USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=19 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 169 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 173 GLN : amide:sc= -0.174 X(o=-0.17,f=0) USER MOD Single : A 93 GLN : amide:sc= 0.00708 X(o=0.0071,f=-0.024) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -0.952 K(o=-0.95,f=-0.22) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 77:sc= 0.038 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 SER OG : 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 -2:sc= 0.906 USER MOD Single : A 127 LYS NZ :NH3+ -109:sc= -0.659 (180deg=-2.07!) USER MOD Single : A 132 MET CE :methyl -118:sc= -0.585 (180deg=-2.24!) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.997 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 158:sc= -0.0515 (180deg=-0.324) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.84 USER MOD Single : A 156 SER OG : rot 180:sc= 0.00116 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 SER OG : rot 89:sc= 0.548 USER MOD Single : A 161 HIS : no HD1:sc= -0.0234 X(o=-0.023,f=-0.077) USER MOD Single : A 162 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 167 TYR OH : rot 180:sc= -1.16 USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -7.679 10.471 3.554 1.00 0.00 N ATOM 86 CA VAL A 86 -6.238 10.349 3.371 1.00 0.00 C ATOM 87 C VAL A 86 -5.904 9.737 2.016 1.00 0.00 C ATOM 88 O VAL A 86 -4.906 10.094 1.391 1.00 0.00 O ATOM 89 CB VAL A 86 -5.601 9.488 4.480 1.00 0.00 C ATOM 90 CG1 VAL A 86 -5.560 10.253 5.794 1.00 0.00 C ATOM 91 CG2 VAL A 86 -6.360 8.180 4.640 1.00 0.00 C ATOM 0 HA VAL A 86 -5.828 11.358 3.422 1.00 0.00 H new ATOM 0 HB VAL A 86 -4.576 9.255 4.191 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -5.107 9.629 6.564 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.969 11.160 5.668 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.574 10.519 6.092 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -5.897 7.585 5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.396 8.391 4.906 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.332 7.626 3.702 1.00 0.00 H new ATOM 101 N ARG A 87 -6.747 8.811 1.567 1.00 0.00 N ATOM 102 CA ARG A 87 -6.542 8.148 0.286 1.00 0.00 C ATOM 103 C ARG A 87 -6.709 9.132 -0.870 1.00 0.00 C ATOM 104 O ARG A 87 -5.897 9.166 -1.793 1.00 0.00 O ATOM 105 CB ARG A 87 -7.521 6.981 0.129 1.00 0.00 C ATOM 106 CG ARG A 87 -6.844 5.620 0.100 1.00 0.00 C ATOM 107 CD ARG A 87 -7.520 4.634 1.040 1.00 0.00 C ATOM 108 NE ARG A 87 -6.721 4.385 2.238 1.00 0.00 N ATOM 109 CZ ARG A 87 -6.914 3.352 3.056 1.00 0.00 C ATOM 110 NH1 ARG A 87 -7.877 2.472 2.808 1.00 0.00 N ATOM 111 NH2 ARG A 87 -6.142 3.198 4.123 1.00 0.00 N ATOM 0 H ARG A 87 -7.578 8.504 2.073 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.523 7.762 0.263 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.236 7.004 0.951 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.089 7.115 -0.792 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.864 5.226 -0.916 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -5.796 5.729 0.380 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.497 5.021 1.330 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.692 3.693 0.517 1.00 0.00 H new ATOM 0 HE ARG A 87 -5.972 5.041 2.461 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -8.473 2.586 1.988 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -8.021 1.682 3.438 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -5.400 3.871 4.317 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -6.290 2.407 4.750 1.00 0.00 H new ATOM 125 N LEU A 88 -7.772 9.928 -0.811 1.00 0.00 N ATOM 126 CA LEU A 88 -8.047 10.912 -1.851 1.00 0.00 C ATOM 127 C LEU A 88 -6.952 11.974 -1.902 1.00 0.00 C ATOM 128 O LEU A 88 -6.495 12.358 -2.977 1.00 0.00 O ATOM 129 CB LEU A 88 -9.408 11.573 -1.609 1.00 0.00 C ATOM 130 CG LEU A 88 -10.365 11.541 -2.801 1.00 0.00 C ATOM 131 CD1 LEU A 88 -11.766 11.944 -2.371 1.00 0.00 C ATOM 132 CD2 LEU A 88 -9.862 12.451 -3.911 1.00 0.00 C ATOM 0 H LEU A 88 -8.456 9.911 -0.055 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.067 10.394 -2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -9.889 11.081 -0.764 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.244 12.612 -1.322 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.405 10.521 -3.185 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.433 11.915 -3.232 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -12.126 11.252 -1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -11.745 12.954 -1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -10.555 12.416 -4.752 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -9.793 13.473 -3.540 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -8.878 12.116 -4.238 1.00 0.00 H new ATOM 144 N ASP A 89 -6.537 12.444 -0.730 1.00 0.00 N ATOM 145 CA ASP A 89 -5.500 13.461 -0.636 1.00 0.00 C ATOM 146 C ASP A 89 -4.212 12.996 -1.307 1.00 0.00 C ATOM 147 O ASP A 89 -3.554 13.763 -2.010 1.00 0.00 O ATOM 148 CB ASP A 89 -5.229 13.808 0.829 1.00 0.00 C ATOM 149 CG ASP A 89 -6.306 14.694 1.424 1.00 0.00 C ATOM 150 OD1 ASP A 89 -7.456 14.638 0.939 1.00 0.00 O ATOM 151 OD2 ASP A 89 -5.999 15.444 2.373 1.00 0.00 O ATOM 0 H ASP A 89 -6.905 12.135 0.169 1.00 0.00 H new ATOM 0 HA ASP A 89 -5.855 14.351 -1.155 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.158 12.888 1.410 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.265 14.310 0.908 1.00 0.00 H new ATOM 156 N PHE A 90 -3.857 11.734 -1.086 1.00 0.00 N ATOM 157 CA PHE A 90 -2.646 11.167 -1.668 1.00 0.00 C ATOM 158 C PHE A 90 -2.672 11.267 -3.190 1.00 0.00 C ATOM 159 O PHE A 90 -1.716 11.732 -3.809 1.00 0.00 O ATOM 160 CB PHE A 90 -2.489 9.705 -1.244 1.00 0.00 C ATOM 161 CG PHE A 90 -1.202 9.081 -1.701 1.00 0.00 C ATOM 162 CD1 PHE A 90 -1.116 8.470 -2.943 1.00 0.00 C ATOM 163 CD2 PHE A 90 -0.079 9.107 -0.891 1.00 0.00 C ATOM 164 CE1 PHE A 90 0.067 7.895 -3.366 1.00 0.00 C ATOM 165 CE2 PHE A 90 1.108 8.534 -1.310 1.00 0.00 C ATOM 166 CZ PHE A 90 1.181 7.926 -2.549 1.00 0.00 C ATOM 0 H PHE A 90 -4.391 11.085 -0.508 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.795 11.740 -1.300 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.548 9.642 -0.157 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.324 9.128 -1.642 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.983 8.443 -3.586 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.131 9.580 0.079 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.121 7.421 -4.335 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.977 8.562 -0.670 1.00 0.00 H new ATOM 0 HZ PHE A 90 2.106 7.476 -2.878 1.00 0.00 H new ATOM 176 N LEU A 91 -3.774 10.825 -3.789 1.00 0.00 N ATOM 177 CA LEU A 91 -3.925 10.865 -5.238 1.00 0.00 C ATOM 178 C LEU A 91 -3.855 12.299 -5.754 1.00 0.00 C ATOM 179 O LEU A 91 -3.374 12.548 -6.859 1.00 0.00 O ATOM 180 CB LEU A 91 -5.254 10.228 -5.651 1.00 0.00 C ATOM 181 CG LEU A 91 -5.216 8.708 -5.822 1.00 0.00 C ATOM 182 CD1 LEU A 91 -5.616 8.015 -4.529 1.00 0.00 C ATOM 183 CD2 LEU A 91 -6.126 8.277 -6.963 1.00 0.00 C ATOM 0 H LEU A 91 -4.575 10.435 -3.292 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.105 10.299 -5.679 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.007 10.476 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.578 10.676 -6.590 1.00 0.00 H new ATOM 0 HG LEU A 91 -4.195 8.415 -6.067 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -5.583 6.935 -4.670 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -4.925 8.299 -3.735 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -6.627 8.314 -4.254 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -6.087 7.193 -7.070 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -7.150 8.583 -6.748 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.795 8.746 -7.890 1.00 0.00 H new ATOM 195 N ASP A 92 -4.341 13.237 -4.948 1.00 0.00 N ATOM 196 CA ASP A 92 -4.335 14.646 -5.325 1.00 0.00 C ATOM 197 C ASP A 92 -2.909 15.147 -5.548 1.00 0.00 C ATOM 198 O ASP A 92 -2.625 15.814 -6.542 1.00 0.00 O ATOM 199 CB ASP A 92 -5.022 15.487 -4.245 1.00 0.00 C ATOM 200 CG ASP A 92 -6.071 16.419 -4.819 1.00 0.00 C ATOM 201 OD1 ASP A 92 -6.672 16.069 -5.857 1.00 0.00 O ATOM 202 OD2 ASP A 92 -6.290 17.500 -4.233 1.00 0.00 O ATOM 0 H ASP A 92 -4.744 13.047 -4.030 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.885 14.748 -6.261 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -5.488 14.825 -3.515 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.272 16.072 -3.712 1.00 0.00 H new ATOM 207 N GLN A 93 -2.019 14.819 -4.617 1.00 0.00 N ATOM 208 CA GLN A 93 -0.625 15.236 -4.716 1.00 0.00 C ATOM 209 C GLN A 93 0.029 14.659 -5.967 1.00 0.00 C ATOM 210 O GLN A 93 0.765 15.351 -6.670 1.00 0.00 O ATOM 211 CB GLN A 93 0.152 14.797 -3.471 1.00 0.00 C ATOM 212 CG GLN A 93 -0.566 15.095 -2.164 1.00 0.00 C ATOM 213 CD GLN A 93 -1.043 16.530 -2.072 1.00 0.00 C ATOM 214 OE1 GLN A 93 -0.242 17.464 -2.053 1.00 0.00 O ATOM 215 NE2 GLN A 93 -2.357 16.714 -2.013 1.00 0.00 N ATOM 0 H GLN A 93 -2.237 14.267 -3.787 1.00 0.00 H new ATOM 0 HA GLN A 93 -0.602 16.324 -4.785 1.00 0.00 H new ATOM 0 HB2 GLN A 93 0.345 13.726 -3.533 1.00 0.00 H new ATOM 0 HB3 GLN A 93 1.121 15.295 -3.464 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -1.420 14.425 -2.063 1.00 0.00 H new ATOM 0 HG3 GLN A 93 0.104 14.885 -1.330 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.986 15.911 -2.032 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -2.737 17.658 -1.949 1.00 0.00 H new ATOM 224 N LEU A 94 -0.244 13.387 -6.237 1.00 0.00 N ATOM 225 CA LEU A 94 0.319 12.714 -7.401 1.00 0.00 C ATOM 226 C LEU A 94 -0.258 13.290 -8.692 1.00 0.00 C ATOM 227 O LEU A 94 0.454 13.457 -9.681 1.00 0.00 O ATOM 228 CB LEU A 94 0.043 11.212 -7.329 1.00 0.00 C ATOM 229 CG LEU A 94 1.095 10.327 -7.998 1.00 0.00 C ATOM 230 CD1 LEU A 94 1.305 9.050 -7.199 1.00 0.00 C ATOM 231 CD2 LEU A 94 0.689 10.003 -9.428 1.00 0.00 C ATOM 0 H LEU A 94 -0.852 12.801 -5.665 1.00 0.00 H new ATOM 0 HA LEU A 94 1.397 12.878 -7.401 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.039 10.923 -6.281 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.924 11.013 -7.791 1.00 0.00 H new ATOM 0 HG LEU A 94 2.038 10.874 -8.025 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.057 8.433 -7.690 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.642 9.301 -6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.366 8.499 -7.140 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.450 9.372 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.265 9.477 -9.425 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.591 10.928 -9.997 1.00 0.00 H new ATOM 243 N ALA A 95 -1.554 13.585 -8.673 1.00 0.00 N ATOM 244 CA ALA A 95 -2.227 14.140 -9.843 1.00 0.00 C ATOM 245 C ALA A 95 -1.775 15.570 -10.111 1.00 0.00 C ATOM 246 O ALA A 95 -1.531 15.950 -11.257 1.00 0.00 O ATOM 247 CB ALA A 95 -3.735 14.089 -9.655 1.00 0.00 C ATOM 0 H ALA A 95 -2.158 13.450 -7.863 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.957 13.534 -10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.226 14.506 -10.535 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.050 13.054 -9.520 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.012 14.670 -8.775 1.00 0.00 H new ATOM 253 N LYS A 96 -1.668 16.362 -9.049 1.00 0.00 N ATOM 254 CA LYS A 96 -1.247 17.752 -9.173 1.00 0.00 C ATOM 255 C LYS A 96 0.234 17.845 -9.526 1.00 0.00 C ATOM 256 O LYS A 96 0.658 18.761 -10.230 1.00 0.00 O ATOM 257 CB LYS A 96 -1.522 18.508 -7.870 1.00 0.00 C ATOM 258 CG LYS A 96 -2.988 18.518 -7.471 1.00 0.00 C ATOM 259 CD LYS A 96 -3.521 19.935 -7.334 1.00 0.00 C ATOM 260 CE LYS A 96 -3.185 20.529 -5.977 1.00 0.00 C ATOM 261 NZ LYS A 96 -2.846 21.976 -6.070 1.00 0.00 N ATOM 0 H LYS A 96 -1.867 16.065 -8.094 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.822 18.208 -9.979 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -0.939 18.056 -7.068 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -1.176 19.536 -7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.572 17.979 -8.217 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.112 17.989 -6.526 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -3.099 20.561 -8.120 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -4.602 19.933 -7.474 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -4.032 20.398 -5.304 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -2.345 19.987 -5.