USER MOD reduce.3.24.130724 H: found=0, std=0, add=1121, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1119 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 131 CYS SG : rot 139:sc= 0.775! USER MOD Set 1.2: A 134 CYS SG : rot -38:sc= 0.794 USER MOD Set 1.3: A 147 CYS SG : rot -160:sc= 0.934 USER MOD Set 1.4: A 150 CYS SG : rot -127:sc= 0.58! USER MOD Set 1.5: A 152 SER OG : rot 103:sc= 0.358 USER MOD Set 2.1: A 58 SER OG : rot -84:sc= 1.26 USER MOD Set 2.2: A 61 SER OG : rot -50:sc= 0.996 USER MOD Set 3.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 18 GLN : amide:sc= 0.409 X(o=0.41,f=0.057) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0.0236 USER MOD Single : A 13 SER OG : rot -43:sc= 1.15 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 128:sc= 1.67 USER MOD Single : A 27 THR OG1 : rot -170:sc= -0.0625 USER MOD Single : A 29 SER OG : rot -180:sc= 1.2 USER MOD Single : A 35 LYS NZ :NH3+ -166:sc= -0.028 (180deg=-0.2) USER MOD Single : A 39 SER OG : rot -170:sc= -0.0321 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 154:sc= 0.922 (180deg=0.535) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -174:sc= 1.29 (180deg=1.12) USER MOD Single : A 67 GLN : amide:sc= -0.154 K(o=-0.15,f=-2) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 ASN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot -120:sc= -0.178 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 30:sc= -1.06 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.261 K(o=-0.26,f=-2.1!) USER MOD Single : A 104 GLN : amide:sc= -0.792 K(o=-0.79,f=-1.4) USER MOD Single : A 105 ASN : amide:sc= -0.205 K(o=-0.21,f=-0.79) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -55:sc= 1.07 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0159) USER MOD Single : A 139 SER OG : rot 180:sc= 0.0238 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 LYS NZ :NH3+ -170:sc= -0.0138 (180deg=-0.128) USER MOD Single : A 155 LYS NZ :NH3+ -161:sc=-0.00237 (180deg=-0.328) USER MOD ----------------------------------------------------------------- ATOM 116 N LYS A 7 -11.481 3.377 -13.922 1.00 0.00 N ATOM 117 CA LYS A 7 -11.247 1.947 -14.129 1.00 0.00 C ATOM 118 C LYS A 7 -11.210 1.212 -12.777 1.00 0.00 C ATOM 119 O LYS A 7 -11.403 1.837 -11.731 1.00 0.00 O ATOM 120 CB LYS A 7 -9.977 1.752 -14.984 1.00 0.00 C ATOM 121 CG LYS A 7 -10.088 0.568 -15.953 1.00 0.00 C ATOM 122 CD LYS A 7 -10.964 0.884 -17.173 1.00 0.00 C ATOM 123 CE LYS A 7 -11.173 -0.402 -17.971 1.00 0.00 C ATOM 124 NZ LYS A 7 -12.185 -0.250 -19.027 1.00 0.00 N ATOM 0 HA LYS A 7 -12.070 1.500 -14.687 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.783 2.663 -15.551 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.122 1.598 -14.326 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -9.091 0.284 -16.290 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -10.503 -0.291 -15.425 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.923 1.291 -16.854 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.487 1.642 -17.795 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.227 -0.706 -18.419 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.476 -1.201 -17.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.290 -1.149 -19.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.096 0.013 -18.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.886 0.493 -19.690 1.00 0.00 H new ATOM 138 N THR A 8 -10.946 -0.091 -12.745 1.00 0.00 N ATOM 139 CA THR A 8 -10.917 -0.826 -11.487 1.00 0.00 C ATOM 140 C THR A 8 -9.836 -0.252 -10.573 1.00 0.00 C ATOM 141 O THR A 8 -8.733 0.103 -11.008 1.00 0.00 O ATOM 142 CB THR A 8 -10.787 -2.334 -11.746 1.00 0.00 C ATOM 143 OG1 THR A 8 -11.517 -2.687 -12.912 1.00 0.00 O ATOM 144 CG2 THR A 8 -11.331 -3.160 -10.581 1.00 0.00 C ATOM 0 H THR A 8 -10.750 -0.656 -13.571 1.00 0.00 H new ATOM 0 HA THR A 8 -11.861 -0.701 -10.957 1.00 0.00 H new ATOM 0 HB THR A 8 -9.725 -2.549 -11.868 1.00 0.00 H new ATOM 0 HG1 THR A 8 -11.429 -3.650 -13.074 1.00 0.00 H new ATOM 0 HG21 THR A 8 -11.220 -4.221 -10.804 1.00 0.00 H new ATOM 0 HG22 THR A 8 -10.776 -2.920 -9.674 1.00 0.00 H new ATOM 0 HG23 THR A 8 -12.386 -2.929 -10.432 1.00 0.00 H new ATOM 152 N LEU A 9 -10.193 -0.091 -9.302 1.00 0.00 N ATOM 153 CA LEU A 9 -9.347 0.435 -8.252 1.00 0.00 C ATOM 154 C LEU A 9 -9.876 -0.109 -6.934 1.00 0.00 C ATOM 155 O LEU A 9 -11.084 -0.302 -6.773 1.00 0.00 O ATOM 156 CB LEU A 9 -9.338 1.974 -8.338 1.00 0.00 C ATOM 157 CG LEU A 9 -9.236 2.815 -7.041 1.00 0.00 C ATOM 158 CD1 LEU A 9 -8.821 4.245 -7.401 1.00 0.00 C ATOM 159 CD2 LEU A 9 -10.563 2.852 -6.351 1.00 0.00 C ATOM 0 H LEU A 9 -11.125 -0.337 -8.968 1.00 0.00 H new ATOM 0 HA LEU A 9 -8.307 0.124 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -8.503 2.259 -8.978 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.251 2.277 -8.851 1.00 0.00 H new ATOM 0 HG LEU A 9 -8.497 2.365 -6.379 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.747 4.842 -6.492 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -7.854 4.228 -7.903 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -9.566 4.684 -8.064 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -10.483 3.445 -5.440 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -11.304 3.301 -7.012 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.870 1.837 -6.097 1.00 0.00 H new ATOM 171 N VAL A 10 -8.968 -0.349 -5.996 1.00 0.00 N ATOM 172 CA VAL A 10 -9.308 -0.748 -4.626 1.00 0.00 C ATOM 173 C VAL A 10 -8.787 0.328 -3.664 1.00 0.00 C ATOM 174 O VAL A 10 -7.764 0.959 -3.955 1.00 0.00 O ATOM 175 CB VAL A 10 -8.724 -2.157 -4.383 1.00 0.00 C ATOM 176 CG1 VAL A 10 -8.695 -2.581 -2.916 1.00 0.00 C ATOM 177 CG2 VAL A 10 -9.555 -3.205 -5.142 1.00 0.00 C ATOM 0 H VAL A 10 -7.964 -0.273 -6.161 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.383 -0.817 -4.457 1.00 0.00 H new ATOM 0 HB VAL A 10 -7.695 -2.103 -4.737 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -8.271 -3.582 -2.835 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -8.084 -1.880 -2.347 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.710 -2.584 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -9.138 -4.197 -4.967 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -10.586 -3.177 -4.789 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -9.531 -2.985 -6.209 1.00 0.00 H new ATOM 187 N LEU A 11 -9.491 0.551 -2.546 1.00 0.00 N ATOM 188 CA LEU A 11 -9.137 1.509 -1.502 1.00 0.00 C ATOM 189 C LEU A 11 -8.864 0.764 -0.198 1.00 0.00 C ATOM 190 O LEU A 11 -9.600 -0.161 0.159 1.00 0.00 O ATOM 191 CB LEU A 11 -10.277 2.505 -1.221 1.00 0.00 C ATOM 192 CG LEU A 11 -10.806 3.399 -2.354 1.00 0.00 C ATOM 193 CD1 LEU A 11 -9.702 3.965 -3.241 1.00 0.00 C ATOM 194 CD2 LEU A 11 -11.925 2.734 -3.159 1.00 0.00 C ATOM 0 H LEU A 11 -10.354 0.048 -2.341 1.00 0.00 H new ATOM 0 HA LEU A 11 -8.259 2.052 -1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -11.122 1.933 -0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -9.945 3.161 -0.417 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.256 4.260 -1.859 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -10.144 4.586 -4.020 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.023 4.568 -2.637 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -9.149 3.146 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -12.260 3.411 -3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -11.553 1.813 -3.608 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -12.761 2.504 -2.498 1.00 0.00 H new ATOM 206 N ASP A 12 -7.846 1.198 0.537 1.00 0.00 N ATOM 207 CA ASP A 12 -7.529 0.731 1.886 1.00 0.00 C ATOM 208 C ASP A 12 -8.225 1.593 2.949 1.00 0.00 C ATOM 209 O ASP A 12 -8.647 2.718 2.682 1.00 0.00 O ATOM 210 CB ASP A 12 -6.006 0.778 2.049 1.00 0.00 C ATOM 211 CG ASP A 12 -5.532 0.720 3.498 1.00 0.00 C ATOM 212 OD1 ASP A 12 -5.876 -0.216 4.254 1.00 0.00 O ATOM 213 OD2 ASP A 12 -4.883 1.703 3.904 1.00 0.00 O ATOM 0 H ASP A 12 -7.196 1.908 0.201 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.891 -0.288 2.024 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.567 -0.056 1.501 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.631 1.693 1.592 1.00 0.00 H new ATOM 218 N SER A 13 -8.274 1.081 4.180 1.00 0.00 N ATOM 219 CA SER A 13 -8.682 1.776 5.395 1.00 0.00 C ATOM 220 C SER A 13 -8.132 3.204 5.503 1.00 0.00 C ATOM 221 O SER A 13 -8.890 4.126 5.813 1.00 0.00 O ATOM 222 CB SER A 13 -8.276 0.948 6.624 1.00 0.00 C ATOM 223 OG SER A 13 -6.906 0.575 6.647 1.00 0.00 O ATOM 0 H SER A 13 -8.014 0.112 4.363 1.00 0.00 H new ATOM 0 HA SER A 13 -9.766 1.878 5.351 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.500 1.520 7.524 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.887 0.046 6.659 1.00 0.00 H new ATOM 0 HG SER A 13 -6.634 0.275 5.755 1.00 0.00 H new ATOM 229 N SER A 14 -6.830 3.397 5.260 1.00 0.00 N ATOM 230 CA SER A 14 -6.163 4.676 5.444 1.00 0.00 C ATOM 231 C SER A 14 -6.811 5.760 4.580 1.00 0.00 C ATOM 232 O SER A 14 -6.899 6.902 5.026 1.00 0.00 O ATOM 233 CB SER A 14 -4.664 4.514 5.147 1.00 0.00 C ATOM 234 OG SER A 14 -3.928 5.665 5.522 1.00 0.00 O ATOM 0 H SER A 14 -6.211 2.658 4.927 1.00 0.00 H new ATOM 0 HA SER A 14 -6.272 5.000 6.479 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.279 3.646 5.682 1.00 0.00 H new ATOM 0 HB3 SER A 14 -4.522 4.322 4.083 1.00 0.00 H new ATOM 0 HG SER A 14 -2.979 5.527 5.320 1.00 0.00 H new ATOM 240 N VAL A 15 -7.307 5.418 3.388 1.00 0.00 N ATOM 241 CA VAL A 15 -7.901 6.368 2.451 1.00 0.00 C ATOM 242 C VAL A 15 -9.097 7.064 3.114 1.00 0.00 C ATOM 243 O VAL A 15 -9.272 8.283 2.999 1.00 0.00 O ATOM 244 CB VAL A 15 -8.284 5.632 1.147 1.00 0.00 C ATOM 245 CG1 VAL A 15 -8.639 6.598 0.014 1.00 0.00 C ATOM 246 CG2 VAL A 15 -7.129 4.771 0.613 1.00 0.00 C ATOM 0 H VAL A 15 -7.306 4.458 3.044 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.184 7.145 2.185 1.00 0.00 H new ATOM 0 HB VAL A 15 -9.143 5.020 1.420 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -8.900 6.031 -0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -9.487 7.214 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.783 7.238 -0.200 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.441 4.272 -0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.268 5.406 0.405 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.857 4.024 1.359 1.00 0.00 H new ATOM 256 N PHE A 16 -9.893 6.289 3.852 1.00 0.00 N ATOM 257 CA PHE A 16 -11.067 6.777 4.548 1.00 0.00 C ATOM 258 C PHE A 16 -10.676 7.587 5.774 1.00 0.00 C ATOM 259 O PHE A 16 -11.296 8.617 6.032 1.00 0.00 O ATOM 260 CB PHE A 16 -11.970 5.605 4.938 1.00 0.00 C ATOM 261 CG PHE A 16 -12.167 4.581 3.844 1.00 0.00 C ATOM 262 CD1 PHE A 16 -12.477 4.974 2.527 1.00 0.00 C ATOM 263 CD2 PHE A 16 -11.947 3.227 4.136 1.00 0.00 C ATOM 264 CE1 PHE A 16 -12.549 4.014 1.507 1.00 0.00 C ATOM 265 CE2 PHE A 16 -12.019 2.266 3.121 1.00 0.00 C ATOM 266 CZ PHE A 16 -12.309 2.663 1.804 1.00 0.00 C ATOM 0 H PHE A 16 -9.731 5.290 3.980 1.00 0.00 H new ATOM 0 HA PHE A 16 -11.618 7.436 3.877 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.546 5.110 5.811 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.944 5.995 5.234 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -12.659 6.015 2.303 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -11.721 2.925 5.148 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -12.788 4.313 0.497 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -11.852 1.224 3.349 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.347 1.925 1.017 1.00 0.00 H new ATOM 276 N ILE A 17 -9.640 7.154 6.500 1.00 0.00 N ATOM 277 CA ILE A 17 -9.135 7.839 7.686 1.00 0.00 C ATOM 278 C ILE A 17 -8.746 9.274 7.329 1.00 0.00 C ATOM 279 O ILE A 17 -9.035 10.181 8.113 1.00 0.00 O ATOM 280 CB ILE A 17 -7.981 7.028 8.330 1.00 0.00 C ATOM 281 CG1 ILE A 17 -8.550 5.703 8.901 1.00 0.00 C ATOM 282 CG2 ILE A 17 -7.270 7.812 9.450 1.00 0.00 C ATOM 283 CD1 ILE A 17 -7.506 4.691 9.382 1.00 0.00 C ATOM 0 H ILE A 17 -9.123 6.304 6.273 1.00 0.00 H new ATOM 0 HA ILE A 17 -9.918 7.904 8.442 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.241 6.826 7.556 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -9.211 5.941 9.734 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -9.162 5.230 8.133 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.470 7.202 9.870 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -6.849 8.731 9.041 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.987 8.059 10.233 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -8.009 3.802 9.762 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.858 4.414 8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -6.907 5.136 10.177 1.00 0.00 H new ATOM 295 N GLN A 18 -8.111 9.501 6.173 1.00 0.00 N ATOM 296 CA GLN A 18 -7.722 10.856 5.795 1.00 0.00 C ATOM 297 C GLN A 18 -8.909 11.659 5.243 1.00 0.00 C ATOM 298 O GLN A 18 -8.896 12.891 5.315 1.00 0.00 O ATOM 299 CB GLN A 18 -6.595 10.852 4.758 1.00 0.00 C ATOM 300 CG GLN A 18 -5.456 9.837 4.919 1.00 0.00 C ATOM 301 CD GLN A 18 -5.010 9.569 6.356 1.00 0.00 C ATOM 302 OE1 GLN A 18 -4.611 10.474 7.090 1.00 0.00 O ATOM 303 NE2 GLN A 18 -5.060 8.318 6.769 1.00 0.00 N ATOM 0 H GLN A 18 -7.862 8.778 5.498 1.00 0.00 H new ATOM 0 HA GLN A 18 -7.366 11.335 6.707 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.046 10.692 3.779 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -6.152 11.848 4.746 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -5.768 8.893 4.472 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.596 10.190 4.350 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -5.395 7.587 6.141 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -4.764 8.081 7.716 1.00 0.00 H new ATOM 312 N GLY A 19 -9.909 10.978 4.674 1.00 0.00 N ATOM 313 CA GLY A 19 -11.108 11.590 4.121 1.00 0.00 C ATOM 314 C GLY A 19 -10.996 11.851 2.621 1.00 0.00 C ATOM 315 O GLY A 19 -11.616 12.789 2.118 1.00 0.00 O ATOM 0 H GLY A 19 -9.901 9.962 4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.963 10.941 4.310 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.302 12.531 4.636 1.00 0.00 H new ATOM 319 N ILE A 20 -10.181 11.078 1.900 1.00 0.00 N ATOM 320 CA ILE A 20 -9.914 11.290 0.482 1.00 0.00 C ATOM 321 C ILE A 20 -11.113 10.779 -0.314 1.00 0.00 C ATOM 322 O ILE A 20 -11.355 9.573 -0.350 1.00 0.00 O ATOM 323 CB ILE A 20 -8.614 10.556 0.102 1.00 0.00 C ATOM 324 CG1 ILE A 20 -7.396 11.088 0.889 1.00 0.00 C ATOM 325 CG2 ILE A 20 -8.309 10.651 -1.404 1.00 0.00 C ATOM 326 CD1 ILE A 20 -6.440 9.930 1.177 1.00 0.00 C ATOM 0 H ILE A 20 -9.684 10.279 2.292 1.00 0.00 H new ATOM 0 HA ILE A 20 -9.777 12.347 0.256 1.00 0.00 H new ATOM 0 HB ILE A 20 -8.783 9.512 0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -6.887 11.862 0.315 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.723 11.547 1.822 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -7.383 10.118 -1.622 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -9.127 10.204 -1.970 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.201 11.698 -1.688 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.578 10.299 1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.954 9.172 1.767 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.105 9.492 0.237 1.00 0.00 H new ATOM 338 N ASP A 21 -11.887 11.678 -0.928 1.00 0.00 N ATOM 339 CA ASP A 21 -13.017 11.312 -1.793 1.00 0.00 C ATOM 340 C ASP A 21 -12.467 10.615 -3.035 1.00 0.00 C ATOM 341 O ASP A 21 -11.776 11.233 -3.854 1.00 0.00 O ATOM 342 CB ASP A 21 -13.859 12.535 -2.174 1.00 0.00 C ATOM 343 CG ASP A 21 -15.145 12.143 -2.918 1.00 0.00 C ATOM 344 OD1 ASP A 21 -15.105 11.909 -4.148 1.00 0.00 O ATOM 345 OD2 ASP A 21 -16.223 12.117 -2.283 1.00 0.00 O ATOM 0 H ASP A 21 -11.749 12.685 -0.840 1.00 0.00 H new ATOM 0 HA ASP A 21 -13.680 10.637 -1.252 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.117 13.091 -1.273 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.267 13.201 -2.801 1.00 0.00 H new ATOM 350 N ILE A 22 -12.681 9.309 -3.149 1.00 0.00 N ATOM 351 CA ILE A 22 -12.327 8.502 -4.305 1.00 0.00 C ATOM 352 C ILE A 22 -13.420 7.424 -4.445 1.00 0.00 C ATOM 353 O ILE A 22 -14.324 7.332 -3.610 1.00 0.00 O ATOM 354 CB ILE A 22 -10.825 8.079 -4.233 1.00 0.00 C ATOM 355 CG1 ILE A 22 -10.336 7.177 -5.386 1.00 0.00 C ATOM 356 CG2 ILE A 22 -10.386 7.469 -2.891 1.00 0.00 C ATOM 357 CD1 ILE A 22 -10.447 7.826 -6.768 1.00 0.00 C ATOM 0 H ILE A 22 -13.123 8.765 -2.408 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.338 9.029 -5.259 1.00 0.00 H new ATOM 0 HB ILE A 22 -10.335 9.047 -4.341 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.296 6.904 -5.205 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.913 