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 121 SER OG : rot 36:sc= 0.659 USER MOD Set 1.2: A 162 TYR OH : rot -150:sc= -0.344 USER MOD Single : A 93 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.94) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -2.44 K(o=-2.4,f=-1.7!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0131) 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 -36:sc= 1.19 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot 177:sc= 0.306 USER MOD Single : A 135 LYS NZ :NH3+ -133:sc= -0.205 (180deg=-1.22) 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= 0.00287 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 -30:sc= -0.802 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot -21:sc= 0.564 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 152:sc= -0.0249 (180deg=-0.506) USER MOD Single : A 160 SER OG : rot 73:sc= 0.234 USER MOD Single : A 161 HIS : no HD1:sc= -0.855 K(o=-0.86,f=-0.28) USER MOD Single : A 167 TYR OH : rot 0:sc= -1.86 USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= -1.36! K(o=-1.4!,f=-0.4) USER MOD Single : A 174 SER OG : rot 52:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -7.126 10.954 3.999 1.00 0.00 N ATOM 86 CA VAL A 86 -5.750 10.771 3.558 1.00 0.00 C ATOM 87 C VAL A 86 -5.694 10.105 2.188 1.00 0.00 C ATOM 88 O VAL A 86 -4.820 10.407 1.374 1.00 0.00 O ATOM 89 CB VAL A 86 -4.947 9.920 4.561 1.00 0.00 C ATOM 90 CG1 VAL A 86 -4.654 10.717 5.824 1.00 0.00 C ATOM 91 CG2 VAL A 86 -5.695 8.638 4.893 1.00 0.00 C ATOM 0 HA VAL A 86 -5.305 11.764 3.495 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.997 9.650 4.101 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.086 10.100 6.520 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.073 11.603 5.568 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.592 11.020 6.289 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -5.113 8.050 5.602 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -6.661 8.884 5.333 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.848 8.060 3.982 1.00 0.00 H new ATOM 101 N ARG A 87 -6.634 9.198 1.937 1.00 0.00 N ATOM 102 CA ARG A 87 -6.692 8.492 0.662 1.00 0.00 C ATOM 103 C ARG A 87 -6.967 9.461 -0.483 1.00 0.00 C ATOM 104 O ARG A 87 -6.266 9.457 -1.496 1.00 0.00 O ATOM 105 CB ARG A 87 -7.772 7.410 0.705 1.00 0.00 C ATOM 106 CG ARG A 87 -7.776 6.505 -0.517 1.00 0.00 C ATOM 107 CD ARG A 87 -7.588 5.043 -0.138 1.00 0.00 C ATOM 108 NE ARG A 87 -8.865 4.360 0.063 1.00 0.00 N ATOM 109 CZ ARG A 87 -9.419 4.141 1.256 1.00 0.00 C ATOM 110 NH1 ARG A 87 -8.817 4.550 2.367 1.00 0.00 N ATOM 111 NH2 ARG A 87 -10.582 3.510 1.339 1.00 0.00 N ATOM 0 H ARG A 87 -7.364 8.935 2.599 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.724 8.021 0.489 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -7.629 6.801 1.597 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.748 7.886 0.797 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.717 6.623 -1.054 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.981 6.809 -1.197 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -7.025 4.535 -0.921 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -6.995 4.978 0.774 1.00 0.00 H new ATOM 0 HE ARG A 87 -9.364 4.030 -0.763 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.922 5.037 2.313 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -9.249 4.377 3.275 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -11.052 3.193 0.491 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -11.007 3.342 2.251 1.00 0.00 H new ATOM 125 N LEU A 88 -7.991 10.291 -0.316 1.00 0.00 N ATOM 126 CA LEU A 88 -8.358 11.266 -1.336 1.00 0.00 C ATOM 127 C LEU A 88 -7.245 12.294 -1.527 1.00 0.00 C ATOM 128 O LEU A 88 -6.887 12.632 -2.655 1.00 0.00 O ATOM 129 CB LEU A 88 -9.663 11.971 -0.953 1.00 0.00 C ATOM 130 CG LEU A 88 -10.716 12.030 -2.064 1.00 0.00 C ATOM 131 CD1 LEU A 88 -11.984 11.301 -1.642 1.00 0.00 C ATOM 132 CD2 LEU A 88 -11.028 13.474 -2.430 1.00 0.00 C ATOM 0 H LEU A 88 -8.581 10.308 0.516 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.505 10.736 -2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.094 11.462 -0.091 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.430 12.989 -0.639 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.311 11.531 -2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.719 11.355 -2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -11.751 10.257 -1.433 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -12.391 11.769 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -11.778 13.495 -3.221 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -11.410 13.997 -1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -10.120 13.965 -2.778 1.00 0.00 H new ATOM 144 N ASP A 89 -6.704 12.785 -0.417 1.00 0.00 N ATOM 145 CA ASP A 89 -5.637 13.771 -0.458 1.00 0.00 C ATOM 146 C ASP A 89 -4.435 13.247 -1.236 1.00 0.00 C ATOM 147 O ASP A 89 -3.798 13.985 -1.988 1.00 0.00 O ATOM 148 CB ASP A 89 -5.211 14.152 0.961 1.00 0.00 C ATOM 149 CG ASP A 89 -6.002 15.325 1.508 1.00 0.00 C ATOM 150 OD1 ASP A 89 -7.234 15.190 1.663 1.00 0.00 O ATOM 151 OD2 ASP A 89 -5.391 16.379 1.780 1.00 0.00 O ATOM 0 H ASP A 89 -6.990 12.513 0.524 1.00 0.00 H new ATOM 0 HA ASP A 89 -6.018 14.656 -0.968 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.340 13.292 1.619 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.150 14.400 0.964 1.00 0.00 H new ATOM 156 N PHE A 90 -4.130 11.966 -1.051 1.00 0.00 N ATOM 157 CA PHE A 90 -3.004 11.340 -1.736 1.00 0.00 C ATOM 158 C PHE A 90 -3.165 11.442 -3.250 1.00 0.00 C ATOM 159 O PHE A 90 -2.207 11.724 -3.968 1.00 0.00 O ATOM 160 CB PHE A 90 -2.882 9.872 -1.322 1.00 0.00 C ATOM 161 CG PHE A 90 -1.697 9.175 -1.928 1.00 0.00 C ATOM 162 CD1 PHE A 90 -1.808 8.530 -3.151 1.00 0.00 C ATOM 163 CD2 PHE A 90 -0.475 9.162 -1.277 1.00 0.00 C ATOM 164 CE1 PHE A 90 -0.721 7.887 -3.711 1.00 0.00 C ATOM 165 CE2 PHE A 90 0.616 8.519 -1.832 1.00 0.00 C ATOM 166 CZ PHE A 90 0.493 7.882 -3.051 1.00 0.00 C ATOM 0 H PHE A 90 -4.647 11.341 -0.432 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.095 11.868 -1.449 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.811 9.814 -0.236 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.791 9.344 -1.611 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.755 8.530 -3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.373 9.660 -0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.820 7.389 -4.664 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.563 8.515 -1.313 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.344 7.381 -3.488 1.00 0.00 H new ATOM 176 N LEU A 91 -4.384 11.210 -3.727 1.00 0.00 N ATOM 177 CA LEU A 91 -4.671 11.277 -5.155 1.00 0.00 C ATOM 178 C LEU A 91 -4.420 12.681 -5.696 1.00 0.00 C ATOM 179 O LEU A 91 -4.014 12.850 -6.845 1.00 0.00 O ATOM 180 CB LEU A 91 -6.120 10.866 -5.424 1.00 0.00 C ATOM 181 CG LEU A 91 -6.541 9.530 -4.809 1.00 0.00 C ATOM 182 CD1 LEU A 91 -8.031 9.526 -4.510 1.00 0.00 C ATOM 183 CD2 LEU A 91 -6.178 8.380 -5.735 1.00 0.00 C ATOM 0 H LEU A 91 -5.188 10.974 -3.146 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.002 10.585 -5.667 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.779 11.647 -5.044 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.273 10.816 -6.502 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.003 9.398 -3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.312 8.568 -4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.263 10.327 -3.808 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -8.588 9.681 -5.434 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -6.485 7.437 -5.282 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -6.688 8.507 -6.690 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.100 8.371 -5.898 1.00 0.00 H new ATOM 195 N ASP A 92 -4.666 13.684 -4.859 1.00 0.00 N ATOM 196 CA ASP A 92 -4.470 15.074 -5.254 1.00 0.00 C ATOM 197 C ASP A 92 -2.991 15.373 -5.485 1.00 0.00 C ATOM 198 O ASP A 92 -2.621 15.985 -6.485 1.00 0.00 O ATOM 199 CB ASP A 92 -5.033 16.012 -4.183 1.00 0.00 C ATOM 200 CG ASP A 92 -5.852 17.141 -4.779 1.00 0.00 C ATOM 201 OD1 ASP A 92 -5.380 17.767 -5.752 1.00 0.00 O ATOM 202 OD2 ASP A 92 -6.964 17.400 -4.272 1.00 0.00 O ATOM 0 H ASP A 92 -5.001 13.560 -3.904 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.003 15.239 -6.190 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -5.654 15.441 -3.493 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.212 16.430 -3.601 1.00 0.00 H new ATOM 207 N GLN A 93 -2.151 14.937 -4.550 1.00 0.00 N ATOM 208 CA GLN A 93 -0.713 15.158 -4.653 1.00 0.00 C ATOM 209 C GLN A 93 -0.146 14.481 -5.895 1.00 0.00 C ATOM 210 O GLN A 93 0.685 15.052 -6.602 1.00 0.00 O ATOM 211 CB GLN A 93 -0.002 14.634 -3.403 1.00 0.00 C ATOM 212 CG GLN A 93 -0.674 15.043 -2.101 1.00 0.00 C ATOM 213 CD GLN A 93 -0.942 16.532 -2.022 1.00 0.00 C ATOM 214 OE1 GLN A 93 -0.193 17.340 -2.574 1.00 0.00 O ATOM 215 NE2 GLN A 93 -2.014 16.906 -1.335 1.00 0.00 N ATOM 0 H GLN A 93 -2.441 14.430 -3.714 1.00 0.00 H new ATOM 0 HA GLN A 93 -0.542 16.231 -4.736 1.00 0.00 H new ATOM 0 HB2 GLN A 93 0.045 13.546 -3.451 1.00 0.00 H new ATOM 0 HB3 GLN A 93 1.026 14.997 -3.401 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -1.615 14.503 -1.998 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -0.043 14.747 -1.263 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.607 16.204 -0.893 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -2.245 17.896 -1.249 1.00 0.00 H new ATOM 224 N LEU A 94 -0.598 13.260 -6.157 1.00 0.00 N ATOM 225 CA LEU A 94 -0.135 12.503 -7.312 1.00 0.00 C ATOM 226 C LEU A 94 -0.586 13.162 -8.613 1.00 0.00 C ATOM 227 O LEU A 94 0.199 13.310 -9.549 1.00 0.00 O ATOM 228 CB LEU A 94 -0.659 11.065 -7.248 1.00 0.00 C ATOM 229 CG LEU A 94 -0.196 10.155 -8.387 1.00 0.00 C ATOM 230 CD1 LEU A 94 1.248 9.726 -8.172 1.00 0.00 C ATOM 231 CD2 LEU A 94 -1.104 8.941 -8.499 1.00 0.00 C ATOM 0 H LEU A 94 -1.286 12.773 -5.583 1.00 0.00 H new ATOM 0 HA LEU A 94 0.955 12.489 -7.292 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.348 10.623 -6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.749 11.092 -7.245 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.252 10.714 -9.321 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.561 9.079 -8.991 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.889 10.607 -8.140 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.330 9.184 -7.230 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.761 8.304 -9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.079 8.380 -7.565 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.125 9.267 -8.699 1.00 0.00 H new ATOM 243 N ALA A 95 -1.854 13.555 -8.662 1.00 0.00 N ATOM 244 CA ALA A 95 -2.410 14.196 -9.847 1.00 0.00 C ATOM 245 C ALA A 95 -1.842 15.598 -10.039 1.00 0.00 C ATOM 246 O ALA A 95 -1.581 16.024 -11.164 1.00 0.00 O ATOM 247 CB ALA A 95 -3.928 14.250 -9.753 1.00 0.00 C ATOM 0 H ALA A 95 -2.516 13.441 -7.894 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.128 13.599 -10.714 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.331 14.731 -10.644 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.324 13.237 -9.677 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.218 14.820 -8.870 1.00 0.00 H new ATOM 253 N LYS A 96 -1.656 16.315 -8.934 1.00 0.00 N ATOM 254 CA LYS A 96 -1.124 17.671 -8.985 1.00 0.00 C ATOM 255 C LYS A 96 0.373 17.664 -9.278 1.00 0.00 C ATOM 256 O LYS A 96 0.858 18.444 -10.098 1.00 0.00 O ATOM 257 CB LYS A 96 -1.392 18.395 -7.665 1.00 0.00 C ATOM 258 CG LYS A 96 -2.841 18.829 -7.492 1.00 0.00 C ATOM 259 CD LYS A 96 -2.946 20.308 -7.155 1.00 0.00 C ATOM 260 CE LYS A 96 -4.245 20.623 -6.431 1.00 0.00 C ATOM 261 NZ LYS A 96 -4.218 21.970 -5.800 1.00 0.00 N ATOM 0 H LYS A 96 -1.866 15.979 -7.994 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.629 18.199 -9.794 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.116 17.740 -6.838 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -0.749 19.273 -7.604 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.395 18.624 -8.408 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.305 18.241 -6.700 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -2.101 20.601 -6.532 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -2.887 20.896 -8.071 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -5.075 20.569 -7.135 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -4.426 19.868 -5.