 H THR A 194 4.074 -4.252 2.798 1.00 71.34 H new ATOM 0 HA THR A 194 1.828 -2.430 3.290 1.00 22.43 H new ATOM 0 HB THR A 194 2.961 -2.844 5.371 1.00 11.41 H new ATOM 0 HG1 THR A 194 3.401 -0.571 5.817 1.00 12.01 H new ATOM 0 HG21 THR A 194 5.257 -2.037 5.754 1.00 11.51 H new ATOM 0 HG22 THR A 194 5.199 -3.395 4.606 1.00 11.51 H new ATOM 0 HG23 THR A 194 5.430 -1.734 4.009 1.00 11.51 H new ATOM 846 N ALA A 195 2.597 -1.096 1.448 1.00 52.21 N ATOM 847 CA ALA A 195 2.964 -0.263 0.364 1.00 72.25 C ATOM 848 C ALA A 195 3.131 1.138 0.872 1.00 23.23 C ATOM 849 O ALA A 195 2.196 1.714 1.446 1.00 51.12 O ATOM 850 CB ALA A 195 1.905 -0.323 -0.719 1.00 44.23 C ATOM 0 H ALA A 195 1.598 -1.101 1.653 1.00 52.21 H new ATOM 0 HA ALA A 195 3.904 -0.603 -0.069 1.00 72.25 H new ATOM 0 HB1 ALA A 195 2.196 0.321 -1.549 1.00 44.23 H new ATOM 0 HB2 ALA A 195 1.805 -1.349 -1.074 1.00 44.23 H new ATOM 0 HB3 ALA A 195 0.951 0.016 -0.314 1.00 44.23 H new ATOM 856 N HIS A 196 4.305 1.663 0.724 1.00 53.05 N ATOM 857 CA HIS A 196 4.574 2.994 1.154 1.00 71.11 C ATOM 858 C HIS A 196 4.431 3.902 -0.052 1.00 62.11 C ATOM 859 O HIS A 196 5.149 3.763 -1.053 1.00 32.24 O ATOM 860 CB HIS A 196 5.953 3.076 1.803 1.00 45.14 C ATOM 861 CG HIS A 196 6.224 4.364 2.512 1.00 73.43 C ATOM 862 ND1 HIS A 196 5.248 5.218 2.984 1.00 64.20 N ATOM 863 CD2 HIS A 196 7.391 4.922 2.853 1.00 3.30 C ATOM 864 CE1 HIS A 196 5.848 6.234 3.581 1.00 1.33 C ATOM 865 NE2 HIS A 196 7.157 6.106 3.531 1.00 32.22 N ATOM 0 H HIS A 196 5.100 1.182 0.303 1.00 53.05 H new ATOM 0 HA HIS A 196 3.867 3.315 1.919 1.00 71.11 H new ATOM 0 HB2 HIS A 196 6.057 2.255 2.513 1.00 45.14 H new ATOM 0 HB3 HIS A 196 6.712 2.931 1.035 1.00 45.14 H new ATOM 0 HD1 HIS A 196 4.241 5.088 2.889 1.00 64.20 H new ATOM 0 HD2 HIS A 196 8.366 4.512 2.633 1.00 3.30 H new ATOM 0 HE1 HIS A 196 5.332 7.060 4.048 1.00 1.33 H new ATOM 873 N LEU A 197 3.495 4.792 0.034 1.00 34.15 N ATOM 874 CA LEU A 197 3.063 5.587 -1.080 1.00 3.11 C ATOM 875 C LEU A 197 3.277 7.069 -0.796 1.00 1.34 C ATOM 876 O LEU A 197 3.547 7.466 0.334 1.00 22.10 O ATOM 877 CB LEU A 197 1.547 5.390 -1.238 1.00 42.32 C ATOM 878 CG LEU A 197 0.989 3.961 -1.120 1.00 44.03 C ATOM 879 CD1 LEU A 197 -0.523 3.971 -1.216 1.00 63.24 C ATOM 880 CD2 LEU A 197 1.565 3.057 -2.175 1.00 61.12 C ATOM 0 H LEU A 197 2.995 4.994 0.900 1.00 34.15 H new ATOM 0 HA LEU A 197 3.624 5.288 -1.965 1.00 3.11 H new ATOM 0 HB2 LEU A 197 1.050 6.006 -0.488 1.00 42.32 H new ATOM 0 HB3 LEU A 197 1.259 5.782 -2.214 1.00 42.32 H new ATOM 0 HG LEU A 197 1.282 3.573 -0.144 1.00 44.03 H new ATOM 0 HD11 LEU A 197 -0.900 2.952 -1.131 1.00 63.24 H new ATOM 0 HD12 LEU A 197 -0.935 4.579 -0.410 1.00 63.24 H new ATOM 0 HD13 LEU A 197 -0.824 4.390 -2.176 1.00 63.24 H new ATOM 0 HD21 LEU A 197 1.149 2.056 -2.062 1.00 61.12 H new ATOM 0 HD22 LEU A 197 1.315 3.445 -3.163 1.00 61.12 H new ATOM 0 HD23 LEU A 197 2.649 3.015 -2.066 1.00 61.12 H new ATOM 892 N LEU A 198 3.147 7.853 -1.828 1.00 22.32 N ATOM 893 CA LEU A 198 3.135 9.296 -1.768 1.00 65.53 C ATOM 894 C LEU A 198 1.950 9.747 -2.591 1.00 15.25 C ATOM 895 O LEU A 198 1.892 9.483 -3.799 1.00 2.00 O ATOM 896 CB LEU A 198 4.402 9.923 -2.370 1.00 5.22 C ATOM 897 CG LEU A 198 5.755 9.511 -1.813 1.00 45.44 C ATOM 898 CD1 LEU A 198 6.245 8.229 -2.452 1.00 13.01 C ATOM 899 CD2 LEU A 198 6.747 10.624 -2.003 1.00 32.41 C ATOM 0 H LEU A 198 3.042 7.494 -2.777 1.00 22.32 H new ATOM 0 HA LEU A 198 3.083 9.608 -0.725 1.00 65.53 H new ATOM 0 HB2 LEU A 198 4.404 9.705 -3.438 1.00 5.22 H new ATOM 0 HB3 LEU A 198 4.317 11.005 -2.266 1.00 5.22 H new ATOM 0 HG LEU A 198 5.646 9.319 -0.746 1.00 45.44 H new ATOM 0 HD11 LEU A 198 7.215 7.961 -2.033 1.00 13.01 H new ATOM 0 HD12 LEU A 198 5.531 7.429 -2.256 1.00 13.01 H new ATOM 0 HD13 LEU A 198 6.342 8.373 -3.528 1.00 13.01 H new