USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 867 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 108 CYS SG : rot 19:sc= -5.92! USER MOD Set 1.2: A 121 MET CE :methyl 163:sc= -0.284 (180deg=-0.888) USER MOD Set 2.1: A 93 LYS NZ :NH3+ -151:sc= 0 (180deg=0) USER MOD Set 2.2: A 106 GLN :FLIP amide:sc= 0 F(o=-1!,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 165:sc= -0.0431 (180deg=-0.277) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -146:sc= -0.121 (180deg=-0.503) USER MOD Single : A 21 THR OG1 : rot -36:sc= 0.345 USER MOD Single : A 23 ASN : amide:sc= 0.0372 X(o=0.037,f=0.25) USER MOD Single : A 24 SER OG : rot -0:sc= 0.326 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.0409 USER MOD Single : A 28 THR OG1 : rot -13:sc= 0.267 USER MOD Single : A 33 LYS NZ :NH3+ -165:sc= -1.28! (180deg=-1.58!) USER MOD Single : A 37 LYS NZ :NH3+ -132:sc= -2.9! (180deg=-5.88!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl 158:sc= -0.584 (180deg=-1.71!) USER MOD Single : A 46 SER OG : rot 108:sc= -0.763 USER MOD Single : A 49 LYS NZ :NH3+ 174:sc= -3.55! (180deg=-3.84!) USER MOD Single : A 52 MET CE :methyl -127:sc= -2.3 (180deg=-5.29!) USER MOD Single : A 59 LYS NZ :NH3+ -120:sc= -1.32 (180deg=-4.04!) USER MOD Single : A 60 SER OG : rot 87:sc= 1.26 USER MOD Single : A 62 THR OG1 : rot -14:sc= -4.41! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 96:sc= -0.0108 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= -0.192 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= -15.3! C(o=-15!,f=-22!) USER MOD Single : A 109 LYS NZ :NH3+ 166:sc= -0.0325 (180deg=-0.28) USER MOD Single : A 117 HIS : no HD1:sc=-0.00519 X(o=-0.0052,f=-0.26) USER MOD Single : A 123 LYS NZ :NH3+ 158:sc= -0.694 (180deg=-1.94) USER MOD Single : A 127 GLN :FLIP amide:sc= -7.93! C(o=-15!,f=-7.9!) USER MOD Single : A 129 ASN :FLIP amide:sc= -2.09! C(o=-7.3!,f=-2.1!) USER MOD Single : A 132 GLN :FLIP amide:sc= -3.29! C(o=-5.3!,f=-3.3!) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl -123:sc= -1.14 (180deg=-2.09) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 2.067 -12.060 5.623 1.00 0.00 N ATOM 161 CA LEU A 12 1.688 -10.659 5.758 1.00 0.00 C ATOM 162 C LEU A 12 2.785 -9.738 5.239 1.00 0.00 C ATOM 163 O LEU A 12 2.499 -8.674 4.693 1.00 0.00 O ATOM 164 CB LEU A 12 1.374 -10.341 7.222 1.00 0.00 C ATOM 165 CG LEU A 12 0.176 -11.091 7.808 1.00 0.00 C ATOM 166 CD1 LEU A 12 0.050 -10.814 9.297 1.00 0.00 C ATOM 167 CD2 LEU A 12 -1.104 -10.699 7.084 1.00 0.00 C ATOM 0 HA LEU A 12 0.796 -10.488 5.156 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.254 -10.568 7.824 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.193 -9.270 7.314 1.00 0.00 H new ATOM 0 HG LEU A 12 0.338 -12.160 7.669 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.807 -11.356 9.697 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.956 -11.142 9.806 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.089 -9.745 9.458 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.946 -11.242 7.514 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.270 -9.627 7.193 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -1.014 -10.947 6.026 1.00 0.00 H new ATOM 179 N LYS A 13 4.042 -10.153 5.391 1.00 0.00 N ATOM 180 CA LYS A 13 5.160 -9.352 4.907 1.00 0.00 C ATOM 181 C LYS A 13 4.986 -9.113 3.417 1.00 0.00 C ATOM 182 O LYS A 13 5.137 -7.991 2.933 1.00 0.00 O ATOM 183 CB LYS A 13 6.489 -10.053 5.193 1.00 0.00 C ATOM 184 CG LYS A 13 7.709 -9.240 4.791 1.00 0.00 C ATOM 185 CD LYS A 13 8.998 -9.972 5.127 1.00 0.00 C ATOM 186 CE LYS A 13 10.220 -9.133 4.793 1.00 0.00 C ATOM 187 NZ LYS A 13 10.263 -7.874 5.586 1.00 0.00 N ATOM 0 H LYS A 13 4.308 -11.029 5.840 1.00 0.00 H new ATOM 0 HA LYS A 13 5.174 -8.394 5.427 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.549 -10.278 6.258 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.508 -11.006 4.664 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.674 -9.033 3.721 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.691 -8.277 5.302 1.00 0.00 H new ATOM 0 HD2 LYS A 13 9.008 -10.225 6.187 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.039 -10.911 4.575 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.122 -9.714 4.985 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.216 -8.892 3.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.214 -7.458 5.