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -5.122 22.145 -5.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -3.442 22.014 -5.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -4.071 22.694 -6.532 1.00 0.00 H new ATOM 275 N PHE A 97 1.102 16.782 -8.602 1.00 0.00 N ATOM 276 CA PHE A 97 2.545 16.681 -8.791 1.00 0.00 C ATOM 277 C PHE A 97 2.882 16.279 -10.225 1.00 0.00 C ATOM 278 O PHE A 97 3.719 16.907 -10.874 1.00 0.00 O ATOM 279 CB PHE A 97 3.137 15.665 -7.814 1.00 0.00 C ATOM 280 CG PHE A 97 4.638 15.636 -7.813 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.334 15.072 -8.870 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.354 16.174 -6.756 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.714 15.046 -8.873 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.735 16.150 -6.753 1.00 0.00 C ATOM 285 CZ PHE A 97 7.417 15.584 -7.813 1.00 0.00 C ATOM 0 H PHE A 97 0.718 16.128 -7.920 1.00 0.00 H new ATOM 0 HA PHE A 97 2.980 17.661 -8.596 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.786 15.894 -6.808 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.763 14.672 -8.064 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.790 14.648 -9.701 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.826 16.617 -5.925 1.00 0.00 H new ATOM 0 HE1 PHE A 97 7.244 14.605 -9.704 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.281 16.573 -5.923 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.497 15.562 -7.813 1.00 0.00 H new ATOM 295 N TRP A 98 2.225 15.233 -10.714 1.00 0.00 N ATOM 296 CA TRP A 98 2.458 14.753 -12.071 1.00 0.00 C ATOM 297 C TRP A 98 1.996 15.781 -13.100 1.00 0.00 C ATOM 298 O TRP A 98 2.582 15.904 -14.175 1.00 0.00 O ATOM 299 CB TRP A 98 1.736 13.425 -12.300 1.00 0.00 C ATOM 300 CG TRP A 98 2.574 12.230 -11.961 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.474 11.443 -10.849 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.643 11.685 -12.743 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.415 10.444 -10.891 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.145 10.571 -12.045 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.224 12.031 -13.967 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.200 9.802 -12.530 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.271 11.267 -14.447 1.00 0.00 C ATOM 308 CH2 TRP A 98 5.750 10.164 -13.729 1.00 0.00 C ATOM 0 H TRP A 98 1.528 14.702 -10.192 1.00 0.00 H new ATOM 0 HA TRP A 98 3.530 14.599 -12.193 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.827 13.405 -11.699 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.429 13.361 -13.344 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.759 11.586 -10.053 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.549 9.725 -10.180 1.00 0.00 H new ATOM 0 HE3 TRP A 98 3.861 12.880 -14.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.571 8.950 -11.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 5.727 11.525 -15.391 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.570 9.587 -14.130 1.00 0.00 H new ATOM 319 N GLU A 99 0.939 16.514 -12.764 1.00 0.00 N ATOM 320 CA GLU A 99 0.394 17.526 -13.656 1.00 0.00 C ATOM 321 C GLU A 99 1.465 18.540 -14.053 1.00 0.00 C ATOM 322 O GLU A 99 1.519 18.981 -15.200 1.00 0.00 O ATOM 323 CB GLU A 99 -0.784 18.242 -12.991 1.00 0.00 C ATOM 324 CG GLU A 99 -2.140 17.801 -13.523 1.00 0.00 C ATOM 325 CD GLU A 99 -3.042 18.974 -13.859 1.00 0.00 C ATOM 326 OE1 GLU A 99 -3.164 19.889 -13.017 1.00 0.00 O ATOM 327 OE2 GLU A 99 -3.627 18.975 -14.962 1.00 0.00 O ATOM 0 H GLU A 99 0.443 16.424 -11.877 1.00 0.00 H new ATOM 0 HA GLU A 99 0.043 17.026 -14.559 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.748 18.063 -11.916 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.676 19.317 -13.139 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.996 17.191 -14.415 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.630 17.171 -12.781 1.00 0.00 H new ATOM 334 N LEU A 100 2.311 18.904 -13.096 1.00 0.00 N ATOM 335 CA LEU A 100 3.380 19.865 -13.347 1.00 0.00 C ATOM 336 C LEU A 100 4.307 19.369 -14.451 1.00 0.00 C ATOM 337 O LEU A 100 4.846 20.160 -15.225 1.00 0.00 O ATOM 338 CB LEU A 100 4.179 20.117 -12.067 1.00 0.00 C ATOM 339 CG LEU A 100 3.658 21.259 -11.193 1.00 0.00 C ATOM 340 CD1 LEU A 100 2.596 20.752 -10.229 1.00 0.00 C ATOM 341 CD2 LEU A 100 4.803 21.912 -10.433 1.00 0.00 C ATOM 0 H LEU A 100 2.278 18.549 -12.140 1.00 0.00 H new ATOM 0 HA LEU A 100 2.926 20.801 -13.672 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.187 19.202 -11.475 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.213 20.330 -12.338 1.00 0.00 H new ATOM 0 HG LEU A 100 3.203 22.009 -11.840 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.237 21.578 -9.616 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.764 20.331 -10.793 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.025 19.983 -9.587 1.00 0.00 H new ATOM 0 HD21 LEU A 100 4.415 22.722 -9.816 1.00 0.00 H new ATOM 0 HD22 LEU A 100 5.287 21.171 -9.796 1.00 0.00 H new ATOM 0 HD23 LEU A 100 5.529 22.311 -11.141 1.00 0.00 H new ATOM 353 N GLN A 101 4.489 18.054 -14.517 1.00 0.00 N ATOM 354 CA GLN A 101 5.351 17.450 -15.526 1.00 0.00 C ATOM 355 C GLN A 101 4.727 17.563 -16.912 1.00 0.00 C ATOM 356 O GLN A 101 5.403 17.901 -17.883 1.00 0.00 O ATOM 357 CB GLN A 101 5.608 15.980 -15.190 1.00 0.00 C ATOM 358 CG GLN A 101 6.652 15.779 -14.106 1.00 0.00 C ATOM 359 CD GLN A 101 6.244 16.399 -12.782 1.00 0.00 C ATOM 360 OE1 GLN A 101 5.676 15.729 -11.920 1.00 0.00 O ATOM 361 NE2 GLN A 101 6.534 17.684 -12.616 1.00 0.00 N ATOM 0 H GLN A 101 4.051 17.386 -13.883 1.00 0.00 H new ATOM 0 HA GLN A 101 6.299 17.988 -15.529 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.673 15.520 -14.872 1.00 0.00 H new ATOM 0 HB3 GLN A 101 5.929 15.460 -16.093 1.00 0.00 H new ATOM 0 HG2 GLN A 101 6.824 14.712 -13.966 1.00 0.00 H new ATOM 0 HG3 GLN A 101 7.597 16.214 -14.431 1.00 0.00 H new ATOM 0 HE21 GLN A 101 7.006 18.200 -13.358 1.00 0.00 H new ATOM 0 HE22 GLN A 101 6.285 18.155 -11.746 1.00 0.00 H new ATOM 370 N GLY A 102 3.433 17.276 -16.995 1.00 0.00 N ATOM 371 CA GLY A 102 2.735 17.347 -18.261 1.00 0.00 C ATOM 372 C GLY A 102 2.291 15.984 -18.756 1.00 0.00 C ATOM 373 O GLY A 102 2.096 15.784 -19.954 1.00 0.00 O ATOM 0 H GLY A 102 2.854 16.994 -16.204 1.00 0.00 H new ATOM 0 HA2 GLY A 102 1.864 17.994 -18.156 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.385 17.806 -19.006 1.00 0.00 H new ATOM 377 N SER A 103 2.134 15.043 -17.830 1.00 0.00 N ATOM 378 CA SER A 103 1.712 13.692 -18.176 1.00 0.00 C ATOM 379 C SER A 103 0.243 13.470 -17.828 1.00 0.00 C ATOM 380 O SER A 103 -0.422 12.620 -18.419 1.00 0.00 O ATOM 381 CB SER A 103 2.583 12.664 -17.452 1.00 0.00 C ATOM 382 OG SER A 103 2.969 11.617 -18.327 1.00 0.00 O ATOM 0 H SER A 103 2.293 15.192 -16.834 1.00 0.00 H new ATOM 0 HA SER A 103 1.831 13.566 -19.252 1.00 0.00 H new ATOM 0 HB2 SER A 103 3.471 13.153 -17.051 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.036 12.251 -16.605 1.00 0.00 H new ATOM 0 HG SER A 103 3.526 10.974 -17.841 1.00 0.00 H new ATOM 388 N THR A 104 -0.258 14.239 -16.863 1.00 0.00 N ATOM 389 CA THR A 104 -1.649 14.123 -16.437 1.00 0.00 C ATOM 390 C THR A 104 -1.908 12.764 -15.794 1.00 0.00 C ATOM 391 O THR A 104 -1.585 11.724 -16.365 1.00 0.00 O ATOM 392 CB THR A 104 -2.592 14.327 -17.625 1.00 0.00 C ATOM 393 OG1 THR A 104 -2.195 15.449 -18.393 1.00 0.00 O ATOM 394 CG2 THR A 104 -4.033 14.538 -17.215 1.00 0.00 C ATOM 0 H THR A 104 0.279 14.948 -16.363 1.00 0.00 H new ATOM 0 HA THR A 104 -1.840 14.899 -15.696 1.00 0.00 H new ATOM 0 HB THR A 104 -2.528 13.407 -18.207 1.00 0.00 H new ATOM 0 HG1 THR A 104 -2.809 15.562 -19.149 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.648 14.676 -18.104 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.385 13.667 -16.662 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.106 15.423 -16.583 1.00 0.00 H new ATOM 402 N LEU A 105 -2.491 12.783 -14.599 1.00 0.00 N ATOM 403 CA LEU A 105 -2.790 11.554 -13.875 1.00 0.00 C ATOM 404 C LEU A 105 -4.052 10.891 -14.420 1.00 0.00 C ATOM 405 O LEU A 105 -5.108 11.517 -14.510 1.00 0.00 O ATOM 406 CB LEU A 105 -2.953 11.847 -12.381 1.00 0.00 C ATOM 407 CG LEU A 105 -3.475 10.681 -11.539 1.00 0.00 C ATOM 408 CD1 LEU A 105 -2.525 9.498 -11.616 1.00 0.00 C ATOM 409 CD2 LEU A 105 -3.671 11.116 -10.094 1.00 0.00 C ATOM 0 H LEU A 105 -2.765 13.636 -14.112 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.956 10.866 -14.015 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.988 12.159 -11.981 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.634 12.691 -12.265 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.440 10.371 -11.940 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.914 8.679 -11.011 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.433 9.172 -12.652 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.545 9.793 -11.241 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.043 10.275 -9.508 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.719 11.452 -9.683 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.392 11.933 -10.054 1.00 0.00 H new ATOM 421 N LYS A 106 -3.932 9.617 -14.780 1.00 0.00 N ATOM 422 CA LYS A 106 -5.057 8.859 -15.314 1.00 0.00 C ATOM 423 C LYS A 106 -5.233 7.549 -14.551 1.00 0.00 C ATOM 424 O LYS A 106 -4.269 6.820 -14.322 1.00 0.00 O ATOM 425 CB LYS A 106 -4.850 8.578 -16.805 1.00 0.00 C ATOM 426 CG LYS A 106 -5.720 9.434 -17.710 1.00 0.00 C ATOM 427 CD LYS A 106 -5.886 8.804 -19.085 1.00 0.00 C ATOM 428 CE LYS A 106 -7.309 8.949 -19.598 1.00 0.00 C ATOM 429 NZ LYS A 106 -7.434 10.056 -20.586 1.00 0.00 N ATOM 0 H LYS A 106 -3.063 9.087 -14.711 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.961 9.455 -15.191 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.803 8.746 -17.056 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.060 7.527 -17.001 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -6.699 9.571 -17.251 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -5.275 10.424 -17.814 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -5.196 9.273 -19.787 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.622 7.748 -19.036 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -7.625 8.014 -20.059 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -7.980 9.134 -18.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -8.420 10.121 -20.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -7.157 10.953 -20.