USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 761 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 134 THR OG1 : rot 180:sc= 0.901 USER MOD Set 1.2: A 159 LYS NZ :NH3+ -122:sc= 0.0578 (180deg=0) USER MOD Set 2.1: A 121 SER OG : rot 40:sc= 0.134 USER MOD Set 2.2: A 162 TYR OH : rot 180:sc= -0.844 USER MOD Single : A 93 GLN : amide:sc= 0.0305 X(o=0.031,f=0) USER MOD Single : A 96 LYS NZ :NH3+ -149:sc= -0.142 (180deg=-0.662) USER MOD Single : A 101 GLN : amide:sc= -0.087 X(o=-0.087,f=-0.1) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.433 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -168:sc= -0.0106 (180deg=-0.174) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot -33:sc= 1.22 USER MOD Single : A 127 LYS NZ :NH3+ -105:sc= -0.172 (180deg=-2.01!) USER MOD Single : A 132 MET CE :methyl 165:sc= -0.0126 (180deg=-0.28) USER MOD Single : A 135 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00681) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 158:sc= -0.0105 (180deg=-0.265) USER MOD Single : A 144 SER OG : rot 73:sc= 0.446 USER MOD Single : A 148 TYR OH : rot -60:sc= -2.68! USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 160 SER OG : rot 86:sc= 0.44 USER MOD Single : A 161 HIS : no HD1:sc= -0.524 X(o=-0.52,f=-0.38) USER MOD Single : A 167 TYR OH : rot 180:sc= -2.08 USER MOD Single : A 169 TYR OH : rot 30:sc= -0.398 USER MOD Single : A 173 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.2) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -8.329 10.257 2.584 1.00 0.00 N ATOM 86 CA VAL A 86 -6.904 9.994 2.432 1.00 0.00 C ATOM 87 C VAL A 86 -6.560 9.632 0.992 1.00 0.00 C ATOM 88 O VAL A 86 -5.517 10.031 0.473 1.00 0.00 O ATOM 89 CB VAL A 86 -6.442 8.854 3.360 1.00 0.00 C ATOM 90 CG1 VAL A 86 -6.592 9.255 4.818 1.00 0.00 C ATOM 91 CG2 VAL A 86 -7.220 7.579 3.068 1.00 0.00 C ATOM 0 HA VAL A 86 -6.383 10.911 2.706 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.386 8.661 3.168 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.260 8.436 5.457 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.985 10.139 5.017 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.638 9.478 5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.880 6.785 3.733 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.283 7.757 3.229 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.055 7.281 2.033 1.00 0.00 H new ATOM 101 N ARG A 87 -7.442 8.873 0.351 1.00 0.00 N ATOM 102 CA ARG A 87 -7.231 8.457 -1.031 1.00 0.00 C ATOM 103 C ARG A 87 -7.265 9.656 -1.973 1.00 0.00 C ATOM 104 O ARG A 87 -6.465 9.749 -2.904 1.00 0.00 O ATOM 105 CB ARG A 87 -8.292 7.438 -1.447 1.00 0.00 C ATOM 106 CG ARG A 87 -8.177 6.107 -0.721 1.00 0.00 C ATOM 107 CD ARG A 87 -8.269 4.935 -1.684 1.00 0.00 C ATOM 108 NE ARG A 87 -8.829 3.744 -1.047 1.00 0.00 N ATOM 109 CZ ARG A 87 -10.130 3.560 -0.837 1.00 0.00 C ATOM 110 NH1 ARG A 87 -11.008 4.482 -1.210 1.00 0.00 N ATOM 111 NH2 ARG A 87 -10.555 2.449 -0.252 1.00 0.00 N ATOM 0 H ARG A 87 -8.310 8.533 0.766 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.246 7.994 -1.097 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -9.280 7.859 -1.262 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.216 7.264 -2.520 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -7.229 6.065 -0.185 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.968 6.029 0.025 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.888 5.215 -2.537 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.276 4.706 -2.072 1.00 0.00 H new ATOM 0 HE ARG A 87 -8.185 3.012 -0.746 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.687 5.339 -1.661 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -12.004 4.334 -1.046 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.885 1.736 0.037 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -11.552 2.307 -0.091 1.00 0.00 H new ATOM 125 N LEU A 88 -8.194 10.573 -1.724 1.00 0.00 N ATOM 126 CA LEU A 88 -8.331 11.766 -2.552 1.00 0.00 C ATOM 127 C LEU A 88 -7.118 12.678 -2.397 1.00 0.00 C ATOM 128 O LEU A 88 -6.569 13.170 -3.383 1.00 0.00 O ATOM 129 CB LEU A 88 -9.606 12.525 -2.180 1.00 0.00 C ATOM 130 CG LEU A 88 -10.190 13.397 -3.292 1.00 0.00 C ATOM 131 CD1 LEU A 88 -9.151 14.387 -3.794 1.00 0.00 C ATOM 132 CD2 LEU A 88 -10.700 12.531 -4.435 1.00 0.00 C ATOM 0 H LEU A 88 -8.863 10.513 -0.956 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.394 11.451 -3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.362 11.804 -1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.395 13.157 -1.317 1.00 0.00 H new ATOM 0 HG LEU A 88 -11.031 13.959 -2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -9.584 14.999 -4.585 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -8.832 15.028 -2.972 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -8.290 13.844 -4.185 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -11.112 13.168 -5.218 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -9.877 11.943 -4.841 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -11.477 11.861 -4.066 1.00 0.00 H new ATOM 144 N ASP A 89 -6.707 12.902 -1.153 1.00 0.00 N ATOM 145 CA ASP A 89 -5.564 13.753 -0.867 1.00 0.00 C ATOM 146 C ASP A 89 -4.304 13.229 -1.549 1.00 0.00 C ATOM 147 O ASP A 89 -3.527 13.998 -2.116 1.00 0.00 O ATOM 148 CB ASP A 89 -5.339 13.849 0.643 1.00 0.00 C ATOM 149 CG ASP A 89 -6.501 14.507 1.362 1.00 0.00 C ATOM 150 OD1 ASP A 89 -7.061 15.481 0.817 1.00 0.00 O ATOM 151 OD2 ASP A 89 -6.851 14.047 2.468 1.00 0.00 O ATOM 0 H ASP A 89 -7.152 12.503 -0.326 1.00 0.00 H new ATOM 0 HA ASP A 89 -5.778 14.747 -1.261 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.184 12.849 1.048 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.428 14.416 0.836 1.00 0.00 H new ATOM 156 N PHE A 90 -4.108 11.917 -1.485 1.00 0.00 N ATOM 157 CA PHE A 90 -2.942 11.286 -2.092 1.00 0.00 C ATOM 158 C PHE A 90 -2.922 11.507 -3.602 1.00 0.00 C ATOM 159 O PHE A 90 -1.901 11.894 -4.170 1.00 0.00 O ATOM 160 CB PHE A 90 -2.932 9.787 -1.786 1.00 0.00 C ATOM 161 CG PHE A 90 -1.718 9.074 -2.308 1.00 0.00 C ATOM 162 CD1 PHE A 90 -0.561 8.997 -1.548 1.00 0.00 C ATOM 163 CD2 PHE A 90 -1.732 8.480 -3.560 1.00 0.00 C ATOM 164 CE1 PHE A 90 0.558 8.342 -2.025 1.00 0.00 C ATOM 165 CE2 PHE A 90 -0.615 7.823 -4.043 1.00 0.00 C ATOM 166 CZ PHE A 90 0.531 7.754 -3.275 1.00 0.00 C ATOM 0 H PHE A 90 -4.742 11.269 -1.018 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.050 11.746 -1.666 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.990 9.645 -0.707 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.824 9.331 -2.216 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.534 9.455 -0.570 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.625 8.531 -4.165 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.452 8.290 -1.422 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.639 7.364 -5.020 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.404 7.241 -3.651 1.00 0.00 H new ATOM 176 N LEU A 91 -4.056 11.258 -4.247 1.00 0.00 N ATOM 177 CA LEU A 91 -4.168 11.430 -5.692 1.00 0.00 C ATOM 178 C LEU A 91 -3.881 12.872 -6.093 1.00 0.00 C ATOM 179 O LEU A 91 -3.341 13.131 -7.169 1.00 0.00 O ATOM 180 CB LEU A 91 -5.564 11.023 -6.168 1.00 0.00 C ATOM 181 CG LEU A 91 -5.846 9.519 -6.138 1.00 0.00 C ATOM 182 CD1 LEU A 91 -7.343 9.258 -6.075 1.00 0.00 C ATOM 183 CD2 LEU A 91 -5.236 8.840 -7.355 1.00 0.00 C ATOM 0 H LEU A 91 -4.911 10.936 -3.793 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.428 10.787 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.304 11.528 -5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.703 11.383 -7.187 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.387 9.099 -5.243 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.524 8.183 -6.054 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -7.754 9.713 -5.174 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.825 9.691 -6.952 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.446 7.771 -7.318 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.667 9.263 -8.262 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -4.158 8.998 -7.358 1.00 0.00 H new ATOM 195 N ASP A 92 -4.244 13.808 -5.224 1.00 0.00 N ATOM 196 CA ASP A 92 -4.027 15.225 -5.488 1.00 0.00 C ATOM 197 C ASP A 92 -2.538 15.531 -5.626 1.00 0.00 C ATOM 198 O ASP A 92 -2.122 16.227 -6.552 1.00 0.00 O ATOM 199 CB ASP A 92 -4.632 16.073 -4.367 1.00 0.00 C ATOM 200 CG ASP A 92 -6.025 16.567 -4.705 1.00 0.00 C ATOM 201 OD1 ASP A 92 -6.144 17.464 -5.566 1.00 0.00 O ATOM 202 OD2 ASP A 92 -6.996 16.058 -4.108 1.00 0.00 O ATOM 0 H ASP A 92 -4.691 13.610 -4.329 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.520 15.473 -6.428 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.670 15.485 -3.450 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.984 16.927 -4.171 1.00 0.00 H new ATOM 207 N GLN A 93 -1.741 15.008 -4.701 1.00 0.00 N ATOM 208 CA GLN A 93 -0.300 15.227 -4.720 1.00 0.00 C ATOM 209 C GLN A 93 0.331 14.602 -5.960 1.00 0.00 C ATOM 210 O GLN A 93 1.124 15.240 -6.654 1.00 0.00 O ATOM 211 CB GLN A 93 0.344 14.645 -3.459 1.00 0.00 C ATOM 212 CG GLN A 93 -0.403 14.981 -2.178 1.00 0.00 C ATOM 213 CD GLN A 93 -0.701 16.461 -2.044 1.00 0.00 C ATOM 214 OE1 GLN A 93 0.177 17.303 -2.230 1.00 0.00 O ATOM 215 NE2 GLN A 93 -1.948 16.786 -1.720 1.00 0.00 N ATOM 0 H GLN A 93 -2.069 14.429 -3.928 1.00 0.00 H new ATOM 0 HA GLN A 93 -0.124 16.302 -4.747 1.00 0.00 H new ATOM 0 HB2 GLN A 93 0.404 13.561 -3.560 1.00 0.00 H new ATOM 0 HB3 GLN A 93 1.366 15.015 -3.380 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -1.339 14.423 -2.151 1.00 0.00 H new ATOM 0 HG3 GLN A 93 0.188 14.655 -1.322 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.644 16.055 -1.575 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -2.209 17.767 -1.616 1.00 0.00 H new ATOM 224 N LEU A 94 -0.024 13.351 -6.232 1.00 0.00 N ATOM 225 CA LEU A 94 0.511 12.639 -7.388 1.00 0.00 C ATOM 226 C LEU A 94 -0.002 13.247 -8.690 1.00 0.00 C ATOM 227 O LEU A 94 0.744 13.374 -9.662 1.00 0.00 O ATOM 228 CB LEU A 94 0.133 11.158 -7.320 1.00 0.00 C ATOM 229 CG LEU A 94 1.134 10.205 -7.975 1.00 0.00 C ATOM 230 CD1 LEU A 94 1.202 8.892 -7.209 1.00 0.00 C ATOM 231 CD2 LEU A 94 0.761 9.958 -9.428 1.00 0.00 C ATOM 0 H LEU A 94 -0.679 12.809 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 94 1.597 12.732 -7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.017 10.876 -6.274 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.838 11.024 -7.796 1.00 0.00 H new ATOM 0 HG LEU A 94 2.120 10.669 -7.947 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.919 8.227 -7.690 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.517 9.085 -6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.218 8.422 -7.204 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.484 9.278 -9.879 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.234 9.516 -9.478 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.765 10.903 -9.971 1.00 0.00 H new ATOM 243 N ALA A 95 -1.278 13.620 -8.703 1.00 0.00 N ATOM 244 CA ALA A 95 -1.888 14.212 -9.887 1.00 0.00 C ATOM 245 C ALA A 95 -1.342 15.612 -10.148 1.00 0.00 C ATOM 246 O ALA A 95 -1.159 16.014 -11.297 1.00 0.00 O ATOM 247 CB ALA A 95 -3.401 14.253 -9.735 1.00 0.00 C ATOM 0 H ALA A 95 -1.909 13.523 -7.907 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.636 13.589 -10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -3.844 14.697 -10.626 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.781 13.240 -9.607 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.663 14.851 -8.862 1.00 0.00 H new ATOM 253 N LYS A 96 -1.084 16.352 -9.074 1.00 0.00 N ATOM 254 CA LYS A 96 -0.561 17.709 -9.188 1.00 0.00 C ATOM 255 C LYS A 96 0.918 17.697 -9.566 1.00 0.00 C ATOM 256 O LYS A 96 1.374 18.524 -10.355 1.00 0.00 O ATOM 257 CB LYS A 96 -0.754 18.465 -7.872 1.00 0.00 C ATOM 258 CG LYS A 96 -2.137 19.074 -7.717 1.00 0.00 C ATOM 259 CD LYS A 96 -2.207 20.464 -8.332 1.00 0.00 C ATOM 260 CE LYS A 96 -1.388 21.467 -7.536 1.00 0.00 C ATOM 261 NZ LYS A 96 -1.715 21.425 -6.084 1.00 0.00 N ATOM 0 H LYS A 96 -1.229 16.035 -8.115 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.115 18.217 -9.978 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -0.571 17.784 -7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -0.008 19.257 -7.805 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -2.875 18.428 -8.191 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -2.395 19.130 -6.659 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -1.842 20.428 -9.358 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.245 20.792 -8.374 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -0.327 21.261 -7.675 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -1.570 22.471 -7.