USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 498 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 Single : A 81 HIS : no HD1:sc= -3.63! C(o=-3.6!,f=-3.4!) USER MOD Single : A 85 SER OG : rot -82:sc= -4.53! USER MOD Single : A 87 MET CE :methyl 152:sc= -0.2 (180deg=-0.983) USER MOD Single : A 90 THR OG1 : rot 180:sc=-0.000883 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 128:sc= 1.32 USER MOD Single : A 96 SER OG : rot 180:sc= -0.0994 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 156:sc= -1.06! USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 155:sc= -0.0262 (180deg=-0.324) USER MOD Single : A 123 MET CE :methyl -124:sc= -0.291 (180deg=-0.427) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.257 X(o=-0.26,f=-0.0042) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -171:sc= 1.07 (180deg=0.669) USER MOD Single : A 142 SER OG : rot 42:sc= 0.987 USER MOD Single : A 144 GLN : amide:sc= -0.271 X(o=-0.27,f=-0.41) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.410 8.215 2.759 1.00 1.00 N ATOM 131 CA HIS A 81 -5.527 7.136 3.724 1.00 1.00 C ATOM 132 C HIS A 81 -4.132 6.680 4.155 1.00 1.00 C ATOM 133 O HIS A 81 -3.128 7.155 3.627 1.00 1.00 O ATOM 134 CB HIS A 81 -6.377 5.995 3.162 1.00 1.00 C ATOM 135 CG HIS A 81 -7.554 6.456 2.335 1.00 1.00 C ATOM 136 ND1 HIS A 81 -8.638 7.122 2.879 1.00 1.00 N ATOM 137 CD2 HIS A 81 -7.805 6.338 0.999 1.00 1.00 C ATOM 138 CE1 HIS A 81 -9.496 7.389 1.907 1.00 1.00 C ATOM 139 NE2 HIS A 81 -8.978 6.902 0.742 1.00 1.00 N ATOM 0 HA HIS A 81 -6.045 7.493 4.614 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -5.745 5.352 2.549 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.743 5.387 3.989 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -7.159 5.866 0.274 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -10.440 7.902 2.017 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -9.420 6.962 -0.175 1.00 1.00 H new ATOM 146 N ILE A 82 -4.114 5.762 5.112 1.00 1.00 N ATOM 147 CA ILE A 82 -2.859 5.236 5.621 1.00 1.00 C ATOM 148 C ILE A 82 -2.989 3.726 5.821 1.00 1.00 C ATOM 149 O ILE A 82 -3.779 3.270 6.645 1.00 1.00 O ATOM 150 CB ILE A 82 -2.434 5.990 6.882 1.00 1.00 C ATOM 151 CG1 ILE A 82 -2.333 7.493 6.615 1.00 1.00 C ATOM 152 CG2 ILE A 82 -1.131 5.421 7.449 1.00 1.00 C ATOM 153 CD1 ILE A 82 -3.651 8.197 6.947 1.00 1.00 C ATOM 0 H ILE A 82 -4.949 5.370 5.548 1.00 1.00 H new ATOM 0 HA ILE A 82 -2.058 5.394 4.899 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.205 5.848 7.640 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -1.528 7.919 7.213 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.078 7.664 5.569 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.851 5.975 8.345 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.272 4.370 7.702 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.340 5.512 6.705 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -3.553 9.264 6.749 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -4.449 7.785 6.330 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -3.890 8.044 7.999 1.00 1.00 H new ATOM 164 N VAL A 83 -2.199 2.989 5.053 1.00 1.00 N ATOM 165 CA VAL A 83 -2.215 1.539 5.136 1.00 1.00 C ATOM 166 C VAL A 83 -1.366 1.091 6.328 1.00 1.00 C ATOM 167 O VAL A 83 -0.160 1.333 6.362 1.00 1.00 O ATOM 168 CB VAL A 83 -1.750 0.933 3.810 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.501 -0.570 3.951 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.756 1.220 2.694 1.00 1.00 C ATOM 0 H VAL A 83 -1.544 3.370 4.370 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.229 1.178 5.305 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.805 1.405 3.539 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.172 -0.976 2.994 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.731 -0.742 4.703 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.423 -1.064 4.256 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.402 0.779 1.762 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.722 0.789 2.955 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.862 2.297 2.568 1.00 1.00 H new ATOM 180 N ARG A 84 -2.028 0.445 7.276 1.00 1.00 N ATOM 181 CA ARG A 84 -1.349 -0.040 8.466 1.00 1.00 C ATOM 182 C ARG A 84 -1.148 -1.554 8.384 1.00 1.00 C ATOM 183 O ARG A 84 -2.116 -2.309 8.292 1.00 1.00 O ATOM 184 CB ARG A 84 -2.147 0.294 9.729 1.00 1.00 C ATOM 185 CG ARG A 84 -2.254 1.807 9.926 1.00 1.00 C ATOM 186 CD ARG A 84 -3.023 2.140 11.207 1.00 1.00 C ATOM 187 NE ARG A 84 -2.416 3.316 11.870 1.00 1.00 N ATOM 188 CZ ARG A 84 -2.758 4.594 11.604 1.00 1.00 C ATOM 189 NH1 ARG A 84 -3.706 4.875 10.685 1.00 1.00 N ATOM 190 NH2 ARG A 84 -2.151 5.568 12.258 1.00 1.00 N ATOM 0 H ARG A 84 -3.028 0.246 7.245 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.380 0.455 8.520 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.145 -0.138 9.658 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.666 -0.156 10.597 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.256 2.243 9.973 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.757 2.254 9.069 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -4.068 2.344 10.971 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -3.010 1.284 11.882 1.00 1.00 H new ATOM 0 HE ARG A 84 -1.694 3.150 12.572 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -4.171 4.118 10.184 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -3.957 5.844 10.491 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -1.436 5.348 12.952 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -2.397 6.540 12.069 1.00 1.00 H new ATOM 199 N SER A 85 0.114 -1.953 8.418 1.00 1.00 N ATOM 200 CA SER A 85 0.454 -3.365 8.348 1.00 1.00 C ATOM 201 C SER A 85 -0.551 -4.186 9.156 1.00 1.00 C ATOM 202 O SER A 85 -0.446 -4.274 10.379 1.00 1.00 O ATOM 203 CB SER A 85 1.876 -3.613 8.857 1.00 1.00 C ATOM 204 OG SER A 85 2.599 -4.502 8.010 1.00 1.00 O ATOM 0 H SER A 85 0.914 -1.325 8.493 1.00 1.00 H new ATOM 0 HA SER A 85 0.411 -3.677 7.305 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.408 -2.664 8.924 1.00 1.00 H new ATOM 0 HB3 SER A 85 1.833 -4.027 9.865 1.00 1.00 H new ATOM 0 HG SER A 85 2.364 -5.428 8.231 1.00 1.00 H new ATOM 209 N PRO A 86 -1.528 -4.784 8.422 1.00 1.00 N ATOM 210 CA PRO A 86 -2.551 -5.596 9.058 1.00 1.00 C ATOM 211 C PRO A 86 -1.989 -6.954 9.480 1.00 1.00 C ATOM 212 O PRO A 86 -2.710 -7.784 10.033 1.00 1.00 O ATOM 213 CB PRO A 86 -3.662 -5.706 8.026 1.00 1.00 C ATOM 214 CG PRO A 86 -3.028 -5.350 6.691 1.00 1.00 C ATOM 215 CD PRO A 86 -1.682 -4.702 6.973 1.00 1.00 C ATOM 0 HA PRO A 86 -2.926 -5.155 9.982 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.077 -6.714 8.005 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.482 -5.028 8.262 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.901 -6.243 6.078 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.670 -4.669 6.133 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.875 -5.225 6.459 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.661 -3.667 6.630 1.00 1.00 H new ATOM 220 N MET A 87 -0.707 -7.140 9.204 1.00 1.00 N ATOM 221 CA MET A 87 -0.040 -8.385 9.549 1.00 1.00 C ATOM 222 C MET A 87 1.478 -8.197 9.601 1.00 1.00 C ATOM 223 O MET A 87 2.107 -7.910 8.585 1.00 1.00 O ATOM 224 CB MET A 87 -0.386 -9.454 8.511 1.00 1.00 C ATOM 225 CG MET A 87 -0.740 -10.780 9.186 1.00 1.00 C ATOM 226 SD MET A 87 -2.445 -10.760 9.714 1.00 1.00 S ATOM 227 CE MET A 87 -3.262 -10.845 8.130 1.00 1.00 C ATOM 0 H MET A 87 -0.112 -6.450 8.746 1.00 1.00 H new ATOM 0 HA MET A 87 -0.383 -8.698 10.535 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.225 -9.117 7.902 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.459 -9.599 7.838 1.00 1.00 H new ATOM 0 HG2 MET A 87 -0.575 -11.605 8.494 1.00 1.00 H new ATOM 0 HG3 MET A 87 -0.087 -10.947 10.043 1.00 1.00 H new ATOM 0 HE1 MET A 87 -4.233 -11.326 8.247 1.00 1.00 H new ATOM 0 HE2 MET A 87 -3.401 -9.838 7.738 1.00 1.00 H new ATOM 0 HE3 MET A 87 -2.652 -11.423 7.436 1.00 1.00 H new ATOM 235 N VAL A 88 2.021 -8.366 10.798 1.00 1.00 N ATOM 236 CA VAL A 88 3.453 -8.219 10.997 1.00 1.00 C ATOM 237 C VAL A 88 4.195 -9.165 10.051 1.00 1.00 C ATOM 238 O VAL A 88 3.719 -10.262 9.766 1.00 1.00 O ATOM 239 CB VAL A 88 3.803 -8.448 12.468 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.237 -8.006 12.767 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.807 -7.736 13.387 1.00 1.00 C ATOM 0 H VAL A 88 1.495 -8.603 11.639 1.00 1.00 H new ATOM 0 HA VAL A 88 3.770 -7.204 10.756 1.00 1.00 H new ATOM 0 HB VAL A 88 3.735 -9.518 12.665 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.459 -8.180 13.820 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.930 -8.578 12.150 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.344 -6.944 12.544 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.079 -7.915 14.427 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.828 -6.665 13.186 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.804 -8.120 13.203 1.00 1.00 H new ATOM 251 N GLY A 89 5.349 -8.705 9.591 1.00 1.00 N ATOM 252 CA GLY A 89 6.161 -9.496 8.683 1.00 1.00 C ATOM 253 C GLY A 89 6.993 -8.597 7.766 1.00 1.00 C ATOM 254 O GLY A 89 7.829 -7.826 8.237 1.00 1.00 O ATOM 0 H GLY A 89 5.741 -7.794 9.830 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.821 -10.149 9.255 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.519 -10.140 8.082 1.00 1.00 H new ATOM 258 N THR A 90 6.736 -8.727 6.472 1.00 1.00 N ATOM 259 CA THR A 90 7.452 -7.935 5.485 1.00 1.00 C ATOM 260 C THR A 90 6.467 -7.268 4.522 1.00 1.00 C ATOM 261 O THR A 90 5.291 -7.626 4.484 1.00 1.00 O ATOM 262 CB THR A 90 8.460 -8.849 4.787 1.00 1.00 C ATOM 263 OG1 THR A 90 9.315 -9.289 5.838 1.00 1.00 O ATOM 264 CG2 THR A 90 9.390 -8.083 3.845 1.00 1.00 C ATOM 0 H THR A 90 6.043 -9.368 6.085 1.00 1.00 H new ATOM 0 HA THR A 90 8.002 -7.120 5.954 1.00 1.00 H new ATOM 0 HB THR A 90 7.927 -9.616 4.225 1.00 1.00 H new ATOM 0 HG1 THR A 90 9.999 -9.889 5.474 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.086 -8.779 3.375 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.799 -7.586 3.076 1.00 1.00 H new ATOM 0 HG23 THR A 90 9.949 -7.338 4.412 1.00 1.00 H new ATOM 272 N PHE A 91 6.985 -6.312 3.766 1.00 1.00 N ATOM 273 CA PHE A 91 6.166 -5.592 2.805 1.00 1.00 C ATOM 274 C PHE A 91 6.914 -5.397 1.485 1.00 1.00 C ATOM 275 O PHE A 91 8.080 -5.005 1.479 1.00 1.00 O ATOM 276 CB PHE A 91 5.864 -4.220 3.413 1.00 1.00 C ATOM 277 CG PHE A 91 5.173 -3.252 2.451 1.00 1.00 C ATOM 278 CD1 PHE A 91 5.859 -2.735 1.396 1.00 1.00 C ATOM 279 CD2 PHE A 91 3.872 -2.908 2.650 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.217 -1.836 0.504 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.230 -2.010 1.758 1.00 1.00 C ATOM 282 CZ PHE A 91 3.917 -1.492 0.704 1.00 1.00 C ATOM 0 H PHE A 91 7.961 -6.019 3.799 1.00 1.00 H new ATOM 0 HA PHE A 91 5.256 -6.154 2.597 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.234 -4.354 4.292 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.797 -3.772 3.755 1.00 1.00 H new ATOM 0 HD1 PHE A 91 6.892 -3.008 1.237 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.327 -3.319 3.487 1.00 1.00 H new ATOM 0 HE1 PHE A 91 5.761 -1.425 -0.333 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.197 -1.738 1.916 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.429 -0.807 0.026 1.00 1.00 H new ATOM 291 N TYR A 92 6.213 -5.680 0.396 1.00 1.00 N ATOM 292 CA TYR A 92 6.796 -5.541 -0.927 1.00 1.00 C ATOM 293 C TYR A 92 5.914 -4.674 -1.827 1.00 1.00 C ATOM 294 O TYR A 92 4.703 -4.594 -1.624 1.00 1.00 O ATOM 295 CB TYR A 92 6.863 -6.955 -1.509 1.00 1.00 C ATOM 296 CG TYR A 92 7.926 -7.844 -0.860 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.263 -7.612 -1.105 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.545 -8.880 -0.031 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.263 -8.450 -0.494 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.544 -9.718 0.580 1.00 1.00 C ATOM 301 CZ TYR A 92 9.854 -9.462 0.318 1.00 1.00 C ATOM 302 OH TYR A 92 10.798 -10.253 0.895 1.00 1.00 O ATOM 0 H TYR A 92 5.246 -6.005 0.404 1.00 1.00 H new ATOM 0 HA TYR A 92 7.775 -5.066 -0.866 1.00 1.00 H new ATOM 0 HB2 TYR A 92 5.888 -7.430 -1.396 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.063 -6.888 -2.578 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.560 -6.802 -1.755 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.498 -9.062 0.159 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.314 -8.279 -0.676 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.260 -10.531 1.231 1.00 1.00 H new ATOM 0 HH TYR A 92 10.361 -10.933 1.449 1.00 1.00 H new ATOM 311 N ARG A 93 6.555 -4.045 -2.801 1.00 1.00 N ATOM 312 CA ARG A 93 5.842 -3.187 -3.733 1.00 1.00 C ATOM 313 C ARG A 93 5.675 -3.890 -5.081 1.00 1.00 C ATOM 314 O ARG A 93 4.888 -3.453 -5.920 1.00 1.00 O ATOM 315 CB ARG A 93 6.586 -1.866 -3.943 1.00 1.00 C ATOM 316 CG ARG A 93 7.015 -1.259 -2.606 1.00 1.00 C ATOM 317 CD ARG A 93 6.100 -0.097 -2.213 1.00 1.00 C ATOM 318 NE ARG A 93 4.687 -0.537 -2.228 1.00 1.00 N ATOM 319 CZ ARG A 93 3.640 0.288 -2.432 1.00 1.00 C ATOM 320 NH1 ARG A 93 3.837 1.607 -2.641 1.00 1.00 N ATOM 321 NH2 ARG A 93 2.419 -0.214 -2.425 1.00 1.00 N ATOM 0 H ARG A 93 7.559 -4.112 -2.965 1.00 1.00 H new ATOM 0 HA ARG A 93 4.861 -2.976 -3.306 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.463 -2.034 -4.568 1.00 1.00 H new ATOM 0 HB3 ARG A 93 5.945 -1.164 -4.476 1.00 1.00 H new ATOM 0 HG2 ARG A 93 6.990 -2.024 -1.830 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.045 -0.908 -2.675 1.00 1.00 H new ATOM 0 HD2 ARG A 93 6.366 0.266 -1.220 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.238 0.735 -2.904 1.00 1.00 H new ATOM 0 HE ARG A 93 4.493 -1.527 -2.074 1.00 1.00 H new ATOM 0 HH11 ARG A 93 4.784 1.987 -2.645 1.00 1.00 H new ATOM 0 HH12 ARG A 93 3.039 2.224 -2.794 1.00 1.00 H new ATOM 0 HH21 ARG A 93 2.279 -1.212 -2.267 1.00 1.00 H new ATOM 0 HH22 ARG A 93 1.616 0.396 -2.578 1.00 1.00 H new ATOM 330 N THR A 94 6.428 -4.967 -5.248 1.00 1.00 N ATOM 331 CA THR A 94 6.372 -5.735 -6.481 1.00 1.00 C ATOM 332 C THR A 94 6.320 -7.233 -6.173 1.00 1.00 C ATOM 333 O THR A 94 6.766 -7.669 -5.113 1.00 1.00 O ATOM 334 CB THR A 94 7.570 -5.333 -7.343 1.00 1.00 C ATOM 335 OG1 THR A 94 8.699 -5.608 -6.518 1.00 1.00 O ATOM 336 CG2 THR A 94 7.642 -3.822 -7.579 1.00 1.00 C ATOM 0 H THR A 94 7.080 -5.326 -4.551 1.00 1.00 H new ATOM 0 HA THR A 94 5.463 -5.518 -7.042 1.00 1.00 H new ATOM 0 HB THR A 94 7.516 -5.848 -8.302 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.333 -6.171 -7.009 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.510 -3.591 -8.196 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.737 -3.490 -8.087 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.730 -3.308 -6.622 1.00 1.00 H new ATOM 344 N PRO A 95 5.759 -8.000 -7.146 1.00 1.00 N ATOM 345 CA PRO A 95 5.643 -9.440 -6.990 1.00 1.00 C ATOM 346 C PRO A 95 6.998 -10.123 -7.185 1.00 1.00 C ATOM 347 O PRO A 95 7.145 -11.312 -6.906 1.00 1.00 O ATOM 348 CB PRO A 95 4.610 -9.865 -8.021 1.00 1.00 C ATOM 349 CG PRO A 95 4.528 -8.727 -9.024 1.00 1.00 C ATOM 350 CD PRO A 95 5.222 -7.519 -8.416 1.00 1.00 C ATOM 0 HA PRO A 95 5.329 -9.731 -5.988 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.904 -10.794 -8.508 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.642 -10.043 -7.553 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.006 -9.010 -9.962 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.488 -8.494 -9.253 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.015 -7.149 -9.066 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.524 -6.696 -8.264 1.00 1.00 H new ATOM 355 N SER A 96 7.956 -9.342 -7.665 1.00 1.00 N ATOM 356 CA SER A 96 9.294 -9.857 -7.901 1.00 1.00 C ATOM 357 C SER A 96 10.296 -8.702 -7.958 1.00 1.00 C ATOM 358 O SER A 96 9.908 -7.536 -7.912 1.00 1.00 O ATOM 359 CB SER A 96 9.350 -10.674 -9.194 1.00 1.00 C ATOM 360 OG SER A 96 9.642 -12.046 -8.946 1.00 1.00 O ATOM 0 H SER A 96 7.831 -8.356 -7.897 1.00 1.00 H new ATOM 0 HA SER A 96 9.557 -10.518 -7.075 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.396 -10.595 -9.715 1.00 1.00 H new ATOM 0 HB3 SER A 96 10.109 -10.255 -9.855 1.00 1.00 H new ATOM 0 HG SER A 96 9.667 -12.534 -9.796 1.00 1.00 H new ATOM 365 N PRO A 97 11.599 -9.077 -8.061 1.00 1.00 N ATOM 366 CA PRO A 97 12.660 -8.086 -8.125 1.00 1.00 C ATOM 367 C PRO A 97 12.707 -7.421 -9.503 1.00 1.00 C ATOM 368 O PRO A 97 13.017 -6.237 -9.613 1.00 1.00 O ATOM 369 CB PRO A 97 13.931 -8.849 -7.790 1.00 1.00 C ATOM 370 CG PRO A 97 13.606 -10.318 -8.008 1.00 1.00 C ATOM 371 CD PRO A 97 12.096 -10.450 -8.119 1.00 1.00 C ATOM 0 HA PRO A 97 12.510 -7.263 -7.427 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.756 -8.533 -8.428 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.237 -8.665 -6.760 1.00 1.00 H new ATOM 0 HG2 PRO A 97 14.089 -10.685 -8.914 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.982 -10.919 -7.180 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.808 -10.936 -9.051 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.690 -11.053 -7.307 1.00 1.00 H new ATOM 376 N ASP A 98 12.395 -8.215 -10.517 1.00 1.00 N ATOM 377 CA ASP A 98 12.397 -7.718 -11.883 1.00 1.00 C ATOM 378 C ASP A 98 10.959 -7.663 -12.404 1.00 1.00 C ATOM 379 O ASP A 98 10.735 -7.629 -13.613 1.00 1.00 O ATOM 380 CB ASP A 98 13.199 -8.640 -12.803 1.00 1.00 C ATOM 381 CG ASP A 98 14.554 -8.089 -13.251 1.00 1.00 C ATOM 382 OD1 ASP A 98 15.505 -8.013 -12.459 1.00 1.00 O ATOM 383 OD2 ASP A 98 14.612 -7.723 -14.486 1.00 1.00 O ATOM 0 H ASP A 98 12.139 -9.198 -10.420 1.00 1.00 H new ATOM 0 HA ASP A 98 12.851 -6.727 -11.881 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.361 -9.588 -12.290 1.00 1.00 H new ATOM 0 HB3 ASP A 98 12.601 -8.855 -13.688 1.00 1.00 H new ATOM 388 N ALA A 99 10.023 -7.655 -11.465 1.00 1.00 N ATOM 389 CA ALA A 99 8.614 -7.604 -11.815 