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.813 9.868 -21.399 1.00 0.00 H new ATOM 443 N ILE A 107 -6.470 7.260 -14.156 1.00 0.00 N ATOM 444 CA ILE A 107 -6.770 6.040 -13.414 1.00 0.00 C ATOM 445 C ILE A 107 -7.530 5.037 -14.280 1.00 0.00 C ATOM 446 O ILE A 107 -8.746 5.143 -14.441 1.00 0.00 O ATOM 447 CB ILE A 107 -7.603 6.342 -12.154 1.00 0.00 C ATOM 448 CG1 ILE A 107 -7.004 7.523 -11.386 1.00 0.00 C ATOM 449 CG2 ILE A 107 -7.686 5.110 -11.265 1.00 0.00 C ATOM 450 CD1 ILE A 107 -7.714 8.834 -11.644 1.00 0.00 C ATOM 0 H ILE A 107 -7.280 7.853 -14.337 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.814 5.609 -13.118 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.613 6.612 -12.462 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.036 7.306 -10.318 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -5.954 7.628 -11.658 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.278 5.340 -10.379 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.157 4.296 -11.815 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.682 4.811 -10.963 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -7.236 9.626 -11.067 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.659 9.075 -12.706 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.759 8.747 -11.345 1.00 0.00 H new ATOM 462 N PRO A 108 -6.823 4.046 -14.854 1.00 0.00 N ATOM 463 CA PRO A 108 -7.439 3.025 -15.709 1.00 0.00 C ATOM 464 C PRO A 108 -8.388 2.115 -14.933 1.00 0.00 C ATOM 465 O PRO A 108 -8.516 2.230 -13.713 1.00 0.00 O ATOM 466 CB PRO A 108 -6.245 2.215 -16.241 1.00 0.00 C ATOM 467 CG PRO A 108 -5.040 3.041 -15.948 1.00 0.00 C ATOM 468 CD PRO A 108 -5.374 3.840 -14.723 1.00 0.00 C ATOM 0 HA PRO A 108 -8.045 3.475 -16.495 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -6.182 1.242 -15.753 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -6.343 2.029 -17.311 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -4.167 2.411 -15.777 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.802 3.695 -16.787 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.123 3.303 -13.809 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.832 4.785 -14.696 1.00 0.00 H new ATOM 476 N VAL A 109 -9.047 1.210 -15.648 1.00 0.00 N ATOM 477 CA VAL A 109 -9.982 0.275 -15.030 1.00 0.00 C ATOM 478 C VAL A 109 -9.581 -1.167 -15.327 1.00 0.00 C ATOM 479 O VAL A 109 -9.495 -1.570 -16.487 1.00 0.00 O ATOM 480 CB VAL A 109 -11.423 0.509 -15.523 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.400 -0.372 -14.758 1.00 0.00 C ATOM 482 CG2 VAL A 109 -11.802 1.976 -15.392 1.00 0.00 C ATOM 0 H VAL A 109 -8.951 1.103 -16.658 1.00 0.00 H new ATOM 0 HA VAL A 109 -9.946 0.450 -13.955 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.474 0.238 -16.577 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.412 -0.193 -15.120 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -12.141 -1.420 -14.910 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.348 -0.136 -13.695 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.823 2.121 -15.745 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.733 2.278 -14.347 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.122 2.582 -15.990 1.00 0.00 H new ATOM 492 N VAL A 110 -9.332 -1.938 -14.274 1.00 0.00 N ATOM 493 CA VAL A 110 -8.935 -3.333 -14.425 1.00 0.00 C ATOM 494 C VAL A 110 -10.044 -4.279 -13.975 1.00 0.00 C ATOM 495 O VAL A 110 -10.490 -4.228 -12.829 1.00 0.00 O ATOM 496 CB VAL A 110 -7.657 -3.642 -13.625 1.00 0.00 C ATOM 497 CG1 VAL A 110 -7.140 -5.033 -13.959 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.591 -2.590 -13.893 1.00 0.00 C ATOM 0 H VAL A 110 -9.398 -1.621 -13.307 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.740 -3.490 -15.486 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.901 -3.616 -12.563 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.236 -5.233 -13.384 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.900 -5.773 -13.710 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -6.913 -5.091 -15.023 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.695 -2.825 -13.319 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.349 -2.580 -14.956 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.965 -1.610 -13.597 1.00 0.00 H new ATOM 508 N GLU A 111 -10.480 -5.146 -14.886 1.00 0.00 N ATOM 509 CA GLU A 111 -11.534 -6.110 -14.585 1.00 0.00 C ATOM 510 C GLU A 111 -12.789 -5.411 -14.072 1.00 0.00 C ATOM 511 O GLU A 111 -13.395 -5.841 -13.090 1.00 0.00 O ATOM 512 CB GLU A 111 -11.041 -7.126 -13.553 1.00 0.00 C ATOM 513 CG GLU A 111 -10.098 -8.170 -14.128 1.00 0.00 C ATOM 514 CD GLU A 111 -9.965 -9.389 -13.237 1.00 0.00 C ATOM 515 OE1 GLU A 111 -10.815 -10.300 -13.347 1.00 0.00 O ATOM 516 OE2 GLU A 111 -9.012 -9.436 -12.431 1.00 0.00 O ATOM 0 H GLU A 111 -10.119 -5.200 -15.839 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.788 -6.631 -15.508 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.534 -6.596 -12.747 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.901 -7.629 -13.112 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.459 -8.479 -15.109 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.115 -7.724 -14.276 1.00 0.00 H new ATOM 523 N ARG A 112 -13.176 -4.331 -14.741 1.00 0.00 N ATOM 524 CA ARG A 112 -14.360 -3.572 -14.351 1.00 0.00 C ATOM 525 C ARG A 112 -14.252 -3.098 -12.904 1.00 0.00 C ATOM 526 O ARG A 112 -15.262 -2.905 -12.228 1.00 0.00 O ATOM 527 CB ARG A 112 -15.618 -4.425 -14.529 1.00 0.00 C ATOM 528 CG ARG A 112 -16.292 -4.241 -15.880 1.00 0.00 C ATOM 529 CD ARG A 112 -17.746 -4.685 -15.846 1.00 0.00 C ATOM 530 NE ARG A 112 -18.009 -5.770 -16.787 1.00 0.00 N ATOM 531 CZ ARG A 112 -17.692 -7.043 -16.559 1.00 0.00 C ATOM 532 NH1 ARG A 112 -17.101 -7.394 -15.423 1.00 0.00 N ATOM 533 NH2 ARG A 112 -17.967 -7.968 -17.468 1.00 0.00 N ATOM 0 H ARG A 112 -12.688 -3.961 -15.556 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.428 -2.696 -14.996 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.355 -5.475 -14.403 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -16.329 -4.178 -13.741 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -16.238 -3.193 -16.174 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -15.754 -4.813 -16.636 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -18.002 -5.010 -14.838 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -18.389 -3.837 -16.081 1.00 0.00 H new ATOM 0 HE ARG A 112 -18.462 -5.539 -17.671 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -16.888 -6.687 -14.720 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -16.861 -8.371 -15.254 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -18.422 -7.705 -18.342 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -17.724 -8.943 -17.293 1.00 0.00 H new ATOM 547 N LYS A 113 -13.021 -2.914 -12.437 1.00 0.00 N ATOM 548 CA LYS A 113 -12.782 -2.464 -11.071 1.00 0.00 C ATOM 549 C LYS A 113 -11.690 -1.399 -11.035 1.00 0.00 C ATOM 550 O LYS A 113 -10.695 -1.493 -11.753 1.00 0.00 O ATOM 551 CB LYS A 113 -12.386 -3.646 -10.184 1.00 0.00 C ATOM 552 CG LYS A 113 -12.935 -3.556 -8.770 1.00 0.00 C ATOM 553 CD LYS A 113 -12.387 -4.665 -7.888 1.00 0.00 C ATOM 554 CE LYS A 113 -12.114 -4.173 -6.476 1.00 0.00 C ATOM 555 NZ LYS A 113 -10.890 -3.328 -6.409 1.00 0.00 N ATOM 0 H LYS A 113 -12.174 -3.070 -12.984 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.706 -2.027 -10.691 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -12.739 -4.569 -10.644 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -11.299 -3.708 -10.139 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -12.679 -2.588 -8.340 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -14.023 -3.615 -8.797 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -13.099 -5.490 -7.855 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -11.467 -5.055 -8.322 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -12.970 -3.601 -6.119 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -12.002 -5.028 -5.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -10.662 -3.125 -5.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -10.095 -3.833 -6.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -11.057 -2.435 -6.915 1.00 0.00 H new ATOM 569 N ILE A 114 -11.885 -0.388 -10.197 1.00 0.00 N ATOM 570 CA ILE A 114 -10.916 0.694 -10.069 1.00 0.00 C ATOM 571 C ILE A 114 -9.636 0.209 -9.398 1.00 0.00 C ATOM 572 O ILE A 114 -9.680 -0.556 -8.435 1.00 0.00 O ATOM 573 CB ILE A 114 -11.492 1.874 -9.262 1.00 0.00 C ATOM 574 CG1 ILE A 114 -12.882 2.247 -9.780 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.555 3.071 -9.331 1.00 0.00 C ATOM 576 CD1 ILE A 114 -14.010 1.639 -8.973 1.00 0.00 C ATOM 0 H ILE A 114 -12.704 -0.295 -9.597 1.00 0.00 H new ATOM 0 HA ILE A 114 -10.687 1.034 -11.079 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.585 1.570 -8.219 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.985 3.332 -9.773 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -12.973 1.925 -10.817 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.976 3.896 -8.756 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.585 2.798 -8.917 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.433 3.378 -10.370 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.967 1.945 -9.396 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -13.932 0.552 -9.001 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -13.944 1.981 -7.940 1.00 0.00 H new ATOM 588 N LEU A 115 -8.497 0.658 -9.914 1.00 0.00 N ATOM 589 CA LEU A 115 -7.203 0.270 -9.366 1.00 0.00 C ATOM 590 C LEU A 115 -6.791 1.197 -8.228 1.00 0.00 C ATOM 591 O LEU A 115 -6.518 2.379 -8.444 1.00 0.00 O ATOM 592 CB LEU A 115 -6.137 0.285 -10.464 1.00 0.00 C ATOM 593 CG LEU A 115 -4.942 -0.638 -10.220 1.00 0.00 C ATOM 594 CD1 LEU A 115 -4.232 -0.260 -8.930 1.00 0.00 C ATOM 595 CD2 LEU A 115 -5.390 -2.090 -10.180 1.00 0.00 C ATOM 0 H LEU A 115 -8.444 1.291 -10.712 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.294 -0.741 -8.969 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.606 0.006 -11.408 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -5.771 1.305 -10.580 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.240 -0.519 -11.045 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.384 -0.927 -8.772 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -3.877 0.768 -8.998 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.925 -0.350 -8.093 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -4.527 -2.732 -10.006 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -6.112 -2.226 -9.375 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.853 -2.354 -11.131 1.00 0.00 H new ATOM 607 N ASP A 116 -6.746 0.654 -7.015 1.00 0.00 N ATOM 608 CA ASP A 116 -6.365 1.434 -5.843 1.00 0.00 C ATOM 609 C ASP A 116 -4.887 1.806 -5.897 1.00 0.00 C ATOM 610 O ASP A 116 -4.097 1.153 -6.580 1.00 0.00 O ATOM 611 CB ASP A 116 -6.659 0.649 -4.564 1.00 0.00 C ATOM 612 CG ASP A 116 -6.946 1.554 -3.382 1.00 0.00 C ATOM 613 OD1 ASP A 116 -6.031 2.299 -2.970 1.00 0.00 O ATOM 614 OD2 ASP A 116 -8.084 1.519 -2.868 1.00 0.00 O ATOM 0 H ASP A 116 -6.968 -0.322 -6.819 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.953 2.352 -5.840 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.514 -0.006 -4.732 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.808 0.010 -4.330 1.00 0.00 H new ATOM 619 N LEU A 117 -4.518 2.860 -5.176 1.00 0.00 N ATOM 620 CA LEU A 117 -3.134 3.317 -5.146 1.00 0.00 C ATOM 621 C LEU A 117 -2.542 3.182 -3.746 1.00 0.00 C ATOM 622 O LEU A 117 -1.536 2.501 -3.550 1.00 0.00 O ATOM 623 CB LEU A 117 -3.043 4.770 -5.614 1.00 0.00 C ATOM 624 CG LEU A 117 -3.619 5.039 -7.007 1.00 0.00 C ATOM 625 CD1 LEU A 117 -5.080 5.448 -6.913 1.00 0.00 C ATOM 626 CD2 LEU A 117 -2.808 6.109 -7.721 1.00 