USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=24 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 127 LYS NZ :NH3+ -128:sc= 0 (180deg=-1.19) USER MOD Set 1.2: A 138 LYS NZ :NH3+ 166:sc= 0 (180deg=0) USER MOD Set 2.1: A 121 SER OG : rot 26:sc= 0.0209 USER MOD Set 2.2: A 162 TYR OH : rot 180:sc= -0.958 USER MOD Single : A 93 GLN : amide:sc= -0.303 K(o=-0.3,f=-2.4!) USER MOD Single : A 96 LYS NZ :NH3+ 165:sc= -0.0626 (180deg=-0.314) USER MOD Single : A 101 GLN : amide:sc= -0.382 K(o=-0.38,f=-1.1) USER MOD Single : A 103 SER OG : rot 1:sc= 0.215 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0477) 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 122 LYS NZ :NH3+ 149:sc= -1.02 (180deg=-2.38!) USER MOD Single : A 126 SER OG : rot -9:sc= 0.672 USER MOD Single : A 132 MET CE :methyl -160:sc= -0.0237 (180deg=-0.457) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.877 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 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+ -143:sc= -1.99 (180deg=-5.26!) USER MOD Single : A 144 SER OG : rot 80:sc= 0.136 USER MOD Single : A 148 TYR OH : rot 30:sc= -1.12 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.256 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ -170:sc= -0.011 (180deg=-0.0451) USER MOD Single : A 160 SER OG : rot 70:sc= 0.144 USER MOD Single : A 161 HIS : no HD1:sc= -0.059 X(o=-0.059,f=-0.087) USER MOD Single : A 167 TYR OH : rot 180:sc= -1.88 USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= 0.839 K(o=0.84,f=0) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -7.616 11.179 3.783 1.00 0.00 N ATOM 86 CA VAL A 86 -6.250 10.775 3.470 1.00 0.00 C ATOM 87 C VAL A 86 -6.188 10.035 2.138 1.00 0.00 C ATOM 88 O VAL A 86 -5.265 10.235 1.348 1.00 0.00 O ATOM 89 CB VAL A 86 -5.664 9.875 4.574 1.00 0.00 C ATOM 90 CG1 VAL A 86 -5.553 10.639 5.885 1.00 0.00 C ATOM 91 CG2 VAL A 86 -6.508 8.622 4.749 1.00 0.00 C ATOM 0 HA VAL A 86 -5.657 11.687 3.403 1.00 0.00 H new ATOM 0 HB VAL A 86 -4.662 9.570 4.272 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -5.137 9.986 6.652 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.900 11.501 5.749 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.542 10.977 6.194 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.077 8.000 5.533 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.524 8.903 5.026 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.529 8.064 3.813 1.00 0.00 H new ATOM 101 N ARG A 87 -7.175 9.179 1.895 1.00 0.00 N ATOM 102 CA ARG A 87 -7.232 8.407 0.659 1.00 0.00 C ATOM 103 C ARG A 87 -7.340 9.328 -0.553 1.00 0.00 C ATOM 104 O ARG A 87 -6.586 9.192 -1.518 1.00 0.00 O ATOM 105 CB ARG A 87 -8.418 7.440 0.694 1.00 0.00 C ATOM 106 CG ARG A 87 -8.013 5.977 0.626 1.00 0.00 C ATOM 107 CD ARG A 87 -8.924 5.107 1.478 1.00 0.00 C ATOM 108 NE ARG A 87 -10.156 4.754 0.779 1.00 0.00 N ATOM 109 CZ ARG A 87 -11.188 4.142 1.355 1.00 0.00 C ATOM 110 NH1 ARG A 87 -11.138 3.811 2.640 1.00 0.00 N ATOM 111 NH2 ARG A 87 -12.271 3.858 0.646 1.00 0.00 N ATOM 0 H ARG A 87 -7.947 9.002 2.538 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.309 7.834 0.572 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.987 7.609 1.609 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -9.083 7.663 -0.140 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.047 5.637 -0.409 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.983 5.867 0.964 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.395 4.197 1.761 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -9.169 5.634 2.400 1.00 0.00 H new ATOM 0 HE ARG A 87 -10.230 4.991 -0.210 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.306 4.026 3.190 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.931 3.342 3.077 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -12.314 4.108 -0.342 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -13.062 3.389 1.088 1.00 0.00 H new ATOM 125 N LEU A 88 -8.281 10.264 -0.498 1.00 0.00 N ATOM 126 CA LEU A 88 -8.487 11.207 -1.591 1.00 0.00 C ATOM 127 C LEU A 88 -7.289 12.141 -1.738 1.00 0.00 C ATOM 128 O LEU A 88 -6.842 12.423 -2.850 1.00 0.00 O ATOM 129 CB LEU A 88 -9.762 12.022 -1.357 1.00 0.00 C ATOM 130 CG LEU A 88 -11.004 11.506 -2.084 1.00 0.00 C ATOM 131 CD1 LEU A 88 -11.655 10.380 -1.297 1.00 0.00 C ATOM 132 CD2 LEU A 88 -11.993 12.639 -2.318 1.00 0.00 C ATOM 0 H LEU A 88 -8.914 10.390 0.292 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.594 10.637 -2.514 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -9.969 12.044 -0.287 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.579 13.051 -1.668 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.697 11.112 -3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.537 10.026 -1.830 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.947 9.559 -1.182 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -11.949 10.746 -0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -12.871 12.254 -2.837 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -12.294 13.063 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -11.523 13.413 -2.925 1.00 0.00 H new ATOM 144 N ASP A 89 -6.776 12.619 -0.609 1.00 0.00 N ATOM 145 CA ASP A 89 -5.636 13.523 -0.610 1.00 0.00 C ATOM 146 C ASP A 89 -4.435 12.892 -1.307 1.00 0.00 C ATOM 147 O ASP A 89 -3.729 13.552 -2.070 1.00 0.00 O ATOM 148 CB ASP A 89 -5.264 13.907 0.824 1.00 0.00 C ATOM 149 CG ASP A 89 -6.240 14.896 1.429 1.00 0.00 C ATOM 150 OD1 ASP A 89 -6.804 15.712 0.671 1.00 0.00 O ATOM 151 OD2 ASP A 89 -6.440 14.853 2.662 1.00 0.00 O ATOM 0 H ASP A 89 -7.134 12.394 0.319 1.00 0.00 H new ATOM 0 HA ASP A 89 -5.919 14.420 -1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.232 13.009 1.441 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.262 14.337 0.834 1.00 0.00 H new ATOM 156 N PHE A 90 -4.207 11.610 -1.039 1.00 0.00 N ATOM 157 CA PHE A 90 -3.090 10.888 -1.639 1.00 0.00 C ATOM 158 C PHE A 90 -3.172 10.918 -3.162 1.00 0.00 C ATOM 159 O PHE A 90 -2.197 11.249 -3.840 1.00 0.00 O ATOM 160 CB PHE A 90 -3.070 9.441 -1.147 1.00 0.00 C ATOM 161 CG PHE A 90 -1.739 8.766 -1.321 1.00 0.00 C ATOM 162 CD1 PHE A 90 -0.685 9.055 -0.468 1.00 0.00 C ATOM 163 CD2 PHE A 90 -1.542 7.842 -2.335 1.00 0.00 C ATOM 164 CE1 PHE A 90 0.541 8.434 -0.625 1.00 0.00 C ATOM 165 CE2 PHE A 90 -0.319 7.219 -2.495 1.00 0.00 C ATOM 166 CZ PHE A 90 0.724 7.516 -1.641 1.00 0.00 C ATOM 0 H PHE A 90 -4.781 11.049 -0.410 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.167 11.383 -1.335 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.343 9.421 -0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.829 8.873 -1.684 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.823 9.773 0.327 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.353 7.606 -3.008 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.355 8.667 0.046 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.179 6.500 -3.288 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.681 7.032 -1.767 1.00 0.00 H new ATOM 176 N LEU A 91 -4.338 10.572 -3.694 1.00 0.00 N ATOM 177 CA LEU A 91 -4.548 10.559 -5.137 1.00 0.00 C ATOM 178 C LEU A 91 -4.448 11.967 -5.716 1.00 0.00 C ATOM 179 O LEU A 91 -4.001 12.154 -6.848 1.00 0.00 O ATOM 180 CB LEU A 91 -5.911 9.952 -5.471 1.00 0.00 C ATOM 181 CG LEU A 91 -5.910 8.437 -5.692 1.00 0.00 C ATOM 182 CD1 LEU A 91 -5.735 7.707 -4.370 1.00 0.00 C ATOM 183 CD2 LEU A 91 -7.194 8.000 -6.380 1.00 0.00 C ATOM 0 H LEU A 91 -5.154 10.296 -3.147 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.766 9.946 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.603 10.185 -4.662 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.296 10.434 -6.369 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.070 8.182 -6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -5.737 6.631 -4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -4.788 7.999 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -6.555 7.967 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.177 6.920 -6.530 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.049 8.267 -5.759 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.277 8.499 -7.346 1.00 0.00 H new ATOM 195 N ASP A 92 -4.870 12.955 -4.933 1.00 0.00 N ATOM 196 CA ASP A 92 -4.829 14.345 -5.369 1.00 0.00 C ATOM 197 C ASP A 92 -3.394 14.805 -5.600 1.00 0.00 C ATOM 198 O ASP A 92 -3.112 15.541 -6.547 1.00 0.00 O ATOM 199 CB ASP A 92 -5.502 15.245 -4.331 1.00 0.00 C ATOM 200 CG ASP A 92 -7.014 15.122 -4.351 1.00 0.00 C ATOM 201 OD1 ASP A 92 -7.608 15.291 -5.437 1.00 0.00 O ATOM 202 OD2 ASP A 92 -7.603 14.857 -3.283 1.00 0.00 O ATOM 0 H ASP A 92 -5.244 12.818 -3.994 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.370 14.418 -6.313 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -5.133 14.989 -3.338 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.222 16.282 -4.517 1.00 0.00 H new ATOM 207 N GLN A 93 -2.488 14.367 -4.731 1.00 0.00 N ATOM 208 CA GLN A 93 -1.083 14.737 -4.841 1.00 0.00 C ATOM 209 C GLN A 93 -0.456 14.131 -6.093 1.00 0.00 C ATOM 210 O GLN A 93 0.222 14.820 -6.855 1.00 0.00 O ATOM 211 CB GLN A 93 -0.316 14.277 -3.600 1.00 0.00 C ATOM 212 CG GLN A 93 -1.022 14.600 -2.293 1.00 0.00 C ATOM 213 CD GLN A 93 -0.326 15.694 -1.507 1.00 0.00 C ATOM 214 OE1 GLN A 93 0.857 15.968 -1.715 1.00 0.00 O ATOM 215 NE2 GLN A 93 -1.058 16.325 -0.598 1.00 0.00 N ATOM 0 H GLN A 93 -2.703 13.756 -3.943 1.00 0.00 H new ATOM 0 HA GLN A 93 -1.024 15.823 -4.916 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -0.156 13.200 -3.660 1.00 0.00 H new ATOM 0 HB3 GLN A 93 0.668 14.746 -3.597 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -2.047 14.906 -2.504 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -1.078 13.699 -1.682 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.034 16.065 -0.459 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -0.644 17.070 -0.038 1.00 0.00 H new ATOM 224 N LEU A 94 -0.687 12.839 -6.299 1.00 0.00 N ATOM 225 CA LEU A 94 -0.144 12.138 -7.459 1.00 0.00 C ATOM 226 C LEU A 94 -0.590 12.803 -8.757 1.00 0.00 C ATOM 227 O LEU A 94 0.207 12.996 -9.675 1.00 0.00 O ATOM 228 CB LEU A 94 -0.584 10.672 -7.446 1.00 0.00 C ATOM 229 CG LEU A 94 -0.209 9.867 -8.692 1.00 0.00 C ATOM 230 CD1 LEU A 94 1.282 9.571 -8.706 1.00 0.00 C ATOM 231 CD2 LEU A 94 -1.012 8.575 -8.752 1.00 0.00 C ATOM 0 H LEU A 94 -1.247 12.255 -5.678 1.00 0.00 H new ATOM 0 HA LEU A 94 0.944 12.186 -7.404 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.146 10.186 -6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.666 10.635 -7.322 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.449 10.462 -9.573 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.531 8.998 -9.599 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.839 10.508 -8.709 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.547 8.995 -7.820 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.733 8.014 -9.644 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.803 7.975 -7.866 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.076 8.809 -8.788 1.00 0.00 H new ATOM 243 N ALA A 95 -1.872 13.148 -8.828 1.00 0.00 N ATOM 244 CA ALA A 95 -2.425 13.788 -10.015 1.00 0.00 C ATOM 245 C ALA A 95 -1.907 15.212 -10.173 1.00 0.00 C ATOM 246 O ALA A 95 -1.652 15.670 -11.287 1.00 0.00 O ATOM 247 CB ALA A 95 -3.945 13.781 -9.955 1.00 0.00 C ATOM 0 H ALA A 95 -2.546 12.995 -8.078 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.100 13.218 -10.886 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.347 14.262 -10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.302 12.752 -9.905 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.277 14.324 -9.070 1.00 0.00 H new ATOM 253 N LYS A 96 -1.757 15.912 -9.053 1.00 0.00 N ATOM 254 CA LYS A 96 -1.273 17.287 -9.070 1.00 0.00 C ATOM 255 C LYS A 96 0.228 17.341 -9.335 1.00 0.00 C ATOM 256 O LYS A 96 0.724 18.278 -9.959 1.00 0.00 O ATOM 257 CB LYS A 96 -1.594 17.978 -7.744 1.00 0.00 C ATOM 258 CG LYS A 96 -2.995 18.560 -7.684 1.00 0.00 C ATOM 259 CD LYS A 96 -3.428 18.825 -6.252 1.00 0.00 C ATOM 260 CE LYS A 96 -2.559 19.883 -5.592 1.00 0.00 C ATOM 261 NZ LYS A 96 -2.612 21.180 -6.324 1.00 0.00 N ATOM 0 H LYS A 96 -1.964 15.549 -8.122 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.781 17.811 -9.880 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.473 17.261 -6.932 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -0.871 18.776 -7.576 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.029 19.489 -8.253 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.696 17.872 -8.156 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -4.469 19.149 -6.240 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -3.375 17.900 -5.678 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -2.887 20.033 -4.563 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -1.528 19.532 -5.