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.566 -7.201 5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 10.039 -8.082 6.580 1.00 0.00 H new ATOM 201 N GLU A 14 4.613 -10.170 2.707 1.00 0.00 N ATOM 202 CA GLU A 14 4.354 -10.073 1.282 1.00 0.00 C ATOM 203 C GLU A 14 3.057 -9.312 1.086 1.00 0.00 C ATOM 204 O GLU A 14 2.990 -8.373 0.298 1.00 0.00 O ATOM 205 CB GLU A 14 4.259 -11.465 0.653 1.00 0.00 C ATOM 206 CG GLU A 14 3.991 -11.439 -0.842 1.00 0.00 C ATOM 207 CD GLU A 14 3.904 -12.828 -1.444 1.00 0.00 C ATOM 208 OE1 GLU A 14 3.030 -13.608 -1.012 1.00 0.00 O ATOM 209 OE2 GLU A 14 4.710 -13.136 -2.347 1.00 0.00 O ATOM 0 H GLU A 14 4.484 -11.103 3.098 1.00 0.00 H new ATOM 0 HA GLU A 14 5.173 -9.547 0.792 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.189 -12.002 0.838 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.464 -12.024 1.147 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.059 -10.906 -1.031 1.00 0.00 H new ATOM 0 HG3 GLU A 14 4.784 -10.881 -1.340 1.00 0.00 H new ATOM 216 N LEU A 15 2.036 -9.719 1.843 1.00 0.00 N ATOM 217 CA LEU A 15 0.730 -9.077 1.789 1.00 0.00 C ATOM 218 C LEU A 15 0.873 -7.566 1.893 1.00 0.00 C ATOM 219 O LEU A 15 0.058 -6.816 1.355 1.00 0.00 O ATOM 220 CB LEU A 15 -0.170 -9.591 2.915 1.00 0.00 C ATOM 221 CG LEU A 15 -1.616 -9.090 2.866 1.00 0.00 C ATOM 222 CD1 LEU A 15 -2.237 -9.382 1.510 1.00 0.00 C ATOM 223 CD2 LEU A 15 -2.438 -9.724 3.977 1.00 0.00 C ATOM 0 H LEU A 15 2.094 -10.495 2.503 1.00 0.00 H new ATOM 0 HA LEU A 15 0.272 -9.323 0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.177 -10.681 2.885 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.267 -9.301 3.870 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.610 -8.010 3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.265 -9.019 1.495 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.663 -8.880 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.230 -10.457 1.330 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.463 -9.356 3.927 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.435 -10.808 3.859 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.006 -9.463 4.943 1.00 0.00 H new ATOM 235 N PHE A 16 1.921 -7.125 2.576 1.00 0.00 N ATOM 236 CA PHE A 16 2.174 -5.706 2.732 1.00 0.00 C ATOM 237 C PHE A 16 2.479 -5.065 1.384 1.00 0.00 C ATOM 238 O PHE A 16 1.876 -4.060 1.008 1.00 0.00 O ATOM 239 CB PHE A 16 3.349 -5.447 3.675 1.00 0.00 C ATOM 240 CG PHE A 16 3.855 -4.041 3.539 1.00 0.00 C ATOM 241 CD1 PHE A 16 3.005 -2.972 3.769 1.00 0.00 C ATOM 242 CD2 PHE A 16 5.155 -3.786 3.137 1.00 0.00 C ATOM 243 CE1 PHE A 16 3.441 -1.676 3.607 1.00 0.00 C ATOM 244 CE2 PHE A 16 5.595 -2.488 2.965 1.00 0.00 C ATOM 245 CZ PHE A 16 4.736 -1.431 3.201 1.00 0.00 C ATOM 0 H PHE A 16 2.606 -7.731 3.028 1.00 0.00 H new ATOM 0 HA PHE A 16 1.273 -5.265 3.158 1.00 0.00 H new ATOM 0 HB2 PHE A 16 3.039 -5.627 4.704 1.00 0.00 H new ATOM 0 HB3 PHE A 16 4.154 -6.149 3.458 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.987 -3.157 4.079 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.831 -4.609 2.956 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.769 -0.852 3.798 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.609 -2.299 2.646 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.078 -0.415 3.068 1.00 0.00 H new ATOM 255 N LYS A 17 3.425 -5.659 0.668 1.00 0.00 N ATOM 256 CA LYS A 17 3.822 -5.156 -0.633 1.00 0.00 C ATOM 257 C LYS A 17 2.790 -5.568 -1.657 1.00 0.00 C ATOM 258 O LYS A 17 2.756 -5.059 -2.779 1.00 0.00 O ATOM 259 CB LYS A 17 5.205 -5.686 -1.015 1.00 0.00 C ATOM 260 CG LYS A 17 5.238 -7.181 -1.270 1.00 0.00 C ATOM 261 CD LYS A 17 6.638 -7.659 -1.621 1.00 0.00 C ATOM 262 CE LYS A 17 7.566 -7.601 -0.418 1.00 0.00 C ATOM 263 NZ LYS A 17 8.923 -8.122 -0.737 1.00 0.00 N ATOM 0 H LYS A 17 3.931 -6.492 0.971 1.00 0.00 H new ATOM 0 HA LYS A 17 3.881 -4.068 -0.599 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.549 -5.166 -1.909 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.909 -5.447 -0.217 1.00 0.00 H new ATOM 0 HG2 LYS A 17 4.884 -7.709 -0.385 1.00 0.00 H new ATOM 0 HG3 LYS A 17 4.555 -7.427 -2.083 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.591 -8.681 -1.996 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.043 -7.043 -2.424 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.645 -6.571 -0.070 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.137 -8.181 0.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.525 -8.065 0.