0.00 C ATOM 0 H LEU A 117 -5.158 3.413 -4.605 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.558 2.688 -5.824 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.564 5.401 -4.894 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.996 5.074 -5.605 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.559 4.118 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.471 5.635 -7.913 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -5.652 4.648 -6.443 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -5.166 6.355 -6.315 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.231 6.287 -8.709 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.835 7.032 -7.143 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.775 5.775 -7.824 1.00 0.00 H new ATOM 638 N TYR A 118 -3.174 3.836 -2.776 1.00 0.00 N ATOM 639 CA TYR A 118 -2.708 3.787 -1.395 1.00 0.00 C ATOM 640 C TYR A 118 -2.618 2.347 -0.901 1.00 0.00 C ATOM 641 O TYR A 118 -1.591 1.924 -0.369 1.00 0.00 O ATOM 642 CB TYR A 118 -3.645 4.592 -0.491 1.00 0.00 C ATOM 643 CG TYR A 118 -2.998 5.060 0.794 1.00 0.00 C ATOM 644 CD1 TYR A 118 -2.232 6.219 0.825 1.00 0.00 C ATOM 645 CD2 TYR A 118 -3.153 4.342 1.973 1.00 0.00 C ATOM 646 CE1 TYR A 118 -1.640 6.650 1.997 1.00 0.00 C ATOM 647 CE2 TYR A 118 -2.565 4.767 3.149 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.809 5.920 3.155 1.00 0.00 C ATOM 649 OH TYR A 118 -1.221 6.347 4.325 1.00 0.00 O ATOM 0 H TYR A 118 -4.008 4.405 -2.921 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.711 4.226 -1.358 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -4.009 5.460 -1.041 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -4.514 3.981 -0.248 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -2.097 6.792 -0.081 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -3.743 3.437 1.970 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -1.048 7.553 2.006 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -2.697 4.199 4.058 1.00 0.00 H new ATOM 0 HH TYR A 118 -1.439 5.722 5.048 1.00 0.00 H new ATOM 659 N ALA A 119 -3.702 1.601 -1.081 1.00 0.00 N ATOM 660 CA ALA A 119 -3.753 0.211 -0.657 1.00 0.00 C ATOM 661 C ALA A 119 -2.715 -0.631 -1.391 1.00 0.00 C ATOM 662 O ALA A 119 -2.019 -1.444 -0.781 1.00 0.00 O ATOM 663 CB ALA A 119 -5.148 -0.355 -0.879 1.00 0.00 C ATOM 0 H ALA A 119 -4.559 1.939 -1.519 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.520 0.174 0.407 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -5.174 -1.396 -0.558 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.871 0.221 -0.301 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -5.401 -0.296 -1.938 1.00 0.00 H new ATOM 669 N LEU A 120 -2.619 -0.436 -2.702 1.00 0.00 N ATOM 670 CA LEU A 120 -1.670 -1.182 -3.521 1.00 0.00 C ATOM 671 C LEU A 120 -0.235 -0.924 -3.070 1.00 0.00 C ATOM 672 O LEU A 120 0.544 -1.858 -2.882 1.00 0.00 O ATOM 673 CB LEU A 120 -1.830 -0.807 -4.995 1.00 0.00 C ATOM 674 CG LEU A 120 -1.398 -1.887 -5.989 1.00 0.00 C ATOM 675 CD1 LEU A 120 0.103 -2.118 -5.907 1.00 0.00 C ATOM 676 CD2 LEU A 120 -2.152 -3.183 -5.727 1.00 0.00 C ATOM 0 H LEU A 120 -3.188 0.233 -3.221 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.882 -2.244 -3.398 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.876 -0.562 -5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.252 0.096 -5.189 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.638 -1.545 -6.996 1.00 0.00 H new ATOM 0 HD11 LEU A 120 0.392 -2.889 -6.621 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.627 -1.192 -6.142 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.367 -2.439 -4.899 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.833 -3.941 -6.443 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -1.941 -3.528 -4.715 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.223 -3.009 -5.836 1.00 0.00 H new ATOM 688 N SER A 121 0.110 0.349 -2.906 1.00 0.00 N ATOM 689 CA SER A 121 1.453 0.729 -2.485 1.00 0.00 C ATOM 690 C SER A 121 1.805 0.102 -1.138 1.00 0.00 C ATOM 691 O SER A 121 2.953 -0.271 -0.897 1.00 0.00 O ATOM 692 CB SER A 121 1.569 2.252 -2.394 1.00 0.00 C ATOM 693 OG SER A 121 2.920 2.668 -2.494 1.00 0.00 O ATOM 0 H SER A 121 -0.522 1.135 -3.058 1.00 0.00 H new ATOM 0 HA SER A 121 2.156 0.359 -3.231 1.00 0.00 H new ATOM 0 HB2 SER A 121 0.984 2.713 -3.190 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.148 2.596 -1.449 1.00 0.00 H new ATOM 0 HG SER A 121 3.397 2.082 -3.118 1.00 0.00 H new ATOM 699 N LYS A 122 0.811 -0.008 -0.263 1.00 0.00 N ATOM 700 CA LYS A 122 1.019 -0.588 1.060 1.00 0.00 C ATOM 701 C LYS A 122 1.324 -2.079 0.963 1.00 0.00 C ATOM 702 O LYS A 122 2.255 -2.575 1.599 1.00 0.00 O ATOM 703 CB LYS A 122 -0.214 -0.365 1.937 1.00 0.00 C ATOM 704 CG LYS A 122 -0.287 1.030 2.538 1.00 0.00 C ATOM 705 CD LYS A 122 -0.641 0.983 4.017 1.00 0.00 C ATOM 706 CE LYS A 122 -0.433 2.335 4.683 1.00 0.00 C ATOM 707 NZ LYS A 122 -0.784 2.301 6.130 1.00 0.00 N ATOM 0 H LYS A 122 -0.145 0.296 -0.445 1.00 0.00 H new ATOM 0 HA LYS A 122 1.876 -0.091 1.514 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -1.110 -0.543 1.342 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -0.215 -1.099 2.742 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.671 1.534 2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -1.032 1.619 2.003 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.680 0.675 4.134 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -0.028 0.232 4.515 1.00 0.00 H new ATOM 0 HE2 LYS A 122 0.607 2.640 4.569 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -1.042 3.085 4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -0.629 3.241 6.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.784 2.035 6.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -0.185 1.603 6.616 1.00 0.00 H new ATOM 721 N ILE A 123 0.533 -2.792 0.167 1.00 0.00 N ATOM 722 CA ILE A 123 0.713 -4.224 -0.007 1.00 0.00 C ATOM 723 C ILE A 123 2.105 -4.549 -0.547 1.00 0.00 C ATOM 724 O ILE A 123 2.728 -5.523 -0.129 1.00 0.00 O ATOM 725 CB ILE A 123 -0.350 -4.814 -0.959 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.755 -4.487 -0.451 1.00 0.00 C ATOM 727 CG2 ILE A 123 -0.170 -6.320 -1.093 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.802 -4.463 -1.544 1.00 0.00 C ATOM 0 H ILE A 123 -0.240 -2.397 -0.368 1.00 0.00 H new ATOM 0 HA ILE A 123 0.599 -4.676 0.978 1.00 0.00 H new ATOM 0 HB ILE A 123 -0.222 -4.364 -1.944 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -2.042 -5.223 0.300 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.737 -3.517 0.045 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.928 -6.718 -1.768 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.821 -6.534 -1.494 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -0.274 -6.787 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.774 -4.225 -1.112 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -2.539 -3.707 -2.284 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.848 -5.440 -2.025 1.00 0.00 H new ATOM 740 N VAL A 124 2.584 -3.729 -1.477 1.00 0.00 N ATOM 741 CA VAL A 124 3.900 -3.938 -2.070 1.00 0.00 C ATOM 742 C VAL A 124 4.999 -3.838 -1.017 1.00 0.00 C ATOM 743 O VAL A 124 5.859 -4.714 -0.918 1.00 0.00 O ATOM 744 CB VAL A 124 4.184 -2.918 -3.189 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.475 -3.267 -3.914 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.019 -2.852 -4.167 1.00 0.00 C ATOM 0 H VAL A 124 2.083 -2.916 -1.835 1.00 0.00 H new ATOM 0 HA VAL A 124 3.897 -4.941 -2.497 1.00 0.00 H new ATOM 0 HB VAL A 124 4.301 -1.935 -2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.659 -2.536 -4.701 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.304 -3.256 -3.207 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.388 -4.260 -4.355 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.241 -2.126 -4.949 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.865 -3.833 -4.616 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.116 -2.550 -3.637 1.00 0.00 H new ATOM 756 N ALA A 125 4.968 -2.763 -0.236 1.00 0.00 N ATOM 757 CA ALA A 125 5.960 -2.546 0.803 1.00 0.00 C ATOM 758 C ALA A 125 5.939 -3.672 1.833 1.00 0.00 C ATOM 759 O ALA A 125 6.985 -4.096 2.324 1.00 0.00 O ATOM 760 CB ALA A 125 5.727 -1.204 1.481 1.00 0.00 C ATOM 0 H ALA A 125 4.264 -2.029 -0.306 1.00 0.00 H new ATOM 0 HA ALA A 125 6.944 -2.540 0.334 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.477 -1.054 2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.803 -0.405 0.743 1.00 0.00 H new ATOM 0 HB3 ALA A 125 4.733 -1.190 1.929 1.00 0.00 H new ATOM 766 N SER A 126 4.741 -4.146 2.158 1.00 0.00 N ATOM 767 CA SER A 126 4.579 -5.216 3.130 1.00 0.00 C ATOM 768 C SER A 126 5.372 -6.456 2.726 1.00 0.00 C ATOM 769 O SER A 126 5.774 -7.251 3.577 1.00 0.00 O ATOM 770 CB SER A 126 3.100 -5.572 3.287 1.00 0.00 C ATOM 771 OG SER A 126 2.653 -6.381 2.211 1.00 0.00 O ATOM 0 H SER A 126 3.867 -3.803 1.760 1.00 0.00 H new ATOM 0 HA SER A 126 4.966 -4.860 4.085 1.00 0.00 H new ATOM 0 HB2 SER A 126 2.947 -6.098 4.229 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.506 -4.659 3.331 1.00 0.00 H new ATOM 0 HG SER A 126 3.094 -6.097 1.383 1.00 0.00 H new ATOM 777 N LYS A 127 5.596 -6.614 1.427 1.00 0.00 N ATOM 778 CA LYS A 127 6.343 -7.756 0.915 1.00 0.00 C ATOM 779 C LYS A 127 7.845 -7.499 0.983 1.00 0.00 C ATOM 780 O LYS A 127 8.642 -8.436 1.056 1.00 0.00 O ATOM 781 CB LYS A 127 5.930 -8.057 -0.529 1.00 0.00 C ATOM 782 CG LYS A 127 4.427 -8.017 -0.752 1.00 0.00 C ATOM 783 CD LYS A 127 3.929 -9.277 -1.447 1.00 0.00 C ATOM 784 CE LYS A 127 3.279 -10.238 -0.462 1.00 0.00 C ATOM 785 NZ LYS A 127 1.794 -10.183 -0.530 1.00 0.00 N ATOM 0 H LYS A 127 5.271 -5.966 0.709 1.00 0.00 H new ATOM 0 HA LYS A 127 6.112 -8.619 1.540 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.407 -7.336 -1.193 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.304 -9.042 -0.807 1.00 0.00 H new ATOM 0 HG2 LYS A 127 3.919 -7.905 0.206 1.00 0.00 H new ATOM 0 HG3 LYS A 127 4.171 -7.144 -1.353 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.211 -9.007 -2.221 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.762 -9.773 -1.944 1.00 0.00 H new ATOM 0 HE2 LYS A 127 3.614 -11.254 -0.671 1.00 0.00 H new ATOM 0 HE3 LYS A 127 3.605 -9.996 0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.390 -10.852 0.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.472 -9.220 -0.