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -2.224 21.934 -5.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.050 21.110 -7.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -3.599 21.402 -6.565 1.00 0.00 H new ATOM 275 N PHE A 97 0.949 16.333 -8.851 1.00 0.00 N ATOM 276 CA PHE A 97 2.394 16.276 -9.034 1.00 0.00 C ATOM 277 C PHE A 97 2.758 16.126 -10.507 1.00 0.00 C ATOM 278 O PHE A 97 3.598 16.863 -11.025 1.00 0.00 O ATOM 279 CB PHE A 97 2.983 15.116 -8.231 1.00 0.00 C ATOM 280 CG PHE A 97 4.403 15.342 -7.799 1.00 0.00 C ATOM 281 CD1 PHE A 97 4.788 16.553 -7.245 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.353 14.345 -7.945 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.093 16.765 -6.846 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.660 14.550 -7.548 1.00 0.00 C ATOM 285 CZ PHE A 97 7.031 15.761 -6.998 1.00 0.00 C ATOM 0 H PHE A 97 0.557 15.548 -8.331 1.00 0.00 H new ATOM 0 HA PHE A 97 2.815 17.214 -8.672 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.366 14.946 -7.348 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.935 14.208 -8.832 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.059 17.340 -7.124 1.00 0.00 H new ATOM 0 HD2 PHE A 97 5.069 13.396 -8.374 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.380 17.713 -6.416 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.391 13.764 -7.668 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.052 15.924 -6.687 1.00 0.00 H new ATOM 295 N TRP A 98 2.126 15.170 -11.180 1.00 0.00 N ATOM 296 CA TRP A 98 2.389 14.933 -12.593 1.00 0.00 C ATOM 297 C TRP A 98 1.926 16.114 -13.440 1.00 0.00 C ATOM 298 O TRP A 98 2.525 16.422 -14.471 1.00 0.00 O ATOM 299 CB TRP A 98 1.709 13.644 -13.059 1.00 0.00 C ATOM 300 CG TRP A 98 2.502 12.414 -12.737 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.312 11.566 -11.684 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.618 11.896 -13.473 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.240 10.553 -11.721 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.051 10.732 -12.810 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.293 12.302 -14.629 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.125 9.971 -13.265 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.359 11.545 -15.079 1.00 0.00 C ATOM 308 CH2 TRP A 98 5.765 10.391 -14.398 1.00 0.00 C ATOM 0 H TRP A 98 1.429 14.548 -10.770 1.00 0.00 H new ATOM 0 HA TRP A 98 3.466 14.823 -12.721 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.727 13.569 -12.592 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.547 13.694 -14.136 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.545 11.675 -10.932 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.313 9.791 -11.047 1.00 0.00 H new ATOM 0 HE3 TRP A 98 3.987 13.191 -15.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.441 9.081 -12.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 5.887 11.849 -15.971 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.601 9.821 -14.775 1.00 0.00 H new ATOM 319 N GLU A 99 0.856 16.770 -13.001 1.00 0.00 N ATOM 320 CA GLU A 99 0.313 17.914 -13.720 1.00 0.00 C ATOM 321 C GLU A 99 1.380 18.983 -13.927 1.00 0.00 C ATOM 322 O GLU A 99 1.497 19.557 -15.009 1.00 0.00 O ATOM 323 CB GLU A 99 -0.879 18.501 -12.960 1.00 0.00 C ATOM 324 CG GLU A 99 -2.223 17.968 -13.427 1.00 0.00 C ATOM 325 CD GLU A 99 -3.373 18.450 -12.567 1.00 0.00 C ATOM 326 OE1 GLU A 99 -3.139 18.759 -11.380 1.00 0.00 O ATOM 327 OE2 GLU A 99 -4.510 18.520 -13.080 1.00 0.00 O ATOM 0 H GLU A 99 0.349 16.527 -12.150 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.024 17.571 -14.698 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.762 18.287 -11.898 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.870 19.585 -13.069 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.393 18.275 -14.459 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.200 16.878 -13.419 1.00 0.00 H new ATOM 334 N LEU A 100 2.163 19.242 -12.883 1.00 0.00 N ATOM 335 CA LEU A 100 3.227 20.237 -12.958 1.00 0.00 C ATOM 336 C LEU A 100 4.314 19.787 -13.927 1.00 0.00 C ATOM 337 O LEU A 100 4.963 20.608 -14.575 1.00 0.00 O ATOM 338 CB LEU A 100 3.829 20.475 -11.571 1.00 0.00 C ATOM 339 CG LEU A 100 3.040 21.439 -10.678 1.00 0.00 C ATOM 340 CD1 LEU A 100 2.493 20.714 -9.457 1.00 0.00 C ATOM 341 CD2 LEU A 100 3.912 22.612 -10.255 1.00 0.00 C ATOM 0 H LEU A 100 2.081 18.778 -11.978 1.00 0.00 H new ATOM 0 HA LEU A 100 2.799 21.170 -13.323 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.914 19.516 -11.059 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.841 20.862 -11.692 1.00 0.00 H new ATOM 0 HG LEU A 100 2.199 21.825 -11.253 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.936 21.416 -8.836 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.831 19.909 -9.778 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.319 20.297 -8.881 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.334 23.285 -9.622 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.774 22.243 -9.700 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.253 23.150 -11.140 1.00 0.00 H new ATOM 353 N GLN A 101 4.503 18.474 -14.021 1.00 0.00 N ATOM 354 CA GLN A 101 5.505 17.903 -14.911 1.00 0.00 C ATOM 355 C GLN A 101 5.100 18.083 -16.369 1.00 0.00 C ATOM 356 O GLN A 101 5.939 18.338 -17.233 1.00 0.00 O ATOM 357 CB GLN A 101 5.691 16.416 -14.606 1.00 0.00 C ATOM 358 CG GLN A 101 6.175 16.140 -13.193 1.00 0.00 C ATOM 359 CD GLN A 101 7.418 16.932 -12.835 1.00 0.00 C ATOM 360 OE1 GLN A 101 8.528 16.581 -13.235 1.00 0.00 O ATOM 361 NE2 GLN A 101 7.236 18.007 -12.078 1.00 0.00 N ATOM 0 H GLN A 101 3.972 17.784 -13.489 1.00 0.00 H new ATOM 0 HA GLN A 101 6.447 18.426 -14.745 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.744 15.900 -14.764 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.405 15.995 -15.314 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.380 16.381 -12.487 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.384 15.076 -13.086 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.297 18.260 -11.769 1.00 0.00 H new ATOM 0 HE22 GLN A 101 8.035 18.580 -11.805 1.00 0.00 H new ATOM 370 N GLY A 102 3.805 17.945 -16.630 1.00 0.00 N ATOM 371 CA GLY A 102 3.297 18.087 -17.979 1.00 0.00 C ATOM 372 C GLY A 102 2.642 16.817 -18.489 1.00 0.00 C ATOM 373 O GLY A 102 2.492 16.630 -19.697 1.00 0.00 O ATOM 0 H GLY A 102 3.096 17.736 -15.927 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.574 18.902 -18.008 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.115 18.363 -18.645 1.00 0.00 H new ATOM 377 N SER A 103 2.252 15.942 -17.566 1.00 0.00 N ATOM 378 CA SER A 103 1.612 14.685 -17.924 1.00 0.00 C ATOM 379 C SER A 103 0.095 14.782 -17.750 1.00 0.00 C ATOM 380 O SER A 103 -0.474 15.871 -17.817 1.00 0.00 O ATOM 381 CB SER A 103 2.179 13.548 -17.069 1.00 0.00 C ATOM 382 OG SER A 103 1.962 12.290 -17.683 1.00 0.00 O ATOM 0 H SER A 103 2.370 16.083 -16.563 1.00 0.00 H new ATOM 0 HA SER A 103 1.819 14.474 -18.973 1.00 0.00 H new ATOM 0 HB2 SER A 103 3.247 13.702 -16.916 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.711 13.561 -16.085 1.00 0.00 H new ATOM 0 HG SER A 103 1.503 12.419 -18.539 1.00 0.00 H new ATOM 388 N THR A 104 -0.555 13.642 -17.527 1.00 0.00 N ATOM 389 CA THR A 104 -2.001 13.611 -17.346 1.00 0.00 C ATOM 390 C THR A 104 -2.414 12.394 -16.526 1.00 0.00 C ATOM 391 O THR A 104 -2.605 11.305 -17.066 1.00 0.00 O ATOM 392 CB THR A 104 -2.707 13.594 -18.701 1.00 0.00 C ATOM 393 OG1 THR A 104 -4.076 13.265 -18.551 1.00 0.00 O ATOM 394 CG2 THR A 104 -2.103 12.608 -19.679 1.00 0.00 C ATOM 0 H THR A 104 -0.102 12.730 -17.468 1.00 0.00 H new ATOM 0 HA THR A 104 -2.297 14.511 -16.806 1.00 0.00 H new ATOM 0 HB THR A 104 -2.585 14.600 -19.101 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.510 13.261 -19.430 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.651 12.647 -20.620 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.059 12.865 -19.857 1.00 0.00 H new ATOM 0 HG23 THR A 104 -2.164 11.601 -19.265 1.00 0.00 H new ATOM 402 N LEU A 105 -2.551 12.587 -15.219 1.00 0.00 N ATOM 403 CA LEU A 105 -2.939 11.506 -14.323 1.00 0.00 C ATOM 404 C LEU A 105 -4.335 10.990 -14.663 1.00 0.00 C ATOM 405 O LEU A 105 -5.327 11.702 -14.506 1.00 0.00 O ATOM 406 CB LEU A 105 -2.896 11.986 -12.870 1.00 0.00 C ATOM 407 CG LEU A 105 -2.709 10.884 -11.826 1.00 0.00 C ATOM 408 CD1 LEU A 105 -3.763 9.802 -11.993 1.00 0.00 C ATOM 409 CD2 LEU A 105 -1.312 10.290 -11.925 1.00 0.00 C ATOM 0 H LEU A 105 -2.399 13.483 -14.757 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.231 10.687 -14.450 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.084 12.705 -12.766 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.822 12.518 -12.652 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.827 11.325 -10.836 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.612 9.028 -11.241 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -4.755 10.238 -11.871 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.679 9.363 -12.987 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.195 9.507 -11.175 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.167 9.865 -12.918 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.571 11.071 -11.752 1.00 0.00 H new ATOM 421 N LYS A 106 -4.400 9.746 -15.127 1.00 0.00 N ATOM 422 CA LYS A 106 -5.671 9.128 -15.487 1.00 0.00 C ATOM 423 C LYS A 106 -5.827 7.774 -14.801 1.00 0.00 C ATOM 424 O LYS A 106 -5.020 6.868 -15.009 1.00 0.00 O ATOM 425 CB LYS A 106 -5.769 8.959 -17.003 1.00 0.00 C ATOM 426 CG LYS A 106 -7.159 8.575 -17.485 1.00 0.00 C ATOM 427 CD LYS A 106 -7.582 9.398 -18.693 1.00 0.00 C ATOM 428 CE LYS A 106 -8.337 10.649 -18.276 1.00 0.00 C ATOM 429 NZ LYS A 106 -7.416 11.762 -17.919 1.00 0.00 N ATOM 0 H LYS A 106 -3.587 9.146 -15.263 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.475 9.783 -15.150 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.472 9.891 -17.484 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.059 8.195 -17.322 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.176 7.516 -17.742 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.877 8.718 -16.677 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.701 9.679 -19.270 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.211 8.792 -19.345 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.991 10.966 -19.089 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.976 10.420 -17.