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 57:sc= 0.161 USER MOD Set 1.2: A 162 TYR OH : rot 180:sc= -0.615 USER MOD Single : A 93 GLN : amide:sc= -0.294 X(o=-0.29,f=-0.038) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -3.77 K(o=-3.8,f=-2.5!) 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+ 180:sc= 0 (180deg=0) 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 -31:sc= 1.18 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 180:sc= 0.551 USER MOD Single : A 135 LYS NZ :NH3+ -111:sc= -0.0103 (180deg=-0.0232) USER MOD Single : A 137 LYS NZ :NH3+ 156:sc= -0.237 (180deg=-0.885) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0.00679 USER MOD Single : A 141 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0792) USER MOD Single : A 144 SER OG : rot 79:sc= 0.85 USER MOD Single : A 148 TYR OH : rot 162:sc= -2.02 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 SER OG : rot 67:sc= 0.39 USER MOD Single : A 161 HIS : no HD1:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 167 TYR OH : rot 180:sc= -1.14 USER MOD Single : A 169 TYR OH : rot 15:sc= -0.0929 USER MOD Single : A 173 GLN : amide:sc= -1.01 K(o=-1,f=-0.46) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N VAL A 86 -8.413 9.786 2.988 1.00 0.00 N ATOM 86 CA VAL A 86 -6.962 9.692 2.907 1.00 0.00 C ATOM 87 C VAL A 86 -6.516 9.218 1.528 1.00 0.00 C ATOM 88 O VAL A 86 -5.505 9.678 0.999 1.00 0.00 O ATOM 89 CB VAL A 86 -6.401 8.733 3.973 1.00 0.00 C ATOM 90 CG1 VAL A 86 -6.634 9.290 5.369 1.00 0.00 C ATOM 91 CG2 VAL A 86 -7.026 7.354 3.830 1.00 0.00 C ATOM 0 HA VAL A 86 -6.571 10.693 3.087 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.326 8.638 3.821 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.231 8.598 6.109 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -6.135 10.254 5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.704 9.417 5.536 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.618 6.689 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.106 7.429 3.955 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.802 6.954 2.841 1.00 0.00 H new ATOM 101 N ARG A 87 -7.278 8.294 0.952 1.00 0.00 N ATOM 102 CA ARG A 87 -6.962 7.756 -0.366 1.00 0.00 C ATOM 103 C ARG A 87 -7.108 8.828 -1.441 1.00 0.00 C ATOM 104 O ARG A 87 -6.222 9.009 -2.275 1.00 0.00 O ATOM 105 CB ARG A 87 -7.872 6.569 -0.686 1.00 0.00 C ATOM 106 CG ARG A 87 -7.466 5.813 -1.940 1.00 0.00 C ATOM 107 CD ARG A 87 -8.678 5.291 -2.695 1.00 0.00 C ATOM 108 NE ARG A 87 -8.310 4.697 -3.978 1.00 0.00 N ATOM 109 CZ ARG A 87 -9.096 3.872 -4.665 1.00 0.00 C ATOM 110 NH1 ARG A 87 -10.294 3.541 -4.197 1.00 0.00 N ATOM 111 NH2 ARG A 87 -8.685 3.376 -5.824 1.00 0.00 N ATOM 0 H ARG A 87 -8.118 7.902 1.377 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.926 7.418 -0.354 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -7.869 5.881 0.160 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.895 6.927 -0.803 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.887 6.469 -2.590 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.818 4.979 -1.669 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -9.192 4.548 -2.086 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -9.380 6.108 -2.862 1.00 0.00 H new ATOM 0 HE ARG A 87 -7.397 4.928 -4.370 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.616 3.920 -3.306 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -10.892 2.908 -4.728 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -7.766 3.627 -6.189 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -9.288 2.744 -6.351 1.00 0.00 H new ATOM 125 N LEU A 88 -8.233 9.537 -1.414 1.00 0.00 N ATOM 126 CA LEU A 88 -8.495 10.591 -2.388 1.00 0.00 C ATOM 127 C LEU A 88 -7.422 11.673 -2.316 1.00 0.00 C ATOM 128 O LEU A 88 -6.955 12.167 -3.344 1.00 0.00 O ATOM 129 CB LEU A 88 -9.874 11.205 -2.144 1.00 0.00 C ATOM 130 CG LEU A 88 -10.663 11.551 -3.410 1.00 0.00 C ATOM 131 CD1 LEU A 88 -12.153 11.363 -3.178 1.00 0.00 C ATOM 132 CD2 LEU A 88 -10.365 12.977 -3.847 1.00 0.00 C ATOM 0 H LEU A 88 -8.977 9.401 -0.729 1.00 0.00 H new ATOM 0 HA LEU A 88 -8.473 10.149 -3.384 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.463 10.510 -1.546 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.751 12.112 -1.552 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.353 10.874 -4.206 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.697 11.614 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -12.351 10.325 -2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -12.480 12.015 -2.368 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -10.933 13.208 -4.748 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.648 13.668 -3.053 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -9.300 13.079 -4.054 1.00 0.00 H new ATOM 144 N ASP A 89 -7.037 12.041 -1.099 1.00 0.00 N ATOM 145 CA ASP A 89 -6.026 13.065 -0.892 1.00 0.00 C ATOM 146 C ASP A 89 -4.717 12.688 -1.578 1.00 0.00 C ATOM 147 O ASP A 89 -4.032 13.542 -2.144 1.00 0.00 O ATOM 148 CB ASP A 89 -5.787 13.279 0.605 1.00 0.00 C ATOM 149 CG ASP A 89 -6.885 14.097 1.255 1.00 0.00 C ATOM 150 OD1 ASP A 89 -8.059 13.932 0.861 1.00 0.00 O ATOM 151 OD2 ASP A 89 -6.572 14.902 2.156 1.00 0.00 O ATOM 0 H ASP A 89 -7.413 11.642 -0.239 1.00 0.00 H new ATOM 0 HA ASP A 89 -6.391 13.993 -1.333 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.717 12.311 1.101 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.830 13.781 0.749 1.00 0.00 H new ATOM 156 N PHE A 90 -4.374 11.405 -1.526 1.00 0.00 N ATOM 157 CA PHE A 90 -3.146 10.916 -2.144 1.00 0.00 C ATOM 158 C PHE A 90 -3.151 11.176 -3.646 1.00 0.00 C ATOM 159 O PHE A 90 -2.140 11.581 -4.220 1.00 0.00 O ATOM 160 CB PHE A 90 -2.975 9.420 -1.874 1.00 0.00 C ATOM 161 CG PHE A 90 -1.681 8.861 -2.391 1.00 0.00 C ATOM 162 CD1 PHE A 90 -1.567 8.448 -3.709 1.00 0.00 C ATOM 163 CD2 PHE A 90 -0.578 8.750 -1.560 1.00 0.00 C ATOM 164 CE1 PHE A 90 -0.378 7.933 -4.188 1.00 0.00 C ATOM 165 CE2 PHE A 90 0.615 8.238 -2.034 1.00 0.00 C ATOM 166 CZ PHE A 90 0.716 7.827 -3.349 1.00 0.00 C ATOM 0 H PHE A 90 -4.929 10.685 -1.063 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.308 11.456 -1.703 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.034 9.244 -0.800 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.804 8.879 -2.332 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.418 8.530 -4.369 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.651 9.067 -0.530 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.303 7.613 -5.217 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.468 8.159 -1.376 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.647 7.424 -3.721 1.00 0.00 H new ATOM 176 N LEU A 91 -4.298 10.942 -4.278 1.00 0.00 N ATOM 177 CA LEU A 91 -4.432 11.152 -5.715 1.00 0.00 C ATOM 178 C LEU A 91 -4.289 12.630 -6.062 1.00 0.00 C ATOM 179 O LEU A 91 -3.779 12.980 -7.127 1.00 0.00 O ATOM 180 CB LEU A 91 -5.786 10.630 -6.202 1.00 0.00 C ATOM 181 CG LEU A 91 -5.844 9.118 -6.444 1.00 0.00 C ATOM 182 CD1 LEU A 91 -6.636 8.429 -5.341 1.00 0.00 C ATOM 183 CD2 LEU A 91 -6.453 8.814 -7.805 1.00 0.00 C ATOM 0 H LEU A 91 -5.145 10.608 -3.819 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.636 10.601 -6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.547 10.895 -5.468 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.045 11.142 -7.129 1.00 0.00 H new ATOM 0 HG LEU A 91 -4.825 8.732 -6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -6.666 7.356 -5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -6.158 8.614 -4.379 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.652 8.823 -5.323 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -6.485 7.735 -7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -7.465 9.217 -7.849 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.846 9.272 -8.586 1.00 0.00 H new ATOM 195 N ASP A 92 -4.742 13.493 -5.160 1.00 0.00 N ATOM 196 CA ASP A 92 -4.662 14.933 -5.371 1.00 0.00 C ATOM 197 C ASP A 92 -3.211 15.381 -5.518 1.00 0.00 C ATOM 198 O ASP A 92 -2.884 16.184 -6.392 1.00 0.00 O ATOM 199 CB ASP A 92 -5.322 15.679 -4.210 1.00 0.00 C ATOM 200 CG ASP A 92 -5.709 17.097 -4.578 1.00 0.00 C ATOM 201 OD1 ASP A 92 -6.002 17.342 -5.768 1.00 0.00 O ATOM 202 OD2 ASP A 92 -5.719 17.963 -3.678 1.00 0.00 O ATOM 0 H ASP A 92 -5.169 13.220 -4.275 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.193 15.169 -6.293 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.210 15.134 -3.890 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.639 15.701 -3.361 1.00 0.00 H new ATOM 207 N GLN A 93 -2.346 14.854 -4.659 1.00 0.00 N ATOM 208 CA GLN A 93 -0.929 15.197 -4.692 1.00 0.00 C ATOM 209 C GLN A 93 -0.267 14.644 -5.951 1.00 0.00 C ATOM 210 O GLN A 93 0.464 15.351 -6.644 1.00 0.00 O ATOM 211 CB GLN A 93 -0.220 14.655 -3.449 1.00 0.00 C ATOM 212 CG GLN A 93 -0.994 14.873 -2.159 1.00 0.00 C ATOM 213 CD GLN A 93 -1.461 16.306 -1.991 1.00 0.00 C ATOM 214 OE1 GLN A 93 -0.662 17.241 -2.041 1.00 0.00 O ATOM 215 NE2 GLN A 93 -2.762 16.486 -1.792 1.00 0.00 N ATOM 0 H GLN A 93 -2.601 14.187 -3.931 1.00 0.00 H new ATOM 0 HA GLN A 93 -0.844 16.284 -4.703 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -0.042 13.588 -3.580 1.00 0.00 H new ATOM 0 HB3 GLN A 93 0.756 15.132 -3.362 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -1.858 14.209 -2.142 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -0.365 14.599 -1.312 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -3.389 15.682 -1.758 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -3.134 17.428 -1.674 1.00 0.00 H new ATOM 224 N LEU A 94 -0.532 13.373 -6.239 1.00 0.00 N ATOM 225 CA LEU A 94 0.034 12.722 -7.414 1.00 0.00 C ATOM 226 C LEU A 94 -0.444 13.398 -8.695 1.00 0.00 C ATOM 227 O LEU A 94 0.318 13.552 -9.650 1.00 0.00 O ATOM 228 CB LEU A 94 -0.348 11.240 -7.431 1.00 0.00 C ATOM 229 CG LEU A 94 0.492 10.365 -8.364 1.00 0.00 C ATOM 230 CD1 LEU A 94 0.711 8.990 -7.752 1.00 0.00 C ATOM 231 CD2 LEU A 94 -0.176 10.246 -9.725 1.00 0.00 C ATOM 0 H LEU A 94 -1.135 12.774 -5.675 1.00 0.00 H new ATOM 0 HA LEU A 94 1.119 12.812 -7.363 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.265 10.848 -6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.395 11.154 -7.722 1.00 0.00 H new ATOM 0 HG LEU A 94 1.465 10.838 -8.499 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.310 8.382 -8.429 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.232 9.094 -6.800 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.252 8.508 -7.587 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.434 9.621 -10.376 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.162 9.795 -9.608 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.280 11.237 -10.167 1.00 0.00 H new ATOM 243 N ALA A 95 -1.712 13.794 -8.711 1.00 0.00 N ATOM 244 CA ALA A 95 -2.295 14.449 -9.875 1.00 0.00 C ATOM 245 C ALA A 95 -1.722 15.849 -10.072 1.00 0.00 C ATOM 246 O ALA A 95 -1.362 16.231 -11.184 1.00 0.00 O ATOM 247 CB ALA A 95 -3.810 14.512 -9.739 1.00 0.00 C ATOM 0 H ALA A 95 -2.356 13.672 -7.930 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.041 13.858 -10.755 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.234 15.004 -10.615 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.211 13.501 -9.661 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.072 15.076 -8.844 1.00 0.00 H new ATOM 253 N LYS A 96 -1.647 16.611 -8.985 1.00 0.00 N ATOM 254 CA LYS A 96 -1.121 17.971 -9.044 1.00 0.00 C ATOM 255 C LYS A 96 0.386 17.970 -9.279 1.00 0.00 C ATOM 256 O LYS A 96 0.916 18.845 -9.966 1.00 0.00 O ATOM 257 CB LYS A 96 -1.447 18.721 -7.749 1.00 0.00 C ATOM 258 CG LYS A 96 -2.936 18.906 -7.513 1.00 0.00 C ATOM 259 CD LYS A 96 -3.527 19.940 -8.460 1.00 0.00 C ATOM 260 CE LYS A 96 -3.631 21.307 -7.800 1.00 0.00 C ATOM 261 NZ LYS A 96 -2.644 22.271 -8.360 1.00 0.00 N ATOM 0 H LYS A 96 -1.943 16.311 -8.056 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.597 18.479 -9.883 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.019 18.178 -6.907 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -0.967 19.699 -7.775 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.448 17.953 -7.648 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.106 19.216 -6.482 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -2.907 20.013 -9.354 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -4.516 19.615 -8.784 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -4.639 21.700 -7.935 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -3.470 21.205 -6.