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -1.587 22.371 -5.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.702 21.123 -5.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -1.084 20.751 -5.605 1.00 0.00 H new ATOM 275 N PHE A 97 1.662 16.756 -8.994 1.00 0.00 N ATOM 276 CA PHE A 97 3.089 16.642 -9.268 1.00 0.00 C ATOM 277 C PHE A 97 3.344 16.343 -10.742 1.00 0.00 C ATOM 278 O PHE A 97 4.166 16.997 -11.383 1.00 0.00 O ATOM 279 CB PHE A 97 3.710 15.545 -8.402 1.00 0.00 C ATOM 280 CG PHE A 97 5.210 15.595 -8.352 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.966 15.189 -9.439 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.864 16.049 -7.217 1.00 0.00 C ATOM 283 CE1 PHE A 97 7.347 15.235 -9.397 1.00 0.00 C ATOM 284 CE2 PHE A 97 7.243 16.098 -7.170 1.00 0.00 C ATOM 285 CZ PHE A 97 7.986 15.690 -8.260 1.00 0.00 C ATOM 0 H PHE A 97 1.301 16.063 -8.339 1.00 0.00 H new ATOM 0 HA PHE A 97 3.553 17.598 -9.025 1.00 0.00 H new ATOM 0 HB2 PHE A 97 3.318 15.629 -7.388 1.00 0.00 H new ATOM 0 HB3 PHE A 97 3.400 14.573 -8.785 1.00 0.00 H new ATOM 0 HD1 PHE A 97 5.471 14.832 -10.330 1.00 0.00 H new ATOM 0 HD2 PHE A 97 5.289 16.368 -6.360 1.00 0.00 H new ATOM 0 HE1 PHE A 97 7.925 14.916 -10.252 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.741 16.455 -6.281 1.00 0.00 H new ATOM 0 HZ PHE A 97 9.065 15.727 -8.224 1.00 0.00 H new ATOM 295 N TRP A 98 2.637 15.351 -11.272 1.00 0.00 N ATOM 296 CA TRP A 98 2.790 14.968 -12.671 1.00 0.00 C ATOM 297 C TRP A 98 2.314 16.083 -13.597 1.00 0.00 C ATOM 298 O TRP A 98 2.883 16.296 -14.669 1.00 0.00 O ATOM 299 CB TRP A 98 2.015 13.682 -12.960 1.00 0.00 C ATOM 300 CG TRP A 98 2.809 12.441 -12.692 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.622 11.552 -11.673 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.916 11.949 -13.456 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.545 10.538 -11.756 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.351 10.758 -12.842 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.582 12.399 -14.600 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.420 10.014 -13.334 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.642 11.658 -15.087 1.00 0.00 C ATOM 308 CH2 TRP A 98 6.053 10.477 -14.455 1.00 0.00 C ATOM 0 H TRP A 98 1.953 14.798 -10.755 1.00 0.00 H new ATOM 0 HA TRP A 98 3.849 14.793 -12.858 1.00 0.00 H new ATOM 0 HB2 TRP A 98 1.111 13.666 -12.351 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.697 13.684 -14.003 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.860 11.634 -10.912 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.618 9.749 -11.113 1.00 0.00 H new ATOM 0 HE3 TRP A 98 4.274 13.309 -15.094 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.738 9.104 -12.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 6.163 11.995 -15.971 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.886 9.921 -14.861 1.00 0.00 H new ATOM 319 N GLU A 99 1.269 16.789 -13.178 1.00 0.00 N ATOM 320 CA GLU A 99 0.717 17.877 -13.972 1.00 0.00 C ATOM 321 C GLU A 99 1.785 18.915 -14.300 1.00 0.00 C ATOM 322 O GLU A 99 1.892 19.371 -15.438 1.00 0.00 O ATOM 323 CB GLU A 99 -0.443 18.542 -13.227 1.00 0.00 C ATOM 324 CG GLU A 99 -1.789 17.887 -13.491 1.00 0.00 C ATOM 325 CD GLU A 99 -2.876 18.397 -12.564 1.00 0.00 C ATOM 326 OE1 GLU A 99 -2.930 17.938 -11.404 1.00 0.00 O ATOM 327 OE2 GLU A 99 -3.674 19.254 -12.999 1.00 0.00 O ATOM 0 H GLU A 99 0.789 16.626 -12.293 1.00 0.00 H new ATOM 0 HA GLU A 99 0.349 17.456 -14.908 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.239 18.516 -12.157 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.496 19.592 -13.516 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.082 18.071 -14.525 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -1.693 16.808 -13.374 1.00 0.00 H new ATOM 334 N LEU A 100 2.578 19.280 -13.297 1.00 0.00 N ATOM 335 CA LEU A 100 3.641 20.259 -13.485 1.00 0.00 C ATOM 336 C LEU A 100 4.652 19.767 -14.516 1.00 0.00 C ATOM 337 O LEU A 100 5.264 20.561 -15.230 1.00 0.00 O ATOM 338 CB LEU A 100 4.345 20.542 -12.156 1.00 0.00 C ATOM 339 CG LEU A 100 3.431 21.033 -11.034 1.00 0.00 C ATOM 340 CD1 LEU A 100 4.224 21.236 -9.751 1.00 0.00 C ATOM 341 CD2 LEU A 100 2.731 22.321 -11.441 1.00 0.00 C ATOM 0 H LEU A 100 2.504 18.913 -12.348 1.00 0.00 H new ATOM 0 HA LEU A 100 3.192 21.182 -13.852 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.845 19.631 -11.825 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.121 21.288 -12.325 1.00 0.00 H new ATOM 0 HG LEU A 100 2.671 20.273 -10.851 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.557 21.586 -8.963 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.677 20.292 -9.450 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.006 21.976 -9.920 1.00 0.00 H new ATOM 0 HD21 LEU A 100 2.084 22.656 -10.630 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.475 23.089 -11.652 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.131 22.143 -12.333 1.00 0.00 H new ATOM 353 N GLN A 101 4.818 18.450 -14.589 1.00 0.00 N ATOM 354 CA GLN A 101 5.748 17.847 -15.535 1.00 0.00 C ATOM 355 C GLN A 101 5.210 17.941 -16.957 1.00 0.00 C ATOM 356 O GLN A 101 5.953 18.230 -17.896 1.00 0.00 O ATOM 357 CB GLN A 101 5.999 16.383 -15.169 1.00 0.00 C ATOM 358 CG GLN A 101 6.499 16.184 -13.747 1.00 0.00 C ATOM 359 CD GLN A 101 7.697 17.053 -13.421 1.00 0.00 C ATOM 360 OE1 GLN A 101 8.655 17.124 -14.191 1.00 0.00 O ATOM 361 NE2 GLN A 101 7.651 17.721 -12.275 1.00 0.00 N ATOM 0 H GLN A 101 4.320 17.780 -14.003 1.00 0.00 H new ATOM 0 HA GLN A 101 6.689 18.395 -15.484 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.074 15.821 -15.301 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.728 15.964 -15.863 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.693 16.407 -13.048 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.765 15.137 -13.603 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.837 17.634 -11.666 1.00 0.00 H new ATOM 0 HE22 GLN A 101 8.429 18.322 -12.003 1.00 0.00 H new ATOM 370 N GLY A 102 3.913 17.694 -17.109 1.00 0.00 N ATOM 371 CA GLY A 102 3.294 17.753 -18.418 1.00 0.00 C ATOM 372 C GLY A 102 2.250 16.670 -18.624 1.00 0.00 C ATOM 373 O GLY A 102 1.483 16.718 -19.586 1.00 0.00 O ATOM 0 H GLY A 102 3.279 17.454 -16.347 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.829 18.730 -18.551 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.064 17.659 -19.184 1.00 0.00 H new ATOM 377 N SER A 103 2.221 15.688 -17.726 1.00 0.00 N ATOM 378 CA SER A 103 1.266 14.594 -17.820 1.00 0.00 C ATOM 379 C SER A 103 0.071 14.829 -16.899 1.00 0.00 C ATOM 380 O SER A 103 -0.156 15.949 -16.439 1.00 0.00 O ATOM 381 CB SER A 103 1.946 13.268 -17.471 1.00 0.00 C ATOM 382 OG SER A 103 3.211 13.163 -18.100 1.00 0.00 O ATOM 0 H SER A 103 2.850 15.630 -16.925 1.00 0.00 H new ATOM 0 HA SER A 103 0.902 14.549 -18.846 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.066 13.191 -16.390 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.312 12.438 -17.782 1.00 0.00 H new ATOM 0 HG SER A 103 3.626 12.308 -17.860 1.00 0.00 H new ATOM 388 N THR A 104 -0.690 13.772 -16.632 1.00 0.00 N ATOM 389 CA THR A 104 -1.857 13.868 -15.765 1.00 0.00 C ATOM 390 C THR A 104 -2.198 12.512 -15.161 1.00 0.00 C ATOM 391 O THR A 104 -2.290 11.509 -15.870 1.00 0.00 O ATOM 392 CB THR A 104 -3.056 14.409 -16.547 1.00 0.00 C ATOM 393 OG1 THR A 104 -2.640 15.347 -17.522 1.00 0.00 O ATOM 394 CG2 THR A 104 -4.088 15.084 -15.669 1.00 0.00 C ATOM 0 H THR A 104 -0.518 12.838 -17.005 1.00 0.00 H new ATOM 0 HA THR A 104 -1.621 14.557 -14.954 1.00 0.00 H new ATOM 0 HB THR A 104 -3.514 13.536 -17.012 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.422 15.679 -18.011 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.911 15.445 -16.286 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.468 14.369 -14.939 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.629 15.925 -15.149 1.00 0.00 H new ATOM 402 N LEU A 105 -2.385 12.486 -13.845 1.00 0.00 N ATOM 403 CA LEU A 105 -2.716 11.252 -13.145 1.00 0.00 C ATOM 404 C LEU A 105 -4.059 10.704 -13.617 1.00 0.00 C ATOM 405 O LEU A 105 -5.076 11.395 -13.565 1.00 0.00 O ATOM 406 CB LEU A 105 -2.745 11.493 -11.634 1.00 0.00 C ATOM 407 CG LEU A 105 -3.303 10.337 -10.797 1.00 0.00 C ATOM 408 CD1 LEU A 105 -2.579 10.245 -9.463 1.00 0.00 C ATOM 409 CD2 LEU A 105 -4.799 10.511 -10.584 1.00 0.00 C ATOM 0 H LEU A 105 -2.313 13.306 -13.243 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.947 10.514 -13.371 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.731 11.707 -11.297 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.341 12.384 -11.436 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.138 9.406 -11.340 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.989 9.418 -8.883 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.517 10.075 -9.637 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.712 11.176 -8.912 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.180 9.682 -9.988 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.985 11.449 -10.062 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.305 10.526 -11.550 1.00 0.00 H new ATOM 421 N LYS A 106 -4.054 9.460 -14.080 1.00 0.00 N ATOM 422 CA LYS A 106 -5.269 8.815 -14.565 1.00 0.00 C ATOM 423 C LYS A 106 -5.522 7.504 -13.829 1.00 0.00 C ATOM 424 O LYS A 106 -4.619 6.680 -13.682 1.00 0.00 O ATOM 425 CB LYS A 106 -5.171 8.560 -16.070 1.00 0.00 C ATOM 426 CG LYS A 106 -5.823 9.643 -16.916 1.00 0.00 C ATOM 427 CD LYS A 106 -6.225 9.115 -18.286 1.00 0.00 C ATOM 428 CE LYS A 106 -7.731 8.934 -18.394 1.00 0.00 C ATOM 429 NZ LYS A 106 -8.091 7.784 -19.269 1.00 0.00 N ATOM 0 H LYS A 106 -3.219 8.876 -14.130 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.107 9.485 -14.372 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.120 8.477 -16.348 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.638 7.602 -16.299 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -6.703 10.028 -16.401 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -5.133 10.478 -17.035 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -5.884 9.806 -19.057 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.729 8.162 -18.470 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.150 8.779 -17.400 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.179 9.846 -18.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -9.126 7.695 -19.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -7.713 7.943 -20.