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -7.970 12.616 -17.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.856 11.495 -17.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.777 11.954 -18.717 1.00 0.00 H new ATOM 443 N ILE A 107 -6.865 7.643 -13.983 1.00 0.00 N ATOM 444 CA ILE A 107 -7.122 6.397 -13.269 1.00 0.00 C ATOM 445 C ILE A 107 -7.600 5.302 -14.223 1.00 0.00 C ATOM 446 O ILE A 107 -8.701 5.382 -14.766 1.00 0.00 O ATOM 447 CB ILE A 107 -8.180 6.592 -12.164 1.00 0.00 C ATOM 448 CG1 ILE A 107 -7.825 7.797 -11.293 1.00 0.00 C ATOM 449 CG2 ILE A 107 -8.298 5.335 -11.315 1.00 0.00 C ATOM 450 CD1 ILE A 107 -8.830 8.066 -10.194 1.00 0.00 C ATOM 0 H ILE A 107 -7.542 8.383 -13.798 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.179 6.094 -12.814 1.00 0.00 H new ATOM 0 HB ILE A 107 -9.144 6.781 -12.636 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.844 7.635 -10.846 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.745 8.681 -11.925 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.049 5.489 -10.540 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.594 4.497 -11.945 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.336 5.118 -10.851 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -8.514 8.935 -9.616 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.808 8.260 -10.635 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.893 7.198 -9.538 1.00 0.00 H new ATOM 462 N PRO A 108 -6.775 4.260 -14.442 1.00 0.00 N ATOM 463 CA PRO A 108 -7.127 3.154 -15.336 1.00 0.00 C ATOM 464 C PRO A 108 -8.076 2.157 -14.680 1.00 0.00 C ATOM 465 O PRO A 108 -8.209 2.122 -13.457 1.00 0.00 O ATOM 466 CB PRO A 108 -5.777 2.501 -15.617 1.00 0.00 C ATOM 467 CG PRO A 108 -4.983 2.743 -14.379 1.00 0.00 C ATOM 468 CD PRO A 108 -5.438 4.074 -13.839 1.00 0.00 C ATOM 0 HA PRO A 108 -7.651 3.495 -16.229 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -5.885 1.435 -15.818 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -5.296 2.942 -16.490 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.149 1.950 -13.650 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -3.915 2.757 -14.598 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.487 4.068 -12.750 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.756 4.875 -14.123 1.00 0.00 H new ATOM 476 N VAL A 109 -8.731 1.344 -15.502 1.00 0.00 N ATOM 477 CA VAL A 109 -9.665 0.342 -15.003 1.00 0.00 C ATOM 478 C VAL A 109 -9.133 -1.067 -15.242 1.00 0.00 C ATOM 479 O VAL A 109 -8.927 -1.477 -16.385 1.00 0.00 O ATOM 480 CB VAL A 109 -11.046 0.477 -15.671 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.057 -0.443 -15.001 1.00 0.00 C ATOM 482 CG2 VAL A 109 -11.520 1.922 -15.629 1.00 0.00 C ATOM 0 H VAL A 109 -8.632 1.360 -16.517 1.00 0.00 H new ATOM 0 HA VAL A 109 -9.772 0.513 -13.932 1.00 0.00 H new ATOM 0 HB VAL A 109 -10.955 0.178 -16.715 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.027 -0.333 -15.487 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.722 -1.477 -15.088 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.147 -0.179 -13.947 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.497 1.998 -16.106 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.595 2.250 -14.592 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -10.808 2.554 -16.159 1.00 0.00 H new ATOM 492 N VAL A 110 -8.909 -1.802 -14.159 1.00 0.00 N ATOM 493 CA VAL A 110 -8.397 -3.164 -14.253 1.00 0.00 C ATOM 494 C VAL A 110 -9.477 -4.186 -13.917 1.00 0.00 C ATOM 495 O VAL A 110 -10.096 -4.124 -12.855 1.00 0.00 O ATOM 496 CB VAL A 110 -7.194 -3.378 -13.315 1.00 0.00 C ATOM 497 CG1 VAL A 110 -6.549 -4.731 -13.573 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.183 -2.256 -13.478 1.00 0.00 C ATOM 0 H VAL A 110 -9.074 -1.478 -13.206 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.075 -3.308 -15.284 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.553 -3.364 -12.286 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.701 -4.864 -12.901 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.279 -5.521 -13.397 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -6.204 -4.779 -14.606 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.341 -2.425 -12.807 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -5.828 -2.233 -14.508 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.654 -1.304 -13.236 1.00 0.00 H new ATOM 508 N GLU A 111 -9.697 -5.129 -14.829 1.00 0.00 N ATOM 509 CA GLU A 111 -10.701 -6.168 -14.631 1.00 0.00 C ATOM 510 C GLU A 111 -12.086 -5.558 -14.424 1.00 0.00 C ATOM 511 O GLU A 111 -12.864 -6.029 -13.597 1.00 0.00 O ATOM 512 CB GLU A 111 -10.331 -7.041 -13.430 1.00 0.00 C ATOM 513 CG GLU A 111 -8.987 -7.736 -13.575 1.00 0.00 C ATOM 514 CD GLU A 111 -9.017 -8.855 -14.597 1.00 0.00 C ATOM 515 OE1 GLU A 111 -8.762 -8.578 -15.788 1.00 0.00 O ATOM 516 OE2 GLU A 111 -9.295 -10.008 -14.206 1.00 0.00 O ATOM 0 H GLU A 111 -9.192 -5.194 -15.713 1.00 0.00 H new ATOM 0 HA GLU A 111 -10.728 -6.787 -15.528 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.316 -6.423 -12.533 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.106 -7.794 -13.286 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -8.233 -7.004 -13.865 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.685 -8.139 -12.609 1.00 0.00 H new ATOM 523 N ARG A 112 -12.384 -4.508 -15.182 1.00 0.00 N ATOM 524 CA ARG A 112 -13.672 -3.835 -15.081 1.00 0.00 C ATOM 525 C ARG A 112 -13.900 -3.304 -13.669 1.00 0.00 C ATOM 526 O ARG A 112 -15.036 -3.217 -13.204 1.00 0.00 O ATOM 527 CB ARG A 112 -14.803 -4.791 -15.467 1.00 0.00 C ATOM 528 CG ARG A 112 -14.853 -5.107 -16.953 1.00 0.00 C ATOM 529 CD ARG A 112 -15.802 -6.258 -17.246 1.00 0.00 C ATOM 530 NE ARG A 112 -15.157 -7.557 -17.071 1.00 0.00 N ATOM 531 CZ ARG A 112 -14.343 -8.109 -17.966 1.00 0.00 C ATOM 532 NH1 ARG A 112 -14.069 -7.479 -19.102 1.00 0.00 N ATOM 533 NH2 ARG A 112 -13.799 -9.295 -17.726 1.00 0.00 N ATOM 0 H ARG A 112 -11.751 -4.105 -15.873 1.00 0.00 H new ATOM 0 HA ARG A 112 -13.667 -2.991 -15.771 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -14.687 -5.721 -14.910 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.755 -4.355 -15.165 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -15.172 -4.222 -17.504 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -13.853 -5.359 -17.306 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -16.667 -6.191 -16.587 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.172 -6.172 -18.268 1.00 0.00 H new ATOM 0 HE ARG A 112 -15.342 -8.072 -16.210 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.484 -6.567 -19.292 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -13.444 -7.907 -19.785 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -14.005 -9.784 -16.855 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.175 -9.718 -18.413 1.00 0.00 H new ATOM 547 N LYS A 113 -12.811 -2.952 -12.993 1.00 0.00 N ATOM 548 CA LYS A 113 -12.891 -2.430 -11.634 1.00 0.00 C ATOM 549 C LYS A 113 -11.827 -1.364 -11.396 1.00 0.00 C ATOM 550 O LYS A 113 -10.811 -1.321 -12.091 1.00 0.00 O ATOM 551 CB LYS A 113 -12.732 -3.567 -10.620 1.00 0.00 C ATOM 552 CG LYS A 113 -14.049 -4.042 -10.028 1.00 0.00 C ATOM 553 CD LYS A 113 -14.648 -3.001 -9.097 1.00 0.00 C ATOM 554 CE LYS A 113 -16.154 -3.168 -8.971 1.00 0.00 C ATOM 555 NZ LYS A 113 -16.892 -2.271 -9.903 1.00 0.00 N ATOM 0 H LYS A 113 -11.863 -3.019 -13.364 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.871 -1.971 -11.504 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -12.236 -4.408 -11.105 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -12.079 -3.234 -9.813 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -14.752 -4.261 -10.831 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -13.889 -4.972 -9.482 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.188 -3.084 -8.112 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -14.421 -2.003 -9.472 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -16.423 -4.204 -9.176 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -16.458 -2.956 -7.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -17.915 -2.415 -9.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -16.656 -1.281 -9.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -16.621 -2.490 -10.883 1.00 0.00 H new ATOM 569 N ILE A 114 -12.065 -0.505 -10.409 1.00 0.00 N ATOM 570 CA ILE A 114 -11.127 0.560 -10.081 1.00 0.00 C ATOM 571 C ILE A 114 -9.944 0.023 -9.282 1.00 0.00 C ATOM 572 O ILE A 114 -10.119 -0.732 -8.327 1.00 0.00 O ATOM 573 CB ILE A 114 -11.809 1.681 -9.273 1.00 0.00 C ATOM 574 CG1 ILE A 114 -13.119 2.099 -9.943 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.876 2.875 -9.129 1.00 0.00 C ATOM 576 CD1 ILE A 114 -13.944 3.059 -9.113 1.00 0.00 C ATOM 0 H ILE A 114 -12.900 -0.527 -9.823 1.00 0.00 H new ATOM 0 HA ILE A 114 -10.770 0.969 -11.026 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.038 1.302 -8.277 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.894 2.563 -10.904 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -13.712 1.208 -10.150 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -11.373 3.658 -8.556 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.968 2.567 -8.611 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.618 3.257 -10.117 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.858 3.312 -9.650 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -14.200 2.591 -8.162 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -13.369 3.966 -8.928 1.00 0.00 H new ATOM 588 N LEU A 115 -8.739 0.419 -9.681 1.00 0.00 N ATOM 589 CA LEU A 115 -7.526 -0.022 -9.004 1.00 0.00 C ATOM 590 C LEU A 115 -7.084 0.997 -7.959 1.00 0.00 C ATOM 591 O LEU A 115 -6.956 2.185 -8.251 1.00 0.00 O ATOM 592 CB LEU A 115 -6.404 -0.248 -10.020 1.00 0.00 C ATOM 593 CG LEU A 115 -5.053 -0.643 -9.418 1.00 0.00 C ATOM 594 CD1 LEU A 115 -4.340 -1.641 -10.316 1.00 0.00 C ATOM 595 CD2 LEU A 115 -4.189 0.590 -9.195 1.00 0.00 C ATOM 0 H LEU A 115 -8.577 1.045 -10.470 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.744 -0.962 -8.498 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.716 -1.027 -10.715 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.272 0.664 -10.602 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.231 -1.117 -8.453 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.382 -1.910 -9.872 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -4.953 -2.535 -10.425 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.173 -1.194 -11.296 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.232 0.291 -8.767 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.019 1.092 -10.147 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.696 1.271 -8.511 1.00 0.00 H new ATOM 607 N ASP A 116 -6.851 0.520 -6.738 1.00 0.00 N ATOM 608 CA ASP A 116 -6.421 1.390 -5.650 1.00 0.00 C ATOM 609 C ASP A 116 -4.939 1.728 -5.780 1.00 0.00 C ATOM 610 O ASP A 116 -4.169 0.968 -6.367 1.00 0.00 O ATOM 611 CB ASP A 116 -6.686 0.721 -4.300 1.00 0.00 C ATOM 612 CG ASP A 116 -6.819 1.725 -3.172 1.00 0.00 C ATOM 613 OD1 ASP A 116 -5.847 2.467 -2.918 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.898 1.770 -2.542 1.00 0.00 O ATOM 0 H ASP A 116 -6.953 -0.461 -6.479 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.994 2.315 -5.708 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.599 0.128 -4.364 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.873 0.031 -4.074 1.00 0.00 H new ATOM 619 N LEU A 117 -4.547 2.873 -5.232 1.00 0.00 