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -2.623 22.342 -5.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.022 22.100 -6.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -3.656 22.498 -6.461 1.00 0.00 H new ATOM 275 N PHE A 97 1.018 16.894 -9.028 1.00 0.00 N ATOM 276 CA PHE A 97 2.452 16.872 -9.290 1.00 0.00 C ATOM 277 C PHE A 97 2.734 16.619 -10.767 1.00 0.00 C ATOM 278 O PHE A 97 3.518 17.336 -11.391 1.00 0.00 O ATOM 279 CB PHE A 97 3.129 15.799 -8.436 1.00 0.00 C ATOM 280 CG PHE A 97 4.615 15.714 -8.640 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.144 14.940 -9.661 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.482 16.407 -7.812 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.510 14.861 -9.852 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.850 16.333 -7.998 1.00 0.00 C ATOM 285 CZ PHE A 97 7.365 15.557 -9.019 1.00 0.00 C ATOM 0 H PHE A 97 0.684 16.129 -8.441 1.00 0.00 H new ATOM 0 HA PHE A 97 2.860 17.848 -9.026 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.927 16.003 -7.385 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.684 14.831 -8.665 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.481 14.393 -10.314 1.00 0.00 H new ATOM 0 HD2 PHE A 97 5.085 17.013 -7.011 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.909 14.255 -10.652 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.515 16.881 -7.347 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.433 15.495 -9.165 1.00 0.00 H new ATOM 295 N TRP A 98 2.094 15.595 -11.323 1.00 0.00 N ATOM 296 CA TRP A 98 2.279 15.250 -12.727 1.00 0.00 C ATOM 297 C TRP A 98 1.736 16.348 -13.635 1.00 0.00 C ATOM 298 O TRP A 98 2.292 16.619 -14.699 1.00 0.00 O ATOM 299 CB TRP A 98 1.596 13.919 -13.046 1.00 0.00 C ATOM 300 CG TRP A 98 2.480 12.731 -12.816 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.395 11.831 -11.793 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.586 12.317 -13.625 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.380 10.881 -11.918 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.124 11.157 -13.036 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.173 12.813 -14.794 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.220 10.487 -13.575 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.261 12.146 -15.327 1.00 0.00 C ATOM 308 CH2 TRP A 98 5.773 10.995 -14.717 1.00 0.00 C ATOM 0 H TRP A 98 1.443 14.990 -10.822 1.00 0.00 H new ATOM 0 HA TRP A 98 3.349 15.150 -12.910 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.700 13.821 -12.432 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.270 13.925 -14.086 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.661 11.861 -11.001 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.533 10.098 -11.282 1.00 0.00 H new ATOM 0 HE3 TRP A 98 3.784 13.700 -15.271 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.618 9.599 -13.108 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 5.723 12.519 -16.229 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.624 10.497 -15.158 1.00 0.00 H new ATOM 319 N GLU A 99 0.642 16.974 -13.210 1.00 0.00 N ATOM 320 CA GLU A 99 0.021 18.038 -13.984 1.00 0.00 C ATOM 321 C GLU A 99 1.020 19.152 -14.285 1.00 0.00 C ATOM 322 O GLU A 99 1.102 19.639 -15.412 1.00 0.00 O ATOM 323 CB GLU A 99 -1.189 18.603 -13.235 1.00 0.00 C ATOM 324 CG GLU A 99 -2.463 18.620 -14.063 1.00 0.00 C ATOM 325 CD GLU A 99 -3.085 17.244 -14.204 1.00 0.00 C ATOM 326 OE1 GLU A 99 -3.541 16.691 -13.182 1.00 0.00 O ATOM 327 OE2 GLU A 99 -3.115 16.721 -15.338 1.00 0.00 O ATOM 0 H GLU A 99 0.169 16.760 -12.332 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.314 17.615 -14.931 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.358 18.011 -12.336 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.963 19.619 -12.910 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.183 19.295 -13.601 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.243 19.019 -15.053 1.00 0.00 H new ATOM 334 N LEU A 100 1.780 19.549 -13.268 1.00 0.00 N ATOM 335 CA LEU A 100 2.776 20.602 -13.427 1.00 0.00 C ATOM 336 C LEU A 100 3.857 20.173 -14.412 1.00 0.00 C ATOM 337 O LEU A 100 4.432 21.000 -15.121 1.00 0.00 O ATOM 338 CB LEU A 100 3.406 20.947 -12.075 1.00 0.00 C ATOM 339 CG LEU A 100 2.695 22.052 -11.293 1.00 0.00 C ATOM 340 CD1 LEU A 100 2.890 23.398 -11.972 1.00 0.00 C ATOM 341 CD2 LEU A 100 1.213 21.736 -11.149 1.00 0.00 C ATOM 0 H LEU A 100 1.725 19.158 -12.328 1.00 0.00 H new ATOM 0 HA LEU A 100 2.278 21.488 -13.821 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.429 20.046 -11.462 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.441 21.247 -12.240 1.00 0.00 H new ATOM 0 HG LEU A 100 3.134 22.104 -10.297 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.377 24.171 -11.401 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.954 23.630 -12.022 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.479 23.359 -12.981 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.724 22.533 -10.590 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.760 21.655 -12.137 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.092 20.793 -10.617 1.00 0.00 H new ATOM 353 N GLN A 101 4.127 18.873 -14.454 1.00 0.00 N ATOM 354 CA GLN A 101 5.136 18.328 -15.354 1.00 0.00 C ATOM 355 C GLN A 101 4.660 18.391 -16.801 1.00 0.00 C ATOM 356 O GLN A 101 5.435 18.681 -17.710 1.00 0.00 O ATOM 357 CB GLN A 101 5.460 16.882 -14.974 1.00 0.00 C ATOM 358 CG GLN A 101 6.007 16.729 -13.565 1.00 0.00 C ATOM 359 CD GLN A 101 7.189 17.642 -13.296 1.00 0.00 C ATOM 360 OE1 GLN A 101 8.345 17.229 -13.404 1.00 0.00 O ATOM 361 NE2 GLN A 101 6.904 18.889 -12.941 1.00 0.00 N ATOM 0 H GLN A 101 3.660 18.176 -13.874 1.00 0.00 H new ATOM 0 HA GLN A 101 6.039 18.932 -15.259 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.557 16.279 -15.071 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.187 16.484 -15.682 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.216 16.944 -12.847 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.309 15.694 -13.407 1.00 0.00 H new ATOM 0 HE21 GLN A 101 5.932 19.188 -12.864 1.00 0.00 H new ATOM 0 HE22 GLN A 101 7.657 19.548 -12.745 1.00 0.00 H new ATOM 370 N GLY A 102 3.376 18.113 -17.005 1.00 0.00 N ATOM 371 CA GLY A 102 2.813 18.139 -18.338 1.00 0.00 C ATOM 372 C GLY A 102 1.876 16.974 -18.606 1.00 0.00 C ATOM 373 O GLY A 102 1.187 16.947 -19.626 1.00 0.00 O ATOM 0 H GLY A 102 2.716 17.870 -16.267 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.272 19.074 -18.480 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.621 18.124 -19.069 1.00 0.00 H new ATOM 377 N SER A 103 1.849 16.008 -17.692 1.00 0.00 N ATOM 378 CA SER A 103 0.992 14.838 -17.841 1.00 0.00 C ATOM 379 C SER A 103 -0.266 14.973 -16.986 1.00 0.00 C ATOM 380 O SER A 103 -0.601 16.064 -16.523 1.00 0.00 O ATOM 381 CB SER A 103 1.758 13.570 -17.456 1.00 0.00 C ATOM 382 OG SER A 103 1.525 12.531 -18.390 1.00 0.00 O ATOM 0 H SER A 103 2.411 16.013 -16.841 1.00 0.00 H new ATOM 0 HA SER A 103 0.690 14.767 -18.886 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.825 13.787 -17.407 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.453 13.245 -16.461 1.00 0.00 H new ATOM 0 HG SER A 103 2.027 11.733 -18.123 1.00 0.00 H new ATOM 388 N THR A 104 -0.959 13.857 -16.781 1.00 0.00 N ATOM 389 CA THR A 104 -2.181 13.851 -15.984 1.00 0.00 C ATOM 390 C THR A 104 -2.400 12.485 -15.341 1.00 0.00 C ATOM 391 O THR A 104 -2.110 11.452 -15.943 1.00 0.00 O ATOM 392 CB THR A 104 -3.384 14.218 -16.853 1.00 0.00 C ATOM 393 OG1 THR A 104 -4.578 14.199 -16.090 1.00 0.00 O ATOM 394 CG2 THR A 104 -3.578 13.288 -18.031 1.00 0.00 C ATOM 0 H THR A 104 -0.695 12.946 -17.156 1.00 0.00 H new ATOM 0 HA THR A 104 -2.075 14.594 -15.193 1.00 0.00 H new ATOM 0 HB THR A 104 -3.172 15.218 -17.231 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.624 15.005 -15.535 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.448 13.605 -18.605 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.693 13.317 -18.667 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.732 12.271 -17.670 1.00 0.00 H new ATOM 402 N LEU A 105 -2.914 12.490 -14.115 1.00 0.00 N ATOM 403 CA LEU A 105 -3.172 11.250 -13.392 1.00 0.00 C ATOM 404 C LEU A 105 -4.526 10.663 -13.781 1.00 0.00 C ATOM 405 O LEU A 105 -5.564 11.301 -13.607 1.00 0.00 O ATOM 406 CB LEU A 105 -3.121 11.498 -11.882 1.00 0.00 C ATOM 407 CG LEU A 105 -3.520 10.301 -11.012 1.00 0.00 C ATOM 408 CD1 LEU A 105 -2.300 9.706 -10.325 1.00 0.00 C ATOM 409 CD2 LEU A 105 -4.565 10.710 -9.983 1.00 0.00 C ATOM 0 H LEU A 105 -3.160 13.337 -13.603 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.397 10.532 -13.662 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.109 11.801 -11.613 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.778 12.335 -11.645 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.955 9.539 -11.659 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.605 8.858 -9.712 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.586 9.372 -11.077 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.834 10.461 -9.692 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.835 9.846 -9.375 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.158 11.492 -9.342 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.452 11.085 -10.494 1.00 0.00 H new ATOM 421 N LYS A 106 -4.504 9.443 -14.306 1.00 0.00 N ATOM 422 CA LYS A 106 -5.727 8.763 -14.717 1.00 0.00 C ATOM 423 C LYS A 106 -5.808 7.375 -14.093 1.00 0.00 C ATOM 424 O LYS A 106 -4.871 6.583 -14.193 1.00 0.00 O ATOM 425 CB LYS A 106 -5.789 8.656 -16.242 1.00 0.00 C ATOM 426 CG LYS A 106 -7.198 8.766 -16.803 1.00 0.00 C ATOM 427 CD LYS A 106 -7.499 10.176 -17.282 1.00 0.00 C ATOM 428 CE LYS A 106 -8.354 10.169 -18.540 1.00 0.00 C ATOM 429 NZ LYS A 106 -9.464 11.157 -18.463 1.00 0.00 N ATOM 0 H LYS A 106 -3.651 8.904 -14.457 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.577 9.350 -14.369 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.171 9.441 -16.678 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.358 7.703 -16.549 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.317 8.067 -17.631 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.919 8.479 -16.037 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.014 10.726 -16.494 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -6.564 10.701 -17.479 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -7.729 10.392 -19.405 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.766 9.172 -18.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -10.023 11.121 -19.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.075 10.930 -17.