1.00 1.00 C ATOM 390 C ALA A 99 8.114 -6.164 -11.691 1.00 1.00 C ATOM 391 O ALA A 99 8.628 -5.392 -10.882 1.00 1.00 O ATOM 392 CB ALA A 99 7.833 -8.572 -10.924 1.00 1.00 C ATOM 0 H ALA A 99 10.213 -7.683 -10.463 1.00 1.00 H new ATOM 0 HA ALA A 99 8.463 -7.917 -12.848 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.776 -8.535 -11.186 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.208 -9.585 -11.071 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.959 -8.287 -9.879 1.00 1.00 H new ATOM 398 N LYS A 100 7.117 -5.846 -12.503 1.00 1.00 N ATOM 399 CA LYS A 100 6.541 -4.512 -12.495 1.00 1.00 C ATOM 400 C LYS A 100 6.152 -4.138 -11.063 1.00 1.00 C ATOM 401 O LYS A 100 6.186 -4.980 -10.167 1.00 1.00 O ATOM 402 CB LYS A 100 5.382 -4.421 -13.490 1.00 1.00 C ATOM 403 CG LYS A 100 5.736 -5.115 -14.807 1.00 1.00 C ATOM 404 CD LYS A 100 5.074 -4.408 -15.992 1.00 1.00 C ATOM 405 CE LYS A 100 4.454 -5.422 -16.958 1.00 1.00 C ATOM 406 NZ LYS A 100 5.508 -6.097 -17.747 1.00 1.00 N ATOM 0 H LYS A 100 6.693 -6.489 -13.171 1.00 1.00 H new ATOM 0 HA LYS A 100 7.275 -3.779 -12.829 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.492 -4.880 -13.060 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.141 -3.375 -13.679 1.00 1.00 H new ATOM 0 HG2 LYS A 100 6.818 -5.121 -14.940 1.00 1.00 H new ATOM 0 HG3 LYS A 100 5.413 -6.156 -14.773 1.00 1.00 H new ATOM 0 HD2 LYS A 100 4.304 -3.727 -15.630 1.00 1.00 H new ATOM 0 HD3 LYS A 100 5.812 -3.803 -16.518 1.00 1.00 H new ATOM 0 HE2 LYS A 100 3.880 -6.161 -16.399 1.00 1.00 H new ATOM 0 HE3 LYS A 100 3.758 -4.917 -17.627 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 5.071 -6.781 -18.397 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 6.038 -5.390 -18.295 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 6.157 -6.595 -17.105 1.00 1.00 H new ATOM 415 N ALA A 101 5.792 -2.875 -10.892 1.00 1.00 N ATOM 416 CA ALA A 101 5.397 -2.379 -9.584 1.00 1.00 C ATOM 417 C ALA A 101 3.872 -2.291 -9.516 1.00 1.00 C ATOM 418 O ALA A 101 3.228 -1.861 -10.471 1.00 1.00 O ATOM 419 CB ALA A 101 6.071 -1.030 -9.324 1.00 1.00 C ATOM 0 H ALA A 101 5.765 -2.179 -11.638 1.00 1.00 H new ATOM 0 HA ALA A 101 5.723 -3.063 -8.800 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.775 -0.658 -8.343 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.154 -1.152 -9.354 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.765 -0.317 -10.090 1.00 1.00 H new ATOM 425 N PHE A 102 3.337 -2.706 -8.377 1.00 1.00 N ATOM 426 CA PHE A 102 1.899 -2.679 -8.172 1.00 1.00 C ATOM 427 C PHE A 102 1.361 -1.249 -8.246 1.00 1.00 C ATOM 428 O PHE A 102 0.282 -1.015 -8.790 1.00 1.00 O ATOM 429 CB PHE A 102 1.636 -3.239 -6.773 1.00 1.00 C ATOM 430 CG PHE A 102 1.544 -4.765 -6.719 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.503 -5.405 -7.318 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.502 -5.482 -6.073 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.418 -6.821 -7.269 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.416 -6.898 -6.025 1.00 1.00 C ATOM 435 CZ PHE A 102 1.377 -7.539 -6.623 1.00 1.00 C ATOM 0 H PHE A 102 3.874 -3.063 -7.587 1.00 1.00 H new ATOM 0 HA PHE A 102 1.402 -3.265 -8.945 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.433 -2.910 -6.106 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.706 -2.816 -6.393 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.258 -4.836 -7.831 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.328 -4.974 -5.597 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.408 -7.329 -7.745 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.177 -7.467 -5.512 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.313 -8.616 -6.586 1.00 1.00 H new ATOM 444 N ILE A 103 2.136 -0.329 -7.691 1.00 1.00 N ATOM 445 CA ILE A 103 1.751 1.072 -7.687 1.00 1.00 C ATOM 446 C ILE A 103 3.009 1.942 -7.696 1.00 1.00 C ATOM 447 O ILE A 103 3.674 2.090 -6.672 1.00 1.00 O ATOM 448 CB ILE A 103 0.809 1.365 -6.517 1.00 1.00 C ATOM 449 CG1 ILE A 103 -0.641 1.047 -6.887 1.00 1.00 C ATOM 450 CG2 ILE A 103 0.973 2.806 -6.029 1.00 1.00 C ATOM 451 CD1 ILE A 103 -1.196 -0.079 -6.013 1.00 1.00 C ATOM 0 H ILE A 103 3.030 -0.527 -7.241 1.00 1.00 H new ATOM 0 HA ILE A 103 1.188 1.315 -8.588 1.00 1.00 H new ATOM 0 HB ILE A 103 1.080 0.711 -5.688 1.00 1.00 H new ATOM 0 HG12 ILE A 103 -1.254 1.940 -6.768 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.697 0.759 -7.937 1.00 1.00 H new ATOM 0 HG21 ILE A 103 0.292 2.988 -5.197 1.00 1.00 H new ATOM 0 HG22 ILE A 103 2.000 2.964 -5.699 1.00 1.00 H new ATOM 0 HG23 ILE A 103 0.744 3.494 -6.843 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -2.228 -0.285 -6.297 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.595 -0.978 -6.152 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -1.161 0.222 -4.966 1.00 1.00 H new ATOM 462 N GLU A 104 3.299 2.495 -8.864 1.00 1.00 N ATOM 463 CA GLU A 104 4.465 3.347 -9.021 1.00 1.00 C ATOM 464 C GLU A 104 4.114 4.796 -8.677 1.00 1.00 C ATOM 465 O GLU A 104 3.097 5.317 -9.131 1.00 1.00 O ATOM 466 CB GLU A 104 5.035 3.242 -10.437 1.00 1.00 C ATOM 467 CG GLU A 104 6.419 2.590 -10.424 1.00 1.00 C ATOM 468 CD GLU A 104 7.517 3.630 -10.652 1.00 1.00 C ATOM 469 OE1 GLU A 104 7.699 4.102 -11.784 1.00 1.00 O ATOM 470 OE2 GLU A 104 8.195 3.946 -9.601 1.00 1.00 O ATOM 0 H GLU A 104 2.746 2.369 -9.712 1.00 1.00 H new ATOM 0 HA GLU A 104 5.235 3.006 -8.329 1.00 1.00 H new ATOM 0 HB2 GLU A 104 4.360 2.658 -11.062 1.00 1.00 H new ATOM 0 HB3 GLU A 104 5.101 4.235 -10.881 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.580 2.089 -9.469 1.00 1.00 H new ATOM 0 HG3 GLU A 104 6.472 1.825 -11.198 1.00 1.00 H new ATOM 476 N VAL A 105 4.977 5.407 -7.878 1.00 1.00 N ATOM 477 CA VAL A 105 4.772 6.786 -7.469 1.00 1.00 C ATOM 478 C VAL A 105 4.255 7.595 -8.660 1.00 1.00 C ATOM 479 O VAL A 105 4.947 7.735 -9.666 1.00 1.00 O ATOM 480 CB VAL A 105 6.062 7.353 -6.874 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.940 8.860 -6.636 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.439 6.622 -5.584 1.00 1.00 C ATOM 0 H VAL A 105 5.820 4.972 -7.503 1.00 1.00 H new ATOM 0 HA VAL A 105 4.017 6.844 -6.685 1.00 1.00 H new ATOM 0 HB VAL A 105 6.863 7.192 -7.596 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.871 9.238 -6.213 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.741 9.363 -7.582 1.00 1.00 H new ATOM 0 HG13 VAL A 105 5.121 9.054 -5.943 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.360 7.045 -5.182 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.638 6.736 -4.854 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.588 5.563 -5.796 1.00 1.00 H new ATOM 492 N GLY A 106 3.042 8.107 -8.506 1.00 1.00 N ATOM 493 CA GLY A 106 2.425 8.899 -9.556 1.00 1.00 C ATOM 494 C GLY A 106 1.331 8.104 -10.272 1.00 1.00 C ATOM 495 O GLY A 106 1.018 8.375 -11.429 1.00 1.00 O ATOM 0 H GLY A 106 2.470 7.988 -7.670 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.999 9.807 -9.129 1.00 1.00 H new ATOM 0 HA3 GLY A 106 3.183 9.210 -10.275 1.00 1.00 H new ATOM 499 N GLN A 107 0.781 7.137 -9.552 1.00 1.00 N ATOM 500 CA GLN A 107 -0.272 6.300 -10.103 1.00 1.00 C ATOM 501 C GLN A 107 -1.511 6.347 -9.207 1.00 1.00 C ATOM 502 O GLN A 107 -1.439 6.797 -8.065 1.00 1.00 O ATOM 503 CB GLN A 107 0.214 4.862 -10.293 1.00 1.00 C ATOM 504 CG GLN A 107 -0.571 4.161 -11.403 1.00 1.00 C ATOM 505 CD GLN A 107 0.269 3.063 -12.061 1.00 1.00 C ATOM 506 OE1 GLN A 107 0.759 3.202 -13.168 1.00 1.00 O ATOM 507 NE2 GLN A 107 0.409 1.970 -11.316 1.00 1.00 N ATOM 0 H GLN A 107 1.045 6.914 -8.592 1.00 1.00 H new ATOM 0 HA GLN A 107 -0.543 6.689 -11.084 1.00 1.00 H new ATOM 0 HB2 GLN A 107 1.276 4.863 -10.538 1.00 1.00 H new ATOM 0 HB3 GLN A 107 0.103 4.310 -9.360 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.483 3.728 -10.991 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.875 4.890 -12.154 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.029 1.920 -10.396 1.00 1.00 H new ATOM 0 HE22 GLN A 107 0.954 1.182 -11.665 1.00 1.00 H new ATOM 514 N LYS A 108 -2.620 5.874 -9.759 1.00 1.00 N ATOM 515 CA LYS A 108 -3.873 5.857 -9.024 1.00 1.00 C ATOM 516 C LYS A 108 -4.288 4.406 -8.769 1.00 1.00 C ATOM 517 O LYS A 108 -3.645 3.478 -9.255 1.00 1.00 O ATOM 518 CB LYS A 108 -4.934 6.682 -9.754 1.00 1.00 C ATOM 519 CG LYS A 108 -4.298 7.855 -10.503 1.00 1.00 C ATOM 520 CD LYS A 108 -5.355 8.657 -11.264 1.00 1.00 C ATOM 521 CE LYS A 108 -4.900 8.938 -12.699 1.00 1.00 C ATOM 522 NZ LYS A 108 -6.019 8.734 -13.645 1.00 1.00 N ATOM 0 H LYS A 108 -2.676 5.500 -10.706 1.00 1.00 H new ATOM 0 HA LYS A 108 -3.751 6.330 -8.050 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.473 6.047 -10.457 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.665 7.057 -9.037 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -3.782 8.505 -9.797 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -3.548 7.482 -11.200 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -6.295 8.106 -11.278 