N ATOM 620 CA LEU A 117 -3.156 3.310 -5.292 1.00 0.00 C ATOM 621 C LEU A 117 -2.494 3.208 -3.922 1.00 0.00 C ATOM 622 O LEU A 117 -1.489 2.516 -3.758 1.00 0.00 O ATOM 623 CB LEU A 117 -3.075 4.749 -5.806 1.00 0.00 C ATOM 624 CG LEU A 117 -3.536 4.947 -7.250 1.00 0.00 C ATOM 625 CD1 LEU A 117 -5.035 5.198 -7.299 1.00 0.00 C ATOM 626 CD2 LEU A 117 -2.779 6.098 -7.897 1.00 0.00 C ATOM 0 H LEU A 117 -5.171 3.514 -4.742 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.624 2.654 -5.981 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.678 5.385 -5.158 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.044 5.092 -5.719 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.321 4.037 -7.810 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.347 5.337 -8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -5.561 4.344 -6.873 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -5.273 6.094 -6.725 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.119 6.225 -8.925 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.963 7.015 -7.337 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.711 5.879 -7.893 1.00 0.00 H new ATOM 638 N TYR A 118 -3.062 3.901 -2.940 1.00 0.00 N ATOM 639 CA TYR A 118 -2.526 3.887 -1.583 1.00 0.00 C ATOM 640 C TYR A 118 -2.417 2.459 -1.056 1.00 0.00 C ATOM 641 O TYR A 118 -1.366 2.044 -0.566 1.00 0.00 O ATOM 642 CB TYR A 118 -3.412 4.719 -0.655 1.00 0.00 C ATOM 643 CG TYR A 118 -2.683 5.270 0.550 1.00 0.00 C ATOM 644 CD1 TYR A 118 -2.012 4.425 1.425 1.00 0.00 C ATOM 645 CD2 TYR A 118 -2.666 6.634 0.811 1.00 0.00 C ATOM 646 CE1 TYR A 118 -1.345 4.924 2.527 1.00 0.00 C ATOM 647 CE2 TYR A 118 -2.000 7.141 1.912 1.00 0.00 C ATOM 648 CZ TYR A 118 -1.342 6.282 2.767 1.00 0.00 C ATOM 649 OH TYR A 118 -0.679 6.782 3.863 1.00 0.00 O ATOM 0 H TYR A 118 -3.894 4.480 -3.059 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.527 4.323 -1.608 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.838 5.548 -1.221 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -4.245 4.104 -0.315 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -2.012 3.361 1.241 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -3.181 7.309 0.144 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.828 4.254 3.198 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -1.995 8.204 2.101 1.00 0.00 H new ATOM 0 HH TYR A 118 -0.774 7.757 3.886 1.00 0.00 H new ATOM 659 N ALA A 119 -3.512 1.714 -1.160 1.00 0.00 N ATOM 660 CA ALA A 119 -3.546 0.336 -0.696 1.00 0.00 C ATOM 661 C ALA A 119 -2.489 -0.512 -1.398 1.00 0.00 C ATOM 662 O ALA A 119 -1.777 -1.286 -0.759 1.00 0.00 O ATOM 663 CB ALA A 119 -4.930 -0.258 -0.913 1.00 0.00 C ATOM 0 H ALA A 119 -4.389 2.044 -1.563 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.322 0.334 0.371 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.942 -1.290 -0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.666 0.323 -0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -5.174 -0.234 -1.975 1.00 0.00 H new ATOM 669 N LEU A 120 -2.396 -0.363 -2.716 1.00 0.00 N ATOM 670 CA LEU A 120 -1.430 -1.119 -3.506 1.00 0.00 C ATOM 671 C LEU A 120 0.001 -0.760 -3.117 1.00 0.00 C ATOM 672 O LEU A 120 0.877 -1.624 -3.071 1.00 0.00 O ATOM 673 CB LEU A 120 -1.645 -0.859 -4.997 1.00 0.00 C ATOM 674 CG LEU A 120 -0.728 -1.652 -5.932 1.00 0.00 C ATOM 675 CD1 LEU A 120 -0.825 -3.140 -5.637 1.00 0.00 C ATOM 676 CD2 LEU A 120 -1.080 -1.372 -7.385 1.00 0.00 C ATOM 0 H LEU A 120 -2.978 0.274 -3.259 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.585 -2.178 -3.301 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.681 -1.092 -5.245 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.502 0.204 -5.189 1.00 0.00 H new ATOM 0 HG LEU A 120 0.300 -1.334 -5.759 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.167 -3.688 -6.311 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.526 -3.327 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -1.852 -3.474 -5.783 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -0.419 -1.944 -8.036 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.114 -1.663 -7.572 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.960 -0.308 -7.590 1.00 0.00 H new ATOM 688 N SER A 121 0.232 0.519 -2.843 1.00 0.00 N ATOM 689 CA SER A 121 1.559 0.992 -2.462 1.00 0.00 C ATOM 690 C SER A 121 2.052 0.290 -1.201 1.00 0.00 C ATOM 691 O SER A 121 3.224 -0.072 -1.099 1.00 0.00 O ATOM 692 CB SER A 121 1.538 2.506 -2.242 1.00 0.00 C ATOM 693 OG SER A 121 2.838 3.058 -2.358 1.00 0.00 O ATOM 0 H SER A 121 -0.482 1.247 -2.877 1.00 0.00 H new ATOM 0 HA SER A 121 2.246 0.757 -3.275 1.00 0.00 H new ATOM 0 HB2 SER A 121 0.875 2.973 -2.971 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.133 2.727 -1.255 1.00 0.00 H new ATOM 0 HG SER A 121 3.384 2.489 -2.939 1.00 0.00 H new ATOM 699 N LYS A 122 1.152 0.106 -0.240 1.00 0.00 N ATOM 700 CA LYS A 122 1.498 -0.549 1.016 1.00 0.00 C ATOM 701 C LYS A 122 1.813 -2.027 0.799 1.00 0.00 C ATOM 702 O LYS A 122 2.735 -2.570 1.408 1.00 0.00 O ATOM 703 CB LYS A 122 0.355 -0.402 2.022 1.00 0.00 C ATOM 704 CG LYS A 122 0.012 1.044 2.342 1.00 0.00 C ATOM 705 CD LYS A 122 -1.077 1.138 3.399 1.00 0.00 C ATOM 706 CE LYS A 122 -2.459 0.948 2.794 1.00 0.00 C ATOM 707 NZ LYS A 122 -2.816 -0.492 2.668 1.00 0.00 N ATOM 0 H LYS A 122 0.178 0.401 -0.307 1.00 0.00 H new ATOM 0 HA LYS A 122 2.390 -0.064 1.413 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.532 -0.899 1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 122 0.625 -0.916 2.945 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.905 1.562 2.691 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.316 1.551 1.434 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -0.907 0.382 4.166 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -1.025 2.109 3.891 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -3.200 1.453 3.414 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -2.493 1.418 1.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -3.845 -0.605 2.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -2.519 -0.843 1.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -2.334 -1.036 3.412 1.00 0.00 H new ATOM 721 N ILE A 123 1.037 -2.674 -0.064 1.00 0.00 N ATOM 722 CA ILE A 123 1.230 -4.086 -0.354 1.00 0.00 C ATOM 723 C ILE A 123 2.631 -4.359 -0.893 1.00 0.00 C ATOM 724 O ILE A 123 3.272 -5.338 -0.513 1.00 0.00 O ATOM 725 CB ILE A 123 0.185 -4.601 -1.367 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.230 -4.338 -0.849 1.00 0.00 C ATOM 727 CG2 ILE A 123 0.386 -6.086 -1.634 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.270 -4.262 -1.945 1.00 0.00 C ATOM 0 H ILE A 123 0.268 -2.240 -0.574 1.00 0.00 H new ATOM 0 HA ILE A 123 1.104 -4.619 0.588 1.00 0.00 H new ATOM 0 HB ILE A 123 0.318 -4.063 -2.305 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.506 -5.129 -0.152 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.235 -3.403 -0.289 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.360 -6.431 -2.350 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.384 -6.251 -2.041 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.278 -6.641 -0.702 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.249 -4.074 -1.505 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -2.018 -3.452 -2.630 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.293 -5.205 -2.491 1.00 0.00 H new ATOM 740 N VAL A 124 3.103 -3.490 -1.782 1.00 0.00 N ATOM 741 CA VAL A 124 4.429 -3.648 -2.369 1.00 0.00 C ATOM 742 C VAL A 124 5.511 -3.635 -1.295 1.00 0.00 C ATOM 743 O VAL A 124 6.368 -4.517 -1.253 1.00 0.00 O ATOM 744 CB VAL A 124 4.730 -2.540 -3.395 1.00 0.00 C ATOM 745 CG1 VAL A 124 6.013 -2.848 -4.152 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.564 -2.368 -4.358 1.00 0.00 C ATOM 0 H VAL A 124 2.589 -2.672 -2.110 1.00 0.00 H new ATOM 0 HA VAL A 124 4.433 -4.612 -2.877 1.00 0.00 H new ATOM 0 HB VAL A 124 4.867 -1.602 -2.857 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.210 -2.054 -4.873 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.843 -2.914 -3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.906 -3.797 -4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.797 -1.580 -5.075 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.391 -3.303 -4.890 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.668 -2.097 -3.800 1.00 0.00 H new ATOM 756 N ALA A 125 5.466 -2.628 -0.429 1.00 0.00 N ATOM 757 CA ALA A 125 6.440 -2.499 0.641 1.00 0.00 C ATOM 758 C ALA A 125 6.351 -3.673 1.609 1.00 0.00 C ATOM 759 O ALA A 125 7.369 -4.232 2.018 1.00 0.00 O ATOM 760 CB ALA A 125 6.241 -1.185 1.380 1.00 0.00 C ATOM 0 H ALA A 125 4.763 -1.890 -0.450 1.00 0.00 H new ATOM 0 HA ALA A 125 7.435 -2.505 0.196 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.978 -1.102 2.179 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.364 -0.354 0.685 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.238 -1.156 1.806 1.00 0.00 H new ATOM 766 N SER A 126 5.127 -4.039 1.976 1.00 0.00 N ATOM 767 CA SER A 126 4.898 -5.140 2.899 1.00 0.00 C ATOM 768 C SER A 126 5.531 -6.431 2.387 1.00 0.00 C ATOM 769 O SER A 126 5.851 -7.327 3.168 1.00 0.00 O ATOM 770 CB SER A 126 3.398 -5.347 3.117 1.00 0.00 C ATOM 771 OG SER A 126 2.744 -5.668 1.901 1.00 0.00 O ATOM 0 H SER A 126 4.276 -3.585 1.645 1.00 0.00 H new ATOM 0 HA SER A 126 5.367 -4.882 3.849 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.240 -6.147 3.841 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.961 -4.443 3.541 1.00 0.00 H new ATOM 0 HG SER A 126 3.369 -5.556 1.154 1.00 0.00 H new ATOM 777 N LYS A 127 5.712 -6.519 1.073 1.00 0.00 N ATOM 778 CA LYS A 127 6.309 -7.703 0.464 1.00 0.00 C ATOM 779 C LYS A 127 7.830 -7.642 0.536 1.00 0.00 C ATOM 780 O LYS A 127 8.505 -8.669 0.488 1.00 0.00 O ATOM 781 CB LYS A 127 5.859 -7.833 -0.994 1.00 0.00 C ATOM 782 CG LYS A 127 4.427 -8.313 -1.148 1.00 0.00 C ATOM 783 CD LYS A 127 4.369 -9.748 -1.650 1.00 0.00 C ATOM 784 CE LYS A 127 4.191 -10.731 -0.504 1.00 0.00 C ATOM 785 NZ LYS A 127 5.495 -11.127 0.097 1.00 0.00 N ATOM 0 H LYS A 127 5.455 -5.787 0.411 1.00 0.00 H new ATOM 0 HA LYS A 127 5.972 -8.578 1.020 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.964 -6.866 -1.485 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.523 -8.526 -1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 127 3.913 -8.241 -0.189 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.897 -7.662 -1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.544 -9.855 -2.355 1.00 0.00 H new ATOM 0 HD3 LYS A 127 5.285 -9.982 -2.193 1.00 0.00 H new ATOM 0 HE2 LYS A 127 3.559 -10.283 0.263 1.00 0.00 H new ATOM 0 HE3 LYS A 127 3.673 -11.620 -0.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 5.560 -12.164 0.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 6.273 -10.750 -0.