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -9.071 12.112 -18.343 1.00 0.00 H new ATOM 443 N ILE A 107 -6.932 7.085 -13.446 1.00 0.00 N ATOM 444 CA ILE A 107 -7.133 5.792 -12.803 1.00 0.00 C ATOM 445 C ILE A 107 -7.956 4.856 -13.686 1.00 0.00 C ATOM 446 O ILE A 107 -9.180 4.968 -13.746 1.00 0.00 O ATOM 447 CB ILE A 107 -7.840 5.947 -11.443 1.00 0.00 C ATOM 448 CG1 ILE A 107 -7.144 7.019 -10.601 1.00 0.00 C ATOM 449 CG2 ILE A 107 -7.866 4.619 -10.703 1.00 0.00 C ATOM 450 CD1 ILE A 107 -7.810 8.375 -10.678 1.00 0.00 C ATOM 0 H ILE A 107 -7.718 7.729 -13.353 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.144 5.361 -12.646 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.869 6.261 -11.620 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.120 6.694 -9.561 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -6.109 7.112 -10.930 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.369 4.746 -9.744 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.403 3.881 -11.299 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.845 4.276 -10.534 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -7.263 9.085 -10.057 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.810 8.722 -11.711 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.837 8.297 -10.321 1.00 0.00 H new ATOM 462 N PRO A 108 -7.295 3.915 -14.385 1.00 0.00 N ATOM 463 CA PRO A 108 -7.979 2.960 -15.263 1.00 0.00 C ATOM 464 C PRO A 108 -8.757 1.907 -14.480 1.00 0.00 C ATOM 465 O PRO A 108 -8.769 1.918 -13.250 1.00 0.00 O ATOM 466 CB PRO A 108 -6.832 2.310 -16.038 1.00 0.00 C ATOM 467 CG PRO A 108 -5.657 2.417 -15.129 1.00 0.00 C ATOM 468 CD PRO A 108 -5.834 3.704 -14.372 1.00 0.00 C ATOM 0 HA PRO A 108 -8.720 3.447 -15.898 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -7.055 1.270 -16.278 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -6.651 2.823 -16.982 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.612 1.567 -14.448 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.725 2.422 -15.695 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.449 3.628 -13.355 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -5.305 4.528 -14.852 1.00 0.00 H new ATOM 476 N VAL A 109 -9.404 0.997 -15.202 1.00 0.00 N ATOM 477 CA VAL A 109 -10.183 -0.063 -14.575 1.00 0.00 C ATOM 478 C VAL A 109 -9.724 -1.436 -15.054 1.00 0.00 C ATOM 479 O VAL A 109 -9.637 -1.686 -16.256 1.00 0.00 O ATOM 480 CB VAL A 109 -11.688 0.095 -14.867 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.499 -0.895 -14.046 1.00 0.00 C ATOM 482 CG2 VAL A 109 -12.139 1.522 -14.594 1.00 0.00 C ATOM 0 H VAL A 109 -9.404 0.973 -16.222 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.021 0.018 -13.500 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.858 -0.119 -15.922 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.559 -0.768 -14.266 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -12.195 -1.911 -14.298 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.325 -0.717 -12.985 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.204 1.614 -14.806 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.955 1.768 -13.548 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.582 2.208 -15.232 1.00 0.00 H new ATOM 492 N VAL A 110 -9.433 -2.322 -14.108 1.00 0.00 N ATOM 493 CA VAL A 110 -8.981 -3.670 -14.438 1.00 0.00 C ATOM 494 C VAL A 110 -10.046 -4.708 -14.104 1.00 0.00 C ATOM 495 O VAL A 110 -10.507 -4.794 -12.966 1.00 0.00 O ATOM 496 CB VAL A 110 -7.684 -4.025 -13.689 1.00 0.00 C ATOM 497 CG1 VAL A 110 -7.113 -5.340 -14.201 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.663 -2.905 -13.824 1.00 0.00 C ATOM 0 H VAL A 110 -9.502 -2.132 -13.108 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.790 -3.684 -15.511 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.920 -4.144 -12.632 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.196 -5.574 -13.660 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.840 -6.137 -14.046 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -6.893 -5.252 -15.265 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.753 -3.175 -13.288 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.430 -2.750 -14.878 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -7.073 -1.987 -13.404 1.00 0.00 H new ATOM 508 N GLU A 111 -10.429 -5.498 -15.106 1.00 0.00 N ATOM 509 CA GLU A 111 -11.439 -6.538 -14.931 1.00 0.00 C ATOM 510 C GLU A 111 -12.810 -5.930 -14.646 1.00 0.00 C ATOM 511 O GLU A 111 -13.727 -6.036 -15.461 1.00 0.00 O ATOM 512 CB GLU A 111 -11.040 -7.488 -13.796 1.00 0.00 C ATOM 513 CG GLU A 111 -10.421 -8.788 -14.282 1.00 0.00 C ATOM 514 CD GLU A 111 -11.397 -9.642 -15.067 1.00 0.00 C ATOM 515 OE1 GLU A 111 -12.334 -10.191 -14.451 1.00 0.00 O ATOM 516 OE2 GLU A 111 -11.226 -9.760 -16.299 1.00 0.00 O ATOM 0 H GLU A 111 -10.052 -5.436 -16.052 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.501 -7.103 -15.861 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.332 -6.981 -13.140 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.922 -7.716 -13.197 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.557 -8.563 -14.907 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -10.056 -9.355 -13.425 1.00 0.00 H new ATOM 523 N ARG A 112 -12.940 -5.292 -13.489 1.00 0.00 N ATOM 524 CA ARG A 112 -14.190 -4.663 -13.095 1.00 0.00 C ATOM 525 C ARG A 112 -14.052 -3.994 -11.732 1.00 0.00 C ATOM 526 O ARG A 112 -14.968 -4.035 -10.910 1.00 0.00 O ATOM 527 CB ARG A 112 -15.323 -5.693 -13.065 1.00 0.00 C ATOM 528 CG ARG A 112 -16.587 -5.225 -13.768 1.00 0.00 C ATOM 529 CD ARG A 112 -17.512 -4.484 -12.816 1.00 0.00 C ATOM 530 NE ARG A 112 -18.214 -3.388 -13.478 1.00 0.00 N ATOM 531 CZ ARG A 112 -19.005 -2.523 -12.845 1.00 0.00 C ATOM 532 NH1 ARG A 112 -19.199 -2.624 -11.537 1.00 0.00 N ATOM 533 NH2 ARG A 112 -19.605 -1.556 -13.526 1.00 0.00 N ATOM 0 H ARG A 112 -12.189 -5.198 -12.805 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.432 -3.898 -13.833 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -14.977 -6.615 -13.532 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.560 -5.930 -12.028 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -16.322 -4.573 -14.600 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -17.109 -6.084 -14.190 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -18.239 -5.182 -12.400 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.933 -4.091 -11.980 1.00 0.00 H new ATOM 0 HE ARG A 112 -18.091 -3.278 -14.485 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -18.741 -3.367 -11.009 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -19.806 -1.958 -11.059 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -19.460 -1.476 -14.532 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -20.211 -0.893 -13.043 1.00 0.00 H new ATOM 547 N LYS A 113 -12.898 -3.378 -11.499 1.00 0.00 N ATOM 548 CA LYS A 113 -12.630 -2.698 -10.239 1.00 0.00 C ATOM 549 C LYS A 113 -11.504 -1.682 -10.404 1.00 0.00 C ATOM 550 O LYS A 113 -10.720 -1.761 -11.347 1.00 0.00 O ATOM 551 CB LYS A 113 -12.268 -3.713 -9.153 1.00 0.00 C ATOM 552 CG LYS A 113 -12.996 -3.483 -7.837 1.00 0.00 C ATOM 553 CD LYS A 113 -14.040 -4.557 -7.578 1.00 0.00 C ATOM 554 CE LYS A 113 -15.321 -3.965 -7.014 1.00 0.00 C ATOM 555 NZ LYS A 113 -16.380 -4.997 -6.839 1.00 0.00 N ATOM 0 H LYS A 113 -12.131 -3.336 -12.170 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.533 -2.168 -9.938 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -12.496 -4.716 -9.514 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -11.193 -3.675 -8.976 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -12.275 -3.471 -7.019 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -13.476 -2.505 -7.853 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.260 -5.084 -8.507 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.641 -5.293 -6.881 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -15.111 -3.494 -6.054 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -15.683 -3.182 -7.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -17.237 -4.553 -6.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -16.599 -5.429 -7.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -16.045 -5.731 -6.183 1.00 0.00 H new ATOM 569 N ILE A 114 -11.431 -0.730 -9.480 1.00 0.00 N ATOM 570 CA ILE A 114 -10.401 0.298 -9.526 1.00 0.00 C ATOM 571 C ILE A 114 -9.127 -0.167 -8.829 1.00 0.00 C ATOM 572 O ILE A 114 -9.166 -0.642 -7.694 1.00 0.00 O ATOM 573 CB ILE A 114 -10.882 1.610 -8.874 1.00 0.00 C ATOM 574 CG1 ILE A 114 -12.242 2.022 -9.441 1.00 0.00 C ATOM 575 CG2 ILE A 114 -9.857 2.714 -9.081 1.00 0.00 C ATOM 576 CD1 ILE A 114 -13.232 2.457 -8.383 1.00 0.00 C ATOM 0 H ILE A 114 -12.073 -0.650 -8.691 1.00 0.00 H new ATOM 0 HA ILE A 114 -10.189 0.483 -10.579 1.00 0.00 H new ATOM 0 HB ILE A 114 -10.994 1.443 -7.803 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.099 2.837 -10.150 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -12.663 1.185 -9.998 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.213 3.633 -8.615 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -8.910 2.420 -8.629 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.713 2.881 -10.148 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.173 2.735 -8.858 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -13.405 1.636 -7.687 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -12.832 3.314 -7.841 1.00 0.00 H new ATOM 588 N LEU A 115 -7.997 -0.026 -9.516 1.00 0.00 N ATOM 589 CA LEU A 115 -6.711 -0.431 -8.963 1.00 0.00 C ATOM 590 C LEU A 115 -6.209 0.591 -7.948 1.00 0.00 C ATOM 591 O LEU A 115 -5.714 1.657 -8.316 1.00 0.00 O ATOM 592 CB LEU A 115 -5.683 -0.600 -10.085 1.00 0.00 C ATOM 593 CG LEU A 115 -4.318 -1.128 -9.639 1.00 0.00 C ATOM 594 CD1 LEU A 115 -3.758 -2.099 -10.666 1.00 0.00 C ATOM 595 CD2 LEU A 115 -3.349 0.025 -9.411 1.00 0.00 C ATOM 0 H LEU A 115 -7.947 0.366 -10.456 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.846 -1.385 -8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.092 -1.280 -10.832 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -5.541 0.363 -10.575 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.447 -1.662 -8.697 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -2.787 -2.463 -10.331 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -4.441 -2.940 -10.782 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -3.644 -1.590 -11.623 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -2.383 -0.369 -9.094 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -3.226 0.586 -10.338 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -3.743 0.684 -8.638 1.00 0.00 H new ATOM 607 N ASP A 116 -6.342 0.259 -6.667 1.00 0.00 N ATOM 608 CA ASP A 116 -5.902 1.147 -5.597 1.00 0.00 C ATOM 609 C ASP A 116 -4.415 1.458 -5.723 1.00 0.00 C ATOM 610 O ASP A 116 -3.670 0.723 -6.370 1.00 0.00 O ATOM 611 CB ASP A 116 -6.189 0.516 -4.233 1.00 0.00 C ATOM 612 CG ASP A 116 -6.418 1.554 -3.153 1.00 0.00 C ATOM 613 OD1 ASP A 116 -5.431 2.173 -2.704 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.587 1.748 -2.754 1.00 0.00 O ATOM 0 H ASP A 116 -6.751 -0.618 -6.345 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.458 2.081 -5.683 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.068 -0.125 -4.310 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.353 -0.123 -3.948 1.00 0.00 H new ATOM 619 N LEU A 117 -3.989 2.554 -5.101 1.00 0.00 N ATOM 620 CA LEU A 117 -2.589 2.962 -5.146 1.00 0.00 C ATOM 621 C LEU A 117 -1.970 2.937 -3.752 1.00 0.00 C ATOM 622 O LEU A 117 -0.999 2.220 -3.507 1.00 0.00 O ATOM 623 CB LEU A 