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -5.545 9.598 -10.748 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -4.532 9.961 -12.777 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -4.071 8.280 -12.960 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -5.694 8.928 -14.614 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -6.352 7.751 -13.582 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -6.799 9.379 -13.405 1.00 1.00 H new ATOM 531 N VAL A 109 -5.363 4.257 -8.008 1.00 1.00 N ATOM 532 CA VAL A 109 -5.872 2.935 -7.683 1.00 1.00 C ATOM 533 C VAL A 109 -7.378 3.023 -7.430 1.00 1.00 C ATOM 534 O VAL A 109 -7.880 4.058 -6.994 1.00 1.00 O ATOM 535 CB VAL A 109 -5.099 2.355 -6.498 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.662 2.012 -6.894 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.126 3.311 -5.304 1.00 1.00 C ATOM 0 H VAL A 109 -5.895 5.029 -7.607 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.722 2.250 -8.518 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.592 1.431 -6.198 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -3.135 1.602 -6.032 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.672 1.276 -7.698 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.153 2.914 -7.234 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.569 2.874 -4.475 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.670 4.260 -5.587 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.158 3.481 -4.998 1.00 1.00 H new ATOM 547 N ASN A 110 -8.059 1.922 -7.715 1.00 1.00 N ATOM 548 CA ASN A 110 -9.497 1.861 -7.525 1.00 1.00 C ATOM 549 C ASN A 110 -9.867 0.520 -6.886 1.00 1.00 C ATOM 550 O ASN A 110 -9.223 -0.494 -7.148 1.00 1.00 O ATOM 551 CB ASN A 110 -10.235 1.967 -8.861 1.00 1.00 C ATOM 552 CG ASN A 110 -9.681 3.117 -9.703 1.00 1.00 C ATOM 553 OD1 ASN A 110 -8.816 2.943 -10.546 1.00 1.00 O ATOM 554 ND2 ASN A 110 -10.226 4.299 -9.430 1.00 1.00 N ATOM 0 H ASN A 110 -7.640 1.065 -8.076 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.787 2.695 -6.885 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -10.138 1.030 -9.410 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -11.299 2.122 -8.682 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -9.924 5.130 -9.939 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -10.946 4.375 -8.712 1.00 1.00 H new ATOM 560 N VAL A 111 -10.900 0.560 -6.059 1.00 1.00 N ATOM 561 CA VAL A 111 -11.363 -0.639 -5.381 1.00 1.00 C ATOM 562 C VAL A 111 -11.312 -1.821 -6.351 1.00 1.00 C ATOM 563 O VAL A 111 -12.108 -1.897 -7.285 1.00 1.00 O ATOM 564 CB VAL A 111 -12.758 -0.406 -4.797 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.504 -1.729 -4.612 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.678 0.368 -3.479 1.00 1.00 C ATOM 0 H VAL A 111 -11.430 1.404 -5.842 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.710 -0.878 -4.542 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.322 0.199 -5.507 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.492 -1.534 -4.196 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.608 -2.226 -5.577 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.944 -2.371 -3.932 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.683 0.520 -3.085 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.088 -0.199 -2.759 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.206 1.335 -3.653 1.00 1.00 H new ATOM 576 N GLY A 112 -10.366 -2.714 -6.097 1.00 1.00 N ATOM 577 CA GLY A 112 -10.200 -3.888 -6.936 1.00 1.00 C ATOM 578 C GLY A 112 -8.760 -4.001 -7.442 1.00 1.00 C ATOM 579 O GLY A 112 -8.350 -5.054 -7.928 1.00 1.00 O ATOM 0 H GLY A 112 -9.707 -2.647 -5.322 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -10.462 -4.783 -6.372 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.884 -3.834 -7.783 1.00 1.00 H new ATOM 583 N ASP A 113 -8.033 -2.902 -7.311 1.00 1.00 N ATOM 584 CA ASP A 113 -6.648 -2.865 -7.749 1.00 1.00 C ATOM 585 C ASP A 113 -5.733 -3.139 -6.555 1.00 1.00 C ATOM 586 O ASP A 113 -5.965 -2.630 -5.459 1.00 1.00 O ATOM 587 CB ASP A 113 -6.287 -1.490 -8.315 1.00 1.00 C ATOM 588 CG ASP A 113 -6.138 -1.436 -9.837 1.00 1.00 C ATOM 589 OD1 ASP A 113 -5.017 -1.408 -10.369 1.00 1.00 O ATOM 590 OD2 ASP A 113 -7.248 -1.422 -10.493 1.00 1.00 O ATOM 0 H ASP A 113 -8.377 -2.030 -6.908 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.519 -3.620 -8.524 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -7.055 -0.777 -8.015 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.352 -1.161 -7.862 1.00 1.00 H new ATOM 595 N THR A 114 -4.710 -3.944 -6.807 1.00 1.00 N ATOM 596 CA THR A 114 -3.758 -4.292 -5.766 1.00 1.00 C ATOM 597 C THR A 114 -3.188 -3.028 -5.119 1.00 1.00 C ATOM 598 O THR A 114 -3.464 -1.917 -5.569 1.00 1.00 O ATOM 599 CB THR A 114 -2.687 -5.192 -6.387 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.416 -6.319 -6.866 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.738 -5.780 -5.341 1.00 1.00 C ATOM 0 H THR A 114 -4.520 -4.365 -7.717 1.00 1.00 H new ATOM 0 HA THR A 114 -4.240 -4.843 -4.958 1.00 1.00 H new ATOM 0 HB THR A 114 -2.113 -4.622 -7.118 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.799 -6.954 -7.286 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.998 -6.410 -5.834 1.00 1.00 H new ATOM 0 HG22 THR A 114 -1.232 -4.971 -4.813 1.00 1.00 H new ATOM 0 HG23 THR A 114 -2.307 -6.378 -4.629 1.00 1.00 H new ATOM 609 N LEU A 115 -2.404 -3.240 -4.072 1.00 1.00 N ATOM 610 CA LEU A 115 -1.793 -2.131 -3.359 1.00 1.00 C ATOM 611 C LEU A 115 -0.334 -2.472 -3.049 1.00 1.00 C ATOM 612 O LEU A 115 0.558 -1.652 -3.266 1.00 1.00 O ATOM 613 CB LEU A 115 -2.617 -1.771 -2.121 1.00 1.00 C ATOM 614 CG LEU A 115 -2.794 -0.278 -1.843 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.470 0.422 -3.024 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.550 -0.049 -0.533 1.00 1.00 C ATOM 0 H LEU A 115 -2.178 -4.163 -3.701 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.787 -1.236 -3.980 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.605 -2.221 -2.223 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -2.147 -2.229 -1.251 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.806 0.167 -1.726 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.584 1.483 -2.801 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.857 0.303 -3.917 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -4.451 -0.020 -3.196 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.662 1.021 -0.360 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.535 -0.511 -0.596 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.992 -0.494 0.291 1.00 1.00 H new ATOM 627 N CYS A 116 -0.136 -3.682 -2.547 1.00 1.00 N ATOM 628 CA CYS A 116 1.200 -4.140 -2.204 1.00 1.00 C ATOM 629 C CYS A 116 1.107 -5.603 -1.764 1.00 1.00 C ATOM 630 O CYS A 116 0.071 -6.243 -1.937 1.00 1.00 O ATOM 631 CB CYS A 116 1.843 -3.261 -1.131 1.00 1.00 C ATOM 632 SG CYS A 116 1.120 -3.642 0.507 1.00 1.00 S ATOM 0 H CYS A 116 -0.878 -4.359 -2.370 1.00 1.00 H new ATOM 0 HA CYS A 116 1.848 -4.064 -3.077 1.00 1.00 H new ATOM 0 HB2 CYS A 116 2.920 -3.428 -1.110 1.00 1.00 H new ATOM 0 HB3 CYS A 116 1.688 -2.209 -1.370 1.00 1.00 H new ATOM 0 HG CYS A 116 1.966 -3.320 1.440 1.00 1.00 H new ATOM 637 N ILE A 117 2.205 -6.089 -1.202 1.00 1.00 N ATOM 638 CA ILE A 117 2.259 -7.464 -0.735 1.00 1.00 C ATOM 639 C ILE A 117 2.857 -7.496 0.672 1.00 1.00 C ATOM 640 O ILE A 117 3.629 -6.613 1.043 1.00 1.00 O ATOM 641 CB ILE A 117 3.007 -8.342 -1.742 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.408 -8.203 -3.142 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.045 -9.798 -1.275 1.00 1.00 C ATOM 644 CD1 ILE A 117 2.860 -9.350 -4.048 1.00 1.00 C ATOM 0 H ILE A 117 3.063 -5.556 -1.060 1.00 1.00 H new ATOM 0 HA ILE A 117 1.255 -7.883 -0.665 1.00 1.00 H new ATOM 0 HB ILE A 117 4.039 -7.995 -1.799 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.320 -8.194 -3.077 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.709 -7.250 -3.578 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.582 -10.401 -2.007 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.553 -9.858 -0.313 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.027 -10.174 -1.172 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.420 -9.227 -5.038 1.00 1.00 H new ATOM 0 HD12 ILE A 117 3.947 -9.342 -4.131 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.536 -10.300 -3.622 1.00 1.00 H new ATOM 655 N VAL A 118 2.479 -8.524 1.418 1.00 1.00 N ATOM 656 CA VAL A 118 2.968 -8.682 2.777 1.00 1.00 C ATOM 657 C VAL A 118 3.413 -10.132 2.989 1.00 1.00 C ATOM 658 O VAL A 118 2.684 -11.064 2.651 1.00 1.00 O ATOM 659 CB VAL A 118 1.898 -8.234 3.774 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.257 -8.669 5.197 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.681 -6.721 3.702 1.00 1.00 C ATOM 0 H VAL A 118 1.840 -9.255 1.107 1.00 1.00 H new ATOM 0 HA VAL A 118 3.837 -8.046 2.946 1.00 1.00 H new ATOM 0 HB VAL A 118 0.962 -8.721 