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.851 -9.113 -1.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.343 -7.553 -1.499 1.00 0.00 H new ATOM 277 N MET A 18 1.928 -6.485 -1.242 1.00 0.00 N ATOM 278 CA MET A 18 0.871 -6.970 -2.074 1.00 0.00 C ATOM 279 C MET A 18 -0.143 -5.861 -2.304 1.00 0.00 C ATOM 280 O MET A 18 -0.870 -5.860 -3.298 1.00 0.00 O ATOM 281 CB MET A 18 0.225 -8.180 -1.407 1.00 0.00 C ATOM 282 CG MET A 18 1.047 -9.458 -1.518 1.00 0.00 C ATOM 283 SD MET A 18 1.732 -9.709 -3.165 1.00 0.00 S ATOM 284 CE MET A 18 0.247 -9.594 -4.152 1.00 0.00 C ATOM 0 H MET A 18 1.954 -6.906 -0.313 1.00 0.00 H new ATOM 0 HA MET A 18 1.263 -7.278 -3.043 1.00 0.00 H new ATOM 0 HB2 MET A 18 0.060 -7.956 -0.353 1.00 0.00 H new ATOM 0 HB3 MET A 18 -0.754 -8.350 -1.854 1.00 0.00 H new ATOM 0 HG2 MET A 18 1.860 -9.425 -0.793 1.00 0.00 H new ATOM 0 HG3 MET A 18 0.421 -10.311 -1.256 1.00 0.00 H new ATOM 0 HE1 MET A 18 0.324 -10.268 -5.005 1.00 0.00 H new ATOM 0 HE2 MET A 18 -0.615 -9.873 -3.546 1.00 0.00 H new ATOM 0 HE3 MET A 18 0.125 -8.571 -4.508 1.00 0.00 H new ATOM 294 N ILE A 19 -0.173 -4.906 -1.375 1.00 0.00 N ATOM 295 CA ILE A 19 -1.085 -3.775 -1.473 1.00 0.00 C ATOM 296 C ILE A 19 -0.506 -2.675 -2.361 1.00 0.00 C ATOM 297 O ILE A 19 -1.168 -2.197 -3.283 1.00 0.00 O ATOM 298 CB ILE A 19 -1.398 -3.160 -0.089 1.00 0.00 C ATOM 299 CG1 ILE A 19 -2.029 -4.204 0.847 1.00 0.00 C ATOM 300 CG2 ILE A 19 -2.305 -1.952 -0.255 1.00 0.00 C ATOM 301 CD1 ILE A 19 -2.831 -3.610 1.993 1.00 0.00 C ATOM 0 H ILE A 19 0.424 -4.896 -0.548 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.004 -4.166 -1.909 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.465 -2.833 0.370 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.680 -4.854 0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.238 -4.831 1.259 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.522 -1.523 0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -1.808 -1.207 -0.876 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.236 -2.259 -0.731 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.241 -4.413 2.605 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -2.182 -2.983 2.605 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -3.646 -3.006 1.593 1.00 0.00 H new ATOM 313 N ASP A 20 0.727 -2.265 -2.063 1.00 0.00 N ATOM 314 CA ASP A 20 1.390 -1.205 -2.818 1.00 0.00 C ATOM 315 C ASP A 20 1.993 -1.710 -4.114 1.00 0.00 C ATOM 316 O ASP A 20 3.165 -1.473 -4.413 1.00 0.00 O ATOM 317 CB ASP A 20 2.466 -0.548 -1.972 1.00 0.00 C ATOM 318 CG ASP A 20 3.250 -1.555 -1.158 1.00 0.00 C ATOM 319 OD1 ASP A 20 3.898 -2.429 -1.768 1.00 0.00 O ATOM 320 OD2 ASP A 20 3.215 -1.470 0.087 1.00 0.00 O ATOM 0 H ASP A 20 1.286 -2.652 -1.303 1.00 0.00 H new ATOM 0 HA ASP A 20 0.626 -0.472 -3.075 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.148 0.003 -2.619 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.006 0.178 -1.302 1.00 0.00 H new ATOM 325 N THR A 21 1.173 -2.388 -4.882 1.00 0.00 N ATOM 326 CA THR A 21 1.585 -2.923 -6.166 1.00 0.00 C ATOM 327 C THR A 21 1.565 -1.816 -7.209 1.00 0.00 C ATOM 328 O THR A 21 1.971 -2.013 -8.355 1.00 0.00 O ATOM 329 CB THR A 21 0.652 -4.060 -6.583 1.00 0.00 C ATOM 330 OG1 THR A 21 1.118 -4.685 -7.766 1.00 0.00 O ATOM 331 CG2 THR A 21 -0.770 -3.608 -6.833 1.00 0.00 C ATOM 0 H THR A 21 0.203 -2.586 -4.638 1.00 0.00 H new ATOM 0 HA THR A 21 2.598 -3.317 -6.084 1.00 0.00 H new ATOM 0 HB THR A 21 0.653 -4.754 -5.743 1.00 0.00 H new ATOM 0 HG1 THR A 21 1.517 -4.012 -8.356 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.378 -4.464 -7.125 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.177 -3.168 -5.923 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.781 -2.866 -7.631 1.00 0.00 H new ATOM 339 N ASP A 22 1.066 -0.652 -6.798 1.00 0.00 N ATOM 340 CA ASP A 22 0.962 0.494 -7.687 1.00 0.00 C ATOM 341 C ASP A 22 1.920 1.622 -7.306 1.00 0.00 C ATOM 342 O ASP A 22 2.321 2.404 -8.169 1.00 0.00 O ATOM 343 CB ASP A 22 -0.472 1.021 -7.676 1.00 0.00 C ATOM 344 CG ASP A 22 -0.600 2.358 -8.374 1.00 0.00 C ATOM 345 OD1 ASP A 22 -0.262 2.435 -9.574 1.00 0.00 O ATOM 346 OD2 ASP A 22 -1.042 3.329 -7.724 1.00 0.00 O ATOM 0 H ASP A 22 0.727 -0.481 -5.851 1.00 0.00 H new ATOM 0 HA ASP A 22 1.238 0.155 -8.685 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.126 0.297 -8.161 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -0.813 1.118 -6.645 1.00 0.00 H new ATOM 351 N ASN A 23 2.276 1.731 -6.026 1.00 0.00 N ATOM 352 CA ASN A 23 3.167 2.799 -5.597 1.00 0.00 C ATOM 353 C ASN A 23 4.635 2.402 -5.727 1.00 0.00 C ATOM 354 O ASN A 23 5.240 2.608 -6.777 1.00 0.00 O ATOM 355 CB ASN A 23 2.857 3.247 -4.163 1.00 0.00 C ATOM 356 CG ASN A 23 2.472 4.711 -4.091 1.00 0.00 C ATOM 357 OD1 ASN A 23 1.501 5.142 -4.711 1.00 0.00 O ATOM 358 ND2 ASN A 23 3.234 5.487 -3.326 1.00 0.00 N ATOM 0 H ASN A 23 1.966 1.104 -5.284 1.00 0.00 H new ATOM 0 HA ASN A 23 2.990 3.643 -6.264 1.00 0.00 H new ATOM 0 HB2 ASN A 23 2.046 2.640 -3.762 1.00 0.00 H new ATOM 0 HB3 ASN A 23 3.729 3.071 -3.533 1.00 0.00 H new ATOM 0 HD21 ASN A 23 3.022 6.481 -3.236 1.00 0.00 H new ATOM 0 HD22 ASN A 23 4.030 5.089 -2.829 1.00 0.00 H new ATOM 365 N SER A 24 5.197 1.838 -4.658 1.00 0.00 N ATOM 366 CA SER A 24 6.604 1.422 -4.648 1.00 0.00 C ATOM 367 C SER A 24 6.957 0.722 -3.341 1.00 0.00 C ATOM 368 O SER A 24 8.122 0.683 -2.943 1.00 0.00 O ATOM 369 CB SER A 24 7.533 2.631 -4.823 1.00 0.00 C ATOM 370 OG SER A 24 7.385 3.223 -6.099 1.00 0.00 O ATOM 0 H SER A 24 4.701 1.657 -3.785 1.00 0.00 H new ATOM 0 HA SER A 24 6.742 0.731 -5.480 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.318 3.370 -4.051 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.568 2.318 -4.685 1.00 0.00 H new ATOM 0 HG SER A 24 6.713 2.729 -6.613 1.00 0.00 H new ATOM 376 N GLY A 25 5.947 0.206 -2.658 1.00 0.00 N ATOM 377 CA GLY A 25 6.171 -0.443 -1.384 1.00 0.00 C ATOM 378 C GLY A 25 5.587 0.362 -0.239 1.00 0.00 C ATOM 379 O GLY A 25 6.009 0.232 0.910 1.00 0.00 O ATOM 0 H GLY A 25 4.974 0.225 -2.964 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.723 -1.437 -1.397 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.241 -0.578 -1.227 1.00 0.00 H new ATOM 383 N THR A 26 4.583 1.172 -0.567 1.00 0.00 N ATOM 384 CA THR A 26 3.884 1.989 0.421 1.00 0.00 C ATOM 385 C THR A 26 2.393 2.009 0.126 1.00 0.00 C ATOM 386 O THR A 26 1.971 2.012 -1.035 1.00 0.00 O ATOM 387 CB THR A 26 4.411 3.415 0.457 1.00 0.00 C ATOM 388 OG1 THR A 26 4.248 4.047 -0.800 1.00 0.00 O ATOM 389 CG2 THR A 26 5.871 3.511 0.840 1.00 0.00 C ATOM 0 H THR A 26 4.233 1.280 -1.519 1.00 0.00 H new ATOM 0 HA THR A 26 4.063 1.538 1.397 1.00 0.00 H new ATOM 0 HB THR A 26 3.822 3.915 1.226 1.00 0.00 H new ATOM 0 HG1 THR A 26 4.592 4.963 -0.753 1.00 0.00 H new ATOM 0 HG21 THR A 26 6.178 4.557 0.845 1.00 0.00 H new ATOM 0 HG22 THR A 26 6.015 3.086 1.833 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.474 2.960 0.118 1.00 0.00 H new ATOM 397 N ILE A 27 1.602 1.983 1.184 1.00 0.00 N ATOM 398 CA ILE A 27 0.160 1.942 1.051 1.00 0.00 C ATOM 399 C ILE A 27 -0.493 3.285 1.313 1.00 0.00 C ATOM 400 O ILE A 27 -0.681 3.683 2.448 1.00 0.00 O ATOM 401 CB ILE A 27 -0.396 0.948 2.067 1.00 0.00 C ATOM 402 CG1 ILE A 27 0.406 -0.353 1.999 1.00 0.00 C ATOM 403 CG2 ILE A 27 -1.876 0.711 1.829 1.00 0.00 C ATOM 404 CD1 ILE A 27 -0.241 -1.505 2.717 1.00 0.00 C ATOM 0 H ILE A 27 1.937 1.990 2.147 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.061 1.652 0.024 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.296 1.360 3.071 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.551 -0.625 0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.395 -0.182 2.424 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.253 -0.000 2.564 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.416 1.653 1.926 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.024 0.310 0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.387 -2.391 2.624 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.362 -1.255 3.771 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.218 -1.705 2.277 1.00 0.00 H new ATOM 416 N THR A 28 -0.888 3.962 0.259 1.00 0.00 N ATOM 417 CA THR A 28 -1.540 5.244 0.420 1.00 0.00 C ATOM 418 C THR A 28 -3.032 5.103 0.201 1.00 0.00 C ATOM 419 O THR A 28 -3.487 4.091 -0.306 1.00 0.00 O ATOM 420 CB THR A 28 -0.942 6.261 -0.548 1.00 0.00 C ATOM 421 OG1 THR A 28 -1.139 5.856 -1.891 1.00 0.00 O ATOM 422 CG2 THR A 28 0.543 6.461 -0.340 1.00 0.00 C ATOM 0 H THR A 28 -0.772 3.653 -0.706 1.00 0.00 H new ATOM 0 HA THR A 28 -1.377 5.601 1.437 1.00 0.00 H new ATOM 0 HB THR A 28 -1.458 7.200 -0.346 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.427 4.920 -1.911 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.915 7.194 -1.055 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.723 6.819 