6.253 -5.382 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.329 7.207 -2.939 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.545 8.194 -2.093 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.973 6.573 -2.689 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -10.085 7.132 -7.526 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.489 8.074 -6.971 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -9.847 8.735 -6.792 1.00 0.00 H new ATOM 369 N GLU A 23 -13.420 6.688 -5.552 1.00 0.00 N ATOM 370 CA GLU A 23 -14.472 5.785 -5.993 1.00 0.00 C ATOM 371 C GLU A 23 -13.800 4.524 -6.512 1.00 0.00 C ATOM 372 O GLU A 23 -12.741 4.654 -7.118 1.00 0.00 O ATOM 373 CB GLU A 23 -15.325 6.494 -7.061 1.00 0.00 C ATOM 374 CG GLU A 23 -14.590 6.824 -8.370 1.00 0.00 C ATOM 375 CD GLU A 23 -15.376 7.767 -9.282 1.00 0.00 C ATOM 376 OE1 GLU A 23 -16.563 8.073 -9.004 1.00 0.00 O ATOM 377 OE2 GLU A 23 -14.779 8.186 -10.299 1.00 0.00 O ATOM 0 H GLU A 23 -12.636 6.709 -6.204 1.00 0.00 H new ATOM 0 HA GLU A 23 -15.148 5.507 -5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -16.184 5.865 -7.294 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -15.713 7.420 -6.637 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -13.627 7.277 -8.134 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -14.384 5.898 -8.907 1.00 0.00 H new ATOM 384 N GLY A 24 -14.373 3.347 -6.234 1.00 0.00 N ATOM 385 CA GLY A 24 -13.685 2.068 -6.276 1.00 0.00 C ATOM 386 C GLY A 24 -14.399 0.959 -5.529 1.00 0.00 C ATOM 387 O GLY A 24 -15.631 0.958 -5.427 1.00 0.00 O ATOM 0 H GLY A 24 -15.354 3.265 -5.967 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.559 1.769 -7.317 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -12.686 2.190 -5.857 1.00 0.00 H new ATOM 391 N TYR A 25 -13.612 0.033 -4.977 1.00 0.00 N ATOM 392 CA TYR A 25 -14.096 -0.985 -4.046 1.00 0.00 C ATOM 393 C TYR A 25 -13.436 -0.840 -2.667 1.00 0.00 C ATOM 394 O TYR A 25 -12.309 -0.345 -2.567 1.00 0.00 O ATOM 395 CB TYR A 25 -13.859 -2.378 -4.638 1.00 0.00 C ATOM 396 CG TYR A 25 -14.678 -2.673 -5.884 1.00 0.00 C ATOM 397 CD1 TYR A 25 -16.032 -3.071 -5.797 1.00 0.00 C ATOM 398 CD2 TYR A 25 -14.083 -2.498 -7.148 1.00 0.00 C ATOM 399 CE1 TYR A 25 -16.782 -3.258 -6.971 1.00 0.00 C ATOM 400 CE2 TYR A 25 -14.823 -2.706 -8.323 1.00 0.00 C ATOM 401 CZ TYR A 25 -16.184 -3.075 -8.235 1.00 0.00 C ATOM 402 OH TYR A 25 -16.929 -3.263 -9.355 1.00 0.00 O ATOM 0 H TYR A 25 -12.612 -0.031 -5.166 1.00 0.00 H new ATOM 0 HA TYR A 25 -15.167 -0.846 -3.899 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -12.801 -2.483 -4.879 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -14.089 -3.127 -3.880 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -16.489 -3.231 -4.831 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -13.047 -2.201 -7.214 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -17.822 -3.543 -6.905 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -14.355 -2.585 -9.289 1.00 0.00 H new ATOM 0 HH TYR A 25 -16.376 -3.098 -10.147 1.00 0.00 H new ATOM 412 N THR A 26 -14.135 -1.282 -1.616 1.00 0.00 N ATOM 413 CA THR A 26 -13.650 -1.373 -0.241 1.00 0.00 C ATOM 414 C THR A 26 -13.938 -2.761 0.369 1.00 0.00 C ATOM 415 O THR A 26 -14.904 -3.436 -0.007 1.00 0.00 O ATOM 416 CB THR A 26 -14.271 -0.233 0.574 1.00 0.00 C ATOM 417 OG1 THR A 26 -13.621 -0.092 1.814 1.00 0.00 O ATOM 418 CG2 THR A 26 -15.777 -0.401 0.792 1.00 0.00 C ATOM 0 H THR A 26 -15.100 -1.600 -1.709 1.00 0.00 H new ATOM 0 HA THR A 26 -12.566 -1.263 -0.224 1.00 0.00 H new ATOM 0 HB THR A 26 -14.131 0.672 -0.017 1.00 0.00 H new ATOM 0 HG1 THR A 26 -13.345 0.841 1.935 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.156 0.438 1.375 1.00 0.00 H new ATOM 0 HG22 THR A 26 -16.283 -0.430 -0.173 1.00 0.00 H new ATOM 0 HG23 THR A 26 -15.965 -1.331 1.329 1.00 0.00 H new ATOM 426 N THR A 27 -13.119 -3.151 1.353 1.00 0.00 N ATOM 427 CA THR A 27 -13.063 -4.480 1.952 1.00 0.00 C ATOM 428 C THR A 27 -13.982 -4.599 3.204 1.00 0.00 C ATOM 429 O THR A 27 -13.758 -3.953 4.248 1.00 0.00 O ATOM 430 CB THR A 27 -11.590 -4.901 2.178 1.00 0.00 C ATOM 431 OG1 THR A 27 -10.727 -3.790 2.362 1.00 0.00 O ATOM 432 CG2 THR A 27 -10.939 -5.680 1.027 1.00 0.00 C ATOM 0 H THR A 27 -12.444 -2.511 1.771 1.00 0.00 H new ATOM 0 HA THR A 27 -13.480 -5.207 1.255 1.00 0.00 H new ATOM 0 HB THR A 27 -11.684 -5.532 3.062 1.00 0.00 H new ATOM 0 HG1 THR A 27 -9.795 -4.093 2.343 1.00 0.00 H new ATOM 0 HG21 THR A 27 -9.910 -5.925 1.290 1.00 0.00 H new ATOM 0 HG22 THR A 27 -11.496 -6.600 0.849 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.948 -5.070 0.124 1.00 0.00 H new ATOM 440 N PRO A 28 -15.049 -5.423 3.138 1.00 0.00 N ATOM 441 CA PRO A 28 -16.043 -5.549 4.204 1.00 0.00 C ATOM 442 C PRO A 28 -15.527 -6.243 5.473 1.00 0.00 C ATOM 443 O PRO A 28 -16.225 -6.229 6.488 1.00 0.00 O ATOM 444 CB PRO A 28 -17.215 -6.328 3.605 1.00 0.00 C ATOM 445 CG PRO A 28 -16.610 -7.085 2.430 1.00 0.00 C ATOM 446 CD PRO A 28 -15.447 -6.218 1.988 1.00 0.00 C ATOM 0 HA PRO A 28 -16.327 -4.551 4.539 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -17.652 -7.010 4.334 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -18.011 -5.659 3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -16.275 -8.079 2.727 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -17.335 -7.219 1.627 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -14.618 -6.834 1.639 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -15.739 -5.575 1.157 1.00 0.00 H new ATOM 454 N SER A 29 -14.345 -6.860 5.437 1.00 0.00 N ATOM 455 CA SER A 29 -13.609 -7.311 6.614 1.00 0.00 C ATOM 456 C SER A 29 -13.048 -6.111 7.369 1.00 0.00 C ATOM 457 O SER A 29 -13.126 -6.065 8.597 1.00 0.00 O ATOM 458 CB SER A 29 -12.507 -8.264 6.128 1.00 0.00 C ATOM 459 OG SER A 29 -11.814 -8.923 7.163 1.00 0.00 O ATOM 0 H SER A 29 -13.862 -7.064 4.562 1.00 0.00 H new ATOM 0 HA SER A 29 -14.256 -7.841 7.313 1.00 0.00 H new ATOM 0 HB2 SER A 29 -12.952 -9.011 5.471 1.00 0.00 H new ATOM 0 HB3 SER A 29 -11.792 -7.699 5.530 1.00 0.00 H new ATOM 0 HG SER A 29 -11.129 -9.509 6.777 1.00 0.00 H new ATOM 465 N VAL A 30 -12.534 -5.113 6.648 1.00 0.00 N ATOM 466 CA VAL A 30 -11.788 -4.022 7.227 1.00 0.00 C ATOM 467 C VAL A 30 -12.756 -3.099 7.928 1.00 0.00 C ATOM 468 O VAL A 30 -12.461 -2.637 9.028 1.00 0.00 O ATOM 469 CB VAL A 30 -11.008 -3.283 6.129 1.00 0.00 C ATOM 470 CG1 VAL A 30 -10.100 -2.203 6.711 1.00 0.00 C ATOM 471 CG2 VAL A 30 -10.162 -4.285 5.347 1.00 0.00 C ATOM 0 H VAL A 30 -12.632 -5.050 5.635 1.00 0.00 H new ATOM 0 HA VAL A 30 -11.065 -4.396 7.952 1.00 0.00 H new ATOM 0 HB VAL A 30 -11.730 -2.799 5.471 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -9.565 -1.703 5.903 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -10.703 -1.474 7.253 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.383 -2.659 7.393 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -9.608 -3.763 4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -9.462 -4.776 6.023 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -10.812 -5.033 4.892 1.00 0.00 H new ATOM 481 N VAL A 31 -13.920 -2.853 7.316 1.00 0.00 N ATOM 482 CA VAL A 31 -14.858 -1.927 7.947 1.00 0.00 C ATOM 483 C VAL A 31 -15.307 -2.369 9.333 1.00 0.00 C ATOM 484 O VAL A 31 -15.692 -1.524 10.136 1.00 0.00 O ATOM 485 CB VAL A 31 -16.044 -1.653 7.033 1.00 0.00 C ATOM 486 CG1 VAL A 31 -17.000 -2.825 6.834 1.00 0.00 C ATOM 487 CG2 VAL A 31 -16.830 -0.412 7.480 1.00 0.00 C ATOM 0 H VAL A 31 -14.222 -3.259 6.431 1.00 0.00 H new ATOM 0 HA VAL A 31 -14.316 -0.994 8.100 1.00 0.00 H new ATOM 0 HB VAL A 31 -15.585 -1.474 6.061 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -17.809 -2.526 6.167 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -16.460 -3.664 6.396 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -17.415 -3.123 7.797 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -17.669 -0.249 6.803 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -17.205 -0.564 8.492 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -16.175 0.459 7.463 1.00 0.00 H new ATOM 497 N GLU A 32 -15.239 -3.665 9.647 1.00 0.00 N ATOM 498 CA GLU A 32 -15.655 -4.099 10.966 1.00 0.00 C ATOM 499 C GLU A 32 -14.665 -3.612 12.037 1.00 0.00 C ATOM 500 O GLU A 32 -15.000 -3.531 13.220 1.00 0.00 O ATOM 501 CB GLU A 32 -15.789 -5.627 11.011 1.00 0.00 C ATOM 502 CG GLU A 32 -16.928 -6.145 10.127 1.00 0.00 C ATOM 503 CD GLU A 32 -16.997 -7.671 10.147 1.00 0.00 C ATOM 504 OE1 GLU A 32 -16.018 -8.336 9.735 1.00 0.00 O ATOM 505 OE2 GLU A 32 -18.066 -8.231 10.491 1.00 0.00 O ATOM 0 H GLU A 32 -14.911 -4.403 9.025 1.00 0.00 H new ATOM 0 HA GLU A 32 -16.630 -3.660 11.179 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -14.851 -6.080 10.691 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -15.960 -5.943 12.040 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -17.876 -5.732 10.472 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -16.783 -5.799 9.104 1.00 0.00 H new ATOM 512 N GLU A 33 -13.437 -3.276 11.633 1.00 0.00 N ATOM 513 CA GLU A 33 -12.411 -2.695 12.478 1.00 0.00 C ATOM 514 C GLU A 33 -12.598 -1.171 12.507 1.00 0.00 C ATOM 515 O GLU A 33 -12.435 -0.554 13.562 1.00 0.00 O ATOM 516 CB GLU A 33 -11.034 -3.129 11.940 1.00 0.00 C ATOM 517 CG GLU A 33 -9.917 -3.150 12.995 1.00 0.00 C ATOM 518 CD GLU A 33 -9.105 -1.854 13.068 1.00 0.00 C ATOM 519 OE1 GLU A 33 -8.097 -1.722 12.334 1.00 0.00 O ATOM 520 OE2 GLU A 33 -9.474 -0.947 13.859 1.00 0.00 O ATOM 0 H GLU A 33 -13.127 -3.410 10.671 1.00 0.00 H new ATOM 0 HA GLU A 33 -12.484 -3.045 13.508 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -11.125 -4.124 11.505 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -10.743 -2.455 11.134 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -10.358 -3.346 13.972 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -9.242 -3.978 12.778 1.00 0.00 H new ATOM 527 N ILE A 34 -12.991 -0.568 11.377 1.00 0.00 N ATOM 528 CA ILE A 34 -13.263 0.861 11.243 1.00 0.00 C ATOM 529 C ILE A 34 -14.495 1.233 12.079 1.00 0.00 C ATOM 530 O ILE A 34 -15.639 1.157 11.626 1.00 0.00 O ATOM 531 CB ILE A 34 -13.390 1.300 9.764 1.00 0.00 C ATOM 532 CG1 ILE A 34 -12.126 0.872 8.985 1.00 0.00 C ATOM 533 CG2 ILE A 34 -13.571 2.830 9.694 1.00 0.00 C ATOM 534 CD1 ILE A 34 -12.044 1.381 7.546 1.00 0.00 C ATOM 0 H ILE A 34 -13.131 -1.081 10.507 1.00 0.00 H new ATOM 0 HA ILE A 34 -12.409 1.414 11.633 1.00 0.00 H new ATOM 0 HB ILE A 34 -14.259 0.821 9.313 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.248 1.223 9.528 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -12.079 -0.217 8.971 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -13.660 3.139 8.652 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -14.473 3.115 10.235 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.708 3.320 10.145 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -11.121 1.026 7.087 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -12.898 1.009 6.979 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -12.054 2.471 7.544 1.00 0.00 H new ATOM 546 N LYS A 35 -14.252 1.691 13.305 1.00 0.00 N ATOM 547 CA LYS A 35 -15.263 2.298 14.170 1.00 0.00 C ATOM 548 C LYS A 35 -15.102 3.809 14.244 1.00 0.00 C ATOM 549 O LYS A 35 -16.065 4.491 14.609 1.00 0.00 O ATOM 550 CB LYS A 35 -15.221 1.652 15.559 1.00 0.00 C ATOM 551 CG LYS A 35 -13.926 1.915 16.345 1.00 0.00 C ATOM 552 CD LYS A 35 -13.954 3.199 17.190 1.00 0.00 C ATOM 553 CE LYS A 35 -12.737 3.321 18.107 1.00 0.00 C ATOM 554 NZ LYS A 35 -12.672 2.251 19.122 1.00 0.00 N ATOM 0 H LYS A 35 -13.328 1.650 13.734 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.246 2.111 13.737 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.066 2.019 16.142 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -15.352 0.576 15.449 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.733 1.066 17.000 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -13.093 1.972 15.644 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -13.995 4.065 16.529 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.862 3.214 17.792 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -11.830 3.297 17.503 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -12.762 4.289 18.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -11.978 2.508 19.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -13.608 2.130 19.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -12.384 1.360 18.669 1.00 0.00 H new ATOM 568 N ASP A 36 -13.893 4.308 13.959 1.00 0.00 N ATOM 569 CA ASP A 36 -13.528 5.718 14.067 1.00 0.00 C ATOM 570 C ASP A 36 -14.502 6.539 13.242 1.00 0.00 C ATOM 571 O ASP A 36 -14.668 6.264 12.052 1.00 0.00 O ATOM 572 CB ASP A 36 -12.096 5.982 13.589 1.00 0.00 C ATOM 573 CG ASP A 36 -11.655 7.389 13.998 1.00 0.00 C ATOM 574 OD1 ASP A 36 -12.215 8.385 13.490 1.00 0.00 O ATOM 575 OD2 ASP A 36 -10.764 7.490 14.878 1.00 0.00 O ATOM 0 H ASP A 36 -13.123 3.722 13.638 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.576 6.003 15.118 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.420 5.242 14.017 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.041 5.876 12.506 1.00 0.00 H new ATOM 580 N ARG A 37 -15.184 7.488 13.885 1.00 0.00 N ATOM 581 CA ARG A 37 -16.293 8.223 13.293 1.00 0.00 C ATOM 582 C ARG A 37 -15.929 8.786 11.937 1.00 0.00 C ATOM 583 O ARG A 37 -16.717 8.582 11.022 1.00 0.00 O ATOM 584 CB ARG A 37 -16.799 9.349 14.211 1.00 0.00 C ATOM 585 CG ARG A 37 -17.836 8.848 15.226 1.00 0.00 C ATOM 586 CD ARG A 37 -18.832 9.950 15.602 1.00 0.00 C ATOM 587 NE ARG A 37 -18.228 11.043 16.375 1.00 0.00 N ATOM 588 CZ ARG A 37 -18.213 11.140 17.708 1.00 0.00 C ATOM 589 NH1 ARG A 37 -18.562 10.107 18.468 1.00 0.00 N ATOM 590 NH2 ARG A 37 -17.863 12.283 18.287 1.00 0.00 N ATOM 0 H ARG A 37 -14.976 7.768 14.843 1.00 0.00 H new ATOM 0 HA ARG A 37 -17.101 7.503 13.165 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.955 9.788 14.743 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -17.240 10.140 13.604 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -18.374 7.997 14.808 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -17.327 8.494 16.123 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -19.272 10.358 14.692 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -19.646 9.512 16.180 1.00 0.00 H new ATOM 0 HE ARG A 37 -17.781 11.794 15.849 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -18.845 9.228 18.035 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -18.546 10.193 19.484 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.606 13.087 17.714 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -17.852 12.357 19.304 1.00 0.00 H new ATOM 604 N GLU A 38 -14.789 9.463 11.807 1.00 0.00 N ATOM 605 CA GLU A 38 -14.485 10.239 10.610 1.00 0.00 C ATOM 606 C GLU A 38 -14.475 9.282 9.424 1.00 0.00 C ATOM 607 O GLU A 38 -15.335 9.353 8.545 1.00 0.00 O ATOM 608 CB GLU A 38 -13.139 10.966 10.784 1.00 0.00 C ATOM 609 CG GLU A 38 -13.191 12.063 11.850 1.00 0.00 C ATOM 610 CD GLU A 38 -13.790 13.366 11.329 1.00 0.00 C ATOM 611 OE1 GLU A 38 -13.157 14.077 10.522 1.00 0.00 O ATOM 612 OE2 GLU A 38 -14.871 13.752 11.829 1.00 0.00 O ATOM 0 H GLU A 38 -14.060 9.488 12.520 1.00 0.00 H new ATOM 0 HA GLU A 38 -15.237 11.008 10.436 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.371 10.240 11.053 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.843 11.405 9.831 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.779 11.712 12.698 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.183 12.254 12.218 1.00 0.00 H new ATOM 619 N SER A 39 -13.563 8.311 9.515 1.00 0.00 N ATOM 620 CA SER A 39 -13.341 7.237 8.571 1.00 0.00 C ATOM 621 C SER A 39 -14.648 6.512 8.258 1.00 0.00 C ATOM 622 O SER A 39 -15.020 6.385 7.097 1.00 0.00 O ATOM 623 CB SER A 39 -12.290 6.310 9.198 1.00 0.00 C ATOM 624 OG SER A 39 -11.822 5.339 8.293 1.00 0.00 O ATOM 0 H SER A 39 -12.922 8.260 10.307 1.00 0.00 H new ATOM 0 HA SER A 39 -12.978 7.613 7.614 1.00 0.00 H new ATOM 0 HB2 SER A 39 -11.450 6.906 9.554 1.00 0.00 H new ATOM 0 HB3 SER A 39 -12.720 5.814 10.068 1.00 0.00 H new ATOM 0 HG SER A 39 -11.279 4.679 8.773 1.00 0.00 H new ATOM 630 N LYS A 40 -15.360 6.043 9.288 1.00 0.00 N ATOM 631 CA LYS A 40 -16.600 5.289 9.163 1.00 0.00 C ATOM 632 C LYS A 40 -17.646 6.086 8.405 1.00 0.00 C ATOM 633 O LYS A 40 -18.101 5.614 7.372 1.00 0.00 O ATOM 634 CB LYS A 40 -17.077 4.879 10.560 1.00 0.00 C ATOM 635 CG LYS A 40 -18.426 4.152 10.507 1.00 0.00 C ATOM 636 CD LYS A 40 -18.808 3.560 11.870 1.00 0.00 C ATOM 637 CE LYS A 40 -18.846 4.663 12.935 1.00 0.00 C ATOM 638 NZ LYS A 40 -19.426 4.194 14.204 1.00 0.00 N ATOM 0 H LYS A 40 -15.076 6.185 10.258 1.00 0.00 H new ATOM 0 HA LYS A 40 -16.426 4.384 8.581 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -16.333 4.232 11.023 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -17.165 5.765 11.189 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -19.201 4.847 10.182 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -18.381 3.355 9.764 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -19.782 3.075 11.804 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -18.088 2.793 12.156 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -17.834 5.028 13.113 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -19.428 5.506 12.