3.501 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.480 -8.338 5.886 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.338 -9.755 5.236 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.210 -8.224 5.484 1.00 1.00 H new ATOM 0 HG21 VAL A 118 0.915 -6.429 4.421 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.614 -6.208 3.937 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.359 -6.447 2.697 1.00 1.00 H new ATOM 671 N GLU A 119 4.605 -10.276 3.547 1.00 1.00 N ATOM 672 CA GLU A 119 5.156 -11.595 3.807 1.00 1.00 C ATOM 673 C GLU A 119 4.954 -11.973 5.276 1.00 1.00 C ATOM 674 O GLU A 119 5.301 -11.207 6.172 1.00 1.00 O ATOM 675 CB GLU A 119 6.635 -11.658 3.423 1.00 1.00 C ATOM 676 CG GLU A 119 6.972 -12.991 2.752 1.00 1.00 C ATOM 677 CD GLU A 119 8.202 -12.858 1.852 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.063 -12.721 0.628 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.335 -12.898 2.469 1.00 1.00 O ATOM 0 H GLU A 119 5.206 -9.500 3.827 1.00 1.00 H new ATOM 0 HA GLU A 119 4.624 -12.318 3.189 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.874 -10.836 2.748 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.251 -11.529 4.313 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.155 -13.749 3.513 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.121 -13.330 2.162 1.00 1.00 H new ATOM 685 N ALA A 120 4.392 -13.157 5.476 1.00 1.00 N ATOM 686 CA ALA A 120 4.139 -13.646 6.821 1.00 1.00 C ATOM 687 C ALA A 120 4.096 -15.176 6.803 1.00 1.00 C ATOM 688 O ALA A 120 3.715 -15.778 5.800 1.00 1.00 O ATOM 689 CB ALA A 120 2.842 -13.034 7.353 1.00 1.00 C ATOM 0 H ALA A 120 4.105 -13.791 4.730 1.00 1.00 H new ATOM 0 HA ALA A 120 4.941 -13.345 7.495 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.653 -13.401 8.362 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.934 -11.948 7.374 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.013 -13.316 6.703 1.00 1.00 H new ATOM 695 N MET A 121 4.492 -15.761 7.923 1.00 1.00 N ATOM 696 CA MET A 121 4.505 -17.209 8.047 1.00 1.00 C ATOM 697 C MET A 121 5.274 -17.852 6.893 1.00 1.00 C ATOM 698 O MET A 121 5.026 -19.005 6.543 1.00 1.00 O ATOM 699 CB MET A 121 3.067 -17.732 8.058 1.00 1.00 C ATOM 700 CG MET A 121 2.317 -17.250 9.301 1.00 1.00 C ATOM 701 SD MET A 121 1.815 -15.550 9.091 1.00 1.00 S ATOM 702 CE MET A 121 0.649 -15.402 10.435 1.00 1.00 C ATOM 0 H MET A 121 4.806 -15.259 8.753 1.00 1.00 H new ATOM 0 HA MET A 121 5.004 -17.471 8.980 1.00 1.00 H new ATOM 0 HB2 MET A 121 2.547 -17.395 7.162 1.00 1.00 H new ATOM 0 HB3 MET A 121 3.073 -18.822 8.032 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.442 -17.877 9.474 1.00 1.00 H new ATOM 0 HG3 MET A 121 2.955 -17.343 10.180 1.00 1.00 H new ATOM 0 HE1 MET A 121 0.237 -14.393 10.449 1.00 1.00 H new ATOM 0 HE2 MET A 121 -0.158 -16.122 10.298 1.00 1.00 H new ATOM 0 HE3 MET A 121 1.155 -15.600 11.380 1.00 1.00 H new ATOM 710 N LYS A 122 6.192 -17.079 6.331 1.00 1.00 N ATOM 711 CA LYS A 122 7.000 -17.559 5.224 1.00 1.00 C ATOM 712 C LYS A 122 6.104 -17.779 4.004 1.00 1.00 C ATOM 713 O LYS A 122 6.245 -18.776 3.296 1.00 1.00 O ATOM 714 CB LYS A 122 7.792 -18.802 5.637 1.00 1.00 C ATOM 715 CG LYS A 122 9.096 -18.414 6.335 1.00 1.00 C ATOM 716 CD LYS A 122 10.272 -19.231 5.795 1.00 1.00 C ATOM 717 CE LYS A 122 11.006 -18.471 4.689 1.00 1.00 C ATOM 718 NZ LYS A 122 11.732 -17.310 5.251 1.00 1.00 N ATOM 0 H LYS A 122 6.394 -16.123 6.622 1.00 1.00 H new ATOM 0 HA LYS A 122 7.745 -16.814 4.944 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.188 -19.418 6.303 1.00 1.00 H new ATOM 0 HB3 LYS A 122 8.012 -19.406 4.757 1.00 1.00 H new ATOM 0 HG2 LYS A 122 9.289 -17.351 6.188 1.00 1.00 H new ATOM 0 HG3 LYS A 122 9.000 -18.575 7.409 1.00 1.00 H new ATOM 0 HD2 LYS A 122 10.964 -19.458 6.606 1.00 1.00 H new ATOM 0 HD3 LYS A 122 9.910 -20.184 5.408 1.00 1.00 H new ATOM 0 HE2 LYS A 122 11.707 -19.137 4.186 1.00 1.00 H new ATOM 0 HE3 LYS A 122 10.293 -18.132 3.938 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 12.529 -17.065 4.629 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 11.086 -16.498 5.323 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 12.092 -17.550 6.197 1.00 1.00 H new ATOM 727 N MET A 123 5.203 -16.831 3.793 1.00 1.00 N ATOM 728 CA MET A 123 4.284 -16.908 2.669 1.00 1.00 C ATOM 729 C MET A 123 3.896 -15.511 2.182 1.00 1.00 C ATOM 730 O MET A 123 3.810 -14.574 2.974 1.00 1.00 O ATOM 731 CB MET A 123 3.025 -17.670 3.091 1.00 1.00 C ATOM 732 CG MET A 123 2.882 -18.972 2.302 1.00 1.00 C ATOM 733 SD MET A 123 2.173 -18.638 0.698 1.00 1.00 S ATOM 734 CE MET A 123 3.599 -18.927 -0.337 1.00 1.00 C ATOM 0 H MET A 123 5.089 -16.005 4.381 1.00 1.00 H new ATOM 0 HA MET A 123 4.780 -17.432 1.852 1.00 1.00 H new ATOM 0 HB2 MET A 123 3.069 -17.890 4.158 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.146 -17.045 2.931 1.00 1.00 H new ATOM 0 HG2 MET A 123 3.857 -19.446 2.186 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.250 -19.671 2.850 1.00 1.00 H new ATOM 0 HE1 MET A 123 3.797 -18.041 -0.940 1.00 1.00 H new ATOM 0 HE2 MET A 123 4.465 -19.141 0.289 1.00 1.00 H new ATOM 0 HE3 MET A 123 3.407 -19.776 -0.993 1.00 1.00 H new ATOM 742 N MET A 124 3.673 -15.415 0.879 1.00 1.00 N ATOM 743 CA MET A 124 3.297 -14.148 0.276 1.00 1.00 C ATOM 744 C MET A 124 1.795 -13.896 0.420 1.00 1.00 C ATOM 745 O MET A 124 0.984 -14.772 0.124 1.00 1.00 O ATOM 746 CB MET A 124 3.673 -14.157 -1.207 1.00 1.00 C ATOM 747 CG MET A 124 4.911 -13.295 -1.465 1.00 1.00 C ATOM 748 SD MET A 124 6.076 -14.188 -2.480 1.00 1.00 S ATOM 749 CE MET A 124 6.603 -12.879 -3.573 1.00 1.00 C ATOM 0 H MET A 124 3.746 -16.194 0.225 1.00 1.00 H new ATOM 0 HA MET A 124 3.831 -13.350 0.791 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.864 -15.180 -1.531 1.00 1.00 H new ATOM 0 HB3 MET A 124 2.837 -13.786 -1.800 1.00 1.00 H new ATOM 0 HG2 MET A 124 4.622 -12.367 -1.959 1.00 1.00 H new ATOM 0 HG3 MET A 124 5.377 -13.020 -0.519 1.00 1.00 H new ATOM 0 HE1 MET A 124 7.338 -13.267 -4.278 1.00 1.00 H new ATOM 0 HE2 MET A 124 5.743 -12.494 -4.121 1.00 1.00 H new ATOM 0 HE3 MET A 124 7.050 -12.075 -2.989 1.00 1.00 H new ATOM 757 N ASN A 125 1.470 -12.696 0.876 1.00 1.00 N ATOM 758 CA ASN A 125 0.079 -12.317 1.063 1.00 1.00 C ATOM 759 C ASN A 125 -0.158 -10.938 0.444 1.00 1.00 C ATOM 760 O ASN A 125 0.187 -9.919 1.039 1.00 1.00 O ATOM 761 CB ASN A 125 -0.273 -12.235 2.550 1.00 1.00 C ATOM 762 CG ASN A 125 0.009 -13.563 3.255 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.854 -14.411 3.406 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.264 -13.696 3.677 1.00 1.00 N ATOM 0 H ASN A 125 2.146 -11.973 1.122 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.544 -13.073 0.585 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.305 -11.440 3.021 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.325 -11.975 2.664 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.552 -14.547 4.159 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.938 -12.947 3.518 1.00 1.00 H new ATOM 770 N GLN A 126 -0.745 -10.951 -0.744 1.00 1.00 N ATOM 771 CA GLN A 126 -1.032 -9.715 -1.450 1.00 1.00 C ATOM 772 C GLN A 126 -2.060 -8.887 -0.675 1.00 1.00 C ATOM 773 O GLN A 126 -2.813 -9.426 0.135 1.00 1.00 O ATOM 774 CB GLN A 126 -1.517 -9.996 -2.873 1.00 1.00 C ATOM 775 CG GLN A 126 -0.338 -10.277 -3.808 1.00 1.00 C ATOM 776 CD GLN A 126 -0.627 -11.479 -4.709 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.755 -12.608 -4.261 1.00 1.00 O ATOM 778 NE2 GLN A 126 -0.722 -11.178 -6.001 1.00 1.00 N ATOM 0 H GLN A 126 -1.029 -11.799 -1.235 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.110 -9.139 -1.522 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.194 -10.850 -2.868 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.084 -9.142 -3.243 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.138 -9.398 -4.421 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.560 -10.466 -3.220 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -0.604 -10.213 -6.310 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -0.912 -11.912 -6.683 1.00 1.00 H new ATOM 785 N ILE A 127 -2.057 -7.592 -0.951 1.00 1.00 N ATOM 786 CA ILE A 127 -2.980 -6.684 -0.289 1.00 1.00 C ATOM 787 C ILE A 127 -3.706 -5.845 -1.342 1.00 1.00 C ATOM 788 O ILE A 127 -3.081 -5.060 -2.055 1.00 1.00 O ATOM 789 CB ILE A 127 -2.248 -5.850 0.764 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.519 -6.748 1.765 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.206 -4.879 1.456 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.183 -5.981 3.046 1.00 1.00 C ATOM 0 H ILE A 127 -1.431 -7.149 -1.623 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.742 -7.244 0.254 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.490 -5.250 0.259 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -2.141 -7.610 2.006 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.603 -7.131 1.315 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.661 -4.298 2.200 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.639 -4.206 0.716 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -4.002 -5.440 1.946 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.665 -6.642 3.741 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.541 -5.134 2.805 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.103 -5.620 3.506 1.00 1.00 H new ATOM 803 N GLU A 128 -5.015 -6.039 -1.408 1.00 1.00 N ATOM 804 CA GLU A 128 -5.833 -5.310 -2.363 1.00 1.00 C ATOM 805 C GLU A 128 -6.261 -3.964 -1.776 1.00 1.00 C ATOM 806 O GLU A 128 -6.355 -3.815 -0.558 1.00 1.00 O ATOM 807 CB GLU A 128 -7.050 -6.135 -2.785 1.00 1.00 C ATOM 808 CG GLU A 128 -7.743 -5.511 -3.997 1.00 1.00 C ATOM 809 CD GLU A 128 -8.624 -6.535 -4.714 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.717 -6.861 -4.228 1.00 1.00 O ATOM 811 OE2 GLU A 128 -8.137 -6.999 -5.815 1.00 1.00 O ATOM 0 H GLU A 128 -5.530 -6.691 -0.816 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.235 -5.122 -3.255 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.739 -7.152 -3.023 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.753 -6.203 -1.955 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.351 -4.665 -3.677 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.995 -5.123 -4.688 1.00 1.00 H new ATOM 817 N ALA A 129 -6.507 -3.016 -2.668 1.00 1.00 N ATOM 818 CA ALA A 129 -6.922 -1.687 -2.253 1.00 1.00 C ATOM 819 C ALA A 129 -8.274 -1.778 -1.543 1.00 1.00 C ATOM 820 O ALA A 129 -9.143 -2.546 -1.951 1.00 1.00 O ATOM 821 CB ALA A 129 -6.965 -0.763 -3.472 1.00 1.00 C ATOM 0 H ALA A 129 -6.427 -3.142 -3.677 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.207 -1.264 -1.547 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.276 0.234 -3.162 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.974 -0.710 -3.923 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.675 -1.154 -4.200 1.00 1.00 H new ATOM 827 N ASP A 130 -8.409 -0.983 -0.492 1.00 1.00 N ATOM 828 CA ASP A 130 -9.640 -0.964 0.279 1.00 1.00 C ATOM 829 C ASP A 130 -10.223 0.450 0.267 1.00 1.00 C ATOM 830 O ASP A 130 -11.012 0.809 1.140 1.00 1.00 O ATOM 831 CB ASP A 130 -9.384 -1.357 1.736 1.00 1.00 C ATOM 832 CG ASP A 130 -8.237 -0.606 2.416 1.00 1.00 C ATOM 833 OD1 ASP A 130 -7.218 -0.291 1.785 1.00 1.00 O ATOM 834 OD2 ASP A 130 -8.425 -0.339 3.664 1.00 1.00 O ATOM 0 H ASP A 130 -7.686 -0.347 -0.156 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.330 -1.677 -0.171 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -10.297 -1.190 2.307 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.173 -2.426 1.777 1.00 1.00 H new ATOM 839 N LYS A 131 -9.812 1.216 -0.734 1.00 1.00 N ATOM 840 CA LYS A 131 -10.284 2.584 -0.872 1.00 1.00 C ATOM 841 C LYS A 131 -9.530 3.266 -2.015 1.00 1.00 C ATOM 842 O LYS A 131 -8.355 3.600 -1.875 1.00 1.00 O ATOM 843 CB LYS A 131 -10.180 3.324 0.463 1.00 1.00 C ATOM 844 CG LYS A 131 -11.561 3.755 0.961 1.00 1.00 C ATOM 845 CD LYS A 131 -11.494 5.123 1.643 1.00 1.00 C ATOM 846 CE LYS A 131 -12.895 5.627 1.999 1.00 1.00 C ATOM 847 NZ LYS A 131 -13.372 6.591 0.982 1.00 1.00 N ATOM 0 H LYS A 131 -9.158 0.915 -1.457 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.342 2.598 -1.135 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -9.707 2.679 1.204 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.541 4.200 0.348 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.257 3.796 0.124 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -11.947 3.014 1.661 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -10.888 5.054 2.546 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -11.003 5.839 0.984 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -13.585 4.786 2.064 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -12.879 6.102 2.980 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -14.324 6.923 1.238 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -12.722 7.402 0.940 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -13.406 6.126 0.052 1.00 1.00 H new ATOM 856 N SER A 132 -10.237 3.453 -3.119 1.00 1.00 N ATOM 857 CA SER A 132 -9.649 4.089 -4.286 1.00 1.00 C ATOM 858 C SER A 132 -8.974 5.401 -3.881 1.00 1.00 C ATOM 859 O SER A 132 -9.409 6.063 -2.940 1.00 1.00 O ATOM 860 CB SER A 132 -10.704 4.346 -5.364 1.00 1.00 C ATOM 861 OG SER A 132 -11.638 5.348 -4.969 1.00 1.00 O ATOM 0 H SER A 132 -11.212 3.175 -3.231 1.00 1.00 H new ATOM 0 HA SER A 132 -8.900 3.415 -4.702 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.212 4.653 -6.287 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.236 3.419 -5.579 1.00 1.00 H new ATOM 0 HG SER A 132 -12.294 5.484 -5.684 1.00 1.00 H new ATOM 866 N GLY A 133 -7.921 5.737 -4.612 1.00 1.00 N ATOM 867 CA GLY A 133 -7.180 6.957 -4.341 1.00 1.00 C ATOM 868 C GLY A 133 -5.879 6.999 -5.144 1.00 1.00 C ATOM 869 O GLY A 133 -5.625 6.122 -5.968 1.00 1.00 O ATOM 0 H GLY A 133 -7.563 5.185 -5.392 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.794 7.822 -4.591 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.956 7.022 -3.276 1.00 1.00 H new ATOM 873 N THR A 134 -5.088 8.028 -4.875 1.00 1.00 N ATOM 874 CA THR A 134 -3.818 8.194 -5.562 1.00 1.00 C ATOM 875 C THR A 134 -2.659 8.109 -4.568 1.00 1.00 C ATOM 876 O THR A 134 -2.866 8.187 -3.359 1.00 1.00 O ATOM 877 CB THR A 134 -3.867 9.518 -6.328 1.00 1.00 C ATOM 878 OG1 THR A 134 -4.743 9.257 -7.420 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.532 9.858 -6.995 1.00 1.00 C ATOM 0 H THR A 134 -5.302 8.754 -4.191 1.00 1.00 H new ATOM 0 HA THR A 134 -3.647 7.392 -6.280 1.00 1.00 H new ATOM 0 HB THR A 134 -4.148 10.321 -5.646 1.00 1.00 H new ATOM 0 HG1 THR A 134 -4.833 10.065 -7.968 1.00 1.00 H new ATOM 0 HG21 THR A 134 -2.621 10.806 -7.525 1.00 1.00 H new ATOM 0 HG22 THR A 134 -1.755 9.939 -6.234 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.267 9.071 -7.701 1.00 1.00 H new ATOM 887 N VAL A 135 -1.463 7.949 -5.116 1.00 1.00 N ATOM 888 CA VAL A 135 -0.270 7.852 -4.292 1.00 1.00 C ATOM 889 C VAL A 135 -0.212 9.049 -3.341 1.00 1.00 C ATOM 890 O VAL A 135 -0.896 10.049 -3.555 1.00 1.00 O ATOM 891 CB VAL A 135 0.971 7.734 -5.181 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.162 8.995 -6.025 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.218 7.439 -4.344 1.00 1.00 C ATOM 0 H VAL A 135 -1.295 7.884 -6.120 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.302 6.952 -3.679 1.00 1.00 H new ATOM 0 HB VAL A 135 0.818 6.896 -5.861 1.00 1.00 H new ATOM 0 HG11 VAL A 135 2.050 8.885 -6.647 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.289 9.143 -6.661 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.283 9.857 -5.369 1.00 1.00 H new ATOM 0 HG21 VAL A 135 3.086 7.360 -4.999 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.376 8.246 -3.629 1.00 1.00 H new ATOM 0 HG23 VAL A 135 2.082 6.500 -3.807 1.00 1.00 H new ATOM 903 N LYS A 136 0.611 8.908 -2.313 1.00 1.00 N ATOM 904 CA LYS A 136 0.766 9.967 -1.329 1.00 1.00 C ATOM 905 C LYS A 136 2.190 9.933 -0.772 1.00 1.00 C ATOM 906 O LYS A 136 2.866 10.960 -0.723 1.00 1.00 O ATOM 907 CB LYS A 136 -0.317 9.861 -0.254 1.00 1.00 C ATOM 908 CG LYS A 136 -1.100 11.171 -0.134 1.00 1.00 C ATOM 909 CD LYS A 136 -0.551 12.035 1.004 1.00 1.00 C ATOM 910 CE LYS A 136 -1.515 12.054 2.191 1.00 1.00 C ATOM 911 NZ LYS A 136 -2.204 13.361 2.279 1.00 1.00 N ATOM 0 H LYS A 136 1.177 8.078 -2.139 1.00 1.00 H new ATOM 0 HA LYS A 136 0.627 10.943 -1.794 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -0.999 9.047 -0.499 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.140 9.617 0.705 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.042 11.721 -1.073 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -2.153 10.954 0.044 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.417 11.650 1.323 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -0.388 13.052 0.647 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -2.249 11.256 2.083 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -0.968 11.862 3.114 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -2.736 13.413 3.171 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -1.501 14.127 2.250 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -2.860 13.462 1.478 1.00 1.00 H new ATOM 920 N ALA A 137 2.605 8.742 -0.365 1.00 1.00 N ATOM 921 CA ALA A 137 3.937 8.561 0.186 1.00 1.00 C ATOM 922 C ALA A 137 4.077 7.132 0.713 1.00 1.00 C ATOM 923 O ALA A 137 3.199 6.638 1.418 1.00 1.00 O ATOM 924 CB ALA A 137 4.186 9.610 1.272 1.00 1.00 C ATOM 0 H ALA A 137 2.042 7.893 -0.406 1.00 1.00 H new ATOM 0 HA ALA A 137 4.694 8.703 -0.585 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.185 9.475 1.686 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.104 10.607 0.840 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.446 9.496 2.065 1.00 1.00 H new ATOM 930 N ILE A 138 5.189 6.508 0.350 1.00 1.00 N ATOM 931 CA ILE A 138 5.455 5.144 0.777 1.00 1.00 C ATOM 932 C ILE