ATOM 0 HD21 LEU A 198 7.714 10.322 -1.602 1.00 32.41 H new ATOM 0 HD22 LEU A 198 6.848 10.844 -3.066 1.00 32.41 H new ATOM 0 HD23 LEU A 198 6.399 11.515 -1.480 1.00 32.41 H new ATOM 911 N MET A 199 1.001 10.369 -1.963 1.00 71.25 N ATOM 912 CA MET A 199 -0.197 10.820 -2.652 1.00 23.41 C ATOM 913 C MET A 199 -0.382 12.311 -2.463 1.00 10.43 C ATOM 914 O MET A 199 -0.026 12.854 -1.409 1.00 20.02 O ATOM 915 CB MET A 199 -1.416 10.017 -2.162 1.00 4.41 C ATOM 916 CG MET A 199 -2.761 10.424 -2.760 1.00 2.02 C ATOM 917 SD MET A 199 -4.136 9.457 -2.087 1.00 1.45 S ATOM 918 CE MET A 199 -5.512 10.162 -2.979 1.00 10.41 C ATOM 0 H MET A 199 1.021 10.584 -0.966 1.00 71.25 H new ATOM 0 HA MET A 199 -0.092 10.642 -3.722 1.00 23.41 H new ATOM 0 HB2 MET A 199 -1.246 8.963 -2.381 1.00 4.41 H new ATOM 0 HB3 MET A 199 -1.478 10.111 -1.078 1.00 4.41 H new ATOM 0 HG2 MET A 199 -2.936 11.482 -2.567 1.00 2.02 H new ATOM 0 HG3 MET A 199 -2.727 10.298 -3.842 1.00 2.02 H new ATOM 0 HE1 MET A 199 -6.440 9.706 -2.635 1.00 10.41 H new ATOM 0 HE2 MET A 199 -5.548 11.237 -2.802 1.00 10.41 H new ATOM 0 HE3 MET A 199 -5.389 9.974 -4.046 1.00 10.41 H new ATOM 928 N VAL A 200 -0.893 12.972 -3.485 1.00 54.13 N ATOM 929 CA VAL A 200 -1.124 14.400 -3.441 1.00 60.43 C ATOM 930 C VAL A 200 -2.237 14.752 -2.479 1.00 51.11 C ATOM 931 O VAL A 200 -3.348 14.207 -2.550 1.00 30.33 O ATOM 932 CB VAL A 200 -1.412 15.015 -4.840 1.00 10.14 C ATOM 933 CG1 VAL A 200 -0.145 15.051 -5.683 1.00 52.53 C ATOM 934 CG2 VAL A 200 -2.511 14.247 -5.581 1.00 71.13 C ATOM 0 H VAL A 200 -1.159 12.533 -4.367 1.00 54.13 H new ATOM 0 HA VAL A 200 -0.193 14.838 -3.081 1.00 60.43 H new ATOM 0 HB VAL A 200 -1.762 16.035 -4.679 1.00 10.14 H new ATOM 0 HG11 VAL A 200 -0.369 15.485 -6.658 1.00 52.53 H new ATOM 0 HG12 VAL A 200 0.609 15.657 -5.181 1.00 52.53 H new ATOM 0 HG13 VAL A 200 0.233 14.037 -5.815 1.00 52.53 H new ATOM 0 HG21 VAL A 200 -2.683 14.707 -6.554 1.00 71.13 H new ATOM 0 HG22 VAL A 200 -2.201 13.211 -5.719 1.00 71.13 H new ATOM 0 HG23 VAL A 200 -3.431 14.276 -4.998 1.00 71.13 H new ATOM 944 N GLY A 201 -1.905 15.662 -1.583 1.00 43.53 N ATOM 945 CA GLY A 201 -2.785 16.088 -0.530 1.00 13.13 C ATOM 946 C GLY A 201 -3.297 14.929 0.271 1.00 35.31 C ATOM 947 O GLY A 201 -2.536 14.198 0.925 1.00 41.14 O ATOM 0 H GLY A 201 -0.999 16.130 -1.573 1.00 43.53 H new ATOM 0 HA2 GLY A 201 -2.257 16.779 0.127 1.00 13.13 H new ATOM 0 HA3 GLY A 201 -3.626 16.634 -0.958 1.00 13.13 H new ATOM 951 N HIS A 202 -4.564 14.758 0.176 1.00 75.40 N ATOM 952 CA HIS A 202 -5.287 13.703 0.787 1.00 33.51 C ATOM 953 C HIS A 202 -6.677 13.763 0.251 1.00 55.04 C ATOM 954 O HIS A 202 -7.441 14.663 0.582 1.00 43.31 O ATOM 955 CB HIS A 202 -5.302 13.796 2.327 1.00 3.23 C ATOM 956 CG HIS A 202 -6.013 12.642 2.995 1.00 74.13 C ATOM 957 ND1 HIS A 202 -7.002 12.788 3.932 1.00 22.14 N ATOM 958 CD2 HIS A 202 -5.835 11.307 2.848 1.00 13.02 C ATOM 959 CE1 HIS A 202 -7.387 11.575 4.324 1.00 34.43 C ATOM 960 NE2 HIS A 202 -6.708 10.634 3.691 1.00 53.44 N ATOM 0 H HIS A 202 -5.160 15.387 -0.362 1.00 75.40 H new ATOM 0 HA HIS A 202 -4.802 12.755 0.554 1.00 33.51 H new ATOM 0 HB2 HIS A 202 -4.275 13.839 2.690 1.00 3.23 H new ATOM 0 HB3 HIS A 202 -5.783 14.728 2.622 1.00 3.23 H new ATOM 0 HD2 HIS A 202 -5.126 10.840 2.180 1.00 13.02 H new ATOM 0 HE1 HIS A 202 -8.153 11.385 5.062 1.00 34.43 H new ATOM 0 HE2 HIS A 202 -6.805 9.624 3.799 1.00 53.44 H new ATOM 968 N THR A 203 -6.970 12.877 -0.635 1.00 14.53 N ATOM 969 CA THR A 203 -8.259 12.746 -1.188 1.00 72.02 C ATOM 970 C THR A 203 -8.891 11.470 -0.596 1.00 54.12 C ATOM 971 O THR A 203 -8.694 10.364 -1.137 1.00 75.10 O ATOM 972 CB THR A 203 -8.184 12.642 -2.720 1.00 32.42 C ATOM 973 OG1 THR A 203 -7.250 13.622 -3.221 1.00 71.15 O ATOM 974 CG2 THR A 203 -9.546 12.898 -3.338 1.00 32.23 C ATOM 0 H