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -19.431 4.973 14.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -20.401 3.870 14.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -18.857 3.407 14.576 1.00 0.00 H new ATOM 652 N ILE A 41 -18.079 7.234 8.927 1.00 0.00 N ATOM 653 CA ILE A 41 -19.182 8.017 8.367 1.00 0.00 C ATOM 654 C ILE A 41 -18.859 8.329 6.906 1.00 0.00 C ATOM 655 O ILE A 41 -19.718 8.189 6.036 1.00 0.00 O ATOM 656 CB ILE A 41 -19.406 9.304 9.198 1.00 0.00 C ATOM 657 CG1 ILE A 41 -19.797 8.991 10.662 1.00 0.00 C ATOM 658 CG2 ILE A 41 -20.494 10.200 8.573 1.00 0.00 C ATOM 659 CD1 ILE A 41 -19.482 10.154 11.607 1.00 0.00 C ATOM 0 H ILE A 41 -17.668 7.652 9.762 1.00 0.00 H new ATOM 0 HA ILE A 41 -20.112 7.450 8.409 1.00 0.00 H new ATOM 0 HB ILE A 41 -18.453 9.834 9.193 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -20.862 8.764 10.711 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -19.265 8.100 10.996 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -20.624 11.094 9.183 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -20.193 10.489 7.566 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -21.435 9.652 8.528 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -19.774 9.887 12.623 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -18.413 10.365 11.580 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -20.034 11.039 11.292 1.00 0.00 H new ATOM 671 N PHE A 42 -17.613 8.711 6.636 1.00 0.00 N ATOM 672 CA PHE A 42 -17.124 8.972 5.302 1.00 0.00 C ATOM 673 C PHE A 42 -17.242 7.725 4.411 1.00 0.00 C ATOM 674 O PHE A 42 -17.872 7.789 3.360 1.00 0.00 O ATOM 675 CB PHE A 42 -15.696 9.494 5.445 1.00 0.00 C ATOM 676 CG PHE A 42 -15.013 9.745 4.133 1.00 0.00 C ATOM 677 CD1 PHE A 42 -15.496 10.740 3.264 1.00 0.00 C ATOM 678 CD2 PHE A 42 -13.902 8.965 3.779 1.00 0.00 C ATOM 679 CE1 PHE A 42 -14.870 10.941 2.032 1.00 0.00 C ATOM 680 CE2 PHE A 42 -13.266 9.171 2.549 1.00 0.00 C ATOM 681 CZ PHE A 42 -13.776 10.145 1.679 1.00 0.00 C ATOM 0 H PHE A 42 -16.907 8.848 7.360 1.00 0.00 H new ATOM 0 HA PHE A 42 -17.727 9.726 4.795 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -15.713 10.420 6.019 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -15.111 8.774 6.018 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -16.345 11.344 3.548 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -13.537 8.206 4.455 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -15.228 11.705 1.358 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -12.398 8.590 2.275 1.00 0.00 H new ATOM 0 HZ PHE A 42 -13.313 10.284 0.713 1.00 0.00 H new ATOM 691 N LEU A 43 -16.710 6.576 4.827 1.00 0.00 N ATOM 692 CA LEU A 43 -16.800 5.300 4.113 1.00 0.00 C ATOM 693 C LEU A 43 -18.265 4.944 3.829 1.00 0.00 C ATOM 694 O LEU A 43 -18.604 4.584 2.700 1.00 0.00 O ATOM 695 CB LEU A 43 -16.024 4.260 4.945 1.00 0.00 C ATOM 696 CG LEU A 43 -16.322 2.760 4.803 1.00 0.00 C ATOM 697 CD1 LEU A 43 -16.165 2.152 3.414 1.00 0.00 C ATOM 698 CD2 LEU A 43 -15.321 2.034 5.708 1.00 0.00 C ATOM 0 H LEU A 43 -16.187 6.504 5.700 1.00 0.00 H new ATOM 0 HA LEU A 43 -16.342 5.342 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -14.966 4.399 4.725 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -16.168 4.517 5.994 1.00 0.00 H new ATOM 0 HG LEU A 43 -17.376 2.645 5.056 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -16.405 1.089 3.453 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -16.841 2.652 2.720 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -15.137 2.280 3.075 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -15.488 0.959 5.646 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -14.306 2.263 5.385 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -15.457 2.363 6.738 1.00 0.00 H new ATOM 710 N GLU A 44 -19.157 5.114 4.805 1.00 0.00 N ATOM 711 CA GLU A 44 -20.587 4.885 4.631 1.00 0.00 C ATOM 712 C GLU A 44 -21.172 5.829 3.574 1.00 0.00 C ATOM 713 O GLU A 44 -22.055 5.424 2.812 1.00 0.00 O ATOM 714 CB GLU A 44 -21.366 5.073 5.939 1.00 0.00 C ATOM 715 CG GLU A 44 -20.836 4.320 7.174 1.00 0.00 C ATOM 716 CD GLU A 44 -21.957 3.542 7.855 1.00 0.00 C ATOM 717 OE1 GLU A 44 -22.259 2.404 7.439 1.00 0.00 O ATOM 718 OE2 GLU A 44 -22.574 4.094 8.800 1.00 0.00 O ATOM 0 H GLU A 44 -18.903 5.417 5.745 1.00 0.00 H new ATOM 0 HA GLU A 44 -20.692 3.850 4.304 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -21.387 6.137 6.173 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -22.397 4.764 5.768 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -20.042 3.636 6.875 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -20.399 5.028 7.878 1.00 0.00 H new ATOM 725 N SER A 45 -20.732 7.092 3.541 1.00 0.00 N ATOM 726 CA SER A 45 -21.163 8.093 2.571 1.00 0.00 C ATOM 727 C SER A 45 -20.900 7.573 1.175 1.00 0.00 C ATOM 728 O SER A 45 -21.790 7.577 0.327 1.00 0.00 O ATOM 729 CB SER A 45 -20.401 9.411 2.764 1.00 0.00 C ATOM 730 OG SER A 45 -21.038 10.454 2.045 1.00 0.00 O ATOM 0 H SER A 45 -20.048 7.451 4.208 1.00 0.00 H new ATOM 0 HA SER A 45 -22.227 8.281 2.717 1.00 0.00 H new ATOM 0 HB2 SER A 45 -20.358 9.663 3.824 1.00 0.00 H new ATOM 0 HB3 SER A 45 -19.372 9.299 2.421 1.00 0.00 H new ATOM 0 HG SER A 45 -20.545 11.291 2.176 1.00 0.00 H new ATOM 736 N LEU A 46 -19.670 7.126 0.944 1.00 0.00 N ATOM 737 CA LEU A 46 -19.186 6.753 -0.367 1.00 0.00 C ATOM 738 C LEU A 46 -19.905 5.512 -0.886 1.00 0.00 C ATOM 739 O LEU A 46 -20.184 5.432 -2.086 1.00 0.00 O ATOM 740 CB LEU A 46 -17.682 6.509 -0.272 1.00 0.00 C ATOM 741 CG LEU A 46 -16.854 7.739 0.138 1.00 0.00 C ATOM 742 CD1 LEU A 46 -15.416 7.283 0.203 1.00 0.00 C ATOM 743 CD2 LEU A 46 -16.895 8.919 -0.827 1.00 0.00 C ATOM 0 H LEU A 46 -18.974 7.013 1.681 1.00 0.00 H new ATOM 0 HA LEU A 46 -19.388 7.558 -1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -17.502 5.711 0.448 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -17.324 6.153 -1.238 1.00 0.00 H new ATOM 0 HG LEU A 46 -17.278 8.098 1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -14.781 8.121 0.491 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -15.320 6.485 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -15.107 6.913 -0.775 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -16.277 9.728 -0.438 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -16.515 8.607 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -17.923 9.266 -0.934 1.00 0.00 H new ATOM 755 N ILE A 47 -20.231 4.565 -0.001 1.00 0.00 N ATOM 756 CA ILE A 47 -21.052 3.408 -0.342 1.00 0.00 C ATOM 757 C ILE A 47 -22.435 3.896 -0.783 1.00 0.00 C ATOM 758 O ILE A 47 -22.928 3.448 -1.821 1.00 0.00 O ATOM 759 CB ILE A 47 -21.112 2.399 0.832 1.00 0.00 C ATOM 760 CG1 ILE A 47 -19.718 1.846 1.214 1.00 0.00 C ATOM 761 CG2 ILE A 47 -22.018 1.198 0.487 1.00 0.00 C ATOM 762 CD1 ILE A 47 -19.664 1.330 2.656 1.00 0.00 C ATOM 0 H ILE A 47 -19.930 4.583 0.973 1.00 0.00 H new ATOM 0 HA ILE A 47 -20.604 2.864 -1.174 1.00 0.00 H new ATOM 0 HB ILE A 47 -21.517 2.956 1.677 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -19.453 1.038 0.533 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -18.972 2.630 1.084 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -22.041 0.506 1.329 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -23.028 1.552 0.280 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -21.625 0.687 -0.392 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -18.664 0.954 2.871 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -19.901 2.143 3.342 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -20.389 0.526 2.782 1.00 0.00 H new ATOM 774 N SER A 48 -23.053 4.802 -0.017 1.00 0.00 N ATOM 775 CA SER A 48 -24.399 5.288 -0.298 1.00 0.00 C ATOM 776 C SER A 48 -24.455 6.124 -1.586 1.00 0.00 C ATOM 777 O SER A 48 -25.406 5.996 -2.356 1.00 0.00 O ATOM 778 CB SER A 48 -24.903 6.082 0.916 1.00 0.00 C ATOM 779 OG SER A 48 -26.259 5.777 1.194 1.00 0.00 O ATOM 0 H SER A 48 -22.630 5.216 0.814 1.00 0.00 H new ATOM 0 HA SER A 48 -25.054 4.434 -0.468 1.00 0.00 H new ATOM 0 HB2 SER A 48 -24.289 5.852 1.786 1.00 0.00 H new ATOM 0 HB3 SER A 48 -24.798 7.150 0.726 1.00 0.00 H new ATOM 0 HG SER A 48 -26.558 6.293 1.972 1.00 0.00 H new ATOM 785 N ALA A 49 -23.447 6.967 -1.830 1.00 0.00 N ATOM 786 CA ALA A 49 -23.341 7.800 -3.022 1.00 0.00 C ATOM 787 C ALA A 49 -23.062 6.967 -4.276 1.00 0.00 C ATOM 788 O ALA A 49 -23.288 7.445 -5.391 1.00 0.00 O ATOM 789 CB ALA A 49 -22.231 8.839 -2.824 1.00 0.00 C ATOM 0 H ALA A 49 -22.666 7.089 -1.186 1.00 0.00 H new ATOM 0 HA ALA A 49 -24.297 8.302 -3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -22.152 9.461 -3.715 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -22.468 9.465 -1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -21.283 8.330 -2.652 1.00 0.00 H new ATOM 795 N GLY A 50 -22.571 5.734 -4.119 1.00 0.00 N ATOM 796 CA GLY A 50 -22.329 4.808 -5.215 1.00 0.00 C ATOM 797 C GLY A 50 -20.862 4.636 -5.553 1.00 0.00 C ATOM 798 O GLY A 50 -20.511 3.756 -6.346 1.00 0.00 O ATOM 0 H GLY A 50 -22.328 5.350 -3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -22.750 3.836 -4.958 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -22.858 5.160 -6.100 1.00 0.00 H new ATOM 802 N LYS A 51 -20.004 5.489 -4.988 1.00 0.00 N ATOM 803 CA LYS A 51 -18.614 5.540 -5.386 1.00 0.00 C ATOM 804 C LYS A 51 -17.865 4.310 -4.921 1.00 0.00 C ATOM 805 O LYS A 51 -17.046 3.806 -5.683 1.00 0.00 O ATOM 806 CB LYS A 51 -17.901 6.850 -5.025 1.00 0.00 C ATOM 807 CG LYS A 51 -18.373 7.688 -3.849 1.00 0.00 C ATOM 808 CD LYS A 51 -17.855 9.134 -3.934 1.00 0.00 C ATOM 809 CE LYS A 51 -18.281 9.897 -5.183 1.00 0.00 C ATOM 810 NZ LYS A 51 -17.668 11.245 -5.199 1.00 0.00 N ATOM 0 H LYS A 51 -20.257 6.150 -4.254 1.00 0.00 H new ATOM 0 HA LYS A 51 -18.612 5.532 -6.476 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -16.853 6.607 -4.847 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -17.934 7.488 -5.908 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -19.463 7.693 -3.820 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -18.032 7.234 -2.919 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -18.201 9.680 -3.057 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -16.766 9.117 -3.890 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -17.983 9.344 -6.074 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -19.367 9.984 -5.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -17.583 11.576 -6.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -18.266 11.905 -4.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -16.724 11.202 -4.765 1.00 0.00 H new ATOM 824 N VAL A 52 -18.121 3.810 -3.716 1.00 0.00 N ATOM 825 CA VAL A 52 -17.271 2.800 -3.097 1.00 0.00 C ATOM 826 C VAL A 52 -18.112 1.553 -2.842 1.00 0.00 C ATOM 827 O VAL A 52 -18.902 1.489 -1.909 1.00 0.00 O ATOM 828 CB VAL A 52 -16.544 3.411 -1.887 1.00 0.00 C ATOM 829 CG1 VAL A 52 -15.815 2.363 -1.058 1.00 0.00 C ATOM 830 CG2 VAL A 52 -15.497 4.430 -2.368 1.00 0.00 C ATOM 0 H VAL A 52 -18.918 4.091 -3.145 1.00 0.00 H new ATOM 0 HA VAL A 52 -16.461 2.466 -3.745 1.00 0.00 H new ATOM 0 HB VAL A 52 -17.309 3.882 -1.269 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -15.318 2.846 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -16.531 1.631 -0.685 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.072 1.861 -1.678 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -14.985 4.860 -1.507 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.771 3.931 -3.010 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.992 5.223 -2.929 1.00 0.00 H new ATOM 840 N LYS A 53 -17.988 0.571 -3.731 1.00 0.00 N ATOM 841 CA LYS A 53 -18.721 -0.688 -3.668 1.00 0.00 C ATOM 842 C LYS A 53 -18.031 -1.654 -2.714 1.00 0.00 C ATOM 843 O LYS A 53 -16.850 -1.502 -2.414 1.00 0.00 O ATOM 844 CB LYS A 53 -18.753 -1.284 -5.077 1.00 0.00 C ATOM 845 CG LYS A 53 -19.902 -0.768 -5.956 1.00 0.00 C ATOM 846 CD LYS A 53 -21.281 -1.312 -5.555 1.00 0.00 C ATOM 847 CE LYS A 53 -21.305 -2.842 -5.447 1.00 0.00 C ATOM 848 NZ LYS A 53 -21.293 -3.521 -6.760 1.00 0.00 N ATOM 0 H LYS A 53 -17.361 0.631 -4.533 1.00 0.00 H new ATOM 0 HA LYS A 53 -19.733 -0.514 -3.303 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -17.807 -1.067 -5.572 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -18.830 -2.368 -4.998 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -19.923 0.321 -5.908 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -19.703 -1.037 -6.993 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -21.573 -0.880 -4.598 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -22.021 -0.992 -6.289 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -20.443 -3.172 -4.867 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -22.195 -3.147 -4.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -21.310 -4.551 -6.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -22.129 -3.233 -7.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -20.431 -3.257 -7.279 1.00 0.00 H new ATOM 862 N ILE A 54 -18.740 -2.701 -2.310 1.00 0.00 N ATOM 863 CA ILE A 54 -18.236 -3.691 -1.365 1.00 0.00 C ATOM 864 C ILE A 54 -17.695 -4.910 -2.099 1.00 0.00 C ATOM 865 O ILE A 54 -18.392 -5.515 -2.921 1.00 0.00 O ATOM 866 CB ILE A 54 -19.347 -4.088 -0.381 1.00 0.00 C ATOM 867 CG1 ILE A 54 -19.892 -2.876 0.388 1.00 0.00 C ATOM 868 CG2 ILE A 54 -18.844 -5.142 0.617 1.00 0.00 C ATOM 869 CD1 ILE A 54 -18.853 -1.971 1.047 1.00 0.00 C ATOM 0 H ILE A 54 -19.690 -2.889 -2.632 1.00 0.00 H new ATOM 0 HA ILE A 54 -17.413 -3.252 -0.800 1.00 0.00 H new ATOM 0 HB ILE A 54 -20.158 -4.510 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -20.485 -2.273 -0.300 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -20.570 -3.238 1.161 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -19.649 -5.407 1.303 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -18.522 -6.031 0.075 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -18.004 -4.737 1.182 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -19.357 -1.151 1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -18.273 -2.547 1.768 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -18.186 -1.567 0.285 1.00 0.00 H new ATOM 881 N ALA A 55 -16.476 -5.309 -1.754 1.00 0.00 N ATOM 882 CA ALA A 55 -15.825 -6.505 -2.276 1.00 0.00 C ATOM 883 C ALA A 55 -14.801 -7.025 -1.267 1.00 0.00 C ATOM 884 O ALA A 55 -13.958 -6.265 -0.800 1.00 0.00 O ATOM 885 CB ALA A 55 -15.152 -6.179 -3.612 1.00 0.00 C ATOM 0 H ALA A 55 -15.899 -4.797 -1.087 1.00 0.00 H new ATOM 0 HA ALA A 55 -16.570 -7.284 -2.439 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -14.665 -7.073 -4.002 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.903 -5.835 -4.323 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -14.408 -5.397 -3.463 1.00 0.00 H new ATOM 891 N GLU A 56 -14.872 -8.311 -0.926 1.00 0.00 N ATOM 892 CA GLU A 56 -13.842 -9.045 -0.192 1.00 0.00 C ATOM 893 C GLU A 56 -13.005 -9.903 -1.155 1.00 0.00 C ATOM 894 O GLU A 56 -13.524 -10.280 -2.208 1.00 0.00 O ATOM 895 CB GLU A 56 -14.511 -9.928 0.873 1.00 0.00 C ATOM 896 CG GLU A 56 -15.501 -10.968 0.315 1.00 0.00 C ATOM 897 CD GLU A 56 -16.479 -11.427 1.394 1.00 0.00 C ATOM 898 OE1 GLU A 56 -17.430 -10.670 1.706 1.00 0.00 O ATOM 899 OE2 GLU A 56 -16.324 -12.530 1.969 1.00 0.00 O ATOM 0 H GLU A 56 -15.677 -8.891 -1.162 1.00 0.00 H new ATOM 0 HA GLU A 56 -13.173 -8.337 0.297 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.735 -10.449 1.434 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.038 -9.286 1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.052 -10.538 -0.521 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.952 -11.826 -0.072 1.00 0.00 H new ATOM 906 N PRO A 57 -11.749 -10.233 -0.809 1.00 0.00 N ATOM 907 CA PRO A 57 -10.892 -11.149 -1.559 1.00 0.00 C ATOM 908 C PRO A 57 -11.341 -12.597 -1.446 1.00 0.00 C ATOM 909 O PRO A 57 -12.255 -12.961 -0.702 1.00 0.00 O ATOM 910 CB PRO A 57 -9.495 -10.977 -0.938 1.00 0.00 C ATOM 911 CG PRO A 57 -9.811 -10.626 0.506 1.00 0.00 C ATOM 912 CD PRO A 57 -11.050 -9.754 0.376 1.00 0.00 C ATOM 0 HA PRO A 57 -10.920 -10.919 -2.624 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.904 -11.890 -1.013 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.927 -10.188 -1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.003 -11.516 1.106 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -8.989 -10.092 0.982 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.680 -9.835 1.262 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -10.780 -8.703 0.273 1.00 0.00 H new ATOM 920 N SER A 58 -10.624 -13.431 -2.190 1.00 0.00 N ATOM 921 CA SER A 58 -10.747 -14.861 -2.171 1.00 0.00 C ATOM 922 C SER A 58 -9.586 -15.424 -1.348 1.00 0.00 C ATOM 923 O SER A 58 -8.539 -14.781 -1.218 1.00 0.00 O ATOM 924 CB SER A 58 -10.777 -15.316 -3.637 1.00 0.00 C ATOM 925 OG SER A 58 -9.533 -15.783 -4.115 1.00 0.00 O ATOM 0 H SER A 58 -9.915 -13.103 -2.846 1.00 0.00 H new ATOM 0 HA SER A 58 -11.657 -15.227 -1.696 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.518 -16.108 -3.747 1.00 0.00 H new ATOM 0 HB3 SER A 58 -11.105 -14.484 -4.259 1.00 0.00 H new ATOM 0 HG SER A 58 -8.992 -15.023 -4.417 1.00 0.00 H new ATOM 931 N LYS A 59 -9.709 -16.661 -0.869 1.00 0.00 N ATOM 932 CA LYS A 59 -8.630 -17.356 -0.170 1.00 0.00 C ATOM 933 C LYS A 59 -7.368 -17.384 -1.023 1.00 0.00 C ATOM 934 O LYS A 59 -6.261 -17.233 -0.513 1.00 0.00 O ATOM 935 CB LYS A 59 -9.111 -18.771 0.180 1.00 0.00 C ATOM 936 CG LYS A 59 -8.222 -19.523 1.183 1.00 0.00 C ATOM 937 CD LYS A 59 -7.202 -20.533 0.619 1.00 0.00 C ATOM 938 CE LYS A 59 -5.780 -19.973 0.487 1.00 0.00 C ATOM 939 NZ LYS A 59 -4.740 -21.023 0.557 1.00 0.00 N ATOM 0 H LYS A 59 -10.564 -17.211 -0.955 1.00 0.00 H new ATOM 0 HA LYS A 59 -8.377 -16.829 0.750 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -10.120 -18.706 0.587 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -9.174 -19.356 -0.738 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -7.674 -18.783 1.766 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.874 -20.056 1.876 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -7.178 -21.410 1.266 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.542 -20.869 -0.361 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.690 -19.442 -0.461 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -5.607 -19.244 1.