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -2.748 23.190 -7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -1.681 21.909 -8.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -2.813 22.388 -9.379 1.00 0.00 H new ATOM 275 N PHE A 97 1.073 16.989 -8.705 1.00 0.00 N ATOM 276 CA PHE A 97 2.520 16.884 -8.856 1.00 0.00 C ATOM 277 C PHE A 97 2.901 16.560 -10.297 1.00 0.00 C ATOM 278 O PHE A 97 3.767 17.214 -10.881 1.00 0.00 O ATOM 279 CB PHE A 97 3.077 15.811 -7.919 1.00 0.00 C ATOM 280 CG PHE A 97 4.573 15.837 -7.801 1.00 0.00 C ATOM 281 CD1 PHE A 97 5.371 15.388 -8.842 1.00 0.00 C ATOM 282 CD2 PHE A 97 5.183 16.313 -6.650 1.00 0.00 C ATOM 283 CE1 PHE A 97 6.749 15.414 -8.737 1.00 0.00 C ATOM 284 CE2 PHE A 97 6.562 16.340 -6.540 1.00 0.00 C ATOM 285 CZ PHE A 97 7.345 15.889 -7.584 1.00 0.00 C ATOM 0 H PHE A 97 0.653 16.257 -8.132 1.00 0.00 H new ATOM 0 HA PHE A 97 2.953 17.849 -8.594 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.640 15.942 -6.929 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.766 14.830 -8.277 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.911 15.014 -9.745 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.575 16.667 -5.830 1.00 0.00 H new ATOM 0 HE1 PHE A 97 7.360 15.063 -9.556 1.00 0.00 H new ATOM 0 HE2 PHE A 97 7.025 16.713 -5.639 1.00 0.00 H new ATOM 0 HZ PHE A 97 8.422 15.907 -7.500 1.00 0.00 H new ATOM 295 N TRP A 98 2.251 15.553 -10.869 1.00 0.00 N ATOM 296 CA TRP A 98 2.525 15.148 -12.243 1.00 0.00 C ATOM 297 C TRP A 98 2.118 16.240 -13.226 1.00 0.00 C ATOM 298 O TRP A 98 2.776 16.448 -14.245 1.00 0.00 O ATOM 299 CB TRP A 98 1.797 13.845 -12.574 1.00 0.00 C ATOM 300 CG TRP A 98 2.610 12.622 -12.274 1.00 0.00 C ATOM 301 CD1 TRP A 98 2.399 11.721 -11.270 1.00 0.00 C ATOM 302 CD2 TRP A 98 3.767 12.167 -12.986 1.00 0.00 C ATOM 303 NE1 TRP A 98 3.353 10.733 -11.314 1.00 0.00 N ATOM 304 CE2 TRP A 98 4.203 10.985 -12.359 1.00 0.00 C ATOM 305 CE3 TRP A 98 4.474 12.644 -14.093 1.00 0.00 C ATOM 306 CZ2 TRP A 98 5.316 10.274 -12.803 1.00 0.00 C ATOM 307 CZ3 TRP A 98 5.578 11.938 -14.533 1.00 0.00 C ATOM 308 CH2 TRP A 98 5.988 10.763 -13.890 1.00 0.00 C ATOM 0 H TRP A 98 1.530 15.002 -10.403 1.00 0.00 H new ATOM 0 HA TRP A 98 3.599 14.985 -12.336 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.866 13.803 -12.008 1.00 0.00 H new ATOM 0 HB3 TRP A 98 1.528 13.845 -13.630 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.599 11.777 -10.547 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.418 9.942 -10.674 1.00 0.00 H new ATOM 0 HE3 TRP A 98 4.163 13.548 -14.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 5.637 9.370 -12.307 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 6.133 12.298 -15.386 1.00 0.00 H new ATOM 0 HH2 TRP A 98 6.853 10.232 -14.260 1.00 0.00 H new ATOM 319 N GLU A 99 1.024 16.932 -12.920 1.00 0.00 N ATOM 320 CA GLU A 99 0.531 17.998 -13.779 1.00 0.00 C ATOM 321 C GLU A 99 1.612 19.048 -14.022 1.00 0.00 C ATOM 322 O GLU A 99 1.762 19.550 -15.136 1.00 0.00 O ATOM 323 CB GLU A 99 -0.707 18.653 -13.159 1.00 0.00 C ATOM 324 CG GLU A 99 -1.930 18.615 -14.060 1.00 0.00 C ATOM 325 CD GLU A 99 -2.783 19.862 -13.937 1.00 0.00 C ATOM 326 OE1 GLU A 99 -2.229 20.929 -13.601 1.00 0.00 O ATOM 327 OE2 GLU A 99 -4.005 19.771 -14.177 1.00 0.00 O ATOM 0 H GLU A 99 0.464 16.772 -12.083 1.00 0.00 H new ATOM 0 HA GLU A 99 0.257 17.559 -14.738 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.942 18.151 -12.220 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.476 19.690 -12.917 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.610 18.498 -15.096 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.532 17.741 -13.812 1.00 0.00 H new ATOM 334 N LEU A 100 2.363 19.373 -12.975 1.00 0.00 N ATOM 335 CA LEU A 100 3.432 20.360 -13.079 1.00 0.00 C ATOM 336 C LEU A 100 4.460 19.931 -14.120 1.00 0.00 C ATOM 337 O LEU A 100 5.087 20.769 -14.770 1.00 0.00 O ATOM 338 CB LEU A 100 4.112 20.551 -11.721 1.00 0.00 C ATOM 339 CG LEU A 100 3.370 21.472 -10.750 1.00 0.00 C ATOM 340 CD1 LEU A 100 3.596 21.025 -9.314 1.00 0.00 C ATOM 341 CD2 LEU A 100 3.816 22.914 -10.938 1.00 0.00 C ATOM 0 H LEU A 100 2.251 18.968 -12.046 1.00 0.00 H new ATOM 0 HA LEU A 100 2.994 21.307 -13.392 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.233 19.575 -11.252 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.112 20.952 -11.886 1.00 0.00 H new ATOM 0 HG LEU A 100 2.303 21.412 -10.964 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.061 21.691 -8.637 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.228 20.007 -9.188 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.662 21.056 -9.087 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.278 23.555 -10.240 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.887 22.991 -10.750 1.00 0.00 H new ATOM 0 HD23 LEU A 100 3.603 23.231 -11.959 1.00 0.00 H new ATOM 353 N GLN A 101 4.626 18.623 -14.274 1.00 0.00 N ATOM 354 CA GLN A 101 5.577 18.079 -15.238 1.00 0.00 C ATOM 355 C GLN A 101 5.028 18.187 -16.656 1.00 0.00 C ATOM 356 O GLN A 101 5.740 18.577 -17.581 1.00 0.00 O ATOM 357 CB GLN A 101 5.880 16.616 -14.912 1.00 0.00 C ATOM 358 CG GLN A 101 6.881 16.438 -13.782 1.00 0.00 C ATOM 359 CD GLN A 101 6.370 16.978 -12.460 1.00 0.00 C ATOM 360 OE1 GLN A 101 5.933 16.218 -11.595 1.00 0.00 O ATOM 361 NE2 GLN A 101 6.425 18.293 -12.296 1.00 0.00 N ATOM 0 H GLN A 101 4.114 17.918 -13.744 1.00 0.00 H new ATOM 0 HA GLN A 101 6.497 18.659 -15.174 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.951 16.112 -14.646 1.00 0.00 H new ATOM 0 HB3 GLN A 101 6.264 16.125 -15.806 1.00 0.00 H new ATOM 0 HG2 GLN A 101 7.115 15.379 -13.672 1.00 0.00 H new ATOM 0 HG3 GLN A 101 7.811 16.944 -14.042 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.795 18.885 -13.040 1.00 0.00 H new ATOM 0 HE22 GLN A 101 6.097 18.713 -11.426 1.00 0.00 H new ATOM 370 N GLY A 102 3.757 17.838 -16.818 1.00 0.00 N ATOM 371 CA GLY A 102 3.130 17.898 -18.124 1.00 0.00 C ATOM 372 C GLY A 102 2.102 16.800 -18.332 1.00 0.00 C ATOM 373 O GLY A 102 1.290 16.871 -19.254 1.00 0.00 O ATOM 0 H GLY A 102 3.149 17.514 -16.066 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.649 18.868 -18.247 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.897 17.822 -18.895 1.00 0.00 H new ATOM 377 N SER A 103 2.137 15.783 -17.476 1.00 0.00 N ATOM 378 CA SER A 103 1.202 14.669 -17.573 1.00 0.00 C ATOM 379 C SER A 103 -0.002 14.891 -16.661 1.00 0.00 C ATOM 380 O SER A 103 -0.266 16.014 -16.231 1.00 0.00 O ATOM 381 CB SER A 103 1.907 13.358 -17.214 1.00 0.00 C ATOM 382 OG SER A 103 1.487 12.305 -18.062 1.00 0.00 O ATOM 0 H SER A 103 2.803 15.708 -16.707 1.00 0.00 H new ATOM 0 HA SER A 103 0.844 14.608 -18.601 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.986 13.487 -17.297 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.695 13.100 -16.176 1.00 0.00 H new ATOM 0 HG SER A 103 1.953 11.479 -17.814 1.00 0.00 H new ATOM 388 N THR A 104 -0.728 13.817 -16.367 1.00 0.00 N ATOM 389 CA THR A 104 -1.901 13.902 -15.506 1.00 0.00 C ATOM 390 C THR A 104 -2.190 12.555 -14.850 1.00 0.00 C ATOM 391 O THR A 104 -2.049 11.505 -15.476 1.00 0.00 O ATOM 392 CB THR A 104 -3.119 14.366 -16.309 1.00 0.00 C ATOM 393 OG1 THR A 104 -2.936 14.110 -17.689 1.00 0.00 O ATOM 394 CG2 THR A 104 -3.411 15.842 -16.150 1.00 0.00 C ATOM 0 H THR A 104 -0.525 12.879 -16.712 1.00 0.00 H new ATOM 0 HA THR A 104 -1.695 14.631 -14.723 1.00 0.00 H new ATOM 0 HB THR A 104 -3.962 13.800 -15.911 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.725 14.412 -18.185 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.286 16.106 -16.744 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.605 16.063 -15.101 1.00 0.00 H new ATOM 0 HG23 THR A 104 -2.553 16.421 -16.490 1.00 0.00 H new ATOM 402 N LEU A 105 -2.596 12.594 -13.586 1.00 0.00 N ATOM 403 CA LEU A 105 -2.907 11.378 -12.845 1.00 0.00 C ATOM 404 C LEU A 105 -4.084 10.642 -13.486 1.00 0.00 C ATOM 405 O LEU A 105 -5.161 11.209 -13.665 1.00 0.00 O ATOM 406 CB LEU A 105 -3.215 11.717 -11.382 1.00 0.00 C ATOM 407 CG LEU A 105 -3.973 10.639 -10.599 1.00 0.00 C ATOM 408 CD1 LEU A 105 -3.493 10.589 -9.157 1.00 0.00 C ATOM 409 CD2 LEU A 105 -5.472 10.895 -10.657 1.00 0.00 C ATOM 0 H LEU A 105 -2.717 13.455 -13.053 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.039 10.720 -12.876 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.275 11.920 -10.869 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.798 12.638 -11.356 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.771 9.672 -11.060 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.043 9.818 -8.617 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.428 10.358 -9.136 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.664 11.556 -8.683 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.995 10.121 -10.096 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.692 11.870 -10.221 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.804 10.878 -11.695 1.00 0.00 H new ATOM 421 N LYS A 106 -3.863 9.377 -13.830 1.00 0.00 N ATOM 422 CA LYS A 106 -4.897 8.559 -14.454 1.00 0.00 C ATOM 423 C LYS A 106 -5.070 7.239 -13.709 1.00 0.00 C ATOM 424 O LYS A 106 -4.093 6.559 -13.397 1.00 0.00 O ATOM 425 CB LYS A 106 -4.546 8.288 -15.919 1.00 0.00 C ATOM 426 CG LYS A 106 -5.737 8.380 -16.856 1.00 0.00 C ATOM 427 CD LYS A 106 -5.335 8.935 -18.214 1.00 0.00 C ATOM 428 CE LYS A 106 -6.143 8.305 -19.339 1.00 0.00 C ATOM 429 NZ LYS A 106 -6.908 9.326 -20.110 1.00 0.00 N ATOM 0 H LYS A 106 -2.975 8.896 -13.687 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.837 9.108 -14.407 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.786 9.001 -16.240 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.106 7.294 -16.001 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -6.180 7.392 -16.982 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.502 9.018 -16.413 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -5.479 10.015 -18.223 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -4.273 8.753 -18.382 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.473 7.769 -20.011 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.833 7.571 -18.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -7.446 8.858 -20.