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 5.564 -10.743 1.061 1.00 0.00 H new ATOM 799 N GLY A 128 8.367 -6.429 0.650 1.00 0.00 N ATOM 800 CA GLY A 128 9.805 -6.260 0.725 1.00 0.00 C ATOM 801 C GLY A 128 10.269 -4.946 0.125 1.00 0.00 C ATOM 802 O GLY A 128 11.366 -4.474 0.422 1.00 0.00 O ATOM 0 H GLY A 128 7.831 -5.562 0.692 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.119 -6.310 1.767 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.292 -7.085 0.205 1.00 0.00 H new ATOM 806 N GLY A 129 9.433 -4.357 -0.725 1.00 0.00 N ATOM 807 CA GLY A 129 9.784 -3.098 -1.357 1.00 0.00 C ATOM 808 C GLY A 129 9.190 -2.965 -2.744 1.00 0.00 C ATOM 809 O GLY A 129 8.365 -2.085 -2.990 1.00 0.00 O ATOM 0 H GLY A 129 8.520 -4.729 -0.987 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.437 -2.273 -0.735 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.869 -3.016 -1.420 1.00 0.00 H new ATOM 813 N PHE A 130 9.610 -3.841 -3.651 1.00 0.00 N ATOM 814 CA PHE A 130 9.115 -3.826 -5.024 1.00 0.00 C ATOM 815 C PHE A 130 9.775 -4.927 -5.849 1.00 0.00 C ATOM 816 O PHE A 130 9.100 -5.819 -6.364 1.00 0.00 O ATOM 817 CB PHE A 130 9.380 -2.464 -5.673 1.00 0.00 C ATOM 818 CG PHE A 130 8.889 -2.369 -7.090 1.00 0.00 C ATOM 819 CD1 PHE A 130 7.540 -2.499 -7.379 1.00 0.00 C ATOM 820 CD2 PHE A 130 9.776 -2.149 -8.131 1.00 0.00 C ATOM 821 CE1 PHE A 130 7.085 -2.411 -8.681 1.00 0.00 C ATOM 822 CE2 PHE A 130 9.327 -2.060 -9.435 1.00 0.00 C ATOM 823 CZ PHE A 130 7.980 -2.191 -9.710 1.00 0.00 C ATOM 0 H PHE A 130 10.294 -4.573 -3.459 1.00 0.00 H new ATOM 0 HA PHE A 130 8.040 -4.005 -4.997 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.900 -1.687 -5.078 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.451 -2.264 -5.654 1.00 0.00 H new ATOM 0 HD1 PHE A 130 6.836 -2.671 -6.578 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.830 -2.046 -7.921 1.00 0.00 H new ATOM 0 HE1 PHE A 130 6.031 -2.514 -8.894 1.00 0.00 H new ATOM 0 HE2 PHE A 130 10.029 -1.888 -10.238 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.627 -2.122 -10.728 1.00 0.00 H new ATOM 833 N GLU A 131 11.096 -4.856 -5.970 1.00 0.00 N ATOM 834 CA GLU A 131 11.849 -5.845 -6.733 1.00 0.00 C ATOM 835 C GLU A 131 11.635 -7.246 -6.171 1.00 0.00 C ATOM 836 O GLU A 131 11.525 -8.217 -6.922 1.00 0.00 O ATOM 837 CB GLU A 131 13.340 -5.500 -6.718 1.00 0.00 C ATOM 838 CG GLU A 131 13.744 -4.500 -7.789 1.00 0.00 C ATOM 839 CD GLU A 131 14.631 -5.111 -8.856 1.00 0.00 C ATOM 840 OE1 GLU A 131 15.613 -5.793 -8.492 1.00 0.00 O ATOM 841 OE2 GLU A 131 14.347 -4.908 -10.055 1.00 0.00 O ATOM 0 H GLU A 131 11.668 -4.124 -5.549 1.00 0.00 H new ATOM 0 HA GLU A 131 11.487 -5.827 -7.761 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.601 -5.097 -5.739 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.917 -6.415 -6.851 1.00 0.00 H new ATOM 0 HG2 GLU A 131 12.848 -4.093 -8.257 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.267 -3.665 -7.322 1.00 0.00 H new ATOM 848 N MET A 132 11.578 -7.348 -4.848 1.00 0.00 N ATOM 849 CA MET A 132 11.377 -8.631 -4.187 1.00 0.00 C ATOM 850 C MET A 132 10.045 -9.252 -4.597 1.00 0.00 C ATOM 851 O MET A 132 9.939 -10.468 -4.756 1.00 0.00 O ATOM 852 CB MET A 132 11.426 -8.460 -2.668 1.00 0.00 C ATOM 853 CG MET A 132 12.619 -7.652 -2.185 1.00 0.00 C ATOM 854 SD MET A 132 13.598 -8.519 -0.943 1.00 0.00 S ATOM 855 CE MET A 132 13.388 -7.439 0.470 1.00 0.00 C ATOM 0 H MET A 132 11.668 -6.556 -4.212 1.00 0.00 H new ATOM 0 HA MET A 132 12.180 -9.300 -4.496 1.00 0.00 H new ATOM 0 HB2 MET A 132 10.509 -7.973 -2.336 1.00 0.00 H new ATOM 0 HB3 MET A 132 11.451 -9.444 -2.201 1.00 0.00 H new ATOM 0 HG2 MET A 132 13.255 -7.408 -3.036 1.00 0.00 H new ATOM 0 HG3 MET A 132 12.267 -6.708 -1.769 1.00 0.00 H new ATOM 0 HE1 MET A 132 14.185 -7.623 1.190 1.00 0.00 H new ATOM 0 HE2 MET A 132 13.427 -6.400 0.143 1.00 0.00 H new ATOM 0 HE3 MET A 132 12.424 -7.636 0.939 1.00 0.00 H new ATOM 865 N VAL A 133 9.032 -8.408 -4.768 1.00 0.00 N ATOM 866 CA VAL A 133 7.708 -8.873 -5.161 1.00 0.00 C ATOM 867 C VAL A 133 7.737 -9.507 -6.548 1.00 0.00 C ATOM 868 O VAL A 133 7.112 -10.541 -6.783 1.00 0.00 O ATOM 869 CB VAL A 133 6.682 -7.725 -5.155 1.00 0.00 C ATOM 870 CG1 VAL A 133 5.273 -8.266 -5.346 1.00 0.00 C ATOM 871 CG2 VAL A 133 6.784 -6.924 -3.866 1.00 0.00 C ATOM 0 H VAL A 133 9.104 -7.399 -4.640 1.00 0.00 H new ATOM 0 HA VAL A 133 7.407 -9.621 -4.428 1.00 0.00 H new ATOM 0 HB VAL A 133 6.906 -7.058 -5.988 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.562 -7.440 -5.339 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.211 -8.790 -6.300 1.00 0.00 H new ATOM 0 HG13 VAL A 133 5.035 -8.956 -4.536 1.00 0.00 H new ATOM 0 HG21 VAL A 133 6.051 -6.117 -3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.588 -7.577 -3.015 1.00 0.00 H new ATOM 0 HG23 VAL A 133 7.786 -6.503 -3.777 1.00 0.00 H new ATOM 881 N THR A 134 8.467 -8.879 -7.464 1.00 0.00 N ATOM 882 CA THR A 134 8.578 -9.381 -8.828 1.00 0.00 C ATOM 883 C THR A 134 9.395 -10.670 -8.870 1.00 0.00 C ATOM 884 O THR A 134 9.033 -11.623 -9.558 1.00 0.00 O ATOM 885 CB THR A 134 9.218 -8.328 -9.732 1.00 0.00 C ATOM 886 OG1 THR A 134 8.652 -7.051 -9.493 1.00 0.00 O ATOM 887 CG2 THR A 134 9.063 -8.630 -11.207 1.00 0.00 C ATOM 0 H THR A 134 8.990 -8.022 -7.286 1.00 0.00 H new ATOM 0 HA THR A 134 7.573 -9.597 -9.191 1.00 0.00 H new ATOM 0 HB THR A 134 10.280 -8.343 -9.485 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.075 -6.390 -10.080 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.540 -7.843 -11.792 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.534 -9.587 -11.434 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.004 -8.678 -11.459 1.00 0.00 H new ATOM 895 N LYS A 135 10.500 -10.686 -8.133 1.00 0.00 N ATOM 896 CA LYS A 135 11.370 -11.849 -8.088 1.00 0.00 C ATOM 897 C LYS A 135 10.633 -13.060 -7.527 1.00 0.00 C ATOM 898 O LYS A 135 10.847 -14.190 -7.969 1.00 0.00 O ATOM 899 CB LYS A 135 12.608 -11.553 -7.239 1.00 0.00 C ATOM 900 CG LYS A 135 13.402 -10.348 -7.718 1.00 0.00 C ATOM 901 CD LYS A 135 14.665 -10.767 -8.455 1.00 0.00 C ATOM 902 CE LYS A 135 15.683 -9.640 -8.499 1.00 0.00 C ATOM 903 NZ LYS A 135 16.423 -9.610 -9.791 1.00 0.00 N ATOM 0 H LYS A 135 10.813 -9.903 -7.558 1.00 0.00 H new ATOM 0 HA LYS A 135 11.682 -12.077 -9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.299 -11.387 -6.207 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.257 -12.429 -7.240 1.00 0.00 H new ATOM 0 HG2 LYS A 135 12.781 -9.740 -8.376 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.668 -9.724 -6.865 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.103 -11.636 -7.964 1.00 0.00 H new ATOM 0 HD3 LYS A 135 14.411 -11.070 -9.471 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.176 -8.687 -8.349 1.00 0.00 H new ATOM 0 HE3 LYS A 135 16.390 -9.758 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.108 -8.827 -9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 16.928 -10.510 -9.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.751 -9.472 -10.573 1.00 0.00 H new ATOM 917 N GLU A 136 9.765 -12.817 -6.550 1.00 0.00 N ATOM 918 CA GLU A 136 8.995 -13.888 -5.926 1.00 0.00 C ATOM 919 C GLU A 136 7.670 -14.115 -6.655 1.00 0.00 C ATOM 920 O GLU A 136 6.988 -15.111 -6.418 1.00 0.00 O ATOM 921 CB GLU A 136 8.728 -13.562 -4.456 1.00 0.00 C ATOM 922 CG GLU A 136 9.993 -13.404 -3.629 1.00 0.00 C ATOM 923 CD GLU A 136 9.704 -13.083 -2.176 1.00 0.00 C ATOM 924 OE1 GLU A 136 9.565 -14.033 -1.375 1.00 0.00 O ATOM 925 OE2 GLU A 136 9.615 -11.884 -1.838 1.00 0.00 O ATOM 0 H GLU A 136 9.577 -11.888 -6.173 1.00 0.00 H new ATOM 0 HA GLU A 136 9.583 -14.803 -5.991 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.147 -12.641 -4.396 1.00 0.00 H new ATOM 0 HB3 GLU A 136 8.117 -14.353 -4.022 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.576 -14.323 -3.685 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.606 -12.611 -4.057 1.00 0.00 H new ATOM 932 N LYS A 137 7.312 -13.189 -7.543 1.00 0.00 N ATOM 933 CA LYS A 137 6.069 -13.297 -8.299 1.00 0.00 C ATOM 934 C LYS A 137 4.861 -13.243 -7.370 1.00 0.00 C ATOM 935 O LYS A 137 3.830 -13.860 -7.639 1.00 0.00 O ATOM 936 CB LYS A 137 6.047 -14.595 -9.110 1.00 0.00 C ATOM 937 CG LYS A 137 7.208 -14.723 -10.083 1.00 0.00 C ATOM 938 CD LYS A 137 7.644 -16.171 -10.240 1.00 0.00 C ATOM 939 CE LYS A 137 7.031 -16.808 -11.475 1.00 0.00 C ATOM 940 NZ LYS A 137 7.994 -17.696 -12.181 1.00 0.00 N ATOM 0 H LYS A 137 7.865 -12.358 -7.755 1.00 0.00 H new ATOM 0 HA LYS A 137 6.017 -12.451 -8.984 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.063 -15.442 -8.425 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.111 -14.651 -9.665 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.917 -14.322 -11.054 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.048 -14.125 -9.730 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.731 -16.219 -10.306 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.353 -16.737 -9.355 1.00 0.00 H new ATOM 0 HE2 LYS A 137 6.151 -17.384 -11.187 1.00 0.00 H new ATOM 0 HE3 LYS A 137 6.692 -16.027 -12.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.535 -18.110 -13.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.823 -17.142 -12.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 8.298 -18.457 -11.541 1.00 0.00 H new ATOM 954 N LYS A 138 4.996 -12.502 -6.276 1.00 0.00 N ATOM 955 CA LYS A 138 3.915 -12.366 -5.304 1.00 0.00 C ATOM 956 C LYS A 138 2.867 -11.359 -5.776 1.00 0.00 C ATOM 957 O LYS A 138 1.832 -11.184 -5.132 1.00 0.00 O ATOM 958 CB LYS A 138 4.474 -11.938 -3.946 1.00 0.00 C ATOM 959 CG LYS A 138 5.160 -13.063 -3.190 1.00 0.00 C ATOM 960 CD LYS A 138 4.163 -14.107 -2.716 1.00 0.00 C ATOM 961 CE LYS A 138 4.839 -15.188 -1.889 1.00 0.00 C ATOM 962 NZ LYS A 138 5.083 -14.744 -0.489 1.00 0.00 N ATOM 0 H LYS A 138 5.843 -11.986 -6.039 1.00 0.00 H new ATOM 0 HA LYS A 138 3.432 -13.338 -5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 138 5.185 -11.125 -4.095 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.662 -11.544 -3.336 1.00 0.00 H new ATOM 0 HG2 LYS A 138 5.903 -13.534 -3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 138 5.694 -12.653 -2.333 1.00 0.00 H new ATOM 0 HD2 LYS A 138 3.386 -13.626 -2.122 1.00 0.00 H new ATOM 0 HD3 LYS A 138 3.672 -14.560 -3.577 1.00 0.00 H new ATOM 0 HE2 LYS A 138 4.217 -16.083 -1.883 1.00 0.00 H new ATOM 0 HE3 LYS A 138 5.786 -15.462 -2.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 5.321 -15.568 0.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 5.872 -14.067 -0.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 4.227 -14.287 -0.115 1.00 0.00 H new ATOM 976 N TRP A 139 3.135 -10.698 -6.901 1.00 0.00 N ATOM 977 CA TRP A 139 2.208 -9.712 -7.448 1.00 0.00 C ATOM 978 C TRP A 139 0.832 -10.328 -7.678 1.00 0.00 C ATOM 979 O TRP A 139 -0.189 -9.649 -7.561 1.00 0.00 O ATOM 980 CB TRP A 139 2.752 -9.144 -8.760 1.00 0.00 C ATOM 981 CG TRP A 139 3.923 -8.229 -8.573 1.00 0.00 C ATOM 982 CD1 TRP A 139 5.228 -8.496 -8.873 1.00 0.00 C ATOM 983 CD2 TRP A 139 3.896 -6.899 -8.043 1.00 0.00 C ATOM 984 NE1 TRP A 139 6.014 -7.413 -8.562 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.220 -6.420 -8.050 1.00 0.00 C ATOM 986 CE3 TRP A 139 2.881 -6.067 -7.563 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.554 -5.147 -7.597 1.00 0.00 C ATOM 988 CZ3 TRP A 139 3.215 -4.803 -7.113 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.541 -4.354 -7.134 1.00 0.00 C ATOM 0 H TRP A 139 3.985 -10.828 -7.450 1.00 0.00 H new ATOM 0 HA TRP A 139 2.107 -8.903 -6.724 1.00 0.00 H new ATOM 0 HB2 TRP A 139 3.045 -9.968 -9.410 1.00 0.00 H new ATOM 0 HB3 TRP A 139 1.956 -8.603 -9.271 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.589 -9.423 -9.293 1.00 0.00 H new ATOM 0 HE1 TRP A 139 7.024 -7.357 -8.691 1.00 0.00 H new ATOM 0 HE3 TRP A 139 1.855 -6.405 -7.544 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.576 -4.798 -7.611 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.440 -4.151 -6.739 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.768 -3.360 -6.777 1.00 0.00 H new ATOM 1000 N SER A 140 0.812 -11.615 -8.004 1.00 0.00 N ATOM 1001 CA SER A 140 -0.439 -12.324 -8.250 1.00 0.00 C ATOM 1002 C SER A 140 -1.316 -12.325 -7.002 1.00 0.00 C ATOM 1003 O SER A 140 -2.535 -12.183 -7.089 1.00 0.00 O ATOM 1004 CB SER A 140 -0.157 -13.760 -8.691 1.00 0.00 C ATOM 1005 OG SER A 140 0.674 -13.789 -9.838 1.00 0.00 O ATOM 0 H SER A 140 1.649 -12.190 -8.104 1.00 0.00 H new ATOM 0 HA SER A 140 -0.972 -11.806 -9.047 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.322 -14.306 -7.878 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.097 -14.268 -8.906 1.00 0.00 H new ATOM 0 HG SER A 140 0.840 -14.719 -10.098 1.00 0.00 H new ATOM 1011 N LYS A 141 -0.686 -12.486 -5.842 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.409 -12.507 -4.576 1.00 0.00 C ATOM 1013 C LYS A 141 -1.913 -11.112 -4.216 1.00 0.00 C ATOM 1014 O LYS A 141 -2.954 -10.964 -3.579 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.510 -13.041 -3.461 1.00 0.00 C ATOM 1016 CG LYS A 141 -0.445 -14.559 -3.405 1.00 0.00 C ATOM 1017 CD LYS A 141 0.921 -15.042 -2.944 1.00 0.00 C ATOM 1018 CE LYS A 141 1.108 -14.842 -1.450 1.00 0.00 C ATOM 1019 NZ LYS A 141 1.217 -13.401 -1.092 1.00 0.00 N ATOM 0 H LYS A 141 0.323 -12.604 -5.753 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.269 -13.168 -4.687 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.497 -12.648 -3.598 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.871 -12.666 -2.504 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -1.212 -14.932 -2.726 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -0.664 -14.970 -4.390 1.00 0.00 H new ATOM 0 HD2 LYS A 141 1.036 -16.098 -3.188 1.00 0.00 H new ATOM 0 HD3 LYS A 141 1.700 -14.504 -3.484 1.00 0.00 H new ATOM 0 HE2 LYS A 141 0.268 -15.286 -0.916 1.00 0.00 H new ATOM 0 HE3 LYS A 141 2.006 -15.366 -1.