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -3.799 -20.580 0.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.867 -21.580 1.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.821 -21.648 -0.270 1.00 0.00 H new ATOM 953 N GLU A 60 -7.521 -17.585 -2.326 1.00 0.00 N ATOM 954 CA GLU A 60 -6.413 -17.745 -3.258 1.00 0.00 C ATOM 955 C GLU A 60 -5.821 -16.379 -3.623 1.00 0.00 C ATOM 956 O GLU A 60 -4.646 -16.279 -3.978 1.00 0.00 O ATOM 957 CB GLU A 60 -6.901 -18.549 -4.476 1.00 0.00 C ATOM 958 CG GLU A 60 -7.546 -19.861 -3.986 1.00 0.00 C ATOM 959 CD GLU A 60 -7.864 -20.870 -5.083 1.00 0.00 C ATOM 960 OE1 GLU A 60 -8.450 -20.495 -6.123 1.00 0.00 O ATOM 961 OE2 GLU A 60 -7.588 -22.067 -4.843 1.00 0.00 O ATOM 0 H GLU A 60 -8.436 -17.642 -2.772 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.600 -18.308 -2.800 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.623 -17.965 -5.048 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.066 -18.766 -5.143 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -6.877 -20.330 -3.264 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.468 -19.620 -3.456 1.00 0.00 H new ATOM 968 N SER A 61 -6.599 -15.308 -3.464 1.00 0.00 N ATOM 969 CA SER A 61 -6.116 -13.940 -3.489 1.00 0.00 C ATOM 970 C SER A 61 -5.189 -13.716 -2.285 1.00 0.00 C ATOM 971 O SER A 61 -4.070 -13.250 -2.480 1.00 0.00 O ATOM 972 CB SER A 61 -7.309 -12.982 -3.518 1.00 0.00 C ATOM 973 OG SER A 61 -8.278 -13.397 -4.465 1.00 0.00 O ATOM 0 H SER A 61 -7.605 -15.376 -3.311 1.00 0.00 H new ATOM 0 HA SER A 61 -5.531 -13.744 -4.388 1.00 0.00 H new ATOM 0 HB2 SER A 61 -7.763 -12.932 -2.528 1.00 0.00 H new ATOM 0 HB3 SER A 61 -6.965 -11.977 -3.762 1.00 0.00 H new ATOM 0 HG SER A 61 -7.841 -13.572 -5.325 1.00 0.00 H new ATOM 979 N ILE A 62 -5.615 -14.085 -1.063 1.00 0.00 N ATOM 980 CA ILE A 62 -4.784 -13.983 0.145 1.00 0.00 C ATOM 981 C ILE A 62 -3.474 -14.752 -0.071 1.00 0.00 C ATOM 982 O ILE A 62 -2.379 -14.264 0.234 1.00 0.00 O ATOM 983 CB ILE A 62 -5.529 -14.514 1.403 1.00 0.00 C ATOM 984 CG1 ILE A 62 -6.896 -13.863 1.705 1.00 0.00 C ATOM 985 CG2 ILE A 62 -4.647 -14.419 2.661 1.00 0.00 C ATOM 986 CD1 ILE A 62 -6.907 -12.340 1.823 1.00 0.00 C ATOM 0 H ILE A 62 -6.546 -14.462 -0.888 1.00 0.00 H new ATOM 0 HA ILE A 62 -4.564 -12.930 0.323 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.739 -15.552 1.146 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -7.594 -14.151 0.918 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.276 -14.281 2.637 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.198 -14.798 3.521 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.744 -15.013 2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.373 -13.379 2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.920 -11.999 2.036 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.243 -12.033 2.631 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -6.566 -11.900 0.886 1.00 0.00 H new ATOM 998 N ASP A 63 -3.586 -15.974 -0.595 1.00 0.00 N ATOM 999 CA ASP A 63 -2.444 -16.862 -0.744 1.00 0.00 C ATOM 1000 C ASP A 63 -1.384 -16.242 -1.648 1.00 0.00 C ATOM 1001 O ASP A 63 -0.208 -16.304 -1.313 1.00 0.00 O ATOM 1002 CB ASP A 63 -2.877 -18.242 -1.244 1.00 0.00 C ATOM 1003 CG ASP A 63 -2.009 -19.336 -0.625 1.00 0.00 C ATOM 1004 OD1 ASP A 63 -2.283 -19.716 0.539 1.00 0.00 O ATOM 1005 OD2 ASP A 63 -1.158 -19.936 -1.310 1.00 0.00 O ATOM 0 H ASP A 63 -4.467 -16.369 -0.924 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.995 -17.001 0.239 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -3.923 -18.414 -0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -2.801 -18.281 -2.331 1.00 0.00 H new ATOM 1010 N ARG A 64 -1.775 -15.539 -2.723 1.00 0.00 N ATOM 1011 CA ARG A 64 -0.815 -14.867 -3.607 1.00 0.00 C ATOM 1012 C ARG A 64 0.088 -13.909 -2.837 1.00 0.00 C ATOM 1013 O ARG A 64 1.270 -13.801 -3.163 1.00 0.00 O ATOM 1014 CB ARG A 64 -1.527 -14.109 -4.749 1.00 0.00 C ATOM 1015 CG ARG A 64 -1.003 -14.534 -6.128 1.00 0.00 C ATOM 1016 CD ARG A 64 0.458 -14.141 -6.402 1.00 0.00 C ATOM 1017 NE ARG A 64 1.026 -14.933 -7.503 1.00 0.00 N ATOM 1018 CZ ARG A 64 0.762 -14.832 -8.813 1.00 0.00 C ATOM 1019 NH1 ARG A 64 0.020 -13.835 -9.279 1.00 0.00 N ATOM 1020 NH2 ARG A 64 1.247 -15.737 -9.655 1.00 0.00 N ATOM 0 H ARG A 64 -2.750 -15.422 -2.999 1.00 0.00 H new ATOM 0 HA ARG A 64 -0.195 -15.651 -4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.600 -14.294 -4.695 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -1.382 -13.037 -4.620 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -1.099 -15.616 -6.222 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -1.636 -14.090 -6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.512 -13.081 -6.648 1.00 0.00 H new ATOM 0 HD3 ARG A 64 1.052 -14.289 -5.500 1.00 0.00 H new ATOM 0 HE ARG A 64 1.704 -15.647 -7.237 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -0.356 -13.136 -8.638 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.175 -13.768 -10.278 1.00 0.00 H new ATOM 0 HH21 ARG A 64 1.818 -16.506 -9.304 1.00 0.00 H new ATOM 0 HH22 ARG A 64 1.048 -15.664 -10.653 1.00 0.00 H new ATOM 1034 N ILE A 65 -0.452 -13.204 -1.842 1.00 0.00 N ATOM 1035 CA ILE A 65 0.340 -12.276 -1.045 1.00 0.00 C ATOM 1036 C ILE A 65 1.328 -13.096 -0.238 1.00 0.00 C ATOM 1037 O ILE A 65 2.510 -12.780 -0.268 1.00 0.00 O ATOM 1038 CB ILE A 65 -0.522 -11.368 -0.130 1.00 0.00 C ATOM 1039 CG1 ILE A 65 -1.930 -11.052 -0.677 1.00 0.00 C ATOM 1040 CG2 ILE A 65 0.220 -10.049 0.150 1.00 0.00 C ATOM 1041 CD1 ILE A 65 -1.951 -10.590 -2.132 1.00 0.00 C ATOM 0 H ILE A 65 -1.434 -13.260 -1.572 1.00 0.00 H new ATOM 0 HA ILE A 65 0.860 -11.589 -1.713 1.00 0.00 H new ATOM 0 HB ILE A 65 -0.673 -11.940 0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.552 -11.942 -0.582 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.383 -10.279 -0.056 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -0.392 -9.417 0.793 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.167 -10.262 0.646 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.411 -9.532 -0.791 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.979 -10.390 -2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.359 -9.681 -2.234 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.531 -11.370 -2.767 1.00 0.00 H new ATOM 1053 N ILE A 66 0.861 -14.164 0.418 1.00 0.00 N ATOM 1054 CA ILE A 66 1.709 -15.056 1.206 1.00 0.00 C ATOM 1055 C ILE A 66 2.907 -15.521 0.368 1.00 0.00 C ATOM 1056 O ILE A 66 4.004 -15.591 0.909 1.00 0.00 O ATOM 1057 CB ILE A 66 0.877 -16.228 1.793 1.00 0.00 C ATOM 1058 CG1 ILE A 66 -0.205 -15.656 2.742 1.00 0.00 C ATOM 1059 CG2 ILE A 66 1.746 -17.275 2.522 1.00 0.00 C ATOM 1060 CD1 ILE A 66 -1.212 -16.681 3.269 1.00 0.00 C ATOM 0 H ILE A 66 -0.123 -14.433 0.415 1.00 0.00 H new ATOM 0 HA ILE A 66 2.114 -14.515 2.061 1.00 0.00 H new ATOM 0 HB ILE A 66 0.406 -16.753 0.962 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.290 -15.186 3.592 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -0.749 -14.871 2.217 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.109 -18.070 2.911 1.00 0.00 H new ATOM 0 HG22 ILE A 66 2.468 -17.698 1.824 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.275 -16.798 3.347 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -1.928 -16.184 3.924 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.741 -17.135 2.431 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.685 -17.455 3.828 1.00 0.00 H new ATOM 1072 N GLN A 67 2.741 -15.795 -0.929 1.00 0.00 N ATOM 1073 CA GLN A 67 3.819 -16.326 -1.756 1.00 0.00 C ATOM 1074 C GLN A 67 4.962 -15.316 -1.859 1.00 0.00 C ATOM 1075 O GLN A 67 6.078 -15.574 -1.405 1.00 0.00 O ATOM 1076 CB GLN A 67 3.309 -16.772 -3.121 1.00 0.00 C ATOM 1077 CG GLN A 67 2.160 -17.787 -3.046 1.00 0.00 C ATOM 1078 CD GLN A 67 2.302 -18.958 -2.070 1.00 0.00 C ATOM 1079 OE1 GLN A 67 2.368 -18.819 -0.849 1.00 0.00 O ATOM 1080 NE2 GLN A 67 2.398 -20.176 -2.572 1.00 0.00 N ATOM 0 H GLN A 67 1.863 -15.655 -1.428 1.00 0.00 H new ATOM 0 HA GLN A 67 4.217 -17.219 -1.273 1.00 0.00 H new ATOM 0 HB2 GLN A 67 2.974 -15.897 -3.678 1.00 0.00 H new ATOM 0 HB3 GLN A 67 4.134 -17.211 -3.682 1.00 0.00 H new ATOM 0 HG2 GLN A 67 1.251 -17.244 -2.787 1.00 0.00 H new ATOM 0 HG3 GLN A 67 2.012 -18.199 -4.044 1.00 0.00 H new ATOM 0 HE21 GLN A 67 2.346 -20.317 -3.581 1.00 0.00 H new ATOM 0 HE22 GLN A 67 2.524 -20.975 -1.951 1.00 0.00 H new ATOM 1089 N VAL A 68 4.678 -14.147 -2.435 1.00 0.00 N ATOM 1090 CA VAL A 68 5.706 -13.138 -2.648 1.00 0.00 C ATOM 1091 C VAL A 68 6.204 -12.617 -1.291 1.00 0.00 C ATOM 1092 O VAL A 68 7.408 -12.436 -1.103 1.00 0.00 O ATOM 1093 CB VAL A 68 5.176 -12.007 -3.551 1.00 0.00 C ATOM 1094 CG1 VAL A 68 6.356 -11.167 -4.070 1.00 0.00 C ATOM 1095 CG2 VAL A 68 4.432 -12.490 -4.804 1.00 0.00 C ATOM 0 H VAL A 68 3.749 -13.880 -2.759 1.00 0.00 H new ATOM 0 HA VAL A 68 6.555 -13.583 -3.167 1.00 0.00 H new ATOM 0 HB VAL A 68 4.482 -11.450 -2.922 1.00 0.00 H new ATOM 0 HG11 VAL A 68 5.980 -10.367 -4.709 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.894 -10.735 -3.226 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.031 -11.803 -4.644 1.00 0.00 H new ATOM 0 HG21 VAL A 68 4.094 -11.629 -5.381 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.102 -13.095 -5.414 1.00 0.00 H new ATOM 0 HG23 VAL A 68 3.571 -13.089 -4.508 1.00 0.00 H new ATOM 1105 N ALA A 69 5.298 -12.404 -0.331 1.00 0.00 N ATOM 1106 CA ALA A 69 5.626 -11.867 0.982 1.00 0.00 C ATOM 1107 C ALA A 69 6.556 -12.804 1.757 1.00 0.00 C ATOM 1108 O ALA A 69 7.547 -12.353 2.340 1.00 0.00 O ATOM 1109 CB ALA A 69 4.349 -11.548 1.764 1.00 0.00 C ATOM 0 H ALA A 69 4.305 -12.604 -0.451 1.00 0.00 H new ATOM 0 HA ALA A 69 6.172 -10.934 0.843 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.612 -11.148 2.743 1.00 0.00 H new ATOM 0 HB2 ALA A 69 3.762 -10.811 1.216 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.763 -12.458 1.890 1.00 0.00 H new ATOM 1115 N LYS A 70 6.296 -14.117 1.754 1.00 0.00 N ATOM 1116 CA LYS A 70 7.205 -15.064 2.392 1.00 0.00 C ATOM 1117 C LYS A 70 8.544 -15.093 1.675 1.00 0.00 C ATOM 1118 O LYS A 70 9.568 -15.273 2.328 1.00 0.00 O ATOM 1119 CB LYS A 70 6.540 -16.439 2.599 1.00 0.00 C ATOM 1120 CG LYS A 70 6.731 -17.449 1.468 1.00 0.00 C ATOM 1121 CD LYS A 70 8.004 -18.282 1.711 1.00 0.00 C ATOM 1122 CE LYS A 70 8.423 -19.130 0.512 1.00 0.00 C ATOM 1123 NZ LYS A 70 7.450 -20.191 0.244 1.00 0.00 N ATOM 0 H LYS A 70 5.474 -14.539 1.322 1.00 0.00 H new ATOM 0 HA LYS A 70 7.430 -14.722 3.402 1.00 0.00 H new ATOM 0 HB2 LYS A 70 6.930 -16.875 3.519 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.471 -16.286 2.747 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.863 -18.106 1.406 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.805 -16.928 0.513 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.822 -17.611 1.973 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.841 -18.936 2.568 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.523 -18.495 -0.368 1.00 0.00 H new ATOM 0 HE3 LYS A 70 9.402 -19.571 0.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 7.762 -20.750 -0.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.374 -20.810 1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.522 -19.768 0.041 1.00 0.00 H new ATOM 1137 N GLU A 71 8.570 -14.892 0.359 1.00 0.00 N ATOM 1138 CA GLU A 71 9.799 -14.942 -0.412 1.00 0.00 C ATOM 1139 C GLU A 71 10.670 -13.697 -0.157 1.00 0.00 C ATOM 1140 O GLU A 71 11.829 -13.687 -0.572 1.00 0.00 O ATOM 1141 CB GLU A 71 9.424 -15.227 -1.874 1.00 0.00 C ATOM 1142 CG GLU A 71 10.616 -15.437 -2.813 1.00 0.00 C ATOM 1143 CD GLU A 71 10.176 -16.204 -4.060 1.00 0.00 C ATOM 1144 OE1 GLU A 71 10.201 -17.460 -4.025 1.00 0.00 O ATOM 1145 OE2 GLU A 71 9.777 -15.572 -5.069 1.00 0.00 O ATOM 0 H GLU A 71 7.739 -14.691 -0.197 1.00 0.00 H new ATOM 0 HA GLU A 71 10.450 -15.757 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 71 8.793 -16.115 -1.906 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.825 -14.397 -2.249 1.00 0.00 H new ATOM 0 HG2 GLU A 71 11.037 -14.473 -3.099 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.402 -15.988 -2.297 1.00 0.00 H new ATOM 1152 N THR A 72 10.185 -12.711 0.610 1.00 0.00 N ATOM 1153 CA THR A 72 11.001 -11.618 1.120 1.00 0.00 C ATOM 1154 C THR A 72 11.242 -11.736 2.632 1.00 0.00 C ATOM 1155 O THR A 72 12.380 -11.523 3.066 1.00 0.00 O ATOM 1156 CB THR A 72 10.438 -10.275 0.629 1.00 0.00 C ATOM 1157 OG1 THR A 72 11.293 -9.216 1.011 1.00 0.00 O ATOM 1158 CG2 THR A 72 9.030 -9.914 1.082 1.00 0.00 C ATOM 0 H THR A 72 9.206 -12.656 0.892 1.00 0.00 H new ATOM 0 HA THR A 72 12.008 -11.679 0.708 1.00 0.00 H new ATOM 0 HB THR A 72 10.382 -10.412 -0.451 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.924 -8.366 0.691 1.00 0.00 H new ATOM 0 HG21 THR A 72 8.752 -8.945 0.668 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.330 -10.672 0.732 1.00 0.00 H new ATOM 0 HG23 THR A 72 8.999 -9.866 2.171 1.00 0.00 H new ATOM 1166 N GLY A 73 10.238 -12.103 3.436 1.00 0.00 N ATOM 1167 CA GLY A 73 10.391 -12.260 4.875 1.00 0.00 C ATOM 1168 C GLY A 73 9.052 -12.090 5.572 1.00 0.00 C ATOM 1169 O GLY A 73 8.411 -13.081 5.924 1.00 0.00 O ATOM 0 H GLY A 73 9.295 -12.299 3.099 1.00 0.00 H new ATOM 0 HA2 GLY A 73 10.802 -13.245 5.098 1.00 0.00 H new ATOM 0 HA3 GLY A 73 11.101 -11.525 5.254 1.00 0.00 H new ATOM 1173 N GLU A 74 8.648 -10.835 5.770 1.00 0.00 N ATOM 1174 CA GLU A 74 7.444 -10.383 6.443 1.00 0.00 C ATOM 1175 C GLU A 74 6.215 -10.889 5.679 1.00 0.00 C ATOM 1176 O GLU A 74 5.706 -10.203 4.792 1.00 0.00 O ATOM 1177 CB GLU A 74 7.461 -8.843 6.567 1.00 0.00 C ATOM 1178 CG GLU A 74 8.448 -8.240 7.583 1.00 0.00 C ATOM 1179 CD GLU A 74 9.858 -7.970 7.032 1.00 0.00 C ATOM 1180 OE1 GLU A 74 10.387 -8.777 6.231 1.00 0.00 O ATOM 1181 OE2 GLU A 74 10.465 -6.958 7.445 1.00 0.00 O ATOM 0 H GLU A 74 9.205 -10.049 5.434 1.00 0.00 H new ATOM 0 HA GLU A 74 7.400 -10.790 7.453 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.686 -8.426 5.586 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.457 -8.512 6.831 1.00 0.00 H new ATOM 0 HG2 GLU A 74 8.035 -7.304 7.958 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.529 -8.916 8.434 1.00 0.00 H new ATOM 1188 N VAL A 75 5.765 -12.101 6.005 1.00 0.00 N ATOM 1189 CA VAL A 75 4.703 -12.822 5.317 1.00 0.00 C ATOM 1190 