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -7.565 9.821 -19.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.248 10.012 -20.528 1.00 0.00 H new ATOM 443 N ILE A 107 -6.319 6.884 -13.423 1.00 0.00 N ATOM 444 CA ILE A 107 -6.619 5.646 -12.713 1.00 0.00 C ATOM 445 C ILE A 107 -7.381 4.667 -13.606 1.00 0.00 C ATOM 446 O ILE A 107 -8.606 4.572 -13.530 1.00 0.00 O ATOM 447 CB ILE A 107 -7.450 5.907 -11.439 1.00 0.00 C ATOM 448 CG1 ILE A 107 -6.969 7.176 -10.732 1.00 0.00 C ATOM 449 CG2 ILE A 107 -7.372 4.709 -10.504 1.00 0.00 C ATOM 450 CD1 ILE A 107 -7.891 8.360 -10.924 1.00 0.00 C ATOM 0 H ILE A 107 -7.139 7.436 -13.672 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.661 5.211 -12.430 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.491 6.053 -11.728 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.869 6.973 -9.666 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -5.977 7.435 -11.102 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.963 4.907 -9.609 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -7.764 3.827 -11.010 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.334 4.535 -10.222 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -7.488 9.224 -10.396 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.972 8.589 -11.986 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.878 8.121 -10.528 1.00 0.00 H new ATOM 462 N PRO A 108 -6.663 3.922 -14.467 1.00 0.00 N ATOM 463 CA PRO A 108 -7.283 2.949 -15.372 1.00 0.00 C ATOM 464 C PRO A 108 -8.169 1.953 -14.632 1.00 0.00 C ATOM 465 O PRO A 108 -7.913 1.618 -13.475 1.00 0.00 O ATOM 466 CB PRO A 108 -6.087 2.229 -16.003 1.00 0.00 C ATOM 467 CG PRO A 108 -4.959 3.196 -15.891 1.00 0.00 C ATOM 468 CD PRO A 108 -5.199 3.968 -14.624 1.00 0.00 C ATOM 0 HA PRO A 108 -7.937 3.432 -16.098 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -5.864 1.299 -15.480 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -6.285 1.970 -17.043 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -4.002 2.676 -15.856 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.929 3.862 -16.754 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -4.689 3.514 -13.774 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.836 4.993 -14.703 1.00 0.00 H new ATOM 476 N VAL A 109 -9.213 1.481 -15.306 1.00 0.00 N ATOM 477 CA VAL A 109 -10.134 0.521 -14.711 1.00 0.00 C ATOM 478 C VAL A 109 -9.771 -0.906 -15.107 1.00 0.00 C ATOM 479 O VAL A 109 -9.770 -1.251 -16.290 1.00 0.00 O ATOM 480 CB VAL A 109 -11.589 0.804 -15.132 1.00 0.00 C ATOM 481 CG1 VAL A 109 -12.552 -0.078 -14.351 1.00 0.00 C ATOM 482 CG2 VAL A 109 -11.924 2.275 -14.939 1.00 0.00 C ATOM 0 H VAL A 109 -9.442 1.748 -16.264 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.049 0.628 -13.630 1.00 0.00 H new ATOM 0 HB VAL A 109 -11.695 0.568 -16.191 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.575 0.136 -14.662 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -12.325 -1.126 -14.546 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -12.447 0.124 -13.285 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.955 2.456 -15.242 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -11.802 2.541 -13.889 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.255 2.883 -15.548 1.00 0.00 H new ATOM 492 N VAL A 110 -9.460 -1.730 -14.114 1.00 0.00 N ATOM 493 CA VAL A 110 -9.093 -3.119 -14.358 1.00 0.00 C ATOM 494 C VAL A 110 -10.210 -4.066 -13.937 1.00 0.00 C ATOM 495 O VAL A 110 -10.669 -4.032 -12.796 1.00 0.00 O ATOM 496 CB VAL A 110 -7.803 -3.501 -13.606 1.00 0.00 C ATOM 497 CG1 VAL A 110 -7.321 -4.877 -14.037 1.00 0.00 C ATOM 498 CG2 VAL A 110 -6.723 -2.454 -13.832 1.00 0.00 C ATOM 0 H VAL A 110 -9.455 -1.460 -13.131 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.923 -3.215 -15.430 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.023 -3.537 -12.539 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.409 -5.129 -13.495 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.090 -5.617 -13.817 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -7.117 -4.872 -15.108 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.820 -2.741 -13.293 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.503 -2.382 -14.897 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -7.071 -1.488 -13.468 1.00 0.00 H new ATOM 508 N GLU A 111 -10.644 -4.913 -14.865 1.00 0.00 N ATOM 509 CA GLU A 111 -11.709 -5.871 -14.590 1.00 0.00 C ATOM 510 C GLU A 111 -12.992 -5.153 -14.184 1.00 0.00 C ATOM 511 O GLU A 111 -13.724 -5.616 -13.308 1.00 0.00 O ATOM 512 CB GLU A 111 -11.278 -6.838 -13.486 1.00 0.00 C ATOM 513 CG GLU A 111 -9.916 -7.469 -13.727 1.00 0.00 C ATOM 514 CD GLU A 111 -10.005 -8.950 -14.040 1.00 0.00 C ATOM 515 OE1 GLU A 111 -10.276 -9.739 -13.110 1.00 0.00 O ATOM 516 OE2 GLU A 111 -9.803 -9.320 -15.215 1.00 0.00 O ATOM 0 H GLU A 111 -10.274 -4.955 -15.815 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.904 -6.436 -15.502 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.259 -6.306 -12.535 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -12.024 -7.628 -13.395 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.423 -6.956 -14.553 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.292 -7.325 -12.845 1.00 0.00 H new ATOM 523 N ARG A 112 -13.262 -4.022 -14.827 1.00 0.00 N ATOM 524 CA ARG A 112 -14.456 -3.240 -14.533 1.00 0.00 C ATOM 525 C ARG A 112 -14.465 -2.787 -13.077 1.00 0.00 C ATOM 526 O ARG A 112 -15.526 -2.648 -12.466 1.00 0.00 O ATOM 527 CB ARG A 112 -15.713 -4.060 -14.832 1.00 0.00 C ATOM 528 CG ARG A 112 -15.978 -4.247 -16.316 1.00 0.00 C ATOM 529 CD ARG A 112 -16.499 -5.643 -16.620 1.00 0.00 C ATOM 530 NE ARG A 112 -15.948 -6.174 -17.864 1.00 0.00 N ATOM 531 CZ ARG A 112 -14.725 -6.687 -17.974 1.00 0.00 C ATOM 532 NH1 ARG A 112 -13.922 -6.740 -16.918 1.00 0.00 N ATOM 533 NH2 ARG A 112 -14.304 -7.150 -19.143 1.00 0.00 N ATOM 0 H ARG A 112 -12.669 -3.626 -15.556 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.447 -2.355 -15.169 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.618 -5.039 -14.362 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -16.573 -3.570 -14.377 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -16.703 -3.506 -16.653 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -15.059 -4.071 -16.875 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -16.246 -6.311 -15.797 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -17.587 -5.617 -16.687 1.00 0.00 H new ATOM 0 HE ARG A 112 -16.535 -6.150 -18.698 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.241 -6.386 -16.016 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -12.986 -7.134 -17.009 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -14.917 -7.113 -19.957 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.367 -7.543 -19.228 1.00 0.00 H new ATOM 547 N LYS A 113 -13.279 -2.559 -12.527 1.00 0.00 N ATOM 548 CA LYS A 113 -13.148 -2.121 -11.142 1.00 0.00 C ATOM 549 C LYS A 113 -11.938 -1.209 -10.971 1.00 0.00 C ATOM 550 O LYS A 113 -10.903 -1.407 -11.608 1.00 0.00 O ATOM 551 CB LYS A 113 -13.027 -3.330 -10.213 1.00 0.00 C ATOM 552 CG LYS A 113 -14.363 -3.951 -9.846 1.00 0.00 C ATOM 553 CD LYS A 113 -15.052 -3.173 -8.737 1.00 0.00 C ATOM 554 CE LYS A 113 -16.439 -3.725 -8.447 1.00 0.00 C ATOM 555 NZ LYS A 113 -17.397 -2.649 -8.069 1.00 0.00 N ATOM 0 H LYS A 113 -12.393 -2.670 -13.019 1.00 0.00 H new ATOM 0 HA LYS A 113 -14.043 -1.558 -10.879 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -12.404 -4.085 -10.693 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -12.514 -3.026 -9.300 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -15.006 -3.980 -10.726 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -14.211 -4.983 -9.528 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.446 -3.214 -7.832 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -15.129 -2.124 -9.021 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -16.812 -4.251 -9.326 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -16.378 -4.456 -7.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -18.331 -3.066 -7.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -17.055 -2.164 -7.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -17.476 -1.965 -8.848 1.00 0.00 H new ATOM 569 N ILE A 114 -12.074 -0.210 -10.105 1.00 0.00 N ATOM 570 CA ILE A 114 -10.992 0.733 -9.850 1.00 0.00 C ATOM 571 C ILE A 114 -9.945 0.127 -8.922 1.00 0.00 C ATOM 572 O ILE A 114 -10.257 -0.299 -7.810 1.00 0.00 O ATOM 573 CB ILE A 114 -11.518 2.039 -9.224 1.00 0.00 C ATOM 574 CG1 ILE A 114 -12.715 2.566 -10.019 1.00 0.00 C ATOM 575 CG2 ILE A 114 -10.412 3.082 -9.168 1.00 0.00 C ATOM 576 CD1 ILE A 114 -13.516 3.614 -9.278 1.00 0.00 C ATOM 0 H ILE A 114 -12.923 -0.033 -9.568 1.00 0.00 H new ATOM 0 HA ILE A 114 -10.536 0.959 -10.814 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.846 1.830 -8.206 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -12.360 2.989 -10.959 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -13.369 1.732 -10.272 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.799 3.999 -8.723 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.587 2.705 -8.563 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.057 3.290 -10.177 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -14.348 3.943 -9.900 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -13.901 3.189 -8.351 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -12.876 4.466 -9.048 1.00 0.00 H new ATOM 588 N LEU A 115 -8.700 0.090 -9.386 1.00 0.00 N ATOM 589 CA LEU A 115 -7.605 -0.465 -8.598 1.00 0.00 C ATOM 590 C LEU A 115 -7.081 0.562 -7.599 1.00 0.00 C ATOM 591 O LEU A 115 -6.896 1.732 -7.934 1.00 0.00 O ATOM 592 CB LEU A 115 -6.471 -0.927 -9.514 1.00 0.00 C ATOM 593 CG LEU A 115 -5.312 -1.632 -8.807 1.00 0.00 C ATOM 594 CD1 LEU A 115 -5.781 -2.937 -8.184 1.00 0.00 C ATOM 595 CD2 LEU A 115 -4.170 -1.882 -9.779 1.00 0.00 C ATOM 0 H LEU A 115 -8.424 0.438 -10.304 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.987 -1.323 -8.045 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.883 -1.602 -10.264 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.078 -0.060 -10.046 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.949 -0.984 -8.009 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.943 -3.424 -7.686 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -6.566 -2.731 -7.456 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.171 -3.593 -8.963 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.354 -2.384 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.520 -2.510 -10.598 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -3.816 -0.931 -10.177 1.00 0.00 H new ATOM 607 N ASP A 116 -6.842 0.114 -6.370 1.00 0.00 N ATOM 608 CA ASP A 116 -6.338 0.994 -5.322 1.00 0.00 C ATOM 609 C ASP A 116 -4.923 1.465 -5.640 1.00 0.00 C ATOM 610 O ASP A 116 -4.208 0.829 -6.415 1.00 0.00 O ATOM 611 CB ASP A 116 -6.358 0.276 -3.971 1.00 0.00 C ATOM 612 CG ASP A 116 -6.409 1.242 -2.803 1.00 0.00 C ATOM 613 OD1 ASP A 116 -5.437 2.005 -2.622 1.00 0.00 O ATOM 614 OD2 ASP A 116 -7.420 1.235 -2.070 1.00 0.00 O ATOM 0 H ASP A 116 -6.989 -0.852 -6.076 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.989 1.867 -5.271 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.222 -0.387 -3.928 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.470 -0.350 -3.882 1.00 0.00 H new ATOM 619 N LEU A 117 -4.524 2.580 -5.039 1.00 0.00 N ATOM 620 CA LEU A 117 -3.194 3.134 -5.261 1.00 0.00 C ATOM 621 C LEU A 117 -2.363 3.085 -3.985 1.00 0.00 C ATOM 622 O LEU A 117 -1.367 2.365 -3.908 1.00 0.00 O ATOM 623 CB LEU A 117 -3.294 4.575 -5.765 1.00 0.00 C ATOM 624 CG LEU A 117 -4.278 4.794 -6.915 1.00 0.00 C ATOM 625 CD1 LEU A 117 -4.427 6.277 -7.215 1.00 0.00 C ATOM 626 CD2 LEU A 117 -3.823 4.039 -8.154 1.00 0.00 C ATOM 0 H LEU A 117 -5.103 3.118 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.698 2.527 -6.018 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.585 5.215 -4.932 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.305 4.900 -6.087 1.00 0.00 H new ATOM 0 HG LEU A 117 -5.252 4.407 -6.615 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.131 6.413 -8.036 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.799 6.792 -6.329 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.458 6.691 -7.495 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.534 4.205 -8.963 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.839 4.396 -8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.769 2.973 -7.931 1.00 0.00 H new ATOM 638 N TYR A 118 -2.778 3.855 -2.983 1.00 0.00 N ATOM 639 CA TYR A 118 -2.068 3.896 -1.708 1.00 0.00 C ATOM 640 C TYR A 118 -1.948 2.500 -1.108 1.00 0.00 C ATOM 641 O TYR A 118 -0.858 2.066 -0.734 1.00 0.00 O ATOM 642 CB TYR A 118 -2.791 4.825 -0.731 1.00 0.00 C ATOM 643 CG TYR A 118 -1.881 5.425 0.317 1.00 0.00 C ATOM 644 CD1 TYR A 118 -1.110 4.617 1.142 1.00 0.00 C ATOM 645 CD2 TYR A 118 -1.794 6.803 0.482 1.00 0.00 C ATOM 646 CE1 TYR A 118 -0.278 5.161 2.101 1.00 0.00 C ATOM 647 CE2 TYR A 118 -0.963 7.355 1.438 1.00 0.00 C ATOM 648 CZ TYR A 118 -0.208 6.530 2.245 1.00 0.00 C ATOM 649 OH TYR A 118 0.620 7.077 3.198 1.00 0.00 O ATOM 0 H TYR A 118 -3.600 4.457 -3.029 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.064 4.280 -1.889 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.266 5.630 -1.292 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -3.587 4.269 -0.235 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -1.162 3.544 1.032 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -2.385 7.452 -0.147 1.00 0.00 H new ATOM 0 HE1 TYR A 118 0.314 4.517 2.734 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -0.905 8.427 1.553 1.00 0.00 H new ATOM 0 HH TYR A 118 0.553 8.054 3.168 1.00 0.00 H new ATOM 659 N ALA A 119 -3.075 1.800 -1.022 1.00 0.00 N ATOM 660 CA ALA A 119 -3.099 0.456 -0.470 1.00 0.00 C ATOM 661 C ALA A 119 -2.174 -0.474 -1.246 1.00 0.00 C ATOM 662 O ALA A 119 -1.520 -1.343 -0.666 1.00 0.00 O ATOM 663 CB ALA A 119 -4.519 -0.089 -0.470 1.00 0.00 C ATOM 0 H ALA A 119 -3.984 2.145 -1.329 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.740 0.506 0.558 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.522 -1.096 -0.054 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -5.156 0.556 0.135 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -4.898 -0.117 -1.492 1.00 0.00 H new ATOM 669 N LEU A 120 -2.121 -0.288 -2.561 1.00 0.00 N ATOM 670 CA LEU A 120 -1.278 -1.111 -3.420 1.00 0.00 C ATOM 671 C LEU A 120 0.199 -0.893 -3.103 1.00 0.00 C ATOM 672 O LEU A 120 0.955 -1.849 -2.927 1.00 0.00 O ATOM 673 CB LEU A 120 -1.547 -0.794 -4.891 1.00 0.00 C ATOM 674 CG LEU A 120 -0.786 -1.663 -5.893 1.00 0.00 C ATOM 675 CD1 LEU A 120 -1.031 -3.138 -5.613 1.00 0.00 C ATOM 676 CD2 LEU A 120 -1.190 -1.313 -7.317 1.00 0.00 C ATOM 0 H LEU A 120 -2.654 0.428 -3.056 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.522 -2.156 -3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.615 -0.900 -5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.293 0.250 -5.074 1.00 0.00 H new ATOM 0 HG LEU A 120 0.280 -1.466 -5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.482 -3.742 -6.336 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.691 -3.379 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.096 -3.352 -5.697 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -0.639 -1.941 -8.017 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.259 -1.481 -7.444 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.962 -0.265 -7.513 1.00 0.00 H new ATOM 688 N SER A 121 0.603 0.371 -3.031 1.00 0.00 N ATOM 689 CA SER A 121 1.990 0.715 -2.736 1.00 0.00 C ATOM 690 C SER A 121 2.418 0.147 -1.387 1.00 0.00 C ATOM 691 O SER A 121 3.566 -0.254 -1.206 1.00 0.00 O ATOM 692 CB SER A 121 2.172 2.235 -2.745 1.00 0.00 C ATOM 693 OG SER A 121 3.467 2.593 -2.295 1.00 0.00 O ATOM 0 H SER A 121 -0.010 1.174 -3.173 1.00 0.00 H new ATOM 0 HA SER A 121 2.620 0.275 -3.509 1.00 0.00 H new ATOM 0 HB2 SER A 121 2.015 2.618 -3.753 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.420 2.699 -2.107 1.00 0.00 H new ATOM 0 HG SER A 121 4.141 2.151 -2.853 1.00 0.00 H new ATOM 699 N LYS A 122 1.483 0.117 -0.440 1.00 0.00 N ATOM 700 CA LYS A 122 1.764 -0.402 0.893 1.00 0.00 C ATOM 701 C LYS A 122 2.040 -1.902 0.850 1.00 0.00 C ATOM 702 O LYS A 122 2.989 -2.385 1.467 1.00 0.00 O ATOM 703 CB LYS A 122 0.591 -0.114 1.832 1.00 0.00 C ATOM 704 CG LYS A 122 0.481 1.348 2.235 1.00 0.00 C ATOM 705 CD LYS A 122 0.048 1.497 3.687 1.00 0.00 C ATOM 706 CE LYS A 122 0.926 2.491 4.431 1.00 0.00 C ATOM 707 NZ LYS A 122 1.211 2.047 5.824 1.00 0.00 N ATOM 0 H LYS A 122 0.527 0.446 -0.572 1.00 0.00 H new ATOM 0 HA LYS A 122 2.655 0.100 1.269 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.336 -0.420 1.347 1.00 0.00 H new ATOM 0 HB3 LYS A 122 0.697 -0.723 2.730 1.00 0.00 H new ATOM 0 HG2 LYS A 122 1.443 1.840 2.089 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.236 1.852 1.587 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -0.990 1.827 3.726 1.00 0.00 H new ATOM 0 HD3 LYS A 122 0.094 0.527 4.183 1.00 0.00 H new ATOM 0 HE2 LYS A 122 1.865 2.621 3.892 1.00 0.00 H new ATOM 0 HE3 LYS A 122 0.434 3.464 4.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 1.812 2.752 6.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 0.317 1.948 6.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 1.703 1.131 5.803 1.00 0.00 H new ATOM 721 N ILE A 123 1.204 -2.632 0.121 1.00 0.00 N ATOM 722 CA ILE A 123 1.353 -4.074 0.001 1.00 0.00 C ATOM 723 C ILE A 123 2.715 -4.441 -0.580 1.00 0.00 C ATOM 724 O ILE A 123 3.339 -5.414 -0.157 1.00 0.00 O ATOM 725 CB ILE A 123 0.245 -4.684 -0.882 1.00 0.00 C ATOM 726 CG1 ILE A 123 -1.134 -4.271 -0.366 1.00 0.00 C ATOM 727 CG2 ILE A 123 0.369 -6.201 -0.919 1.00 0.00 C ATOM 728 CD1 ILE A 123 -2.149 -4.051 -1.467 1.00 0.00 C ATOM 0 H ILE A 123 0.414 -2.246 -0.397 1.00 0.00 H new ATOM 0 HA ILE A 123 1.270 -4.485 1.007 1.00 0.00 H new ATOM 0 HB ILE A 123 0.362 -4.305 -1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.505 -5.040 0.311 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.036 -3.354 0.216 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.420 -6.615 -1.546 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.341 -6.477 -1.329 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.276 -6.598 0.092 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.104 -3.760 -1.029 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.799 -3.261 -2.132 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.276 -4.973 -2.035 1.00 0.00 H new ATOM 740 N VAL A 124 3.169 -3.658 -1.555 1.00 0.00 N ATOM 741 CA VAL A 124 4.456 -3.905 -2.193 1.00 0.00 C ATOM 742 C VAL A 124 5.594 -3.838 -1.180 1.00 0.00 C ATOM 743 O VAL A 124 6.430 -4.739 -1.110 1.00 0.00 O ATOM 744 CB VAL A 124 4.727 -2.890 -3.323 1.00 0.00 C ATOM 745 CG1 VAL A 124 5.999 -3.253 -4.075 1.00 0.00 C ATOM 746 CG2 VAL A 124 3.540 -2.816 -4.271 1.00 0.00 C ATOM 0 H VAL A 124 2.665 -2.849 -1.919 1.00 0.00 H new ATOM 0 HA VAL A 124 4.411 -4.908 -2.618 1.00 0.00 H new ATOM 0 HB VAL A 124 4.866 -1.906 -2.876 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.173 -2.526 -4.868 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.843 -3.247 -3.386 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.893 -4.246 -4.511 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.750 -2.095 -5.061 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.365 -3.797 -4.712 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.653 -2.503 -3.720 1.00 0.00 H new ATOM 756 N ALA A 125 5.622 -2.763 -0.397 1.00 0.00 N ATOM 757 CA ALA A 125 6.654 -2.577 0.610 1.00 0.00 C ATOM 758 C ALA A 125 6.690 -3.747 1.588 1.00 0.00 C ATOM 759 O ALA A 125 7.758 -4.254 1.927 1.00 0.00 O ATOM 760 CB ALA A 125 6.433 -1.270 1.357 1.00 0.00 C ATOM 0 H ALA A 125 4.938 -2.007 -0.443 1.00 0.00 H new ATOM 0 HA ALA A 125 7.617 -2.535 0.101 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.213 -1.144 2.108 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.469 -0.438 0.653 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.459 -1.290 1.846 1.00 0.00 H new ATOM 766 N SER A 126 5.512 -4.168 2.039 1.00 0.00 N ATOM 767 CA SER A 126 5.399 -5.272 2.978 1.00 0.00 C ATOM 768 C SER A 126 6.055 -6.539 2.432 1.00 0.00 C ATOM 769 O SER A 126 6.418 -7.436 3.192 1.00 0.00 O ATOM 770 CB SER A 126 3.928 -5.545 3.299 1.00 0.00 C ATOM 771 OG SER A 126 3.286 -6.205 2.224 1.00 0.00 O ATOM 0 H SER A 126 4.620 -3.757 1.766 1.00 0.00 H new ATOM 0 HA SER A 126 5.922 -4.986 3.891 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.856 -6.155 4.199 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.418 -4.605 3.509 1.00 0.00 H new ATOM 0 HG SER A 126 3.699 -5.932 1.379 1.00 0.00 H new ATOM 777 N LYS A 127 6.203 -6.608 1.112 1.00 0.00 N ATOM 778 CA LYS A 127 6.813 -7.768 0.472 1.00 0.00 C ATOM 779 C LYS A 127 8.330 -7.625 0.431 1.00 0.00 C ATOM 780 O LYS A 127 9.060 -8.616 0.489 1.00 0.00 O ATOM 781 CB LYS A 127 6.266 -7.943 -0.945 1.00 0.00 C ATOM 782 CG LYS A 127 4.770 -8.206 -0.993 1.00 0.00 C ATOM 783 CD LYS A 127 4.424 -9.568 -0.415 1.00 0.00 C ATOM 784 CE LYS A 127 2.927 -9.717 -0.197 1.00 0.00 C ATOM 785 NZ LYS A 127 2.618 -10.438 1.069 1.00 0.00 N ATOM 0 H LYS A 127 5.909 -5.875 0.466 1.00 0.00 H new ATOM 0 HA LYS A 127 6.563 -8.652 1.059 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.487 -7.046 -1.524 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.787 -8.770 -1.427 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.245 -7.430 -0.436 1.00 0.00 H new ATOM 0 HG3 LYS A 127 4.423 -8.149 -2.025 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.774 -10.350 -1.089 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.946 -9.706 0.532 1.00 0.00 H new ATOM 0 HE2 LYS A 127 2.464 -8.731 -0.175 1.00 0.00 H new ATOM 0 HE3 LYS A 127 2.490 -10.256 -1.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.587 -10.518 1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 3.038 -11.389 1.