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.686 6.910 -18.878 1.00 0.00 H new ATOM 443 N ILE A 107 -6.754 7.317 -13.369 1.00 0.00 N ATOM 444 CA ILE A 107 -7.125 6.105 -12.648 1.00 0.00 C ATOM 445 C ILE A 107 -7.893 5.142 -13.550 1.00 0.00 C ATOM 446 O ILE A 107 -9.117 5.227 -13.661 1.00 0.00 O ATOM 447 CB ILE A 107 -7.987 6.425 -11.412 1.00 0.00 C ATOM 448 CG1 ILE A 107 -7.360 7.566 -10.605 1.00 0.00 C ATOM 449 CG2 ILE A 107 -8.156 5.186 -10.548 1.00 0.00 C ATOM 450 CD1 ILE A 107 -8.032 8.903 -10.829 1.00 0.00 C ATOM 0 H ILE A 107 -7.513 7.989 -13.483 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.196 5.636 -12.323 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.973 6.745 -11.749 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.406 7.318 -9.544 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -6.305 7.650 -10.868 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.767 5.429 -9.679 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.644 4.402 -11.127 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.178 4.837 -10.217 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -7.537 9.665 -10.227 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.963 9.173 -11.883 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -9.081 8.836 -10.539 1.00 0.00 H new ATOM 462 N PRO A 108 -7.186 4.209 -14.212 1.00 0.00 N ATOM 463 CA PRO A 108 -7.814 3.231 -15.107 1.00 0.00 C ATOM 464 C PRO A 108 -8.699 2.243 -14.354 1.00 0.00 C ATOM 465 O PRO A 108 -8.683 2.193 -13.123 1.00 0.00 O ATOM 466 CB PRO A 108 -6.624 2.505 -15.742 1.00 0.00 C ATOM 467 CG PRO A 108 -5.508 2.686 -14.772 1.00 0.00 C ATOM 468 CD PRO A 108 -5.723 4.032 -14.142 1.00 0.00 C ATOM 0 HA PRO A 108 -8.472 3.710 -15.832 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -6.843 1.449 -15.901 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -6.375 2.929 -16.715 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.513 1.897 -14.019 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.542 2.640 -15.275 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.363 4.057 -13.113 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -5.196 4.818 -14.683 1.00 0.00 H new ATOM 476 N VAL A 109 -9.471 1.461 -15.100 1.00 0.00 N ATOM 477 CA VAL A 109 -10.364 0.476 -14.503 1.00 0.00 C ATOM 478 C VAL A 109 -9.889 -0.945 -14.791 1.00 0.00 C ATOM 479 O VAL A 109 -9.752 -1.343 -15.948 1.00 0.00 O ATOM 480 CB VAL A 109 -11.806 0.635 -15.022 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.757 -0.262 -14.246 1.00 0.00 C ATOM 482 CG2 VAL A 109 -12.244 2.089 -14.942 1.00 0.00 C ATOM 0 H VAL A 109 -9.496 1.490 -16.119 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.350 0.651 -13.427 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.832 0.329 -16.068 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.770 -0.135 -14.628 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -12.453 -1.302 -14.363 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.731 0.007 -13.190 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.265 2.182 -15.313 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.202 2.425 -13.906 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.580 2.703 -15.550 1.00 0.00 H new ATOM 492 N VAL A 110 -9.636 -1.705 -13.729 1.00 0.00 N ATOM 493 CA VAL A 110 -9.177 -3.082 -13.868 1.00 0.00 C ATOM 494 C VAL A 110 -10.283 -4.068 -13.510 1.00 0.00 C ATOM 495 O VAL A 110 -10.801 -4.055 -12.394 1.00 0.00 O ATOM 496 CB VAL A 110 -7.952 -3.358 -12.979 1.00 0.00 C ATOM 497 CG1 VAL A 110 -7.365 -4.727 -13.287 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.904 -2.269 -13.159 1.00 0.00 C ATOM 0 H VAL A 110 -9.741 -1.390 -12.764 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.896 -3.218 -14.912 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.274 -3.352 -11.938 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.500 -4.904 -12.648 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.116 -5.495 -13.102 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -7.058 -4.765 -14.332 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -6.045 -2.482 -12.522 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.585 -2.240 -14.201 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -7.330 -1.305 -12.883 1.00 0.00 H new ATOM 508 N GLU A 111 -10.641 -4.920 -14.465 1.00 0.00 N ATOM 509 CA GLU A 111 -11.688 -5.912 -14.248 1.00 0.00 C ATOM 510 C GLU A 111 -13.017 -5.236 -13.925 1.00 0.00 C ATOM 511 O GLU A 111 -13.791 -5.728 -13.104 1.00 0.00 O ATOM 512 CB GLU A 111 -11.295 -6.862 -13.116 1.00 0.00 C ATOM 513 CG GLU A 111 -10.472 -8.053 -13.577 1.00 0.00 C ATOM 514 CD GLU A 111 -10.874 -9.342 -12.886 1.00 0.00 C ATOM 515 OE1 GLU A 111 -11.164 -9.299 -11.672 1.00 0.00 O ATOM 516 OE2 GLU A 111 -10.898 -10.394 -13.560 1.00 0.00 O ATOM 0 H GLU A 111 -10.223 -4.944 -15.395 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.807 -6.486 -15.167 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.728 -6.307 -12.368 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -12.199 -7.224 -12.627 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.584 -8.172 -14.655 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.417 -7.857 -13.386 1.00 0.00 H new ATOM 523 N ARG A 112 -13.271 -4.106 -14.575 1.00 0.00 N ATOM 524 CA ARG A 112 -14.507 -3.361 -14.358 1.00 0.00 C ATOM 525 C ARG A 112 -14.609 -2.888 -12.910 1.00 0.00 C ATOM 526 O ARG A 112 -15.706 -2.761 -12.365 1.00 0.00 O ATOM 527 CB ARG A 112 -15.718 -4.224 -14.718 1.00 0.00 C ATOM 528 CG ARG A 112 -16.514 -3.691 -15.898 1.00 0.00 C ATOM 529 CD ARG A 112 -15.651 -3.561 -17.142 1.00 0.00 C ATOM 530 NE ARG A 112 -16.136 -2.516 -18.040 1.00 0.00 N ATOM 531 CZ ARG A 112 -17.160 -2.673 -18.875 1.00 0.00 C ATOM 532 NH1 ARG A 112 -17.810 -3.828 -18.929 1.00 0.00 N ATOM 533 NH2 ARG A 112 -17.536 -1.669 -19.657 1.00 0.00 N ATOM 0 H ARG A 112 -12.639 -3.685 -15.256 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.494 -2.484 -15.005 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.379 -5.235 -14.946 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -16.374 -4.296 -13.850 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -17.351 -4.358 -16.104 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -16.936 -2.719 -15.644 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -14.625 -3.339 -16.849 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.633 -4.514 -17.671 1.00 0.00 H new ATOM 0 HE ARG A 112 -15.662 -1.613 -18.026 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -17.526 -4.602 -18.328 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -18.594 -3.942 -19.571 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -17.040 -0.778 -19.617 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -18.321 -1.788 -20.298 1.00 0.00 H new ATOM 547 N LYS A 113 -13.462 -2.632 -12.293 1.00 0.00 N ATOM 548 CA LYS A 113 -13.423 -2.174 -10.910 1.00 0.00 C ATOM 549 C LYS A 113 -12.275 -1.194 -10.692 1.00 0.00 C ATOM 550 O LYS A 113 -11.250 -1.261 -11.370 1.00 0.00 O ATOM 551 CB LYS A 113 -13.278 -3.366 -9.960 1.00 0.00 C ATOM 552 CG LYS A 113 -13.936 -3.148 -8.607 1.00 0.00 C ATOM 553 CD LYS A 113 -14.465 -4.450 -8.030 1.00 0.00 C ATOM 554 CE LYS A 113 -15.146 -4.230 -6.688 1.00 0.00 C ATOM 555 NZ LYS A 113 -14.197 -3.716 -5.662 1.00 0.00 N ATOM 0 H LYS A 113 -12.546 -2.734 -12.729 1.00 0.00 H new ATOM 0 HA LYS A 113 -14.360 -1.660 -10.698 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -13.713 -4.249 -10.429 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -12.219 -3.574 -9.810 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -13.215 -2.709 -7.917 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -14.754 -2.435 -8.710 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -15.172 -4.898 -8.729 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.644 -5.156 -7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -15.967 -3.524 -6.809 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -15.581 -5.168 -6.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -14.639 -3.771 -4.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -13.331 -4.291 -5.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -13.958 -2.726 -5.875 1.00 0.00 H new ATOM 569 N ILE A 114 -12.453 -0.284 -9.739 1.00 0.00 N ATOM 570 CA ILE A 114 -11.433 0.709 -9.430 1.00 0.00 C ATOM 571 C ILE A 114 -10.275 0.086 -8.658 1.00 0.00 C ATOM 572 O ILE A 114 -10.476 -0.536 -7.615 1.00 0.00 O ATOM 573 CB ILE A 114 -12.015 1.877 -8.609 1.00 0.00 C ATOM 574 CG1 ILE A 114 -13.282 2.415 -9.275 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.981 2.983 -8.453 1.00 0.00 C ATOM 576 CD1 ILE A 114 -14.130 3.269 -8.356 1.00 0.00 C ATOM 0 H ILE A 114 -13.295 -0.215 -9.168 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.066 1.092 -10.382 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.277 1.509 -7.617 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -13.002 3.003 -10.149 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -13.879 1.576 -9.633 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -11.407 3.800 -7.871 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.103 2.591 -7.939 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.691 3.351 -9.437 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -15.012 3.617 -8.894 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -14.440 2.679 -7.494 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -13.549 4.127 -8.018 1.00 0.00 H new ATOM 588 N LEU A 115 -9.064 0.255 -9.179 1.00 0.00 N ATOM 589 CA LEU A 115 -7.874 -0.292 -8.538 1.00 0.00 C ATOM 590 C LEU A 115 -7.370 0.636 -7.437 1.00 0.00 C ATOM 591 O LEU A 115 -7.128 1.819 -7.673 1.00 0.00 O ATOM 592 CB LEU A 115 -6.772 -0.519 -9.574 1.00 0.00 C ATOM 593 CG LEU A 115 -5.447 -1.043 -9.008 1.00 0.00 C ATOM 594 CD1 LEU A 115 -5.067 -2.367 -9.654 1.00 0.00 C ATOM 595 CD2 LEU A 115 -4.340 -0.016 -9.204 1.00 0.00 C ATOM 0 H LEU A 115 -8.881 0.766 -10.043 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.142 -1.247 -8.086 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.136 -1.226 -10.320 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.582 0.421 -10.092 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.577 -1.212 -7.939 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.124 -2.718 -9.236 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.847 -3.104 -9.460 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.958 -2.229 -10.730 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.407 -0.405 -8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.215 0.186 -10.268 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.605 0.907 -8.688 1.00 0.00 H new ATOM 607 N ASP A 116 -7.212 0.089 -6.236 1.00 0.00 N ATOM 608 CA ASP A 116 -6.734 0.868 -5.098 1.00 0.00 C ATOM 609 C ASP A 116 -5.351 1.448 -5.381 1.00 0.00 C ATOM 610 O ASP A 116 -4.607 0.923 -6.209 1.00 0.00 O ATOM 611 CB ASP A 116 -6.688 -0.002 -3.841 1.00 0.00 C ATOM 612 CG ASP A 116 -6.916 0.798 -2.574 1.00 0.00 C ATOM 613 OD1 ASP A 116 -6.202 1.802 -2.371 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.806 0.419 -1.784 1.00 0.00 O ATOM 0 H ASP A 116 -7.408 -0.890 -6.025 1.00 0.00 H new ATOM 0 HA ASP A 116 -7.428 1.692 -4.935 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.445 -0.783 -3.915 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.720 -0.501 -3.783 1.00 0.00 H new ATOM 619 N LEU A 117 -5.015 2.531 -4.688 1.00 0.00 N ATOM 620 CA LEU A 117 -3.720 3.180 -4.868 1.00 0.00 C ATOM 621 C LEU A 117 -2.913 3.159 -3.575 1.00 0.00 C ATOM 622 O LEU A 117 -1.869 2.512 -3.492 1.00 0.00 O ATOM 623 CB LEU A 117 -3.908 4.621 -5.344 1.00 0.00 C ATOM 624 CG LEU A 117 -4.968 4.811 -6.434 1.00 0.00 C ATOM 625 CD1 LEU A 117 -6.176 5.556 -5.885 1.00 0.00 C ATOM 626 CD2 LEU A 117 -4.382 5.552 -7.627 1.00 0.00 C ATOM 0 H LEU A 117 -5.619 2.977 -3.998 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.168 2.624 -5.626 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -4.176 5.239 -4.487 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.954 4.991 -5.718 1.00 0.00 H new ATOM 0 HG LEU A 117 -5.295 3.826 -6.767 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -6.917 5.680 -6.675 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -6.613 4.987 -5.065 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -5.865 6.535 -5.522 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -5.150 5.677 -8.390 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -4.025 6.531 -7.308 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.551 4.979 -8.039 1.00 0.00 H new ATOM 638 N TYR A 118 -3.402 3.874 -2.566 1.00 0.00 N ATOM 639 CA TYR A 118 -2.723 3.939 -1.276 1.00 0.00 C ATOM 640 C TYR A 118 -2.508 2.542 -0.703 1.00 0.00 C ATOM 641 O TYR A 118 -1.396 2.182 -0.314 1.00 0.00 O ATOM 642 CB TYR A 118 -3.533 4.788 -0.294 1.00 0.00 C ATOM 643 CG TYR A 118 -2.697 5.411 0.803 1.00 0.00 C ATOM 644 CD1 TYR A 118 -1.937 4.621 1.656 1.00 0.00 C ATOM 645 CD2 TYR A 118 -2.670 6.788 0.983 1.00 0.00 C ATOM 646 CE1 TYR A 118 -1.174 5.186 2.659 1.00 0.00 C ATOM 647 CE2 TYR A 118 -1.908 7.359 1.983 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.161 6.555 2.819 1.00 0.00 C ATOM 649 OH TYR A 118 -0.402 7.122 3.818 1.00 0.00 O ATOM 0 H TYR A 118 -4.265 4.416 -2.617 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.748 4.402 -1.428 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -4.042 5.579 -0.845 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -4.306 4.167 0.158 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -1.943 3.548 1.533 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -3.254 7.421 0.331 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.590 4.558 3.315 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -1.897 8.431 2.110 1.00 0.00 H new ATOM 0 HH TYR A 118 -0.504 8.096 3.793 1.00 0.00 H new ATOM 659 N ALA A 119 -3.580 1.759 -0.653 1.00 0.00 N ATOM 660 CA ALA A 119 -3.513 0.405 -0.130 1.00 0.00 C ATOM 661 C ALA A 119 -2.545 -0.452 -0.940 1.00 0.00 C ATOM 662 O ALA A 119 -1.824 -1.282 -0.388 1.00 0.00 O ATOM 663 CB ALA A 119 -4.898 -0.225 -0.120 1.00 0.00 C ATOM 0 H ALA A 119 -4.507 2.042 -0.970 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.141 0.456 0.893 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.834 -1.239 0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.563 0.367 0.509 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -5.291 -0.255 -1.136 1.00 0.00 H new ATOM 669 N LEU A 120 -2.538 -0.245 -2.253 1.00 0.00 N ATOM 670 CA LEU A 120 -1.662 -1.000 -3.142 1.00 0.00 C ATOM 671 C LEU A 120 -0.194 -0.738 -2.818 1.00 0.00 C ATOM 672 O LEU A 120 0.640 -1.639 -2.896 1.00 0.00 O ATOM 673 CB LEU A 120 -1.947 -0.639 -4.601 1.00 0.00 C ATOM 674 CG LEU A 120 -1.226 -1.503 -5.636 1.00 0.00 C ATOM 675 CD1 LEU A 120 -1.520 -2.976 -5.400 1.00 0.00 C ATOM 676 CD2 LEU A 120 -1.632 -1.096 -7.045 1.00 0.00 C ATOM 0 H LEU A 120 -3.129 0.439 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.863 -2.061 -2.991 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.021 -0.712 -4.774 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.668 0.402 -4.762 1.00 0.00 H new ATOM 0 HG LEU A 120 -0.153 -1.346 -5.528 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.998 -3.575 -6.146 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.180 -3.260 -4.404 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.593 -3.150 -5.480 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.109 -1.721 -7.769 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.708 -1.224 -7.165 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -1.370 -0.051 -7.212 1.00 0.00 H new ATOM 688 N SER A 121 0.114 0.504 -2.458 1.00 0.00 N ATOM 689 CA SER A 121 1.482 0.887 -2.127 1.00 0.00 C ATOM 690 C SER A 121 1.952 0.195 -0.850 1.00 0.00 C ATOM 691 O SER A 121 3.106 -0.218 -0.745 1.00 0.00 O ATOM 692 CB SER A 121 1.584 2.404 -1.966 1.00 0.00 C ATOM 693 OG SER A 121 2.937 2.823 -1.936 1.00 0.00 O ATOM 0 H SER A 121 -0.565 1.262 -2.388 1.00 0.00 H new ATOM 0 HA SER A 121 2.127 0.570 -2.946 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.066 2.896 -2.789 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.085 2.710 -1.047 1.00 0.00 H new ATOM 0 HG SER A 121 3.452 2.314 -2.597 1.00 0.00 H new ATOM 699 N LYS A 122 1.051 0.077 0.120 1.00 0.00 N ATOM 700 CA LYS A 122 1.376 -0.561 1.391 1.00 0.00 C ATOM 701 C LYS A 122 1.630 -2.053 1.208 1.00 0.00 C ATOM 702 O LYS A 122 2.551 -2.614 1.805 1.00 0.00 O ATOM 703 CB LYS A 122 0.245 -0.345 2.397 1.00 0.00 C ATOM 704 CG LYS A 122 0.151 1.084 2.910 1.00 0.00 C ATOM 705 CD LYS A 122 -0.944 1.233 3.956 1.00 0.00 C ATOM 706 CE LYS A 122 -0.363 1.434 5.348 1.00 0.00 C ATOM 707 NZ LYS A 122 -0.211 0.145 6.078 1.00 0.00 N ATOM 0 H LYS A 122 0.091 0.414 0.050 1.00 0.00 H new ATOM 0 HA LYS A 122 2.288 -0.102 1.773 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.702 -0.618 1.931 1.00 0.00 H new ATOM 0 HB3 LYS A 122 0.389 -1.017 3.243 1.00 0.00 H new ATOM 0 HG2 LYS A 122 1.108 1.381 3.339 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.047 1.758 2.077 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.580 2.081 3.700 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -1.578 0.346 3.950 1.00 0.00 H new ATOM 0 HE2 LYS A 122 0.608 1.923 5.269 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -1.010 2.100 5.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 0.188 0.325 7.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.141 -0.310 6.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 0.427 -0.482 5.547 1.00 0.00 H new ATOM 721 N ILE A 123 0.806 -2.695 0.387 1.00 0.00 N ATOM 722 CA ILE A 123 0.937 -4.122 0.133 1.00 0.00 C ATOM 723 C ILE A 123 2.310 -4.461 -0.441 1.00 0.00 C ATOM 724 O ILE A 123 2.936 -5.441 -0.033 1.00 0.00 O ATOM 725 CB ILE A 123 -0.155 -4.625 -0.833 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.543 -4.268 -0.297 1.00 0.00 C ATOM 727 CG2 ILE A 123 -0.034 -6.128 -1.040 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.565 -4.021 -1.385 1.00 0.00 C ATOM 0 H ILE A 123 0.039 -2.247 -0.114 1.00 0.00 H new ATOM 0 HA ILE A 123 0.819 -4.624 1.094 1.00 0.00 H new ATOM 0 HB ILE A 123 -0.018 -4.134 -1.797 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.895 -5.076 0.344 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.465 -3.377 0.326 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.813 -6.465 -1.724 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.944 -6.360 -1.461 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -0.147 -6.637 -0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.525 -3.773 -0.933 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -2.235 -3.193 -2.013 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.672 -4.918 -1.994 1.00 0.00 H new ATOM 740 N VAL A 124 2.775 -3.652 -1.387 1.00 0.00 N ATOM 741 CA VAL A 124 4.072 -3.878 -2.013 1.00 0.00 C ATOM 742 C VAL A 124 5.191 -3.867 -0.976 1.00 0.00 C ATOM 743 O VAL A 124 6.021 -4.777 -0.936 1.00 0.00 O ATOM 744 CB VAL A 124 4.375 -2.813 -3.085 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.609 -3.198 -3.883 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.176 -2.618 -4.002 1.00 0.00 C ATOM 0 H VAL A 124 2.274 -2.835 -1.736 1.00 0.00 H new ATOM 0 HA VAL A 124 4.026 -4.858 -2.488 1.00 0.00 H new ATOM 0 HB VAL A 124 4.575 -1.866 -2.584 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.808 -2.435 -4.635 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.465 -3.279 -3.213 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.440 -4.156 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.410 -1.862 -4.752 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.940 -3.560 -4.498 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.318 -2.292 -3.414 1.00 0.00 H new ATOM 756 N ALA A 125 5.209 -2.833 -0.141 1.00 0.00 N ATOM 757 CA ALA A 125 6.224 -2.700 0.892 1.00 0.00 C ATOM 758 C ALA A 125 6.240 -3.913 1.816 1.00 0.00 C ATOM 759 O ALA A 125 7.299 -4.460 2.122 1.00 0.00 O ATOM 760 CB ALA A 125 5.996 -1.427 1.693 1.00 0.00 C ATOM 0 H ALA A 125 4.528 -2.074 -0.162 1.00 0.00 H new ATOM 0 HA ALA A 125 7.196 -2.642 0.402 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.763 -1.339 2.463 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.049 -0.565 1.028 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.013 -1.464 2.162 1.00 0.00 H new ATOM 766 N SER A 126 5.057 -4.324 2.263 1.00 0.00 N ATOM 767 CA SER A 126 4.927 -5.465 3.156 1.00 0.00 C ATOM 768 C SER A 126 5.545 -6.724 2.552 1.00 0.00 C ATOM 769 O SER A 126 5.878 -7.667 3.270 1.00 0.00 O ATOM 770 CB SER A 126 3.452 -5.716 3.482 1.00 0.00 C ATOM 771 OG SER A 126 2.791 -6.347 2.400 1.00 0.00 O ATOM 0 H SER A 126 4.172 -3.880 2.018 1.00 0.00 H new ATOM 0 HA SER A 126 5.467 -5.230 4.073 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.374 -6.339 4.373 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.961 -4.770 3.711 1.00 0.00 H new ATOM 0 HG SER A 126 3.174 -6.033 1.554 1.00 0.00 H new ATOM 777 N LYS A 127 5.695 -6.738 1.230 1.00 0.00 N ATOM 778 CA LYS A 127 6.270 -7.886 0.541 1.00 0.00 C ATOM 779 C LYS A 127 7.789 -7.766 0.460 1.00 0.00 C ATOM 780 O LYS A 127 8.511 -8.746 0.638 1.00 0.00 O ATOM 781 CB LYS A 127 5.681 -8.013 -0.864 1.00 0.00 C ATOM 782 CG LYS A 127 4.180 -8.249 -0.875 1.00 0.00 C ATOM 783 CD LYS A 127 3.835 -9.665 -0.443 1.00 0.00 C ATOM 784 CE LYS A 127 2.357 -9.963 -0.631 1.00 0.00 C ATOM 785 NZ LYS A 127 2.112 -11.401 -0.933 1.00 0.00 N ATOM 0 H LYS A 127 5.426 -5.968 0.617 1.00 0.00 H new ATOM 0 HA LYS A 127 6.024 -8.781 1.112 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.902 -7.105 -1.425 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.174 -8.836 -1.382 1.00 0.00 H new ATOM 0 HG2 LYS A 127 3.694 -7.536 -0.209 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.790 -8.068 -1.876 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.426 -10.376 -1.020 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.104 -9.802 0.604 1.00 0.00 H new ATOM 0 HE2 LYS A 127 1.813 -9.684 0.272 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.964 -9.350 -1.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.887 -11.510 -1.