C VAL A 75 3.349 -12.488 5.911 1.00 0.00 C ATOM 1191 O VAL A 75 2.395 -12.181 5.196 1.00 0.00 O ATOM 1192 CB VAL A 75 5.016 -14.336 5.315 1.00 0.00 C ATOM 1193 CG1 VAL A 75 5.256 -14.990 6.689 1.00 0.00 C ATOM 1194 CG2 VAL A 75 3.942 -15.135 4.571 1.00 0.00 C ATOM 0 H VAL A 75 6.150 -12.626 6.790 1.00 0.00 H new ATOM 0 HA VAL A 75 4.657 -12.504 4.276 1.00 0.00 H new ATOM 0 HB VAL A 75 5.972 -14.378 4.794 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.465 -16.051 6.555 1.00 0.00 H new ATOM 0 HG12 VAL A 75 6.105 -14.511 7.176 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.367 -14.871 7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.197 -16.194 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.977 -14.985 5.054 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.887 -14.795 3.537 1.00 0.00 H new ATOM 1204 N ASN A 76 3.248 -12.579 7.232 1.00 0.00 N ATOM 1205 CA ASN A 76 2.010 -12.363 7.964 1.00 0.00 C ATOM 1206 C ASN A 76 2.261 -11.398 9.118 1.00 0.00 C ATOM 1207 O ASN A 76 1.422 -11.262 10.003 1.00 0.00 O ATOM 1208 CB ASN A 76 1.408 -13.696 8.442 1.00 0.00 C ATOM 1209 CG ASN A 76 0.835 -14.613 7.364 1.00 0.00 C ATOM 1210 OD1 ASN A 76 0.568 -14.148 6.155 1.00 0.00 O flip ATOM 1211 ND2 ASN A 76 0.611 -15.795 7.614 1.00 0.00 N flip ATOM 0 H ASN A 76 4.039 -12.809 7.833 1.00 0.00 H new ATOM 0 HA ASN A 76 1.273 -11.912 7.299 1.00 0.00 H new ATOM 0 HB2 ASN A 76 2.180 -14.245 8.981 1.00 0.00 H new ATOM 0 HB3 ASN A 76 0.616 -13.475 9.158 1.00 0.00 H new ATOM 0 HD21 ASN A 76 0.812 -16.167 8.542 1.00 0.00 H new ATOM 0 HD22 ASN A 76 0.224 -16.404 6.893 1.00 0.00 H new ATOM 1218 N GLU A 77 3.403 -10.706 9.090 1.00 0.00 N ATOM 1219 CA GLU A 77 3.729 -9.609 9.990 1.00 0.00 C ATOM 1220 C GLU A 77 2.659 -8.512 9.898 1.00 0.00 C ATOM 1221 O GLU A 77 2.311 -7.881 10.896 1.00 0.00 O ATOM 1222 CB GLU A 77 5.146 -9.115 9.623 1.00 0.00 C ATOM 1223 CG GLU A 77 5.947 -8.538 10.795 1.00 0.00 C ATOM 1224 CD GLU A 77 5.481 -7.171 11.297 1.00 0.00 C ATOM 1225 OE1 GLU A 77 5.094 -6.303 10.483 1.00 0.00 O ATOM 1226 OE2 GLU A 77 5.613 -6.932 12.519 1.00 0.00 O ATOM 0 H GLU A 77 4.145 -10.904 8.419 1.00 0.00 H new ATOM 0 HA GLU A 77 3.733 -9.929 11.032 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.705 -9.946 9.192 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.061 -8.353 8.849 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.906 -9.244 11.624 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.992 -8.459 10.495 1.00 0.00 H new ATOM 1233 N LEU A 78 2.109 -8.342 8.696 1.00 0.00 N ATOM 1234 CA LEU A 78 1.185 -7.289 8.297 1.00 0.00 C ATOM 1235 C LEU A 78 -0.221 -7.557 8.841 1.00 0.00 C ATOM 1236 O LEU A 78 -0.531 -8.673 9.274 1.00 0.00 O ATOM 1237 CB LEU A 78 1.180 -7.120 6.760 1.00 0.00 C ATOM 1238 CG LEU A 78 2.591 -6.936 6.166 1.00 0.00 C ATOM 1239 CD1 LEU A 78 3.323 -8.265 5.883 1.00 0.00 C ATOM 1240 CD2 LEU A 78 2.479 -6.194 4.845 1.00 0.00 C ATOM 0 H LEU A 78 2.313 -8.980 7.927 1.00 0.00 H new ATOM 0 HA LEU A 78 1.527 -6.350 8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.713 -7.994 6.306 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.567 -6.258 6.497 1.00 0.00 H new ATOM 0 HG LEU A 78 3.166 -6.387 6.912 1.00 0.00 H new ATOM 0 HD11 LEU A 78 4.308 -8.056 5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.433 -8.825 6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.746 -8.854 5.170 1.00 0.00 H new ATOM 0 HD21 LEU A 78 3.473 -6.060 4.418 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.862 -6.770 4.155 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.021 -5.219 5.013 1.00 0.00 H new ATOM 1252 N SER A 79 -1.084 -6.542 8.830 1.00 0.00 N ATOM 1253 CA SER A 79 -2.453 -6.676 9.314 1.00 0.00 C ATOM 1254 C SER A 79 -3.332 -7.485 8.353 1.00 0.00 C ATOM 1255 O SER A 79 -3.003 -7.689 7.179 1.00 0.00 O ATOM 1256 CB SER A 79 -3.013 -5.285 9.630 1.00 0.00 C ATOM 1257 OG SER A 79 -2.333 -4.790 10.770 1.00 0.00 O ATOM 0 H SER A 79 -0.854 -5.609 8.487 1.00 0.00 H new ATOM 0 HA SER A 79 -2.453 -7.255 10.237 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.872 -4.615 8.781 1.00 0.00 H new ATOM 0 HB3 SER A 79 -4.085 -5.339 9.819 1.00 0.00 H new ATOM 0 HG SER A 79 -2.673 -3.898 10.992 1.00 0.00 H new ATOM 1263 N LYS A 80 -4.484 -7.944 8.858 1.00 0.00 N ATOM 1264 CA LYS A 80 -5.496 -8.622 8.064 1.00 0.00 C ATOM 1265 C LYS A 80 -5.872 -7.754 6.903 1.00 0.00 C ATOM 1266 O LYS A 80 -5.719 -8.189 5.760 1.00 0.00 O ATOM 1267 CB LYS A 80 -6.726 -8.924 8.941 1.00 0.00 C ATOM 1268 CG LYS A 80 -8.088 -9.148 8.233 1.00 0.00 C ATOM 1269 CD LYS A 80 -8.448 -10.626 8.217 1.00 0.00 C ATOM 1270 CE LYS A 80 -7.577 -11.222 7.132 1.00 0.00 C ATOM 1271 NZ LYS A 80 -7.840 -12.655 6.950 1.00 0.00 N ATOM 0 H LYS A 80 -4.735 -7.850 9.842 1.00 0.00 H new ATOM 0 HA LYS A 80 -5.103 -9.566 7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -6.506 -9.814 9.530 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -6.846 -8.099 9.643 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -8.867 -8.584 8.746 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -8.040 -8.769 7.212 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -8.252 -11.092 9.183 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -9.506 -10.774 8.001 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -7.755 -10.697 6.193 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -6.527 -11.074 7.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -7.225 -13.028 6.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -7.646 -13.159 7.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.836 -12.794 6.683 1.00 0.00 H new ATOM 1285 N ALA A 81 -6.396 -6.571 7.226 1.00 0.00 N ATOM 1286 CA ALA A 81 -6.968 -5.682 6.252 1.00 0.00 C ATOM 1287 C ALA A 81 -5.977 -5.419 5.131 1.00 0.00 C ATOM 1288 O ALA A 81 -6.360 -5.403 3.968 1.00 0.00 O ATOM 1289 CB ALA A 81 -7.334 -4.363 6.943 1.00 0.00 C ATOM 0 H ALA A 81 -6.429 -6.214 8.181 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.860 -6.138 5.823 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.769 -3.679 6.214 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -8.056 -4.556 7.736 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.437 -3.915 7.370 1.00 0.00 H new ATOM 1295 N ASP A 82 -4.705 -5.299 5.502 1.00 0.00 N ATOM 1296 CA ASP A 82 -3.563 -5.146 4.623 1.00 0.00 C ATOM 1297 C ASP A 82 -3.623 -6.206 3.545 1.00 0.00 C ATOM 1298 O ASP A 82 -3.846 -5.934 2.368 1.00 0.00 O ATOM 1299 CB ASP A 82 -2.273 -5.292 5.447 1.00 0.00 C ATOM 1300 CG ASP A 82 -1.325 -4.172 5.118 1.00 0.00 C ATOM 1301 OD1 ASP A 82 -1.549 -3.118 5.740 1.00 0.00 O ATOM 1302 OD2 ASP A 82 -0.357 -4.367 4.347 1.00 0.00 O ATOM 0 H ASP A 82 -4.434 -5.307 6.485 1.00 0.00 H new ATOM 0 HA ASP A 82 -3.575 -4.162 4.154 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -2.508 -5.280 6.511 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.803 -6.252 5.235 1.00 0.00 H new ATOM 1307 N ILE A 83 -3.447 -7.453 3.962 1.00 0.00 N ATOM 1308 CA ILE A 83 -3.327 -8.555 3.037 1.00 0.00 C ATOM 1309 C ILE A 83 -4.645 -8.698 2.258 1.00 0.00 C ATOM 1310 O ILE A 83 -4.599 -9.091 1.098 1.00 0.00 O ATOM 1311 CB ILE A 83 -2.840 -9.789 3.828 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -1.393 -9.551 4.319 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -2.901 -11.076 2.996 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -0.920 -10.601 5.330 1.00 0.00 C ATOM 0 H ILE A 83 -3.385 -7.720 4.944 1.00 0.00 H new ATOM 0 HA ILE A 83 -2.577 -8.401 2.261 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.510 -9.920 4.678 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.720 -9.552 3.462 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.328 -8.563 4.774 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.548 -11.915 3.597 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -3.929 -11.260 2.685 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -2.269 -10.970 2.115 1.00 0.00 H new ATOM 0 HD11 ILE A 83 0.102 -10.378 5.635 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -1.571 -10.584 6.204 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -0.954 -11.589 4.871 1.00 0.00 H new ATOM 1326 N GLU A 84 -5.801 -8.342 2.833 1.00 0.00 N ATOM 1327 CA GLU A 84 -7.093 -8.389 2.145 1.00 0.00 C ATOM 1328 C GLU A 84 -7.203 -7.384 0.992 1.00 0.00 C ATOM 1329 O GLU A 84 -7.606 -7.776 -0.105 1.00 0.00 O ATOM 1330 CB GLU A 84 -8.268 -8.197 3.119 1.00 0.00 C ATOM 1331 CG GLU A 84 -8.399 -9.370 4.092 1.00 0.00 C ATOM 1332 CD GLU A 84 -9.829 -9.736 4.470 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -10.689 -9.873 3.575 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -10.053 -9.990 5.670 1.00 0.00 O ATOM 0 H GLU A 84 -5.864 -8.011 3.796 1.00 0.00 H new ATOM 0 HA GLU A 84 -7.150 -9.388 1.713 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.127 -7.273 3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.194 -8.089 2.554 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -7.921 -10.244 3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.848 -9.131 5.002 1.00 0.00 H new ATOM 1341 N VAL A 85 -6.854 -6.115 1.226 1.00 0.00 N ATOM 1342 CA VAL A 85 -6.834 -5.028 0.240 1.00 0.00 C ATOM 1343 C VAL A 85 -6.054 -5.494 -0.976 1.00 0.00 C ATOM 1344 O VAL A 85 -6.561 -5.538 -2.103 1.00 0.00 O ATOM 1345 CB VAL A 85 -6.145 -3.801 0.886 1.00 0.00 C ATOM 1346 CG1 VAL A 85 -5.602 -2.738 -0.080 1.00 0.00 C ATOM 1347 CG2 VAL A 85 -7.108 -3.107 1.864 1.00 0.00 C ATOM 0 H VAL A 85 -6.564 -5.802 2.152 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.844 -4.755 -0.068 1.00 0.00 H new ATOM 0 HB VAL A 85 -5.274 -4.227 1.384 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.143 -1.930 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.857 -3.189 -0.736 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.420 -2.340 -0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.613 -2.246 2.312 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.996 -2.776 1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -7.398 -3.807 2.647 1.00 0.00 H new ATOM 1357 N LEU A 86 -4.786 -5.814 -0.720 1.00 0.00 N ATOM 1358 CA LEU A 86 -3.829 -6.126 -1.748 1.00 0.00 C ATOM 1359 C LEU A 86 -4.308 -7.372 -2.496 1.00 0.00 C ATOM 1360 O LEU A 86 -4.387 -7.348 -3.723 1.00 0.00 O ATOM 1361 CB LEU A 86 -2.449 -6.278 -1.091 1.00 0.00 C ATOM 1362 CG LEU A 86 -1.736 -4.973 -0.649 1.00 0.00 C ATOM 1363 CD1 LEU A 86 -1.816 -3.772 -1.579 1.00 0.00 C ATOM 1364 CD2 LEU A 86 -1.832 -4.539 0.796 1.00 0.00 C ATOM 0 H LEU A 86 -4.403 -5.861 0.224 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.738 -5.334 -2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -2.558 -6.918 -0.216 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.796 -6.802 -1.789 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.732 -5.384 -0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.273 -2.935 -1.140 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.373 -4.027 -2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.860 -3.492 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.279 -3.610 0.934 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.878 -4.382 1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.408 -5.312 1.437 1.00 0.00 H new ATOM 1376 N ALA A 87 -4.706 -8.421 -1.766 1.00 0.00 N ATOM 1377 CA ALA A 87 -5.236 -9.660 -2.318 1.00 0.00 C ATOM 1378 C ALA A 87 -6.343 -9.404 -3.326 1.00 0.00 C ATOM 1379 O ALA A 87 -6.245 -9.843 -4.474 1.00 0.00 O ATOM 1380 CB ALA A 87 -5.745 -10.545 -1.180 1.00 0.00 C ATOM 0 H ALA A 87 -4.664 -8.425 -0.747 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.431 -10.168 -2.849 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -6.142 -11.473 -1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.924 -10.771 -0.500 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -6.532 -10.022 -0.637 1.00 0.00 H new ATOM 1386 N LEU A 88 -7.413 -8.743 -2.890 1.00 0.00 N ATOM 1387 CA LEU A 88 -8.561 -8.478 -3.735 1.00 0.00 C ATOM 1388 C LEU A 88 -8.129 -7.733 -4.986 1.00 0.00 C ATOM 1389 O LEU A 88 -8.549 -8.096 -6.083 1.00 0.00 O ATOM 1390 CB LEU A 88 -9.583 -7.653 -2.959 1.00 0.00 C ATOM 1391 CG LEU A 88 -10.716 -7.132 -3.859 1.00 0.00 C ATOM 1392 CD1 LEU A 88 -11.580 -8.241 -4.468 1.00 0.00 C ATOM 1393 CD2 LEU A 88 -11.554 -6.220 -2.992 1.00 0.00 C ATOM 0 H LEU A 88 -7.503 -8.379 -1.941 1.00 0.00 H new ATOM 0 HA LEU A 88 -9.014 -9.424 -4.033 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -10.007 -8.262 -2.160 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -9.081 -6.809 -2.485 1.00 0.00 H new ATOM 0 HG LEU A 88 -10.286 -6.614 -4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.357 -7.797 -5.090 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.956 -8.894 -5.078 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -12.042 -8.822 -3.670 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -12.379 -5.817 -3.579 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -11.951 -6.784 -2.148 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -10.937 -5.401 -2.623 1.00 0.00 H new ATOM 1405 N ALA A 89 -7.306 -6.694 -4.849 1.00 0.00 N ATOM 1406 CA ALA A 89 -6.936 -5.917 -6.013 1.00 0.00 C ATOM 1407 C ALA A 89 -6.167 -6.766 -7.028 1.00 0.00 C ATOM 1408 O ALA A 89 -6.248 -6.486 -8.227 1.00 0.00 O ATOM 1409 CB ALA A 89 -6.136 -4.690 -5.603 1.00 0.00 C ATOM 0 H ALA A 89 -6.897 -6.383 -3.968 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.851 -5.580 -6.499 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -5.867 -4.118 -6.491 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -6.737 -4.068 -4.940 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -5.230 -5.003 -5.084 1.00 0.00 H new ATOM 1415 N TYR A 90 -5.436 -7.792 -6.591 1.00 0.00 N ATOM 1416 CA TYR A 90 -4.751 -8.703 -7.500 1.00 0.00 C ATOM 1417 C TYR A 90 -5.707 -9.762 -8.066 1.00 0.00 C ATOM 1418 O TYR A 90 -5.432 -10.313 -9.132 1.00 0.00 O ATOM 1419 CB TYR A 90 -3.551 -9.358 -6.813 1.00 0.00 C ATOM 1420 CG TYR A 90 -2.646 -8.460 -6.010 1.00 0.00 C ATOM 1421 CD1 TYR A 90 -2.400 -7.133 -6.397 1.00 0.00 C ATOM 1422 CD2 TYR A 90 -2.007 -8.985 -4.883 1.00 0.00 C ATOM 1423 CE1 TYR A 90 -1.581 -6.312 -5.610 1.00 0.00 C ATOM 1424 CE2 TYR A 90 -1.199 -8.162 -4.086 1.00 0.00 C ATOM 1425 CZ TYR A 90 -0.984 -6.819 -4.447 1.00 0.00 C ATOM 1426 OH TYR A 90 -0.139 -6.038 -3.727 1.00 0.00 O ATOM 0 H TYR A 90 -5.304 -8.012 -5.604 1.00 0.00 H new ATOM 0 HA TYR A 90 -4.383 -8.114 -8.340 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.925 -10.140 -6.152 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -2.949 -9.848 -7.578 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -2.842 -6.744 -7.302 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.136 -10.026 -4.626 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.409 -5.286 -5.900 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.740 -8.560 -3.193 1.00 0.00 H new ATOM 0 HH TYR A 90 0.743 -6.463 -3.685 1.00 0.00 H new ATOM 1436 N GLU A 91 -6.845 -10.030 -7.417 1.00 0.00 N ATOM 1437 CA GLU A 91 -7.975 -10.754 -8.007 1.00 0.00 C ATOM 1438 C GLU A 91 -8.535 -9.935 -9.173 1.00 0.00 C ATOM 1439 O GLU A 91 -8.882 -10.473 -10.222 1.00 0.00 O ATOM 1440 CB GLU A 91 -9.081 -10.994 -6.952 1.00 0.00 C ATOM 1441 CG GLU A 91 -9.817 -12.333 -7.096 1.00 0.00 C ATOM 1442 CD GLU A 91 -10.612 -12.478 -8.397 1.00 0.00 C ATOM 1443 OE1 GLU A 91 -11.443 -11.604 -8.735 1.00 0.00 O ATOM 1444 OE2 GLU A 91 -10.425 -13.497 -9.101 1.00 0.00 O ATOM 0 H GLU A 91 -7.009 -9.745 -6.451 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.631 -11.724 -8.365 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -8.635 -10.944 -5.959 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.809 -10.185 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -9.089 -13.142 -7.036 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -10.497 -12.453 -6.253 1.00 0.00 H new ATOM 1451 N LEU A 92 -8.607 -8.618 -8.992 1.00 0.00 N ATOM 1452 CA LEU A 92 -9.182 -7.680 -9.946 1.00 0.00 C ATOM 1453 C LEU A 92 -8.191 -7.268 -11.033 1.00 0.00 C ATOM 1454 O LEU A 92 -8.599 -6.720 -12.062 1.00 0.00 O ATOM 1455 CB LEU A 92 -9.671 -6.452 -9.165 1.00 0.00 C ATOM 1456 CG LEU A 92 -10.844 -6.772 -8.216 1.00 0.00 C ATOM 1457 CD1 LEU A 92 -11.112 -5.562 -7.317 1.00 0.00 C ATOM 1458 CD2 LEU A 92 -12.114 -7.077 -9.010 1.00 0.00 C ATOM 0 H LEU A 92 -8.255 -8.163 -8.150 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.010 -8.166 -10.462 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.843 -6.043 -8.586 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.980 -5.679 -9.869 1.00 0.00 H new ATOM 0 HG LEU A 92 -10.576 -7.643 -7.618 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.941 -5.785 -6.645 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.220 -5.339 -6.732 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.367 -4.700 -7.934 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -12.929 -7.300 -8.321 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.379 -6.212 -9.618 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.941 -7.937 -9.657 1.00 0.00 H new ATOM 1470 N LYS A 93 -6.895 -7.536 -10.832 1.00 0.00 N ATOM 1471 CA LYS A 93 -5.793 -7.075 -11.674 1.00 0.00 C ATOM 1472 C LYS A 93 -5.967 -5.573 -12.012 1.00 0.00 C ATOM 1473 O LYS A 93 -5.818 -5.175 -13.169 1.00 0.00 O ATOM 1474 CB LYS A 93 -5.641 -8.020 -12.898 1.00 0.00 C ATOM 1475 CG LYS A 93 -5.426 -9.520 -12.548 1.00 0.00 C ATOM 1476 CD LYS A 93 -6.687 -10.396 -12.666 1.00 0.00 C ATOM 1477 CE LYS A 93 -6.756 -11.621 -11.731 1.00 0.00 C ATOM 1478 NZ LYS A 93 -5.850 -12.756 -12.014 1.00 0.00 N ATOM 0 H LYS A 93 -6.577 -8.103 -10.046 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.843 -7.132 -11.143 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.532 -7.932 -13.519 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.798 -7.678 -13.499 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.656 -9.925 -13.204 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.046 -9.590 -11.529 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.558 -9.770 -12.475 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.766 -10.746 -13.695 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -6.557 -11.279 -10.715 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.779 -11.997 -11.