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 3.013 -9.911 1.874 1.00 0.00 H new ATOM 799 N GLY A 128 8.799 -6.386 0.330 1.00 0.00 N ATOM 800 CA GLY A 128 10.226 -6.134 0.283 1.00 0.00 C ATOM 801 C GLY A 128 10.585 -4.984 -0.636 1.00 0.00 C ATOM 802 O GLY A 128 11.575 -5.049 -1.366 1.00 0.00 O ATOM 0 H GLY A 128 8.215 -5.551 0.280 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.586 -5.917 1.289 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.740 -7.035 -0.051 1.00 0.00 H new ATOM 806 N GLY A 129 9.783 -3.925 -0.600 1.00 0.00 N ATOM 807 CA GLY A 129 10.041 -2.769 -1.437 1.00 0.00 C ATOM 808 C GLY A 129 9.432 -2.898 -2.819 1.00 0.00 C ATOM 809 O GLY A 129 8.511 -2.158 -3.168 1.00 0.00 O ATOM 0 H GLY A 129 8.958 -3.847 -0.005 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.643 -1.878 -0.951 1.00 0.00 H new ATOM 0 HA3 GLY A 129 11.118 -2.627 -1.531 1.00 0.00 H new ATOM 813 N PHE A 130 9.947 -3.835 -3.608 1.00 0.00 N ATOM 814 CA PHE A 130 9.446 -4.051 -4.961 1.00 0.00 C ATOM 815 C PHE A 130 10.141 -5.240 -5.620 1.00 0.00 C ATOM 816 O PHE A 130 9.485 -6.156 -6.116 1.00 0.00 O ATOM 817 CB PHE A 130 9.656 -2.792 -5.807 1.00 0.00 C ATOM 818 CG PHE A 130 8.930 -2.822 -7.123 1.00 0.00 C ATOM 819 CD1 PHE A 130 9.316 -3.701 -8.124 1.00 0.00 C ATOM 820 CD2 PHE A 130 7.865 -1.969 -7.360 1.00 0.00 C ATOM 821 CE1 PHE A 130 8.651 -3.729 -9.335 1.00 0.00 C ATOM 822 CE2 PHE A 130 7.197 -1.992 -8.570 1.00 0.00 C ATOM 823 CZ PHE A 130 7.591 -2.873 -9.558 1.00 0.00 C ATOM 0 H PHE A 130 10.709 -4.456 -3.335 1.00 0.00 H new ATOM 0 HA PHE A 130 8.380 -4.269 -4.896 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.324 -1.923 -5.239 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.722 -2.663 -5.993 1.00 0.00 H new ATOM 0 HD1 PHE A 130 10.146 -4.371 -7.955 1.00 0.00 H new ATOM 0 HD2 PHE A 130 7.553 -1.278 -6.591 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.960 -4.419 -10.106 1.00 0.00 H new ATOM 0 HE2 PHE A 130 6.368 -1.322 -8.743 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.070 -2.892 -10.504 1.00 0.00 H new ATOM 833 N GLU A 131 11.469 -5.215 -5.626 1.00 0.00 N ATOM 834 CA GLU A 131 12.253 -6.289 -6.226 1.00 0.00 C ATOM 835 C GLU A 131 11.908 -7.637 -5.603 1.00 0.00 C ATOM 836 O GLU A 131 11.778 -8.641 -6.302 1.00 0.00 O ATOM 837 CB GLU A 131 13.749 -6.008 -6.066 1.00 0.00 C ATOM 838 CG GLU A 131 14.307 -5.067 -7.122 1.00 0.00 C ATOM 839 CD GLU A 131 15.237 -5.768 -8.095 1.00 0.00 C ATOM 840 OE1 GLU A 131 15.918 -6.728 -7.679 1.00 0.00 O ATOM 841 OE2 GLU A 131 15.281 -5.356 -9.274 1.00 0.00 O ATOM 0 H GLU A 131 12.026 -4.462 -5.222 1.00 0.00 H new ATOM 0 HA GLU A 131 12.008 -6.330 -7.287 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.926 -5.580 -5.079 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.294 -6.951 -6.107 1.00 0.00 H new ATOM 0 HG2 GLU A 131 13.482 -4.616 -7.674 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.844 -4.255 -6.632 1.00 0.00 H new ATOM 848 N MET A 132 11.763 -7.653 -4.281 1.00 0.00 N ATOM 849 CA MET A 132 11.434 -8.880 -3.564 1.00 0.00 C ATOM 850 C MET A 132 10.091 -9.436 -4.024 1.00 0.00 C ATOM 851 O MET A 132 9.892 -10.651 -4.062 1.00 0.00 O ATOM 852 CB MET A 132 11.402 -8.619 -2.056 1.00 0.00 C ATOM 853 CG MET A 132 12.741 -8.177 -1.488 1.00 0.00 C ATOM 854 SD MET A 132 13.721 -9.556 -0.864 1.00 0.00 S ATOM 855 CE MET A 132 14.957 -9.702 -2.152 1.00 0.00 C ATOM 0 H MET A 132 11.868 -6.831 -3.686 1.00 0.00 H new ATOM 0 HA MET A 132 12.206 -9.618 -3.783 1.00 0.00 H new ATOM 0 HB2 MET A 132 10.656 -7.853 -1.844 1.00 0.00 H new ATOM 0 HB3 MET A 132 11.081 -9.527 -1.545 1.00 0.00 H new ATOM 0 HG2 MET A 132 13.305 -7.656 -2.262 1.00 0.00 H new ATOM 0 HG3 MET A 132 12.571 -7.463 -0.682 1.00 0.00 H new ATOM 0 HE1 MET A 132 15.641 -10.516 -1.910 1.00 0.00 H new ATOM 0 HE2 MET A 132 14.468 -9.910 -3.104 1.00 0.00 H new ATOM 0 HE3 MET A 132 15.516 -8.769 -2.228 1.00 0.00 H new ATOM 865 N VAL A 133 9.172 -8.541 -4.371 1.00 0.00 N ATOM 866 CA VAL A 133 7.847 -8.944 -4.829 1.00 0.00 C ATOM 867 C VAL A 133 7.937 -9.779 -6.101 1.00 0.00 C ATOM 868 O VAL A 133 7.313 -10.836 -6.207 1.00 0.00 O ATOM 869 CB VAL A 133 6.947 -7.722 -5.095 1.00 0.00 C ATOM 870 CG1 VAL A 133 5.517 -8.161 -5.367 1.00 0.00 C ATOM 871 CG2 VAL A 133 7.002 -6.750 -3.923 1.00 0.00 C ATOM 0 H VAL A 133 9.320 -7.532 -4.344 1.00 0.00 H new ATOM 0 HA VAL A 133 7.406 -9.543 -4.032 1.00 0.00 H new ATOM 0 HB VAL A 133 7.319 -7.207 -5.981 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.896 -7.284 -5.553 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.496 -8.812 -6.241 1.00 0.00 H new ATOM 0 HG13 VAL A 133 5.132 -8.702 -4.503 1.00 0.00 H new ATOM 0 HG21 VAL A 133 6.360 -5.894 -4.130 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.658 -7.251 -3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 133 8.027 -6.409 -3.781 1.00 0.00 H new ATOM 881 N THR A 134 8.715 -9.300 -7.065 1.00 0.00 N ATOM 882 CA THR A 134 8.885 -10.004 -8.332 1.00 0.00 C ATOM 883 C THR A 134 9.658 -11.304 -8.130 1.00 0.00 C ATOM 884 O THR A 134 9.284 -12.348 -8.662 1.00 0.00 O ATOM 885 CB THR A 134 9.615 -9.114 -9.340 1.00 0.00 C ATOM 886 OG1 THR A 134 9.077 -7.803 -9.332 1.00 0.00 O ATOM 887 CG2 THR A 134 9.540 -9.634 -10.759 1.00 0.00 C ATOM 0 H THR A 134 9.238 -8.427 -6.994 1.00 0.00 H new ATOM 0 HA THR A 134 7.896 -10.246 -8.722 1.00 0.00 H new ATOM 0 HB THR A 134 10.659 -9.114 -9.025 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.557 -7.248 -9.982 1.00 0.00 H new ATOM 0 HG21 THR A 134 10.077 -8.957 -11.423 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.992 -10.625 -10.808 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.497 -9.695 -11.069 1.00 0.00 H new ATOM 895 N LYS A 135 10.738 -11.230 -7.362 1.00 0.00 N ATOM 896 CA LYS A 135 11.565 -12.394 -7.093 1.00 0.00 C ATOM 897 C LYS A 135 10.768 -13.472 -6.366 1.00 0.00 C ATOM 898 O LYS A 135 11.012 -14.665 -6.542 1.00 0.00 O ATOM 899 CB LYS A 135 12.786 -11.998 -6.260 1.00 0.00 C ATOM 900 CG LYS A 135 13.777 -11.125 -7.012 1.00 0.00 C ATOM 901 CD LYS A 135 14.938 -11.942 -7.556 1.00 0.00 C ATOM 902 CE LYS A 135 14.499 -12.842 -8.699 1.00 0.00 C ATOM 903 NZ LYS A 135 14.280 -14.245 -8.250 1.00 0.00 N ATOM 0 H LYS A 135 11.060 -10.372 -6.914 1.00 0.00 H new ATOM 0 HA LYS A 135 11.901 -12.797 -8.048 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.451 -11.468 -5.368 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.294 -12.901 -5.922 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.269 -10.621 -7.834 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.157 -10.349 -6.348 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.725 -11.272 -7.901 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.363 -12.549 -6.757 1.00 0.00 H new ATOM 0 HE2 LYS A 135 13.579 -12.453 -9.134 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.255 -12.826 -9.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 15.016 -14.858 -8.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.326 -14.289 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.345 -14.569 -8.569 1.00 0.00 H new ATOM 917 N GLU A 136 9.813 -13.040 -5.549 1.00 0.00 N ATOM 918 CA GLU A 136 8.976 -13.967 -4.793 1.00 0.00 C ATOM 919 C GLU A 136 7.683 -14.280 -5.543 1.00 0.00 C ATOM 920 O GLU A 136 7.002 -15.259 -5.239 1.00 0.00 O ATOM 921 CB GLU A 136 8.649 -13.383 -3.417 1.00 0.00 C ATOM 922 CG GLU A 136 9.877 -13.123 -2.559 1.00 0.00 C ATOM 923 CD GLU A 136 9.879 -13.935 -1.280 1.00 0.00 C ATOM 924 OE1 GLU A 136 8.781 -14.260 -0.781 1.00 0.00 O ATOM 925 OE2 GLU A 136 10.978 -14.246 -0.775 1.00 0.00 O ATOM 0 H GLU A 136 9.599 -12.055 -5.393 1.00 0.00 H new ATOM 0 HA GLU A 136 9.533 -14.895 -4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.103 -12.449 -3.548 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.986 -14.068 -2.889 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.773 -13.356 -3.134 1.00 0.00 H new ATOM 0 HG3 GLU A 136 9.924 -12.063 -2.311 1.00 0.00 H new ATOM 932 N LYS A 137 7.348 -13.444 -6.524 1.00 0.00 N ATOM 933 CA LYS A 137 6.136 -13.635 -7.314 1.00 0.00 C ATOM 934 C LYS A 137 4.891 -13.407 -6.461 1.00 0.00 C ATOM 935 O LYS A 137 3.880 -14.089 -6.626 1.00 0.00 O ATOM 936 CB LYS A 137 6.104 -15.042 -7.919 1.00 0.00 C ATOM 937 CG LYS A 137 7.404 -15.440 -8.599 1.00 0.00 C ATOM 938 CD LYS A 137 7.555 -14.761 -9.952 1.00 0.00 C ATOM 939 CE LYS A 137 8.464 -15.556 -10.875 1.00 0.00 C ATOM 940 NZ LYS A 137 7.945 -16.930 -11.118 1.00 0.00 N ATOM 0 H LYS A 137 7.900 -12.628 -6.790 1.00 0.00 H new ATOM 0 HA LYS A 137 6.143 -12.904 -8.122 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.880 -15.762 -7.132 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.292 -15.099 -8.644 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.246 -15.173 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.432 -16.522 -8.728 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.575 -14.647 -10.415 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.961 -13.759 -9.814 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.563 -15.032 -11.826 1.00 0.00 H new ATOM 0 HE3 LYS A 137 9.461 -15.617 -10.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 8.323 -17.290 -12.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.243 -17.556 -10.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.906 -16.906 -11.164 1.00 0.00 H new ATOM 954 N LYS A 138 4.974 -12.443 -5.550 1.00 0.00 N ATOM 955 CA LYS A 138 3.855 -12.122 -4.671 1.00 0.00 C ATOM 956 C LYS A 138 2.921 -11.094 -5.310 1.00 0.00 C ATOM 957 O LYS A 138 1.901 -10.727 -4.726 1.00 0.00 O ATOM 958 CB LYS A 138 4.370 -11.593 -3.332 1.00 0.00 C ATOM 959 CG LYS A 138 5.339 -12.534 -2.638 1.00 0.00 C ATOM 960 CD LYS A 138 4.606 -13.613 -1.855 1.00 0.00 C ATOM 961 CE LYS A 138 5.574 -14.570 -1.178 1.00 0.00 C ATOM 962 NZ LYS A 138 5.434 -15.960 -1.696 1.00 0.00 N ATOM 0 H LYS A 138 5.805 -11.870 -5.401 1.00 0.00 H new ATOM 0 HA LYS A 138 3.289 -13.039 -4.505 1.00 0.00 H new ATOM 0 HB2 LYS A 138 4.862 -10.634 -3.495 1.00 0.00 H new ATOM 0 HB3 LYS A 138 3.521 -11.408 -2.673 1.00 0.00 H new ATOM 0 HG2 LYS A 138 5.989 -12.999 -3.379 1.00 0.00 H new ATOM 0 HG3 LYS A 138 5.980 -11.966 -1.964 1.00 0.00 H new ATOM 0 HD2 LYS A 138 3.968 -13.148 -1.103 1.00 0.00 H new ATOM 0 HD3 LYS A 138 3.953 -14.170 -2.527 1.00 0.00 H new ATOM 0 HE2 LYS A 138 6.596 -14.225 -1.336 1.00 0.00 H new ATOM 0 HE3 LYS A 138 5.398 -14.564 -0.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 6.111 -16.582 -1.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 4.466 -16.299 -1.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 5.627 -15.971 -2.718 1.00 0.00 H new ATOM 976 N TRP A 139 3.270 -10.633 -6.509 1.00 0.00 N ATOM 977 CA TRP A 139 2.456 -9.648 -7.214 1.00 0.00 C ATOM 978 C TRP A 139 1.046 -10.179 -7.451 1.00 0.00 C ATOM 979 O TRP A 139 0.068 -9.436 -7.361 1.00 0.00 O ATOM 980 CB TRP A 139 3.105 -9.281 -8.549 1.00 0.00 C ATOM 981 CG TRP A 139 4.248 -8.322 -8.410 1.00 0.00 C ATOM 982 CD1 TRP A 139 5.567 -8.578 -8.656 1.00 0.00 C ATOM 983 CD2 TRP A 139 4.175 -6.955 -7.992 1.00 0.00 C ATOM 984 NE1 TRP A 139 6.317 -7.452 -8.415 1.00 0.00 N ATOM 985 CE2 TRP A 139 5.486 -6.442 -8.007 1.00 0.00 C ATOM 986 CE3 TRP A 139 3.128 -6.112 -7.607 1.00 0.00 C ATOM 987 CZ2 TRP A 139 5.776 -5.127 -7.652 1.00 0.00 C ATOM 988 CZ3 TRP A 139 3.417 -4.807 -7.255 1.00 0.00 C ATOM 989 CH2 TRP A 139 4.731 -4.326 -7.280 1.00 0.00 C ATOM 0 H TRP A 139 4.109 -10.925 -7.011 1.00 0.00 H new ATOM 0 HA TRP A 139 2.390 -8.755 -6.592 1.00 0.00 H new ATOM 0 HB2 TRP A 139 3.460 -10.190 -9.034 1.00 0.00 H new ATOM 0 HB3 TRP A 139 2.351 -8.844 -9.203 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.962 -9.526 -8.991 1.00 0.00 H new ATOM 0 HE1 TRP A 139 7.329 -7.380 -8.522 1.00 0.00 H new ATOM 0 HE3 TRP A 139 2.111 -6.474 -7.