0.674 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.062 5.514 -0.488 1.00 0.00 H new ATOM 430 N PHE A 29 -3.776 6.116 0.614 1.00 0.00 N ATOM 431 CA PHE A 29 -5.234 6.132 0.501 1.00 0.00 C ATOM 432 C PHE A 29 -5.717 5.413 -0.766 1.00 0.00 C ATOM 433 O PHE A 29 -6.771 4.779 -0.760 1.00 0.00 O ATOM 434 CB PHE A 29 -5.714 7.584 0.500 1.00 0.00 C ATOM 435 CG PHE A 29 -7.196 7.737 0.645 1.00 0.00 C ATOM 436 CD1 PHE A 29 -7.799 7.542 1.871 1.00 0.00 C ATOM 437 CD2 PHE A 29 -7.986 8.074 -0.442 1.00 0.00 C ATOM 438 CE1 PHE A 29 -9.161 7.679 2.018 1.00 0.00 C ATOM 439 CE2 PHE A 29 -9.353 8.213 -0.303 1.00 0.00 C ATOM 440 CZ PHE A 29 -9.943 8.015 0.932 1.00 0.00 C ATOM 0 H PHE A 29 -3.388 6.957 1.040 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.653 5.597 1.353 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.223 8.118 1.313 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -5.400 8.059 -0.429 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -7.195 7.278 2.726 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.528 8.230 -1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -9.618 7.523 2.984 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -9.960 8.476 -1.157 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.012 8.123 1.046 1.00 0.00 H new ATOM 450 N ASP A 30 -4.934 5.498 -1.840 1.00 0.00 N ATOM 451 CA ASP A 30 -5.282 4.834 -3.097 1.00 0.00 C ATOM 452 C ASP A 30 -4.993 3.333 -3.014 1.00 0.00 C ATOM 453 O ASP A 30 -5.835 2.505 -3.366 1.00 0.00 O ATOM 454 CB ASP A 30 -4.502 5.451 -4.260 1.00 0.00 C ATOM 455 CG ASP A 30 -4.816 4.784 -5.586 1.00 0.00 C ATOM 456 OD1 ASP A 30 -5.996 4.805 -5.996 1.00 0.00 O ATOM 457 OD2 ASP A 30 -3.883 4.241 -6.212 1.00 0.00 O ATOM 0 H ASP A 30 -4.057 6.018 -1.866 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.349 4.975 -3.271 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.735 6.514 -4.327 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.433 5.371 -4.060 1.00 0.00 H new ATOM 462 N GLU A 31 -3.802 2.993 -2.526 1.00 0.00 N ATOM 463 CA GLU A 31 -3.397 1.597 -2.371 1.00 0.00 C ATOM 464 C GLU A 31 -4.124 0.939 -1.212 1.00 0.00 C ATOM 465 O GLU A 31 -4.289 -0.277 -1.184 1.00 0.00 O ATOM 466 CB GLU A 31 -1.897 1.491 -2.155 1.00 0.00 C ATOM 467 CG GLU A 31 -1.118 1.467 -3.453 1.00 0.00 C ATOM 468 CD GLU A 31 -1.045 2.821 -4.133 1.00 0.00 C ATOM 469 OE1 GLU A 31 -1.593 3.798 -3.581 1.00 0.00 O ATOM 470 OE2 GLU A 31 -0.432 2.907 -5.217 1.00 0.00 O ATOM 0 H GLU A 31 -3.097 3.668 -2.230 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.663 1.077 -3.291 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.561 2.333 -1.550 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.679 0.585 -1.589 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.106 1.112 -3.255 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.580 0.751 -4.133 1.00 0.00 H new ATOM 477 N LEU A 32 -4.554 1.754 -0.257 1.00 0.00 N ATOM 478 CA LEU A 32 -5.251 1.260 0.912 1.00 0.00 C ATOM 479 C LEU A 32 -6.360 0.309 0.487 1.00 0.00 C ATOM 480 O LEU A 32 -6.461 -0.818 0.972 1.00 0.00 O ATOM 481 CB LEU A 32 -5.828 2.422 1.713 1.00 0.00 C ATOM 482 CG LEU A 32 -6.152 2.109 3.181 1.00 0.00 C ATOM 483 CD1 LEU A 32 -7.395 1.237 3.295 1.00 0.00 C ATOM 484 CD2 LEU A 32 -4.970 1.430 3.857 1.00 0.00 C ATOM 0 H LEU A 32 -4.429 2.766 -0.275 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.546 0.721 1.545 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.120 3.250 1.683 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.739 2.764 1.222 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.351 3.054 3.687 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.600 1.032 4.346 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.246 1.757 2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.230 0.298 2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.219 1.216 4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.741 0.498 3.340 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.102 2.088 3.820 1.00 0.00 H new ATOM 496 N LYS A 33 -7.179 0.786 -0.439 1.00 0.00 N ATOM 497 CA LYS A 33 -8.289 0.007 -0.974 1.00 0.00 C ATOM 498 C LYS A 33 -7.813 -0.934 -2.069 1.00 0.00 C ATOM 499 O LYS A 33 -8.266 -2.074 -2.160 1.00 0.00 O ATOM 500 CB LYS A 33 -9.357 0.938 -1.544 1.00 0.00 C ATOM 501 CG LYS A 33 -8.823 1.915 -2.582 1.00 0.00 C ATOM 502 CD LYS A 33 -9.888 2.884 -3.042 1.00 0.00 C ATOM 503 CE LYS A 33 -10.463 