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 1.481 -10.438 -1.488 1.00 0.00 H new ATOM 799 N GLY A 128 8.226 -6.227 0.959 1.00 0.00 N ATOM 800 CA GLY A 128 9.632 -5.871 1.018 1.00 0.00 C ATOM 801 C GLY A 128 9.928 -4.549 0.336 1.00 0.00 C ATOM 802 O GLY A 128 10.935 -3.904 0.629 1.00 0.00 O ATOM 0 H GLY A 128 7.586 -5.435 0.900 1.00 0.00 H new ATOM 0 HA2 GLY A 128 9.946 -5.816 2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.222 -6.658 0.549 1.00 0.00 H new ATOM 806 N GLY A 129 9.049 -4.145 -0.577 1.00 0.00 N ATOM 807 CA GLY A 129 9.239 -2.894 -1.288 1.00 0.00 C ATOM 808 C GLY A 129 8.737 -2.961 -2.716 1.00 0.00 C ATOM 809 O GLY A 129 7.860 -2.192 -3.109 1.00 0.00 O ATOM 0 H GLY A 129 8.209 -4.662 -0.837 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.718 -2.096 -0.759 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.298 -2.637 -1.289 1.00 0.00 H new ATOM 813 N PHE A 130 9.292 -3.887 -3.494 1.00 0.00 N ATOM 814 CA PHE A 130 8.896 -4.058 -4.887 1.00 0.00 C ATOM 815 C PHE A 130 9.679 -5.194 -5.539 1.00 0.00 C ATOM 816 O PHE A 130 9.096 -6.145 -6.058 1.00 0.00 O ATOM 817 CB PHE A 130 9.117 -2.759 -5.668 1.00 0.00 C ATOM 818 CG PHE A 130 8.706 -2.847 -7.111 1.00 0.00 C ATOM 819 CD1 PHE A 130 9.496 -3.517 -8.030 1.00 0.00 C ATOM 820 CD2 PHE A 130 7.528 -2.261 -7.545 1.00 0.00 C ATOM 821 CE1 PHE A 130 9.119 -3.600 -9.357 1.00 0.00 C ATOM 822 CE2 PHE A 130 7.145 -2.340 -8.871 1.00 0.00 C ATOM 823 CZ PHE A 130 7.943 -3.010 -9.777 1.00 0.00 C ATOM 0 H PHE A 130 10.019 -4.531 -3.181 1.00 0.00 H new ATOM 0 HA PHE A 130 7.836 -4.310 -4.908 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.557 -1.956 -5.188 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.171 -2.488 -5.615 1.00 0.00 H new ATOM 0 HD1 PHE A 130 10.417 -3.980 -7.706 1.00 0.00 H new ATOM 0 HD2 PHE A 130 6.901 -1.736 -6.839 1.00 0.00 H new ATOM 0 HE1 PHE A 130 9.743 -4.126 -10.065 1.00 0.00 H new ATOM 0 HE2 PHE A 130 6.224 -1.879 -9.197 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.648 -3.073 -10.814 1.00 0.00 H new ATOM 833 N GLU A 131 11.004 -5.086 -5.511 1.00 0.00 N ATOM 834 CA GLU A 131 11.868 -6.103 -6.100 1.00 0.00 C ATOM 835 C GLU A 131 11.600 -7.472 -5.483 1.00 0.00 C ATOM 836 O GLU A 131 11.601 -8.488 -6.177 1.00 0.00 O ATOM 837 CB GLU A 131 13.338 -5.724 -5.912 1.00 0.00 C ATOM 838 CG GLU A 131 13.822 -4.665 -6.889 1.00 0.00 C ATOM 839 CD GLU A 131 15.251 -4.898 -7.340 1.00 0.00 C ATOM 840 OE1 GLU A 131 16.055 -5.401 -6.529 1.00 0.00 O ATOM 841 OE2 GLU A 131 15.565 -4.577 -8.505 1.00 0.00 O ATOM 0 H GLU A 131 11.503 -4.304 -5.086 1.00 0.00 H new ATOM 0 HA GLU A 131 11.647 -6.157 -7.166 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.484 -5.362 -4.894 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.952 -6.617 -6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 131 13.167 -4.653 -7.760 1.00 0.00 H new ATOM 0 HG3 GLU A 131 13.748 -3.683 -6.421 1.00 0.00 H new ATOM 848 N MET A 132 11.369 -7.491 -4.174 1.00 0.00 N ATOM 849 CA MET A 132 11.097 -8.736 -3.465 1.00 0.00 C ATOM 850 C MET A 132 9.838 -9.404 -4.009 1.00 0.00 C ATOM 851 O MET A 132 9.768 -10.627 -4.116 1.00 0.00 O ATOM 852 CB MET A 132 10.939 -8.471 -1.967 1.00 0.00 C ATOM 853 CG MET A 132 12.129 -7.757 -1.346 1.00 0.00 C ATOM 854 SD MET A 132 13.145 -8.849 -0.331 1.00 0.00 S ATOM 855 CE MET A 132 12.330 -8.691 1.256 1.00 0.00 C ATOM 0 H MET A 132 11.365 -6.659 -3.584 1.00 0.00 H new ATOM 0 HA MET A 132 11.942 -9.407 -3.621 1.00 0.00 H new ATOM 0 HB2 MET A 132 10.042 -7.873 -1.805 1.00 0.00 H new ATOM 0 HB3 MET A 132 10.787 -9.420 -1.453 1.00 0.00 H new ATOM 0 HG2 MET A 132 12.743 -7.328 -2.138 1.00 0.00 H new ATOM 0 HG3 MET A 132 11.772 -6.928 -0.735 1.00 0.00 H new ATOM 0 HE1 MET A 132 12.844 -9.310 1.992 1.00 0.00 H new ATOM 0 HE2 MET A 132 12.356 -7.649 1.576 1.00 0.00 H new ATOM 0 HE3 MET A 132 11.294 -9.018 1.167 1.00 0.00 H new ATOM 865 N VAL A 133 8.846 -8.589 -4.351 1.00 0.00 N ATOM 866 CA VAL A 133 7.589 -9.098 -4.886 1.00 0.00 C ATOM 867 C VAL A 133 7.793 -9.729 -6.259 1.00 0.00 C ATOM 868 O VAL A 133 7.269 -10.806 -6.541 1.00 0.00 O ATOM 869 CB VAL A 133 6.535 -7.979 -4.999 1.00 0.00 C ATOM 870 CG1 VAL A 133 5.184 -8.556 -5.398 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.427 -7.210 -3.689 1.00 0.00 C ATOM 0 H VAL A 133 8.888 -7.573 -4.267 1.00 0.00 H new ATOM 0 HA VAL A 133 7.231 -9.857 -4.190 1.00 0.00 H new ATOM 0 HB VAL A 133 6.853 -7.284 -5.776 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.452 -7.751 -5.473 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.273 -9.057 -6.362 1.00 0.00 H new ATOM 0 HG13 VAL A 133 4.858 -9.274 -4.645 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.678 -6.424 -3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.134 -7.891 -2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.392 -6.763 -3.449 1.00 0.00 H new ATOM 881 N THR A 134 8.557 -9.050 -7.110 1.00 0.00 N ATOM 882 CA THR A 134 8.830 -9.545 -8.454 1.00 0.00 C ATOM 883 C THR A 134 9.723 -10.781 -8.408 1.00 0.00 C ATOM 884 O THR A 134 9.463 -11.772 -9.089 1.00 0.00 O ATOM 885 CB THR A 134 9.491 -8.455 -9.298 1.00 0.00 C ATOM 886 OG1 THR A 134 9.005 -7.174 -8.933 1.00 0.00 O ATOM 887 CG2 THR A 134 9.262 -8.625 -10.784 1.00 0.00 C ATOM 0 H THR A 134 8.997 -8.156 -6.892 1.00 0.00 H new ATOM 0 HA THR A 134 7.880 -9.822 -8.911 1.00 0.00 H new ATOM 0 HB THR A 134 10.559 -8.545 -9.099 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.474 -6.487 -9.451 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.758 -7.818 -11.323 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.670 -9.582 -11.108 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.193 -8.597 -10.993 1.00 0.00 H new ATOM 895 N LYS A 135 10.778 -10.712 -7.602 1.00 0.00 N ATOM 896 CA LYS A 135 11.708 -11.820 -7.468 1.00 0.00 C ATOM 897 C LYS A 135 11.006 -13.058 -6.921 1.00 0.00 C ATOM 898 O LYS A 135 11.319 -14.184 -7.305 1.00 0.00 O ATOM 899 CB LYS A 135 12.870 -11.431 -6.551 1.00 0.00 C ATOM 900 CG LYS A 135 13.735 -10.311 -7.108 1.00 0.00 C ATOM 901 CD LYS A 135 14.627 -10.805 -8.235 1.00 0.00 C ATOM 902 CE LYS A 135 15.726 -11.718 -7.717 1.00 0.00 C ATOM 903 NZ LYS A 135 15.379 -13.157 -7.885 1.00 0.00 N ATOM 0 H LYS A 135 11.008 -9.898 -7.032 1.00 0.00 H new ATOM 0 HA LYS A 135 12.098 -12.054 -8.458 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.472 -11.125 -5.584 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.493 -12.308 -6.376 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.098 -9.505 -7.473 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.351 -9.895 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.025 -11.340 -8.969 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.072 -9.953 -8.748 1.00 0.00 H new ATOM 0 HE2 LYS A 135 16.655 -11.504 -8.246 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.905 -11.509 -6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 15.575 -13.667 -7.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.370 -13.246 -8.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.950 -13.564 -8.653 1.00 0.00 H new ATOM 917 N GLU A 136 10.051 -12.837 -6.022 1.00 0.00 N ATOM 918 CA GLU A 136 9.299 -13.931 -5.419 1.00 0.00 C ATOM 919 C GLU A 136 8.057 -14.263 -6.245 1.00 0.00 C ATOM 920 O GLU A 136 7.495 -15.350 -6.124 1.00 0.00 O ATOM 921 CB GLU A 136 8.895 -13.572 -3.989 1.00 0.00 C ATOM 922 CG GLU A 136 10.074 -13.429 -3.042 1.00 0.00 C ATOM 923 CD GLU A 136 9.647 -13.284 -1.594 1.00 0.00 C ATOM 924 OE1 GLU A 136 8.784 -12.427 -1.314 1.00 0.00 O ATOM 925 OE2 GLU A 136 10.175 -14.029 -0.743 1.00 0.00 O ATOM 0 H GLU A 136 9.780 -11.909 -5.695 1.00 0.00 H new ATOM 0 HA GLU A 136 9.942 -14.811 -5.398 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.335 -12.637 -4.002 1.00 0.00 H new ATOM 0 HB3 GLU A 136 8.223 -14.340 -3.606 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.721 -14.300 -3.140 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.664 -12.559 -3.331 1.00 0.00 H new ATOM 932 N LYS A 137 7.633 -13.318 -7.083 1.00 0.00 N ATOM 933 CA LYS A 137 6.458 -13.512 -7.926 1.00 0.00 C ATOM 934 C LYS A 137 5.187 -13.574 -7.086 1.00 0.00 C ATOM 935 O LYS A 137 4.276 -14.347 -7.376 1.00 0.00 O ATOM 936 CB LYS A 137 6.601 -14.791 -8.758 1.00 0.00 C ATOM 937 CG LYS A 137 6.288 -14.596 -10.231 1.00 0.00 C ATOM 938 CD LYS A 137 6.071 -15.926 -10.934 1.00 0.00 C ATOM 939 CE LYS A 137 4.609 -16.346 -10.901 1.00 0.00 C ATOM 940 NZ LYS A 137 3.986 -16.300 -12.252 1.00 0.00 N ATOM 0 H LYS A 137 8.087 -12.411 -7.195 1.00 0.00 H new ATOM 0 HA LYS A 137 6.383 -12.658 -8.600 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.619 -15.167 -8.658 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.938 -15.555 -8.352 1.00 0.00 H new ATOM 0 HG2 LYS A 137 5.396 -13.978 -10.336 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.107 -14.059 -10.710 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.405 -15.850 -11.969 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.681 -16.693 -10.458 1.00 0.00 H new ATOM 0 HE2 LYS A 137 4.531 -17.356 -10.500 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.059 -15.691 -10.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.990 -16.593 -12.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.037 -15.331 -12.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 4.495 -16.944 -12.891 1.00 0.00 H new ATOM 954 N LYS A 138 5.134 -12.754 -6.040 1.00 0.00 N ATOM 955 CA LYS A 138 3.973 -12.716 -5.158 1.00 0.00 C ATOM 956 C LYS A 138 3.031 -11.573 -5.535 1.00 0.00 C ATOM 957 O LYS A 138 2.187 -11.168 -4.736 1.00 0.00 O ATOM 958 CB LYS A 138 4.419 -12.563 -3.703 1.00 0.00 C ATOM 959 CG LYS A 138 5.159 -13.777 -3.163 1.00 0.00 C ATOM 960 CD LYS A 138 4.579 -14.243 -1.837 1.00 0.00 C ATOM 961 CE LYS A 138 5.225 -13.526 -0.664 1.00 0.00 C ATOM 962 NZ LYS A 138 4.433 -13.680 0.588 1.00 0.00 N ATOM 0 H LYS A 138 5.881 -12.108 -5.783 1.00 0.00 H new ATOM 0 HA LYS A 138 3.434 -13.656 -5.272 1.00 0.00 H new ATOM 0 HB2 LYS A 138 5.064 -11.688 -3.619 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.544 -12.375 -3.081 1.00 0.00 H new ATOM 0 HG2 LYS A 138 5.106 -14.588 -3.889 1.00 0.00 H new ATOM 0 HG3 LYS A 138 6.213 -13.533 -3.034 1.00 0.00 H new ATOM 0 HD2 LYS A 138 3.504 -14.065 -1.826 1.00 0.00 H new ATOM 0 HD3 LYS A 138 4.725 -15.318 -1.733 1.00 0.00 H new ATOM 0 HE2 LYS A 138 6.230 -13.918 -0.508 1.00 0.00 H new ATOM 0 HE3 LYS A 138 5.329 -12.467 -0.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 4.908 -13.176 1.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 3.482 -13.283 0.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 4.355 -14.689 0.827 1.00 0.00 H new ATOM 976 N TRP A 139 3.177 -11.061 -6.754 1.00 0.00 N ATOM 977 CA TRP A 139 2.334 -9.970 -7.229 1.00 0.00 C ATOM 978 C TRP A 139 0.890 -10.429 -7.389 1.00 0.00 C ATOM 979 O TRP A 139 -0.046 -9.665 -7.151 1.00 0.00 O ATOM 980 CB TRP A 139 2.862 -9.430 -8.560 1.00 0.00 C ATOM 981 CG TRP A 139 3.952 -8.414 -8.400 1.00 0.00 C ATOM 982 CD1 TRP A 139 5.293 -8.619 -8.557 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.794 -7.034 -8.049 1.00 0.00 C ATOM 984 NE1 TRP A 139 5.979 -7.451 -8.326 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.081 -6.464 -8.013 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.691 -6.226 -7.763 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.292 -5.123 -7.702 1.00 0.00 C ATOM 988 CZ3 TRP A 139 2.902 -4.894 -7.455 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.194 -4.355 -7.426 1.00 0.00 C ATOM 0 H TRP A 139 3.870 -11.384 -7.429 1.00 0.00 H new ATOM 0 HA TRP A 139 2.362 -9.173 -6.486 1.00 0.00 H new ATOM 0 HB2 TRP A 139 3.235 -10.261 -9.158 1.00 0.00 H new ATOM 0 HB3 TRP A 139 2.037 -8.983 -9.115 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.748 -9.561 -8.824 1.00 0.00 H new ATOM 0 HE1 TRP A 139 6.991 -7.337 -8.379 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.691 -6.634 -7.782 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.287 -4.704 -7.680 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.057 -4.260 -7.233 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.326 -3.312 -7.181 1.00 0.00 H new ATOM 1000 N SER A 140 0.716 -11.683 -7.794 1.00 0.00 N ATOM 1001 CA SER A 140 -0.615 -12.248 -7.987 1.00 0.00 C ATOM 1002 C SER A 140 -1.412 -12.215 -6.687 1.00 0.00 C ATOM 1003 O SER A 140 -2.614 -11.948 -6.690 1.00 0.00 O ATOM 1004 CB SER A 140 -0.513 -13.684 -8.502 1.00 0.00 C ATOM 1005 OG SER A 140 0.435 -13.786 -9.549 1.00 0.00 O ATOM 0 H SER A 140 1.480 -12.328 -7.995 1.00 0.00 H new ATOM 0 HA SER A 140 -1.137 -11.642 -8.727 1.00 0.00 H new ATOM 0 HB2 SER A 140 -0.229 -14.347 -7.685 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.489 -14.016 -8.857 1.00 0.00 H new ATOM 0 HG SER A 140 0.482 -14.715 -9.859 1.00 0.00 H new ATOM 1011 N LYS A 141 -0.734 -12.488 -5.576 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.377 -12.489 -4.269 1.00 0.00 C ATOM 1013 C LYS A 141 -1.928 -11.107 -3.933 1.00 0.00 C ATOM 1014 O LYS A 141 -2.947 -10.982 -3.253 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.388 -12.933 -3.190 1.00 0.00 C ATOM 1016 CG LYS A 141 0.310 -14.246 -3.507 1.00 0.00 C ATOM 1017 CD LYS A 141 0.552 -15.065 -2.250 1.00 0.00 C ATOM 1018 CE LYS A 141 0.343 -16.549 -2.504 1.00 0.00 C ATOM 1019 NZ LYS A 141 0.708 -17.372 -1.318 1.00 0.00 N ATOM 0 H LYS A 141 0.261 -12.711 -5.556 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.208 -13.194 -4.302 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.363 -12.155 -3.055 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.917 -13.032 -2.242 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.296 -14.822 -4.207 1.00 0.00 H new ATOM 0 HG3 LYS A 141 1.261 -14.044 -4.000 1.00 0.00 H new ATOM 0 HD2 LYS A 141 1.568 -14.895 -1.894 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -0.122 -14.731 -1.461 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -0.700 -16.729 -2.764 1.00 0.00 H new ATOM 0 HE3 LYS A 141 0.943 -16.859 -3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 0.551 -18.378 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 1.710 -17.220 -1.