THR A 203 -6.294 12.206 -1.002 1.00 14.53 H new ATOM 0 HA THR A 203 -8.863 13.621 -0.948 1.00 72.02 H new ATOM 0 HB THR A 203 -7.855 11.637 -2.986 1.00 32.42 H new ATOM 0 HG1 THR A 203 -7.199 13.556 -4.197 1.00 71.15 H new ATOM 0 HG21 THR A 203 -9.474 12.820 -4.423 1.00 32.23 H new ATOM 0 HG22 THR A 203 -10.258 12.160 -2.968 1.00 32.23 H new ATOM 0 HG23 THR A 203 -9.886 13.898 -3.068 1.00 32.23 H new ATOM 982 N PRO A 204 -9.565 11.616 0.574 1.00 1.20 N ATOM 983 CA PRO A 204 -10.174 10.520 1.333 1.00 12.20 C ATOM 984 C PRO A 204 -10.901 9.506 0.484 1.00 32.15 C ATOM 985 O PRO A 204 -10.601 8.330 0.548 1.00 43.34 O ATOM 986 CB PRO A 204 -11.147 11.234 2.258 1.00 31.02 C ATOM 987 CG PRO A 204 -10.519 12.552 2.513 1.00 30.41 C ATOM 988 CD PRO A 204 -9.750 12.898 1.267 1.00 0.31 C ATOM 0 HA PRO A 204 -9.412 9.931 1.843 1.00 12.20 H new ATOM 0 HB2 PRO A 204 -12.127 11.345 1.794 1.00 31.02 H new ATOM 0 HB3 PRO A 204 -11.294 10.679 3.184 1.00 31.02 H new ATOM 0 HG2 PRO A 204 -11.274 13.308 2.727 1.00 30.41 H new ATOM 0 HG3 PRO A 204 -9.858 12.507 3.379 1.00 30.41 H new ATOM 0 HD2 PRO A 204 -10.299 13.607 0.647 1.00 0.31 H new ATOM 0 HD3 PRO A 204 -8.792 13.359 1.508 1.00 0.31 H new ATOM 996 N ALA A 205 -11.785 9.979 -0.351 1.00 3.11 N ATOM 997 CA ALA A 205 -12.637 9.117 -1.168 1.00 53.54 C ATOM 998 C ALA A 205 -11.835 8.203 -2.085 1.00 43.41 C ATOM 999 O ALA A 205 -12.147 7.024 -2.220 1.00 55.04 O ATOM 1000 CB ALA A 205 -13.643 9.935 -1.963 1.00 60.41 C ATOM 0 H ALA A 205 -11.946 10.976 -0.494 1.00 3.11 H new ATOM 0 HA ALA A 205 -13.183 8.474 -0.478 1.00 53.54 H new ATOM 0 HB1 ALA A 205 -14.263 9.267 -2.561 1.00 60.41 H new ATOM 0 HB2 ALA A 205 -14.275 10.500 -1.278 1.00 60.41 H new ATOM 0 HB3 ALA A 205 -13.113 10.624 -2.620 1.00 60.41 H new ATOM 1006 N LYS A 206 -10.779 8.724 -2.669 1.00 60.32 N ATOM 1007 CA LYS A 206 -9.979 7.940 -3.583 1.00 74.41 C ATOM 1008 C LYS A 206 -9.142 6.923 -2.840 1.00 20.54 C ATOM 1009 O LYS A 206 -9.000 5.782 -3.284 1.00 21.13 O ATOM 1010 CB LYS A 206 -9.117 8.827 -4.492 1.00 42.33 C ATOM 1011 CG LYS A 206 -9.930 9.700 -5.439 1.00 51.04 C ATOM 1012 CD LYS A 206 -9.067 10.636 -6.285 1.00 34.54 C ATOM 1013 CE LYS A 206 -8.079 9.900 -7.191 1.00 64.03 C ATOM 1014 NZ LYS A 206 -7.357 10.852 -8.072 1.00 53.21 N ATOM 0 H LYS A 206 -10.456 9.681 -2.529 1.00 60.32 H new ATOM 0 HA LYS A 206 -10.664 7.394 -4.231 1.00 74.41 H new ATOM 0 HB2 LYS A 206 -8.488 9.466 -3.872 1.00 42.33 H new ATOM 0 HB3 LYS A 206 -8.450 8.194 -5.077 1.00 42.33 H new ATOM 0 HG2 LYS A 206 -10.516 9.061 -6.099 1.00 51.04 H new ATOM 0 HG3 LYS A 206 -10.637 10.293 -4.859 1.00 51.04 H new ATOM 0 HD2 LYS A 206 -9.716 11.260 -6.899 1.00 34.54 H new ATOM 0 HD3 LYS A 206 -8.514 11.304 -5.625 1.00 34.54 H new ATOM 0 HE2 LYS A 206 -7.363 9.348 -6.582 1.00 64.03 H new ATOM 0 HE3 LYS A 206 -8.612 9.169 -7.799 1.00 64.03 H new ATOM 0 HZ1 LYS A 206 -6.558 10.366 -8.527 1.00 53.21 H new ATOM 0 HZ2 LYS A 206 -8.006 11.210 -8.802 1.00 53.21 H new ATOM 0 HZ3 LYS A 206 -7.001 11.648 -7.505 1.00 53.21 H new ATOM 1028 N LEU A 207 -8.647 7.316 -1.694 1.00 2.33 N ATOM 1029 CA LEU A 207 -7.811 6.453 -0.891 1.00 34.41 C ATOM 1030 C LEU A 207 -8.674 5.361 -0.256 1.00 40.41 C ATOM 1031 O LEU A 207 -8.335 4.173 -0.300 1.00 25.53 O ATOM 1032 CB LEU A 207 -7.041 7.307 0.166 1.00 54.22 C ATOM 1033 CG LEU A 207 -5.961 6.618 1.053 1.00 2.43 C ATOM 1034 CD1 LEU A 207 -5.100 7.678 1.725 1.00 1.44 C ATOM 1035 CD2 LEU A 207 -6.584 5.745 2.138 1.00 65.24 C ATOM 0 H LEU A 207 -8.810 8.239 -1.290 1.00 2.33 H new ATOM 0 HA LEU A 207 -7.062 5.957 -1.509 1.00 34.41 H new ATOM 0 HB2 LEU A 207 -6.557 8.128 -0.364 1.00 54.22 H new ATOM 0 HB3 LEU A 207 -7.781 7.750 0.833 1.00 54.22 H new ATOM 0 HG LEU A 207 -5.361 5.984 0.400 1.00 2.43 H new ATOM 0 HD11 LEU A 207 -4.345 7.194 2.345 1.00 1.44 