117 -2.463 4.363 -5.748 1.00 0.00 C ATOM 624 CG LEU A 117 -3.327 4.616 -6.984 1.00 0.00 C ATOM 625 CD1 LEU A 117 -3.121 6.035 -7.495 1.00 0.00 C ATOM 626 CD2 LEU A 117 -3.008 3.603 -8.072 1.00 0.00 C ATOM 0 H LEU A 117 -4.592 3.174 -4.561 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.050 2.254 -5.776 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.725 5.095 -4.984 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.420 4.536 -6.011 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.374 4.500 -6.704 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.743 6.199 -8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.399 6.746 -6.717 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.073 6.178 -7.760 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.632 3.797 -8.944 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.958 3.687 -8.351 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.206 2.597 -7.702 1.00 0.00 H new ATOM 638 N TYR A 118 -2.535 3.724 -2.843 1.00 0.00 N ATOM 639 CA TYR A 118 -2.036 3.790 -1.474 1.00 0.00 C ATOM 640 C TYR A 118 -2.038 2.408 -0.828 1.00 0.00 C ATOM 641 O TYR A 118 -1.030 1.968 -0.277 1.00 0.00 O ATOM 642 CB TYR A 118 -2.887 4.756 -0.645 1.00 0.00 C ATOM 643 CG TYR A 118 -2.237 5.175 0.654 1.00 0.00 C ATOM 644 CD1 TYR A 118 -0.971 5.747 0.667 1.00 0.00 C ATOM 645 CD2 TYR A 118 -2.890 5.000 1.868 1.00 0.00 C ATOM 646 CE1 TYR A 118 -0.374 6.132 1.853 1.00 0.00 C ATOM 647 CE2 TYR A 118 -2.301 5.384 3.057 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.044 5.949 3.044 1.00 0.00 C ATOM 649 OH TYR A 118 -0.453 6.331 4.227 1.00 0.00 O ATOM 0 H TYR A 118 -3.338 4.325 -3.029 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.010 4.156 -1.504 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.096 5.645 -1.240 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -3.846 4.286 -0.426 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -0.445 5.893 -0.265 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -3.875 4.556 1.882 1.00 0.00 H new ATOM 0 HE1 TYR A 118 0.612 6.574 1.847 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -2.823 5.242 3.992 1.00 0.00 H new ATOM 0 HH TYR A 118 -1.057 6.135 4.973 1.00 0.00 H new ATOM 659 N ALA A 119 -3.178 1.729 -0.901 1.00 0.00 N ATOM 660 CA ALA A 119 -3.315 0.403 -0.328 1.00 0.00 C ATOM 661 C ALA A 119 -2.379 -0.590 -1.012 1.00 0.00 C ATOM 662 O ALA A 119 -1.748 -1.417 -0.356 1.00 0.00 O ATOM 663 CB ALA A 119 -4.756 -0.071 -0.431 1.00 0.00 C ATOM 0 H ALA A 119 -4.021 2.081 -1.354 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.037 0.459 0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.843 -1.067 0.003 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.405 0.618 0.109 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -5.054 -0.104 -1.479 1.00 0.00 H new ATOM 669 N LEU A 120 -2.298 -0.500 -2.335 1.00 0.00 N ATOM 670 CA LEU A 120 -1.443 -1.389 -3.112 1.00 0.00 C ATOM 671 C LEU A 120 0.032 -1.092 -2.854 1.00 0.00 C ATOM 672 O LEU A 120 0.871 -1.992 -2.881 1.00 0.00 O ATOM 673 CB LEU A 120 -1.751 -1.249 -4.605 1.00 0.00 C ATOM 674 CG LEU A 120 -1.054 -2.267 -5.510 1.00 0.00 C ATOM 675 CD1 LEU A 120 -1.587 -3.668 -5.249 1.00 0.00 C ATOM 676 CD2 LEU A 120 -1.237 -1.891 -6.972 1.00 0.00 C ATOM 0 H LEU A 120 -2.815 0.180 -2.892 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.647 -2.413 -2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.828 -1.337 -4.748 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.468 -0.247 -4.926 1.00 0.00 H new ATOM 0 HG LEU A 120 0.012 -2.258 -5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.079 -4.378 -5.902 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.406 -3.938 -4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.658 -3.693 -5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -0.735 -2.625 -7.602 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.300 -1.872 -7.213 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.807 -0.905 -7.151 1.00 0.00 H new ATOM 688 N SER A 121 0.340 0.177 -2.609 1.00 0.00 N ATOM 689 CA SER A 121 1.714 0.594 -2.350 1.00 0.00 C ATOM 690 C SER A 121 2.203 0.063 -1.007 1.00 0.00 C ATOM 691 O SER A 121 3.373 -0.292 -0.858 1.00 0.00 O ATOM 692 CB SER A 121 1.817 2.120 -2.376 1.00 0.00 C ATOM 693 OG SER A 121 3.124 2.550 -2.036 1.00 0.00 O ATOM 0 H SER A 121 -0.343 0.935 -2.584 1.00 0.00 H new ATOM 0 HA SER A 121 2.347 0.179 -3.134 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.557 2.488 -3.368 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.097 2.548 -1.678 1.00 0.00 H new ATOM 0 HG SER A 121 3.163 3.529 -2.062 1.00 0.00 H new ATOM 699 N LYS A 122 1.303 0.011 -0.031 1.00 0.00 N ATOM 700 CA LYS A 122 1.646 -0.476 1.302 1.00 0.00 C ATOM 701 C LYS A 122 1.957 -1.969 1.275 1.00 0.00 C ATOM 702 O LYS A 122 2.935 -2.419 1.872 1.00 0.00 O ATOM 703 CB LYS A 122 0.500 -0.199 2.277 1.00 0.00 C ATOM 704 CG LYS A 122 0.483 1.224 2.811 1.00 0.00 C ATOM 705 CD LYS A 122 -0.937 1.747 2.966 1.00 0.00 C ATOM 706 CE LYS A 122 -1.120 2.480 4.284 1.00 0.00 C ATOM 707 NZ LYS A 122 -1.408 1.543 5.406 1.00 0.00 N ATOM 0 H LYS A 122 0.330 0.300 -0.137 1.00 0.00 H new ATOM 0 HA LYS A 122 2.537 0.054 1.637 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.447 -0.402 1.777 1.00 0.00 H new ATOM 0 HB3 LYS A 122 0.573 -0.892 3.116 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.991 1.258 3.775 1.00 0.00 H new ATOM 0 HG3 LYS A 122 1.039 1.874 2.135 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.171 2.418 2.140 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -1.640 0.916 2.910 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -0.219 3.051 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -1.936 3.196 4.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -1.526 2.083 6.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -2.281 1.016 5.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -0.618 0.875 5.512 1.00 0.00 H new ATOM 721 N ILE A 123 1.115 -2.731 0.586 1.00 0.00 N ATOM 722 CA ILE A 123 1.294 -4.170 0.487 1.00 0.00 C ATOM 723 C ILE A 123 2.644 -4.522 -0.131 1.00 0.00 C ATOM 724 O ILE A 123 3.299 -5.478 0.286 1.00 0.00 O ATOM 725 CB ILE A 123 0.170 -4.821 -0.346 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.198 -4.476 0.245 1.00 0.00 C ATOM 727 CG2 ILE A 123 0.355 -6.330 -0.410 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.350 -4.755 -0.695 1.00 0.00 C ATOM 0 H ILE A 123 0.300 -2.373 0.087 1.00 0.00 H new ATOM 0 HA ILE A 123 1.256 -4.561 1.504 1.00 0.00 H new ATOM 0 HB ILE A 123 0.221 -4.426 -1.361 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.342 -5.046 1.163 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.211 -3.421 0.519 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.448 -6.770 -1.002 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.315 -6.560 -0.873 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.330 -6.743 0.599 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.289 -4.487 -0.210 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -2.229 -4.165 -1.603 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.363 -5.815 -0.950 1.00 0.00 H new ATOM 740 N VAL A 124 3.056 -3.747 -1.130 1.00 0.00 N ATOM 741 CA VAL A 124 4.328 -3.984 -1.803 1.00 0.00 C ATOM 742 C VAL A 124 5.503 -3.772 -0.854 1.00 0.00 C ATOM 743 O VAL A 124 6.388 -4.621 -0.747 1.00 0.00 O ATOM 744 CB VAL A 124 4.498 -3.060 -3.024 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.738 -3.441 -3.816 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.259 -3.103 -3.907 1.00 0.00 C ATOM 0 H VAL A 124 2.529 -2.952 -1.490 1.00 0.00 H new ATOM 0 HA VAL A 124 4.318 -5.021 -2.138 1.00 0.00 H new ATOM 0 HB VAL A 124 4.624 -2.039 -2.665 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.840 -2.777 -4.674 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.618 -3.350 -3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.646 -4.470 -4.163 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.400 -2.444 -4.764 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.097 -4.123 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.392 -2.774 -3.334 1.00 0.00 H new ATOM 756 N ALA A 125 5.506 -2.633 -0.169 1.00 0.00 N ATOM 757 CA ALA A 125 6.570 -2.308 0.767 1.00 0.00 C ATOM 758 C ALA A 125 6.658 -3.339 1.885 1.00 0.00 C ATOM 759 O ALA A 125 7.748 -3.781 2.251 1.00 0.00 O ATOM 760 CB ALA A 125 6.356 -0.917 1.344 1.00 0.00 C ATOM 0 H ALA A 125 4.781 -1.920 -0.247 1.00 0.00 H new ATOM 0 HA ALA A 125 7.514 -2.324 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.159 -0.686 2.043 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.355 -0.184 0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.400 -0.883 1.866 1.00 0.00 H new ATOM 766 N SER A 126 5.504 -3.717 2.429 1.00 0.00 N ATOM 767 CA SER A 126 5.447 -4.690 3.508 1.00 0.00 C ATOM 768 C SER A 126 6.114 -6.003 3.105 1.00 0.00 C ATOM 769 O SER A 126 6.606 -6.746 3.955 1.00 0.00 O ATOM 770 CB SER A 126 3.995 -4.947 3.913 1.00 0.00 C ATOM 771 OG SER A 126 3.221 -5.363 2.802 1.00 0.00 O ATOM 0 H SER A 126 4.594 -3.361 2.136 1.00 0.00 H new ATOM 0 HA SER A 126 5.990 -4.278 4.358 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.961 -5.711 4.690 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.567 -4.039 4.339 1.00 0.00 H new ATOM 0 HG SER A 126 3.780 -5.368 1.997 1.00 0.00 H new ATOM 777 N LYS A 127 6.128 -6.282 1.805 1.00 0.00 N ATOM 778 CA LYS A 127 6.736 -7.505 1.295 1.00 0.00 C ATOM 779 C LYS A 127 8.239 -7.331 1.108 1.00 0.00 C ATOM 780 O LYS A 127 8.997 -8.300 1.159 1.00 0.00 O ATOM 781 CB LYS A 127 6.087 -7.907 -0.031 1.00 0.00 C ATOM 782 CG LYS A 127 4.767 -8.642 0.135 1.00 0.00 C ATOM 783 CD LYS A 127 4.099 -8.899 -1.205 1.00 0.00 C ATOM 784 CE LYS A 127 2.610 -8.593 -1.153 1.00 0.00 C ATOM 785 NZ LYS A 127 1.794 -9.822 -0.948 1.00 0.00 N ATOM 0 H LYS A 127 5.726 -5.679 1.087 1.00 0.00 H new ATOM 0 HA LYS A 127 6.570 -8.295 2.027 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.922 -7.012 -0.631 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.778 -8.540 -0.587 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.939 -9.590 0.644 1.00 0.00 H new ATOM 0 HG3 LYS A 127 4.101 -8.056 0.768 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.571 -8.285 -1.972 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.248 -9.940 -1.493 1.00 0.00 H new ATOM 0 HE2 LYS A 127 2.413 -7.888 -0.345 1.00 0.00 H new ATOM 0 HE3 LYS A 127 2.307 -8.107 -2.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.282 -10.049 -1.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.418 -10.615 -0.