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.964 -11.953 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 1.314 -11.745 -0.361 1.00 0.00 H new ATOM 799 N GLY A 128 8.264 -6.554 0.191 1.00 0.00 N ATOM 800 CA GLY A 128 9.692 -6.326 0.090 1.00 0.00 C ATOM 801 C GLY A 128 10.028 -5.120 -0.765 1.00 0.00 C ATOM 802 O GLY A 128 10.951 -5.164 -1.578 1.00 0.00 O ATOM 0 H GLY A 128 7.686 -5.727 0.041 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.106 -6.186 1.089 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.169 -7.211 -0.332 1.00 0.00 H new ATOM 806 N GLY A 129 9.276 -4.040 -0.580 1.00 0.00 N ATOM 807 CA GLY A 129 9.513 -2.832 -1.346 1.00 0.00 C ATOM 808 C GLY A 129 8.858 -2.871 -2.713 1.00 0.00 C ATOM 809 O GLY A 129 7.943 -2.097 -2.991 1.00 0.00 O ATOM 0 H GLY A 129 8.507 -3.980 0.087 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.135 -1.974 -0.790 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.587 -2.687 -1.466 1.00 0.00 H new ATOM 813 N PHE A 130 9.328 -3.775 -3.568 1.00 0.00 N ATOM 814 CA PHE A 130 8.782 -3.912 -4.915 1.00 0.00 C ATOM 815 C PHE A 130 9.493 -5.026 -5.680 1.00 0.00 C ATOM 816 O PHE A 130 8.861 -5.972 -6.148 1.00 0.00 O ATOM 817 CB PHE A 130 8.909 -2.593 -5.680 1.00 0.00 C ATOM 818 CG PHE A 130 8.364 -2.654 -7.079 1.00 0.00 C ATOM 819 CD1 PHE A 130 6.998 -2.571 -7.308 1.00 0.00 C ATOM 820 CD2 PHE A 130 9.214 -2.793 -8.163 1.00 0.00 C ATOM 821 CE1 PHE A 130 6.494 -2.628 -8.593 1.00 0.00 C ATOM 822 CE2 PHE A 130 8.716 -2.851 -9.451 1.00 0.00 C ATOM 823 CZ PHE A 130 7.353 -2.768 -9.666 1.00 0.00 C ATOM 0 H PHE A 130 10.085 -4.423 -3.352 1.00 0.00 H new ATOM 0 HA PHE A 130 7.727 -4.171 -4.825 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.386 -1.811 -5.129 1.00 0.00 H new ATOM 0 HB3 PHE A 130 9.960 -2.306 -5.721 1.00 0.00 H new ATOM 0 HD1 PHE A 130 6.322 -2.461 -6.473 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.280 -2.857 -8.000 1.00 0.00 H new ATOM 0 HE1 PHE A 130 5.429 -2.563 -8.759 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.390 -2.961 -10.288 1.00 0.00 H new ATOM 0 HZ PHE A 130 6.960 -2.813 -10.671 1.00 0.00 H new ATOM 833 N GLU A 131 10.810 -4.901 -5.806 1.00 0.00 N ATOM 834 CA GLU A 131 11.610 -5.893 -6.519 1.00 0.00 C ATOM 835 C GLU A 131 11.422 -7.282 -5.917 1.00 0.00 C ATOM 836 O GLU A 131 11.502 -8.290 -6.619 1.00 0.00 O ATOM 837 CB GLU A 131 13.089 -5.505 -6.485 1.00 0.00 C ATOM 838 CG GLU A 131 13.477 -4.491 -7.549 1.00 0.00 C ATOM 839 CD GLU A 131 14.242 -5.117 -8.700 1.00 0.00 C ATOM 840 OE1 GLU A 131 15.435 -5.435 -8.516 1.00 0.00 O ATOM 841 OE2 GLU A 131 13.648 -5.288 -9.785 1.00 0.00 O ATOM 0 H GLU A 131 11.347 -4.123 -5.424 1.00 0.00 H new ATOM 0 HA GLU A 131 11.271 -5.919 -7.555 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.326 -5.097 -5.503 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.694 -6.402 -6.612 1.00 0.00 H new ATOM 0 HG2 GLU A 131 12.577 -4.011 -7.934 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.086 -3.709 -7.096 1.00 0.00 H new ATOM 848 N MET A 132 11.174 -7.328 -4.612 1.00 0.00 N ATOM 849 CA MET A 132 10.976 -8.594 -3.918 1.00 0.00 C ATOM 850 C MET A 132 9.699 -9.280 -4.394 1.00 0.00 C ATOM 851 O MET A 132 9.646 -10.505 -4.509 1.00 0.00 O ATOM 852 CB MET A 132 10.911 -8.366 -2.407 1.00 0.00 C ATOM 853 CG MET A 132 11.224 -9.611 -1.591 1.00 0.00 C ATOM 854 SD MET A 132 12.951 -10.113 -1.724 1.00 0.00 S ATOM 855 CE MET A 132 13.752 -8.827 -0.768 1.00 0.00 C ATOM 0 H MET A 132 11.106 -6.504 -4.015 1.00 0.00 H new ATOM 0 HA MET A 132 11.823 -9.241 -4.145 1.00 0.00 H new ATOM 0 HB2 MET A 132 11.613 -7.578 -2.136 1.00 0.00 H new ATOM 0 HB3 MET A 132 9.915 -8.010 -2.144 1.00 0.00 H new ATOM 0 HG2 MET A 132 10.983 -9.425 -0.544 1.00 0.00 H new ATOM 0 HG3 MET A 132 10.585 -10.429 -1.924 1.00 0.00 H new ATOM 0 HE1 MET A 132 14.771 -9.132 -0.530 1.00 0.00 H new ATOM 0 HE2 MET A 132 13.775 -7.904 -1.347 1.00 0.00 H new ATOM 0 HE3 MET A 132 13.198 -8.662 0.156 1.00 0.00 H new ATOM 865 N VAL A 133 8.673 -8.482 -4.667 1.00 0.00 N ATOM 866 CA VAL A 133 7.395 -9.010 -5.132 1.00 0.00 C ATOM 867 C VAL A 133 7.526 -9.624 -6.521 1.00 0.00 C ATOM 868 O VAL A 133 6.963 -10.683 -6.798 1.00 0.00 O ATOM 869 CB VAL A 133 6.314 -7.914 -5.169 1.00 0.00 C ATOM 870 CG1 VAL A 133 4.945 -8.522 -5.435 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.311 -7.122 -3.870 1.00 0.00 C ATOM 0 H VAL A 133 8.701 -7.467 -4.574 1.00 0.00 H new ATOM 0 HA VAL A 133 7.096 -9.782 -4.423 1.00 0.00 H new ATOM 0 HB VAL A 133 6.546 -7.229 -5.984 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.194 -7.732 -5.458 1.00 0.00 H new ATOM 0 HG12 VAL A 133 4.957 -9.039 -6.395 1.00 0.00 H new ATOM 0 HG13 VAL A 133 4.702 -9.231 -4.644 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.541 -6.352 -3.915 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.106 -7.793 -3.036 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.285 -6.653 -3.728 1.00 0.00 H new ATOM 881 N THR A 134 8.269 -8.951 -7.393 1.00 0.00 N ATOM 882 CA THR A 134 8.473 -9.430 -8.756 1.00 0.00 C ATOM 883 C THR A 134 9.348 -10.678 -8.771 1.00 0.00 C ATOM 884 O THR A 134 9.057 -11.644 -9.476 1.00 0.00 O ATOM 885 CB THR A 134 9.110 -8.334 -9.612 1.00 0.00 C ATOM 886 OG1 THR A 134 8.495 -7.082 -9.364 1.00 0.00 O ATOM 887 CG2 THR A 134 9.015 -8.607 -11.098 1.00 0.00 C ATOM 0 H THR A 134 8.740 -8.072 -7.180 1.00 0.00 H new ATOM 0 HA THR A 134 7.500 -9.689 -9.173 1.00 0.00 H new ATOM 0 HB THR A 134 10.162 -8.319 -9.328 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.917 -6.394 -9.920 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.485 -7.792 -11.648 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.524 -9.543 -11.329 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.967 -8.683 -11.388 1.00 0.00 H new ATOM 895 N LYS A 135 10.427 -10.649 -7.994 1.00 0.00 N ATOM 896 CA LYS A 135 11.346 -11.772 -7.921 1.00 0.00 C ATOM 897 C LYS A 135 10.645 -13.020 -7.393 1.00 0.00 C ATOM 898 O LYS A 135 10.912 -14.132 -7.846 1.00 0.00 O ATOM 899 CB LYS A 135 12.537 -11.425 -7.026 1.00 0.00 C ATOM 900 CG LYS A 135 13.572 -10.543 -7.706 1.00 0.00 C ATOM 901 CD LYS A 135 14.559 -11.367 -8.516 1.00 0.00 C ATOM 902 CE LYS A 135 15.086 -10.588 -9.710 1.00 0.00 C ATOM 903 NZ LYS A 135 15.876 -9.397 -9.294 1.00 0.00 N ATOM 0 H LYS A 135 10.684 -9.856 -7.406 1.00 0.00 H new ATOM 0 HA LYS A 135 11.705 -11.980 -8.929 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.173 -10.920 -6.131 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.016 -12.348 -6.699 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.070 -9.829 -8.359 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.109 -9.965 -6.954 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.392 -11.668 -7.880 1.00 0.00 H new ATOM 0 HD3 LYS A 135 14.075 -12.281 -8.861 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.709 -11.240 -10.322 1.00 0.00 H new ATOM 0 HE3 LYS A 135 14.250 -10.269 -10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.259 -8.923 -10.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.262 -8.737 -8.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 16.659 -9.697 -8.680 1.00 0.00 H new ATOM 917 N GLU A 136 9.748 -12.823 -6.432 1.00 0.00 N ATOM 918 CA GLU A 136 9.007 -13.933 -5.841 1.00 0.00 C ATOM 919 C GLU A 136 7.675 -14.154 -6.556 1.00 0.00 C ATOM 920 O GLU A 136 7.022 -15.179 -6.361 1.00 0.00 O ATOM 921 CB GLU A 136 8.764 -13.673 -4.355 1.00 0.00 C ATOM 922 CG GLU A 136 9.967 -13.981 -3.478 1.00 0.00 C ATOM 923 CD GLU A 136 9.895 -15.361 -2.853 1.00 0.00 C ATOM 924 OE1 GLU A 136 10.073 -16.356 -3.589 1.00 0.00 O ATOM 925 OE2 GLU A 136 9.661 -15.447 -1.630 1.00 0.00 O ATOM 0 H GLU A 136 9.517 -11.908 -6.046 1.00 0.00 H new ATOM 0 HA GLU A 136 9.608 -14.835 -5.955 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.484 -12.629 -4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.919 -14.276 -4.023 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.876 -13.903 -4.074 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.038 -13.232 -2.689 1.00 0.00 H new ATOM 932 N LYS A 137 7.275 -13.191 -7.383 1.00 0.00 N ATOM 933 CA LYS A 137 6.019 -13.289 -8.122 1.00 0.00 C ATOM 934 C LYS A 137 4.827 -13.266 -7.170 1.00 0.00 C ATOM 935 O LYS A 137 3.825 -13.944 -7.399 1.00 0.00 O ATOM 936 CB LYS A 137 5.993 -14.565 -8.963 1.00 0.00 C ATOM 937 CG LYS A 137 5.297 -14.395 -10.304 1.00 0.00 C ATOM 938 CD LYS A 137 4.818 -15.728 -10.857 1.00 0.00 C ATOM 939 CE LYS A 137 3.484 -15.590 -11.573 1.00 0.00 C ATOM 940 NZ LYS A 137 2.918 -16.912 -11.954 1.00 0.00 N ATOM 0 H LYS A 137 7.802 -12.335 -7.558 1.00 0.00 H new ATOM 0 HA LYS A 137 5.948 -12.427 -8.786 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.017 -14.899 -9.134 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.491 -15.352 -8.400 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.448 -13.721 -10.191 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.981 -13.930 -11.014 1.00 0.00 H new ATOM 0 HD2 LYS A 137 5.563 -16.125 -11.547 1.00 0.00 H new ATOM 0 HD3 LYS A 137 4.722 -16.447 -10.043 1.00 0.00 H new ATOM 0 HE2 LYS A 137 2.779 -15.066 -10.928 1.00 0.00 H new ATOM 0 HE3 LYS A 137 3.613 -14.980 -12.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.009 -16.773 -12.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 3.579 -17.402 -12.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 2.770 -17.486 -11.099 1.00 0.00 H new ATOM 954 N LYS A 138 4.942 -12.479 -6.105 1.00 0.00 N ATOM 955 CA LYS A 138 3.873 -12.367 -5.119 1.00 0.00 C ATOM 956 C LYS A 138 2.792 -11.386 -5.576 1.00 0.00 C ATOM 957 O LYS A 138 1.799 -11.181 -4.880 1.00 0.00 O ATOM 958 CB LYS A 138 4.443 -11.920 -3.772 1.00 0.00 C ATOM 959 CG LYS A 138 5.304 -12.973 -3.095 1.00 0.00 C ATOM 960 CD LYS A 138 4.552 -13.676 -1.976 1.00 0.00 C ATOM 961 CE LYS A 138 4.893 -15.156 -1.916 1.00 0.00 C ATOM 962 NZ LYS A 138 5.046 -15.637 -0.515 1.00 0.00 N ATOM 0 H LYS A 138 5.764 -11.910 -5.903 1.00 0.00 H new ATOM 0 HA LYS A 138 3.415 -13.350 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS A 138 5.037 -11.018 -3.920 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.620 -11.655 -3.109 1.00 0.00 H new ATOM 0 HG2 LYS A 138 5.629 -13.707 -3.832 1.00 0.00 H new ATOM 0 HG3 LYS A 138 6.203 -12.505 -2.693 1.00 0.00 H new ATOM 0 HD2 LYS A 138 4.796 -13.207 -1.023 1.00 0.00 H new ATOM 0 HD3 LYS A 138 3.479 -13.555 -2.126 1.00 0.00 H new ATOM 0 HE2 LYS A 138 4.110 -15.729 -2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 138 5.817 -15.338 -2.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 5.278 -16.651 -0.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 5.811 -15.109 -0.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 4.156 -15.488 0.002 1.00 0.00 H new ATOM 976 N TRP A 139 2.988 -10.783 -6.747 1.00 0.00 N ATOM 977 CA TRP A 139 2.025 -9.829 -7.283 1.00 0.00 C ATOM 978 C TRP A 139 0.653 -10.473 -7.448 1.00 0.00 C ATOM 979 O TRP A 139 -0.376 -9.824 -7.258 1.00 0.00 O ATOM 980 CB TRP A 139 2.511 -9.285 -8.628 1.00 0.00 C ATOM 981 CG TRP A 139 3.695 -8.376 -8.508 1.00 0.00 C ATOM 982 CD1 TRP A 139 4.962 -8.616 -8.956 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.723 -7.081 -7.898 1.00 0.00 C ATOM 984 NE1 TRP A 139 5.776 -7.549 -8.664 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.040 -6.595 -8.013 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.764 -6.284 -7.265 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.419 -5.349 -7.521 1.00 0.00 C ATOM 988 CZ3 TRP A 139 3.142 -5.048 -6.776 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.460 -4.590 -6.906 1.00 0.00 C ATOM 0 H TRP A 139 3.803 -10.939 -7.340 1.00 0.00 H new ATOM 0 HA TRP A 139 1.935 -9.005 -6.575 1.00 0.00 H new ATOM 0 HB2 TRP A 139 2.768 -10.121 -9.278 1.00 0.00 H new ATOM 0 HB3 TRP A 139 1.695 -8.746 -9.110 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.278 -9.514 -9.466 1.00 0.00 H new ATOM 0 HE1 TRP A 139 6.767 -7.479 -8.894 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.746 -6.628 -7.