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 6.789 -4.753 -7.670 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 2.616 -4.148 -6.956 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.924 -3.301 -7.000 1.00 0.00 H new ATOM 1000 N SER A 140 0.947 -11.470 -7.755 1.00 0.00 N ATOM 1001 CA SER A 140 -0.344 -12.101 -8.006 1.00 0.00 C ATOM 1002 C SER A 140 -1.214 -12.075 -6.754 1.00 0.00 C ATOM 1003 O SER A 140 -2.429 -11.899 -6.835 1.00 0.00 O ATOM 1004 CB SER A 140 -0.148 -13.543 -8.475 1.00 0.00 C ATOM 1005 OG SER A 140 0.960 -13.649 -9.352 1.00 0.00 O ATOM 0 H SER A 140 1.746 -12.099 -7.833 1.00 0.00 H new ATOM 0 HA SER A 140 -0.850 -11.537 -8.790 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.004 -14.192 -7.612 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.050 -13.890 -8.980 1.00 0.00 H new ATOM 0 HG SER A 140 1.065 -14.581 -9.636 1.00 0.00 H new ATOM 1011 N LYS A 141 -0.584 -12.248 -5.597 1.00 0.00 N ATOM 1012 CA LYS A 141 -1.302 -12.244 -4.329 1.00 0.00 C ATOM 1013 C LYS A 141 -1.844 -10.854 -4.014 1.00 0.00 C ATOM 1014 O LYS A 141 -2.898 -10.712 -3.396 1.00 0.00 O ATOM 1015 CB LYS A 141 -0.382 -12.713 -3.198 1.00 0.00 C ATOM 1016 CG LYS A 141 0.156 -14.120 -3.398 1.00 0.00 C ATOM 1017 CD LYS A 141 0.296 -14.855 -2.075 1.00 0.00 C ATOM 1018 CE LYS A 141 0.747 -16.292 -2.282 1.00 0.00 C ATOM 1019 NZ LYS A 141 -0.323 -17.127 -2.893 1.00 0.00 N ATOM 0 H LYS A 141 0.422 -12.393 -5.512 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.144 -12.931 -4.414 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.456 -12.021 -3.111 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -0.928 -12.672 -2.256 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.512 -14.676 -4.056 1.00 0.00 H new ATOM 0 HG3 LYS A 141 1.125 -14.073 -3.894 1.00 0.00 H new ATOM 0 HD2 LYS A 141 1.015 -14.334 -1.442 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -0.658 -14.844 -1.549 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.629 -16.307 -2.922 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.041 -16.722 -1.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -0.035 -18.126 -2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -1.204 -17.013 -2.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -0.479 -16.826 -3.876 1.00 0.00 H new ATOM 1033 N VAL A 142 -1.116 -9.829 -4.446 1.00 0.00 N ATOM 1034 CA VAL A 142 -1.524 -8.450 -4.211 1.00 0.00 C ATOM 1035 C VAL A 142 -2.813 -8.122 -4.960 1.00 0.00 C ATOM 1036 O VAL A 142 -3.705 -7.467 -4.423 1.00 0.00 O ATOM 1037 CB VAL A 142 -0.427 -7.458 -4.643 1.00 0.00 C ATOM 1038 CG1 VAL A 142 -0.784 -6.045 -4.211 1.00 0.00 C ATOM 1039 CG2 VAL A 142 0.922 -7.873 -4.075 1.00 0.00 C ATOM 0 H VAL A 142 -0.241 -9.928 -4.960 1.00 0.00 H new ATOM 0 HA VAL A 142 -1.694 -8.349 -3.139 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.357 -7.473 -5.731 1.00 0.00 H new ATOM 0 HG11 VAL A 142 0.003 -5.359 -4.525 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.727 -5.751 -4.672 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.884 -6.010 -3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 142 1.684 -7.161 -4.391 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.869 -7.889 -2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.180 -8.867 -4.440 1.00 0.00 H new ATOM 1049 N GLY A 143 -2.900 -8.581 -6.205 1.00 0.00 N ATOM 1050 CA GLY A 143 -4.083 -8.327 -7.007 1.00 0.00 C ATOM 1051 C GLY A 143 -5.300 -9.074 -6.501 1.00 0.00 C ATOM 1052 O GLY A 143 -6.402 -8.525 -6.458 1.00 0.00 O ATOM 0 H GLY A 143 -2.173 -9.124 -6.672 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -4.293 -7.257 -7.010 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -3.887 -8.616 -8.039 1.00 0.00 H new ATOM 1056 N SER A 144 -5.104 -10.331 -6.117 1.00 0.00 N ATOM 1057 CA SER A 144 -6.194 -11.156 -5.612 1.00 0.00 C ATOM 1058 C SER A 144 -6.811 -10.538 -4.361 1.00 0.00 C ATOM 1059 O SER A 144 -8.021 -10.610 -4.152 1.00 0.00 O ATOM 1060 CB SER A 144 -5.695 -12.569 -5.303 1.00 0.00 C ATOM 1061 OG SER A 144 -4.973 -13.106 -6.399 1.00 0.00 O ATOM 0 H SER A 144 -4.199 -10.801 -6.146 1.00 0.00 H new ATOM 0 HA SER A 144 -6.960 -11.211 -6.385 1.00 0.00 H new ATOM 0 HB2 SER A 144 -5.058 -12.548 -4.419 1.00 0.00 H new ATOM 0 HB3 SER A 144 -6.542 -13.214 -5.070 1.00 0.00 H new ATOM 0 HG SER A 144 -4.067 -12.733 -6.408 1.00 0.00 H new ATOM 1067 N ARG A 145 -5.968 -9.930 -3.532 1.00 0.00 N ATOM 1068 CA ARG A 145 -6.431 -9.298 -2.301 1.00 0.00 C ATOM 1069 C ARG A 145 -7.273 -8.063 -2.608 1.00 0.00 C ATOM 1070 O ARG A 145 -8.194 -7.728 -1.865 1.00 0.00 O ATOM 1071 CB ARG A 145 -5.239 -8.914 -1.421 1.00 0.00 C ATOM 1072 CG ARG A 145 -4.917 -9.947 -0.352 1.00 0.00 C ATOM 1073 CD ARG A 145 -3.418 -10.166 -0.220 1.00 0.00 C ATOM 1074 NE ARG A 145 -3.006 -10.310 1.174 1.00 0.00 N ATOM 1075 CZ ARG A 145 -1.854 -10.858 1.555 1.00 0.00 C ATOM 1076 NH1 ARG A 145 -0.997 -11.314 0.649 1.00 0.00 N ATOM 1077 NH2 ARG A 145 -1.559 -10.951 2.843 1.00 0.00 N ATOM 0 H ARG A 145 -4.963 -9.862 -3.690 1.00 0.00 H new ATOM 0 HA ARG A 145 -7.053 -10.014 -1.764 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -4.362 -8.771 -2.053 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.445 -7.958 -0.941 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -5.323 -9.620 0.605 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.403 -10.891 -0.599 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -3.132 -11.058 -0.777 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -2.888 -9.326 -0.670 1.00 0.00 H new ATOM 0 HE ARG A 145 -3.639 -9.971 1.899 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -1.220 -11.245 -0.344 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -0.116 -11.733 0.946 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -2.214 -10.603 3.543 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -0.676 -11.371 3.135 1.00 0.00 H new ATOM 1091 N LEU A 146 -6.950 -7.392 -3.708 1.00 0.00 N ATOM 1092 CA LEU A 146 -7.675 -6.194 -4.114 1.00 0.00 C ATOM 1093 C LEU A 146 -9.108 -6.538 -4.516 1.00 0.00 C ATOM 1094 O LEU A 146 -10.065 -6.055 -3.913 1.00 0.00 O ATOM 1095 CB LEU A 146 -6.955 -5.505 -5.277 1.00 0.00 C ATOM 1096 CG LEU A 146 -6.174 -4.246 -4.899 1.00 0.00 C ATOM 1097 CD1 LEU A 146 -7.099 -3.209 -4.282 1.00 0.00 C ATOM 1098 CD2 LEU A 146 -5.041 -4.590 -3.944 1.00 0.00 C ATOM 0 H LEU A 146 -6.190 -7.658 -4.335 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.708 -5.512 -3.264 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.267 -6.218 -5.732 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.692 -5.243 -6.037 1.00 0.00 H new ATOM 0 HG LEU A 146 -5.742 -3.822 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -6.525 -2.320 -4.019 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -7.875 -2.941 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -7.561 -3.621 -3.385 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -4.495 -3.683 -3.685 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -5.451 -5.037 -3.039 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -4.363 -5.297 -4.423 1.00 0.00 H new ATOM 1110 N GLY A 147 -9.245 -7.377 -5.537 1.00 0.00 N ATOM 1111 CA GLY A 147 -10.561 -7.772 -6.001 1.00 0.00 C ATOM 1112 C GLY A 147 -10.560 -8.198 -7.456 1.00 0.00 C ATOM 1113 O GLY A 147 -11.300 -7.646 -8.272 1.00 0.00 O ATOM 0 H GLY A 147 -8.467 -7.791 -6.052 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -10.928 -8.593 -5.386 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -11.254 -6.941 -5.870 1.00 0.00 H new ATOM 1117 N TYR A 148 -9.729 -9.181 -7.782 1.00 0.00 N ATOM 1118 CA TYR A 148 -9.633 -9.681 -9.149 1.00 0.00 C ATOM 1119 C TYR A 148 -10.235 -11.078 -9.260 1.00 0.00 C ATOM 1120 O TYR A 148 -9.772 -12.018 -8.614 1.00 0.00 O ATOM 1121 CB TYR A 148 -8.173 -9.703 -9.604 1.00 0.00 C ATOM 1122 CG TYR A 148 -7.624 -8.337 -9.946 1.00 0.00 C ATOM 1123 CD1 TYR A 148 -7.704 -7.288 -9.039 1.00 0.00 C ATOM 1124 CD2 TYR A 148 -7.027 -8.097 -11.176 1.00 0.00 C ATOM 1125 CE1 TYR A 148 -7.204 -6.038 -9.349 1.00 0.00 C ATOM 1126 CE2 TYR A 148 -6.524 -6.848 -11.493 1.00 0.00 C ATOM 1127 CZ TYR A 148 -6.615 -5.822 -10.576 1.00 0.00 C ATOM 1128 OH TYR A 148 -6.115 -4.579 -10.888 1.00 0.00 O ATOM 0 H TYR A 148 -9.111 -9.648 -7.118 1.00 0.00 H new ATOM 0 HA TYR A 148 -10.197 -9.010 -9.796 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -7.562 -10.144 -8.816 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -8.083 -10.350 -10.476 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -8.164 -7.452 -8.076 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -6.954 -8.898 -11.897 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -7.274 -5.233 -8.632 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -6.062 -6.677 -12.454 1.00 0.00 H new ATOM 0 HH TYR A 148 -5.492 -4.656 -11.641 1.00 0.00 H new ATOM 1138 N LEU A 149 -11.271 -11.208 -10.083 1.00 0.00 N ATOM 1139 CA LEU A 149 -11.937 -12.491 -10.277 1.00 0.00 C ATOM 1140 C LEU A 149 -10.984 -13.509 -10.905 1.00 0.00 C ATOM 1141 O LEU A 149 -10.334 -13.219 -11.911 1.00 0.00 O ATOM 1142 CB LEU A 149 -13.172 -12.320 -11.162 1.00 0.00 C ATOM 1143 CG LEU A 149 -14.350 -11.603 -10.499 1.00 0.00 C ATOM 1144 CD1 LEU A 149 -15.249 -10.968 -11.550 1.00 0.00 C ATOM 1145 CD2 LEU A 149 -15.142 -12.571 -9.633 1.00 0.00 C ATOM 0 H LEU A 149 -11.667 -10.441 -10.626 1.00 0.00 H new ATOM 0 HA LEU A 149 -12.247 -12.863 -9.300 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -12.886 -11.766 -12.056 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -13.504 -13.305 -11.490 1.00 0.00 H new ATOM 0 HG LEU A 149 -13.957 -10.812 -9.861 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.081 -10.463 -11.060 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -14.676 -10.244 -12.130 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -15.635 -11.741 -12.214 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.976 -12.045 -9.169 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -15.524 -13.383 -10.251 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -14.494 -12.979 -8.858 1.00 0.00 H new ATOM 1157 N PRO A 150 -10.886 -14.719 -10.325 1.00 0.00 N ATOM 1158 CA PRO A 150 -10.006 -15.771 -10.842 1.00 0.00 C ATOM 1159 C PRO A 150 -10.248 -16.051 -12.322 1.00 0.00 C ATOM 1160 O PRO A 150 -11.288 -15.687 -12.871 1.00 0.00 O ATOM 1161 CB PRO A 150 -10.376 -16.996 -10.001 1.00 0.00 C ATOM 1162 CG PRO A 150 -10.931 -16.435 -8.739 1.00 0.00 C ATOM 1163 CD PRO A 150 -11.625 -15.157 -9.124 1.00 0.00 C ATOM 0 HA PRO A 150 -8.955 -15.492 -10.770 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -11.108 -17.621 -10.512 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -9.504 -17.621 -9.807 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -11.628 -17.133 -8.275 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -10.139 -16.246 -8.014 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -12.681 -15.321 -9.339 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -11.574 -14.415 -8.327 1.00 0.00 H new ATOM 1171 N GLY A 151 -9.281 -16.699 -12.963 1.00 0.00 N ATOM 1172 CA GLY A 151 -9.409 -17.016 -14.374 1.00 0.00 C ATOM 1173 C GLY A 151 -8.105 -16.847 -15.127 1.00 0.00 C ATOM 1174 O GLY A 151 -7.296 -17.771 -15.196 1.00 0.00 O ATOM 0 H GLY A 151 -8.411 -17.010 -12.531 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -9.757 -18.043 -14.482 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -10.168 -16.374 -14.820 1.00 0.00 H new ATOM 1178 N LYS A 152 -7.901 -15.662 -15.695 1.00 0.00 N ATOM 1179 CA LYS A 152 -6.685 -15.375 -16.446 1.00 0.00 C ATOM 1180 C LYS A 152 -5.655 -14.672 -15.569 1.00 0.00 C ATOM 1181 O LYS A 152 -5.949 -14.286 -14.438 1.00 0.00 O ATOM 1182 CB LYS A 152 -7.008 -14.511 -17.668 1.00 0.00 C ATOM 1183 CG LYS A 152 -7.877 -15.214 -18.697 1.00 0.00 C ATOM 1184 CD LYS A 152 -7.905 -14.457 -20.015 1.00 0.00 C ATOM 1185 CE LYS A 152 -6.542 -14.458 -20.691 1.00 0.00 C ATOM 1186 NZ LYS A 152 -6.053 -13.077 -20.958 1.00 0.00 N ATOM 0 H LYS A 152 -8.562 -14.886 -15.649 1.00 0.00 H new ATOM 0 HA LYS A 152 -6.262 -16.323 -16.780 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -7.513 -13.603 -17.338 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -6.076 -14.203 -18.141 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -7.500 -16.223 -18.864 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -8.892 -15.312 -18.311 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -8.641 -14.909 -20.679 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -8.223 -13.430 -19.838 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -5.824 -14.981 -20.060 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -6.603 -15.009 -21.