H new ATOM 0 HD12 LEU A 207 -4.610 8.285 0.964 1.00 1.44 H new ATOM 0 HD13 LEU A 207 -5.728 8.315 2.348 1.00 1.44 H new ATOM 0 HD21 LEU A 207 -5.795 5.284 2.732 1.00 65.24 H new ATOM 0 HD22 LEU A 207 -7.212 6.359 2.783 1.00 65.24 H new ATOM 0 HD23 LEU A 207 -7.191 4.967 1.675 1.00 65.24 H new ATOM 1047 N GLU A 208 -9.820 5.756 0.252 1.00 31.40 N ATOM 1048 CA GLU A 208 -10.695 4.843 0.941 1.00 52.55 C ATOM 1049 C GLU A 208 -11.362 3.865 0.000 1.00 51.21 C ATOM 1050 O GLU A 208 -11.595 2.704 0.364 1.00 33.20 O ATOM 1051 CB GLU A 208 -11.694 5.579 1.810 1.00 22.14 C ATOM 1052 CG GLU A 208 -11.028 6.299 2.969 1.00 72.02 C ATOM 1053 CD GLU A 208 -11.997 7.015 3.849 1.00 65.42 C ATOM 1054 OE1 GLU A 208 -12.828 6.341 4.502 1.00 13.43 O ATOM 1055 OE2 GLU A 208 -11.913 8.256 3.970 1.00 73.23 O ATOM 0 H GLU A 208 -10.167 6.714 0.198 1.00 31.40 H new ATOM 0 HA GLU A 208 -10.072 4.245 1.607 1.00 52.55 H new ATOM 0 HB2 GLU A 208 -12.239 6.301 1.202 1.00 22.14 H new ATOM 0 HB3 GLU A 208 -12.426 4.871 2.198 1.00 22.14 H new ATOM 0 HG2 GLU A 208 -10.470 5.577 3.565 1.00 72.02 H new ATOM 0 HG3 GLU A 208 -10.305 7.015 2.577 1.00 72.02 H new ATOM 1062 N ARG A 209 -11.627 4.295 -1.222 1.00 32.44 N ATOM 1063 CA ARG A 209 -12.217 3.398 -2.184 1.00 40.44 C ATOM 1064 C ARG A 209 -11.139 2.412 -2.642 1.00 43.31 C ATOM 1065 O ARG A 209 -11.418 1.231 -2.874 1.00 61.43 O ATOM 1066 CB ARG A 209 -12.858 4.191 -3.356 1.00 12.44 C ATOM 1067 CG ARG A 209 -13.836 3.407 -4.254 1.00 2.11 C ATOM 1068 CD ARG A 209 -13.147 2.413 -5.173 1.00 31.24 C ATOM 1069 NE ARG A 209 -14.100 1.586 -5.917 1.00 64.22 N ATOM 1070 CZ ARG A 209 -13.762 0.569 -6.719 1.00 62.43 C ATOM 1071 NH1 ARG A 209 -12.490 0.302 -6.940 1.00 71.21 N ATOM 1072 NH2 ARG A 209 -14.700 -0.165 -7.294 1.00 2.43 N ATOM 0 H ARG A 209 -11.446 5.240 -1.561 1.00 32.44 H new ATOM 0 HA ARG A 209 -13.032 2.830 -1.735 1.00 40.44 H new ATOM 0 HB2 ARG A 209 -13.387 5.049 -2.940 1.00 12.44 H new ATOM 0 HB3 ARG A 209 -12.057 4.583 -3.983 1.00 12.44 H new ATOM 0 HG2 ARG A 209 -14.549 2.875 -3.624 1.00 2.11 H new ATOM 0 HG3 ARG A 209 -14.408 4.112 -4.857 1.00 2.11 H new ATOM 0 HD2 ARG A 209 -12.512 2.952 -5.876 1.00 31.24 H new ATOM 0 HD3 ARG A 209 -12.495 1.769 -4.583 1.00 31.24 H new ATOM 0 HE ARG A 209 -15.092 1.800 -5.817 1.00 64.22 H new ATOM 0 HH11 ARG A 209 -11.766 0.870 -6.500 1.00 71.21 H new ATOM 0 HH12 ARG A 209 -12.230 -0.472 -7.551 1.00 71.21 H new ATOM 0 HH21 ARG A 209 -15.684 0.043 -7.127 1.00 2.43 H new ATOM 0 HH22 ARG A 209 -14.439 -0.939 -7.905 1.00 2.43 H new ATOM 1086 N LEU A 210 -9.904 2.884 -2.689 1.00 30.22 N ATOM 1087 CA LEU A 210 -8.790 2.053 -3.092 1.00 13.43 C ATOM 1088 C LEU A 210 -8.537 0.959 -2.065 1.00 0.52 C ATOM 1089 O LEU A 210 -8.394 -0.199 -2.420 1.00 42.22 O ATOM 1090 CB LEU A 210 -7.521 2.888 -3.305 1.00 73.50 C ATOM 1091 CG LEU A 210 -6.286 2.128 -3.798 1.00 60.31 C ATOM 1092 CD1 LEU A 210 -6.555 1.485 -5.149 1.00 51.53 C ATOM 1093 CD2 LEU A 210 -5.086 3.056 -3.879 1.00 62.53 C ATOM 0 H LEU A 210 -9.651 3.843 -2.451 1.00 30.22 H new ATOM 0 HA LEU A 210 -9.051 1.587 -4.042 1.00 13.43 H new ATOM 0 HB2 LEU A 210 -7.747 3.677 -4.022 1.00 73.50 H new ATOM 0 HB3 LEU A 210 -7.270 3.376 -2.363 1.00 73.50 H new ATOM 0 HG LEU A 210 -6.063 1.338 -3.081 1.00 60.31 H new ATOM 0 HD11 LEU A 210 -5.665 0.950 -5.481 1.00 51.53 H new ATOM 0 HD12 LEU A 210 -7.386 0.786 -5.060 1.00 51.53 H new ATOM 0 HD13 LEU A 210 -6.807 2.257 -5.876 1.00 51.53 H new ATOM 0 HD21 LEU A 210 -4.218 2.499 -4.231 1.00 62.53 H new ATOM 0 HD22 LEU A 210 -5.301 3.869 -4.573 1.00 62.53 H new ATOM 0 HD23 LEU A 210 -4.877 3.467 -2.892 1.00 62.53 H new ATOM 1105 N VAL A 211 -8.541 1.317 -0.788 1.00 61.13 N ATOM 1106 CA VAL A 211 -8.270 0.337 0.258 1.00 35.22 C ATOM 1107 C VAL A 211 -9.418 -0.656 0.411 1.00 41.40 C ATOM 1108 O VAL A 