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 1.909 -13.285 -0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 1.529 -12.859 -1.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 0.290 -13.050 -0.778 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.166 -10.093 -4.628 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.537 -8.712 -4.349 1.00 0.00 C ATOM 1035 C VAL A 142 -2.900 -8.378 -4.947 1.00 0.00 C ATOM 1036 O VAL A 142 -3.747 -7.775 -4.288 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.490 -7.726 -4.903 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -0.812 -6.303 -4.469 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.907 -8.124 -4.455 1.00 0.00 C ATOM 0 H VAL A 142 -0.300 -10.198 -5.156 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.584 -8.609 -3.265 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.523 -7.765 -5.992 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.062 -5.622 -4.870 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.796 -6.022 -4.845 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.810 -6.245 -3.381 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.633 -7.417 -4.856 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.956 -8.117 -3.366 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.135 -9.125 -4.822 1.00 0.00 H new ATOM 1049 N GLY A 143 -3.104 -8.775 -6.199 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.367 -8.510 -6.864 1.00 0.00 C ATOM 1051 C GLY A 143 -5.513 -9.307 -6.275 1.00 0.00 C ATOM 1052 O GLY A 143 -6.634 -8.811 -6.168 1.00 0.00 O ATOM 0 H GLY A 143 -2.418 -9.275 -6.765 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.595 -7.446 -6.793 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.272 -8.746 -7.924 1.00 0.00 H new ATOM 1056 N SER A 144 -5.230 -10.548 -5.890 1.00 0.00 N ATOM 1057 CA SER A 144 -6.247 -11.417 -5.307 1.00 0.00 C ATOM 1058 C SER A 144 -6.711 -10.880 -3.957 1.00 0.00 C ATOM 1059 O SER A 144 -7.886 -10.990 -3.604 1.00 0.00 O ATOM 1060 CB SER A 144 -5.700 -12.836 -5.144 1.00 0.00 C ATOM 1061 OG SER A 144 -5.381 -13.408 -6.402 1.00 0.00 O ATOM 0 H SER A 144 -4.307 -10.974 -5.971 1.00 0.00 H new ATOM 0 HA SER A 144 -7.102 -11.440 -5.982 1.00 0.00 H new ATOM 0 HB2 SER A 144 -4.811 -12.816 -4.514 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.437 -13.457 -4.635 1.00 0.00 H new ATOM 0 HG SER A 144 -4.513 -13.068 -6.705 1.00 0.00 H new ATOM 1067 N ARG A 145 -5.781 -10.301 -3.204 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.097 -9.747 -1.893 1.00 0.00 C ATOM 1069 C ARG A 145 -7.072 -8.582 -2.015 1.00 0.00 C ATOM 1070 O ARG A 145 -7.890 -8.348 -1.125 1.00 0.00 O ATOM 1071 CB ARG A 145 -4.818 -9.287 -1.191 1.00 0.00 C ATOM 1072 CG ARG A 145 -4.151 -10.378 -0.368 1.00 0.00 C ATOM 1073 CD ARG A 145 -2.872 -9.880 0.287 1.00 0.00 C ATOM 1074 NE ARG A 145 -2.092 -10.971 0.865 1.00 0.00 N ATOM 1075 CZ ARG A 145 -1.001 -10.793 1.605 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -0.556 -9.568 1.858 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -0.352 -11.842 2.092 1.00 0.00 N ATOM 0 H ARG A 145 -4.804 -10.204 -3.479 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.569 -10.529 -1.299 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.113 -8.925 -1.939 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.053 -8.445 -0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.841 -10.729 0.399 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.925 -11.231 -1.008 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -2.267 -9.354 -0.452 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -3.121 -9.160 1.066 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.402 -11.927 0.691 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -1.051 -8.758 1.484 1.00 0.00 H new ATOM 0 HH12 ARG A 145 0.281 -9.437 2.426 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -0.689 -12.785 1.899 1.00 0.00 H new ATOM 0 HH22 ARG A 145 0.485 -11.706 2.659 1.00 0.00 H new ATOM 1091 N LEU A 146 -6.981 -7.855 -3.123 1.00 0.00 N ATOM 1092 CA LEU A 146 -7.858 -6.713 -3.361 1.00 0.00 C ATOM 1093 C LEU A 146 -9.300 -7.168 -3.560 1.00 0.00 C ATOM 1094 O LEU A 146 -10.162 -6.918 -2.718 1.00 0.00 O ATOM 1095 CB LEU A 146 -7.383 -5.928 -4.588 1.00 0.00 C ATOM 1096 CG LEU A 146 -6.423 -4.775 -4.286 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -5.614 -4.419 -5.523 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -7.190 -3.563 -3.780 1.00 0.00 C ATOM 0 H LEU A 146 -6.310 -8.035 -3.870 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.819 -6.065 -2.485 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.893 -6.618 -5.275 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -8.255 -5.529 -5.105 1.00 0.00 H new ATOM 0 HG LEU A 146 -5.733 -5.095 -3.505 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -4.937 -3.597 -5.291 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.036 -5.287 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.288 -4.118 -6.324 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -6.492 -2.752 -3.570 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.903 -3.241 -4.539 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -7.725 -3.826 -2.868 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.556 -7.836 -4.680 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.894 -8.316 -4.969 1.00 0.00 C ATOM 1112 C GLY A 147 -11.135 -8.504 -6.454 1.00 0.00 C ATOM 1113 O GLY A 147 -12.080 -7.946 -7.013 1.00 0.00 O ATOM 0 H GLY A 147 -8.860 -8.053 -5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -11.055 -9.264 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.623 -7.610 -4.572 1.00 0.00 H new ATOM 1117 N TYR A 148 -10.279 -9.294 -7.095 1.00 0.00 N ATOM 1118 CA TYR A 148 -10.402 -9.555 -8.524 1.00 0.00 C ATOM 1119 C TYR A 148 -10.960 -10.953 -8.776 1.00 0.00 C ATOM 1120 O TYR A 148 -10.891 -11.826 -7.909 1.00 0.00 O ATOM 1121 CB TYR A 148 -9.044 -9.404 -9.211 1.00 0.00 C ATOM 1122 CG TYR A 148 -8.417 -8.042 -9.020 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -9.179 -6.885 -9.107 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -7.059 -7.914 -8.753 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -8.608 -5.638 -8.933 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.480 -6.672 -8.578 1.00 0.00 C ATOM 1127 CZ TYR A 148 -7.259 -5.538 -8.668 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.685 -4.299 -8.495 1.00 0.00 O ATOM 0 H TYR A 148 -9.493 -9.764 -6.647 1.00 0.00 H new ATOM 0 HA TYR A 148 -11.096 -8.825 -8.942 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -8.365 -10.165 -8.826 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -9.163 -9.594 -10.278 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -10.236 -6.960 -9.314 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.446 -8.800 -8.681 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -9.215 -4.748 -9.004 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -5.423 -6.590 -8.372 1.00 0.00 H new ATOM 0 HH TYR A 148 -7.347 -3.681 -8.121 1.00 0.00 H new ATOM 1138 N LEU A 149 -11.511 -11.159 -9.968 1.00 0.00 N ATOM 1139 CA LEU A 149 -12.080 -12.450 -10.333 1.00 0.00 C ATOM 1140 C LEU A 149 -10.982 -13.443 -10.707 1.00 0.00 C ATOM 1141 O LEU A 149 -9.881 -13.048 -11.089 1.00 0.00 O ATOM 1142 CB LEU A 149 -13.057 -12.290 -11.499 1.00 0.00 C ATOM 1143 CG LEU A 149 -14.382 -11.613 -11.146 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -15.147 -11.244 -12.408 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -15.220 -12.517 -10.256 1.00 0.00 C ATOM 0 H LEU A 149 -11.575 -10.448 -10.697 1.00 0.00 H new ATOM 0 HA LEU A 149 -12.618 -12.839 -9.468 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -12.570 -11.713 -12.285 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -13.269 -13.276 -11.913 1.00 0.00 H new ATOM 0 HG LEU A 149 -14.166 -10.696 -10.598 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.087 -10.763 -12.136 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -14.549 -10.558 -13.008 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -15.354 -12.145 -12.985 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -16.159 -12.020 -10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -15.428 -13.451 -10.778 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -14.675 -12.729 -9.336 1.00 0.00 H new ATOM 1157 N PRO A 150 -11.270 -14.753 -10.603 1.00 0.00 N ATOM 1158 CA PRO A 150 -10.299 -15.803 -10.932 1.00 0.00 C ATOM 1159 C PRO A 150 -9.992 -15.857 -12.425 1.00 0.00 C ATOM 1160 O PRO A 150 -10.860 -16.175 -13.238 1.00 0.00 O ATOM 1161 CB PRO A 150 -10.998 -17.089 -10.484 1.00 0.00 C ATOM 1162 CG PRO A 150 -12.451 -16.766 -10.519 1.00 0.00 C ATOM 1163 CD PRO A 150 -12.559 -15.311 -10.156 1.00 0.00 C ATOM 0 HA PRO A 150 -9.337 -15.635 -10.447 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -10.762 -17.920 -11.149 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -10.682 -17.382 -9.483 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -12.869 -16.954 -11.508 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -13.006 -17.386 -9.815 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -13.400 -14.833 -10.658 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -12.707 -15.174 -9.085 1.00 0.00 H new ATOM 1171 N GLY A 151 -8.749 -15.544 -12.779 1.00 0.00 N ATOM 1172 CA GLY A 151 -8.348 -15.562 -14.172 1.00 0.00 C ATOM 1173 C GLY A 151 -6.990 -16.205 -14.377 1.00 0.00 C ATOM 1174 O GLY A 151 -6.598 -17.096 -13.623 1.00 0.00 O ATOM 0 H GLY A 151 -8.013 -15.278 -12.125 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -9.094 -16.103 -14.755 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -8.324 -14.541 -14.553 1.00 0.00 H new ATOM 1178 N LYS A 152 -6.272 -15.753 -15.400 1.00 0.00 N ATOM 1179 CA LYS A 152 -4.949 -16.291 -15.701 1.00 0.00 C ATOM 1180 C LYS A 152 -3.857 -15.307 -15.298 1.00 0.00 C ATOM 1181 O LYS A 152 -3.034 -15.598 -14.430 1.00 0.00 O ATOM 1182 CB LYS A 152 -4.836 -16.615 -17.192 1.00 0.00 C ATOM 1183 CG LYS A 152 -5.882 -17.603 -17.682 1.00 0.00 C ATOM 1184 CD LYS A 152 -5.837 -17.760 -19.192 1.00 0.00 C ATOM 1185 CE LYS A 152 -5.076 -19.012 -19.600 1.00 0.00 C ATOM 1186 NZ LYS A 152 -4.628 -18.953 -21.019 1.00 0.00 N ATOM 0 H LYS A 152 -6.583 -15.017 -16.034 1.00 0.00 H new ATOM 0 HA LYS A 152 -4.816 -17.207 -15.126 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -4.925 -15.691 -17.764 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.844 -17.020 -17.393 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -5.718 -18.572 -17.210 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -6.873 -17.265 -17.380 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -6.853 -17.806 -19.584 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.363 -16.884 -19.636 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -4.209 -19.138 -18.951 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -5.711 -19.886 -19.