3.662 -1.873 1.00 0.00 C ATOM 504 NZ LYS A 33 -9.454 4.562 -1.251 1.00 0.00 N ATOM 0 H LYS A 33 -7.095 1.720 -0.840 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.710 -0.582 -0.159 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -10.147 0.338 -1.995 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.810 1.500 -0.728 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.984 2.470 -2.161 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.441 1.361 -3.440 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.464 3.576 -3.770 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -10.685 2.339 -3.547 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.314 4.252 -2.214 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.838 2.965 -1.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -9.797 4.878 -0.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.557 4.049 -1.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -9.302 5.389 -1.863 1.00 0.00 H new ATOM 518 N ASP A 34 -6.911 -0.432 -2.904 1.00 0.00 N ATOM 519 CA ASP A 34 -6.366 -1.193 -4.021 1.00 0.00 C ATOM 520 C ASP A 34 -6.120 -2.656 -3.654 1.00 0.00 C ATOM 521 O ASP A 34 -6.713 -3.555 -4.247 1.00 0.00 O ATOM 522 CB ASP A 34 -5.064 -0.545 -4.491 1.00 0.00 C ATOM 523 CG ASP A 34 -4.573 -1.115 -5.808 1.00 0.00 C ATOM 524 OD1 ASP A 34 -4.301 -2.332 -5.866 1.00 0.00 O ATOM 525 OD2 ASP A 34 -4.461 -0.342 -6.783 1.00 0.00 O ATOM 0 H ASP A 34 -6.537 0.514 -2.826 1.00 0.00 H new ATOM 0 HA ASP A 34 -7.101 -1.180 -4.826 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -5.215 0.529 -4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.297 -0.685 -3.730 1.00 0.00 H new ATOM 530 N GLY A 35 -5.237 -2.887 -2.685 1.00 0.00 N ATOM 531 CA GLY A 35 -4.914 -4.244 -2.266 1.00 0.00 C ATOM 532 C GLY A 35 -6.130 -5.100 -1.954 1.00 0.00 C ATOM 533 O GLY A 35 -6.133 -6.297 -2.240 1.00 0.00 O ATOM 0 H GLY A 35 -4.737 -2.156 -2.180 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.334 -4.728 -3.052 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.278 -4.199 -1.382 1.00 0.00 H new ATOM 537 N LEU A 36 -7.159 -4.505 -1.358 1.00 0.00 N ATOM 538 CA LEU A 36 -8.361 -5.257 -1.011 1.00 0.00 C ATOM 539 C LEU A 36 -9.269 -5.458 -2.217 1.00 0.00 C ATOM 540 O LEU A 36 -9.561 -6.592 -2.591 1.00 0.00 O ATOM 541 CB LEU A 36 -9.111 -4.576 0.120 1.00 0.00 C ATOM 542 CG LEU A 36 -8.322 -4.445 1.424 1.00 0.00 C ATOM 543 CD1 LEU A 36 -9.212 -3.916 2.529 1.00 0.00 C ATOM 544 CD2 LEU A 36 -7.718 -5.786 1.823 1.00 0.00 C ATOM 0 H LEU A 36 -7.186 -3.517 -1.108 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.045 -6.244 -0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.411 -3.581 -0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.025 -5.135 0.319 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.509 -3.737 1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -8.636 -3.829 3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.598 -2.936 2.248 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.044 -4.602 2.686 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.161 -5.672 2.753 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -8.515 -6.516 1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.046 -6.130 1.037 1.00 0.00 H new ATOM 556 N LYS A 37 -9.706 -4.366 -2.837 1.00 0.00 N ATOM 557 CA LYS A 37 -10.561 -4.463 -4.010 1.00 0.00 C ATOM 558 C LYS A 37 -9.887 -5.333 -5.066 1.00 0.00 C ATOM 559 O LYS A 37 -10.535 -5.849 -5.977 1.00 0.00 O ATOM 560 CB LYS A 37 -10.864 -3.071 -4.561 1.00 0.00 C ATOM 561 CG LYS A 37 -9.630 -2.285 -4.972 1.00 0.00 C ATOM 562 CD LYS A 37 -9.990 -0.919 -5.550 1.00 0.00 C ATOM 563 CE LYS A 37 -10.758 -0.056 -4.556 1.00 0.00 C ATOM 564 NZ LYS A 37 -12.164 -0.514 -4.373 1.00 0.00 N ATOM 0 H LYS A 37 -9.484 -3.413 -2.549 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.507 -4.927 -3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.523 -3.169 -5.423 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.408 -2.504 -3.806 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.979 -2.153 -4.108 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.067 -2.855 -5.711 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.078 -0.402 -5.849 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.590 -1.054 -6.450 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.246 -0.071 -3.594 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.758 0.978 -4.