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 0.118 -17.094 -0.508 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.247 -10.073 -4.415 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.669 -8.699 -4.167 1.00 0.00 C ATOM 1035 C VAL A 142 -3.029 -8.420 -4.794 1.00 0.00 C ATOM 1036 O VAL A 142 -3.927 -7.885 -4.143 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.644 -7.690 -4.718 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -0.998 -6.277 -4.282 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.763 -8.057 -4.270 1.00 0.00 C ATOM 0 H VAL A 142 -0.402 -10.160 -4.979 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.740 -8.580 -3.086 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.675 -7.728 -5.807 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.263 -5.578 -4.681 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.987 -6.017 -4.659 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.998 -6.221 -3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.473 -7.332 -4.669 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.812 -8.050 -3.181 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.014 -9.052 -4.638 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.175 -8.787 -6.065 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.431 -8.567 -6.758 1.00 0.00 C ATOM 1051 C GLY A 143 -5.585 -9.312 -6.118 1.00 0.00 C ATOM 1052 O GLY A 143 -6.721 -8.838 -6.131 1.00 0.00 O ATOM 0 H GLY A 143 -2.448 -9.231 -6.625 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.654 -7.500 -6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.330 -8.883 -7.796 1.00 0.00 H new ATOM 1056 N SER A 144 -5.294 -10.479 -5.553 1.00 0.00 N ATOM 1057 CA SER A 144 -6.316 -11.291 -4.904 1.00 0.00 C ATOM 1058 C SER A 144 -6.862 -10.588 -3.665 1.00 0.00 C ATOM 1059 O SER A 144 -8.071 -10.573 -3.430 1.00 0.00 O ATOM 1060 CB SER A 144 -5.745 -12.657 -4.519 1.00 0.00 C ATOM 1061 OG SER A 144 -5.601 -13.489 -5.657 1.00 0.00 O ATOM 0 H SER A 144 -4.358 -10.884 -5.532 1.00 0.00 H new ATOM 0 HA SER A 144 -7.134 -11.434 -5.610 1.00 0.00 H new ATOM 0 HB2 SER A 144 -4.777 -12.527 -4.035 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.402 -13.138 -3.794 1.00 0.00 H new ATOM 0 HG SER A 144 -5.233 -14.355 -5.384 1.00 0.00 H new ATOM 1067 N ARG A 145 -5.965 -10.006 -2.877 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.359 -9.301 -1.662 1.00 0.00 C ATOM 1069 C ARG A 145 -7.263 -8.116 -1.989 1.00 0.00 C ATOM 1070 O ARG A 145 -8.134 -7.750 -1.201 1.00 0.00 O ATOM 1071 CB ARG A 145 -5.120 -8.824 -0.901 1.00 0.00 C ATOM 1072 CG ARG A 145 -5.139 -9.182 0.577 1.00 0.00 C ATOM 1073 CD ARG A 145 -5.061 -7.945 1.460 1.00 0.00 C ATOM 1074 NE ARG A 145 -3.763 -7.825 2.121 1.00 0.00 N ATOM 1075 CZ ARG A 145 -3.544 -7.071 3.194 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -4.533 -6.368 3.733 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -2.334 -7.020 3.734 1.00 0.00 N ATOM 0 H ARG A 145 -4.961 -10.008 -3.057 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.917 -9.994 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.232 -9.258 -1.360 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.035 -7.742 -1.003 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -6.050 -9.734 0.805 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -4.301 -9.842 0.802 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -5.244 -7.056 0.856 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -5.849 -7.986 2.212 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.978 -8.351 1.736 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -5.467 -6.405 3.324 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -4.359 -5.791 4.556 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -1.570 -7.559 3.326 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -2.167 -6.441 4.557 1.00 0.00 H new ATOM 1091 N LEU A 146 -7.049 -7.520 -3.158 1.00 0.00 N ATOM 1092 CA LEU A 146 -7.844 -6.377 -3.590 1.00 0.00 C ATOM 1093 C LEU A 146 -9.244 -6.817 -4.007 1.00 0.00 C ATOM 1094 O LEU A 146 -10.211 -6.070 -3.856 1.00 0.00 O ATOM 1095 CB LEU A 146 -7.153 -5.657 -4.751 1.00 0.00 C ATOM 1096 CG LEU A 146 -6.323 -4.436 -4.353 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.540 -3.911 -5.546 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -7.219 -3.348 -3.779 1.00 0.00 C ATOM 0 H LEU A 146 -6.332 -7.810 -3.823 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.934 -5.689 -2.750 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.504 -6.367 -5.264 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.912 -5.343 -5.468 1.00 0.00 H new ATOM 0 HG LEU A 146 -5.612 -4.738 -3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -4.955 -3.042 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -4.871 -4.689 -5.913 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.232 -3.625 -6.338 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -6.612 -2.486 -3.501 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.953 -3.049 -4.527 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -7.734 -3.729 -2.897 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.345 -8.034 -4.532 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.627 -8.553 -4.962 1.00 0.00 C ATOM 1112 C GLY A 147 -10.635 -8.944 -6.427 1.00 0.00 C ATOM 1113 O GLY A 147 -11.571 -8.621 -7.159 1.00 0.00 O ATOM 0 H GLY A 147 -8.559 -8.670 -4.667 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -10.885 -9.422 -4.356 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.397 -7.802 -4.786 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.586 -9.640 -6.856 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.474 -10.075 -8.243 1.00 0.00 C ATOM 1119 C TYR A 148 -9.848 -11.548 -8.383 1.00 0.00 C ATOM 1120 O TYR A 148 -9.812 -12.302 -7.412 1.00 0.00 O ATOM 1121 CB TYR A 148 -8.051 -9.847 -8.758 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.762 -8.408 -9.119 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -7.972 -7.386 -8.203 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -7.277 -8.072 -10.377 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -7.708 -6.068 -8.530 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -7.012 -6.758 -10.711 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.228 -5.761 -9.785 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.964 -4.451 -10.114 1.00 0.00 O ATOM 0 H TYR A 148 -8.803 -9.914 -6.263 1.00 0.00 H new ATOM 0 HA TYR A 148 -10.168 -9.484 -8.840 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -7.342 -10.171 -7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -7.886 -10.473 -9.635 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -8.348 -7.624 -7.219 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -7.104 -8.851 -11.105 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -7.877 -5.284 -7.806 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.637 -6.513 -11.694 1.00 0.00 H new ATOM 0 HH TYR A 148 -7.568 -3.861 -9.617 1.00 0.00 H new ATOM 1138 N LEU A 149 -10.204 -11.948 -9.598 1.00 0.00 N ATOM 1139 CA LEU A 149 -10.583 -13.332 -9.866 1.00 0.00 C ATOM 1140 C LEU A 149 -9.455 -14.078 -10.574 1.00 0.00 C ATOM 1141 O LEU A 149 -8.633 -13.472 -11.261 1.00 0.00 O ATOM 1142 CB LEU A 149 -11.854 -13.377 -10.718 1.00 0.00 C ATOM 1143 CG LEU A 149 -12.987 -12.469 -10.239 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -14.066 -12.356 -11.305 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -13.573 -12.991 -8.936 1.00 0.00 C ATOM 0 H LEU A 149 -10.238 -11.335 -10.413 1.00 0.00 H new ATOM 0 HA LEU A 149 -10.775 -13.822 -8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -11.597 -13.103 -11.741 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -12.219 -14.404 -10.745 1.00 0.00 H new ATOM 0 HG LEU A 149 -12.579 -11.475 -10.057 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -14.864 -11.706 -10.947 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.636 -11.936 -12.214 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.471 -13.345 -11.519 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -14.378 -12.333 -8.610 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -13.966 -13.996 -9.091 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -12.795 -13.019 -8.173 1.00 0.00 H new ATOM 1157 N PRO A 150 -9.401 -15.412 -10.415 1.00 0.00 N ATOM 1158 CA PRO A 150 -8.365 -16.240 -11.042 1.00 0.00 C ATOM 1159 C PRO A 150 -8.515 -16.302 -12.558 1.00 0.00 C ATOM 1160 O PRO A 150 -9.607 -16.532 -13.077 1.00 0.00 O ATOM 1161 CB PRO A 150 -8.592 -17.623 -10.426 1.00 0.00 C ATOM 1162 CG PRO A 150 -10.023 -17.628 -10.016 1.00 0.00 C ATOM 1163 CD PRO A 150 -10.342 -16.216 -9.613 1.00 0.00 C ATOM 0 HA PRO A 150 -7.365 -15.842 -10.869 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.384 -18.415 -11.145 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.935 -17.788 -9.572 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -10.663 -17.954 -10.836 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -10.190 -18.317 -9.188 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -11.378 -15.960 -9.833 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -10.195 -16.060 -8.544 1.00 0.00 H new ATOM 1171 N GLY A 151 -7.409 -16.096 -13.266 1.00 0.00 N ATOM 1172 CA GLY A 151 -7.437 -16.132 -14.715 1.00 0.00 C ATOM 1173 C GLY A 151 -6.077 -15.864 -15.328 1.00 0.00 C ATOM 1174 O GLY A 151 -5.070 -15.808 -14.622 1.00 0.00 O ATOM 0 H GLY A 151 -6.493 -15.905 -12.860 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -7.795 -17.108 -15.044 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -8.149 -15.392 -15.080 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.045 -15.700 -16.648 1.00 0.00 N ATOM 1179 CA LYS A 152 -4.798 -15.440 -17.356 1.00 0.00 C ATOM 1180 C LYS A 152 -4.609 -13.944 -17.588 1.00 0.00 C ATOM 1181 O LYS A 152 -5.569 -13.218 -17.848 1.00 0.00 O ATOM 1182 CB LYS A 152 -4.781 -16.180 -18.694 1.00 0.00 C ATOM 1183 CG LYS A 152 -4.957 -17.684 -18.559 1.00 0.00 C ATOM 1184 CD LYS A 152 -4.743 -18.391 -19.887 1.00 0.00 C ATOM 1185 CE LYS A 152 -4.584 -19.892 -19.699 1.00 0.00 C ATOM 1186 NZ LYS A 152 -5.898 -20.577 -19.555 1.00 0.00 N ATOM 0 H LYS A 152 -6.869 -15.743 -17.247 1.00 0.00 H new ATOM 0 HA LYS A 152 -3.976 -15.803 -16.739 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -5.575 -15.785 -19.328 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.837 -15.977 -19.200 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -4.252 -18.069 -17.823 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -5.958 -17.902 -18.186 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -5.588 -18.193 -20.546 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -3.856 -17.988 -20.376 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -4.049 -20.310 -20.552 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -3.976 -20.085 -18.