211 -9.217 -1.779 0.870 1.00 60.05 O ATOM 1109 CB VAL A 211 -7.876 0.956 1.633 1.00 41.03 C ATOM 1110 CG1 VAL A 211 -6.615 1.797 1.508 1.00 30.42 C ATOM 1111 CG2 VAL A 211 -9.010 1.768 2.232 1.00 34.52 C ATOM 0 H VAL A 211 -8.726 2.263 -0.454 1.00 61.13 H new ATOM 0 HA VAL A 211 -7.386 -0.202 -0.084 1.00 35.22 H new ATOM 0 HB VAL A 211 -7.672 0.130 2.314 1.00 41.03 H new ATOM 0 HG11 VAL A 211 -6.361 2.218 2.481 1.00 30.42 H new ATOM 0 HG12 VAL A 211 -5.794 1.172 1.157 1.00 30.42 H new ATOM 0 HG13 VAL A 211 -6.785 2.605 0.796 1.00 30.42 H new ATOM 0 HG21 VAL A 211 -8.695 2.182 3.190 1.00 34.52 H new ATOM 0 HG22 VAL A 211 -9.273 2.580 1.554 1.00 34.52 H new ATOM 0 HG23 VAL A 211 -9.878 1.126 2.383 1.00 34.52 H new ATOM 1121 N ALA A 212 -10.617 -0.250 0.006 1.00 72.11 N ATOM 1122 CA ALA A 212 -11.762 -1.138 0.015 1.00 21.32 C ATOM 1123 C ALA A 212 -11.565 -2.207 -1.042 1.00 1.13 C ATOM 1124 O ALA A 212 -11.749 -3.381 -0.779 1.00 53.53 O ATOM 1125 CB ALA A 212 -13.055 -0.369 -0.218 1.00 22.04 C ATOM 0 H ALA A 212 -10.816 0.691 -0.332 1.00 72.11 H new ATOM 0 HA ALA A 212 -11.843 -1.610 0.994 1.00 21.32 H new ATOM 0 HB1 ALA A 212 -13.897 -1.061 -0.206 1.00 22.04 H new ATOM 0 HB2 ALA A 212 -13.184 0.373 0.570 1.00 22.04 H new ATOM 0 HB3 ALA A 212 -13.011 0.132 -1.185 1.00 22.04 H new ATOM 1131 N GLU A 213 -11.127 -1.785 -2.206 1.00 5.44 N ATOM 1132 CA GLU A 213 -10.832 -2.671 -3.321 1.00 21.45 C ATOM 1133 C GLU A 213 -9.630 -3.537 -3.004 1.00 0.12 C ATOM 1134 O GLU A 213 -9.615 -4.730 -3.305 1.00 22.33 O ATOM 1135 CB GLU A 213 -10.631 -1.821 -4.579 1.00 1.14 C ATOM 1136 CG GLU A 213 -10.175 -2.553 -5.823 1.00 44.43 C ATOM 1137 CD GLU A 213 -10.127 -1.626 -7.010 1.00 63.22 C ATOM 1138 OE1 GLU A 213 -9.252 -0.745 -7.074 1.00 72.43 O ATOM 1139 OE2 GLU A 213 -11.008 -1.736 -7.897 1.00 4.50 O ATOM 0 H GLU A 213 -10.961 -0.800 -2.413 1.00 5.44 H new ATOM 0 HA GLU A 213 -11.663 -3.353 -3.499 1.00 21.45 H new ATOM 0 HB2 GLU A 213 -11.571 -1.318 -4.805 1.00 1.14 H new ATOM 0 HB3 GLU A 213 -9.900 -1.044 -4.353 1.00 1.14 H new ATOM 0 HG2 GLU A 213 -9.188 -2.984 -5.654 1.00 44.43 H new ATOM 0 HG3 GLU A 213 -10.853 -3.381 -6.031 1.00 44.43 H new ATOM 1146 N LEU A 214 -8.675 -2.953 -2.345 1.00 43.01 N ATOM 1147 CA LEU A 214 -7.482 -3.646 -1.950 1.00 44.25 C ATOM 1148 C LEU A 214 -7.815 -4.721 -0.900 1.00 22.24 C ATOM 1149 O LEU A 214 -7.228 -5.787 -0.904 1.00 54.34 O ATOM 1150 CB LEU A 214 -6.429 -2.609 -1.473 1.00 72.24 C ATOM 1151 CG LEU A 214 -4.966 -3.061 -1.287 1.00 2.01 C ATOM 1152 CD1 LEU A 214 -4.776 -3.900 -0.044 1.00 72.10 C ATOM 1153 CD2 LEU A 214 -4.488 -3.812 -2.515 1.00 1.22 C ATOM 0 H LEU A 214 -8.701 -1.973 -2.063 1.00 43.01 H new ATOM 0 HA LEU A 214 -7.045 -4.180 -2.794 1.00 44.25 H new ATOM 0 HB2 LEU A 214 -6.431 -1.786 -2.187 1.00 72.24 H new ATOM 0 HB3 LEU A 214 -6.772 -2.205 -0.520 1.00 72.24 H new ATOM 0 HG LEU A 214 -4.363 -2.162 -1.159 1.00 2.01 H new ATOM 0 HD11 LEU A 214 -3.729 -4.193 0.041 1.00 72.10 H new ATOM 0 HD12 LEU A 214 -5.063 -3.321 0.833 1.00 72.10 H new ATOM 0 HD13 LEU A 214 -5.398 -4.793 -0.109 1.00 72.10 H new ATOM 0 HD21 LEU A 214 -3.454 -4.125 -2.370 1.00 1.22 H new ATOM 0 HD22 LEU A 214 -5.115 -4.690 -2.671 1.00 1.22 H new ATOM 0 HD23 LEU A 214 -4.551 -3.161 -3.387 1.00 1.22 H new ATOM 1165 N SER A 215 -8.774 -4.457 -0.034 1.00 34.45 N ATOM 1166 CA SER A 215 -9.169 -5.462 0.918 1.00 14.55 C ATOM 1167 C SER A 215 -10.182 -6.461 0.306 1.00 5.42 C ATOM 1168 O SER A 215 -10.382 -7.561 0.828 1.00 73.23 O ATOM 1169 CB SER A 215 -9.671 -4.840 2.229 1.00 21.22 C ATOM 1170 OG SER A 215 -10.596 -3.776 2.005 1.00 45.45 O ATOM 0 H SER A 215 -9.281 -3.574 0.026 1.00 34.45 H new ATOM 0 HA SER A 215 -8.280 -6.039 1.173 1.00 14.55 H new ATOM 0 HB2 SER A 215 -10.147 -5.611 2.835 1.00 21.22 H new ATOM 0 HB3 SER A 215 -8.821 -4.465 