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 1.112 -9.662 -0.180 1.00 0.00 H new ATOM 799 N GLY A 128 8.665 -6.091 0.890 1.00 0.00 N ATOM 800 CA GLY A 128 10.078 -5.818 0.699 1.00 0.00 C ATOM 801 C GLY A 128 10.325 -4.537 -0.075 1.00 0.00 C ATOM 802 O GLY A 128 11.390 -3.929 0.042 1.00 0.00 O ATOM 0 H GLY A 128 8.059 -5.272 0.842 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.566 -5.750 1.671 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.537 -6.653 0.169 1.00 0.00 H new ATOM 806 N GLY A 129 9.341 -4.123 -0.869 1.00 0.00 N ATOM 807 CA GLY A 129 9.481 -2.909 -1.650 1.00 0.00 C ATOM 808 C GLY A 129 9.019 -3.084 -3.084 1.00 0.00 C ATOM 809 O GLY A 129 8.245 -2.276 -3.595 1.00 0.00 O ATOM 0 H GLY A 129 8.451 -4.607 -0.984 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.905 -2.111 -1.181 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.525 -2.595 -1.644 1.00 0.00 H new ATOM 813 N PHE A 130 9.497 -4.142 -3.733 1.00 0.00 N ATOM 814 CA PHE A 130 9.128 -4.418 -5.116 1.00 0.00 C ATOM 815 C PHE A 130 9.747 -5.727 -5.593 1.00 0.00 C ATOM 816 O PHE A 130 9.049 -6.617 -6.080 1.00 0.00 O ATOM 817 CB PHE A 130 9.577 -3.271 -6.023 1.00 0.00 C ATOM 818 CG PHE A 130 8.752 -3.131 -7.272 1.00 0.00 C ATOM 819 CD1 PHE A 130 9.089 -3.826 -8.422 1.00 0.00 C ATOM 820 CD2 PHE A 130 7.642 -2.302 -7.294 1.00 0.00 C ATOM 821 CE1 PHE A 130 8.333 -3.696 -9.573 1.00 0.00 C ATOM 822 CE2 PHE A 130 6.883 -2.169 -8.441 1.00 0.00 C ATOM 823 CZ PHE A 130 7.229 -2.867 -9.581 1.00 0.00 C ATOM 0 H PHE A 130 10.139 -4.820 -3.324 1.00 0.00 H new ATOM 0 HA PHE A 130 8.043 -4.510 -5.165 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.533 -2.337 -5.462 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.619 -3.426 -6.302 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.951 -4.476 -8.420 1.00 0.00 H new ATOM 0 HD2 PHE A 130 7.367 -1.754 -6.405 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.606 -4.242 -10.464 1.00 0.00 H new ATOM 0 HE2 PHE A 130 6.020 -1.520 -8.446 1.00 0.00 H new ATOM 0 HZ PHE A 130 6.637 -2.765 -10.478 1.00 0.00 H new ATOM 833 N GLU A 131 11.063 -5.840 -5.446 1.00 0.00 N ATOM 834 CA GLU A 131 11.779 -7.039 -5.861 1.00 0.00 C ATOM 835 C GLU A 131 11.263 -8.268 -5.120 1.00 0.00 C ATOM 836 O GLU A 131 11.083 -9.332 -5.711 1.00 0.00 O ATOM 837 CB GLU A 131 13.280 -6.872 -5.611 1.00 0.00 C ATOM 838 CG GLU A 131 13.912 -5.753 -6.422 1.00 0.00 C ATOM 839 CD GLU A 131 15.354 -6.040 -6.788 1.00 0.00 C ATOM 840 OE1 GLU A 131 15.582 -6.749 -7.793 1.00 0.00 O ATOM 841 OE2 GLU A 131 16.257 -5.559 -6.072 1.00 0.00 O ATOM 0 H GLU A 131 11.655 -5.114 -5.042 1.00 0.00 H new ATOM 0 HA GLU A 131 11.607 -7.183 -6.928 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.444 -6.678 -4.551 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.785 -7.809 -5.845 1.00 0.00 H new ATOM 0 HG2 GLU A 131 13.334 -5.599 -7.333 1.00 0.00 H new ATOM 0 HG3 GLU A 131 13.864 -4.825 -5.853 1.00 0.00 H new ATOM 848 N MET A 132 11.026 -8.113 -3.821 1.00 0.00 N ATOM 849 CA MET A 132 10.530 -9.210 -3.000 1.00 0.00 C ATOM 850 C MET A 132 9.173 -9.695 -3.499 1.00 0.00 C ATOM 851 O MET A 132 8.895 -10.894 -3.508 1.00 0.00 O ATOM 852 CB MET A 132 10.421 -8.771 -1.538 1.00 0.00 C ATOM 853 CG MET A 132 11.727 -8.885 -0.768 1.00 0.00 C ATOM 854 SD MET A 132 12.109 -10.584 -0.297 1.00 0.00 S ATOM 855 CE MET A 132 13.211 -11.064 -1.623 1.00 0.00 C ATOM 0 H MET A 132 11.170 -7.239 -3.315 1.00 0.00 H new ATOM 0 HA MET A 132 11.239 -10.034 -3.074 1.00 0.00 H new ATOM 0 HB2 MET A 132 10.077 -7.737 -1.503 1.00 0.00 H new ATOM 0 HB3 MET A 132 9.662 -9.376 -1.041 1.00 0.00 H new ATOM 0 HG2 MET A 132 12.539 -8.490 -1.378 1.00 0.00 H new ATOM 0 HG3 MET A 132 11.671 -8.267 0.128 1.00 0.00 H new ATOM 0 HE1 MET A 132 12.772 -11.893 -2.179 1.00 0.00 H new ATOM 0 HE2 MET A 132 13.364 -10.218 -2.293 1.00 0.00 H new ATOM 0 HE3 MET A 132 14.169 -11.374 -1.206 1.00 0.00 H new ATOM 865 N VAL A 133 8.330 -8.755 -3.914 1.00 0.00 N ATOM 866 CA VAL A 133 7.002 -9.084 -4.415 1.00 0.00 C ATOM 867 C VAL A 133 7.087 -9.853 -5.730 1.00 0.00 C ATOM 868 O VAL A 133 6.416 -10.870 -5.911 1.00 0.00 O ATOM 869 CB VAL A 133 6.150 -7.820 -4.628 1.00 0.00 C ATOM 870 CG1 VAL A 133 4.710 -8.192 -4.945 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.219 -6.918 -3.404 1.00 0.00 C ATOM 0 H VAL A 133 8.544 -7.758 -3.913 1.00 0.00 H new ATOM 0 HA VAL A 133 6.526 -9.709 -3.659 1.00 0.00 H new ATOM 0 HB VAL A 133 6.553 -7.271 -5.479 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.124 -7.285 -5.092 1.00 0.00 H new ATOM 0 HG12 VAL A 133 4.681 -8.794 -5.853 1.00 0.00 H new ATOM 0 HG13 VAL A 133 4.291 -8.764 -4.117 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.611 -6.029 -3.572 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.843 -7.456 -2.534 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.253 -6.622 -3.228 1.00 0.00 H new ATOM 881 N THR A 134 7.914 -9.359 -6.646 1.00 0.00 N ATOM 882 CA THR A 134 8.085 -9.998 -7.944 1.00 0.00 C ATOM 883 C THR A 134 8.823 -11.326 -7.806 1.00 0.00 C ATOM 884 O THR A 134 8.501 -12.300 -8.485 1.00 0.00 O ATOM 885 CB THR A 134 8.849 -9.074 -8.894 1.00 0.00 C ATOM 886 OG1 THR A 134 8.481 -7.723 -8.684 1.00 0.00 O ATOM 887 CG2 THR A 134 8.617 -9.392 -10.355 1.00 0.00 C ATOM 0 H THR A 134 8.476 -8.518 -6.512 1.00 0.00 H new ATOM 0 HA THR A 134 7.095 -10.195 -8.356 1.00 0.00 H new ATOM 0 HB THR A 134 9.903 -9.236 -8.667 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.981 -7.148 -9.300 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.188 -8.699 -10.973 1.00 0.00 H new ATOM 0 HG22 THR A 134 8.939 -10.413 -10.561 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.556 -9.293 -10.585 1.00 0.00 H new ATOM 895 N LYS A 135 9.819 -11.355 -6.926 1.00 0.00 N ATOM 896 CA LYS A 135 10.605 -12.555 -6.701 1.00 0.00 C ATOM 897 C LYS A 135 9.733 -13.693 -6.182 1.00 0.00 C ATOM 898 O LYS A 135 9.991 -14.863 -6.458 1.00 0.00 O ATOM 899 CB LYS A 135 11.735 -12.271 -5.710 1.00 0.00 C ATOM 900 CG LYS A 135 12.896 -11.499 -6.317 1.00 0.00 C ATOM 901 CD LYS A 135 14.032 -12.426 -6.721 1.00 0.00 C ATOM 902 CE LYS A 135 14.642 -12.013 -8.052 1.00 0.00 C ATOM 903 NZ LYS A 135 16.125 -12.154 -8.051 1.00 0.00 N ATOM 0 H LYS A 135 10.099 -10.556 -6.357 1.00 0.00 H new ATOM 0 HA LYS A 135 11.034 -12.859 -7.656 1.00 0.00 H new ATOM 0 HB2 LYS A 135 11.335 -11.707 -4.867 1.00 0.00 H new ATOM 0 HB3 LYS A 135 12.106 -13.216 -5.313 1.00 0.00 H new ATOM 0 HG2 LYS A 135 12.549 -10.945 -7.189 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.262 -10.765 -5.598 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.801 -12.418 -5.949 1.00 0.00 H new ATOM 0 HD3 LYS A 135 13.661 -13.449 -6.791 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.220 -12.624 -8.850 1.00 0.00 H new ATOM 0 HE3 LYS A 135 14.376 -10.978 -8.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.502 -11.863 -8.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 16.530 -11.552 -7.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 16.379 -13.146 -7.870 1.00 0.00 H new ATOM 917 N GLU A 136 8.697 -13.340 -5.427 1.00 0.00 N ATOM 918 CA GLU A 136 7.784 -14.332 -4.869 1.00 0.00 C ATOM 919 C GLU A 136 6.471 -14.385 -5.650 1.00 0.00 C ATOM 920 O GLU A 136 5.581 -15.173 -5.327 1.00 0.00 O ATOM 921 CB GLU A 136 7.502 -14.020 -3.399 1.00 0.00 C ATOM 922 CG GLU A 136 8.539 -14.594 -2.446 1.00 0.00 C ATOM 923 CD GLU A 136 7.965 -15.656 -1.528 1.00 0.00 C ATOM 924 OE1 GLU A 136 7.468 -16.680 -2.044 1.00 0.00 O ATOM 925 OE2 GLU A 136 8.012 -15.464 -0.296 1.00 0.00 O ATOM 0 H GLU A 136 8.469 -12.375 -5.188 1.00 0.00 H new ATOM 0 HA GLU A 136 8.264 -15.308 -4.947 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.459 -12.939 -3.267 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.520 -14.413 -3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.359 -15.022 -3.023 1.00 0.00 H new ATOM 0 HG3 GLU A 136 8.959 -13.788 -1.844 1.00 0.00 H new ATOM 932 N LYS A 137 6.351 -13.546 -6.676 1.00 0.00 N ATOM 933 CA LYS A 137 5.142 -13.507 -7.492 1.00 0.00 C ATOM 934 C LYS A 137 3.923 -13.163 -6.642 1.00 0.00 C ATOM 935 O LYS A 137 2.808 -13.599 -6.930 1.00 0.00 O ATOM 936 CB LYS A 137 4.931 -14.852 -8.192 1.00 0.00 C ATOM 937 CG LYS A 137 5.507 -14.903 -9.598 1.00 0.00 C ATOM 938 CD LYS A 137 6.108 -16.265 -9.907 1.00 0.00 C ATOM 939 CE LYS A 137 5.064 -17.221 -10.461 1.00 0.00 C ATOM 940 NZ LYS A 137 4.614 -16.822 -11.824 1.00 0.00 N ATOM 0 H LYS A 137 7.075 -12.886 -6.961 1.00 0.00 H new ATOM 0 HA LYS A 137 5.266 -12.730 -8.246 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.387 -15.640 -7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 137 3.863 -15.065 -8.238 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.723 -14.678 -10.321 1.00 0.00 H new ATOM 0 HG3 LYS A 137 6.272 -14.134 -9.707 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.918 -16.152 -10.628 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.544 -16.686 -9.001 1.00 0.00 H new ATOM 0 HE2 LYS A 137 5.477 -18.229 -10.495 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.206 -17.251 -9.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 4.213 -17.648 -12.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 3.890 -16.080 -11.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.425 -16.460 -12.365 1.00 0.00 H new ATOM 954 N LYS A 138 4.144 -12.378 -5.593 1.00 0.00 N ATOM 955 CA LYS A 138 3.065 -11.973 -4.698 1.00 0.00 C ATOM 956 C LYS A 138 2.151 -10.943 -5.361 1.00 0.00 C ATOM 957 O LYS A 138 1.069 -10.645 -4.853 1.00 0.00 O ATOM 958 CB LYS A 138 3.640 -11.400 -3.402 1.00 0.00 C ATOM 959 CG LYS A 138 3.880 -12.449 -2.327 1.00 0.00 C ATOM 960 CD LYS A 138 5.213 -12.237 -1.621 1.00 0.00 C ATOM 961 CE LYS A 138 5.022 -11.977 -0.134 1.00 0.00 C ATOM 962 NZ LYS A 138 4.946 -13.244 0.646 1.00 0.00 N ATOM 0 H LYS A 138 5.061 -12.009 -5.341 1.00 0.00 H new ATOM 0 HA LYS A 138 2.471 -12.858 -4.469 1.00 0.00 H new ATOM 0 HB2 LYS A 138 4.581 -10.896 -3.623 1.00 0.00 H new ATOM 0 HB3 LYS A 138 2.957 -10.644 -3.014 1.00 0.00 H new ATOM 0 HG2 LYS A 138 3.072 -12.413 -1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 138 3.860 -13.442 -2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 138 5.843 -13.116 -1.760 1.00 0.00 H new ATOM 0 HD3 LYS A 138 5.736 -11.395 -2.074 1.00 0.00 H new ATOM 0 HE2 LYS A 138 5.848 -11.371 0.238 1.00 0.00 H new ATOM 0 HE3 LYS A 138 4.110 -11.401 0.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 4.816 -13.024 1.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 4.142 -13.812 0.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 5.827 -13.782 0.520 1.00 0.00 H new ATOM 976 N TRP A 139 2.587 -10.399 -6.497 1.00 0.00 N ATOM 977 CA TRP A 139 1.802 -9.404 -7.220 1.00 0.00 C ATOM 978 C TRP A 139 0.392 -9.916 -7.504 1.00 0.00 C ATOM 979 O TRP A 139 -0.582 -9.169 -7.409 1.00 0.00 O ATOM 980 CB TRP A 139 2.496 -9.033 -8.533 1.00 0.00 C ATOM 981 CG TRP A 139 3.720 -8.191 -8.341 1.00 0.00 C ATOM 982 CD1 TRP A 139 5.013 -8.559 -8.574 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.764 -6.837 -7.876 1.00 0.00 C ATOM 984 NE1 TRP A 139 5.860 -7.517 -8.282 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.117 -6.449 -7.853 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.791 -5.915 -7.479 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.520 -5.179 -7.446 1.00 0.00 C ATOM 988 CZ3 TRP A 139 3.192 -4.655 -7.077 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.546 -4.297 -7.064 1.00 0.00 C ATOM 0 H TRP A 139 3.479 -10.631 -6.934 1.00 0.00 H new ATOM 0 HA TRP A 139 1.724 -8.516 -6.592 1.00 0.00 H new ATOM 0 HB2 TRP A 139 2.771 -9.946 -9.061 1.00 0.00 H new ATOM 0 HB3 TRP A 139 1.791 -8.497 -9.169 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.325 -9.528 -8.935 1.00 0.00 H new ATOM 0 HE1 TRP A 139 6.876 -7.536 -8.370 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.745 -6.183 -7.486 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.563 -4.901 -7.