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.434 -4.994 -7.621 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.409 -4.424 -6.285 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.724 -3.619 -6.513 1.00 0.00 H new ATOM 1000 N SER A 140 0.646 -11.755 -7.801 1.00 0.00 N ATOM 1001 CA SER A 140 -0.601 -12.487 -7.990 1.00 0.00 C ATOM 1002 C SER A 140 -1.416 -12.514 -6.701 1.00 0.00 C ATOM 1003 O SER A 140 -2.646 -12.456 -6.731 1.00 0.00 O ATOM 1004 CB SER A 140 -0.312 -13.916 -8.454 1.00 0.00 C ATOM 1005 OG SER A 140 0.353 -13.921 -9.704 1.00 0.00 O ATOM 0 H SER A 140 1.488 -12.307 -7.962 1.00 0.00 H new ATOM 0 HA SER A 140 -1.182 -11.974 -8.756 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.300 -14.426 -7.711 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.246 -14.472 -8.533 1.00 0.00 H new ATOM 0 HG SER A 140 0.528 -14.846 -9.978 1.00 0.00 H new ATOM 1011 N LYS A 141 -0.723 -12.599 -5.570 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.382 -12.631 -4.270 1.00 0.00 C ATOM 1013 C LYS A 141 -1.957 -11.263 -3.919 1.00 0.00 C ATOM 1014 O LYS A 141 -3.003 -11.165 -3.277 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.397 -13.075 -3.187 1.00 0.00 C ATOM 1016 CG LYS A 141 0.226 -14.437 -3.454 1.00 0.00 C ATOM 1017 CD LYS A 141 -0.662 -15.566 -2.953 1.00 0.00 C ATOM 1018 CE LYS A 141 -0.692 -16.728 -3.932 1.00 0.00 C ATOM 1019 NZ LYS A 141 0.678 -17.170 -4.312 1.00 0.00 N ATOM 0 H LYS A 141 0.295 -12.647 -5.528 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.201 -13.348 -4.323 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.396 -12.332 -3.102 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.913 -13.102 -2.227 1.00 0.00 H new ATOM 0 HG2 LYS A 141 0.398 -14.556 -4.524 1.00 0.00 H new ATOM 0 HG3 LYS A 141 1.199 -14.495 -2.966 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.299 -15.913 -1.986 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -1.674 -15.193 -2.799 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -1.233 -17.563 -3.487 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -1.240 -16.434 -4.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 0.643 -18.150 -4.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 1.047 -16.551 -5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 1.302 -17.118 -3.482 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.270 -10.209 -4.346 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.712 -8.847 -4.077 1.00 0.00 C ATOM 1035 C VAL A 142 -3.096 -8.595 -4.667 1.00 0.00 C ATOM 1036 O VAL A 142 -3.977 -8.053 -3.998 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.727 -7.812 -4.650 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -1.100 -6.408 -4.194 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.699 -8.151 -4.243 1.00 0.00 C ATOM 0 H VAL A 142 -0.404 -10.273 -4.881 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.753 -8.735 -2.994 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.788 -7.843 -5.738 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.392 -5.691 -4.609 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.105 -6.168 -4.540 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.070 -6.359 -3.106 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.382 -7.409 -4.657 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.777 -8.150 -3.156 1.00 0.00 H new ATOM 0 HG23 VAL A 142 0.961 -9.138 -4.624 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.282 -8.991 -5.922 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.560 -8.799 -6.579 1.00 0.00 C ATOM 1051 C GLY A 143 -5.674 -9.590 -5.921 1.00 0.00 C ATOM 1052 O GLY A 143 -6.799 -9.105 -5.795 1.00 0.00 O ATOM 0 H GLY A 143 -2.569 -9.442 -6.496 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.815 -7.739 -6.568 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.476 -9.096 -7.624 1.00 0.00 H new ATOM 1056 N SER A 144 -5.360 -10.812 -5.499 1.00 0.00 N ATOM 1057 CA SER A 144 -6.341 -11.671 -4.849 1.00 0.00 C ATOM 1058 C SER A 144 -6.889 -11.016 -3.586 1.00 0.00 C ATOM 1059 O SER A 144 -8.085 -11.093 -3.302 1.00 0.00 O ATOM 1060 CB SER A 144 -5.717 -13.025 -4.505 1.00 0.00 C ATOM 1061 OG SER A 144 -5.185 -13.650 -5.660 1.00 0.00 O ATOM 0 H SER A 144 -4.434 -11.228 -5.596 1.00 0.00 H new ATOM 0 HA SER A 144 -7.167 -11.825 -5.544 1.00 0.00 H new ATOM 0 HB2 SER A 144 -4.928 -12.888 -3.766 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.469 -13.671 -4.052 1.00 0.00 H new ATOM 0 HG SER A 144 -4.363 -13.190 -5.932 1.00 0.00 H new ATOM 1067 N ARG A 145 -6.007 -10.372 -2.830 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.401 -9.703 -1.596 1.00 0.00 C ATOM 1069 C ARG A 145 -7.389 -8.575 -1.880 1.00 0.00 C ATOM 1070 O ARG A 145 -8.251 -8.270 -1.056 1.00 0.00 O ATOM 1071 CB ARG A 145 -5.171 -9.149 -0.874 1.00 0.00 C ATOM 1072 CG ARG A 145 -4.566 -10.118 0.127 1.00 0.00 C ATOM 1073 CD ARG A 145 -3.086 -9.845 0.343 1.00 0.00 C ATOM 1074 NE ARG A 145 -2.568 -10.535 1.521 1.00 0.00 N ATOM 1075 CZ ARG A 145 -2.374 -11.851 1.585 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -2.651 -12.621 0.540 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -1.901 -12.397 2.696 1.00 0.00 N ATOM 0 H ARG A 145 -5.014 -10.299 -3.050 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.889 -10.437 -0.955 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.415 -8.884 -1.613 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.447 -8.230 -0.357 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -5.094 -10.038 1.077 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -4.701 -11.140 -0.227 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -2.527 -10.162 -0.537 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -2.928 -8.772 0.453 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.341 -9.976 2.344 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -3.014 -12.205 -0.318 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -2.500 -13.628 0.595 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -1.686 -11.809 3.501 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.752 -13.405 2.746 1.00 0.00 H new ATOM 1091 N LEU A 146 -7.256 -7.960 -3.051 1.00 0.00 N ATOM 1092 CA LEU A 146 -8.138 -6.867 -3.443 1.00 0.00 C ATOM 1093 C LEU A 146 -9.475 -7.399 -3.948 1.00 0.00 C ATOM 1094 O LEU A 146 -10.534 -7.028 -3.442 1.00 0.00 O ATOM 1095 CB LEU A 146 -7.474 -6.012 -4.525 1.00 0.00 C ATOM 1096 CG LEU A 146 -6.580 -4.887 -4.002 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.548 -4.496 -5.048 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -7.420 -3.683 -3.602 1.00 0.00 C ATOM 0 H LEU A 146 -6.547 -8.200 -3.744 1.00 0.00 H new ATOM 0 HA LEU A 146 -8.323 -6.250 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.877 -6.662 -5.165 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -8.253 -5.576 -5.151 1.00 0.00 H new ATOM 0 HG LEU A 146 -6.053 -5.247 -3.119 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -4.921 -3.694 -4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -4.927 -5.359 -5.287 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.056 -4.154 -5.950 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -6.768 -2.891 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.974 -3.322 -4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -8.120 -3.972 -2.819 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.418 -8.271 -4.950 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.632 -8.839 -5.506 1.00 0.00 C ATOM 1112 C GLY A 147 -10.440 -9.343 -6.924 1.00 0.00 C ATOM 1113 O GLY A 147 -11.213 -9.006 -7.821 1.00 0.00 O ATOM 0 H GLY A 147 -8.554 -8.594 -5.386 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -10.968 -9.661 -4.874 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.420 -8.086 -5.495 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.406 -10.151 -7.126 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.111 -10.703 -8.444 1.00 0.00 C ATOM 1119 C TYR A 148 -9.333 -12.211 -8.466 1.00 0.00 C ATOM 1120 O TYR A 148 -9.102 -12.896 -7.469 1.00 0.00 O ATOM 1121 CB TYR A 148 -7.670 -10.382 -8.842 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.446 -8.928 -9.192 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -7.753 -7.921 -8.285 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -6.928 -8.562 -10.428 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -7.551 -6.592 -8.600 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.722 -7.234 -10.751 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.036 -6.253 -9.834 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.832 -4.930 -10.150 1.00 0.00 O ATOM 0 H TYR A 148 -8.757 -10.439 -6.394 1.00 0.00 H new ATOM 0 HA TYR A 148 -9.791 -10.245 -9.162 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -7.006 -10.656 -8.022 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -7.392 -10.999 -9.696 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -8.156 -8.182 -7.318 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.682 -9.328 -11.149 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -7.795 -5.821 -7.884 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.317 -6.966 -11.716 1.00 0.00 H new ATOM 0 HH TYR A 148 -7.685 -4.448 -10.108 1.00 0.00 H new ATOM 1138 N LEU A 149 -9.783 -12.722 -9.607 1.00 0.00 N ATOM 1139 CA LEU A 149 -10.036 -14.149 -9.757 1.00 0.00 C ATOM 1140 C LEU A 149 -8.996 -14.794 -10.674 1.00 0.00 C ATOM 1141 O LEU A 149 -8.635 -14.227 -11.706 1.00 0.00 O ATOM 1142 CB LEU A 149 -11.441 -14.383 -10.318 1.00 0.00 C ATOM 1143 CG LEU A 149 -12.529 -13.483 -9.730 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -13.774 -13.509 -10.603 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -12.862 -13.910 -8.309 1.00 0.00 C ATOM 0 H LEU A 149 -9.980 -12.169 -10.441 1.00 0.00 H new ATOM 0 HA LEU A 149 -9.963 -14.611 -8.772 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -11.414 -14.237 -11.398 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -11.717 -15.423 -10.144 1.00 0.00 H new ATOM 0 HG LEU A 149 -12.153 -12.460 -9.702 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -14.537 -12.863 -10.168 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.525 -13.154 -11.603 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.154 -14.529 -10.664 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -13.638 -13.259 -7.906 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -13.218 -14.940 -8.313 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -11.969 -13.837 -7.688 1.00 0.00 H new ATOM 1157 N PRO A 150 -8.498 -15.989 -10.311 1.00 0.00 N ATOM 1158 CA PRO A 150 -7.497 -16.702 -11.110 1.00 0.00 C ATOM 1159 C PRO A 150 -7.937 -16.887 -12.559 1.00 0.00 C ATOM 1160 O PRO A 150 -8.921 -17.574 -12.836 1.00 0.00 O ATOM 1161 CB PRO A 150 -7.375 -18.059 -10.414 1.00 0.00 C ATOM 1162 CG PRO A 150 -7.814 -17.808 -9.013 1.00 0.00 C ATOM 1163 CD PRO A 150 -8.870 -16.743 -9.097 1.00 0.00 C ATOM 0 HA PRO A 150 -6.557 -16.152 -11.163 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.002 -18.809 -10.897 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -6.351 -18.430 -10.447 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.211 -18.716 -8.559 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -6.978 -17.481 -8.394 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -9.868 -17.172 -9.181 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -8.870 -16.106 -8.212 1.00 0.00 H new ATOM 1171 N GLY A 151 -7.205 -16.270 -13.479 1.00 0.00 N ATOM 1172 CA GLY A 151 -7.536 -16.380 -14.888 1.00 0.00 C ATOM 1173 C GLY A 151 -6.314 -16.622 -15.753 1.00 0.00 C ATOM 1174 O GLY A 151 -5.548 -17.555 -15.509 1.00 0.00 O ATOM 0 H GLY A 151 -6.388 -15.695 -13.275 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -8.245 -17.196 -15.029 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -8.033 -15.466 -15.214 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.131 -15.780 -16.764 1.00 0.00 N ATOM 1179 CA LYS A 152 -4.994 -15.907 -17.666 1.00 0.00 C ATOM 1180 C LYS A 152 -3.736 -15.308 -17.045 1.00 0.00 C ATOM 1181 O LYS A 152 -2.621 -15.740 -17.338 1.00 0.00 O ATOM 1182 CB LYS A 152 -5.295 -15.221 -19.000 1.00 0.00 C ATOM 1183 CG LYS A 152 -6.254 -16.003 -19.883 1.00 0.00 C ATOM 1184 CD LYS A 152 -6.425 -15.343 -21.242 1.00 0.00 C ATOM 1185 CE LYS A 152 -5.282 -15.696 -22.183 1.00 0.00 C ATOM 1186 NZ LYS A 152 -5.774 -16.280 -23.460 1.00 0.00 N ATOM 0 H LYS A 152 -6.756 -15.003 -16.979 1.00 0.00 H new ATOM 0 HA LYS A 152 -4.820 -16.968 -17.842 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -5.716 -14.235 -18.805 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -4.360 -15.068 -19.539 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -5.882 -17.019 -20.015 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -7.223 -16.080 -19.390 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -7.371 -15.657 -21.683 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -6.475 -14.261 -21.118 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -4.697 -14.801 -22.395 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -4.614 -16.405 -21.