2.800 1.00 21.22 H new ATOM 0 HG SER A 215 -10.107 -2.964 1.756 1.00 45.45 H new ATOM 1176 N LEU A 216 -10.822 -6.056 -0.809 1.00 34.24 N ATOM 1177 CA LEU A 216 -11.729 -6.919 -1.548 1.00 24.45 C ATOM 1178 C LEU A 216 -10.972 -8.020 -2.254 1.00 71.02 C ATOM 1179 O LEU A 216 -11.570 -9.032 -2.644 1.00 14.23 O ATOM 1180 CB LEU A 216 -12.559 -6.128 -2.560 1.00 44.22 C ATOM 1181 CG LEU A 216 -13.731 -5.300 -2.016 1.00 2.41 C ATOM 1182 CD1 LEU A 216 -14.402 -4.523 -3.138 1.00 73.20 C ATOM 1183 CD2 LEU A 216 -14.747 -6.196 -1.322 1.00 43.05 C ATOM 0 H LEU A 216 -10.717 -5.124 -1.211 1.00 34.24 H new ATOM 0 HA LEU A 216 -12.409 -7.366 -0.823 1.00 24.45 H new ATOM 0 HB2 LEU A 216 -11.888 -5.454 -3.093 1.00 44.22 H new ATOM 0 HB3 LEU A 216 -12.954 -6.830 -3.294 1.00 44.22 H new ATOM 0 HG LEU A 216 -13.336 -4.593 -1.287 1.00 2.41 H new ATOM 0 HD11 LEU A 216 -15.231 -3.942 -2.733 1.00 73.20 H new ATOM 0 HD12 LEU A 216 -13.678 -3.851 -3.598 1.00 73.20 H new ATOM 0 HD13 LEU A 216 -14.779 -5.219 -3.888 1.00 73.20 H new ATOM 0 HD21 LEU A 216 -15.569 -5.589 -0.944 1.00 43.05 H new ATOM 0 HD22 LEU A 216 -15.133 -6.927 -2.033 1.00 43.05 H new ATOM 0 HD23 LEU A 216 -14.268 -6.715 -0.492 1.00 43.05 H new ATOM 1195 N GLN A 217 -9.679 -7.786 -2.480 1.00 42.04 N ATOM 1196 CA GLN A 217 -8.777 -8.813 -3.016 1.00 10.13 C ATOM 1197 C GLN A 217 -8.935 -10.117 -2.215 1.00 2.51 C ATOM 1198 O GLN A 217 -8.669 -10.146 -1.007 1.00 11.15 O ATOM 1199 CB GLN A 217 -7.323 -8.338 -2.968 1.00 62.43 C ATOM 1200 CG GLN A 217 -7.027 -7.146 -3.861 1.00 71.25 C ATOM 1201 CD GLN A 217 -7.229 -7.467 -5.320 1.00 3.21 C ATOM 1202 OE1 GLN A 217 -8.315 -7.299 -5.867 1.00 71.32 O ATOM 1203 NE2 GLN A 217 -6.192 -7.938 -5.961 1.00 23.52 N ATOM 0 H GLN A 217 -9.228 -6.889 -2.300 1.00 42.04 H new ATOM 0 HA GLN A 217 -9.042 -8.997 -4.057 1.00 10.13 H new ATOM 0 HB2 GLN A 217 -7.071 -8.079 -1.940 1.00 62.43 H new ATOM 0 HB3 GLN A 217 -6.673 -9.164 -3.257 1.00 62.43 H new ATOM 0 HG2 GLN A 217 -7.673 -6.314 -3.580 1.00 71.25 H new ATOM 0 HG3 GLN A 217 -5.999 -6.820 -3.701 1.00 71.25 H new ATOM 0 HE21 GLN A 217 -5.305 -8.064 -5.473 1.00 23.52 H new ATOM 0 HE22 GLN A 217 -6.270 -8.179 -6.949 1.00 23.52 H new ATOM 1212 N PRO A 218 -9.385 -11.200 -2.880 1.00 50.12 N ATOM 1213 CA PRO A 218 -9.719 -12.468 -2.225 1.00 70.54 C ATOM 1214 C PRO A 218 -8.558 -13.124 -1.485 1.00 5.43 C ATOM 1215 O PRO A 218 -7.682 -13.778 -2.071 1.00 72.32 O ATOM 1216 CB PRO A 218 -10.235 -13.358 -3.359 1.00 24.23 C ATOM 1217 CG PRO A 218 -9.700 -12.738 -4.604 1.00 74.34 C ATOM 1218 CD PRO A 218 -9.602 -11.269 -4.333 1.00 14.24 C ATOM 0 HA PRO A 218 -10.452 -12.303 -1.435 1.00 70.54 H new ATOM 0 HB2 PRO A 218 -9.885 -14.384 -3.247 1.00 24.23 H new ATOM 0 HB3 PRO A 218 -11.324 -13.392 -3.371 1.00 24.23 H new ATOM 0 HG2 PRO A 218 -8.724 -13.153 -4.857 1.00 74.34 H new ATOM 0 HG3 PRO A 218 -10.359 -12.934 -5.450 1.00 74.34 H new ATOM 0 HD2 PRO A 218 -8.779 -10.814 -4.884 1.00 14.24 H new ATOM 0 HD3 PRO A 218 -10.511 -10.745 -4.628 1.00 14.24 H new ATOM 1226 N GLY A 219 -8.556 -12.950 -0.206 1.00 40.22 N ATOM 1227 CA GLY A 219 -7.507 -13.513 0.595 1.00 61.22 C ATOM 1228 C GLY A 219 -6.974 -12.549 1.609 1.00 13.12 C ATOM 1229 O GLY A 219 -6.113 -12.909 2.422 1.00 34.42 O ATOM 0 H GLY A 219 -9.262 -12.426 0.311 1.00 40.22 H new ATOM 0 HA2 GLY A 219 -7.881 -14.401 1.105 1.00 61.22 H new ATOM 0 HA3 GLY A 219 -6.694 -13.838 -0.054 1.00 61.22 H new ATOM 1233 N VAL A 220 -7.423 -11.312 1.531 1.00 74.00 N ATOM 1234 CA VAL A 220 -7.084 -10.317 2.517 1.00 13.10 C ATOM 1235 C VAL A 220 -7.811 -10.608 3.825 1.00 22.11 C ATOM 1236 O VAL A 220 -9.017 -10.842 3.836 1.00 24.51 O ATOM 1237 CB VAL A 220 -7.425 -8.884 2.021 1.00 1.14 C ATOM 1238 CG1 VAL A 220 -7.221 -7.855 3.124 1.00 63.43 C ATOM 1239 CG2 VAL A 220 -6.578 -8.530 0.812 1.00 