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.449 -3.935 -6.768 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.827 -3.304 -6.746 1.00 0.00 H new ATOM 1000 N SER A 140 0.291 -11.195 -7.854 1.00 0.00 N ATOM 1001 CA SER A 140 -1.000 -11.806 -8.151 1.00 0.00 C ATOM 1002 C SER A 140 -1.839 -11.951 -6.885 1.00 0.00 C ATOM 1003 O SER A 140 -3.066 -11.854 -6.926 1.00 0.00 O ATOM 1004 CB SER A 140 -0.802 -13.175 -8.803 1.00 0.00 C ATOM 1005 OG SER A 140 -0.189 -13.050 -10.074 1.00 0.00 O ATOM 0 H SER A 140 1.087 -11.827 -7.939 1.00 0.00 H new ATOM 0 HA SER A 140 -1.531 -11.153 -8.844 1.00 0.00 H new ATOM 0 HB2 SER A 140 -0.186 -13.803 -8.159 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.765 -13.674 -8.908 1.00 0.00 H new ATOM 0 HG SER A 140 -0.072 -13.939 -10.469 1.00 0.00 H new ATOM 1011 N LYS A 141 -1.169 -12.184 -5.760 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.853 -12.343 -4.482 1.00 0.00 C ATOM 1013 C LYS A 141 -2.400 -11.008 -3.986 1.00 0.00 C ATOM 1014 O LYS A 141 -3.433 -10.960 -3.318 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.900 -12.933 -3.441 1.00 0.00 C ATOM 1016 CG LYS A 141 -0.799 -14.449 -3.499 1.00 0.00 C ATOM 1017 CD LYS A 141 0.227 -14.901 -4.524 1.00 0.00 C ATOM 1018 CE LYS A 141 1.564 -15.217 -3.872 1.00 0.00 C ATOM 1019 NZ LYS A 141 1.708 -16.668 -3.575 1.00 0.00 N ATOM 0 H LYS A 141 -0.154 -12.267 -5.708 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.690 -13.026 -4.629 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.092 -12.505 -3.585 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -1.233 -12.637 -2.446 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.527 -14.834 -2.516 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -1.773 -14.870 -3.748 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.143 -15.784 -5.045 1.00 0.00 H new ATOM 0 HD3 LYS A 141 0.362 -14.121 -5.274 1.00 0.00 H new ATOM 0 HE2 LYS A 141 2.373 -14.899 -4.530 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.661 -14.646 -2.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 2.632 -16.841 -3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 0.951 -16.966 -2.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 1.641 -17.212 -4.459 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.702 -9.928 -4.318 1.00 0.00 N ATOM 1034 CA VAL A 142 -2.118 -8.593 -3.906 1.00 0.00 C ATOM 1035 C VAL A 142 -3.412 -8.182 -4.601 1.00 0.00 C ATOM 1036 O VAL A 142 -4.340 -7.685 -3.963 1.00 0.00 O ATOM 1037 CB VAL A 142 -1.030 -7.544 -4.207 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -1.411 -6.194 -3.619 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.320 -8.004 -3.676 1.00 0.00 C ATOM 0 H VAL A 142 -0.845 -9.951 -4.871 1.00 0.00 H new ATOM 0 HA VAL A 142 -2.283 -8.633 -2.829 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.949 -7.433 -5.288 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.630 -5.467 -3.842 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.353 -5.860 -4.054 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.523 -6.286 -2.539 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.075 -7.250 -3.899 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.257 -8.147 -2.597 1.00 0.00 H new ATOM 0 HG23 VAL A 142 0.596 -8.945 -4.151 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.464 -8.389 -5.912 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.648 -8.034 -6.672 1.00 0.00 C ATOM 1051 C GLY A 143 -5.864 -8.839 -6.262 1.00 0.00 C ATOM 1052 O GLY A 143 -6.971 -8.305 -6.179 1.00 0.00 O ATOM 0 H GLY A 143 -2.708 -8.796 -6.462 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.857 -6.973 -6.538 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.455 -8.189 -7.733 1.00 0.00 H new ATOM 1056 N SER A 144 -5.662 -10.128 -6.006 1.00 0.00 N ATOM 1057 CA SER A 144 -6.751 -11.008 -5.604 1.00 0.00 C ATOM 1058 C SER A 144 -7.351 -10.559 -4.275 1.00 0.00 C ATOM 1059 O SER A 144 -8.562 -10.640 -4.070 1.00 0.00 O ATOM 1060 CB SER A 144 -6.256 -12.451 -5.492 1.00 0.00 C ATOM 1061 OG SER A 144 -6.315 -13.109 -6.744 1.00 0.00 O ATOM 0 H SER A 144 -4.753 -10.585 -6.070 1.00 0.00 H new ATOM 0 HA SER A 144 -7.526 -10.957 -6.368 1.00 0.00 H new ATOM 0 HB2 SER A 144 -5.231 -12.459 -5.121 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.862 -12.991 -4.765 1.00 0.00 H new ATOM 0 HG SER A 144 -5.992 -14.029 -6.646 1.00 0.00 H new ATOM 1067 N ARG A 145 -6.495 -10.086 -3.375 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.940 -9.624 -2.066 1.00 0.00 C ATOM 1069 C ARG A 145 -7.872 -8.425 -2.200 1.00 0.00 C ATOM 1070 O ARG A 145 -8.778 -8.237 -1.387 1.00 0.00 O ATOM 1071 CB ARG A 145 -5.736 -9.255 -1.197 1.00 0.00 C ATOM 1072 CG ARG A 145 -5.238 -10.401 -0.329 1.00 0.00 C ATOM 1073 CD ARG A 145 -4.351 -9.902 0.802 1.00 0.00 C ATOM 1074 NE ARG A 145 -4.778 -10.416 2.101 1.00 0.00 N ATOM 1075 CZ ARG A 145 -5.799 -9.918 2.796 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -6.497 -8.895 2.321 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -6.120 -10.445 3.968 1.00 0.00 N ATOM 0 H ARG A 145 -5.489 -10.013 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 145 -7.489 -10.436 -1.589 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.923 -8.918 -1.841 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -6.005 -8.415 -0.556 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -6.089 -10.940 0.086 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -4.681 -11.109 -0.944 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -3.320 -10.203 0.614 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -4.366 -8.812 0.821 1.00 0.00 H new ATOM 0 HE ARG A 145 -4.264 -11.202 2.499 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -6.253 -8.486 1.419 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -7.278 -8.518 2.858 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -5.585 -11.231 4.337 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -6.902 -10.064 4.501 1.00 0.00 H new ATOM 1091 N LEU A 146 -7.645 -7.616 -3.229 1.00 0.00 N ATOM 1092 CA LEU A 146 -8.466 -6.436 -3.469 1.00 0.00 C ATOM 1093 C LEU A 146 -9.803 -6.820 -4.097 1.00 0.00 C ATOM 1094 O LEU A 146 -10.866 -6.532 -3.546 1.00 0.00 O ATOM 1095 CB LEU A 146 -7.723 -5.448 -4.374 1.00 0.00 C ATOM 1096 CG LEU A 146 -7.397 -4.098 -3.727 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.904 -3.817 -3.794 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -8.182 -2.979 -4.398 1.00 0.00 C ATOM 0 H LEU A 146 -6.899 -7.756 -3.910 1.00 0.00 H new ATOM 0 HA LEU A 146 -8.663 -5.959 -2.509 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.793 -5.910 -4.704 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -8.325 -5.271 -5.265 1.00 0.00 H new ATOM 0 HG LEU A 146 -7.690 -4.143 -2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -5.694 -2.854 -3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.362 -4.601 -3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -5.584 -3.795 -4.836 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.937 -2.028 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.922 -2.936 -5.456 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.250 -3.171 -4.295 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.741 -7.473 -5.253 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.951 -7.888 -5.938 1.00 0.00 C ATOM 1112 C GLY A 147 -10.692 -8.310 -7.370 1.00 0.00 C ATOM 1113 O GLY A 147 -11.454 -7.965 -8.273 1.00 0.00 O ATOM 0 H GLY A 147 -8.873 -7.722 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -11.406 -8.717 -5.395 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.669 -7.068 -5.929 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.614 -9.059 -7.578 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.255 -9.530 -8.911 1.00 0.00 C ATOM 1119 C TYR A 148 -9.449 -11.039 -9.025 1.00 0.00 C ATOM 1120 O TYR A 148 -9.042 -11.796 -8.145 1.00 0.00 O ATOM 1121 CB TYR A 148 -7.804 -9.166 -9.229 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.586 -7.686 -9.453 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -7.901 -6.762 -8.465 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -7.066 -7.215 -10.651 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -7.702 -5.408 -8.665 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.864 -5.864 -10.859 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.184 -4.965 -9.864 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.985 -3.619 -10.067 1.00 0.00 O ATOM 0 H TYR A 148 -8.974 -9.353 -6.840 1.00 0.00 H new ATOM 0 HA TYR A 148 -9.911 -9.042 -9.631 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -7.167 -9.499 -8.410 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -7.488 -9.710 -10.119 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -8.308 -7.106 -7.526 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.815 -7.916 -11.433 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -7.951 -4.702 -7.887 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.457 -5.514 -11.796 1.00 0.00 H new ATOM 0 HH TYR A 148 -6.613 -3.475 -10.962 1.00 0.00 H new ATOM 1138 N LEU A 149 -10.074 -11.470 -10.116 1.00 0.00 N ATOM 1139 CA LEU A 149 -10.323 -12.888 -10.346 1.00 0.00 C ATOM 1140 C LEU A 149 -9.140 -13.539 -11.056 1.00 0.00 C ATOM 1141 O LEU A 149 -8.428 -12.889 -11.820 1.00 0.00 O ATOM 1142 CB LEU A 149 -11.596 -13.077 -11.172 1.00 0.00 C ATOM 1143 CG LEU A 149 -12.858 -12.458 -10.569 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -14.061 -12.722 -11.460 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -13.100 -13.002 -9.168 1.00 0.00 C ATOM 0 H LEU A 149 -10.417 -10.857 -10.855 1.00 0.00 H new ATOM 0 HA LEU A 149 -10.453 -13.371 -9.377 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -11.436 -12.647 -12.161 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -11.765 -14.145 -11.312 1.00 0.00 H new ATOM 0 HG LEU A 149 -12.714 -11.380 -10.500 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -14.949 -12.274 -11.014 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.888 -12.285 -12.443 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.209 -13.797 -11.562 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -14.002 -12.551 -8.753 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -13.223 -14.084 -9.214 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -12.248 -12.761 -8.532 1.00 0.00 H new ATOM 1157 N PRO A 150 -8.916 -14.844 -10.815 1.00 0.00 N ATOM 1158 CA PRO A 150 -7.812 -15.582 -11.438 1.00 0.00 C ATOM 1159 C PRO A 150 -8.036 -15.810 -12.928 1.00 0.00 C ATOM 1160 O PRO A 150 -8.668 -16.787 -13.331 1.00 0.00 O ATOM 1161 CB PRO A 150 -7.811 -16.916 -10.688 1.00 0.00 C ATOM 1162 CG PRO A 150 -9.212 -17.082 -10.210 1.00 0.00 C ATOM 1163 CD PRO A 150 -9.718 -15.696 -9.919 1.00 0.00 C ATOM 0 HA PRO A 150 -6.869 -15.039 -11.372 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -7.515 -17.737 -11.341 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.108 -16.902 -9.855 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -9.827 -17.571 -10.966 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -9.248 -17.706 -9.317 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -10.784 -15.606 -10.127 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -9.573 -15.427 -8.873 1.00 0.00 H new ATOM 1171 N GLY A 151 -7.513 -14.900 -13.746 1.00 0.00 N ATOM 1172 CA GLY A 151 -7.665 -15.020 -15.184 1.00 0.00 C ATOM 1173 C GLY A 151 -6.337 -15.178 -15.898 1.00 0.00 C ATOM 1174 O GLY A 151 -5.279 -15.137 -15.269 1.00 0.00 O ATOM 0 H GLY A 151 -6.987 -14.082 -13.438 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -8.299 -15.878 -15.409 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -8.177 -14.137 -15.567 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.393 -15.359 -17.213 1.00 0.00 N ATOM 1179 CA LYS A 152 -5.185 -15.523 -18.013 1.00 0.00 C ATOM 1180 C LYS A 152 -4.346 -14.249 -17.999 1.00 0.00 C ATOM 1181 O LYS A 152 -4.648 -13.287 -18.706 1.00 0.00 O ATOM 1182 CB LYS A 152 -5.547 -15.894 -19.452 1.00 0.00 C ATOM 1183 CG LYS A 152 -6.479 -17.090 -19.556 1.00 0.00 C ATOM 1184 CD LYS A 152 -5.795 -18.370 -19.103 1.00 0.00 C ATOM 1185 CE LYS A 152 -6.772 -19.532 -19.043 1.00 0.00 C ATOM 1186 NZ LYS A 152 -6.112 -20.788 -18.594 1.00 0.00 N ATOM 0 H LYS A 152 -7.261 -15.396 -17.747 1.00 0.00 H new ATOM 0 HA LYS A 152 -4.596 -16.329 -17.575 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -6.016 -15.036 -19.933 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -4.632 -16.108 -20.004 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -7.366 -16.915 -18.947 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -6.816 -17.201 -20.587 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.982 -18.612 -19.788 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.349 -18.217 -18.120 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -7.587 -19.287 -18.362 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -7.214 -19.686 -20.