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -4.965 -16.507 -24.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -6.311 -17.148 -23.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -6.391 -15.594 -23.941 1.00 0.00 H new ATOM 1200 N GLY A 153 -3.921 -14.311 -16.183 1.00 0.00 N ATOM 1201 CA GLY A 153 -2.790 -13.674 -15.536 1.00 0.00 C ATOM 1202 C GLY A 153 -3.180 -12.413 -14.791 1.00 0.00 C ATOM 1203 O GLY A 153 -3.474 -12.455 -13.596 1.00 0.00 O ATOM 0 H GLY A 153 -4.833 -13.935 -15.923 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.332 -14.376 -14.840 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.037 -13.431 -16.285 1.00 0.00 H new ATOM 1207 N THR A 154 -3.179 -11.285 -15.499 1.00 0.00 N ATOM 1208 CA THR A 154 -3.531 -9.995 -14.906 1.00 0.00 C ATOM 1209 C THR A 154 -2.431 -9.486 -13.973 1.00 0.00 C ATOM 1210 O THR A 154 -2.592 -8.453 -13.321 1.00 0.00 O ATOM 1211 CB THR A 154 -4.854 -10.099 -14.144 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.828 -10.773 -14.919 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.428 -8.753 -13.755 1.00 0.00 C ATOM 0 H THR A 154 -2.937 -11.238 -16.489 1.00 0.00 H new ATOM 0 HA THR A 154 -3.641 -9.279 -15.721 1.00 0.00 H new ATOM 0 HB THR A 154 -4.620 -10.653 -13.235 1.00 0.00 H new ATOM 0 HG1 THR A 154 -6.666 -10.831 -14.414 1.00 0.00 H new ATOM 0 HG21 THR A 154 -6.365 -8.899 -13.218 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.720 -8.227 -13.114 1.00 0.00 H new ATOM 0 HG23 THR A 154 -5.612 -8.163 -14.653 1.00 0.00 H new ATOM 1221 N GLY A 155 -1.314 -10.209 -13.911 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.215 -9.800 -13.055 1.00 0.00 C ATOM 1223 C GLY A 155 0.561 -8.630 -13.626 1.00 0.00 C ATOM 1224 O GLY A 155 0.931 -7.708 -12.900 1.00 0.00 O ATOM 0 H GLY A 155 -1.152 -11.068 -14.437 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -0.604 -9.529 -12.074 1.00 0.00 H new ATOM 0 HA3 GLY A 155 0.460 -10.643 -12.908 1.00 0.00 H new ATOM 1228 N SER A 156 0.811 -8.669 -14.931 1.00 0.00 N ATOM 1229 CA SER A 156 1.550 -7.607 -15.602 1.00 0.00 C ATOM 1230 C SER A 156 0.788 -6.287 -15.536 1.00 0.00 C ATOM 1231 O SER A 156 1.390 -5.218 -15.413 1.00 0.00 O ATOM 1232 CB SER A 156 1.814 -7.983 -17.060 1.00 0.00 C ATOM 1233 OG SER A 156 2.434 -9.253 -17.156 1.00 0.00 O ATOM 0 H SER A 156 0.512 -9.426 -15.545 1.00 0.00 H new ATOM 0 HA SER A 156 2.503 -7.482 -15.088 1.00 0.00 H new ATOM 0 HB2 SER A 156 0.874 -7.991 -17.612 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.450 -7.229 -17.524 1.00 0.00 H new ATOM 0 HG SER A 156 2.590 -9.470 -18.099 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.535 -6.366 -15.618 1.00 0.00 N ATOM 1240 CA LEU A 157 -1.376 -5.177 -15.567 1.00 0.00 C ATOM 1241 C LEU A 157 -1.253 -4.480 -14.214 1.00 0.00 C ATOM 1242 O LEU A 157 -1.102 -3.262 -14.146 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.837 -5.545 -15.832 1.00 0.00 C ATOM 1244 CG LEU A 157 -3.180 -5.815 -17.298 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -3.132 -7.307 -17.592 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -4.551 -5.248 -17.639 1.00 0.00 C ATOM 0 H LEU A 157 -1.048 -7.242 -15.720 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.036 -4.491 -16.342 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -3.085 -6.431 -15.247 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -3.471 -4.736 -15.469 1.00 0.00 H new ATOM 0 HG LEU A 157 -2.437 -5.318 -17.922 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -3.379 -7.480 -18.640 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -2.131 -7.686 -17.388 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -3.852 -7.826 -16.959 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -4.778 -5.450 -18.686 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -5.306 -5.716 -17.007 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -4.552 -4.171 -17.468 1.00 0.00 H new ATOM 1258 N LEU A 158 -1.318 -5.264 -13.144 1.00 0.00 N ATOM 1259 CA LEU A 158 -1.213 -4.723 -11.794 1.00 0.00 C ATOM 1260 C LEU A 158 0.187 -4.175 -11.533 1.00 0.00 C ATOM 1261 O LEU A 158 0.348 -3.124 -10.914 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.554 -5.799 -10.762 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.978 -6.352 -10.850 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -3.134 -7.566 -9.948 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.989 -5.277 -10.480 1.00 0.00 C ATOM 0 H LEU A 158 -1.443 -6.276 -13.185 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.926 -3.904 -11.702 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.852 -6.625 -10.875 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.402 -5.386 -9.765 1.00 0.00 H new ATOM 0 HG LEU A 158 -3.166 -6.662 -11.878 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -4.153 -7.946 -10.023 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -2.433 -8.342 -10.257 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.928 -7.282 -8.916 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.997 -5.687 -10.548 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.803 -4.938 -9.461 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.893 -4.435 -11.166 1.00 0.00 H new ATOM 1277 N LYS A 159 1.197 -4.897 -12.009 1.00 0.00 N ATOM 1278 CA LYS A 159 2.584 -4.482 -11.827 1.00 0.00 C ATOM 1279 C LYS A 159 2.901 -3.254 -12.674 1.00 0.00 C ATOM 1280 O LYS A 159 3.549 -2.315 -12.209 1.00 0.00 O ATOM 1281 CB LYS A 159 3.532 -5.630 -12.190 1.00 0.00 C ATOM 1282 CG LYS A 159 4.481 -6.011 -11.066 1.00 0.00 C ATOM 1283 CD LYS A 159 5.798 -5.259 -11.170 1.00 0.00 C ATOM 1284 CE LYS A 159 6.642 -5.770 -12.325 1.00 0.00 C ATOM 1285 NZ LYS A 159 7.946 -5.058 -12.418 1.00 0.00 N ATOM 0 H LYS A 159 1.081 -5.771 -12.523 1.00 0.00 H new ATOM 0 HA LYS A 159 2.726 -4.221 -10.778 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.942 -6.503 -12.469 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.115 -5.346 -13.066 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.013 -5.797 -10.105 1.00 0.00 H new ATOM 0 HG3 LYS A 159 4.670 -7.084 -11.096 1.00 0.00 H new ATOM 0 HD2 LYS A 159 5.601 -4.195 -11.305 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.353 -5.365 -10.238 1.00 0.00 H new ATOM 0 HE2 LYS A 159 6.820 -6.838 -12.200 1.00 0.00 H new ATOM 0 HE3 LYS A 159 6.093 -5.646 -13.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 8.033 -4.614 -13.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 7.995 -4.325 -11.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 8.722 -5.737 -12.283 1.00 0.00 H new ATOM 1299 N SER A 160 2.443 -3.269 -13.922 1.00 0.00 N ATOM 1300 CA SER A 160 2.679 -2.157 -14.836 1.00 0.00 C ATOM 1301 C SER A 160 1.937 -0.905 -14.379 1.00 0.00 C ATOM 1302 O SER A 160 2.478 0.200 -14.426 1.00 0.00 O ATOM 1303 CB SER A 160 2.242 -2.535 -16.252 1.00 0.00 C ATOM 1304 OG SER A 160 3.127 -3.484 -16.824 1.00 0.00 O ATOM 0 H SER A 160 1.907 -4.038 -14.323 1.00 0.00 H new ATOM 0 HA SER A 160 3.747 -1.941 -14.836 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.232 -2.944 -16.227 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.209 -1.642 -16.876 1.00 0.00 H new ATOM 0 HG SER A 160 2.858 -4.387 -16.553 1.00 0.00 H new ATOM 1310 N HIS A 161 0.695 -1.084 -13.941 1.00 0.00 N ATOM 1311 CA HIS A 161 -0.120 0.031 -13.478 1.00 0.00 C ATOM 1312 C HIS A 161 0.485 0.679 -12.236 1.00 0.00 C ATOM 1313 O HIS A 161 0.433 1.897 -12.070 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.545 -0.439 -13.178 1.00 0.00 C ATOM 1315 CG HIS A 161 -2.456 -0.386 -14.364 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.443 0.647 -15.278 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -3.413 -1.247 -14.786 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -3.352 0.419 -16.210 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.953 -0.723 -15.933 1.00 0.00 N ATOM 0 H HIS A 161 0.232 -1.992 -13.897 1.00 0.00 H new ATOM 0 HA HIS A 161 -0.148 0.776 -14.273 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.510 -1.462 -12.803 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.962 0.178 -12.382 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -3.698 -2.173 -14.309 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.566 1.058 -17.054 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -4.699 -1.148 -16.483 1.00 0.00 H new ATOM 1328 N TYR A 162 1.055 -0.145 -11.364 1.00 0.00 N ATOM 1329 CA TYR A 162 1.669 0.349 -10.134 1.00 0.00 C ATOM 1330 C TYR A 162 2.987 1.059 -10.424 1.00 0.00 C ATOM 1331 O TYR A 162 3.284 2.099 -9.839 1.00 0.00 O ATOM 1332 CB TYR A 162 1.901 -0.804 -9.156 1.00 0.00 C ATOM 1333 CG TYR A 162 2.457 -0.362 -7.820 1.00 0.00 C ATOM 1334 CD1 TYR A 162 1.625 0.164 -6.839 1.00 0.00 C ATOM 1335 CD2 TYR A 162 3.814 -0.471 -7.541 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.131 0.569 -5.618 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.327 -0.068 -6.322 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.481 0.451 -5.365 1.00 0.00 C ATOM 1339 OH TYR A 162 3.987 0.853 -4.149 1.00 0.00 O ATOM 0 H TYR A 162 1.105 -1.157 -11.484 1.00 0.00 H new ATOM 0 HA TYR A 162 0.985 1.068 -9.683 1.00 0.00 H new ATOM 0 HB2 TYR A 162 0.958 -1.326 -8.993 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.588 -1.520 -9.607 1.00 0.00 H new ATOM 0 HD1 TYR A 162 0.567 0.258 -7.034 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.479 -0.877 -8.289 1.00 0.00 H new ATOM 0 HE1 TYR A 162 1.472 0.976 -4.866 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.384 -0.159 -6.121 1.00 0.00 H new ATOM 0 HH TYR A 162 4.955 0.702 -4.131 1.00 0.00 H new ATOM 1349 N GLU A 163 3.776 0.488 -11.328 1.00 0.00 N ATOM 1350 CA GLU A 163 5.066 1.063 -11.690 1.00 0.00 C ATOM 1351 C GLU A 163 4.965 1.861 -12.987 1.00 0.00 C ATOM 1352 O GLU A 163 5.446 1.428 -14.034 1.00 0.00 O ATOM 1353 CB GLU A 163 6.118 -0.036 -11.836 1.00 0.00 C ATOM 1354 CG GLU A 163 7.548 0.469 -11.719 1.00 0.00 C ATOM 1355 CD GLU A 163 8.430 0.000 -12.860 1.00 0.00 C ATOM 1356 OE1 GLU A 163 7.899 -0.211 -13.972 1.00 0.00 O ATOM 1357 OE2 GLU A 163 9.649 -0.155 -12.643 1.00 0.00 O ATOM 0 H GLU A 163 3.544 -0.373 -11.824 1.00 0.00 H new ATOM 0 HA GLU A 163 5.367 1.740 -10.891 1.00 0.00 H new ATOM 0 HB2 GLU A 163 5.946 -0.795 -11.073 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.991 -0.522 -12.803 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.543 1.559 -11.693 1.00 0.00 H new ATOM 0 HG3 GLU A 163 7.972 0.130 -10.774 1.00 0.00 H new ATOM 1364 N ARG A 164 4.339 3.030 -12.909 1.00 0.00 N ATOM 1365 CA ARG A 164 4.179 3.889 -14.077 1.00 0.00 C ATOM 1366 C ARG A 164 3.704 5.282 -13.676 1.00 0.00 C ATOM 1367 O ARG A 164 4.157 6.283 -14.231 1.00 0.00 O ATOM 1368 CB ARG A 164 3.189 3.267 -15.062 1.00 0.00 C ATOM 1369 CG ARG A 164 3.420 3.694 -16.502 1.00 0.00 C ATOM 1370 CD ARG A 164 2.115 4.061 -17.193 1.00 0.00 C ATOM 1371 NE ARG A 164 2.249 4.061 -18.648 1.00 0.00 N ATOM 1372 