73.01 C ATOM 0 H VAL A 220 -8.030 -10.974 0.784 1.00 74.00 H new ATOM 0 HA VAL A 220 -6.008 -10.364 2.685 1.00 13.10 H new ATOM 0 HB VAL A 220 -8.477 -8.869 1.736 1.00 1.14 H new ATOM 0 HG11 VAL A 220 -7.468 -6.863 2.746 1.00 63.43 H new ATOM 0 HG12 VAL A 220 -7.868 -8.093 3.968 1.00 63.43 H new ATOM 0 HG13 VAL A 220 -6.181 -7.871 3.449 1.00 63.43 H new ATOM 0 HG21 VAL A 220 -6.827 -7.524 0.475 1.00 73.01 H new ATOM 0 HG22 VAL A 220 -5.523 -8.571 1.082 1.00 73.01 H new ATOM 0 HG23 VAL A 220 -6.775 -9.241 0.009 1.00 73.01 H new ATOM 1249 N TYR A 221 -7.070 -10.628 4.902 1.00 11.12 N ATOM 1250 CA TYR A 221 -7.629 -10.841 6.211 1.00 13.23 C ATOM 1251 C TYR A 221 -8.001 -9.504 6.798 1.00 2.44 C ATOM 1252 O TYR A 221 -9.072 -9.340 7.370 1.00 40.41 O ATOM 1253 CB TYR A 221 -6.614 -11.517 7.142 1.00 74.31 C ATOM 1254 CG TYR A 221 -6.164 -12.893 6.714 1.00 42.42 C ATOM 1255 CD1 TYR A 221 -5.107 -13.051 5.848 1.00 52.11 C ATOM 1256 CD2 TYR A 221 -6.795 -14.032 7.187 1.00 64.52 C ATOM 1257 CE1 TYR A 221 -4.686 -14.299 5.456 1.00 72.14 C ATOM 1258 CE2 TYR A 221 -6.377 -15.290 6.799 1.00 22.14 C ATOM 1259 CZ TYR A 221 -5.319 -15.411 5.930 1.00 42.32 C ATOM 1260 OH TYR A 221 -4.892 -16.652 5.536 1.00 2.21 O ATOM 0 H TYR A 221 -6.059 -10.497 4.896 1.00 11.12 H new ATOM 0 HA TYR A 221 -8.502 -11.487 6.117 1.00 13.23 H new ATOM 0 HB2 TYR A 221 -5.737 -10.875 7.224 1.00 74.31 H new ATOM 0 HB3 TYR A 221 -7.051 -11.589 8.138 1.00 74.31 H new ATOM 0 HD1 TYR A 221 -4.598 -12.177 5.469 1.00 52.11 H new ATOM 0 HD2 TYR A 221 -7.626 -13.935 7.869 1.00 64.52 H new ATOM 0 HE1 TYR A 221 -3.855 -14.400 4.774 1.00 72.14 H new ATOM 0 HE2 TYR A 221 -6.877 -16.170 7.175 1.00 22.14 H new ATOM 0 HH TYR A 221 -3.917 -16.648 5.441 1.00 2.21 H new ATOM 1270 N ALA A 222 -7.111 -8.537 6.620 1.00 73.44 N ATOM 1271 CA ALA A 222 -7.287 -7.200 7.181 1.00 72.22 C ATOM 1272 C ALA A 222 -6.374 -6.207 6.479 1.00 21.35 C ATOM 1273 O ALA A 222 -5.425 -6.612 5.793 1.00 72.41 O ATOM 1274 CB ALA A 222 -6.981 -7.217 8.672 1.00 34.24 C ATOM 0 H ALA A 222 -6.250 -8.654 6.086 1.00 73.44 H new ATOM 0 HA ALA A 222 -8.322 -6.893 7.031 1.00 72.22 H new ATOM 0 HB1 ALA A 222 -7.115 -6.216 9.082 1.00 34.24 H new ATOM 0 HB2 ALA A 222 -7.657 -7.908 9.174 1.00 34.24 H new ATOM 0 HB3 ALA A 222 -5.951 -7.539 8.828 1.00 34.24 H new ATOM 1280 N VAL A 223 -6.658 -4.930 6.643 1.00 10.10 N ATOM 1281 CA VAL A 223 -5.866 -3.867 6.057 1.00 43.33 C ATOM 1282 C VAL A 223 -5.941 -2.634 6.967 1.00 30.23 C ATOM 1283 O VAL A 223 -6.956 -2.414 7.635 1.00 50.51 O ATOM 1284 CB VAL A 223 -6.365 -3.507 4.605 1.00 10.14 C ATOM 1285 CG1 VAL A 223 -7.787 -2.959 4.612 1.00 5.30 C ATOM 1286 CG2 VAL A 223 -5.420 -2.537 3.903 1.00 2.05 C ATOM 0 H VAL A 223 -7.452 -4.598 7.191 1.00 10.10 H new ATOM 0 HA VAL A 223 -4.833 -4.205 5.970 1.00 43.33 H new ATOM 0 HB VAL A 223 -6.368 -4.439 4.040 1.00 10.14 H new ATOM 0 HG11 VAL A 223 -8.091 -2.724 3.592 1.00 5.30 H new ATOM 0 HG12 VAL A 223 -8.463 -3.706 5.029 1.00 5.30 H new ATOM 0 HG13 VAL A 223 -7.826 -2.055 5.220 1.00 5.30 H new ATOM 0 HG21 VAL A 223 -5.801 -2.315 2.906 1.00 2.05 H new ATOM 0 HG22 VAL A 223 -5.352 -1.614 4.479 1.00 2.05 H new ATOM 0 HG23 VAL A 223 -4.431 -2.987 3.822 1.00 2.05 H new ATOM 1296 N HIS A 224 -4.878 -1.887 7.035 1.00 11.35 N ATOM 1297 CA HIS A 224 -4.824 -0.668 7.812 1.00 14.33 C ATOM 1298 C HIS A 224 -3.873 0.300 7.112 1.00 61.45 C ATOM 1299 O HIS A 224 -2.854 -0.123 6.567 1.00 61.23 O ATOM 1300 CB HIS A 224 -4.318 -0.974 9.244 1.00 21.24 C ATOM 1301 CG HIS A 224 -4.276 0.214 10.170 1.00 23.32 C ATOM 1302 ND1 HIS A 224 -3.145 0.970 10.403 1.00 72.01 N ATOM 1303 CD2 HIS A 224 -5.255 0.770 10.924 1.00 33.52 C ATOM 1304 CE1 HIS A 224 -3.463 1.937 11.267 1.00 72.51 C ATOM 1305 NE2 HIS A 224 -4.738 1.862 11.617 1.00 52.40 N ATOM 0 H HIS A 224 -4.008 -2.104 