A 138 6.542 5.154 1.852 1.00 1.00 C ATOM 933 O ILE A 138 7.688 5.511 1.578 1.00 1.00 O ATOM 934 CB ILE A 138 5.787 4.261 -0.428 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.064 4.751 -1.684 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.488 2.791 -0.130 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.946 5.710 -2.486 1.00 1.00 C ATOM 0 H ILE A 138 5.915 6.922 -0.235 1.00 1.00 H new ATOM 0 HA ILE A 138 4.565 4.705 1.228 1.00 1.00 H new ATOM 0 HB ILE A 138 6.857 4.338 -0.623 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.789 3.899 -2.305 1.00 1.00 H new ATOM 0 HG13 ILE A 138 4.138 5.252 -1.403 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.733 2.186 -1.003 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.087 2.463 0.719 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.430 2.676 0.106 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.408 6.043 -3.373 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.199 6.573 -1.870 1.00 1.00 H new ATOM 0 HD13 ILE A 138 6.860 5.198 -2.787 1.00 1.00 H new ATOM 948 N LEU A 139 6.147 4.759 3.053 1.00 1.00 N ATOM 949 CA LEU A 139 7.075 4.718 4.171 1.00 1.00 C ATOM 950 C LEU A 139 7.864 3.408 4.125 1.00 1.00 C ATOM 951 O LEU A 139 9.074 3.401 4.341 1.00 1.00 O ATOM 952 CB LEU A 139 6.334 4.945 5.489 1.00 1.00 C ATOM 953 CG LEU A 139 4.915 5.507 5.374 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.350 5.852 6.753 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.875 6.702 4.422 1.00 1.00 C ATOM 0 H LEU A 139 5.197 4.464 3.277 1.00 1.00 H new ATOM 0 HA LEU A 139 7.800 5.529 4.096 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.285 3.996 6.023 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.924 5.626 6.102 1.00 1.00 H new ATOM 0 HG LEU A 139 4.274 4.735 4.948 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.341 6.249 6.644 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.321 4.954 7.370 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.985 6.599 7.230 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.856 7.082 4.358 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.532 7.487 4.796 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.208 6.390 3.432 1.00 1.00 H new ATOM 966 N VAL A 140 7.145 2.331 3.842 1.00 1.00 N ATOM 967 CA VAL A 140 7.763 1.019 3.766 1.00 1.00 C ATOM 968 C VAL A 140 8.412 0.844 2.391 1.00 1.00 C ATOM 969 O VAL A 140 7.940 1.404 1.403 1.00 1.00 O ATOM 970 CB VAL A 140 6.729 -0.065 4.081 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.630 -0.101 3.017 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.398 -1.434 4.226 1.00 1.00 C ATOM 0 H VAL A 140 6.141 2.341 3.663 1.00 1.00 H new ATOM 0 HA VAL A 140 8.552 0.925 4.512 1.00 1.00 H new ATOM 0 HB VAL A 140 6.263 0.183 5.035 1.00 1.00 H new ATOM 0 HG11 VAL A 140 4.909 -0.880 3.265 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.125 0.864 2.983 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.073 -0.313 2.044 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.642 -2.187 4.450 1.00 1.00 H new ATOM 0 HG22 VAL A 140 7.903 -1.692 3.295 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.126 -1.399 5.036 1.00 1.00 H new ATOM 982 N GLU A 141 9.483 0.064 2.372 1.00 1.00 N ATOM 983 CA GLU A 141 10.201 -0.191 1.135 1.00 1.00 C ATOM 984 C GLU A 141 9.902 -1.603 0.630 1.00 1.00 C ATOM 985 O GLU A 141 9.373 -2.432 1.369 1.00 1.00 O ATOM 986 CB GLU A 141 11.705 0.018 1.322 1.00 1.00 C ATOM 987 CG GLU A 141 12.282 0.879 0.197 1.00 1.00 C ATOM 988 CD GLU A 141 13.023 0.017 -0.828 1.00 1.00 C ATOM 989 OE1 GLU A 141 12.561 -0.121 -1.970 1.00 1.00 O ATOM 990 OE2 GLU A 141 14.117 -0.518 -0.402 1.00 1.00 O ATOM 0 H GLU A 141 9.871 -0.400 3.194 1.00 1.00 H new ATOM 0 HA GLU A 141 9.859 0.522 0.385 1.00 1.00 H new ATOM 0 HB2 GLU A 141 11.893 0.496 2.284 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.210 -0.948 1.342 1.00 1.00 H new ATOM 0 HG2 GLU A 141 11.478 1.426 -0.296 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.963 1.620 0.614 1.00 1.00 H new ATOM 996 N SER A 142 10.253 -1.834 -0.627 1.00 1.00 N ATOM 997 CA SER A 142 10.028 -3.133 -1.240 1.00 1.00 C ATOM 998 C SER A 142 11.014 -4.156 -0.673 1.00 1.00 C ATOM 999 O SER A 142 12.093 -4.358 -1.229 1.00 1.00 O ATOM 1000 CB SER A 142 10.162 -3.053 -2.762 1.00 1.00 C ATOM 1001 OG SER A 142 11.478 -2.683 -3.164 1.00 1.00 O ATOM 0 H SER A 142 10.691 -1.144 -1.237 1.00 1.00 H new ATOM 0 HA SER A 142 9.011 -3.451 -1.008 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.907 -4.018 -3.199 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.447 -2.328 -3.151 1.00 1.00 H new ATOM 0 HG SER A 142 12.134 -3.154 -2.609 1.00 1.00 H new ATOM 1006 N GLY A 143 10.609 -4.776 0.425 1.00 1.00 N ATOM 1007 CA GLY A 143 11.442 -5.773 1.074 1.00 1.00 C ATOM 1008 C GLY A 143 11.629 -5.452 2.557 1.00 1.00 C ATOM 1009 O GLY A 143 12.106 -6.289 3.322 1.00 1.00 O ATOM 0 H GLY A 143 9.713 -4.607 0.882 1.00 1.00 H new ATOM 0 HA2 GLY A 143 10.987 -6.758 0.966 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.414 -5.815 0.582 1.00 1.00 H new ATOM 1013 N GLN A 144 11.244 -4.237 2.920 1.00 1.00 N ATOM 1014 CA GLN A 144 11.363 -3.795 4.299 1.00 1.00 C ATOM 1015 C GLN A 144 10.338 -4.513 5.177 1.00 1.00 C ATOM 1016 O GLN A 144 9.264 -4.884 4.708 1.00 1.00 O ATOM 1017 CB GLN A 144 11.206 -2.276 4.403 1.00 1.00 C ATOM 1018 CG GLN A 144 12.307 -1.668 5.274 1.00 1.00 C ATOM 1019 CD GLN A 144 12.927 -0.442 4.600 1.00 1.00 C ATOM 1020 OE1 GLN A 144 13.768 -0.543 3.723 1.00 1.00 O ATOM 1021 NE2 GLN A 144 12.463 0.717 5.058 1.00 1.00 N ATOM 0 H GLN A 144 10.849 -3.545 2.283 1.00 1.00 H new ATOM 0 HA GLN A 144 12.360 -4.050 4.657 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.240 -1.835 3.407 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.230 -2.036 4.825 1.00 1.00 H new ATOM 0 HG2 GLN A 144 11.895 -1.385 6.242 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.080 -2.413 5.462 1.00 1.00 H new ATOM 0 HE21 GLN A 144 11.758 0.729 5.795 1.00 1.00 H new ATOM 0 HE22 GLN A 144 12.812 1.594 4.672 1.00 1.00 H new ATOM 1028 N PRO A 145 10.715 -4.691 6.472 1.00 1.00 N ATOM 1029 CA PRO A 145 9.841 -5.359 7.421 1.00 1.00 C ATOM 1030 C PRO A 145 8.691 -4.443 7.846 1.00 1.00 C ATOM 1031 O PRO A 145 8.743 -3.234 7.626 1.00 1.00 O ATOM 1032 CB PRO A 145 10.744 -5.754 8.577 1.00 1.00 C ATOM 1033 CG PRO A 145 11.988 -4.891 8.449 1.00 1.00 C ATOM 1034 CD PRO A 145 11.979 -4.265 7.064 1.00 1.00 C ATOM 0 HA PRO A 145 9.352 -6.236 6.997 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.249 -5.586 9.534 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.997 -6.813 8.530 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.997 -4.118 9.217 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.886 -5.492 8.591 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.043 -3.178 7.120 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.828 -4.604 6.471 1.00 1.00 H new ATOM 1039 N VAL A 146 7.682 -5.054 8.449 1.00 1.00 N ATOM 1040 CA VAL A 146 6.522 -4.308 8.907 1.00 1.00 C ATOM 1041 C VAL A 146 6.040 -4.890 10.237 1.00 1.00 C ATOM 1042 O VAL A 146 6.325 -6.043 10.554 1.00 1.00 O ATOM 1043 CB VAL A 146 5.439 -4.309 7.826 1.00 1.00 C ATOM 1044 CG1 VAL A 146 5.975 -3.740 6.511 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.868 -5.714 7.622 1.00 1.00 C ATOM 0 H VAL A 146 7.644 -6.057 8.631 1.00 1.00 H new ATOM 0 HA VAL A 146 6.784 -3.265 9.084 1.00 1.00 H new ATOM 0 HB VAL A 146 4.629 -3.664 8.165 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.185 -3.752 5.760 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.310 -2.715 6.668 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.812 -4.347 6.166 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.101 -5.686 6.849 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.666 -6.390 7.317 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.430 -6.068 8.555 1.00 1.00 H new ATOM 1055 N GLU A 147 5.317 -4.064 10.980 1.00 1.00 N ATOM 1056 CA GLU A 147 4.792 -4.482 12.269 1.00 1.00 C ATOM 1057 C GLU A 147 3.333 -4.044 12.416 1.00 1.00 C ATOM 1058 O GLU A 147 2.879 -3.141 11.714 1.00 1.00 O ATOM 1059 CB GLU A 147 5.647 -3.935 13.412 1.00 1.00 C ATOM 1060 CG GLU A 147 6.269 -5.073 14.225 1.00 1.00 C ATOM 1061 CD GLU A 147 7.252 -4.530 15.264 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.900 -4.409 16.447 1.00 1.00 O ATOM 1063 OE2 GLU A 147 8.420 -4.229 14.805 1.00 1.00 O ATOM 0 H GLU A 147 5.083 -3.108 10.714 1.00 1.00 H new ATOM 0 HA GLU A 147 4.830 -5.570 12.319 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.435 -3.298 13.009 1.00 1.00 H new ATOM 0 HB3 GLU A 147 5.034 -3.311 14.063 1.00 1.00 H new ATOM 0 HG2 GLU A 147 5.483 -5.640 14.724 1.00 1.00 H new ATOM 0 HG3 GLU A 147 6.785 -5.763 13.557 1.00 1.00 H new ATOM 1069 N PHE A 148 2.640 -4.703 13.332 1.00 1.00 N ATOM 1070 CA PHE A 148 1.243 -4.391 13.581 1.00 1.00 C ATOM 1071 C PHE A 148 1.084 -2.966 14.113 1.00 1.00 C ATOM 1072 O PHE A 148 1.795 -2.559 