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -4.114 -19.825 -21.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -5.456 -18.859 -21.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -4.001 -18.134 -21.151 1.00 0.00 H new ATOM 1200 N GLY A 153 -3.856 -14.139 -15.933 1.00 0.00 N ATOM 1201 CA GLY A 153 -2.861 -13.128 -15.627 1.00 0.00 C ATOM 1202 C GLY A 153 -3.462 -11.900 -14.973 1.00 0.00 C ATOM 1203 O GLY A 153 -4.476 -11.376 -15.437 1.00 0.00 O ATOM 0 H GLY A 153 -4.527 -13.875 -16.654 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.106 -13.554 -14.967 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.352 -12.834 -16.545 1.00 0.00 H new ATOM 1207 N THR A 154 -2.838 -11.439 -13.894 1.00 0.00 N ATOM 1208 CA THR A 154 -3.321 -10.265 -13.177 1.00 0.00 C ATOM 1209 C THR A 154 -2.170 -9.536 -12.489 1.00 0.00 C ATOM 1210 O THR A 154 -2.055 -8.314 -12.578 1.00 0.00 O ATOM 1211 CB THR A 154 -4.372 -10.670 -12.142 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.155 -11.749 -12.620 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.314 -9.545 -11.774 1.00 0.00 C ATOM 0 H THR A 154 -1.998 -11.860 -13.497 1.00 0.00 H new ATOM 0 HA THR A 154 -3.775 -9.589 -13.902 1.00 0.00 H new ATOM 0 HB THR A 154 -3.809 -10.954 -11.253 1.00 0.00 H new ATOM 0 HG1 THR A 154 -5.820 -11.995 -11.944 1.00 0.00 H new ATOM 0 HG21 THR A 154 -6.034 -9.900 -11.036 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.744 -8.715 -11.355 1.00 0.00 H new ATOM 0 HG23 THR A 154 -5.844 -9.208 -12.665 1.00 0.00 H new ATOM 1221 N GLY A 155 -1.319 -10.295 -11.807 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.188 -9.703 -11.115 1.00 0.00 C ATOM 1223 C GLY A 155 0.726 -8.934 -12.048 1.00 0.00 C ATOM 1224 O GLY A 155 1.248 -7.879 -11.686 1.00 0.00 O ATOM 0 H GLY A 155 -1.392 -11.309 -11.721 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -0.553 -9.034 -10.336 1.00 0.00 H new ATOM 0 HA3 GLY A 155 0.382 -10.489 -10.619 1.00 0.00 H new ATOM 1228 N SER A 156 0.920 -9.462 -13.252 1.00 0.00 N ATOM 1229 CA SER A 156 1.777 -8.819 -14.240 1.00 0.00 C ATOM 1230 C SER A 156 1.159 -7.509 -14.724 1.00 0.00 C ATOM 1231 O SER A 156 1.871 -6.564 -15.064 1.00 0.00 O ATOM 1232 CB SER A 156 2.012 -9.754 -15.429 1.00 0.00 C ATOM 1233 OG SER A 156 2.714 -10.917 -15.029 1.00 0.00 O ATOM 0 H SER A 156 0.495 -10.334 -13.567 1.00 0.00 H new ATOM 0 HA SER A 156 2.733 -8.598 -13.766 1.00 0.00 H new ATOM 0 HB2 SER A 156 1.055 -10.036 -15.869 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.577 -9.231 -16.201 1.00 0.00 H new ATOM 0 HG SER A 156 2.851 -11.500 -15.805 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.168 -7.460 -14.751 1.00 0.00 N ATOM 1240 CA LEU A 157 -0.880 -6.267 -15.192 1.00 0.00 C ATOM 1241 C LEU A 157 -0.747 -5.144 -14.168 1.00 0.00 C ATOM 1242 O LEU A 157 -0.474 -3.997 -14.523 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.359 -6.587 -15.424 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.689 -7.157 -16.806 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -2.282 -8.619 -16.890 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -4.171 -6.995 -17.107 1.00 0.00 C ATOM 0 H LEU A 157 -0.772 -8.233 -14.473 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.435 -5.935 -16.130 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.684 -7.300 -14.666 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.940 -5.677 -15.275 1.00 0.00 H new ATOM 0 HG LEU A 157 -2.124 -6.601 -17.554 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -2.524 -9.008 -17.879 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -1.210 -8.709 -16.717 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -2.820 -9.191 -16.134 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -4.389 -7.405 -18.093 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -4.755 -7.526 -16.356 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -4.433 -5.937 -17.088 1.00 0.00 H new ATOM 1258 N LEU A 158 -0.941 -5.483 -12.899 1.00 0.00 N ATOM 1259 CA LEU A 158 -0.842 -4.503 -11.823 1.00 0.00 C ATOM 1260 C LEU A 158 0.574 -3.948 -11.721 1.00 0.00 C ATOM 1261 O LEU A 158 0.771 -2.781 -11.384 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.252 -5.135 -10.490 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.656 -5.740 -10.467 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -2.772 -6.777 -9.358 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.703 -4.651 -10.289 1.00 0.00 C ATOM 0 H LEU A 158 -1.168 -6.428 -12.590 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.520 -3.680 -12.051 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.533 -5.914 -10.238 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.187 -4.376 -9.710 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.833 -6.235 -11.422 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -3.778 -7.197 -9.356 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -2.047 -7.573 -9.527 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.575 -6.304 -8.396 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.696 -5.100 -10.275 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.528 -4.128 -9.349 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.636 -3.944 -11.116 1.00 0.00 H new ATOM 1277 N LYS A 159 1.558 -4.791 -12.016 1.00 0.00 N ATOM 1278 CA LYS A 159 2.957 -4.384 -11.958 1.00 0.00 C ATOM 1279 C LYS A 159 3.243 -3.275 -12.968 1.00 0.00 C ATOM 1280 O LYS A 159 3.968 -2.327 -12.673 1.00 0.00 O ATOM 1281 CB LYS A 159 3.871 -5.583 -12.225 1.00 0.00 C ATOM 1282 CG LYS A 159 5.069 -5.655 -11.291 1.00 0.00 C ATOM 1283 CD LYS A 159 6.335 -6.060 -12.032 1.00 0.00 C ATOM 1284 CE LYS A 159 7.423 -5.006 -11.897 1.00 0.00 C ATOM 1285 NZ LYS A 159 7.049 -3.732 -12.571 1.00 0.00 N ATOM 0 H LYS A 159 1.412 -5.760 -12.298 1.00 0.00 H new ATOM 0 HA LYS A 159 3.157 -4.000 -10.958 1.00 0.00 H new ATOM 0 HB2 LYS A 159 3.290 -6.500 -12.129 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.226 -5.537 -13.255 1.00 0.00 H new ATOM 0 HG2 LYS A 159 5.219 -4.685 -10.816 1.00 0.00 H new ATOM 0 HG3 LYS A 159 4.868 -6.372 -10.495 1.00 0.00 H new ATOM 0 HD2 LYS A 159 6.698 -7.011 -11.641 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.106 -6.215 -13.086 1.00 0.00 H new ATOM 0 HE2 LYS A 159 7.615 -4.815 -10.841 1.00 0.00 H new ATOM 0 HE3 LYS A 159 8.351 -5.385 -12.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 7.875 -3.101 -12.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 6.727 -3.933 -13.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 6.283 -3.271 -12.041 1.00 0.00 H new ATOM 1299 N SER A 160 2.666 -3.405 -14.158 1.00 0.00 N ATOM 1300 CA SER A 160 2.858 -2.415 -15.211 1.00 0.00 C ATOM 1301 C SER A 160 2.268 -1.067 -14.807 1.00 0.00 C ATOM 1302 O SER A 160 2.902 -0.026 -14.973 1.00 0.00 O ATOM 1303 CB SER A 160 2.216 -2.895 -16.513 1.00 0.00 C ATOM 1304 OG SER A 160 2.750 -4.144 -16.915 1.00 0.00 O ATOM 0 H SER A 160 2.062 -4.185 -14.417 1.00 0.00 H new ATOM 0 HA SER A 160 3.930 -2.290 -15.366 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.138 -2.983 -16.380 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.381 -2.156 -17.297 1.00 0.00 H new ATOM 0 HG SER A 160 2.442 -4.844 -16.302 1.00 0.00 H new ATOM 1310 N HIS A 161 1.051 -1.095 -14.274 1.00 0.00 N ATOM 1311 CA HIS A 161 0.376 0.124 -13.845 1.00 0.00 C ATOM 1312 C HIS A 161 1.087 0.749 -12.648 1.00 0.00 C ATOM 1313 O HIS A 161 1.318 1.958 -12.612 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.082 -0.172 -13.491 1.00 0.00 C ATOM 1315 CG HIS A 161 -1.951 -0.415 -14.684 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.418 0.599 -15.494 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.440 -1.565 -15.206 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -3.156 0.083 -16.461 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.185 -1.227 -16.310 1.00 0.00 N ATOM 0 H HIS A 161 0.512 -1.949 -14.129 1.00 0.00 H new ATOM 0 HA HIS A 161 0.404 0.834 -14.671 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.119 -1.046 -12.841 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.486 0.665 -12.922 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.275 -2.562 -14.825 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.652 0.640 -17.243 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.680 -1.883 -16.915 1.00 0.00 H new ATOM 1328 N TYR A 162 1.432 -0.084 -11.671 1.00 0.00 N ATOM 1329 CA TYR A 162 2.118 0.387 -10.473 1.00 0.00 C ATOM 1330 C TYR A 162 3.444 1.051 -10.833 1.00 0.00 C ATOM 1331 O TYR A 162 3.757 2.139 -10.351 1.00 0.00 O ATOM 1332 CB TYR A 162 2.359 -0.775 -9.509 1.00 0.00 C ATOM 1333 CG TYR A 162 2.843 -0.338 -8.145 1.00 0.00 C ATOM 1334 CD1 TYR A 162 1.966 0.210 -7.217 1.00 0.00 C ATOM 1335 CD2 TYR A 162 4.177 -0.475 -7.782 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.404 0.610 -5.969 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.623 -0.077 -6.537 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.733 0.464 -5.634 1.00 0.00 C ATOM 1339 OH TYR A 162 4.173 0.862 -4.392 1.00 0.00 O ATOM 0 H TYR A 162 1.248 -1.087 -11.685 1.00 0.00 H new ATOM 0 HA TYR A 162 1.483 1.127 -9.986 1.00 0.00 H new ATOM 0 HB2 TYR A 162 1.433 -1.339 -9.394 1.00 0.00 H new ATOM 0 HB3 TYR A 162 3.092 -1.453 -9.946 1.00 0.00 H new ATOM 0 HD1 TYR A 162 0.924 0.325 -7.476 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.877 -0.900 -8.486 1.00 0.00 H new ATOM 0 HE1 TYR A 162 1.709 1.035 -5.260 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.664 -0.189 -6.272 1.00 0.00 H new ATOM 0 HH TYR A 162 5.135 0.690 -4.315 1.00 0.00 H new ATOM 1349 N GLU A 163 4.219 0.387 -11.685 1.00 0.00 N ATOM 1350 CA GLU A 163 5.511 0.910 -12.112 1.00 0.00 C ATOM 1351 C GLU A 163 5.357 1.774 -13.361 1.00 0.00 C ATOM 1352 O GLU A 163 6.021 1.547 -14.372 1.00 0.00 O ATOM 1353 CB GLU A 163 6.483 -0.237 -12.384 1.00 0.00 C ATOM 1354 CG GLU A 163 7.944 0.150 -12.226 1.00 0.00 C ATOM 1355 CD GLU A 163 8.802 -0.318 -13.385 1.00 0.00 C ATOM 1356 OE1 GLU A 163 8.606 0.185 -14.512 1.00 0.00 O ATOM 1357 OE2 GLU A 163 9.671 -1.190 -13.166 1.00 0.00 O ATOM 0 H GLU A 163 3.974 -0.515 -12.093 1.00 0.00 H new ATOM 0 HA GLU A 163 5.911 1.530 -11.310 1.00 0.00 H new ATOM 0 HB2 GLU A 163 6.259 -1.060 -11.705 1.00 0.00 H new ATOM 0 HB3 GLU A 163 6.321 -0.606 -13.397 1.00 0.00 H new ATOM 0 HG2 GLU A 163 8.021 1.234 -12.137 1.00 0.00 H new ATOM 0 HG3 GLU A 163 8.330 -0.274 -11.299 1.00 0.00 H new ATOM 1364 N ARG A 164 4.474 2.764 -13.282 1.00 0.00 N ATOM 1365 CA ARG A 164 4.231 3.662 -14.406 1.00 0.00 C ATOM 1366 C ARG A 164 3.775 5.035 -13.923 1.00 0.00 C ATOM 1367 O ARG A 164 4.226 6.062 -14.433 1.00 0.00 O ATOM 1368 CB ARG A 164 3.181 3.062 -15.345 1.00 0.00 C ATOM 1369 CG ARG A 164 3.773 2.433 -16.596 1.00 0.00 C ATOM 1370 CD ARG A 164 4.305 3.488 -17.551 1.00 0.00 C ATOM 1371 NE ARG A 164 5.693 3.838 -17.262 1.00 0.00 N ATOM 1372 CZ ARG A 164 6.713 2.993 -17.387 1.00 0.00 C ATOM 1373 NH1 ARG A 164 6.505 1.747 -17.795 1.00 0.00 N ATOM 1374 NH2 ARG A 164 7.945 3.393 -17.103 1.00 0.00 N ATOM 0 H ARG A 164 3.915 2.965 -12.453 1.00 0.00 H new ATOM 0 HA ARG A 164 5.168 3.785 -14.949 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.611 2.307 -14.804 1.00 0.00 H new ATOM 0 HB3 ARG A 164 2.479 3.843 -15.638 1.00 0.00 H new ATOM 0 HG2 ARG A 164 4.579 1.754 -16.317 1.00 0.00 H new ATOM 0 HG3 ARG A 164 3.013 1.836 -17.099 1.00 0.00 H new ATOM 0 HD2 ARG A 164 4.229 3.121 -18.575 1.00 0.00 H new ATOM 0 HD3 ARG A 164 3.685 4.382 -17.486 1.00 0.00 H new ATOM 0 HE ARG A 164 5.892 4.787 -16.945 1.00 0.00 H new ATOM 0 HH11 ARG A 164 5.560 1.433 -18.014 1.00 0.00 H new ATOM 0 HH12 ARG A 164 7.291 1.103 -17.889 1.00 0.00 H new ATOM 0 HH21 ARG A 164 8.111 4.349 -16.788 1.00 0.00 H new ATOM 0 HH22 ARG A 164 8.727 2.745 -17.199 1.00 0.00 H new ATOM 1388 N ILE A 165 2.875 5.050 -12.945 1.00 0.00 N ATOM 1389 CA ILE A 165 2.358 6.303 -12.402 1.00 0.00 C ATOM 1390 C ILE A 165 2.483 6.353 -10.881 1.00 0.00 C ATOM 1391 O ILE A 165 2.732 7.413 -10.306 1.00 0.00 O ATOM 1392 CB ILE A 165 0.879 6.511 -12.784 1.00 0.00 C ATOM 1393 CG1 ILE A 165 0.671 6.278 -14.284 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.425 7.910 -12.393 1.00 0.00 C ATOM 1395 CD1 ILE A 165 -0.517 5.395 -14.596 1.00 0.00 C ATOM 0 H ILE A 165 2.489 4.211 -12.512 1.00 0.00 H new ATOM 0 HA ILE A 165 2.962 7.100 -12.836 1.00 0.00 H new ATOM 0 HB ILE A 165 0.276 5.785 -12.239 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.539 7.240 -14.779 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.570 5.826 -14.702 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.621 8.043 -12.668 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.536 8.041 -11.317 1.00 0.00 H new ATOM 0 HG23 ILE A 165 1.034 8.649 -12.913 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -0.605 5.272 -15.675 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -0.378 4.420 -14.130 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -1.425 5.856 -14.208 1.00 0.00 H new ATOM 1407 N LEU A 166 2.297 5.208 -10.233 1.00 0.00 N ATOM 1408 CA LEU A 166 2.378 5.129 -8.777 1.00 0.00 C ATOM 1409 C LEU A 166 3.826 5.081 -8.295 1.00 0.00 C ATOM 1410 O LEU A 166 4.307 6.016 -7.653 1.00 0.00 O ATOM 1411 CB LEU A 166 1.622 3.895 -8.275 1.00 0.00 C ATOM 1412 CG LEU A 166 0.490 4.188 -7.288 1.00 0.00 C ATOM 1413 CD1 LEU A 166 -0.481 3.017 -7.223 1.00 0.00 C ATOM 1414 CD2 LEU A 166 1.054 4.495 -5.908 1.00 0.00 C ATOM 0 H LEU A 166 2.089 4.321 -10.692 1.00 0.00 H new ATOM 0 HA LEU A 166 1.919 6.030 -8.370 1.00 0.00 H new ATOM 0 HB2 LEU A 166 1.208 3.367 -9.134 1.00 0.00 H new ATOM 0 HB3 LEU A 166 2.333 3.220 -7.799 1.00 0.00 H new ATOM 0 HG LEU A 166 -0.055 5.064 -7.639 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -1.279 3.245 -6.516 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -0.910 2.844 -8.210 1.00 0.00 H new ATOM 0 HD13 LEU A 166 0.049 2.122 -6.896 1.00 0.00 H new ATOM 0 HD21 LEU A 166 0.236 4.701 -5.218 1.00 0.00 H new ATOM 0 HD22 LEU A 166 1.624 3.638 -5.549 1.00 0.00 H new ATOM 0 HD23 LEU A 166 1.707 5.366 -5.967 1.00 0.00 H new ATOM 1426 N TYR A 167 4.512 3.983 -8.599 1.00 0.00 N ATOM 1427 CA TYR A 167 5.903 3.801 -8.184 1.00 0.00 C ATOM 1428 C TYR A 167 6.750 5.049 -8.449 1.00 0.00 C ATOM 1429 O TYR A 167 7.505 5.484 -7.579 1.00 0.00 O ATOM 1430 CB TYR A 167 6.517 2.596 -8.898 1.00 0.00 C ATOM 1431 CG TYR A 167 7.587 1.900 -8.089 1.00 0.00 C ATOM 1432 CD1 TYR A 167 7.369 1.563 -6.758 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.817 1.584 -8.652 1.00 0.00 C ATOM 1434 CE1 TYR A 167 8.345 0.930 -6.014 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.799 0.952 -7.913 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.558 0.626 -6.595 1.00 0.00 C ATOM 1437 OH TYR A 167 10.533 -0.002 -5.855 1.00 0.00 O ATOM 0 H TYR A 167 4.128 3.203 -9.132 1.00 0.00 H new ATOM 0 HA TYR A 167 5.899 3.625 -7.108 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.728 1.882 -9.134 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.944 2.924 -9.846 1.00 0.00 H new ATOM 0 HD1 TYR A 167 6.421 1.800 -6.298 1.00 0.00 H new ATOM 0 HD2 TYR A 167 9.009 1.836 -9.684 1.00 0.00 H new ATOM 0 HE1 TYR A 167 8.159 0.674 -4.981 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.750 0.715 -8.366 1.00 0.00 H new ATOM 0 HH TYR A 167 11.326 -0.145 -6.413 1.00 0.00 H new ATOM 1447 N PRO A 168 6.649 5.640 -9.652 1.00 0.00 N ATOM 1448 CA PRO A 168 7.424 6.833 -10.009 1.00 0.00 C ATOM 1449 C PRO A 168 7.235 7.972 -9.012 1.00 0.00 C ATOM 1450 O PRO A 168 8.177 8.704 -8.711 1.00 0.00 O ATOM 1451 CB PRO A 168 6.867 7.233 -11.376 1.00 0.00 C ATOM 1452 CG PRO A 168 6.298 5.977 -11.937 1.00 0.00 C ATOM 1453 CD PRO A 168 5.787 5.191 -10.762 1.00 0.00 C ATOM 0 HA PRO A 168 8.495 6.628 -10.012 1.00 0.00 H new ATOM 0 HB2 PRO A 168 6.104 8.005 -11.282 1.00 0.00 H new ATOM 0 HB3 PRO A 168 7.649 7.635 -12.020 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.494 6.193 -12.641 1.00 0.00 H new ATOM 0 HG3 PRO A 168 7.056 5.415 -12.482 1.00 0.00 H new ATOM 0 HD2 PRO A 168 4.736 5.400 -10.565 1.00 0.00 H new ATOM 0 HD3 PRO A 168 5.872 4.117 -10.929 1.00 0.00 H new ATOM 1461 N TYR A 169 6.017 8.116 -8.501 1.00 0.00 N ATOM 1462 CA TYR A 169 5.713 9.172 -7.540 1.00 0.00 C ATOM 1463 C TYR A 169 6.627 9.081 -6.321 1.00 0.00 C ATOM 1464 O TYR A 169 7.273 10.059 -5.945 1.00 0.00 O ATOM 1465 CB TYR A 169 4.251 9.083 -7.101 1.00 0.00 C ATOM 1466 CG TYR A 169 3.838 10.174 -6.139 1.00 0.00 C ATOM 1467 CD1 TYR A 169 4.136 11.506 -6.401 1.00 0.00 C ATOM 1468 CD2 TYR A 169 3.152 9.872 -4.969 1.00 0.00 C ATOM 1469 CE1 TYR A 169 3.760 12.507 -5.523 1.00 0.00 C ATOM 1470 CE2 TYR A 169 2.774 10.867 -4.087 1.00 0.00 C ATOM 1471 CZ TYR A 169 3.080 12.182 -4.369 1.00 0.00 C ATOM 1472 OH TYR A 169 2.704 13.173 -3.493 1.00 0.00 O ATOM 0 H TYR A 169 5.225 7.517 -8.735 1.00 0.00 H new ATOM 0 HA TYR A 169 5.883 10.132 -8.028 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.613 9.128 -7.983 1.00 0.00 H new ATOM 0 HB3 TYR A 169 4.080 8.114 -6.633 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.669 11.764 -7.304 1.00 0.00 H new ATOM 0 HD2 TYR A 169 2.910 8.843 -4.745 1.00 0.00 H new ATOM 0 HE1 TYR A 169 3.998 13.538 -5.741 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.242 10.616 -3.181 1.00 0.00 H new ATOM 0 HH TYR A 169 2.233 12.775 -2.731 1.00 0.00 H new ATOM 1482 N GLU A 170 6.675 7.904 -5.706 1.00 0.00 N ATOM 1483 CA GLU A 170 7.506 7.692 -4.531 1.00 0.00 C ATOM 1484 C GLU A 170 8.972 7.984 -4.836 1.00 0.00 C ATOM 1485 O GLU A 170 9.633 8.723 -4.108 1.00 0.00 O ATOM 1486 CB GLU A 170 7.355 6.256 -4.026 1.00 0.00 C ATOM 1487 CG GLU A 170 5.921 5.873 -3.697 1.00 0.00 C ATOM 1488 CD GLU A 170 5.329 6.730 -2.595 1.00 0.00 C ATOM 1489 OE1 GLU A 170 6.104 7.254 -1.768 1.00 0.00 O ATOM 1490 OE2 GLU A 170 4.089 6.876 -2.558 1.00 0.00 O ATOM 0 H GLU A 170 6.147 7.083 -6.003 1.00 0.00 H new ATOM 0 HA GLU A 170 7.173 8.381 -3.755 1.00 0.00 H new ATOM 0 HB2 GLU A 170 7.740 5.572 -4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 170 7.970 6.127 -3.135 1.00 0.00 H new ATOM 0 HG2 GLU A 170 5.309 5.966 -4.594 1.00 0.00 H new ATOM 0 HG3 GLU A 170 5.888 4.826 -3.396 1.00 0.00 H new ATOM 1497 N LEU A 171 9.475 7.396 -5.918 1.00 0.00 N ATOM 1498 CA LEU A 171 10.858 7.589 -6.321 1.00 0.00 C ATOM 1499 C LEU A 171 11.146 9.058 -6.609 1.00 0.00 C ATOM 1500 O LEU A 171 12.243 9.551 -6.346 1.00 0.00 O ATOM 1501 CB LEU A 171 11.174 6.744 -7.557 1.00 0.00 C ATOM 1502 CG LEU A 171 10.811 5.262 -7.438 1.00 0.00 C ATOM 1503 CD1 LEU A 171 11.075 4.541 -8.751 1.00 0.00 C ATOM 1504 CD2 LEU A 171 11.592 4.613 -6.305 1.00 0.00 C ATOM 0 H LEU A 171 8.940 6.780 -6.531 1.00 0.00 H new ATOM 0 HA LEU A 171 11.495 7.270 -5.496 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.644 7.165 -8.411 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.240 6.825 -7.771 1.00 0.00 H new ATOM 0 HG LEU A 171 9.748 5.184 -7.212 1.00 0.00 H new ATOM 0 HD11 LEU A 171 10.811 3.488 -8.648 1.00 0.00 H new ATOM 0 HD12 LEU A 171 10.472 4.990 -9.540 1.00 0.00 H new ATOM 0 HD13 LEU A 171 12.131 4.627 -9.007 1.00 0.00 H new ATOM 0 HD21 LEU A 171 11.322 3.559 -6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 171 12.660 4.701 -6.502 1.00 0.00 H new ATOM 0 HD23 LEU A 171 11.354 5.113 -5.366 1.00 0.00 H new ATOM 1516 N PHE A 172 10.153 9.755 -7.152 1.00 0.00 N ATOM 1517 CA PHE A 172 10.297 11.168 -7.480 1.00 0.00 C ATOM 1518 C PHE A 172 10.656 11.982 -6.240 1.00 0.00 C ATOM 1519 O PHE A 172 11.454 12.916 -6.307 1.00 0.00 O ATOM 1520 CB PHE A 172 9.003 11.699 -8.097 1.00 0.00 C ATOM 1521 CG PHE A 172 9.217 12.819 -9.075 1.00 0.00 C ATOM 1522 CD1 PHE A 172 9.803 14.007 -8.671 1.00 0.00 C ATOM 1523 CD2 PHE A 172 8.831 12.682 -10.398 1.00 0.00 C ATOM 1524 CE1 PHE A 172 10.001 15.038 -9.570 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.026 13.709 -11.302 1.00 0.00 C ATOM 1526 CZ PHE A 172 9.611 14.888 -10.888 1.00 0.00 C ATOM 0 H PHE A 172 9.238 9.363 -7.374 1.00 0.00 H new ATOM 0 HA PHE A 172 11.107 11.269 -8.203 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.489 10.881 -8.601 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.346 12.045 -7.299 1.00 0.00 H new ATOM 0 HD1 PHE A 172 10.109 14.129 -7.642 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.372 11.761 -10.727 1.00 0.00 H new ATOM 0 HE1 PHE A 172 10.460 15.960 -9.243 1.00 0.00 H new ATOM 0 HE2 PHE A 172 8.721 13.589 -12.331 1.00 0.00 H new ATOM 0 HZ PHE A 172 9.764 15.692 -11.592 1.00 0.00 H new ATOM 1536 N GLN A 173 10.058 11.621 -5.109 1.00 0.00 N ATOM 1537 CA GLN A 173 10.313 12.317 -3.853 1.00 0.00 C ATOM 1538 C GLN A 173 11.553 11.763 -3.162 1.00 0.00 C ATOM 1539 O GLN A 173 12.367 12.517 -2.629 1.00 0.00 O ATOM 1540 CB GLN A 173 9.101 12.200 -2.928 1.00 0.00 C ATOM 1541 CG GLN A 173 7.808 12.693 -3.556 1.00 0.00 C ATOM 1542 CD GLN A 173 6.578 12.080 -2.913 1.00 0.00 C ATOM 1543 OE1 GLN A 173 6.166 12.482 -1.825 1.00 0.00 O ATOM 1544 NE2 GLN A 173 5.984 11.102 -3.587 1.00 0.00 N ATOM 0 H GLN A 173 9.394 10.851 -5.037 1.00 0.00 H new ATOM 0 HA GLN A 173 10.489 13.369 -4.079 1.00 0.00 H new ATOM 0 HB2 GLN A 173 8.978 11.158 -2.634 1.00 0.00 H new ATOM 0 HB3 GLN A 173 9.293 12.768 -2.018 1.00 0.00 H new ATOM 0 HG2 GLN A 173 7.757 13.778 -3.469 1.00 0.00 H new ATOM 0 HG3 GLN A 173 7.812 12.458 -4.620 1.00 0.00 H new ATOM 0 HE21 GLN A 173 6.360 10.801 -4.486 1.00 0.00 H new ATOM 0 HE22 GLN A 173 5.152 10.652 -3.206 1.00 0.00 H new ATOM 1553 N SER A 174 11.691 10.441 -3.172 1.00 0.00 N ATOM 1554 CA SER A 174 12.832 9.789 -2.544 1.00 0.00 C ATOM 1555 C SER A 174 13.905 9.451 -3.574 1.00 0.00 C ATOM 1556 O SER A 174 14.634 8.470 -3.429 1.00 0.00 O ATOM 1557 CB SER A 174 12.386 8.516 -1.820 1.00 0.00 C ATOM 1558 OG SER A 174 11.449 8.811 -0.799 1.00 0.00 O ATOM 0 H SER A 174 11.027 9.802 -3.608 1.00 0.00 H new ATOM 0 HA SER A 174 13.257 10.482 -1.818 1.00 0.00 H new ATOM 0 HB2 SER A 174 11.943 7.823 -2.536 1.00 0.00 H new ATOM 0 HB3 SER A 174 13.253 8.017 -1.388 1.00 0.00 H new ATOM 0 HG SER A 174 11.179 7.981 -0.353 1.00 0.00 H new ATOM 1564 N GLY A 175 13.995 10.271 -4.615 1.00 0.00 N ATOM 1565 CA GLY A 175 14.981 10.045 -5.655 1.00 0.00 C ATOM 1566 C GLY A 175 15.851 11.263 -5.905 1.00 0.00 C ATOM 1567 O GLY A 175 15.979 12.098 -4.985 1.00 0.00 O ATOM 1568 OXT GLY A 175 16.404 11.379 -7.017 1.00 0.00 O ATOM 0 H GLY A 175 13.402 11.089 -4.757 1.00 0.00 H new ATOM 0 HA2 GLY A 175 15.613 9.202 -5.375 1.00 0.00 H new ATOM 0 HA3 GLY A 175 14.473 9.769 -6.579 1.00 0.00 H new