CZ ARG A 164 2.204 2.962 -19.398 1.00 0.00 C ATOM 1373 NH1 ARG A 164 2.035 1.771 -18.834 1.00 0.00 N ATOM 1374 NH2 ARG A 164 2.331 3.053 -20.714 1.00 0.00 N ATOM 0 H ARG A 164 3.935 3.404 -12.051 1.00 0.00 H new ATOM 0 HA ARG A 164 5.153 3.984 -14.558 1.00 0.00 H new ATOM 0 HB2 ARG A 164 3.258 2.181 -14.998 1.00 0.00 H new ATOM 0 HB3 ARG A 164 2.176 3.540 -14.768 1.00 0.00 H new ATOM 0 HG2 ARG A 164 4.097 4.548 -16.525 1.00 0.00 H new ATOM 0 HG3 ARG A 164 3.907 2.886 -17.048 1.00 0.00 H new ATOM 0 HD2 ARG A 164 1.338 3.355 -16.900 1.00 0.00 H new ATOM 0 HD3 ARG A 164 1.792 5.047 -16.858 1.00 0.00 H new ATOM 0 HE ARG A 164 2.385 4.956 -19.117 1.00 0.00 H new ATOM 0 HH11 ARG A 164 1.939 1.695 -17.821 1.00 0.00 H new ATOM 0 HH12 ARG A 164 2.001 0.932 -19.414 1.00 0.00 H new ATOM 0 HH21 ARG A 164 2.463 3.965 -21.152 1.00 0.00 H new ATOM 0 HH22 ARG A 164 2.297 2.211 -21.289 1.00 0.00 H new ATOM 1388 N ILE A 165 2.785 5.342 -12.717 1.00 0.00 N ATOM 1389 CA ILE A 165 2.250 6.618 -12.255 1.00 0.00 C ATOM 1390 C ILE A 165 2.371 6.765 -10.741 1.00 0.00 C ATOM 1391 O ILE A 165 2.621 7.860 -10.235 1.00 0.00 O ATOM 1392 CB ILE A 165 0.769 6.780 -12.655 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.552 6.342 -14.107 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.323 8.223 -12.458 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.295 5.096 -14.240 1.00 0.00 C ATOM 0 H ILE A 165 2.396 4.525 -12.246 1.00 0.00 H new ATOM 0 HA ILE A 165 2.844 7.396 -12.736 1.00 0.00 H new ATOM 0 HB ILE A 165 0.165 6.140 -12.012 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.077 7.155 -14.657 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.521 6.165 -14.574 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.724 8.323 -12.744 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.441 8.500 -11.411 1.00 0.00 H new ATOM 0 HG23 ILE A 165 0.933 8.880 -13.078 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.408 4.843 -15.294 1.00 0.00 H new ATOM 0 HD12 ILE A 165 0.189 4.270 -13.719 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.277 5.275 -13.803 1.00 0.00 H new ATOM 1407 N LEU A 166 2.184 5.665 -10.020 1.00 0.00 N ATOM 1408 CA LEU A 166 2.261 5.681 -8.563 1.00 0.00 C ATOM 1409 C LEU A 166 3.692 5.470 -8.075 1.00 0.00 C ATOM 1410 O LEU A 166 4.265 6.332 -7.411 1.00 0.00 O ATOM 1411 CB LEU A 166 1.346 4.606 -7.975 1.00 0.00 C ATOM 1412 CG LEU A 166 0.624 5.004 -6.686 1.00 0.00 C ATOM 1413 CD1 LEU A 166 -0.724 4.306 -6.594 1.00 0.00 C ATOM 1414 CD2 LEU A 166 1.481 4.675 -5.473 1.00 0.00 C ATOM 0 H LEU A 166 1.978 4.750 -10.421 1.00 0.00 H new ATOM 0 HA LEU A 166 1.931 6.663 -8.224 1.00 0.00 H new ATOM 0 HB2 LEU A 166 0.600 4.337 -8.723 1.00 0.00 H new ATOM 0 HB3 LEU A 166 1.939 3.713 -7.780 1.00 0.00 H new ATOM 0 HG LEU A 166 0.453 6.080 -6.704 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -1.224 4.600 -5.671 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -1.340 4.590 -7.447 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -0.576 3.226 -6.598 1.00 0.00 H new ATOM 0 HD21 LEU A 166 0.952 4.965 -4.565 1.00 0.00 H new ATOM 0 HD22 LEU A 166 1.683 3.604 -5.450 1.00 0.00 H new ATOM 0 HD23 LEU A 166 2.423 5.220 -5.534 1.00 0.00 H new ATOM 1426 N TYR A 167 4.260 4.312 -8.396 1.00 0.00 N ATOM 1427 CA TYR A 167 5.620 3.982 -7.978 1.00 0.00 C ATOM 1428 C TYR A 167 6.612 5.099 -8.309 1.00 0.00 C ATOM 1429 O TYR A 167 7.324 5.581 -7.428 1.00 0.00 O ATOM 1430 CB TYR A 167 6.076 2.673 -8.625 1.00 0.00 C ATOM 1431 CG TYR A 167 7.116 1.933 -7.812 1.00 0.00 C ATOM 1432 CD1 TYR A 167 6.955 1.756 -6.444 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.257 1.416 -8.411 1.00 0.00 C ATOM 1434 CE1 TYR A 167 7.902 1.086 -5.695 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.209 0.743 -7.670 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.027 0.581 -6.311 1.00 0.00 C ATOM 1437 OH TYR A 167 9.974 -0.086 -5.569 1.00 0.00 O ATOM 0 H TYR A 167 3.800 3.585 -8.945 1.00 0.00 H new ATOM 0 HA TYR A 167 5.602 3.865 -6.894 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.210 2.026 -8.769 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.482 2.887 -9.614 1.00 0.00 H new ATOM 0 HD1 TYR A 167 6.074 2.149 -5.958 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.403 1.542 -9.474 1.00 0.00 H new ATOM 0 HE1 TYR A 167 7.762 0.958 -4.632 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.091 0.346 -8.151 1.00 0.00 H new ATOM 0 HH TYR A 167 10.703 -0.378 -6.155 1.00 0.00 H new ATOM 1447 N PRO A 168 6.688 5.525 -9.585 1.00 0.00 N ATOM 1448 CA PRO A 168 7.615 6.582 -10.005 1.00 0.00 C ATOM 1449 C PRO A 168 7.455 7.863 -9.194 1.00 0.00 C ATOM 1450 O PRO A 168 8.399 8.643 -9.063 1.00 0.00 O ATOM 1451 CB PRO A 168 7.259 6.830 -11.479 1.00 0.00 C ATOM 1452 CG PRO A 168 5.951 6.145 -11.699 1.00 0.00 C ATOM 1453 CD PRO A 168 5.899 5.013 -10.715 1.00 0.00 C ATOM 0 HA PRO A 168 8.652 6.281 -9.854 1.00 0.00 H new ATOM 0 HB2 PRO A 168 7.183 7.897 -11.689 1.00 0.00 H new ATOM 0 HB3 PRO A 168 8.027 6.429 -12.140 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.120 6.834 -11.544 1.00 0.00 H new ATOM 0 HG3 PRO A 168 5.872 5.776 -12.721 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.876 4.780 -10.421 1.00 0.00 H new ATOM 0 HD3 PRO A 168 6.328 4.100 -11.127 1.00 0.00 H new ATOM 1461 N TYR A 169 6.263 8.079 -8.649 1.00 0.00 N ATOM 1462 CA TYR A 169 6.000 9.271 -7.851 1.00 0.00 C ATOM 1463 C TYR A 169 6.927 9.328 -6.640 1.00 0.00 C ATOM 1464 O TYR A 169 7.613 10.327 -6.415 1.00 0.00 O ATOM 1465 CB TYR A 169 4.541 9.301 -7.390 1.00 0.00 C ATOM 1466 CG TYR A 169 4.185 10.528 -6.583 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.503 11.801 -7.040 1.00 0.00 C ATOM 1468 CD2 TYR A 169 3.530 10.414 -5.362 1.00 0.00 C ATOM 1469 CE1 TYR A 169 4.181 12.925 -6.304 1.00 0.00 C ATOM 1470 CE2 TYR A 169 3.203 11.534 -4.621 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.530 12.787 -5.096 1.00 0.00 C ATOM 1472 OH TYR A 169 3.206 13.903 -4.361 1.00 0.00 O ATOM 0 H TYR A 169 5.467 7.448 -8.744 1.00 0.00 H new ATOM 0 HA TYR A 169 6.190 10.142 -8.478 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.892 9.251 -8.264 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.340 8.412 -6.792 1.00 0.00 H new ATOM 0 HD1 TYR A 169 5.011 11.914 -7.987 1.00 0.00 H new ATOM 0 HD2 TYR A 169 3.273 9.435 -4.986 1.00 0.00 H new ATOM 0 HE1 TYR A 169 4.438 13.907 -6.673 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.694 11.429 -3.674 1.00 0.00 H new ATOM 0 HH TYR A 169 3.050 14.659 -4.965 1.00 0.00 H new ATOM 1482 N GLU A 170 6.944 8.250 -5.863 1.00 0.00 N ATOM 1483 CA GLU A 170 7.784 8.176 -4.679 1.00 0.00 C ATOM 1484 C GLU A 170 9.254 8.365 -5.040 1.00 0.00 C ATOM 1485 O GLU A 170 9.955 9.175 -4.434 1.00 0.00 O ATOM 1486 CB GLU A 170 7.589 6.833 -3.972 1.00 0.00 C ATOM 1487 CG GLU A 170 6.190 6.639 -3.410 1.00 0.00 C ATOM 1488 CD GLU A 170 6.086 7.051 -1.954 1.00 0.00 C ATOM 1489 OE1 GLU A 170 7.124 7.047 -1.260 1.00 0.00 O ATOM 1490 OE2 GLU A 170 4.965 7.376 -1.507 1.00 0.00 O ATOM 0 H GLU A 170 6.383 7.415 -6.035 1.00 0.00 H new ATOM 0 HA GLU A 170 7.488 8.980 -4.005 1.00 0.00 H new ATOM 0 HB2 GLU A 170 7.804 6.028 -4.674 1.00 0.00 H new ATOM 0 HB3 GLU A 170 8.312 6.751 -3.161 1.00 0.00 H new ATOM 0 HG2 GLU A 170 5.481 7.220 -4.000 1.00 0.00 H new ATOM 0 HG3 GLU A 170 5.904 5.592 -3.509 1.00 0.00 H new ATOM 1497 N LEU A 171 9.713 7.610 -6.034 1.00 0.00 N ATOM 1498 CA LEU A 171 11.095 7.691 -6.480 1.00 0.00 C ATOM 1499 C LEU A 171 11.446 9.109 -6.916 1.00 0.00 C ATOM 1500 O LEU A 171 12.573 9.568 -6.730 1.00 0.00 O ATOM 1501 CB LEU A 171 11.338 6.715 -7.634 1.00 0.00 C ATOM 1502 CG LEU A 171 11.288 5.235 -7.251 1.00 0.00 C ATOM 1503 CD1 LEU A 171 10.914 4.385 -8.454 1.00 0.00 C ATOM 1504 CD2 LEU A 171 12.624 4.791 -6.674 1.00 0.00 C ATOM 0 H LEU A 171 9.145 6.935 -6.545 1.00 0.00 H new ATOM 0 HA LEU A 171 11.737 7.420 -5.642 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.594 6.900 -8.409 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.313 6.929 -8.071 1.00 0.00 H new ATOM 0 HG LEU A 171 10.522 5.101 -6.487 1.00 0.00 H new ATOM 0 HD11 LEU A 171 10.883 3.335 -8.162 1.00 0.00 H new ATOM 0 HD12 LEU A 171 9.934 4.688 -8.823 1.00 0.00 H new ATOM 0 HD13 LEU A 171 11.656 4.521 -9.241 1.00 0.00 H new ATOM 0 HD21 LEU A 171 12.572 3.736 -6.406 1.00 0.00 H new ATOM 0 HD22 LEU A 171 13.408 4.939 -7.416 1.00 0.00 H new ATOM 0 HD23 LEU A 171 12.850 5.380 -5.785 1.00 0.00 H new ATOM 1516 N PHE A 172 10.470 9.800 -7.499 1.00 0.00 N ATOM 1517 CA PHE A 172 10.672 11.167 -7.963 1.00 0.00 C ATOM 1518 C PHE A 172 11.088 12.076 -6.810 1.00 0.00 C ATOM 1519 O PHE A 172 11.928 12.961 -6.976 1.00 0.00 O ATOM 1520 CB PHE A 172 9.393 11.698 -8.611 1.00 0.00 C ATOM 1521 CG PHE A 172 9.641 12.711 -9.692 1.00 0.00 C ATOM 1522 CD1 PHE A 172 10.290 13.902 -9.406 1.00 0.00 C ATOM 1523 CD2 PHE A 172 9.225 12.473 -10.992 1.00 0.00 C ATOM 1524 CE1 PHE A 172 10.520 14.836 -10.399 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.452 13.404 -11.988 1.00 0.00 C ATOM 1526 CZ PHE A 172 10.100 14.586 -11.691 1.00 0.00 C ATOM 0 H PHE A 172 9.532 9.434 -7.661 1.00 0.00 H new ATOM 0 HA PHE A 172 11.472 11.161 -8.703 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.834 10.861 -9.030 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.765 12.147 -7.841 1.00 0.00 H new ATOM 0 HD1 PHE A 172 10.619 14.102 -8.397 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.718 11.550 -11.230 1.00 0.00 H new ATOM 0 HE1 PHE A 172 11.028 15.760 -10.165 1.00 0.00 H new ATOM 0 HE2 PHE A 172 9.123 13.207 -12.998 1.00 0.00 H new ATOM 0 HZ PHE A 172 10.278 15.315 -12.468 1.00 0.00 H new ATOM 1536 N GLN A 173 10.494 11.852 -5.642 1.00 0.00 N ATOM 1537 CA GLN A 173 10.803 12.650 -4.462 1.00 0.00 C ATOM 1538 C GLN A 173 12.032 12.106 -3.740 1.00 0.00 C ATOM 1539 O GLN A 173 12.896 12.865 -3.304 1.00 0.00 O ATOM 1540 CB GLN A 173 9.607 12.676 -3.510 1.00 0.00 C ATOM 1541 CG GLN A 173 8.295 13.026 -4.190 1.00 0.00 C ATOM 1542 CD GLN A 173 7.093 12.437 -3.475 1.00 0.00 C ATOM 1543 OE1 GLN A 173 6.553 13.039 -2.547 1.00 0.00 O ATOM 1544 NE2 GLN A 173 6.669 11.254 -3.905 1.00 0.00 N ATOM 0 H GLN A 173 9.796 11.124 -5.488 1.00 0.00 H new ATOM 0 HA GLN A 173 11.019 13.667 -4.790 1.00 0.00 H new ATOM 0 HB2 GLN A 173 9.511 11.700 -3.034 1.00 0.00 H new ATOM 0 HB3 GLN A 173 9.800 13.399 -2.718 1.00 0.00 H new ATOM 0 HG2 GLN A 173 8.191 14.110 -4.235 1.00 0.00 H new ATOM 0 HG3 GLN A 173 8.315 12.665 -5.218 1.00 0.00 H new ATOM 0 HE21 GLN A 173 7.147 10.791 -4.678 1.00 0.00 H new ATOM 0 HE22 GLN A 173 5.865 10.809 -3.462 1.00 0.00 H new ATOM 1553 N SER A 174 12.101 10.784 -3.616 1.00 0.00 N ATOM 1554 CA SER A 174 13.223 10.137 -2.945 1.00 0.00 C ATOM 1555 C SER A 174 14.252 9.640 -3.955 1.00 0.00 C ATOM 1556 O SER A 174 14.928 8.637 -3.724 1.00 0.00 O ATOM 1557 CB SER A 174 12.728 8.972 -2.087 1.00 0.00 C ATOM 1558 OG SER A 174 11.646 9.370 -1.261 1.00 0.00 O ATOM 0 H SER A 174 11.394 10.140 -3.971 1.00 0.00 H new ATOM 0 HA SER A 174 13.702 10.875 -2.302 1.00 0.00 H new ATOM 0 HB2 SER A 174 12.415 8.150 -2.730 1.00 0.00 H new ATOM 0 HB3 SER A 174 13.544 8.600 -1.468 1.00 0.00 H new ATOM 0 HG SER A 174 11.347 8.607 -0.724 1.00 0.00 H new ATOM 1564 N GLY A 175 14.366 10.347 -5.073 1.00 0.00 N ATOM 1565 CA GLY A 175 15.315 9.962 -6.102 1.00 0.00 C ATOM 1566 C GLY A 175 16.386 11.013 -6.324 1.00 0.00 C ATOM 1567 O GLY A 175 17.150 10.883 -7.304 1.00 0.00 O ATOM 1568 OXT GLY A 175 16.459 11.967 -5.520 1.00 0.00 O ATOM 0 H GLY A 175 13.818 11.181 -5.286 1.00 0.00 H new ATOM 0 HA2 GLY A 175 15.787 9.020 -5.823 1.00 0.00 H new ATOM 0 HA3 GLY A 175 14.782 9.787 -7.037 1.00 0.00 H new