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.003 -13.506 -11.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.046 -13.128 -12.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.863 -12.432 -11.966 1.00 0.00 H new ATOM 1492 N GLY A 94 -6.349 -4.752 -11.022 1.00 0.00 N ATOM 1493 CA GLY A 94 -6.855 -3.385 -11.181 1.00 0.00 C ATOM 1494 C GLY A 94 -5.862 -2.281 -10.829 1.00 0.00 C ATOM 1495 O GLY A 94 -4.878 -2.077 -11.542 1.00 0.00 O ATOM 0 H GLY A 94 -6.311 -5.039 -10.044 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.173 -3.250 -12.215 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.741 -3.267 -10.557 1.00 0.00 H new ATOM 1499 N GLU A 95 -6.155 -1.523 -9.769 1.00 0.00 N ATOM 1500 CA GLU A 95 -5.252 -0.576 -9.135 1.00 0.00 C ATOM 1501 C GLU A 95 -5.542 -0.519 -7.629 1.00 0.00 C ATOM 1502 O GLU A 95 -6.555 -1.069 -7.181 1.00 0.00 O ATOM 1503 CB GLU A 95 -5.349 0.766 -9.892 1.00 0.00 C ATOM 1504 CG GLU A 95 -4.274 1.810 -9.560 1.00 0.00 C ATOM 1505 CD GLU A 95 -4.483 3.164 -10.251 1.00 0.00 C ATOM 1506 OE1 GLU A 95 -5.014 3.229 -11.385 1.00 0.00 O ATOM 1507 OE2 GLU A 95 -4.137 4.201 -9.637 1.00 0.00 O ATOM 0 H GLU A 95 -7.068 -1.559 -9.315 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.208 -0.881 -9.201 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.308 0.560 -10.962 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.326 1.204 -9.689 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.253 1.964 -8.481 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.299 1.415 -9.845 1.00 0.00 H new ATOM 1514 N ILE A 96 -4.660 0.100 -6.832 1.00 0.00 N ATOM 1515 CA ILE A 96 -4.792 0.238 -5.378 1.00 0.00 C ATOM 1516 C ILE A 96 -4.572 1.705 -4.989 1.00 0.00 C ATOM 1517 O ILE A 96 -3.958 2.488 -5.727 1.00 0.00 O ATOM 1518 CB ILE A 96 -3.820 -0.733 -4.658 1.00 0.00 C ATOM 1519 CG1 ILE A 96 -4.054 -2.164 -5.179 1.00 0.00 C ATOM 1520 CG2 ILE A 96 -3.927 -0.710 -3.121 1.00 0.00 C ATOM 1521 CD1 ILE A 96 -3.027 -3.191 -4.738 1.00 0.00 C ATOM 0 H ILE A 96 -3.810 0.531 -7.194 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.797 -0.038 -5.058 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.812 -0.391 -4.890 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.039 -2.496 -4.851 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.073 -2.138 -6.269 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.214 -1.417 -2.696 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -3.705 0.293 -2.756 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.937 -0.990 -2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.282 -4.164 -5.158 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.039 -2.892 -5.089 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -3.021 -3.255 -3.650 1.00 0.00 H new ATOM 1533 N PHE A 97 -5.077 2.090 -3.823 1.00 0.00 N ATOM 1534 CA PHE A 97 -4.896 3.382 -3.202 1.00 0.00 C ATOM 1535 C PHE A 97 -4.691 3.092 -1.709 1.00 0.00 C ATOM 1536 O PHE A 97 -5.596 2.556 -1.070 1.00 0.00 O ATOM 1537 CB PHE A 97 -6.163 4.206 -3.480 1.00 0.00 C ATOM 1538 CG PHE A 97 -5.979 5.706 -3.462 1.00 0.00 C ATOM 1539 CD1 PHE A 97 -5.324 6.301 -2.380 1.00 0.00 C ATOM 1540 CD2 PHE A 97 -6.456 6.511 -4.513 1.00 0.00 C ATOM 1541 CE1 PHE A 97 -5.163 7.690 -2.331 1.00 0.00 C ATOM 1542 CE2 PHE A 97 -6.311 7.912 -4.456 1.00 0.00 C ATOM 1543 CZ PHE A 97 -5.658 8.506 -3.361 1.00 0.00 C ATOM 0 H PHE A 97 -5.656 1.468 -3.259 1.00 0.00 H new ATOM 0 HA PHE A 97 -4.046 3.951 -3.579 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -6.557 3.917 -4.454 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.918 3.941 -2.740 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.941 5.686 -1.579 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -6.935 6.054 -5.366 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -4.653 8.139 -1.492 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -6.701 8.529 -5.252 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.539 9.578 -3.313 1.00 0.00 H new ATOM 1553 N SER A 98 -3.510 3.395 -1.166 1.00 0.00 N ATOM 1554 CA SER A 98 -3.202 3.323 0.260 1.00 0.00 C ATOM 1555 C SER A 98 -1.952 4.182 0.535 1.00 0.00 C ATOM 1556 O SER A 98 -1.419 4.796 -0.392 1.00 0.00 O ATOM 1557 CB SER A 98 -2.991 1.861 0.671 1.00 0.00 C ATOM 1558 OG SER A 98 -2.891 1.766 2.082 1.00 0.00 O ATOM 0 H SER A 98 -2.717 3.707 -1.727 1.00 0.00 H new ATOM 0 HA SER A 98 -4.029 3.712 0.854 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.821 1.251 0.315 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.086 1.471 0.206 1.00 0.00 H new ATOM 0 HG SER A 98 -3.421 2.479 2.496 1.00 0.00 H new ATOM 1564 N ASP A 99 -1.480 4.277 1.779 1.00 0.00 N ATOM 1565 CA ASP A 99 -0.268 5.016 2.132 1.00 0.00 C ATOM 1566 C ASP A 99 0.294 4.523 3.463 1.00 0.00 C ATOM 1567 O ASP A 99 -0.026 5.053 4.526 1.00 0.00 O ATOM 1568 CB ASP A 99 -0.532 6.530 2.171 1.00 0.00 C ATOM 1569 CG ASP A 99 0.609 7.297 2.837 1.00 0.00 C ATOM 1570 OD1 ASP A 99 1.777 7.027 2.483 1.00 0.00 O ATOM 1571 OD2 ASP A 99 0.337 8.140 3.725 1.00 0.00 O ATOM 0 H ASP A 99 -1.935 3.837 2.579 1.00 0.00 H new ATOM 0 HA ASP A 99 0.477 4.831 1.359 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -0.671 6.899 1.155 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -1.460 6.722 2.710 1.00 0.00 H new ATOM 1576 N ASP A 100 1.157 3.515 3.413 1.00 0.00 N ATOM 1577 CA ASP A 100 1.841 2.966 4.579 1.00 0.00 C ATOM 1578 C ASP A 100 3.165 2.336 4.178 1.00 0.00 C ATOM 1579 O ASP A 100 3.342 1.939 3.028 1.00 0.00 O ATOM 1580 CB ASP A 100 0.960 1.967 5.341 1.00 0.00 C ATOM 1581 CG ASP A 100 0.844 2.309 6.829 1.00 0.00 C ATOM 1582 OD1 ASP A 100 1.669 3.089 7.366 1.00 0.00 O ATOM 1583 OD2 ASP A 100 -0.154 1.873 7.440 1.00 0.00 O ATOM 0 H ASP A 100 1.406 3.046 2.542 1.00 0.00 H new ATOM 0 HA ASP A 100 2.047 3.793 5.259 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -0.035 1.951 4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 100 1.374 0.965 5.232 1.00 0.00 H new ATOM 1588 N TYR A 101 4.101 2.240 5.117 1.00 0.00 N ATOM 1589 CA TYR A 101 5.446 1.720 4.870 1.00 0.00 C ATOM 1590 C TYR A 101 5.368 0.287 4.336 1.00 0.00 C ATOM 1591 O TYR A 101 5.990 -0.045 3.326 1.00 0.00 O ATOM 1592 CB TYR A 101 6.305 1.807 6.148 1.00 0.00 C ATOM 1593 CG TYR A 101 5.704 1.073 7.336 1.00 0.00 C ATOM 1594 CD1 TYR A 101 4.643 1.664 8.043 1.00 0.00 C ATOM 1595 CD2 TYR A 101 6.096 -0.245 7.642 1.00 0.00 C ATOM 1596 CE1 TYR A 101 3.913 0.927 8.990 1.00 0.00 C ATOM 1597 CE2 TYR A 101 5.396 -0.975 8.620 1.00 0.00 C ATOM 1598 CZ TYR A 101 4.281 -0.407 9.276 1.00 0.00 C ATOM 1599 OH TYR A 101 3.592 -1.153 10.180 1.00 0.00 O ATOM 0 H TYR A 101 3.947 2.524 6.084 1.00 0.00 H new ATOM 0 HA TYR A 101 5.930 2.334 4.110 1.00 0.00 H new ATOM 0 HB2 TYR A 101 7.293 1.397 5.940 1.00 0.00 H new ATOM 0 HB3 TYR A 101 6.444 2.855 6.412 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.386 2.696 7.856 1.00 0.00 H new ATOM 0 HD2 TYR A 101 6.932 -0.694 7.127 1.00 0.00 H new ATOM 0 HE1 TYR A 101 3.073 1.378 9.498 1.00 0.00 H new ATOM 0 HE2 TYR A 101 5.713 -1.976 8.871 1.00 0.00 H new ATOM 0 HH TYR A 101 3.993 -2.045 10.241 1.00 0.00 H new ATOM 1609 N ASN A 102 4.590 -0.557 5.007 1.00 0.00 N ATOM 1610 CA ASN A 102 4.299 -1.917 4.594 1.00 0.00 C ATOM 1611 C ASN A 102 3.513 -1.901 3.290 1.00 0.00 C ATOM 1612 O ASN A 102 3.930 -2.544 2.331 1.00 0.00 O ATOM 1613 CB ASN A 102 3.513 -2.664 5.682 1.00 0.00 C ATOM 1614 CG ASN A 102 2.289 -1.893 6.160 1.00 0.00 C ATOM 1615 OD1 ASN A 102 2.428 -0.899 6.855 1.00 0.00 O ATOM 1616 ND2 ASN A 102 1.090 -2.265 5.765 1.00 0.00 N ATOM 0 H ASN A 102 4.132 -0.300 5.881 1.00 0.00 H new ATOM 0 HA ASN A 102 5.241 -2.443 4.438 1.00 0.00 H new ATOM 0 HB2 ASN A 102 3.198 -3.633 5.296 1.00 0.00 H new ATOM 0 HB3 ASN A 102 4.169 -2.857 6.530 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.271 -1.722 6.039 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.979 -3.096 5.184 1.00 0.00 H new ATOM 1623 N VAL A 103 2.386 -1.191 3.249 1.00 0.00 N ATOM 1624 CA VAL A 103 1.393 -1.350 2.201 1.00 0.00 C ATOM 1625 C VAL A 103 1.974 -0.974 0.836 1.00 0.00 C ATOM 1626 O VAL A 103 1.641 -1.585 -0.184 1.00 0.00 O ATOM 1627 CB VAL A 103 0.142 -0.524 2.574 1.00 0.00 C ATOM 1628 CG1 VAL A 103 0.182 0.906 2.049 1.00 0.00 C ATOM 1629 CG2 VAL A 103 -1.083 -1.229 1.995 1.00 0.00 C ATOM 0 H VAL A 103 2.140 -0.488 3.947 1.00 0.00 H new ATOM 0 HA VAL A 103 1.095 -2.395 2.118 1.00 0.00 H new ATOM 0 HB VAL A 103 0.104 -0.459 3.661 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.727 1.429 2.347 1.00 0.00 H new ATOM 0 HG12 VAL A 103 1.049 1.421 2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.252 0.892 0.961 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.981 -0.664 2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -0.986 -1.295 0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -1.157 -2.232 2.414 1.00 0.00 H new ATOM 1639 N GLN A 104 2.833 0.051 0.823 1.00 0.00 N ATOM 1640 CA GLN A 104 3.435 0.555 -0.387 1.00 0.00 C ATOM 1641 C GLN A 104 4.349 -0.528 -0.944 1.00 0.00 C ATOM 1642 O GLN A 104 4.372 -0.777 -2.147 1.00 0.00 O ATOM 1643 CB GLN A 104 4.298 1.790 -0.058 1.00 0.00 C ATOM 1644 CG GLN A 104 3.547 3.102 0.234 1.00 0.00 C ATOM 1645 CD GLN A 104 4.299 4.021 1.212 1.00 0.00 C ATOM 1646 OE1 GLN A 104 5.448 3.792 1.595 1.00 0.00 O ATOM 1647 NE2 GLN A 104 3.685 5.095 1.674 1.00 0.00 N ATOM 0 H GLN A 104 3.123 0.548 1.665 1.00 0.00 H new ATOM 0 HA GLN A 104 2.660 0.826 -1.104 1.00 0.00 H new ATOM 0 HB2 GLN A 104 4.916 1.552 0.808 1.00 0.00 H new ATOM 0 HB3 GLN A 104 4.975 1.965 -0.894 1.00 0.00 H new ATOM 0 HG2 GLN A 104 3.381 3.635 -0.702 1.00 0.00 H new ATOM 0 HG3 GLN A 104 2.565 2.868 0.646 1.00 0.00 H new ATOM 0 HE21 GLN A 104 2.734 5.308 1.373 1.00 0.00 H new ATOM 0 HE22 GLN A 104 4.162 5.712 2.332 1.00 0.00 H new ATOM 1656 N ASN A 105 5.122 -1.148 -0.045 1.00 0.00 N ATOM 1657 CA ASN A 105 6.082 -2.170 -0.395 1.00 0.00 C ATOM 1658 C ASN A 105 5.353 -3.338 -1.037 1.00 0.00 C ATOM 1659 O ASN A 105 5.742 -3.726 -2.132 1.00 0.00 O ATOM 1660 CB ASN A 105 6.884 -2.620 0.832 1.00 0.00 C ATOM 1661 CG ASN A 105 8.104 -3.439 0.430 1.00 0.00 C ATOM 1662 OD1 ASN A 105 8.820 -3.091 -0.510 1.00 0.00 O ATOM 1663 ND2 ASN A 105 8.374 -4.524 1.136 1.00 0.00 N ATOM 0 H ASN A 105 5.089 -0.943 0.954 1.00 0.00 H new ATOM 0 HA ASN A 105 6.797 -1.761 -1.109 1.00 0.00 H new ATOM 0 HB2 ASN A 105 7.202 -1.746 1.401 1.00 0.00 H new ATOM 0 HB3 ASN A 105 6.246 -3.213 1.488 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.189 -5.092 0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.767 -4.793 1.910 1.00 0.00 H new ATOM 1670 N ILE A 106 4.286 -3.852 -0.406 1.00 0.00 N ATOM 1671 CA ILE A 106 3.556 -5.029 -0.881 1.00 0.00 C ATOM 1672 C ILE A 106 3.113 -4.820 -2.317 1.00 0.00 C ATOM 1673 O ILE A 106 3.389 -5.682 -3.139 1.00 0.00 O ATOM 1674 CB ILE A 106 2.361 -5.397 0.032 1.00 0.00 C ATOM 1675 CG1 ILE A 106 2.790 -5.619 1.495 1.00 0.00 C ATOM 1676 CG2 ILE A 106 1.630 -6.661 -0.480 1.00 0.00 C ATOM 1677 CD1 ILE A 106 3.450 -6.975 1.744 1.00 0.00 C ATOM 0 H ILE A 106 3.906 -3.457 0.454 1.00 0.00 H new ATOM 0 HA ILE A 106 4.238 -5.878 -0.842 1.00 0.00 H new ATOM 0 HB ILE A 106 1.681 -4.546 -0.002 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.483 -4.829 1.785 1.00 0.00 H new ATOM 0 HG13 ILE A 106 1.915 -5.527 2.139 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.796 -6.893 0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.254 -6.481 -1.487 1.00 0.00 H new ATOM 0 HG23 ILE A 106 2.324 -7.501 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 106 3.724 -7.058 2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 106 2.752 -7.772 1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.345 -7.063 1.127 1.00 0.00 H new ATOM 1689 N ALA A 107 2.457 -3.712 -2.659 1.00 0.00 N ATOM 1690 CA ALA A 107 2.057 -3.510 -4.046 1.00 0.00 C ATOM 1691 C ALA A 107 3.280 -3.393 -4.968 1.00 0.00 C ATOM 1692 O ALA A 107 3.275 -3.958 -6.066 1.00 0.00 O ATOM 1693 CB ALA A 107 1.116 -2.316 -4.128 1.00 0.00 C ATOM 0 H ALA A 107 2.199 -2.963 -2.016 1.00 0.00 H new ATOM 0 HA ALA A 107 1.510 -4.382 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 107 0.814 -2.161 -5.164 1.00 0.00 H new ATOM 0 HB2 ALA A 107 0.233 -2.506 -3.517 1.00 0.00 H new ATOM 0 HB3 ALA A 107 1.626 -1.425 -3.762 1.00 0.00 H new ATOM 1699 N SER A 108 4.355 -2.745 -4.512 1.00 0.00 N ATOM 1700 CA SER A 108 5.568 -2.552 -5.291 1.00 0.00 C ATOM 1701 C SER A 108 6.292 -3.866 -5.609 1.00 0.00 C ATOM 1702 O SER A 108 6.615 -4.091 -6.780 1.00 0.00 O ATOM 1703 CB SER A 108 6.477 -1.541 -4.575 1.00 0.00 C ATOM 1704 OG SER A 108 7.326 -0.877 -5.497 1.00 0.00 O ATOM 0 H SER A 108 4.402 -2.337 -3.579 1.00 0.00 H new ATOM 0 HA SER A 108 5.287 -2.146 -6.263 1.00 0.00 H new ATOM 0 HB2 SER A 108 5.867 -0.809 -4.046 1.00 0.00 H new ATOM 0 HB3 SER A 108 7.079 -2.055 -3.826 1.00 0.00 H new ATOM 0 HG SER A 108 7.893 -0.238 -5.017 1.00 0.00 H new ATOM 1710 N LEU A 109 6.546 -4.755 -4.636 1.00 0.00 N ATOM 1711 CA LEU A 109 7.149 -6.059 -4.906 1.00 0.00 C ATOM 1712 C LEU A 109 6.243 -6.897 -5.786 1.00 0.00 C ATOM 1713 O LEU A 109 6.746 -7.587 -6.674 1.00 0.00 O ATOM 1714 CB LEU A 109 7.489 -6.872 -3.647 1.00 0.00 C ATOM 1715 CG LEU A 109 6.449 -6.901 -2.520 1.00 0.00 C ATOM 1716 CD1 LEU A 109 5.917 -8.297 -2.221 1.00 0.00 C ATOM 1717 CD2 LEU A 109 7.051 -6.323 -1.256 1.00 0.00 C ATOM 0 H LEU A 109 6.340 -4.588 -3.651 1.00 0.00 H new ATOM 0 HA LEU A 109 8.089 -5.833 -5.410 1.00 0.00 H new ATOM 0 HB2 LEU A 109 7.682 -7.900 -3.953 1.00 0.00 H new ATOM 0 HB3 LEU A 109 8.420 -6.481 -3.236 1.00 0.00 H new ATOM 0 HG LEU A 109 5.606 -6.302 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 109 5.186 -8.243 -1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 109 5.442 -8.704 -3.114 1.00 0.00 H new ATOM 0 HD13 LEU A 109 6.741 -8.944 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 109 6.310 -6.345 -0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 109 7.918 -6.914 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 109 7.359 -5.293 -1.437 1.00 0.00 H new ATOM 1729 N LEU A 110 4.928 -6.803 -5.594 1.00 0.00 N ATOM 1730 CA LEU A 110 3.964 -7.531 -6.408 1.00 0.00 C ATOM 1731 C LEU A 110 3.989 -7.026 -7.845 1.00 0.00 C ATOM 1732 O LEU A 110 3.689 -7.773 -8.778 1.00 0.00 O ATOM 1733 CB LEU A 110 2.558 -7.381 -5.813 1.00 0.00 C ATOM 1734 CG LEU A 110 2.033 -8.656 -5.142 1.00 0.00 C ATOM 1735 CD1 LEU A 110 1.844 -9.857 -6.074 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.888 -9.006 -3.941 1.00 0.00 C ATOM 0 H LEU A 110 4.505 -6.221 -4.871 1.00 0.00 H new ATOM 0 HA LEU A 110 4.235 -8.587 -6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.567 -6.573 -5.081 1.00 0.00 H new ATOM 0 HB3 LEU A 110 1.868 -7.087 -6.604 1.00 0.00 H new ATOM 0 HG LEU A 110 1.021 -8.419 -4.815 1.00 0.00 H new ATOM 0 HD11 LEU A 110 1.470 -10.706 -5.502 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.128 -9.602 -6.855 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.799 -10.119 -6.529 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.505 -9.913 -3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.917 -9.170 -4.262 