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.807 0.301 -4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.402 -1.208 -5.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.266 -0.955 -3.437 1.00 0.00 H new ATOM 578 N ARG A 38 -8.577 -5.516 -4.905 1.00 0.00 N ATOM 579 CA ARG A 38 -7.790 -6.349 -5.802 1.00 0.00 C ATOM 580 C ARG A 38 -8.027 -7.815 -5.474 1.00 0.00 C ATOM 581 O ARG A 38 -8.178 -8.652 -6.367 1.00 0.00 O ATOM 582 CB ARG A 38 -6.301 -6.020 -5.649 1.00 0.00 C ATOM 583 CG ARG A 38 -5.380 -6.907 -6.469 1.00 0.00 C ATOM 584 CD ARG A 38 -3.920 -6.669 -6.109 1.00 0.00 C ATOM 585 NE ARG A 38 -3.013 -7.414 -6.977 1.00 0.00 N ATOM 586 CZ ARG A 38 -2.857 -7.159 -8.273 1.00 0.00 C ATOM 587 NH1 ARG A 38 -3.525 -6.165 -8.843 1.00 0.00 N ATOM 588 NH2 ARG A 38 -2.024 -7.893 -8.999 1.00 0.00 N ATOM 0 H ARG A 38 -8.037 -5.091 -4.151 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.093 -6.154 -6.831 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -6.138 -4.981 -5.937 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -6.028 -6.105 -4.597 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.633 -7.954 -6.299 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -5.532 -6.711 -7.530 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.698 -5.604 -6.181 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.750 -6.960 -5.072 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.468 -8.173 -6.567 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.161 -5.593 -8.287 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -3.403 -5.972 -9.837 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -1.502 -8.654 -8.563 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.905 -7.697 -9.993 1.00 0.00 H new ATOM 602 N VAL A 39 -8.049 -8.117 -4.178 1.00 0.00 N ATOM 603 CA VAL A 39 -8.256 -9.475 -3.703 1.00 0.00 C ATOM 604 C VAL A 39 -9.698 -9.928 -3.937 1.00 0.00 C ATOM 605 O VAL A 39 -10.060 -11.064 -3.628 1.00 0.00 O ATOM 606 CB VAL A 39 -7.920 -9.589 -2.197 1.00 0.00 C ATOM 607 CG1 VAL A 39 -9.120 -9.236 -1.329 1.00 0.00 C ATOM 608 CG2 VAL A 39 -7.398 -10.977 -1.870 1.00 0.00 C ATOM 0 H VAL A 39 -7.924 -7.429 -3.435 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.587 -10.123 -4.269 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.135 -8.867 -1.974 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.848 -9.327 -0.277 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -9.430 -8.212 -1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.942 -9.916 -1.551 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.167 -11.038 -0.806 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.156 -11.719 -2.120 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.495 -11.172 -2.449 1.00 0.00 H new ATOM 618 N GLY A 40 -10.515 -9.031 -4.485 1.00 0.00 N ATOM 619 CA GLY A 40 -11.906 -9.356 -4.750 1.00 0.00 C ATOM 620 C GLY A 40 -12.856 -8.652 -3.801 1.00 0.00 C ATOM 621 O GLY A 40 -14.062 -8.900 -3.822 1.00 0.00 O ATOM 0 H GLY A 40 -10.238 -8.086 -4.750 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -12.151 -9.081 -5.776 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -12.046 -10.434 -4.667 1.00 0.00 H new ATOM 625 N SER A 41 -12.311 -7.772 -2.966 1.00 0.00 N ATOM 626 CA SER A 41 -13.105 -7.030 -2.004 1.00 0.00 C ATOM 627 C SER A 41 -13.768 -5.817 -2.655 1.00 0.00 C ATOM 628 O SER A 41 -13.413 -5.426 -3.766 1.00 0.00 O ATOM 629 CB SER A 41 -12.210 -6.581 -0.852 1.00 0.00 C ATOM 630 OG SER A 41 -11.729 -7.690 -0.114 1.00 0.00 O ATOM 0 H SER A 41 -11.314 -7.557 -2.940 1.00 0.00 H new ATOM 0 HA SER A 41 -13.894 -7.681 -1.627 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.369 -6.009 -1.243 1.00 0.00 H new ATOM 0 HB3 SER A 41 -12.768 -5.916 -0.192 1.00 0.00 H new ATOM 0 HG SER A 41 -11.157 -7.374 0.616 1.00 0.00 H new ATOM 636 N GLU A 42 -14.731 -5.227 -1.954 1.00 0.00 N ATOM 637 CA GLU A 42 -15.440 -4.058 -2.463 1.00 0.00 C ATOM 638 C GLU A 42 -15.661 -3.032 -1.354 1.00 0.00 C ATOM 639 O GLU A 42 -16.511 -3.217 -0.483 1.00 0.00 O ATOM 640 CB GLU A 42 -16.782 -4.475 -3.066 1.00 0.00 C ATOM 641 CG GLU A 42 -16.651 -5.419 -4.250 1.00 0.00 C ATOM 642 CD GLU A 42 -17.995 -5.824 -4.822 1.00 0.00 C ATOM 643 OE1 GLU A 42 -18.803 -6.418 -4.076 1.00 0.00 O ATOM 644 OE2 GLU A 42 -18.241 -5.548 -6.015 1.00 0.00 O ATOM 0 H GLU A 42 -15.038 -5.539 -1.033 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.828 -3.599 -3.240 