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -6.812 -21.557 -18.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -5.351 -21.036 -19.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -5.712 -20.649 -17.644 1.00 0.00 H new ATOM 1200 N GLY A 153 -3.292 -14.249 -17.191 1.00 0.00 N ATOM 1201 CA GLY A 153 -2.427 -13.088 -17.101 1.00 0.00 C ATOM 1202 C GLY A 153 -3.039 -11.972 -16.278 1.00 0.00 C ATOM 1203 O GLY A 153 -4.183 -11.577 -16.510 1.00 0.00 O ATOM 0 H GLY A 153 -3.021 -15.032 -16.597 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -1.475 -13.381 -16.659 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.212 -12.720 -18.104 1.00 0.00 H new ATOM 1207 N THR A 154 -2.279 -11.463 -15.314 1.00 0.00 N ATOM 1208 CA THR A 154 -2.757 -10.385 -14.454 1.00 0.00 C ATOM 1209 C THR A 154 -1.593 -9.684 -13.762 1.00 0.00 C ATOM 1210 O THR A 154 -1.545 -8.456 -13.695 1.00 0.00 O ATOM 1211 CB THR A 154 -3.731 -10.931 -13.410 1.00 0.00 C ATOM 1212 OG1 THR A 154 -4.429 -12.057 -13.913 1.00 0.00 O ATOM 1213 CG2 THR A 154 -4.762 -9.915 -12.966 1.00 0.00 C ATOM 0 H THR A 154 -1.331 -11.779 -15.108 1.00 0.00 H new ATOM 0 HA THR A 154 -3.275 -9.658 -15.080 1.00 0.00 H new ATOM 0 HB THR A 154 -3.114 -11.200 -12.553 1.00 0.00 H new ATOM 0 HG1 THR A 154 -5.046 -12.392 -13.229 1.00 0.00 H new ATOM 0 HG21 THR A 154 -5.422 -10.366 -12.225 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.258 -9.054 -12.527 1.00 0.00 H new ATOM 0 HG23 THR A 154 -5.349 -9.593 -13.826 1.00 0.00 H new ATOM 1221 N GLY A 155 -0.655 -10.473 -13.246 1.00 0.00 N ATOM 1222 CA GLY A 155 0.496 -9.910 -12.563 1.00 0.00 C ATOM 1223 C GLY A 155 1.279 -8.949 -13.438 1.00 0.00 C ATOM 1224 O GLY A 155 1.781 -7.933 -12.958 1.00 0.00 O ATOM 0 H GLY A 155 -0.672 -11.492 -13.289 1.00 0.00 H new ATOM 0 HA2 GLY A 155 0.163 -9.389 -11.665 1.00 0.00 H new ATOM 0 HA3 GLY A 155 1.152 -10.717 -12.238 1.00 0.00 H new ATOM 1228 N SER A 156 1.381 -9.271 -14.723 1.00 0.00 N ATOM 1229 CA SER A 156 2.107 -8.427 -15.666 1.00 0.00 C ATOM 1230 C SER A 156 1.392 -7.094 -15.865 1.00 0.00 C ATOM 1231 O SER A 156 2.031 -6.055 -16.029 1.00 0.00 O ATOM 1232 CB SER A 156 2.263 -9.144 -17.009 1.00 0.00 C ATOM 1233 OG SER A 156 2.579 -10.511 -16.824 1.00 0.00 O ATOM 0 H SER A 156 0.971 -10.109 -15.135 1.00 0.00 H new ATOM 0 HA SER A 156 3.096 -8.229 -15.252 1.00 0.00 H new ATOM 0 HB2 SER A 156 1.340 -9.055 -17.581 1.00 0.00 H new ATOM 0 HB3 SER A 156 3.047 -8.662 -17.593 1.00 0.00 H new ATOM 0 HG SER A 156 2.672 -10.946 -17.697 1.00 0.00 H new ATOM 1239 N LEU A 157 0.065 -7.134 -15.849 1.00 0.00 N ATOM 1240 CA LEU A 157 -0.738 -5.929 -16.028 1.00 0.00 C ATOM 1241 C LEU A 157 -0.698 -5.061 -14.774 1.00 0.00 C ATOM 1242 O LEU A 157 -0.511 -3.847 -14.852 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.185 -6.299 -16.358 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.421 -6.761 -17.798 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -3.413 -7.915 -17.834 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -2.917 -5.605 -18.653 1.00 0.00 C ATOM 0 H LEU A 157 -0.478 -7.987 -15.714 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.317 -5.361 -16.858 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.505 -7.091 -15.681 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.819 -5.435 -16.161 1.00 0.00 H new ATOM 0 HG LEU A 157 -1.473 -7.111 -18.207 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -3.568 -8.230 -18.866 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -3.020 -8.751 -17.255 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -4.362 -7.592 -17.407 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -3.080 -5.951 -19.674 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -3.854 -5.226 -18.245 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -2.173 -4.808 -18.654 1.00 0.00 H new ATOM 1258 N LEU A 158 -0.875 -5.693 -13.618 1.00 0.00 N ATOM 1259 CA LEU A 158 -0.858 -4.979 -12.347 1.00 0.00 C ATOM 1260 C LEU A 158 0.495 -4.317 -12.112 1.00 0.00 C ATOM 1261 O LEU A 158 0.568 -3.156 -11.705 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.178 -5.936 -11.197 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.481 -6.722 -11.352 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -2.376 -8.072 -10.661 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.652 -5.925 -10.795 1.00 0.00 C ATOM 0 H LEU A 158 -1.032 -6.698 -13.536 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.620 -4.201 -12.386 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.355 -6.643 -11.093 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.225 -5.364 -10.271 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.656 -6.894 -12.414 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -3.312 -8.617 -10.782 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -1.563 -8.646 -11.105 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.178 -7.923 -9.600 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.571 -6.498 -10.913 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.484 -5.723 -9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.740 -4.982 -11.335 1.00 0.00 H new ATOM 1277 N LYS A 159 1.566 -5.060 -12.371 1.00 0.00 N ATOM 1278 CA LYS A 159 2.917 -4.544 -12.190 1.00 0.00 C ATOM 1279 C LYS A 159 3.184 -3.377 -13.135 1.00 0.00 C ATOM 1280 O LYS A 159 3.822 -2.393 -12.760 1.00 0.00 O ATOM 1281 CB LYS A 159 3.945 -5.653 -12.427 1.00 0.00 C ATOM 1282 CG LYS A 159 5.144 -5.581 -11.494 1.00 0.00 C ATOM 1283 CD LYS A 159 6.403 -5.139 -12.229 1.00 0.00 C ATOM 1284 CE LYS A 159 7.428 -6.261 -12.306 1.00 0.00 C ATOM 1285 NZ LYS A 159 8.241 -6.187 -13.550 1.00 0.00 N ATOM 0 H LYS A 159 1.524 -6.022 -12.707 1.00 0.00 H new ATOM 0 HA LYS A 159 3.009 -4.186 -11.164 1.00 0.00 H new ATOM 0 HB2 LYS A 159 3.458 -6.621 -12.305 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.294 -5.599 -13.458 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.933 -4.885 -10.683 1.00 0.00 H new ATOM 0 HG3 LYS A 159 5.311 -6.558 -11.040 1.00 0.00 H new ATOM 0 HD2 LYS A 159 6.142 -4.814 -13.236 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.840 -4.280 -11.720 1.00 0.00 H new ATOM 0 HE2 LYS A 159 8.086 -6.211 -11.439 1.00 0.00 H new ATOM 0 HE3 LYS A 159 6.917 -7.223 -12.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 8.927 -6.969 -13.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 7.616 -6.260 -14.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 8.749 -5.280 -13.579 1.00 0.00 H new ATOM 1299 N SER A 160 2.687 -3.493 -14.364 1.00 0.00 N ATOM 1300 CA SER A 160 2.870 -2.450 -15.366 1.00 0.00 C ATOM 1301 C SER A 160 2.114 -1.182 -14.982 1.00 0.00 C ATOM 1302 O SER A 160 2.653 -0.078 -15.064 1.00 0.00 O ATOM 1303 CB SER A 160 2.401 -2.942 -16.735 1.00 0.00 C ATOM 1304 OG SER A 160 3.347 -3.828 -17.312 1.00 0.00 O ATOM 0 H SER A 160 2.154 -4.300 -14.689 1.00 0.00 H new ATOM 0 HA SER A 160 3.933 -2.214 -15.416 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.440 -3.447 -16.634 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.245 -2.090 -17.397 1.00 0.00 H new ATOM 0 HG SER A 160 3.147 -4.746 -17.034 1.00 0.00 H new ATOM 1310 N HIS A 161 0.862 -1.346 -14.568 1.00 0.00 N ATOM 1311 CA HIS A 161 0.031 -0.212 -14.175 1.00 0.00 C ATOM 1312 C HIS A 161 0.505 0.381 -12.852 1.00 0.00 C ATOM 1313 O HIS A 161 0.499 1.599 -12.668 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.433 -0.640 -14.058 1.00 0.00 C ATOM 1315 CG HIS A 161 -2.191 -0.546 -15.345 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.586 0.655 -15.899 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.628 -1.510 -16.190 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -3.234 0.424 -17.027 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.273 -0.881 -17.226 1.00 0.00 N ATOM 0 H HIS A 161 0.400 -2.252 -14.496 1.00 0.00 H new ATOM 0 HA HIS A 161 0.119 0.552 -14.947 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.474 -1.667 -13.696 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.926 -0.019 -13.310 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.494 -2.575 -16.071 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.660 1.175 -17.676 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.711 -1.346 -18.021 1.00 0.00 H new ATOM 1328 N TYR A 162 0.909 -0.487 -11.932 1.00 0.00 N ATOM 1329 CA TYR A 162 1.382 -0.051 -10.624 1.00 0.00 C ATOM 1330 C TYR A 162 2.708 0.695 -10.742 1.00 0.00 C ATOM 1331 O TYR A 162 2.969 1.636 -9.993 1.00 0.00 O ATOM 1332 CB TYR A 162 1.535 -1.256 -9.691 1.00 0.00 C ATOM 1333 CG TYR A 162 2.167 -0.922 -8.356 1.00 0.00 C ATOM 1334 CD1 TYR A 162 1.430 -0.312 -7.349 1.00 0.00 C ATOM 1335 CD2 TYR A 162 3.501 -1.217 -8.105 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.004 -0.005 -6.130 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.082 -0.913 -6.888 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.330 -0.308 -5.905 1.00 0.00 C ATOM 1339 OH TYR A 162 3.906 -0.004 -4.692 1.00 0.00 O ATOM 0 H TYR A 162 0.918 -1.498 -12.068 1.00 0.00 H new ATOM 0 HA TYR A 162 0.644 0.633 -10.205 1.00 0.00 H new ATOM 0 HB2 TYR A 162 0.553 -1.695 -9.517 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.140 -2.014 -10.189 1.00 0.00 H new ATOM 0 HD1 TYR A 162 0.391 -0.074 -7.522 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.094 -1.692 -8.873 1.00 0.00 H new ATOM 0 HE1 TYR A 162 1.417 0.470 -5.358 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.121 -1.149 -6.709 1.00 0.00 H new ATOM 0 HH TYR A 162 4.845 -0.284 -4.697 1.00 0.00 H new ATOM 1349 N GLU A 163 3.544 0.265 -11.682 1.00 0.00 N ATOM 1350 CA GLU A 163 4.845 0.890 -11.890 1.00 0.00 C ATOM 1351 C GLU A 163 4.859 1.714 -13.174 1.00 0.00 C ATOM 1352 O GLU A 163 5.397 1.283 -14.194 1.00 0.00 O ATOM 1353 CB GLU A 163 5.942 -0.175 -11.944 1.00 0.00 C ATOM 1354 CG GLU A 163 7.350 0.400 -11.908 1.00 0.00 C ATOM 1355 CD GLU A 163 8.413 -0.642 -12.200 1.00 0.00 C ATOM 1356 OE1 GLU A 163 8.397 -1.211 -13.313 1.00 0.00 O ATOM 1357 OE2 GLU A 163 9.260 -0.888 -11.317 1.00 0.00 O ATOM 0 H GLU A 163 3.344 -0.513 -12.311 1.00 0.00 H new ATOM 0 HA GLU A 163 5.035 1.559 -11.050 1.00 0.00 H new ATOM 0 HB2 GLU A 163 5.816 -0.858 -11.104 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.822 -0.763 -12.854 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.428 1.207 -12.637 1.00 0.00 H new ATOM 0 HG3 GLU A 163 7.535 0.837 -10.927 1.00 0.00 H new ATOM 1364 N ARG A 164 4.269 2.903 -13.115 1.00 0.00 N ATOM 1365 CA ARG A 164 4.221 3.786 -14.275 1.00 0.00 C ATOM 1366 C ARG A 164 3.737 5.186 -13.902 1.00 0.00 C ATOM 1367 O ARG A 164 4.171 6.175 -14.494 1.00 0.00 O ATOM 1368 CB ARG A 164 3.314 3.202 -15.354 1.00 0.00 C ATOM 1369 CG ARG A 164 1.937 2.830 -14.845 1.00 0.00 C ATOM 1370 CD ARG A 164 0.955 2.637 -15.989 1.00 0.00 C ATOM 1371 NE ARG A 164 1.379 1.576 -16.900 1.00 0.00 N ATOM 1372 CZ ARG A 164 0.947 1.458 -18.153 1.00 0.00 C ATOM 