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.858 -8.187 -3.222 1.00 0.00 H new ATOM 1748 N GLY A 111 4.342 -5.755 -8.036 1.00 0.00 N ATOM 1749 CA GLY A 111 4.226 -5.083 -9.309 1.00 0.00 C ATOM 1750 C GLY A 111 2.756 -4.884 -9.643 1.00 0.00 C ATOM 1751 O GLY A 111 2.333 -5.253 -10.739 1.00 0.00 O ATOM 0 H GLY A 111 4.720 -5.165 -7.295 1.00 0.00 H new ATOM 0 HA2 GLY A 111 4.735 -4.120 -9.272 1.00 0.00 H new ATOM 0 HA3 GLY A 111 4.711 -5.671 -10.088 1.00 0.00 H new ATOM 1755 N LEU A 112 1.947 -4.410 -8.689 1.00 0.00 N ATOM 1756 CA LEU A 112 0.663 -3.795 -8.995 1.00 0.00 C ATOM 1757 C LEU A 112 0.769 -2.295 -8.729 1.00 0.00 C ATOM 1758 O LEU A 112 1.125 -1.867 -7.630 1.00 0.00 O ATOM 1759 CB LEU A 112 -0.469 -4.446 -8.186 1.00 0.00 C ATOM 1760 CG LEU A 112 -1.818 -4.569 -8.927 1.00 0.00 C ATOM 1761 CD1 LEU A 112 -2.324 -3.230 -9.458 1.00 0.00 C ATOM 1762 CD2 LEU A 112 -1.734 -5.565 -10.086 1.00 0.00 C ATOM 0 H LEU A 112 2.166 -4.444 -7.693 1.00 0.00 H new ATOM 0 HA LEU A 112 0.416 -3.952 -10.045 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.149 -5.442 -7.879 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -0.624 -3.866 -7.276 1.00 0.00 H new ATOM 0 HG LEU A 112 -2.528 -4.933 -8.184 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.275 -3.377 -9.969 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.462 -2.538 -8.627 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.596 -2.817 -10.157 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -2.701 -5.626 -10.584 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.979 -5.232 -10.798 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.461 -6.548 -9.702 1.00 0.00 H new ATOM 1774 N ARG A 113 0.474 -1.489 -9.746 1.00 0.00 N ATOM 1775 CA ARG A 113 0.468 -0.038 -9.683 1.00 0.00 C ATOM 1776 C ARG A 113 -0.549 0.432 -8.644 1.00 0.00 C ATOM 1777 O ARG A 113 -1.666 -0.081 -8.569 1.00 0.00 O ATOM 1778 CB ARG A 113 0.138 0.450 -11.098 1.00 0.00 C ATOM 1779 CG ARG A 113 0.337 1.947 -11.356 1.00 0.00 C ATOM 1780 CD ARG A 113 -0.846 2.804 -10.892 1.00 0.00 C ATOM 1781 NE ARG A 113 -0.846 4.102 -11.584 1.00 0.00 N ATOM 1782 CZ ARG A 113 -1.311 4.304 -12.822 1.00 0.00 C ATOM 1783 NH1 ARG A 113 -2.048 3.382 -13.431 1.00 0.00 N ATOM 1784 NH2 ARG A 113 -1.026 5.431 -13.463 1.00 0.00 N ATOM 0 H ARG A 113 0.224 -1.846 -10.668 1.00 0.00 H new ATOM 0 HA ARG A 113 1.428 0.371 -9.369 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.754 -0.105 -11.805 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.900 0.199 -11.314 1.00 0.00 H new ATOM 0 HG2 ARG A 113 1.240 2.280 -10.845 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.497 2.107 -12.422 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -1.781 2.280 -11.089 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.789 2.960 -9.815 1.00 0.00 H new ATOM 0 HE ARG A 113 -0.464 4.905 -11.084 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -2.266 2.507 -12.955 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -2.396 3.549 -14.375 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -0.452 6.143 -13.012 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -1.381 5.585 -14.407 1.00 0.00 H new ATOM 1798 N PHE A 114 -0.199 1.462 -7.880 1.00 0.00 N ATOM 1799 CA PHE A 114 -1.089 2.096 -6.915 1.00 0.00 C ATOM 1800 C PHE A 114 -0.803 3.590 -6.856 1.00 0.00 C ATOM 1801 O PHE A 114 0.124 4.068 -7.518 1.00 0.00 O ATOM 1802 CB PHE A 114 -0.941 1.434 -5.535 1.00 0.00 C ATOM 1803 CG PHE A 114 0.380 1.639 -4.825 1.00 0.00 C ATOM 1804 CD1 PHE A 114 1.580 1.108 -5.341 1.00 0.00 C ATOM 1805 CD2 PHE A 114 0.400 2.316 -3.595 1.00 0.00 C ATOM 1806 CE1 PHE A 114 2.790 1.296 -4.661 1.00 0.00 C ATOM 1807 CE2 PHE A 114 1.596 2.472 -2.895 1.00 0.00 C ATOM 1808 CZ PHE A 114 2.794 1.989 -3.444 1.00 0.00 C ATOM 0 H PHE A 114 0.728 1.887 -7.915 1.00 0.00 H new ATOM 0 HA PHE A 114 -2.123 1.962 -7.232 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -1.736 1.808 -4.890 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -1.103 0.362 -5.652 1.00 0.00 H new ATOM 0 HD1 PHE A 114 1.566 0.552 -6.267 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -0.516 2.718 -3.189 1.00 0.00 H new ATOM 0 HE1 PHE A 114 3.711 0.910 -5.071 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.600 2.963 -1.933 1.00 0.00 H new ATOM 0 HZ PHE A 114 3.726 2.153 -2.924 1.00 0.00 H new ATOM 1818 N ARG A 115 -1.557 4.327 -6.040 1.00 0.00 N ATOM 1819 CA ARG A 115 -1.264 5.711 -5.670 1.00 0.00 C ATOM 1820 C ARG A 115 -0.796 5.742 -4.227 1.00 0.00 C ATOM 1821 O ARG A 115 -1.368 5.009 -3.419 1.00 0.00 O ATOM 1822 CB ARG A 115 -2.534 6.561 -5.787 1.00 0.00 C ATOM 1823 CG ARG A 115 -2.860 6.861 -7.247 1.00 0.00 C ATOM 1824 CD ARG A 115 -4.100 7.764 -7.338 1.00 0.00 C ATOM 1825 NE ARG A 115 -4.650 7.787 -8.699 1.00 0.00 N ATOM 1826 CZ ARG A 115 -5.625 8.571 -9.173 1.00 0.00 C ATOM 1827 NH1 ARG A 115 -6.122 9.586 -8.468 1.00 0.00 N ATOM 1828 NH2 ARG A 115 -6.083 8.300 -10.389 1.00 0.00 N ATOM 0 H ARG A 115 -2.409 3.969 -5.608 1.00 0.00 H new ATOM 0 HA ARG A 115 -0.495 6.107 -6.333 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -3.370 6.037 -5.324 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -2.402 7.495 -5.241 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -2.010 7.349 -7.724 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -3.038 5.931 -7.786 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.861 7.410 -6.643 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -3.837 8.777 -7.034 1.00 0.00 H new ATOM 0 HE ARG A 115 -4.241 7.128 -9.361 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -5.759 9.786 -7.536 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.865 10.164 -8.860 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.692 7.522 -10.920 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -6.826 8.870 -10.793 1.00 0.00 H new ATOM 1842 N THR A 116 0.120 6.651 -3.893 1.00 0.00 N ATOM 1843 CA THR A 116 0.527 6.970 -2.529 1.00 0.00 C ATOM 1844 C THR A 116 0.317 8.472 -2.289 1.00 0.00 C ATOM 1845 O THR A 116 0.580 9.271 -3.193 1.00 0.00 O ATOM 1846 CB THR A 116 2.006 6.596 -2.330 1.00 0.00 C ATOM 1847 OG1 THR A 116 2.393 5.364 -2.912 1.00 0.00 O ATOM 1848 CG2 THR A 116 2.350 6.491 -0.849 1.00 0.00 C ATOM 0 H THR A 116 0.616 7.204 -4.592 1.00 0.00 H new ATOM 0 HA THR A 116 -0.072 6.403 -1.816 1.00 0.00 H new ATOM 0 HB THR A 116 2.542 7.402 -2.830 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.815 4.648 -2.576 1.00 0.00 H new ATOM 0 HG21 THR A 116 3.401 6.226 -0.738 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.164 7.449 -0.364 1.00 0.00 H new ATOM 0 HG23 THR A 116 1.731 5.723 -0.385 1.00 0.00 H new ATOM 2048 N TRP A 127 15.755 7.803 1.475 1.00 0.00 N ATOM 2049 CA TRP A 127 16.715 7.035 0.704 1.00 0.00 C ATOM 2050 C TRP A 127 16.392 5.546 0.908 1.00 0.00 C ATOM 2051 O TRP A 127 15.632 5.215 1.825 1.00 0.00 O ATOM 2052 CB TRP A 127 18.121 7.436 1.181 1.00 0.00 C ATOM 2053 CG TRP A 127 18.416 7.105 2.612 1.00 0.00 C ATOM 2054 CD1 TRP A 127 17.931 7.729 3.710 1.00 0.00 C ATOM 2055 CD2 TRP A 127 19.240 6.022 3.116 1.00 0.00 C ATOM 2056 NE1 TRP A 127 18.357 7.071 4.844 1.00 0.00 N ATOM 2057 CE2 TRP A 127 19.091 5.952 4.531 1.00 0.00 C ATOM 2058 CE3 TRP A 127 20.085 5.083 2.501 1.00 0.00 C ATOM 2059 CZ2 TRP A 127 19.664 4.932 5.300 1.00 0.00 C ATOM 2060 CZ3 TRP A 127 20.728 4.098 3.274 1.00 0.00 C ATOM 2061 CH2 TRP A 127 20.503 4.008 4.655 1.00 0.00 C ATOM 0 HA TRP A 127 16.668 7.231 -0.367 1.00 0.00 H new ATOM 0 HB2 TRP A 127 18.859 6.942 0.549 1.00 0.00 H new ATOM 0 HB3 TRP A 127 18.246 8.509 1.038 1.00 0.00 H new ATOM 0 HD1 TRP A 127 17.305 8.609 3.700 1.00 0.00 H new ATOM 0 HE1 TRP A 127 18.153 7.376 5.796 1.00 0.00 H new ATOM 0 HE3 TRP A 127 20.242 5.117 1.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 19.467 4.858 6.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 21.403 3.403 2.797 1.00 0.00 H new ATOM 0 HH2 TRP A 127 20.977 3.224 5.226 1.00 0.00 H new ATOM 2072 N ARG A 128 16.898 4.644 0.053 1.00 0.00 N ATOM 2073 CA ARG A 128 16.434 3.245 0.023 1.00 0.00 C ATOM 2074 C ARG A 128 17.484 2.222 -0.388 1.00 0.00 C ATOM 2075 O ARG A 128 17.129 1.071 -0.637 1.00 0.00 O ATOM 2076 CB ARG A 128 15.102 3.118 -0.758 1.00 0.00 C ATOM 2077 CG ARG A 128 15.130 3.423 -2.268 1.00 0.00 C ATOM 2078 CD ARG A 128 13.689 3.438 -2.816 1.00 0.00 C ATOM 2079 NE ARG A 128 13.590 3.833 -4.233 1.00 0.00 N ATOM 2080 CZ ARG A 128 12.475 4.230 -4.866 1.00 0.00 C ATOM 2081 NH1 ARG A 128 11.302 4.236 -4.243 1.00 0.00 N ATOM 2082 NH2 ARG A 128 12.524 4.644 -6.127 1.00 0.00 N ATOM 0 H ARG A 128 17.628 4.856 -0.627 1.00 0.00 H new ATOM 0 HA ARG A 128 16.235 2.977 1.060 1.00 0.00 H new ATOM 0 HB2 ARG A 128 14.731 2.101 -0.627 1.00 0.00 H new ATOM 0 HB3 ARG A 128 14.375 3.785 -0.294 1.00 0.00 H new ATOM 0 HG2 ARG A 128 15.608 4.386 -2.447 1.00 0.00 H new ATOM 0 HG3 ARG A 128 15.722 2.671 -2.791 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.255 2.445 -2.695 1.00 0.00 H new ATOM 0 HD3 ARG A 128 13.090 4.123 -2.216 1.00 0.00 H new ATOM 0 HE ARG A 128 14.448 3.802 -4.783 1.00 0.00 H new ATOM 0 HH11 ARG A 128 11.240 3.936 -3.270 1.00 0.00 H new ATOM 0 HH12 ARG A 128 10.463 4.540 -4.738 1.00 0.00 H new ATOM 0 HH21 ARG A 128 13.415 4.662 -6.624 1.00 0.00 H new ATOM 0 HH22 ARG A 128 11.671 4.944 -6.599 1.00 0.00 H new ATOM 2096 N TYR A 129 18.767 2.582 -0.376 1.00 0.00 N ATOM 2097 CA TYR A 129 19.829 1.668 -0.748 1.00 0.00 C ATOM 2098 C TYR A 129 21.055 1.915 0.125 1.00 0.00 C ATOM 2099 O TYR A 129 21.336 3.061 0.466 1.00 0.00 O ATOM 2100 CB TYR A 129 20.210 1.920 -2.214 1.00 0.00 C ATOM 2101 CG TYR A 129 19.323 1.325 -3.273 1.00 0.00 C ATOM 2102 CD1 TYR A 129 19.017 -0.038 -3.220 1.00 0.00 C ATOM 2103 CD2 TYR A 129 18.968 2.074 -4.407 1.00 0.00 C ATOM 2104 CE1 TYR A 129 18.335 -0.663 -4.263 1.00 0.00 C ATOM 2105 CE2 TYR A 129 18.249 1.471 -5.450 1.00 0.00 C ATOM 2106 CZ TYR A 129 17.919 0.093 -5.382 1.00 0.00 C ATOM 2107 OH TYR A 129 17.281 -0.524 -6.409 1.00 0.00 O ATOM 0 H TYR A 129 19.091 3.512 -0.109 1.00 0.00 H new ATOM 0 HA TYR A 129 19.486 0.642 -0.613 1.00 0.00 H new ATOM 0 HB2 TYR A 129 20.246 2.998 -2.372 1.00 0.00 H new ATOM 0 HB3 TYR A 129 21.220 1.541 -2.369 1.00 0.00 H new ATOM 0 HD1 TYR A 129 19.314 -0.616 -2.357 1.00 0.00 H new ATOM 0 HD2 TYR A 129 19.249 3.115 -4.476 1.00 0.00 H new ATOM 0 HE1 TYR A 129 18.125 -1.721 -4.216 1.00 0.00 H new ATOM 0 HE2 TYR A 129 17.946 2.057 -6.306 1.00 0.00 H new ATOM 0 HH TYR A 129 17.060 0.135 -7.100 1.00 0.00 H new ATOM 2117 N VAL A 130 21.821 0.873 0.449 1.00 0.00 N ATOM 2118 CA VAL A 130 23.035 0.969 1.263 1.00 0.00 C ATOM 2119 C VAL A 130 24.140 0.094 0.661 1.00 0.00 C ATOM 2120 O VAL A 130 23.893 -1.046 0.263 1.00 0.00 O ATOM 2121 CB VAL A 130 22.676 0.607 2.723 1.00 0.00 C ATOM 2122 CG1 VAL A 130 22.628 -0.905 3.000 1.00 0.00 C ATOM 2123 CG2 VAL A 130 23.644 1.272 3.709 1.00 0.00 C ATOM 0 H VAL A 130 21.612 -0.079 0.148 1.00 0.00 H new ATOM 0 HA VAL A 130 23.432 1.984 1.268 1.00 0.00 H new ATOM 0 HB VAL A 130 21.666 0.990 2.870 1.00 0.00 H new ATOM 0 HG11 VAL A 130 22.370 -1.075 4.045 1.00 0.00 H new ATOM 0 HG12 VAL A 130 21.877 -1.368 2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 130 23.603 -1.344 2.791 1.00 0.00 H new ATOM 0 HG21 VAL A 130 23.369 1.001 4.728 1.00 0.00 H new ATOM 0 HG22 VAL A 130 24.660 0.934 3.505 1.00 0.00 H new ATOM 0 HG23 VAL A 130 23.592 2.355 3.595 1.00 0.00 H new ATOM 2133 N CYS A 131 25.357 0.630 0.581 1.00 0.00 N ATOM 2134 CA CYS A 131 26.572 -0.108 0.247 1.00 0.00 C ATOM 2135 C CYS A 131 26.824 -1.160 1.328 1.00 0.00 C ATOM 2136 O CYS A 131 26.840 -0.832 2.515 1.00 0.00 O ATOM 2137 CB CYS A 131 27.720 0.906 0.141 1.00 0.00 C ATOM 2138 SG CYS A 131 29.379 0.229 0.415 1.00 0.00 S ATOM 0 H CYS A 131 25.529 1.621 0.752 1.00 0.00 H new ATOM 0 HA CYS A 131 26.484 -0.633 -0.704 1.00 0.00 H new ATOM 0 HB2 CYS A 131 27.690 1.361 -0.849 1.00 0.00 H new ATOM 0 HB3 CYS A 131 27.547 1.703 0.864 1.00 0.00 H new ATOM 0 HG CYS A 131 30.208 0.753 -0.438 1.00 0.00 H new ATOM 2143 N ILE A 132 27.064 -2.413 0.935 1.00 0.00 N ATOM 2144 CA ILE A 132 27.335 -3.517 1.856 1.00 0.00 C ATOM 2145 C ILE A 132 28.831 -3.606 2.200 1.00 0.00 C ATOM 2146 O ILE A 132 29.445 -4.666 2.098 1.00 0.00 O ATOM 2147 CB ILE A 132 26.752 -4.845 1.332 1.00 0.00 C ATOM 2148 CG1 ILE A 132 27.300 -5.280 -0.042 1.00 0.00 C ATOM 2149 CG2 ILE A 132 25.223 -4.771 1.271 1.00 0.00 C ATOM 2150 CD1 ILE A 132 27.628 -6.764 -0.052 1.00 0.00 C ATOM 0 H ILE A 132 27.076 -2.692 -0.046 1.00 0.00 H new ATOM 0 HA ILE A 132 26.820 -3.310 2.794 1.00 0.00 H new ATOM 0 HB ILE A 132 27.072 -5.603 2.047 1.00 0.00 H new ATOM 0 HG12 ILE A 132 26.565 -5.061 -0.817 1.00 0.00 H new ATOM 0 HG13 ILE A 132 28.195 -4.704 -0.280 1.00 0.00 H new ATOM 0 HG21 ILE A 132 24.828 -5.716 0.899 1.00 0.00 H new ATOM 0 HG22 ILE A 132 24.828 -4.580 2.269 1.00 0.00 H new ATOM 0 HG23 ILE A 132 24.924 -3.964 0.602 1.00 0.00 H new ATOM 0 HD11 ILE A 132 28.013 -7.045 -1.032 1.00 0.00 H new ATOM 0 HD12 ILE A 132 28.381 -6.975 0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 132 26.726 -7.337 0.162 1.00 0.00 H new ATOM 2162 N GLY A 133 29.418 -2.492 2.623 1.00 0.00 N ATOM 2163 CA GLY A 133 30.812 -2.419 3.029 1.00 0.00 C ATOM 2164 C GLY A 133 31.042 -1.141 3.815 1.00 0.00 C ATOM 2165 O GLY A 133 30.976 -1.143 5.042 1.00 0.00 O ATOM 0 H GLY A 133 28.928 -1.600 2.694 1.00 0.00 H new ATOM 0 HA2 GLY A 133 31.071 -3.285 3.638 1.00 0.00 H new ATOM 0 HA3 GLY A 133 31.459 -2.441 2.152 1.00 0.00 H new ATOM 2169 N CYS A 134 31.234 -0.026 3.105 1.00 0.00 N ATOM 2170 CA CYS A 134 31.497 1.274 3.717 1.00 0.00 C ATOM 2171 C CYS A 134 30.223 1.901 4.296 1.00 0.00 C ATOM 2172 O CYS A 134 30.273 2.941 4.943 1.00 0.00 O ATOM 2173 CB CYS A 134 32.170 2.212 2.706 1.00 0.00 C ATOM 2174 SG CYS A 134 31.149 2.977 1.410 1.00 0.00 S ATOM 0 H CYS A 134 31.211 -0.002 2.086 1.00 0.00 H new ATOM 0 HA CYS A 134 32.180 1.119 4.552 1.00 0.00 H new ATOM 0 HB2 CYS A 134 32.648 3.015 3.267 1.00 0.00 H new ATOM 0 HB3 CYS A 134 32.964 1.651 2.213 1.00 0.00 H new ATOM 0 HG CYS A 134 30.260 2.123 0.998 1.00 0.00 H new ATOM 2179 N GLY A 135 29.074 1.278 4.036 1.00 0.00 N ATOM 2180 CA GLY A 135 27.779 1.645 4.567 1.00 0.00 C ATOM 2181 C GLY A 135 27.307 3.008 4.103 1.00 0.00 C ATOM 2182 O GLY A 135 26.559 3.691 4.802 1.00 0.00 O ATOM 0 H GLY A 135 29.028 0.467 3.420 1.00 0.00 H new ATOM 0 HA2 GLY A 135 27.046 0.894 4.271 1.00 0.00 H new ATOM 0 HA3 GLY A 135 27.824 1.635 5.656 1.00 0.00 H new ATOM 2186 N ARG A 136 27.741 3.412 2.911 1.00 0.00 N ATOM 2187 CA ARG A 136 27.314 4.653 2.305 1.00 0.00 C ATOM 2188 C ARG A 136 25.858 4.505 1.909 1.00 0.00 C ATOM 2189 O ARG A 136 25.437 3.440 1.439 1.00 0.00 O ATOM 2190 CB ARG A 136 28.224 4.978 1.132 1.00 0.00 C ATOM 2191 CG ARG A 136 27.999 6.409 0.622 1.00 0.00 C ATOM 2192 CD ARG A 136 28.795 6.656 -0.654 1.00 0.00 C ATOM 2193 NE ARG A 136 29.689 7.810 -0.529 1.00 0.00 N ATOM 2194 CZ ARG A 136 29.663 8.956 -1.213 1.00 0.00 C ATOM 2195 NH1 ARG A 136 28.583 9.357 -1.878 1.00 0.00 N ATOM 2196 NH2 ARG A 136 30.758 9.698 -1.244 1.00 0.00 N ATOM 0 H ARG A 136 28.401 2.880 2.343 1.00 0.00 H new ATOM 0 HA ARG A 136 27.389 5.491 2.998 1.00 0.00 H new ATOM 0 HB2 ARG A 136 29.265 4.858 1.434 1.00 0.00 H new ATOM 0 HB3 ARG A 136 28.043 4.270 0.323 1.00 0.00 H new ATOM 0 HG2 ARG A 136 26.938 6.570 0.432 1.00 0.00 H new ATOM 0 HG3 ARG A 136 28.298 7.125 1.388 1.00 0.00 H new ATOM 0 HD2 ARG A 136 29.380 5.768 -0.894 1.00 0.00 H new ATOM 0 HD3 ARG A 136 28.108 6.818 -1.484 1.00 0.00 H new ATOM 0 HE ARG A 136 30.426 7.727 0.171 1.00 0.00 H new ATOM 0 HH11 ARG A 136 27.740 8.783 -1.875 1.00 0.00 H new ATOM 0 HH12 ARG A 136 28.598 10.239 -2.390 1.00 0.00 H new ATOM 0 HH21 ARG A 136 31.597 9.390 -0.752 1.00 0.00 H new ATOM 0 HH22 ARG A 136 30.763 10.578 -1.760 1.00 0.00 H new ATOM 2210 N LYS A 137 25.109 5.573 2.120 1.00 0.00 N ATOM 2211 CA LYS A 137 23.698 5.672 1.805 1.00 0.00 C ATOM 2212 C LYS A 137 23.529 5.999 0.332 1.00 0.00 C ATOM 2213 O LYS A 137 24.403 6.618 -0.276 1.00 0.00 O ATOM 2214 CB LYS A 137 23.072 6.779 2.657 1.00 0.00 C ATOM 2215 CG LYS A 137 23.214 6.486 4.154 1.00 0.00 C ATOM 2216 CD LYS A 137 22.393 7.478 4.977 1.00 0.00 C ATOM 2217 CE LYS A 137 22.403 7.105 6.462 1.00 0.00 C ATOM 2218 NZ LYS A 137 23.749 7.215 7.062 1.00 0.00 N ATOM 0 H LYS A 137 25.484 6.428 2.532 1.00 0.00 H new ATOM 0 HA LYS A 137 23.204 4.724 2.019 1.00 0.00 H new ATOM 0 HB2 LYS A 137 23.549 7.731 2.425 1.00 0.00 H new ATOM 0 HB3 LYS A 137 22.017 6.881 2.404 1.00 0.00 H new ATOM 0 HG2 LYS A 137 22.882 5.469 4.364 1.00 0.00 H new ATOM 0 HG3 LYS A 137 24.263 6.545 4.444 1.00 0.00 H new ATOM 0 HD2 LYS A 137 22.796 8.483 4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 137 21.367 7.497 4.611 1.00 0.00 H new ATOM 0 HE2 LYS A 137 21.714 7.755 7.001 1.00 0.00 H new ATOM 0 HE3 LYS A 137 22.038 6.085 6.