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -5.122 -13.122 -21.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -6.725 -12.585 -21.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -5.970 -12.558 -20.060 1.00 0.00 H new ATOM 1200 N GLY A 153 -4.447 -14.511 -16.097 1.00 0.00 N ATOM 1201 CA GLY A 153 -3.391 -13.857 -15.347 1.00 0.00 C ATOM 1202 C GLY A 153 -3.492 -12.345 -15.400 1.00 0.00 C ATOM 1203 O GLY A 153 -3.562 -11.759 -16.481 1.00 0.00 O ATOM 0 H GLY A 153 -4.180 -14.822 -17.031 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.431 -14.184 -14.308 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.424 -14.167 -15.742 1.00 0.00 H new ATOM 1207 N THR A 154 -3.498 -11.713 -14.232 1.00 0.00 N ATOM 1208 CA THR A 154 -3.589 -10.259 -14.149 1.00 0.00 C ATOM 1209 C THR A 154 -2.499 -9.685 -13.245 1.00 0.00 C ATOM 1210 O THR A 154 -2.549 -8.515 -12.866 1.00 0.00 O ATOM 1211 CB THR A 154 -4.967 -9.846 -13.629 1.00 0.00 C ATOM 1212 OG1 THR A 154 -5.958 -10.768 -14.047 1.00 0.00 O ATOM 1213 CG2 THR A 154 -5.396 -8.471 -14.093 1.00 0.00 C ATOM 0 H THR A 154 -3.441 -12.184 -13.329 1.00 0.00 H new ATOM 0 HA THR A 154 -3.446 -9.857 -15.152 1.00 0.00 H new ATOM 0 HB THR A 154 -4.872 -9.832 -12.543 1.00 0.00 H new ATOM 0 HG1 THR A 154 -6.832 -10.487 -13.703 1.00 0.00 H new ATOM 0 HG21 THR A 154 -6.382 -8.241 -13.688 1.00 0.00 H new ATOM 0 HG22 THR A 154 -4.678 -7.729 -13.744 1.00 0.00 H new ATOM 0 HG23 THR A 154 -5.438 -8.451 -15.182 1.00 0.00 H new ATOM 1221 N GLY A 155 -1.514 -10.512 -12.900 1.00 0.00 N ATOM 1222 CA GLY A 155 -0.432 -10.059 -12.046 1.00 0.00 C ATOM 1223 C GLY A 155 0.551 -9.168 -12.779 1.00 0.00 C ATOM 1224 O GLY A 155 1.001 -8.155 -12.244 1.00 0.00 O ATOM 0 H GLY A 155 -1.447 -11.486 -13.197 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -0.847 -9.516 -11.197 1.00 0.00 H new ATOM 0 HA3 GLY A 155 0.096 -10.924 -11.644 1.00 0.00 H new ATOM 1228 N SER A 156 0.886 -9.546 -14.009 1.00 0.00 N ATOM 1229 CA SER A 156 1.821 -8.771 -14.817 1.00 0.00 C ATOM 1230 C SER A 156 1.245 -7.400 -15.152 1.00 0.00 C ATOM 1231 O SER A 156 1.981 -6.423 -15.285 1.00 0.00 O ATOM 1232 CB SER A 156 2.160 -9.525 -16.105 1.00 0.00 C ATOM 1233 OG SER A 156 2.699 -10.805 -15.822 1.00 0.00 O ATOM 0 H SER A 156 0.525 -10.383 -14.467 1.00 0.00 H new ATOM 0 HA SER A 156 2.733 -8.629 -14.237 1.00 0.00 H new ATOM 0 HB2 SER A 156 1.262 -9.632 -16.714 1.00 0.00 H new ATOM 0 HB3 SER A 156 2.875 -8.947 -16.690 1.00 0.00 H new ATOM 0 HG SER A 156 2.905 -11.266 -16.662 1.00 0.00 H new ATOM 1239 N LEU A 157 -0.075 -7.336 -15.287 1.00 0.00 N ATOM 1240 CA LEU A 157 -0.750 -6.083 -15.606 1.00 0.00 C ATOM 1241 C LEU A 157 -0.631 -5.092 -14.452 1.00 0.00 C ATOM 1242 O LEU A 157 -0.369 -3.909 -14.662 1.00 0.00 O ATOM 1243 CB LEU A 157 -2.225 -6.341 -15.923 1.00 0.00 C ATOM 1244 CG LEU A 157 -2.479 -7.296 -17.091 1.00 0.00 C ATOM 1245 CD1 LEU A 157 -3.959 -7.628 -17.197 1.00 0.00 C ATOM 1246 CD2 LEU A 157 -1.971 -6.691 -18.392 1.00 0.00 C ATOM 0 H LEU A 157 -0.699 -8.136 -15.181 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.267 -5.651 -16.483 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.707 -6.744 -15.032 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.706 -5.388 -16.142 1.00 0.00 H new ATOM 0 HG LEU A 157 -1.934 -8.221 -16.906 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -4.120 -8.308 -18.033 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -4.293 -8.102 -16.274 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -4.527 -6.712 -17.360 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -2.159 -7.383 -19.213 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -2.489 -5.751 -18.583 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -0.900 -6.505 -18.313 1.00 0.00 H new ATOM 1258 N LEU A 158 -0.826 -5.585 -13.232 1.00 0.00 N ATOM 1259 CA LEU A 158 -0.738 -4.743 -12.045 1.00 0.00 C ATOM 1260 C LEU A 158 0.642 -4.103 -11.931 1.00 0.00 C ATOM 1261 O LEU A 158 0.765 -2.918 -11.623 1.00 0.00 O ATOM 1262 CB LEU A 158 -1.039 -5.561 -10.788 1.00 0.00 C ATOM 1263 CG LEU A 158 -2.387 -6.281 -10.791 1.00 0.00 C ATOM 1264 CD1 LEU A 158 -2.294 -7.593 -10.027 1.00 0.00 C ATOM 1265 CD2 LEU A 158 -3.467 -5.391 -10.196 1.00 0.00 C ATOM 0 H LEU A 158 -1.046 -6.562 -13.041 1.00 0.00 H new ATOM 0 HA LEU A 158 -1.480 -3.950 -12.139 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -0.250 -6.301 -10.657 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.001 -4.898 -9.924 1.00 0.00 H new ATOM 0 HG LEU A 158 -2.656 -6.504 -11.823 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -3.263 -8.091 -10.040 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -1.549 -8.236 -10.497 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -2.002 -7.394 -8.996 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -4.420 -5.919 -10.206 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -3.204 -5.136 -9.169 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -3.552 -4.478 -10.786 1.00 0.00 H new ATOM 1277 N LYS A 159 1.678 -4.896 -12.182 1.00 0.00 N ATOM 1278 CA LYS A 159 3.050 -4.410 -12.109 1.00 0.00 C ATOM 1279 C LYS A 159 3.277 -3.269 -13.097 1.00 0.00 C ATOM 1280 O LYS A 159 4.014 -2.325 -12.812 1.00 0.00 O ATOM 1281 CB LYS A 159 4.034 -5.550 -12.387 1.00 0.00 C ATOM 1282 CG LYS A 159 5.081 -5.729 -11.298 1.00 0.00 C ATOM 1283 CD LYS A 159 6.475 -5.383 -11.799 1.00 0.00 C ATOM 1284 CE LYS A 159 7.291 -6.633 -12.088 1.00 0.00 C ATOM 1285 NZ LYS A 159 7.027 -7.169 -13.453 1.00 0.00 N ATOM 0 H LYS A 159 1.593 -5.880 -12.438 1.00 0.00 H new ATOM 0 HA LYS A 159 3.222 -4.031 -11.101 1.00 0.00 H new ATOM 0 HB2 LYS A 159 3.477 -6.480 -12.501 1.00 0.00 H new ATOM 0 HB3 LYS A 159 4.537 -5.362 -13.336 1.00 0.00 H new ATOM 0 HG2 LYS A 159 4.832 -5.096 -10.446 1.00 0.00 H new ATOM 0 HG3 LYS A 159 5.066 -6.760 -10.944 1.00 0.00 H new ATOM 0 HD2 LYS A 159 6.398 -4.780 -12.704 1.00 0.00 H new ATOM 0 HD3 LYS A 159 6.990 -4.776 -11.055 1.00 0.00 H new ATOM 0 HE2 LYS A 159 8.352 -6.405 -11.987 1.00 0.00 H new ATOM 0 HE3 LYS A 159 7.058 -7.398 -11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 7.603 -8.021 -13.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 6.020 -7.411 -13.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 7.274 -6.449 -14.162 1.00 0.00 H new ATOM 1299 N SER A 160 2.638 -3.365 -14.258 1.00 0.00 N ATOM 1300 CA SER A 160 2.768 -2.342 -15.289 1.00 0.00 C ATOM 1301 C SER A 160 2.140 -1.027 -14.837 1.00 0.00 C ATOM 1302 O SER A 160 2.725 0.041 -15.003 1.00 0.00 O ATOM 1303 CB SER A 160 2.114 -2.812 -16.590 1.00 0.00 C ATOM 1304 OG SER A 160 2.420 -4.170 -16.852 1.00 0.00 O ATOM 0 H SER A 160 2.025 -4.141 -14.509 1.00 0.00 H new ATOM 0 HA SER A 160 3.831 -2.174 -15.464 1.00 0.00 H new ATOM 0 HB2 SER A 160 1.033 -2.686 -16.524 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.457 -2.192 -17.418 1.00 0.00 H new ATOM 0 HG SER A 160 1.998 -4.737 -16.173 1.00 0.00 H new ATOM 1310 N HIS A 161 0.943 -1.117 -14.265 1.00 0.00 N ATOM 1311 CA HIS A 161 0.234 0.065 -13.789 1.00 0.00 C ATOM 1312 C HIS A 161 0.965 0.699 -12.610 1.00 0.00 C ATOM 1313 O HIS A 161 1.183 1.910 -12.580 1.00 0.00 O ATOM 1314 CB HIS A 161 -1.194 -0.300 -13.379 1.00 0.00 C ATOM 1315 CG HIS A 161 -2.093 -0.596 -14.541 1.00 0.00 C ATOM 1316 ND1 HIS A 161 -2.451 0.351 -15.476 1.00 0.00 N ATOM 1317 CD2 HIS A 161 -2.706 -1.744 -14.915 1.00 0.00 C ATOM 1318 CE1 HIS A 161 -3.248 -0.200 -16.375 1.00 0.00 C ATOM 1319 NE2 HIS A 161 -3.418 -1.470 -16.058 1.00 0.00 N ATOM 0 H HIS A 161 0.445 -1.995 -14.120 1.00 0.00 H new ATOM 0 HA HIS A 161 0.197 0.788 -14.604 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -1.164 -1.170 -12.723 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -1.619 0.521 -12.801 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -2.646 -2.697 -14.410 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -3.686 0.303 -17.224 1.00 0.00 H new ATOM 0 HE2 HIS A 161 -3.986 -2.140 -16.577 1.00 0.00 H new ATOM 1328 N TYR A 162 1.344 -0.128 -11.640 1.00 0.00 N ATOM 1329 CA TYR A 162 2.052 0.352 -10.459 1.00 0.00 C ATOM 1330 C TYR A 162 3.361 1.029 -10.850 1.00 0.00 C ATOM 1331 O TYR A 162 3.657 2.136 -10.401 1.00 0.00 O ATOM 1332 CB TYR A 162 2.328 -0.808 -9.498 1.00 0.00 C ATOM 1333 CG TYR A 162 2.915 -0.372 -8.175 1.00 0.00 C ATOM 1334 CD1 TYR A 162 2.338 0.657 -7.441 1.00 0.00 C ATOM 1335 CD2 TYR A 162 4.048 -0.990 -7.660 1.00 0.00 C ATOM 1336 CE1 TYR A 162 2.872 1.056 -6.231 1.00 0.00 C ATOM 1337 CE2 TYR A 162 4.588 -0.597 -6.451 1.00 0.00 C ATOM 1338 CZ TYR A 162 3.998 0.428 -5.741 1.00 0.00 C ATOM 1339 OH TYR A 162 4.533 0.823 -4.536 1.00 0.00 O ATOM 0 H TYR A 162 1.172 -1.133 -11.649 1.00 0.00 H new ATOM 0 HA TYR A 162 1.420 1.086 -9.958 1.00 0.00 H new ATOM 0 HB2 TYR A 162 1.398 -1.345 -9.314 1.00 0.00 H new ATOM 0 HB3 TYR A 162 3.012 -1.510 -9.976 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.458 1.153 -7.823 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.514 -1.791 -8.214 1.00 0.00 H new ATOM 0 HE1 TYR A 162 2.410 1.856 -5.671 1.00 0.00 H new ATOM 0 HE2 TYR A 162 5.468 -1.090 -6.064 1.00 0.00 H new ATOM 0 HH TYR A 162 5.323 0.279 -4.335 1.00 0.00 H new ATOM 1349 N GLU A 163 4.142 0.357 -11.690 1.00 0.00 N ATOM 1350 CA GLU A 163 5.417 0.896 -12.145 1.00 0.00 C ATOM 1351 C GLU A 163 5.232 1.719 -13.416 1.00 0.00 C ATOM 1352 O GLU A 163 5.677 1.326 -14.494 1.00 0.00 O ATOM 1353 CB GLU A 163 6.414 -0.238 -12.395 1.00 0.00 C ATOM 1354 CG GLU A 163 7.838 0.243 -12.625 1.00 0.00 C ATOM 1355 CD GLU A 163 8.536 -0.516 -13.736 1.00 0.00 C ATOM 1356 OE1 GLU A 163 9.138 -1.573 -13.446 1.00 0.00 O ATOM 1357 OE2 GLU A 163 8.485 -0.053 -14.895 1.00 0.00 O ATOM 0 H GLU A 163 3.913 -0.562 -12.069 1.00 0.00 H new ATOM 0 HA GLU A 163 5.810 1.548 -11.365 1.00 0.00 H new ATOM 0 HB2 GLU A 163 6.402 -0.916 -11.542 1.00 0.00 H new ATOM 0 HB3 GLU A 163 6.089 -0.812 -13.263 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.824 1.305 -12.869 1.00 0.00 H new ATOM 0 HG3 GLU A 163 8.408 0.135 -11.702 1.00 0.00 H new ATOM 1364 N ARG A 164 4.568 2.863 -13.279 1.00 0.00 N ATOM 1365 CA ARG A 164 4.320 3.740 -14.417 1.00 0.00 C ATOM 1366 C ARG A 164 3.914 5.137 -13.954 1.00 0.00 C ATOM 1367 O ARG A 164 4.346 6.139 -14.524 1.00 0.00 O ATOM 1368 CB ARG A 164 3.231 3.147 -15.315 1.00 0.00 C ATOM 1369 CG ARG A 164 3.748 2.664 -16.660 1.00 0.00 C ATOM 1370 CD ARG A 164 3.677 3.760 -17.710 