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -5.745 -21.598 -19.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -6.399 -20.197 -18.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -6.469 -20.415 -20.409 1.00 0.00 H new ATOM 1200 N GLY A 153 -3.365 -13.488 -17.492 1.00 0.00 N ATOM 1201 CA GLY A 153 -3.073 -12.081 -17.693 1.00 0.00 C ATOM 1202 C GLY A 153 -3.798 -11.189 -16.705 1.00 0.00 C ATOM 1203 O GLY A 153 -4.922 -10.757 -16.960 1.00 0.00 O ATOM 0 H GLY A 153 -2.553 -14.068 -17.279 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -1.999 -11.920 -17.602 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.353 -11.797 -18.707 1.00 0.00 H new ATOM 1207 N THR A 154 -3.154 -10.915 -15.575 1.00 0.00 N ATOM 1208 CA THR A 154 -3.746 -10.070 -14.545 1.00 0.00 C ATOM 1209 C THR A 154 -2.669 -9.488 -13.634 1.00 0.00 C ATOM 1210 O THR A 154 -2.596 -8.275 -13.441 1.00 0.00 O ATOM 1211 CB THR A 154 -4.753 -10.869 -13.716 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.731 -11.463 -14.551 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.477 -10.032 -12.684 1.00 0.00 C ATOM 0 H THR A 154 -2.223 -11.266 -15.350 1.00 0.00 H new ATOM 0 HA THR A 154 -4.264 -9.248 -15.039 1.00 0.00 H new ATOM 0 HB THR A 154 -4.164 -11.626 -13.198 1.00 0.00 H new ATOM 0 HG1 THR A 154 -5.762 -10.988 -15.408 1.00 0.00 H new ATOM 0 HG21 THR A 154 -6.176 -10.660 -12.131 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.753 -9.600 -11.993 1.00 0.00 H new ATOM 0 HG23 THR A 154 -6.024 -9.232 -13.183 1.00 0.00 H new ATOM 1221 N GLY A 155 -1.837 -10.362 -13.078 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.775 -9.914 -12.195 1.00 0.00 C ATOM 1223 C GLY A 155 0.209 -8.995 -12.891 1.00 0.00 C ATOM 1224 O GLY A 155 0.679 -8.020 -12.304 1.00 0.00 O ATOM 0 H GLY A 155 -1.878 -11.371 -13.222 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -1.211 -9.395 -11.342 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -0.243 -10.781 -11.803 1.00 0.00 H new ATOM 1228 N SER A 156 0.520 -9.304 -14.145 1.00 0.00 N ATOM 1229 CA SER A 156 1.455 -8.498 -14.921 1.00 0.00 C ATOM 1230 C SER A 156 0.886 -7.109 -15.184 1.00 0.00 C ATOM 1231 O SER A 156 1.622 -6.122 -15.224 1.00 0.00 O ATOM 1232 CB SER A 156 1.777 -9.189 -16.248 1.00 0.00 C ATOM 1233 OG SER A 156 2.401 -10.443 -16.034 1.00 0.00 O ATOM 0 H SER A 156 0.138 -10.107 -14.646 1.00 0.00 H new ATOM 0 HA SER A 156 2.372 -8.392 -14.342 1.00 0.00 H new ATOM 0 HB2 SER A 156 0.860 -9.329 -16.820 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.430 -8.552 -16.844 1.00 0.00 H new ATOM 0 HG SER A 156 2.594 -10.864 -16.898 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.430 -7.036 -15.360 1.00 0.00 N ATOM 1240 CA LEU A 157 -1.098 -5.766 -15.619 1.00 0.00 C ATOM 1241 C LEU A 157 -0.982 -4.837 -14.414 1.00 0.00 C ATOM 1242 O LEU A 157 -0.669 -3.655 -14.557 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.570 -5.999 -15.959 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.849 -6.355 -17.420 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -2.344 -7.755 -17.734 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -4.336 -6.243 -17.721 1.00 0.00 C ATOM 0 H LEU A 157 -1.054 -7.842 -15.328 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.608 -5.292 -16.470 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.951 -6.801 -15.327 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -3.132 -5.100 -15.706 1.00 0.00 H new ATOM 0 HG LEU A 157 -2.316 -5.648 -18.055 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -2.551 -7.991 -18.778 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -1.269 -7.802 -17.558 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -2.849 -8.477 -17.092 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -4.516 -6.500 -18.765 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -4.890 -6.927 -17.078 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -4.669 -5.222 -17.536 1.00 0.00 H new ATOM 1258 N LEU A 158 -1.239 -5.379 -13.228 1.00 0.00 N ATOM 1259 CA LEU A 158 -1.162 -4.599 -11.999 1.00 0.00 C ATOM 1260 C LEU A 158 0.247 -4.054 -11.786 1.00 0.00 C ATOM 1261 O LEU A 158 0.425 -2.947 -11.278 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.578 -5.454 -10.800 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.936 -6.145 -10.935 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -3.162 -7.107 -9.779 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -4.052 -5.115 -11.002 1.00 0.00 C ATOM 0 H LEU A 158 -1.502 -6.355 -13.092 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.847 -3.756 -12.091 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.816 -6.215 -10.634 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.596 -4.822 -9.912 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.942 -6.718 -11.862 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -4.133 -7.589 -9.892 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -2.378 -7.865 -9.778 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -3.137 -6.557 -8.838 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -5.011 -5.624 -11.098 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -4.049 -4.515 -10.092 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.897 -4.467 -11.864 1.00 0.00 H new ATOM 1277 N LYS A 159 1.243 -4.841 -12.178 1.00 0.00 N ATOM 1278 CA LYS A 159 2.637 -4.438 -12.030 1.00 0.00 C ATOM 1279 C LYS A 159 2.973 -3.283 -12.969 1.00 0.00 C ATOM 1280 O LYS A 159 3.719 -2.373 -12.607 1.00 0.00 O ATOM 1281 CB LYS A 159 3.563 -5.626 -12.305 1.00 0.00 C ATOM 1282 CG LYS A 159 4.608 -5.845 -11.223 1.00 0.00 C ATOM 1283 CD LYS A 159 5.667 -4.756 -11.243 1.00 0.00 C ATOM 1284 CE LYS A 159 6.742 -5.042 -12.278 1.00 0.00 C ATOM 1285 NZ LYS A 159 6.515 -4.281 -13.540 1.00 0.00 N ATOM 0 H LYS A 159 1.112 -5.760 -12.600 1.00 0.00 H new ATOM 0 HA LYS A 159 2.787 -4.100 -11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.961 -6.529 -12.406 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.067 -5.470 -13.259 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.124 -5.865 -10.247 1.00 0.00 H new ATOM 0 HG3 LYS A 159 5.081 -6.817 -11.364 1.00 0.00 H new ATOM 0 HD2 LYS A 159 5.199 -3.796 -11.459 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.123 -4.673 -10.257 1.00 0.00 H new ATOM 0 HE2 LYS A 159 7.718 -4.783 -11.868 1.00 0.00 H new ATOM 0 HE3 LYS A 159 6.761 -6.110 -12.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 7.427 -4.108 -14.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 5.899 -4.832 -14.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 6.061 -3.371 -13.320 1.00 0.00 H new ATOM 1299 N SER A 160 2.416 -3.327 -14.175 1.00 0.00 N ATOM 1300 CA SER A 160 2.657 -2.283 -15.165 1.00 0.00 C ATOM 1301 C SER A 160 2.053 -0.957 -14.715 1.00 0.00 C ATOM 1302 O SER A 160 2.694 0.090 -14.802 1.00 0.00 O ATOM 1303 CB SER A 160 2.072 -2.691 -16.518 1.00 0.00 C ATOM 1304 OG SER A 160 2.721 -3.843 -17.030 1.00 0.00 O ATOM 0 H SER A 160 1.796 -4.073 -14.490 1.00 0.00 H new ATOM 0 HA SER A 160 3.735 -2.154 -15.267 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.005 -2.888 -16.412 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.175 -1.868 -17.225 1.00 0.00 H new ATOM 0 HG SER A 160 2.440 -4.631 -16.520 1.00 0.00 H new ATOM 1310 N HIS A 161 0.815 -1.009 -14.233 1.00 0.00 N ATOM 1311 CA HIS A 161 0.125 0.188 -13.767 1.00 0.00 C ATOM 1312 C HIS A 161 0.836 0.790 -12.560 1.00 0.00 C ATOM 1313 O HIS A 161 1.009 2.006 -12.472 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.325 -0.141 -13.408 1.00 0.00 C ATOM 1315 CG HIS A 161 -2.148 -0.575 -14.581 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.447 0.255 -15.641 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.737 -1.762 -14.859 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -3.185 -0.401 -16.518 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.374 -1.628 -16.067 1.00 0.00 N ATOM 0 H HIS A 161 0.270 -1.867 -14.155 1.00 0.00 H new ATOM 0 HA HIS A 161 0.135 0.920 -14.574 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.335 -0.930 -12.656 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.787 0.736 -12.955 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.710 -2.650 -14.244 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.568 -0.002 -17.446 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.907 -2.358 -16.540 1.00 0.00 H new ATOM 1328 N TYR A 162 1.249 -0.068 -11.633 1.00 0.00 N ATOM 1329 CA TYR A 162 1.944 0.379 -10.433 1.00 0.00 C ATOM 1330 C TYR A 162 3.268 1.046 -10.788 1.00 0.00 C ATOM 1331 O TYR A 162 3.685 2.006 -10.141 1.00 0.00 O ATOM 1332 CB TYR A 162 2.191 -0.802 -9.492 1.00 0.00 C ATOM 1333 CG TYR A 162 2.688 -0.394 -8.123 1.00 0.00 C ATOM 1334 CD1 TYR A 162 1.946 0.464 -7.322 1.00 0.00 C ATOM 1335 CD2 TYR A 162 3.898 -0.866 -7.633 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.397 0.840 -6.070 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.356 -0.496 -6.383 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.601 0.357 -5.606 1.00 0.00 C ATOM 1339 OH TYR A 162 4.053 0.728 -4.359 1.00 0.00 O ATOM 0 H TYR A 162 1.114 -1.077 -11.691 1.00 0.00 H new ATOM 0 HA TYR A 162 1.313 1.111 -9.929 1.00 0.00 H new ATOM 0 HB2 TYR A 162 1.265 -1.366 -9.380 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.919 -1.473 -9.948 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.001 0.844 -7.683 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.492 -1.534 -8.239 1.00 0.00 H new ATOM 0 HE1 TYR A 162 1.809 1.509 -5.459 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.300 -0.873 -6.017 1.00 0.00 H new ATOM 0 HH TYR A 162 5.033 0.731 -4.354 1.00 0.00 H new ATOM 1349 N GLU A 163 3.923 0.532 -11.825 1.00 0.00 N ATOM 1350 CA GLU A 163 5.198 1.078 -12.271 1.00 0.00 C ATOM 1351 C GLU A 163 4.997 2.045 -13.434 1.00 0.00 C ATOM 1352 O GLU A 163 5.725 2.002 -14.427 1.00 0.00 O ATOM 1353 CB GLU A 163 6.141 -0.053 -12.688 1.00 0.00 C ATOM 1354 CG GLU A 163 7.584 0.390 -12.865 1.00 0.00 C ATOM 1355 CD GLU A 163 8.329 0.492 -11.549 1.00 0.00 C ATOM 1356 OE1 GLU A 163 8.256 -0.465 -10.750 1.00 0.00 O ATOM 1357 OE2 GLU A 163 8.983 1.530 -11.315 1.00 0.00 O ATOM 0 H GLU A 163 3.590 -0.262 -12.372 1.00 0.00 H new ATOM 0 HA GLU A 163 5.643 1.625 -11.440 1.00 0.00 H new ATOM 0 HB2 GLU A 163 6.102 -0.842 -11.937 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.785 -0.485 -13.623 1.00 0.00 H new ATOM 0 HG2 GLU A 163 8.099 -0.316 -13.516 1.00 0.00 H new ATOM 0 HG3 GLU A 163 7.604 1.358 -13.365 1.00 0.00 H new ATOM 1364 N ARG A 164 4.002 2.917 -13.305 1.00 0.00 N ATOM 1365 CA ARG A 164 3.703 3.895 -14.341 1.00 0.00 C ATOM 1366 C ARG A 164 3.471 5.277 -13.738 1.00 0.00 C ATOM 1367 O ARG A 164 4.003 6.275 -14.224 1.00 0.00 O ATOM 1368 CB ARG A 164 2.472 3.458 -15.142 1.00 0.00 C ATOM 1369 CG ARG A 164 2.769 3.177 -16.607 1.00 0.00 C ATOM 1370 CD ARG A 164 1.803 2.155 -17.185 1.00 0.00 C ATOM 1371 NE ARG A 164 2.498 1.092 -17.906 1.00 0.00 N ATOM 1372 CZ ARG A 164 1.906 0.273 -18.772 1.00 0.00 C ATOM 1373 NH1 ARG