15.031 1.00 1.00 O ATOM 1073 CB PHE A 148 0.747 -5.376 14.642 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.775 -5.425 14.782 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.526 -6.066 13.847 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.380 -4.828 15.845 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.939 -6.110 13.978 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -2.793 -4.872 15.976 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.543 -5.513 15.039 1.00 1.00 C ATOM 0 H PHE A 148 3.020 -5.452 13.911 1.00 1.00 H new ATOM 0 HA PHE A 148 0.675 -4.469 12.654 1.00 1.00 H new ATOM 0 HB2 PHE A 148 1.111 -6.373 14.396 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.182 -5.107 15.605 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -1.047 -6.542 13.004 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -0.785 -4.320 16.590 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.534 -6.618 13.234 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.272 -4.397 16.819 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.618 -5.547 15.138 1.00 1.00 H new ATOM 1088 N ASP A 149 0.148 -2.245 13.512 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.112 -0.873 13.913 1.00 1.00 C ATOM 1090 C ASP A 149 0.859 0.060 13.186 1.00 1.00 C ATOM 1091 O ASP A 149 0.704 1.279 13.230 1.00 1.00 O ATOM 1092 CB ASP A 149 0.095 -0.690 15.418 1.00 1.00 C ATOM 1093 CG ASP A 149 1.443 -0.087 15.817 1.00 1.00 C ATOM 1094 OD1 ASP A 149 2.264 -0.740 16.478 1.00 1.00 O ATOM 1095 OD2 ASP A 149 1.639 1.122 15.416 1.00 1.00 O ATOM 0 H ASP A 149 -0.439 -2.586 12.751 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.146 -0.639 13.660 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.700 -0.052 15.804 1.00 1.00 H new ATOM 0 HB3 ASP A 149 -0.010 -1.660 15.905 1.00 1.00 H new ATOM 1100 N GLU A 150 1.838 -0.550 12.534 1.00 1.00 N ATOM 1101 CA GLU A 150 2.833 0.210 11.798 1.00 1.00 C ATOM 1102 C GLU A 150 2.283 0.624 10.431 1.00 1.00 C ATOM 1103 O GLU A 150 1.525 -0.122 9.812 1.00 1.00 O ATOM 1104 CB GLU A 150 4.131 -0.585 11.648 1.00 1.00 C ATOM 1105 CG GLU A 150 5.350 0.291 11.944 1.00 1.00 C ATOM 1106 CD GLU A 150 6.169 0.536 10.675 1.00 1.00 C ATOM 1107 OE1 GLU A 150 7.396 0.701 10.752 1.00 1.00 O ATOM 1108 OE2 GLU A 150 5.488 0.551 9.580 1.00 1.00 O ATOM 0 H GLU A 150 1.963 -1.562 12.500 1.00 1.00 H new ATOM 0 HA GLU A 150 3.062 1.113 12.364 1.00 1.00 H new ATOM 0 HB2 GLU A 150 4.119 -1.438 12.326 1.00 1.00 H new ATOM 0 HB3 GLU A 150 4.202 -0.983 10.636 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.025 1.244 12.361 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.974 -0.190 12.697 1.00 1.00 H new ATOM 1114 N PRO A 151 2.696 1.843 9.990 1.00 1.00 N ATOM 1115 CA PRO A 151 2.251 2.364 8.709 1.00 1.00 C ATOM 1116 C PRO A 151 2.970 1.664 7.554 1.00 1.00 C ATOM 1117 O PRO A 151 4.066 1.134 7.730 1.00 1.00 O ATOM 1118 CB PRO A 151 2.538 3.856 8.769 1.00 1.00 C ATOM 1119 CG PRO A 151 3.551 4.039 9.888 1.00 1.00 C ATOM 1120 CD PRO A 151 3.591 2.753 10.697 1.00 1.00 C ATOM 0 HA PRO A 151 1.192 2.183 8.526 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.935 4.216 7.820 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.628 4.421 8.969 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.536 4.263 9.478 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.271 4.880 10.522 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.603 2.351 10.752 1.00 1.00 H new ATOM 0 HD3 PRO A 151 3.258 2.919 11.722 1.00 1.00 H new ATOM 1125 N LEU A 152 2.323 1.684 6.397 1.00 1.00 N ATOM 1126 CA LEU A 152 2.888 1.057 5.214 1.00 1.00 C ATOM 1127 C LEU A 152 3.052 2.109 4.114 1.00 1.00 C ATOM 1128 O LEU A 152 4.147 2.627 3.904 1.00 1.00 O ATOM 1129 CB LEU A 152 2.044 -0.146 4.792 1.00 1.00 C ATOM 1130 CG LEU A 152 2.008 -1.319 5.775 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.319 -2.536 5.153 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.413 -1.652 6.281 1.00 1.00 C ATOM 0 H LEU A 152 1.414 2.124 6.254 1.00 1.00 H new ATOM 0 HA LEU A 152 3.881 0.662 5.429 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.022 0.193 4.625 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.419 -0.511 3.836 1.00 1.00 H new ATOM 0 HG LEU A 152 1.415 -1.022 6.640 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.307 -3.355 5.873 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.296 -2.276 4.882 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.863 -2.845 4.260 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.360 -2.489 6.978 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.049 -1.922 5.438 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.832 -0.783 6.788 1.00 1.00 H new ATOM 1143 N VAL A 153 1.945 2.394 3.442 1.00 1.00 N ATOM 1144 CA VAL A 153 1.952 3.374 2.370 1.00 1.00 C ATOM 1145 C VAL A 153 0.806 4.365 2.583 1.00 1.00 C ATOM 1146 O VAL A 153 -0.298 3.971 2.953 1.00 1.00 O ATOM 1147 CB VAL A 153 1.889 2.668 1.014 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.167 3.647 -0.128 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.854 1.482 0.968 1.00 1.00 C ATOM 0 H VAL A 153 1.038 1.963 3.620 1.00 1.00 H new ATOM 0 HA VAL A 153 2.881 3.945 2.380 1.00 1.00 H new ATOM 0 HB VAL A 153 0.878 2.282 0.884 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.116 3.119 -1.080 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.423 4.443 -0.114 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.161 4.077 -0.004 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.789 0.998 -0.006 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.872 1.835 1.131 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.589 0.767 1.747 1.00 1.00 H new ATOM 1159 N VAL A 154 1.108 5.632 2.339 1.00 1.00 N ATOM 1160 CA VAL A 154 0.117 6.682 2.499 1.00 1.00 C ATOM 1161 C VAL A 154 -0.499 7.008 1.137 1.00 1.00 C ATOM 1162 O VAL A 154 0.214 7.349 0.195 1.00 1.00 O ATOM 1163 CB VAL A 154 0.749 7.899 3.176 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.232 9.074 3.217 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.244 7.550 4.580 1.00 1.00 C ATOM 0 H VAL A 154 2.025 5.955 2.032 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.691 6.348 3.150 1.00 1.00 H new ATOM 0 HB VAL A 154 1.612 8.202 2.583 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.242 9.927 3.703 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.515 9.347 2.201 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -1.122 8.786 3.776 1.00 1.00 H new ATOM 0 HG21 VAL A 154 1.689 8.433 5.039 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.405 7.209 5.187 1.00 1.00 H new ATOM 0 HG23 VAL A 154 1.991 6.759 4.516 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.817 6.891 1.076 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.538 7.170 -0.154 1.00 1.00 C ATOM 1177 C ILE A 155 -3.280 8.501 -0.017 1.00 1.00 C ATOM 1178 O ILE A 155 -3.450 9.009 1.090 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.446 5.995 -0.520 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.651 4.874 -1.192 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.623 6.458 -1.382 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.182 3.842 -0.165 1.00 1.00 C ATOM 0 H ILE A 155 -2.405 6.606 1.859 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.842 7.278 -0.986 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.862 5.587 0.401 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.269 4.387 -1.946 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.789 5.295 -1.710 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.253 5.603 -1.628 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.209 7.194 -0.832 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.246 6.907 -2.301 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.620 3.056 -0.669 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.544 4.328 0.574 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -3.047 3.406 0.334 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.700 9.028 -1.157 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.419 10.291 -1.178 1.00 1.00 C ATOM 1195 C GLU A 156 -5.899 10.053 -1.485 1.00 1.00 C ATOM 1196 O GLU A 156 -6.750 10.865 -1.122 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.798 11.258 -2.187 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.348 12.674 -1.999 1.00 1.00 C ATOM 1199 CD GLU A 156 -3.710 13.353 -0.786 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -3.526 12.712 0.260 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -3.400 14.594 -0.956 1.00 1.00 O ATOM 0 H GLU A 156 -3.556 8.604 -2.073 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.341 10.748 -0.192 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.714 11.266 -2.069 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -4.006 10.915 -3.200 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.155 13.265 -2.894 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.430 12.634 -1.871 1.00 1.00 H new