6.548 1.00 11.35 H new ATOM 0 HA HIS A 224 -5.817 -0.226 7.890 1.00 14.33 H new ATOM 0 HB2 HIS A 224 -4.959 -1.737 9.685 1.00 21.24 H new ATOM 0 HB3 HIS A 224 -3.317 -1.399 9.177 1.00 21.24 H new ATOM 0 HD2 HIS A 224 -6.276 0.421 10.979 1.00 33.52 H new ATOM 0 HE1 HIS A 224 -2.772 2.682 11.632 1.00 72.51 H new ATOM 0 HE2 HIS A 224 -5.237 2.476 12.260 1.00 52.40 H new ATOM 1313 N TRP A 225 -4.193 1.563 7.099 1.00 23.15 N ATOM 1314 CA TRP A 225 -3.312 2.532 6.490 1.00 23.52 C ATOM 1315 C TRP A 225 -2.812 3.516 7.510 1.00 71.11 C ATOM 1316 O TRP A 225 -3.486 3.815 8.493 1.00 64.40 O ATOM 1317 CB TRP A 225 -3.935 3.239 5.269 1.00 23.52 C ATOM 1318 CG TRP A 225 -5.232 3.942 5.535 1.00 3.41 C ATOM 1319 CD1 TRP A 225 -6.480 3.391 5.504 1.00 35.32 C ATOM 1320 CD2 TRP A 225 -5.411 5.334 5.846 1.00 20.40 C ATOM 1321 NE1 TRP A 225 -7.420 4.336 5.811 1.00 13.32 N ATOM 1322 CE2 TRP A 225 -6.791 5.544 6.016 1.00 74.44 C ATOM 1323 CE3 TRP A 225 -4.535 6.425 6.007 1.00 73.21 C ATOM 1324 CZ2 TRP A 225 -7.320 6.791 6.338 1.00 74.04 C ATOM 1325 CZ3 TRP A 225 -5.064 7.658 6.322 1.00 61.45 C ATOM 1326 CH2 TRP A 225 -6.441 7.833 6.486 1.00 63.34 C ATOM 0 H TRP A 225 -5.049 1.948 7.498 1.00 23.15 H new ATOM 0 HA TRP A 225 -2.457 1.977 6.103 1.00 23.52 H new ATOM 0 HB2 TRP A 225 -3.218 3.965 4.884 1.00 23.52 H new ATOM 0 HB3 TRP A 225 -4.094 2.501 4.483 1.00 23.52 H new ATOM 0 HD1 TRP A 225 -6.694 2.358 5.271 1.00 35.32 H new ATOM 0 HE1 TRP A 225 -8.425 4.172 5.877 1.00 13.32 H new ATOM 0 HE3 TRP A 225 -3.469 6.298 5.886 1.00 73.21 H new ATOM 0 HZ2 TRP A 225 -8.383 6.932 6.466 1.00 74.04 H new ATOM 0 HZ3 TRP A 225 -4.403 8.504 6.444 1.00 61.45 H new ATOM 0 HH2 TRP A 225 -6.822 8.812 6.735 1.00 63.34 H new ATOM 1337 N TYR A 226 -1.646 3.993 7.285 1.00 21.11 N ATOM 1338 CA TYR A 226 -0.985 4.894 8.193 1.00 1.13 C ATOM 1339 C TYR A 226 -0.450 6.083 7.408 1.00 0.22 C ATOM 1340 O TYR A 226 -0.022 5.929 6.269 1.00 50.23 O ATOM 1341 CB TYR A 226 0.166 4.139 8.895 1.00 73.55 C ATOM 1342 CG TYR A 226 0.832 4.891 10.027 1.00 21.44 C ATOM 1343 CD1 TYR A 226 0.290 4.865 11.301 1.00 54.34 C ATOM 1344 CD2 TYR A 226 2.003 5.619 9.829 1.00 40.14 C ATOM 1345 CE1 TYR A 226 0.882 5.542 12.345 1.00 54.13 C ATOM 1346 CE2 TYR A 226 2.602 6.299 10.873 1.00 52.00 C ATOM 1347 CZ TYR A 226 2.034 6.253 12.128 1.00 4.22 C ATOM 1348 OH TYR A 226 2.615 6.941 13.170 1.00 2.54 O ATOM 0 H TYR A 226 -1.101 3.773 6.452 1.00 21.11 H new ATOM 0 HA TYR A 226 -1.681 5.258 8.949 1.00 1.13 H new ATOM 0 HB2 TYR A 226 -0.222 3.198 9.284 1.00 73.55 H new ATOM 0 HB3 TYR A 226 0.922 3.889 8.151 1.00 73.55 H new ATOM 0 HD1 TYR A 226 -0.615 4.303 11.480 1.00 54.34 H new ATOM 0 HD2 TYR A 226 2.449 5.653 8.846 1.00 40.14 H new ATOM 0 HE1 TYR A 226 0.440 5.513 13.330 1.00 54.13 H new ATOM 0 HE2 TYR A 226 3.508 6.862 10.706 1.00 52.00 H new ATOM 0 HH TYR A 226 3.425 7.392 12.853 1.00 2.54 H new ATOM 1358 N ALA A 227 -0.513 7.251 7.984 1.00 71.45 N ATOM 1359 CA ALA A 227 0.005 8.445 7.353 1.00 12.32 C ATOM 1360 C ALA A 227 1.346 8.790 7.968 1.00 63.24 C ATOM 1361 O ALA A 227 1.474 8.845 9.193 1.00 40.13 O ATOM 1362 CB ALA A 227 -0.972 9.598 7.533 1.00 21.20 C ATOM 0 H ALA A 227 -0.924 7.408 8.904 1.00 71.45 H new ATOM 0 HA ALA A 227 0.133 8.267 6.285 1.00 12.32 H new ATOM 0 HB1 ALA A 227 -0.572 10.492 7.054 1.00 21.20 H new ATOM 0 HB2 ALA A 227 -1.928 9.339 7.078 1.00 21.20 H new ATOM 0 HB3 ALA A 227 -1.117 9.790 8.596 1.00 21.20 H new ATOM 1368 N GLY A 228 2.327 9.024 7.146 1.00 23.22 N ATOM 1369 CA GLY A 228 3.642 9.305 7.648 1.00 31.14 C ATOM 1370 C GLY A 228 4.690 8.453 6.978 1.00 54.14 C ATOM 1371 O GLY A 228 4.385 7.385 6.438 1.00 44.11 O ATOM 0 H GLY A 228 2.243 9.026 6.129 1.00 23.22 H new ATOM 0 HA2 GLY A 228 3.874 10.358 7.490 1.00 31.14 H new ATOM 0 HA3 GLY A 228 3.665 9.131 8.724 1.00 31.14 H new