A 164 0.609 0.394 -19.028 1.00 0.00 N ATOM 1374 NH2 ARG A 164 2.612 -0.667 -19.385 1.00 0.00 N ATOM 0 H ARG A 164 3.389 2.965 -12.491 1.00 0.00 H new ATOM 0 HA ARG A 164 4.562 3.954 -15.010 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.052 2.561 -14.686 1.00 0.00 H new ATOM 0 HB3 ARG A 164 1.711 4.236 -15.077 1.00 0.00 H new ATOM 0 HG2 ARG A 164 2.704 4.104 -17.177 1.00 0.00 H new ATOM 0 HG3 ARG A 164 3.791 2.812 -16.709 1.00 0.00 H new ATOM 0 HD2 ARG A 164 1.211 1.720 -16.380 1.00 0.00 H new ATOM 0 HD3 ARG A 164 1.107 2.655 -17.858 1.00 0.00 H new ATOM 0 HE ARG A 164 3.496 0.970 -17.736 1.00 0.00 H new ATOM 0 HH11 ARG A 164 0.062 1.117 -18.560 1.00 0.00 H new ATOM 0 HH12 ARG A 164 0.159 -0.236 -19.692 1.00 0.00 H new ATOM 0 HH21 ARG A 164 3.609 -0.763 -19.193 1.00 0.00 H new ATOM 0 HH22 ARG A 164 2.158 -1.295 -20.049 1.00 0.00 H new ATOM 1388 N ILE A 165 2.673 5.326 -12.677 1.00 0.00 N ATOM 1389 CA ILE A 165 2.368 6.588 -12.009 1.00 0.00 C ATOM 1390 C ILE A 165 2.471 6.454 -10.491 1.00 0.00 C ATOM 1391 O ILE A 165 2.893 7.384 -9.804 1.00 0.00 O ATOM 1392 CB ILE A 165 0.956 7.092 -12.366 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.656 6.855 -13.849 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.820 8.569 -12.023 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.168 5.611 -14.109 1.00 0.00 C ATOM 0 H ILE A 165 2.226 4.509 -12.261 1.00 0.00 H new ATOM 0 HA ILE A 165 3.106 7.309 -12.360 1.00 0.00 H new ATOM 0 HB ILE A 165 0.230 6.530 -11.778 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.127 7.721 -14.247 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.597 6.778 -14.394 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.182 8.912 -12.280 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.989 8.712 -10.956 1.00 0.00 H new ATOM 0 HG23 ILE A 165 1.555 9.143 -12.587 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.342 5.507 -15.180 1.00 0.00 H new ATOM 0 HD12 ILE A 165 0.368 4.736 -13.742 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.124 5.694 -13.593 1.00 0.00 H new ATOM 1407 N LEU A 166 2.073 5.297 -9.972 1.00 0.00 N ATOM 1408 CA LEU A 166 2.109 5.047 -8.535 1.00 0.00 C ATOM 1409 C LEU A 166 3.543 4.931 -8.023 1.00 0.00 C ATOM 1410 O LEU A 166 4.051 5.836 -7.361 1.00 0.00 O ATOM 1411 CB LEU A 166 1.336 3.768 -8.201 1.00 0.00 C ATOM 1412 CG LEU A 166 -0.168 3.827 -8.476 1.00 0.00 C ATOM 1413 CD1 LEU A 166 -0.448 3.654 -9.961 1.00 0.00 C ATOM 1414 CD2 LEU A 166 -0.897 2.764 -7.669 1.00 0.00 C ATOM 0 H LEU A 166 1.721 4.516 -10.526 1.00 0.00 H new ATOM 0 HA LEU A 166 1.639 5.896 -8.040 1.00 0.00 H new ATOM 0 HB2 LEU A 166 1.762 2.945 -8.774 1.00 0.00 H new ATOM 0 HB3 LEU A 166 1.488 3.535 -7.147 1.00 0.00 H new ATOM 0 HG LEU A 166 -0.536 4.806 -8.170 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -1.523 3.699 -10.136 1.00 0.00 H new ATOM 0 HD12 LEU A 166 0.044 4.450 -10.519 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -0.066 2.689 -10.293 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -1.966 2.819 -7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -0.524 1.778 -7.946 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -0.724 2.932 -6.606 1.00 0.00 H new ATOM 1426 N TYR A 167 4.186 3.809 -8.324 1.00 0.00 N ATOM 1427 CA TYR A 167 5.557 3.564 -7.886 1.00 0.00 C ATOM 1428 C TYR A 167 6.506 4.686 -8.314 1.00 0.00 C ATOM 1429 O TYR A 167 7.227 5.241 -7.485 1.00 0.00 O ATOM 1430 CB TYR A 167 6.057 2.226 -8.431 1.00 0.00 C ATOM 1431 CG TYR A 167 7.098 1.571 -7.553 1.00 0.00 C ATOM 1432 CD1 TYR A 167 6.893 1.438 -6.185 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.286 1.089 -8.089 1.00 0.00 C ATOM 1434 CE1 TYR A 167 7.842 0.843 -5.376 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.239 0.492 -7.286 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.013 0.372 -5.931 1.00 0.00 C ATOM 1437 OH TYR A 167 9.962 -0.220 -5.129 1.00 0.00 O ATOM 0 H TYR A 167 3.779 3.051 -8.872 1.00 0.00 H new ATOM 0 HA TYR A 167 5.548 3.534 -6.796 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.210 1.549 -8.544 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.476 2.381 -9.425 1.00 0.00 H new ATOM 0 HD1 TYR A 167 5.977 1.806 -5.747 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.467 1.182 -9.150 1.00 0.00 H new ATOM 0 HE1 TYR A 167 7.667 0.747 -4.314 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.157 0.121 -7.718 1.00 0.00 H new ATOM 0 HH TYR A 167 9.649 -0.224 -4.200 1.00 0.00 H new ATOM 1447 N PRO A 168 6.538 5.027 -9.617 1.00 0.00 N ATOM 1448 CA PRO A 168 7.426 6.075 -10.130 1.00 0.00 C ATOM 1449 C PRO A 168 7.258 7.403 -9.399 1.00 0.00 C ATOM 1450 O PRO A 168 8.187 8.210 -9.347 1.00 0.00 O ATOM 1451 CB PRO A 168 7.023 6.219 -11.606 1.00 0.00 C ATOM 1452 CG PRO A 168 5.741 5.472 -11.754 1.00 0.00 C ATOM 1453 CD PRO A 168 5.740 4.416 -10.688 1.00 0.00 C ATOM 0 HA PRO A 168 8.473 5.808 -9.989 1.00 0.00 H new ATOM 0 HB2 PRO A 168 6.898 7.268 -11.876 1.00 0.00 H new ATOM 0 HB3 PRO A 168 7.791 5.810 -12.262 1.00 0.00 H new ATOM 0 HG2 PRO A 168 4.887 6.140 -11.640 1.00 0.00 H new ATOM 0 HG3 PRO A 168 5.665 5.024 -12.745 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.729 4.180 -10.354 1.00 0.00 H new ATOM 0 HD3 PRO A 168 6.184 3.485 -11.041 1.00 0.00 H new ATOM 1461 N TYR A 169 6.079 7.629 -8.830 1.00 0.00 N ATOM 1462 CA TYR A 169 5.814 8.866 -8.099 1.00 0.00 C ATOM 1463 C TYR A 169 6.803 9.034 -6.948 1.00 0.00 C ATOM 1464 O TYR A 169 7.460 10.069 -6.828 1.00 0.00 O ATOM 1465 CB TYR A 169 4.380 8.875 -7.562 1.00 0.00 C ATOM 1466 CG TYR A 169 4.061 10.073 -6.693 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.052 11.357 -7.222 1.00 0.00 C ATOM 1468 CD2 TYR A 169 3.769 9.917 -5.344 1.00 0.00 C ATOM 1469 CE1 TYR A 169 3.762 12.452 -6.432 1.00 0.00 C ATOM 1470 CE2 TYR A 169 3.478 11.006 -4.547 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.475 12.271 -5.095 1.00 0.00 C ATOM 1472 OH TYR A 169 3.186 13.359 -4.303 1.00 0.00 O ATOM 0 H TYR A 169 5.295 6.977 -8.859 1.00 0.00 H new ATOM 0 HA TYR A 169 5.937 9.701 -8.789 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.687 8.853 -8.403 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.212 7.965 -6.986 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.276 11.502 -8.269 1.00 0.00 H new ATOM 0 HD2 TYR A 169 3.770 8.927 -4.911 1.00 0.00 H new ATOM 0 HE1 TYR A 169 3.760 13.444 -6.859 1.00 0.00 H new ATOM 0 HE2 TYR A 169 3.254 10.868 -3.500 1.00 0.00 H new ATOM 0 HH TYR A 169 3.006 13.059 -3.388 1.00 0.00 H new ATOM 1482 N GLU A 170 6.903 8.010 -6.105 1.00 0.00 N ATOM 1483 CA GLU A 170 7.807 8.038 -4.966 1.00 0.00 C ATOM 1484 C GLU A 170 9.239 8.328 -5.406 1.00 0.00 C ATOM 1485 O GLU A 170 9.904 9.206 -4.854 1.00 0.00 O ATOM 1486 CB GLU A 170 7.753 6.709 -4.212 1.00 0.00 C ATOM 1487 CG GLU A 170 8.368 6.772 -2.824 1.00 0.00 C ATOM 1488 CD GLU A 170 7.327 6.737 -1.722 1.00 0.00 C ATOM 1489 OE1 GLU A 170 6.327 7.478 -1.827 1.00 0.00 O ATOM 1490 OE2 GLU A 170 7.512 5.969 -0.754 1.00 0.00 O ATOM 0 H GLU A 170 6.365 7.148 -6.193 1.00 0.00 H new ATOM 0 HA GLU A 170 7.484 8.840 -4.302 1.00 0.00 H new ATOM 0 HB2 GLU A 170 6.714 6.392 -4.126 1.00 0.00 H new ATOM 0 HB3 GLU A 170 8.271 5.948 -4.796 1.00 0.00 H new ATOM 0 HG2 GLU A 170 9.055 5.935 -2.697 1.00 0.00 H new ATOM 0 HG3 GLU A 170 8.957 7.684 -2.733 1.00 0.00 H new ATOM 1497 N LEU A 171 9.710 7.582 -6.401 1.00 0.00 N ATOM 1498 CA LEU A 171 11.061 7.754 -6.915 1.00 0.00 C ATOM 1499 C LEU A 171 11.307 9.199 -7.338 1.00 0.00 C ATOM 1500 O LEU A 171 12.417 9.715 -7.206 1.00 0.00 O ATOM 1501 CB LEU A 171 11.302 6.817 -8.101 1.00 0.00 C ATOM 1502 CG LEU A 171 11.013 5.339 -7.830 1.00 0.00 C ATOM 1503 CD1 LEU A 171 11.116 4.532 -9.115 1.00 0.00 C ATOM 1504 CD2 LEU A 171 11.966 4.793 -6.778 1.00 0.00 C ATOM 0 H LEU A 171 9.173 6.851 -6.867 1.00 0.00 H new ATOM 0 HA LEU A 171 11.758 7.506 -6.115 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.682 7.145 -8.935 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.340 6.916 -8.417 1.00 0.00 H new ATOM 0 HG LEU A 171 9.995 5.251 -7.449 1.00 0.00 H new ATOM 0 HD11 LEU A 171 10.907 3.483 -8.904 1.00 0.00 H new ATOM 0 HD12 LEU A 171 10.393 4.907 -9.839 1.00 0.00 H new ATOM 0 HD13 LEU A 171 12.122 4.627 -9.524 1.00 0.00 H new ATOM 0 HD21 LEU A 171 11.745 3.741 -6.598 1.00 0.00 H new ATOM 0 HD22 LEU A 171 12.993 4.894 -7.130 1.00 0.00 H new ATOM 0 HD23 LEU A 171 11.844 5.353 -5.851 1.00 0.00 H new ATOM 1516 N PHE A 172 10.263 9.845 -7.844 1.00 0.00 N ATOM 1517 CA PHE A 172 10.362 11.232 -8.287 1.00 0.00 C ATOM 1518 C PHE A 172 10.572 12.168 -7.101 1.00 0.00 C ATOM 1519 O PHE A 172 11.230 13.201 -7.224 1.00 0.00 O ATOM 1520 CB PHE A 172 9.098 11.632 -9.048 1.00 0.00 C ATOM 1521 CG PHE A 172 9.337 12.675 -10.104 1.00 0.00 C ATOM 1522 CD1 PHE A 172 9.657 13.976 -9.750 1.00 0.00 C ATOM 1523 CD2 PHE A 172 9.241 12.352 -11.447 1.00 0.00 C ATOM 1524 CE1 PHE A 172 9.877 14.937 -10.719 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.460 13.308 -12.420 1.00 0.00 C ATOM 1526 CZ PHE A 172 9.777 14.603 -12.056 1.00 0.00 C ATOM 0 H PHE A 172 9.338 9.431 -7.958 1.00 0.00 H new ATOM 0 HA PHE A 172 11.223 11.317 -8.950 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.669 10.745 -9.515 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.360 12.007 -8.339 1.00 0.00 H new ATOM 0 HD1 PHE A 172 9.735 14.242 -8.706 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.992 11.342 -11.737 1.00 0.00 H new ATOM 0 HE1 PHE A 172 10.127 15.948 -10.431 1.00 0.00 H new ATOM 0 HE2 PHE A 172 9.384 13.044 -13.464 1.00 0.00 H new ATOM 0 HZ PHE A 172 9.946 15.352 -12.815 1.00 0.00 H new ATOM 1536 N GLN A 173 10.008 11.802 -5.956 1.00 0.00 N ATOM 1537 CA GLN A 173 10.131 12.612 -4.750 1.00 0.00 C ATOM 1538 C GLN A 173 11.577 12.645 -4.259 1.00 0.00 C ATOM 1539 O GLN A 173 12.092 13.700 -3.890 1.00 0.00 O ATOM 1540 CB GLN A 173 9.221 12.068 -3.647 1.00 0.00 C ATOM 1541 CG GLN A 173 7.826 11.703 -4.129 1.00 0.00 C ATOM 1542 CD GLN A 173 7.161 12.824 -4.903 1.00 0.00 C ATOM 1543 OE1 GLN A 173 7.168 13.979 -4.474 1.00 0.00 O ATOM 1544 NE2 GLN A 173 6.584 12.491 -6.051 1.00 0.00 N ATOM 0 H GLN A 173 9.461 10.949 -5.837 1.00 0.00 H new ATOM 0 HA GLN A 173 9.825 13.629 -4.996 1.00 0.00 H new ATOM 0 HB2 GLN A 173 9.686 11.186 -3.207 1.00 0.00 H new ATOM 0 HB3 GLN A 173 9.139 12.813 -2.856 1.00 0.00 H new ATOM 0 HG2 GLN A 173 7.885 10.817 -4.760 1.00 0.00 H new ATOM 0 HG3 GLN A 173 7.206 11.442 -3.271 1.00 0.00 H new ATOM 0 HE21 GLN A 173 6.602 11.522 -6.369 1.00 0.00 H new ATOM 0 HE22 GLN A 173 6.123 13.204 -6.616 1.00 0.00 H new ATOM 1553 N SER A 174 12.225 11.484 -4.258 1.00 0.00 N ATOM 1554 CA SER A 174 13.610 11.382 -3.813 1.00 0.00 C ATOM 1555 C SER A 174 14.110 9.945 -3.914 1.00 0.00 C ATOM 1556 O SER A 174 14.838 9.467 -3.043 1.00 0.00 O ATOM 1557 CB SER A 174 13.744 11.881 -2.371 1.00 0.00 C ATOM 1558 OG SER A 174 13.986 13.276 -2.336 1.00 0.00 O ATOM 0 H SER A 174 11.813 10.601 -4.560 1.00 0.00 H new ATOM 0 HA SER A 174 14.221 12.007 -4.465 1.00 0.00 H new ATOM 0 HB2 SER A 174 12.833 11.653 -1.817 1.00 0.00 H new ATOM 0 HB3 SER A 174 14.559 11.355 -1.875 1.00 0.00 H new ATOM 0 HG SER A 174 13.306 13.739 -2.869 1.00 0.00 H new ATOM 1564 N GLY A 175 13.716 9.258 -4.981 1.00 0.00 N ATOM 1565 CA GLY A 175 14.134 7.884 -5.175 1.00 0.00 C ATOM 1566 C GLY A 175 14.558 7.601 -6.602 1.00 0.00 C ATOM 1567 O GLY A 175 14.159 6.547 -7.143 1.00 0.00 O ATOM 1568 OXT GLY A 175 15.287 8.433 -7.182 1.00 0.00 O ATOM 0 H GLY A 175 13.114 9.630 -5.715 1.00 0.00 H new ATOM 0 HA2 GLY A 175 14.963 7.662 -4.503 1.00 0.00 H new ATOM 0 HA3 GLY A 175 13.316 7.217 -4.904 1.00 0.00 H new