1.00 0.00 C ATOM 1371 NE ARG A 164 4.037 3.270 -19.039 1.00 0.00 N ATOM 1372 CZ ARG A 164 3.214 2.578 -19.822 1.00 0.00 C ATOM 1373 NH1 ARG A 164 1.983 2.291 -19.415 1.00 0.00 N ATOM 1374 NH2 ARG A 164 3.621 2.171 -21.017 1.00 0.00 N ATOM 0 H ARG A 164 4.193 3.203 -12.393 1.00 0.00 H new ATOM 0 HA ARG A 164 5.245 3.825 -14.987 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.758 2.313 -14.796 1.00 0.00 H new ATOM 0 HB3 ARG A 164 2.459 3.899 -15.480 1.00 0.00 H new ATOM 0 HG2 ARG A 164 4.779 2.326 -16.555 1.00 0.00 H new ATOM 0 HG3 ARG A 164 3.163 1.805 -16.989 1.00 0.00 H new ATOM 0 HD2 ARG A 164 2.668 4.172 -17.737 1.00 0.00 H new ATOM 0 HD3 ARG A 164 4.346 4.574 -17.430 1.00 0.00 H new ATOM 0 HE ARG A 164 4.975 3.471 -19.387 1.00 0.00 H new ATOM 0 HH11 ARG A 164 1.664 2.602 -18.497 1.00 0.00 H new ATOM 0 HH12 ARG A 164 1.357 1.760 -20.020 1.00 0.00 H new ATOM 0 HH21 ARG A 164 4.565 2.389 -21.336 1.00 0.00 H new ATOM 0 HH22 ARG A 164 2.990 1.640 -21.617 1.00 0.00 H new ATOM 1388 N ILE A 165 3.080 5.198 -12.921 1.00 0.00 N ATOM 1389 CA ILE A 165 2.617 6.474 -12.389 1.00 0.00 C ATOM 1390 C ILE A 165 2.671 6.496 -10.864 1.00 0.00 C ATOM 1391 O ILE A 165 3.086 7.487 -10.263 1.00 0.00 O ATOM 1392 CB ILE A 165 1.177 6.783 -12.843 1.00 0.00 C ATOM 1393 CG1 ILE A 165 1.017 6.507 -14.339 1.00 0.00 C ATOM 1394 CG2 ILE A 165 0.819 8.226 -12.521 1.00 0.00 C ATOM 1395 CD1 ILE A 165 0.332 5.191 -14.640 1.00 0.00 C ATOM 0 H ILE A 165 2.711 4.380 -12.436 1.00 0.00 H new ATOM 0 HA ILE A 165 3.289 7.237 -12.782 1.00 0.00 H new ATOM 0 HB ILE A 165 0.493 6.130 -12.300 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.445 7.317 -14.791 1.00 0.00 H new ATOM 0 HG13 ILE A 165 2.001 6.511 -14.809 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.201 8.429 -12.847 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.895 8.389 -11.446 1.00 0.00 H new ATOM 0 HG23 ILE A 165 1.506 8.896 -13.039 1.00 0.00 H new ATOM 0 HD11 ILE A 165 0.252 5.061 -15.719 1.00 0.00 H new ATOM 0 HD12 ILE A 165 0.915 4.372 -14.218 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -0.665 5.191 -14.200 1.00 0.00 H new ATOM 1407 N LEU A 166 2.242 5.403 -10.243 1.00 0.00 N ATOM 1408 CA LEU A 166 2.233 5.299 -8.788 1.00 0.00 C ATOM 1409 C LEU A 166 3.649 5.173 -8.231 1.00 0.00 C ATOM 1410 O LEU A 166 4.094 6.010 -7.445 1.00 0.00 O ATOM 1411 CB LEU A 166 1.391 4.099 -8.349 1.00 0.00 C ATOM 1412 CG LEU A 166 0.450 4.363 -7.172 1.00 0.00 C ATOM 1413 CD1 LEU A 166 -0.532 3.214 -7.004 1.00 0.00 C ATOM 1414 CD2 LEU A 166 1.246 4.579 -5.893 1.00 0.00 C ATOM 0 H LEU A 166 1.895 4.574 -10.726 1.00 0.00 H new ATOM 0 HA LEU A 166 1.792 6.213 -8.391 1.00 0.00 H new ATOM 0 HB2 LEU A 166 0.799 3.760 -9.199 1.00 0.00 H new ATOM 0 HB3 LEU A 166 2.062 3.282 -8.082 1.00 0.00 H new ATOM 0 HG LEU A 166 -0.118 5.270 -7.381 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -1.193 3.420 -6.162 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -1.125 3.106 -7.912 1.00 0.00 H new ATOM 0 HD13 LEU A 166 0.017 2.291 -6.817 1.00 0.00 H new ATOM 0 HD21 LEU A 166 0.561 4.766 -5.066 1.00 0.00 H new ATOM 0 HD22 LEU A 166 1.840 3.690 -5.679 1.00 0.00 H new ATOM 0 HD23 LEU A 166 1.908 5.436 -6.017 1.00 0.00 H new ATOM 1426 N TYR A 167 4.348 4.118 -8.633 1.00 0.00 N ATOM 1427 CA TYR A 167 5.711 3.878 -8.166 1.00 0.00 C ATOM 1428 C TYR A 167 6.629 5.064 -8.464 1.00 0.00 C ATOM 1429 O TYR A 167 7.255 5.609 -7.557 1.00 0.00 O ATOM 1430 CB TYR A 167 6.276 2.603 -8.795 1.00 0.00 C ATOM 1431 CG TYR A 167 7.329 1.927 -7.947 1.00 0.00 C ATOM 1432 CD1 TYR A 167 7.136 1.745 -6.584 1.00 0.00 C ATOM 1433 CD2 TYR A 167 8.518 1.475 -8.508 1.00 0.00 C ATOM 1434 CE1 TYR A 167 8.097 1.129 -5.803 1.00 0.00 C ATOM 1435 CE2 TYR A 167 9.483 0.859 -7.735 1.00 0.00 C ATOM 1436 CZ TYR A 167 9.268 0.688 -6.384 1.00 0.00 C ATOM 1437 OH TYR A 167 10.232 0.075 -5.610 1.00 0.00 O ATOM 0 H TYR A 167 3.995 3.414 -9.281 1.00 0.00 H new ATOM 0 HA TYR A 167 5.668 3.753 -7.084 1.00 0.00 H new ATOM 0 HB2 TYR A 167 5.460 1.903 -8.973 1.00 0.00 H new ATOM 0 HB3 TYR A 167 6.705 2.846 -9.767 1.00 0.00 H new ATOM 0 HD1 TYR A 167 6.221 2.090 -6.126 1.00 0.00 H new ATOM 0 HD2 TYR A 167 8.690 1.608 -9.566 1.00 0.00 H new ATOM 0 HE1 TYR A 167 7.932 0.994 -4.744 1.00 0.00 H new ATOM 0 HE2 TYR A 167 10.401 0.513 -8.187 1.00 0.00 H new ATOM 0 HH TYR A 167 10.993 -0.176 -6.174 1.00 0.00 H new ATOM 1447 N PRO A 168 6.734 5.482 -9.742 1.00 0.00 N ATOM 1448 CA PRO A 168 7.594 6.604 -10.130 1.00 0.00 C ATOM 1449 C PRO A 168 7.284 7.876 -9.348 1.00 0.00 C ATOM 1450 O PRO A 168 8.167 8.705 -9.120 1.00 0.00 O ATOM 1451 CB PRO A 168 7.295 6.806 -11.624 1.00 0.00 C ATOM 1452 CG PRO A 168 6.052 6.027 -11.893 1.00 0.00 C ATOM 1453 CD PRO A 168 6.040 4.901 -10.902 1.00 0.00 C ATOM 0 HA PRO A 168 8.643 6.391 -9.923 1.00 0.00 H new ATOM 0 HB2 PRO A 168 7.154 7.862 -11.856 1.00 0.00 H new ATOM 0 HB3 PRO A 168 8.121 6.451 -12.241 1.00 0.00 H new ATOM 0 HG2 PRO A 168 5.168 6.654 -11.780 1.00 0.00 H new ATOM 0 HG3 PRO A 168 6.045 5.647 -12.914 1.00 0.00 H new ATOM 0 HD2 PRO A 168 5.025 4.592 -10.653 1.00 0.00 H new ATOM 0 HD3 PRO A 168 6.557 4.020 -11.284 1.00 0.00 H new ATOM 1461 N TYR A 169 6.029 8.028 -8.936 1.00 0.00 N ATOM 1462 CA TYR A 169 5.616 9.203 -8.177 1.00 0.00 C ATOM 1463 C TYR A 169 6.423 9.327 -6.888 1.00 0.00 C ATOM 1464 O TYR A 169 7.014 10.370 -6.610 1.00 0.00 O ATOM 1465 CB TYR A 169 4.122 9.131 -7.853 1.00 0.00 C ATOM 1466 CG TYR A 169 3.624 10.289 -7.017 1.00 0.00 C ATOM 1467 CD1 TYR A 169 3.971 11.597 -7.332 1.00 0.00 C ATOM 1468 CD2 TYR A 169 2.808 10.074 -5.913 1.00 0.00 C ATOM 1469 CE1 TYR A 169 3.520 12.658 -6.570 1.00 0.00 C ATOM 1470 CE2 TYR A 169 2.354 11.129 -5.146 1.00 0.00 C ATOM 1471 CZ TYR A 169 2.711 12.419 -5.479 1.00 0.00 C ATOM 1472 OH TYR A 169 2.260 13.473 -4.716 1.00 0.00 O ATOM 0 H TYR A 169 5.283 7.355 -9.114 1.00 0.00 H new ATOM 0 HA TYR A 169 5.804 10.085 -8.790 1.00 0.00 H new ATOM 0 HB2 TYR A 169 3.558 9.099 -8.785 1.00 0.00 H new ATOM 0 HB3 TYR A 169 3.918 8.199 -7.325 1.00 0.00 H new ATOM 0 HD1 TYR A 169 4.604 11.788 -8.186 1.00 0.00 H new ATOM 0 HD2 TYR A 169 2.524 9.066 -5.650 1.00 0.00 H new ATOM 0 HE1 TYR A 169 3.800 13.669 -6.827 1.00 0.00 H new ATOM 0 HE2 TYR A 169 1.722 10.945 -4.290 1.00 0.00 H new ATOM 0 HH TYR A 169 2.396 14.312 -5.204 1.00 0.00 H new ATOM 1482 N GLU A 170 6.444 8.253 -6.102 1.00 0.00 N ATOM 1483 CA GLU A 170 7.176 8.241 -4.846 1.00 0.00 C ATOM 1484 C GLU A 170 8.656 8.534 -5.076 1.00 0.00 C ATOM 1485 O GLU A 170 9.240 9.393 -4.415 1.00 0.00 O ATOM 1486 CB GLU A 170 7.009 6.888 -4.149 1.00 0.00 C ATOM 1487 CG GLU A 170 6.598 7.002 -2.691 1.00 0.00 C ATOM 1488 CD GLU A 170 7.771 6.861 -1.741 1.00 0.00 C ATOM 1489 OE1 GLU A 170 8.750 6.174 -2.104 1.00 0.00 O ATOM 1490 OE2 GLU A 170 7.712 7.437 -0.634 1.00 0.00 O ATOM 0 H GLU A 170 5.961 7.381 -6.316 1.00 0.00 H new ATOM 0 HA GLU A 170 6.767 9.023 -4.206 1.00 0.00 H new ATOM 0 HB2 GLU A 170 6.261 6.303 -4.684 1.00 0.00 H new ATOM 0 HB3 GLU A 170 7.948 6.338 -4.211 1.00 0.00 H new ATOM 0 HG2 GLU A 170 6.117 7.966 -2.527 1.00 0.00 H new ATOM 0 HG3 GLU A 170 5.858 6.234 -2.465 1.00 0.00 H new ATOM 1497 N LEU A 171 9.256 7.810 -6.016 1.00 0.00 N ATOM 1498 CA LEU A 171 10.664 7.987 -6.336 1.00 0.00 C ATOM 1499 C LEU A 171 10.951 9.423 -6.767 1.00 0.00 C ATOM 1500 O LEU A 171 12.002 9.978 -6.450 1.00 0.00 O ATOM 1501 CB LEU A 171 11.083 7.017 -7.443 1.00 0.00 C ATOM 1502 CG LEU A 171 10.811 5.541 -7.144 1.00 0.00 C ATOM 1503 CD1 LEU A 171 10.516 4.781 -8.429 1.00 0.00 C ATOM 1504 CD2 LEU A 171 11.994 4.919 -6.415 1.00 0.00 C ATOM 0 H LEU A 171 8.785 7.094 -6.569 1.00 0.00 H new ATOM 0 HA LEU A 171 11.243 7.775 -5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 171 10.561 7.289 -8.361 1.00 0.00 H new ATOM 0 HB3 LEU A 171 12.149 7.144 -7.633 1.00 0.00 H new ATOM 0 HG LEU A 171 9.935 5.476 -6.498 1.00 0.00 H new ATOM 0 HD11 LEU A 171 10.325 3.733 -8.196 1.00 0.00 H new ATOM 0 HD12 LEU A 171 9.639 5.211 -8.913 1.00 0.00 H new ATOM 0 HD13 LEU A 171 11.372 4.854 -9.099 1.00 0.00 H new ATOM 0 HD21 LEU A 171 11.784 3.869 -6.210 1.00 0.00 H new ATOM 0 HD22 LEU A 171 12.886 4.996 -7.037 1.00 0.00 H new ATOM 0 HD23 LEU A 171 12.160 5.446 -5.475 1.00 0.00 H new ATOM 1516 N PHE A 172 10.007 10.016 -7.492 1.00 0.00 N ATOM 1517 CA PHE A 172 10.156 11.386 -7.967 1.00 0.00 C ATOM 1518 C PHE A 172 10.368 12.347 -6.803 1.00 0.00 C ATOM 1519 O PHE A 172 11.106 13.327 -6.920 1.00 0.00 O ATOM 1520 CB PHE A 172 8.922 11.803 -8.770 1.00 0.00 C ATOM 1521 CG PHE A 172 9.213 12.827 -9.830 1.00 0.00 C ATOM 1522 CD1 PHE A 172 9.668 14.090 -9.488 1.00 0.00 C ATOM 1523 CD2 PHE A 172 9.030 12.525 -11.170 1.00 0.00 C ATOM 1524 CE1 PHE A 172 9.936 15.033 -10.461 1.00 0.00 C ATOM 1525 CE2 PHE A 172 9.298 13.464 -12.148 1.00 0.00 C ATOM 1526 CZ PHE A 172 9.750 14.719 -11.793 1.00 0.00 C ATOM 0 H PHE A 172 9.131 9.569 -7.763 1.00 0.00 H new ATOM 0 HA PHE A 172 11.034 11.428 -8.611 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.488 10.920 -9.239 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.172 12.202 -8.087 1.00 0.00 H new ATOM 0 HD1 PHE A 172 9.815 14.340 -8.448 1.00 0.00 H new ATOM 0 HD2 PHE A 172 8.674 11.545 -11.453 1.00 0.00 H new ATOM 0 HE1 PHE A 172 10.290 16.014 -10.181 1.00 0.00 H new ATOM 0 HE2 PHE A 172 9.154 13.216 -13.189 1.00 0.00 H new ATOM 0 HZ PHE A 172 9.958 15.455 -12.556 1.00 0.00 H new ATOM 1536 N GLN A 173 9.719 12.060 -5.680 1.00 0.00 N ATOM 1537 CA GLN A 173 9.837 12.899 -4.493 1.00 0.00 C ATOM 1538 C GLN A 173 11.153 12.638 -3.769 1.00 0.00 C ATOM 1539 O GLN A 173 11.838 13.570 -3.349 1.00 0.00 O ATOM 1540 CB GLN A 173 8.662 12.649 -3.547 1.00 0.00 C ATOM 1541 CG GLN A 173 7.305 12.890 -4.189 1.00 0.00 C ATOM 1542 CD GLN A 173 6.182 12.179 -3.460 1.00 0.00 C ATOM 1543 OE1 GLN A 173 5.762 12.598 -2.381 1.00 0.00 O ATOM 1544 NE2 GLN A 173 5.688 11.096 -4.049 1.00 0.00 N ATOM 0 H GLN A 173 9.106 11.253 -5.567 1.00 0.00 H new ATOM 0 HA GLN A 173 9.821 13.941 -4.813 1.00 0.00 H new ATOM 0 HB2 GLN A 173 8.708 11.621 -3.187 1.00 0.00 H new ATOM 0 HB3 GLN A 173 8.763 13.296 -2.676 1.00 0.00 H new ATOM 0 HG2 GLN A 173 7.101 13.961 -4.208 1.00 0.00 H new ATOM 0 HG3 GLN A 173 7.332 12.552 -5.225 1.00 0.00 H new ATOM 0 HE21 GLN A 173 6.066 10.784 -4.943 1.00 0.00 H new ATOM 0 HE22 GLN A 173 4.930 10.576 -3.607 1.00 0.00 H new ATOM 1553 N SER A 174 11.503 11.363 -3.629 1.00 0.00 N ATOM 1554 CA SER A 174 12.736 10.980 -2.958 1.00 0.00 C ATOM 1555 C SER A 174 13.825 10.639 -3.970 1.00 0.00 C ATOM 1556 O SER A 174 14.694 9.808 -3.706 1.00 0.00 O ATOM 1557 CB SER A 174 12.490 9.788 -2.032 1.00 0.00 C ATOM 1558 OG SER A 174 11.485 10.082 -1.077 1.00 0.00 O ATOM 0 H SER A 174 10.948 10.579 -3.972 1.00 0.00 H new ATOM 0 HA SER A 174 13.073 11.828 -2.363 1.00 0.00 H new ATOM 0 HB2 SER A 174 12.193 8.921 -2.622 1.00 0.00 H new ATOM 0 HB3 SER A 174 13.416 9.524 -1.521 1.00 0.00 H new ATOM 0 HG SER A 174 11.346 9.303 -0.499 1.00 0.00 H new ATOM 1564 N GLY A 175 13.770 11.287 -5.128 1.00 0.00 N ATOM 1565 CA GLY A 175 14.754 11.039 -6.165 1.00 0.00 C ATOM 1566 C GLY A 175 14.936 12.229 -7.087 1.00 0.00 C ATOM 1567 O GLY A 175 13.916 12.794 -7.535 1.00 0.00 O ATOM 1568 OXT GLY A 175 16.098 12.595 -7.361 1.00 0.00 O ATOM 0 H GLY A 175 13.061 11.980 -5.367 1.00 0.00 H new ATOM 0 HA2 GLY A 175 15.710 10.791 -5.703 1.00 0.00 H new ATOM 0 HA3 GLY A 175 14.449 10.172 -6.751 1.00 0.00 H new