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 23.692 7.018 8.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 24.387 6.528 6.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 24.117 8.177 6.915 1.00 0.00 H new ATOM 2232 N PHE A 138 22.394 5.602 -0.233 1.00 0.00 N ATOM 2233 CA PHE A 138 22.023 5.852 -1.606 1.00 0.00 C ATOM 2234 C PHE A 138 20.507 6.022 -1.652 1.00 0.00 C ATOM 2235 O PHE A 138 19.756 5.170 -1.160 1.00 0.00 O ATOM 2236 CB PHE A 138 22.505 4.683 -2.476 1.00 0.00 C ATOM 2237 CG PHE A 138 24.002 4.615 -2.662 1.00 0.00 C ATOM 2238 CD1 PHE A 138 24.782 3.916 -1.726 1.00 0.00 C ATOM 2239 CD2 PHE A 138 24.621 5.269 -3.742 1.00 0.00 C ATOM 2240 CE1 PHE A 138 26.179 3.940 -1.825 1.00 0.00 C ATOM 2241 CE2 PHE A 138 26.021 5.249 -3.867 1.00 0.00 C ATOM 2242 CZ PHE A 138 26.800 4.586 -2.905 1.00 0.00 C ATOM 0 H PHE A 138 21.685 5.077 0.280 1.00 0.00 H new ATOM 0 HA PHE A 138 22.488 6.758 -1.995 1.00 0.00 H new ATOM 0 HB2 PHE A 138 22.165 3.749 -2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 138 22.033 4.757 -3.456 1.00 0.00 H new ATOM 0 HD1 PHE A 138 24.305 3.361 -0.931 1.00 0.00 H new ATOM 0 HD2 PHE A 138 24.021 5.787 -4.476 1.00 0.00 H new ATOM 0 HE1 PHE A 138 26.780 3.460 -1.067 1.00 0.00 H new ATOM 0 HE2 PHE A 138 26.497 5.743 -4.701 1.00 0.00 H new ATOM 0 HZ PHE A 138 27.876 4.573 -2.996 1.00 0.00 H new ATOM 2252 N SER A 139 20.020 7.125 -2.212 1.00 0.00 N ATOM 2253 CA SER A 139 18.601 7.292 -2.496 1.00 0.00 C ATOM 2254 C SER A 139 18.210 6.620 -3.818 1.00 0.00 C ATOM 2255 O SER A 139 17.063 6.192 -3.968 1.00 0.00 O ATOM 2256 CB SER A 139 18.245 8.783 -2.420 1.00 0.00 C ATOM 2257 OG SER A 139 19.178 9.560 -3.147 1.00 0.00 O ATOM 0 H SER A 139 20.595 7.924 -2.480 1.00 0.00 H new ATOM 0 HA SER A 139 18.005 6.780 -1.741 1.00 0.00 H new ATOM 0 HB2 SER A 139 17.243 8.943 -2.818 1.00 0.00 H new ATOM 0 HB3 SER A 139 18.229 9.105 -1.379 1.00 0.00 H new ATOM 0 HG SER A 139 18.932 10.507 -3.087 1.00 0.00 H new ATOM 2263 N THR A 140 19.159 6.427 -4.731 1.00 0.00 N ATOM 2264 CA THR A 140 18.988 5.820 -6.043 1.00 0.00 C ATOM 2265 C THR A 140 20.200 4.970 -6.342 1.00 0.00 C ATOM 2266 O THR A 140 21.231 5.064 -5.682 1.00 0.00 O ATOM 2267 CB THR A 140 18.694 6.882 -7.119 1.00 0.00 C ATOM 2268 OG1 THR A 140 19.515 8.035 -7.025 1.00 0.00 O ATOM 2269 CG2 THR A 140 17.237 7.352 -7.007 1.00 0.00 C ATOM 0 H THR A 140 20.125 6.708 -4.562 1.00 0.00 H new ATOM 0 HA THR A 140 18.114 5.168 -6.049 1.00 0.00 H new ATOM 0 HB THR A 140 18.898 6.394 -8.072 1.00 0.00 H new ATOM 0 HG1 THR A 140 19.277 8.665 -7.737 1.00 0.00 H new ATOM 0 HG21 THR A 140 17.037 8.103 -7.771 1.00 0.00 H new ATOM 0 HG22 THR A 140 16.569 6.503 -7.149 1.00 0.00 H new ATOM 0 HG23 THR A 140 17.069 7.785 -6.021 1.00 0.00 H new ATOM 2277 N LEU A 141 19.988 4.049 -7.270 1.00 0.00 N ATOM 2278 CA LEU A 141 20.943 3.034 -7.634 1.00 0.00 C ATOM 2279 C LEU A 141 22.132 3.769 -8.257 1.00 0.00 C ATOM 2280 O LEU A 141 21.908 4.495 -9.230 1.00 0.00 O ATOM 2281 CB LEU A 141 20.247 2.095 -8.635 1.00 0.00 C ATOM 2282 CG LEU A 141 20.352 0.606 -8.312 1.00 0.00 C ATOM 2283 CD1 LEU A 141 19.584 -0.219 -9.339 1.00 0.00 C ATOM 2284 CD2 LEU A 141 21.790 0.166 -8.292 1.00 0.00 C ATOM 0 H LEU A 141 19.119 3.993 -7.801 1.00 0.00 H new ATOM 0 HA LEU A 141 21.296 2.435 -6.795 1.00 0.00 H new ATOM 0 HB2 LEU A 141 19.192 2.365 -8.689 1.00 0.00 H new ATOM 0 HB3 LEU A 141 20.671 2.266 -9.624 1.00 0.00 H new ATOM 0 HG LEU A 141 19.918 0.446 -7.325 1.00 0.00 H new ATOM 0 HD11 LEU A 141 19.670 -1.277 -9.093 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.534 0.072 -9.328 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.999 -0.042 -10.331 1.00 0.00 H new ATOM 0 HD21 LEU A 141 21.842 -0.898 -8.060 1.00 0.00 H new ATOM 0 HD22 LEU A 141 22.239 0.347 -9.268 1.00 0.00 H new ATOM 0 HD23 LEU A 141 22.332 0.730 -7.533 1.00 0.00 H new ATOM 2296 N PRO A 142 23.364 3.646 -7.746 1.00 0.00 N ATOM 2297 CA PRO A 142 24.522 4.190 -8.444 1.00 0.00 C ATOM 2298 C PRO A 142 24.681 3.471 -9.793 1.00 0.00 C ATOM 2299 O PRO A 142 24.213 2.335 -9.928 1.00 0.00 O ATOM 2300 CB PRO A 142 25.712 3.923 -7.521 1.00 0.00 C ATOM 2301 CG PRO A 142 25.266 2.681 -6.756 1.00 0.00 C ATOM 2302 CD PRO A 142 23.776 2.899 -6.573 1.00 0.00 C ATOM 0 HA PRO A 142 24.431 5.255 -8.659 1.00 0.00 H new ATOM 0 HB2 PRO A 142 26.629 3.746 -8.083 1.00 0.00 H new ATOM 0 HB3 PRO A 142 25.904 4.763 -6.854 1.00 0.00 H new ATOM 0 HG2 PRO A 142 25.473 1.768 -7.315 1.00 0.00 H new ATOM 0 HG3 PRO A 142 25.780 2.592 -5.799 1.00 0.00 H new ATOM 0 HD2 PRO A 142 23.243 1.951 -6.501 1.00 0.00 H new ATOM 0 HD3 PRO A 142 23.567 3.453 -5.658 1.00 0.00 H new ATOM 2310 N PRO A 143 25.359 4.072 -10.783 1.00 0.00 N ATOM 2311 CA PRO A 143 25.629 3.390 -12.036 1.00 0.00 C ATOM 2312 C PRO A 143 26.476 2.145 -11.752 1.00 0.00 C ATOM 2313 O PRO A 143 27.473 2.202 -11.030 1.00 0.00 O ATOM 2314 CB PRO A 143 26.310 4.416 -12.943 1.00 0.00 C ATOM 2315 CG PRO A 143 26.878 5.459 -11.982 1.00 0.00 C ATOM 2316 CD PRO A 143 25.960 5.395 -10.761 1.00 0.00 C ATOM 0 HA PRO A 143 24.732 3.028 -12.539 1.00 0.00 H new ATOM 0 HB2 PRO A 143 27.097 3.957 -13.541 1.00 0.00 H new ATOM 0 HB3 PRO A 143 25.601 4.863 -13.640 1.00 0.00 H new ATOM 0 HG2 PRO A 143 27.910 5.232 -11.715 1.00 0.00 H new ATOM 0 HG3 PRO A 143 26.876 6.453 -12.429 1.00 0.00 H new ATOM 0 HD2 PRO A 143 26.522 5.553 -9.841 1.00 0.00 H new ATOM 0 HD3 PRO A 143 25.196 6.172 -10.805 1.00 0.00 H new ATOM 2324 N GLY A 144 26.025 1.004 -12.267 1.00 0.00 N ATOM 2325 CA GLY A 144 26.620 -0.306 -12.046 1.00 0.00 C ATOM 2326 C GLY A 144 26.085 -1.008 -10.798 1.00 0.00 C ATOM 2327 O GLY A 144 26.314 -2.208 -10.643 1.00 0.00 O ATOM 0 H GLY A 144 25.204 0.968 -12.872 1.00 0.00 H new ATOM 0 HA2 GLY A 144 26.433 -0.934 -12.917 1.00 0.00 H new ATOM 0 HA3 GLY A 144 27.701 -0.197 -11.958 1.00 0.00 H new ATOM 2331 N GLY A 145 25.331 -0.315 -9.939 1.00 0.00 N ATOM 2332 CA GLY A 145 24.787 -0.870 -8.709 1.00 0.00 C ATOM 2333 C GLY A 145 25.895 -1.389 -7.794 1.00 0.00 C ATOM 2334 O GLY A 145 25.763 -2.457 -7.192 1.00 0.00 O ATOM 0 H GLY A 145 25.081 0.663 -10.087 1.00 0.00 H new ATOM 0 HA2 GLY A 145 24.210 -0.106 -8.187 1.00 0.00 H new ATOM 0 HA3 GLY A 145 24.100 -1.682 -8.947 1.00 0.00 H new ATOM 2338 N VAL A 146 26.971 -0.618 -7.667 1.00 0.00 N ATOM 2339 CA VAL A 146 28.074 -0.839 -6.741 1.00 0.00 C ATOM 2340 C VAL A 146 28.455 0.533 -6.185 1.00 0.00 C ATOM 2341 O VAL A 146 27.957 1.550 -6.655 1.00 0.00 O ATOM 2342 CB VAL A 146 29.258 -1.569 -7.412 1.00 0.00 C ATOM 2343 CG1 VAL A 146 28.867 -2.955 -7.948 1.00 0.00 C ATOM 2344 CG2 VAL A 146 29.909 -0.759 -8.544 1.00 0.00 C ATOM 0 H VAL A 146 27.102 0.219 -8.236 1.00 0.00 H new ATOM 0 HA VAL A 146 27.776 -1.502 -5.929 1.00 0.00 H new ATOM 0 HB VAL A 146 29.991 -1.689 -6.614 1.00 0.00 H new ATOM 0 HG11 VAL A 146 29.735 -3.425 -8.410 1.00 0.00 H new ATOM 0 HG12 VAL A 146 28.513 -3.576 -7.126 1.00 0.00 H new ATOM 0 HG13 VAL A 146 28.075 -2.848 -8.689 1.00 0.00 H new ATOM 0 HG21 VAL A 146 30.733 -1.329 -8.972 1.00 0.00 H new ATOM 0 HG22 VAL A 146 29.169 -0.555 -9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 146 30.287 0.183 -8.146 1.00 0.00 H new ATOM 2354 N CYS A 147 29.273 0.582 -5.146 1.00 0.00 N ATOM 2355 CA CYS A 147 29.631 1.788 -4.424 1.00 0.00 C ATOM 2356 C CYS A 147 30.674 2.598 -5.187 1.00 0.00 C ATOM 2357 O CYS A 147 31.833 2.194 -5.165 1.00 0.00 O ATOM 2358 CB CYS A 147 30.110 1.337 -3.037 1.00 0.00 C ATOM 2359 SG CYS A 147 30.309 2.634 -1.799 1.00 0.00 S ATOM 0 H CYS A 147 29.723 -0.252 -4.769 1.00 0.00 H new ATOM 0 HA CYS A 147 28.781 2.462 -4.317 1.00 0.00 H new ATOM 0 HB2 CYS A 147 29.402 0.603 -2.653 1.00 0.00 H new ATOM 0 HB3 CYS A 147 31.066 0.827 -3.154 1.00 0.00 H new ATOM 0 HG CYS A 147 31.087 2.210 -0.848 1.00 0.00 H new ATOM 2364 N PRO A 148 30.337 3.780 -5.739 1.00 0.00 N ATOM 2365 CA PRO A 148 31.309 4.749 -6.255 1.00 0.00 C ATOM 2366 C PRO A 148 32.265 5.329 -5.190 1.00 0.00 C ATOM 2367 O PRO A 148 32.880 6.368 -5.416 1.00 0.00 O ATOM 2368 CB PRO A 148 30.458 5.849 -6.902 1.00 0.00 C ATOM 2369 CG PRO A 148 29.100 5.758 -6.229 1.00 0.00 C ATOM 2370 CD PRO A 148 28.986 4.267 -6.003 1.00 0.00 C ATOM 0 HA PRO A 148 31.986 4.261 -6.956 1.00 0.00 H new ATOM 0 HB2 PRO A 148 30.906 6.831 -6.752 1.00 0.00 H new ATOM 0 HB3 PRO A 148 30.374 5.698 -7.978 1.00 0.00 H new ATOM 0 HG2 PRO A 148 29.064 6.320 -5.296 1.00 0.00 H new ATOM 0 HG3 PRO A 148 28.300 6.141 -6.862 1.00 0.00 H new ATOM 0 HD2 PRO A 148 28.326 4.052 -5.163 1.00 0.00 H new ATOM 0 HD3 PRO A 148 28.560 3.774 -6.877 1.00 0.00 H new ATOM 2378 N ASP A 149 32.355 4.710 -4.012 1.00 0.00 N ATOM 2379 CA ASP A 149 33.129 5.164 -2.859 1.00 0.00 C ATOM 2380 C ASP A 149 33.972 4.037 -2.263 1.00 0.00 C ATOM 2381 O ASP A 149 34.920 4.305 -1.534 1.00 0.00 O ATOM 2382 CB ASP A 149 32.153 5.681 -1.795 1.00 0.00 C ATOM 2383 CG ASP A 149 32.551 7.032 -1.211 1.00 0.00 C ATOM 2384 OD1 ASP A 149 32.784 7.976 -1.997 1.00 0.00 O ATOM 2385 OD2 ASP A 149 32.296 7.226 -0.003 1.00 0.00 O ATOM 0 H ASP A 149 31.865 3.835 -3.829 1.00 0.00 H new ATOM 0 HA ASP A 149 33.809 5.951 -3.185 1.00 0.00 H new ATOM 0 HB2 ASP A 149 31.159 5.762 -2.234 1.00 0.00 H new ATOM 0 HB3 ASP A 149 32.086 4.951 -0.989 1.00 0.00 H new ATOM 2390 N CYS A 150 33.629 2.768 -2.537 1.00 0.00 N ATOM 2391 CA CYS A 150 34.354 1.622 -1.997 1.00 0.00 C ATOM 2392 C CYS A 150 34.257 0.345 -2.851 1.00 0.00 C ATOM 2393 O CYS A 150 34.701 -0.715 -2.417 1.00 0.00 O ATOM 2394 CB CYS A 150 33.892 1.364 -0.556 1.00 0.00 C ATOM 2395 SG CYS A 150 32.371 0.398 -0.313 1.00 0.00 S ATOM 0 H CYS A 150 32.844 2.515 -3.137 1.00 0.00 H new ATOM 0 HA CYS A 150 35.412 1.883 -2.014 1.00 0.00 H new ATOM 0 HB2 CYS A 150 34.700 0.854 -0.032 1.00 0.00 H new ATOM 0 HB3 CYS A 150 33.756 2.330 -0.070 1.00 0.00 H new ATOM 0 HG CYS A 150 31.552 1.062 0.447 1.00 0.00 H new ATOM 2400 N GLY A 151 33.604 0.388 -4.015 1.00 0.00 N ATOM 2401 CA GLY A 151 33.463 -0.720 -4.959 1.00 0.00 C ATOM 2402 C GLY A 151 32.524 -1.839 -4.504 1.00 0.00 C ATOM 2403 O GLY A 151 32.109 -2.647 -5.332 1.00 0.00 O ATOM 0 H GLY A 151 33.138 1.236 -4.338 1.00 0.00 H new ATOM 0 HA2 GLY A 151 33.101 -0.325 -5.908 1.00 0.00 H new ATOM 0 HA3 GLY A 151 34.449 -1.146 -5.146 1.00 0.00 H new ATOM 2407 N SER A 152 32.142 -1.886 -3.227 1.00 0.00 N ATOM 2408 CA SER A 152 31.242 -2.905 -2.708 1.00 0.00 C ATOM 2409 C SER A 152 29.876 -2.824 -3.390 1.00 0.00 C ATOM 2410 O SER A 152 29.398 -1.745 -3.734 1.00 0.00 O ATOM 2411 CB SER A 152 31.067 -2.711 -1.206 1.00 0.00 C ATOM 2412 OG SER A 152 32.276 -2.935 -0.509 1.00 0.00 O ATOM 0 H SER A 152 32.452 -1.214 -2.525 1.00 0.00 H new ATOM 0 HA SER A 152 31.676 -3.884 -2.911 1.00 0.00 H new ATOM 0 HB2 SER A 152 30.714 -1.699 -1.008 1.00 0.00 H new ATOM 0 HB3 SER A 152 30.302 -3.394 -0.837 1.00 0.00 H new ATOM 0 HG SER A 152 32.675 -2.075 -0.261 1.00 0.00 H new ATOM 2418 N LYS A 153 29.201 -3.963 -3.523 1.00 0.00 N ATOM 2419 CA LYS A 153 27.816 -4.049 -3.971 1.00 0.00 C ATOM 2420 C LYS A 153 26.915 -3.216 -3.042 1.00 0.00 C ATOM 2421 O LYS A 153 27.261 -2.946 -1.890 1.00 0.00 O ATOM 2422 CB LYS A 153 27.496 -5.556 -4.031 1.00 0.00 C ATOM 2423 CG LYS A 153 26.072 -6.012 -4.356 1.00 0.00 C ATOM 2424 CD LYS A 153 25.516 -5.522 -5.698 1.00 0.00 C ATOM 2425 CE LYS A 153 24.113 -6.078 -5.984 1.00 0.00 C ATOM 2426 NZ LYS A 153 24.093 -7.553 -6.123 1.00 0.00 N ATOM 0 H LYS A 153 29.613 -4.873 -3.317 1.00 0.00 H new ATOM 0 HA LYS A 153 27.638 -3.622 -4.958 1.00 0.00 H new ATOM 0 HB2 LYS A 153 28.159 -6.001 -4.773 1.00 0.00 H new ATOM 0 HB3 LYS A 153 27.764 -5.985 -3.066 1.00 0.00 H new ATOM 0 HG2 LYS A 153 26.046 -7.102 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 153 25.409 -5.671 -3.561 1.00 0.00 H new ATOM 0 HD2 LYS A 153 25.480 -4.433 -5.698 1.00 0.00 H new ATOM 0 HD3 LYS A 153 26.193 -5.819 -6.499 1.00 0.00 H new ATOM 0 HE2 LYS A 153 23.441 -5.785 -5.178 1.00 0.00 H new ATOM 0 HE3 LYS A 153 23.729 -5.627 -6.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 23.164 -7.856 -6.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 24.833 -7.849 -6.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 24.267 -7.991 -5.196 1.00 0.00 H new ATOM 2440 N VAL A 154 25.751 -2.807 -3.532 1.00 0.00 N ATOM 2441 CA VAL A 154 24.707 -2.130 -2.750 1.00 0.00 C ATOM 2442 C VAL A 154 23.601 -3.167 -2.446 1.00 0.00 C ATOM 2443 O VAL A 154 23.514 -4.188 -3.135 1.00 0.00 O ATOM 2444 CB VAL A 154 24.144 -0.930 -3.555 1.00 0.00 C ATOM 2445 CG1 VAL A 154 23.647 0.194 -2.641 1.00 0.00 C ATOM 2446 CG2 VAL A 154 25.134 -0.311 -4.555 1.00 0.00 C ATOM 0 H VAL A 154 25.494 -2.938 -4.510 1.00 0.00 H new ATOM 0 HA VAL A 154 25.109 -1.739 -1.815 1.00 0.00 H new ATOM 0 HB VAL A 154 23.319 -1.368 -4.117 1.00 0.00 H new ATOM 0 HG11 VAL A 154 23.262 1.013 -3.248 1.00 0.00 H new ATOM 0 HG12 VAL A 154 22.853 -0.185 -1.997 1.00 0.00 H new ATOM 0 HG13 VAL A 154 24.472 0.555 -2.026 1.00 0.00 H new ATOM 0 HG21 VAL A 154 24.656 0.521 -5.073 1.00 0.00 H new ATOM 0 HG22 VAL A 154 26.012 0.051 -4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 154 25.437 -1.065 -5.282 1.00 0.00 H new ATOM 2456 N LYS A 155 22.710 -2.930 -1.476 1.00 0.00 N ATOM 2457 CA LYS A 155 21.463 -3.662 -1.311 1.00 0.00 C ATOM 2458 C LYS A 155 20.353 -2.674 -1.014 1.00 0.00 C ATOM 2459 O LYS A 155 20.622 -1.545 -0.587 1.00 0.00 O ATOM 2460 CB LYS A 155 21.575 -4.695 -0.179 1.00 0.00 C ATOM 2461 CG LYS A 155 21.813 -4.065 1.197 1.00 0.00 C ATOM 2462 CD LYS A 155 21.475 -4.967 2.380 1.00 0.00 C ATOM 2463 CE LYS A 155 22.120 -6.361 2.444 1.00 0.00 C ATOM 2464 NZ LYS A 155 21.438 -7.381 1.613 1.00 0.00 N ATOM 0 H LYS A 155 22.846 -2.205 -0.771 1.00 0.00 H new ATOM 0 HA LYS A 155 21.242 -4.204 -2.231 1.00 0.00 H new ATOM 0 HB2 LYS A 155 20.661 -5.288 -0.146 1.00 0.00 H new ATOM 0 HB3 LYS A 155 22.392 -5.381 -0.403 1.00 0.00 H new ATOM 0 HG2 LYS A 155 22.860 -3.770 1.270 1.00 0.00 H new ATOM 0 HG3 LYS A 155 21.219 -3.154 1.272 1.00 0.00 H new ATOM 0 HD2 LYS A 155 21.745 -4.434 3.292 1.00 0.00 H new ATOM 0 HD3 LYS A 155 20.393 -5.101 2.397 1.00 0.00 H new ATOM 0 HE2 LYS A 155 23.159 -6.284 2.125 1.00 0.00 H new ATOM 0 HE3 LYS A 155 22.129 -6.699 3.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 21.707 -8.331 1.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 20.408 -7.265 1.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 21.720 -7.264 0.619 1.00 0.00 H new ATOM 2478 N LEU A 156 19.113 -3.122 -1.179 1.00 0.00 N ATOM 2479 CA LEU A 156 17.949 -2.454 -0.616 1.00 0.00 C ATOM 2480 C LEU A 156 18.053 -2.474 0.913 1.00 0.00 C ATOM 2481 O LEU A 156 18.602 -3.410 1.493 1.00 0.00 O ATOM 2482 CB LEU A 156 16.693 -3.150 -1.167 1.00 0.00 C ATOM 2483 CG LEU A 156 15.363 -2.787 -0.472 1.00 0.00 C ATOM 2484 CD1 LEU A 156 14.216 -2.765 -1.480 1.00 0.00 C ATOM 2485 CD2 LEU A 156 15.010 -3.794 0.634 1.00 0.00 C ATOM 0 H LEU A 156 18.888 -3.963 -1.710 1.00 0.00 H new ATOM 0 HA LEU A 156 17.891 -1.404 -0.903 1.00 0.00 H new ATOM 0 HB2 LEU A 156 16.604 -2.911 -2.227 1.00 0.00 H new ATOM 0 HB3 LEU A 156 16.837 -4.228 -1.094 1.00 0.00 H new ATOM 0 HG LEU A 156 15.498 -1.799 -0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 156 13.288 -2.507 -0.970 1.00 0.00 H new ATOM 0 HD12 LEU A 156 14.424 -2.024 -2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 156 14.116 -3.748 -1.939 1.00 0.00 H new ATOM 0 HD21 LEU A 156 14.068 -3.506 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 156 14.912 -4.790 0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 156 15.800 -3.801 1.385 1.00 0.00 H new ATOM 2497 N ILE A 157 17.513 -1.447 1.566 1.00 0.00 N ATOM 2498 CA ILE A 157 17.297 -1.385 3.013 1.00 0.00 C ATOM 2499 C ILE A 157 15.796 -1.473 3.319 1.00 0.00 C ATOM 2500 O ILE A 157 14.980 -1.207 2.431 1.00 0.00 O ATOM 2501 CB ILE A 157 17.917 -0.101 3.619 1.00 0.00 C ATOM 2502 CG1 ILE A 157 17.907 1.112 2.674 1.00 0.00 C ATOM 2503 CG2 ILE A 157 19.348 -0.410 4.071 1.00 0.00 C ATOM 2504 CD1 ILE A 157 17.811 2.431 3.434 1.00 0.00 C ATOM 0 H ILE A 157 17.202 -0.603 1.085 1.00 0.00 H new ATOM 0 HA ILE A 157 17.799 -2.235 3.476 1.00 0.00 H new ATOM 0 HB ILE A 157 17.290 0.186 4.463 1.00 0.00 H new ATOM 0 HG12 ILE A 157 18.814 1.108 2.070 1.00 0.00 H new ATOM 0 HG13 ILE A 157 17.065 1.028 1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 157 19.796 0.487 4.500 1.00 0.00 H new ATOM 0 HG22 ILE A 157 19.330 -1.201 4.821 1.00 0.00 H new ATOM 0 HG23 ILE A 157 19.938 -0.736 3.214 1.00 0.00 H new ATOM 0 HD11 ILE A 157 17.807 3.260 2.726 1.00 0.00 H new ATOM 0 HD12 ILE A 157 16.891 2.448 4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 157 18.666 2.529 4.102 1.00 0.00 H new