1373 NH1 ARG A 164 0.074 2.327 -18.647 1.00 0.00 N ATOM 1374 NH2 ARG A 164 1.391 0.468 -18.916 1.00 0.00 N ATOM 0 H ARG A 164 3.819 3.277 -12.280 1.00 0.00 H new ATOM 0 HA ARG A 164 5.238 3.869 -14.660 1.00 0.00 H new ATOM 0 HB2 ARG A 164 3.211 3.926 -16.163 1.00 0.00 H new ATOM 0 HB3 ARG A 164 3.788 2.317 -15.777 1.00 0.00 H new ATOM 0 HG2 ARG A 164 2.000 1.913 -14.259 1.00 0.00 H new ATOM 0 HG3 ARG A 164 1.571 3.610 -14.178 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -0.029 2.397 -15.586 1.00 0.00 H new ATOM 0 HD3 ARG A 164 0.854 3.571 -16.542 1.00 0.00 H new ATOM 0 HE ARG A 164 2.045 0.885 -16.555 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -0.270 3.091 -18.065 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -0.253 2.231 -19.608 1.00 0.00 H new ATOM 0 HH21 ARG A 164 2.063 -0.202 -18.542 1.00 0.00 H new ATOM 0 HH22 ARG A 164 1.060 0.377 -19.877 1.00 0.00 H new ATOM 1388 N ILE A 165 2.828 5.269 -12.934 1.00 0.00 N ATOM 1389 CA ILE A 165 2.287 6.558 -12.514 1.00 0.00 C ATOM 1390 C ILE A 165 2.466 6.791 -11.016 1.00 0.00 C ATOM 1391 O ILE A 165 3.028 7.806 -10.601 1.00 0.00 O ATOM 1392 CB ILE A 165 0.790 6.676 -12.858 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.523 6.180 -14.282 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.321 8.114 -12.694 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.466 5.037 -14.350 1.00 0.00 C ATOM 0 H ILE A 165 2.453 4.466 -12.429 1.00 0.00 H new ATOM 0 HA ILE A 165 2.848 7.317 -13.060 1.00 0.00 H new ATOM 0 HB ILE A 165 0.226 6.048 -12.168 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.149 7.009 -14.882 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.465 5.862 -14.729 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.739 8.181 -12.941 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.474 8.431 -11.663 1.00 0.00 H new ATOM 0 HG23 ILE A 165 0.891 8.761 -13.361 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.606 4.738 -15.389 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -0.085 4.191 -13.777 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.421 5.357 -13.933 1.00 0.00 H new ATOM 1407 N LEU A 166 1.969 5.860 -10.208 1.00 0.00 N ATOM 1408 CA LEU A 166 2.058 5.983 -8.755 1.00 0.00 C ATOM 1409 C LEU A 166 3.451 5.636 -8.237 1.00 0.00 C ATOM 1410 O LEU A 166 3.934 6.244 -7.282 1.00 0.00 O ATOM 1411 CB LEU A 166 1.012 5.088 -8.084 1.00 0.00 C ATOM 1412 CG LEU A 166 1.130 3.593 -8.396 1.00 0.00 C ATOM 1413 CD1 LEU A 166 0.787 2.763 -7.168 1.00 0.00 C ATOM 1414 CD2 LEU A 166 0.231 3.220 -9.568 1.00 0.00 C ATOM 0 H LEU A 166 1.501 5.014 -10.532 1.00 0.00 H new ATOM 0 HA LEU A 166 1.862 7.025 -8.503 1.00 0.00 H new ATOM 0 HB2 LEU A 166 1.081 5.223 -7.005 1.00 0.00 H new ATOM 0 HB3 LEU A 166 0.021 5.428 -8.385 1.00 0.00 H new ATOM 0 HG LEU A 166 2.162 3.379 -8.675 1.00 0.00 H new ATOM 0 HD11 LEU A 166 0.876 1.704 -7.408 1.00 0.00 H new ATOM 0 HD12 LEU A 166 1.473 3.010 -6.358 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -0.235 2.980 -6.856 1.00 0.00 H new ATOM 0 HD21 LEU A 166 0.328 2.154 -9.776 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -0.805 3.449 -9.319 1.00 0.00 H new ATOM 0 HD23 LEU A 166 0.527 3.790 -10.449 1.00 0.00 H new ATOM 1426 N TYR A 167 4.093 4.651 -8.857 1.00 0.00 N ATOM 1427 CA TYR A 167 5.426 4.230 -8.437 1.00 0.00 C ATOM 1428 C TYR A 167 6.479 5.301 -8.723 1.00 0.00 C ATOM 1429 O TYR A 167 7.192 5.728 -7.814 1.00 0.00 O ATOM 1430 CB TYR A 167 5.816 2.918 -9.119 1.00 0.00 C ATOM 1431 CG TYR A 167 6.779 2.083 -8.307 1.00 0.00 C ATOM 1432 CD1 TYR A 167 6.385 1.507 -7.106 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.083 1.874 -8.739 1.00 0.00 C ATOM 1434 CE1 TYR A 167 7.264 0.746 -6.359 1.00 0.00 C ATOM 1435 CE2 TYR A 167 8.966 1.114 -7.998 1.00 0.00 C ATOM 1436 CZ TYR A 167 8.553 0.553 -6.809 1.00 0.00 C ATOM 1437 OH TYR A 167 9.431 -0.204 -6.067 1.00 0.00 O ATOM 0 H TYR A 167 3.714 4.131 -9.649 1.00 0.00 H new ATOM 0 HA TYR A 167 5.390 4.077 -7.358 1.00 0.00 H new ATOM 0 HB2 TYR A 167 4.915 2.336 -9.312 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.266 3.140 -10.087 1.00 0.00 H new ATOM 0 HD1 TYR A 167 5.376 1.656 -6.751 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.411 2.313 -9.670 1.00 0.00 H new ATOM 0 HE1 TYR A 167 6.943 0.305 -5.427 1.00 0.00 H new ATOM 0 HE2 TYR A 167 9.976 0.960 -8.349 1.00 0.00 H new ATOM 0 HH TYR A 167 10.297 -0.243 -6.524 1.00 0.00 H new ATOM 1447 N PRO A 168 6.606 5.751 -9.986 1.00 0.00 N ATOM 1448 CA PRO A 168 7.593 6.768 -10.360 1.00 0.00 C ATOM 1449 C PRO A 168 7.468 8.036 -9.520 1.00 0.00 C ATOM 1450 O PRO A 168 8.441 8.769 -9.342 1.00 0.00 O ATOM 1451 CB PRO A 168 7.285 7.068 -11.835 1.00 0.00 C ATOM 1452 CG PRO A 168 5.949 6.459 -12.098 1.00 0.00 C ATOM 1453 CD PRO A 168 5.818 5.306 -11.146 1.00 0.00 C ATOM 0 HA PRO A 168 8.611 6.414 -10.196 1.00 0.00 H new ATOM 0 HB2 PRO A 168 7.270 8.142 -12.022 1.00 0.00 H new ATOM 0 HB3 PRO A 168 8.046 6.642 -12.489 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.152 7.186 -11.940 1.00 0.00 H new ATOM 0 HG3 PRO A 168 5.872 6.121 -13.131 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.778 5.117 -10.880 1.00 0.00 H new ATOM 0 HD3 PRO A 168 6.211 4.383 -11.572 1.00 0.00 H new ATOM 1461 N TYR A 169 6.271 8.289 -9.001 1.00 0.00 N ATOM 1462 CA TYR A 169 6.033 9.470 -8.178 1.00 0.00 C ATOM 1463 C TYR A 169 6.947 9.468 -6.955 1.00 0.00 C ATOM 1464 O TYR A 169 7.659 10.439 -6.698 1.00 0.00 O ATOM 1465 CB TYR A 169 4.568 9.524 -7.738 1.00 0.00 C ATOM 1466 CG TYR A 169 4.254 10.670 -6.800 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.142 11.970 -7.275 1.00 0.00 C ATOM 1468 CD2 TYR A 169 4.072 10.448 -5.441 1.00 0.00 C ATOM 1469 CE1 TYR A 169 3.856 13.019 -6.419 1.00 0.00 C ATOM 1470 CE2 TYR A 169 3.785 11.492 -4.581 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.679 12.774 -5.075 1.00 0.00 C ATOM 1472 OH TYR A 169 3.394 13.814 -4.221 1.00 0.00 O ATOM 0 H TYR A 169 5.453 7.695 -9.135 1.00 0.00 H new ATOM 0 HA TYR A 169 6.256 10.354 -8.776 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.936 9.606 -8.622 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.310 8.585 -7.248 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.280 12.165 -8.328 1.00 0.00 H new ATOM 0 HD2 TYR A 169 4.156 9.445 -5.050 1.00 0.00 H new ATOM 0 HE1 TYR A 169 3.772 14.025 -6.803 1.00 0.00 H new ATOM 0 HE2 TYR A 169 3.645 11.304 -3.527 1.00 0.00 H new ATOM 0 HH TYR A 169 3.298 13.471 -3.308 1.00 0.00 H new ATOM 1482 N GLU A 170 6.922 8.370 -6.206 1.00 0.00 N ATOM 1483 CA GLU A 170 7.744 8.242 -5.013 1.00 0.00 C ATOM 1484 C GLU A 170 9.224 8.386 -5.356 1.00 0.00 C ATOM 1485 O GLU A 170 9.946 9.157 -4.725 1.00 0.00 O ATOM 1486 CB GLU A 170 7.491 6.892 -4.338 1.00 0.00 C ATOM 1487 CG GLU A 170 7.346 6.985 -2.828 1.00 0.00 C ATOM 1488 CD GLU A 170 7.692 5.687 -2.127 1.00 0.00 C ATOM 1489 OE1 GLU A 170 6.894 4.731 -2.216 1.00 0.00 O ATOM 1490 OE2 GLU A 170 8.765 5.625 -1.489 1.00 0.00 O ATOM 0 H GLU A 170 6.340 7.557 -6.406 1.00 0.00 H new ATOM 0 HA GLU A 170 7.471 9.041 -4.324 1.00 0.00 H new ATOM 0 HB2 GLU A 170 6.586 6.451 -4.755 1.00 0.00 H new ATOM 0 HB3 GLU A 170 8.313 6.217 -4.575 1.00 0.00 H new ATOM 0 HG2 GLU A 170 7.992 7.779 -2.453 1.00 0.00 H new ATOM 0 HG3 GLU A 170 6.322 7.264 -2.582 1.00 0.00 H new ATOM 1497 N LEU A 171 9.667 7.636 -6.359 1.00 0.00 N ATOM 1498 CA LEU A 171 11.056 7.675 -6.790 1.00 0.00 C ATOM 1499 C LEU A 171 11.453 9.083 -7.220 1.00 0.00 C ATOM 1500 O LEU A 171 12.593 9.504 -7.031 1.00 0.00 O ATOM 1501 CB LEU A 171 11.282 6.693 -7.942 1.00 0.00 C ATOM 1502 CG LEU A 171 11.385 5.224 -7.529 1.00 0.00 C ATOM 1503 CD1 LEU A 171 12.608 4.997 -6.655 1.00 0.00 C ATOM 1504 CD2 LEU A 171 10.122 4.786 -6.803 1.00 0.00 C ATOM 0 H LEU A 171 9.080 6.992 -6.889 1.00 0.00 H new ATOM 0 HA LEU A 171 11.681 7.384 -5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.464 6.798 -8.655 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.197 6.973 -8.464 1.00 0.00 H new ATOM 0 HG LEU A 171 11.492 4.621 -8.431 1.00 0.00 H new ATOM 0 HD11 LEU A 171 12.663 3.946 -6.372 1.00 0.00 H new ATOM 0 HD12 LEU A 171 13.506 5.271 -7.208 1.00 0.00 H new ATOM 0 HD13 LEU A 171 12.533 5.611 -5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 171 10.212 3.738 -6.516 1.00 0.00 H new ATOM 0 HD22 LEU A 171 9.985 5.396 -5.910 1.00 0.00 H new ATOM 0 HD23 LEU A 171 9.262 4.909 -7.462 1.00 0.00 H new ATOM 1516 N PHE A 172 10.502 9.808 -7.802 1.00 0.00 N ATOM 1517 CA PHE A 172 10.747 11.169 -8.261 1.00 0.00 C ATOM 1518 C PHE A 172 11.231 12.052 -7.115 1.00 0.00 C ATOM 1519 O PHE A 172 12.146 12.859 -7.284 1.00 0.00 O ATOM 1520 CB PHE A 172 9.472 11.756 -8.868 1.00 0.00 C ATOM 1521 CG PHE A 172 9.730 12.772 -9.943 1.00 0.00 C ATOM 1522 CD1 PHE A 172 10.380 13.961 -9.650 1.00 0.00 C ATOM 1523 CD2 PHE A 172 9.322 12.539 -11.246 1.00 0.00 C ATOM 1524 CE1 PHE A 172 10.619 14.898 -10.638 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.556 13.473 -12.239 1.00 0.00 C ATOM 1526 CZ PHE A 172 10.205 14.653 -11.933 1.00 0.00 C ATOM 0 H PHE A 172 9.553 9.473 -7.967 1.00 0.00 H new ATOM 0 HA PHE A 172 11.526 11.136 -9.023 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.871 10.947 -9.282 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.882 12.219 -8.076 1.00 0.00 H new ATOM 0 HD1 PHE A 172 10.703 14.157 -8.638 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.815 11.617 -11.490 1.00 0.00 H new ATOM 0 HE1 PHE A 172 11.128 15.820 -10.398 1.00 0.00 H new ATOM 0 HE2 PHE A 172 9.232 13.280 -13.251 1.00 0.00 H new ATOM 0 HZ PHE A 172 10.389 15.384 -12.706 1.00 0.00 H new ATOM 1536 N GLN A 173 10.611 11.894 -5.950 1.00 0.00 N ATOM 1537 CA GLN A 173 10.979 12.678 -4.776 1.00 0.00 C ATOM 1538 C GLN A 173 12.146 12.037 -4.033 1.00 0.00 C ATOM 1539 O GLN A 173 13.050 12.729 -3.563 1.00 0.00 O ATOM 1540 CB GLN A 173 9.779 12.819 -3.838 1.00 0.00 C ATOM 1541 CG GLN A 173 8.516 13.294 -4.537 1.00 0.00 C ATOM 1542 CD GLN A 173 7.253 12.832 -3.838 1.00 0.00 C ATOM 1543 OE1 GLN A 173 6.600 13.603 -3.136 1.00 0.00 O ATOM 1544 NE2 GLN A 173 6.903 11.564 -4.028 1.00 0.00 N ATOM 0 H GLN A 173 9.852 11.231 -5.794 1.00 0.00 H new ATOM 0 HA GLN A 173 11.289 13.667 -5.114 1.00 0.00 H new ATOM 0 HB2 GLN A 173 9.583 11.857 -3.365 1.00 0.00 H new ATOM 0 HB3 GLN A 173 10.030 13.520 -3.042 1.00 0.00 H new ATOM 0 HG2 GLN A 173 8.521 14.383 -4.588 1.00 0.00 H new ATOM 0 HG3 GLN A 173 8.514 12.927 -5.563 1.00 0.00 H new ATOM 0 HE21 GLN A 173 7.475 10.960 -4.619 1.00 0.00 H new ATOM 0 HE22 GLN A 173 6.063 11.195 -3.583 1.00 0.00 H new ATOM 1553 N SER A 174 12.123 10.712 -3.926 1.00 0.00 N ATOM 1554 CA SER A 174 13.179 9.982 -3.238 1.00 0.00 C ATOM 1555 C SER A 174 14.198 9.430 -4.231 1.00 0.00 C ATOM 1556 O SER A 174 14.795 8.378 -4.001 1.00 0.00 O ATOM 1557 CB SER A 174 12.585 8.840 -2.411 1.00 0.00 C ATOM 1558 OG SER A 174 12.232 9.282 -1.112 1.00 0.00 O ATOM 0 H SER A 174 11.383 10.123 -4.308 1.00 0.00 H new ATOM 0 HA SER A 174 13.689 10.677 -2.571 1.00 0.00 H new ATOM 0 HB2 SER A 174 11.704 8.442 -2.915 1.00 0.00 H new ATOM 0 HB3 SER A 174 13.306 8.026 -2.338 1.00 0.00 H new ATOM 0 HG SER A 174 11.853 8.535 -0.604 1.00 0.00 H new ATOM 1564 N GLY A 175 14.390 10.146 -5.332 1.00 0.00 N ATOM 1565 CA GLY A 175 15.336 9.712 -6.343 1.00 0.00 C ATOM 1566 C GLY A 175 15.975 10.873 -7.079 1.00 0.00 C ATOM 1567 O GLY A 175 17.199 10.823 -7.318 1.00 0.00 O ATOM 1568 OXT GLY A 175 15.249 11.832 -7.416 1.00 0.00 O ATOM 0 H GLY A 175 13.908 11.020 -5.543 1.00 0.00 H new ATOM 0 HA2 GLY A 175 16.115 9.112 -5.873 1.00 0.00 H new ATOM 0 HA3 GLY A 175 14.826 9.068 -7.060 1.00 0.00 H new