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.384 -4.955 -2.294 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.322 -3.582 -3.382 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.058 -4.939 -5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.108 -6.312 -3.940 1.00 0.00 H new ATOM 651 N LEU A 43 -14.878 -1.959 -1.386 1.00 0.00 N ATOM 652 CA LEU A 43 -14.969 -0.909 -0.377 1.00 0.00 C ATOM 653 C LEU A 43 -15.105 0.467 -1.017 1.00 0.00 C ATOM 654 O LEU A 43 -14.844 0.639 -2.208 1.00 0.00 O ATOM 655 CB LEU A 43 -13.721 -0.928 0.498 1.00 0.00 C ATOM 656 CG LEU A 43 -13.349 -2.295 1.062 1.00 0.00 C ATOM 657 CD1 LEU A 43 -12.014 -2.221 1.782 1.00 0.00 C ATOM 658 CD2 LEU A 43 -14.436 -2.802 1.999 1.00 0.00 C ATOM 0 H LEU A 43 -14.171 -1.793 -2.102 1.00 0.00 H new ATOM 0 HA LEU A 43 -15.857 -1.101 0.226 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.881 -0.552 -0.086 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -13.867 -0.237 1.328 1.00 0.00 H new ATOM 0 HG LEU A 43 -13.258 -2.999 0.234 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -11.760 -3.204 2.180 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -11.241 -1.902 1.083 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -12.081 -1.504 2.601 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -14.152 -3.779 2.391 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -14.560 -2.102 2.825 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -15.375 -2.889 1.453 1.00 0.00 H new ATOM 670 N MET A 44 -15.480 1.451 -0.206 1.00 0.00 N ATOM 671 CA MET A 44 -15.612 2.824 -0.662 1.00 0.00 C ATOM 672 C MET A 44 -14.461 3.638 -0.097 1.00 0.00 C ATOM 673 O MET A 44 -13.826 3.220 0.869 1.00 0.00 O ATOM 674 CB MET A 44 -16.929 3.420 -0.178 1.00 0.00 C ATOM 675 CG MET A 44 -18.123 2.520 -0.411 1.00 0.00 C ATOM 676 SD MET A 44 -19.685 3.350 -0.062 1.00 0.00 S ATOM 677 CE MET A 44 -19.478 4.870 -0.987 1.00 0.00 C ATOM 0 H MET A 44 -15.699 1.317 0.781 1.00 0.00 H new ATOM 0 HA MET A 44 -15.595 2.844 -1.752 1.00 0.00 H new ATOM 0 HB2 MET A 44 -16.850 3.637 0.887 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.096 4.370 -0.685 1.00 0.00 H new ATOM 0 HG2 MET A 44 -18.120 2.177 -1.446 1.00 0.00 H new ATOM 0 HG3 MET A 44 -18.036 1.635 0.219 1.00 0.00 H new ATOM 0 HE1 MET A 44 -20.456 5.302 -1.201 1.00 0.00 H new ATOM 0 HE2 MET A 44 -18.890 5.576 -0.400 1.00 0.00 H new ATOM 0 HE3 MET A 44 -18.962 4.659 -1.924 1.00 0.00 H new ATOM 687 N GLU A 45 -14.189 4.797 -0.679 1.00 0.00 N ATOM 688 CA GLU A 45 -13.103 5.631 -0.188 1.00 0.00 C ATOM 689 C GLU A 45 -13.268 5.948 1.293 1.00 0.00 C ATOM 690 O GLU A 45 -12.393 5.612 2.091 1.00 0.00 O ATOM 691 CB GLU A 45 -12.969 6.897 -1.008 1.00 0.00 C ATOM 692 CG GLU A 45 -12.238 6.669 -2.318 1.00 0.00 C ATOM 693 CD GLU A 45 -11.951 7.959 -3.061 1.00 0.00 C ATOM 694 OE1 GLU A 45 -12.917 8.675 -3.401 1.00 0.00 O ATOM 695 OE2 GLU A 45 -10.762 8.254 -3.304 1.00 0.00 O ATOM 0 H GLU A 45 -14.696 5.176 -1.479 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.179 5.064 -0.300 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.961 7.298 -1.215 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.436 7.648 -0.425 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -11.299 6.152 -2.120 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -12.835 6.014 -2.953 1.00 0.00 H new ATOM 702 N SER A 46 -14.367 6.605 1.671 1.00 0.00 N ATOM 703 CA SER A 46 -14.614 6.967 3.066 1.00 0.00 C ATOM 704 C SER A 46 -14.282 5.840 4.044 1.00 0.00 C ATOM 705 O SER A 46 -13.915 6.096 5.191 1.00 0.00 O ATOM 706 CB SER A 46 -16.079 7.369 3.230 1.00 0.00 C ATOM 707 OG SER A 46 -16.379 7.668 4.578 1.00 0.00 O ATOM 0 H SER A 46 -15.102 6.897 1.027 1.00 0.00 H new ATOM 0 HA SER A 46 -13.953 7.800 3.305 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.293 8.237 2.606 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.722 6.560 2.882 1.00 0.00 H new ATOM 0 HG SER A 46 -16.506 8.635 4.678 1.00 0.00 H new ATOM 713 N GLU A 47 -14.405 4.598 3.592 1.00 0.00 N ATOM 714 CA GLU A 47 -14.107 3.447 4.437 1.00 0.00 C ATOM 715 C GLU A 47 -12.603 3.318 4.631 1.00 0.00 C ATOM 716 O GLU A 47 -12.121 3.066 5.734 1.00 0.00 O ATOM 717 CB GLU A 47 -14.673 2.169 3.814 1.00 0.00 C ATOM 718 CG GLU A 47 -16.181 2.199 3.633 1.00 0.00 C ATOM 719 CD GLU A 47 -16.936 2.220 4.950 1.00 0.00 C ATOM 720 OE1 GLU A 47 -16.283 2.165 6.013 1.00 0.00 O ATOM 721 OE2 GLU A 47 -18.183 2.285 4.917 1.00 0.00 O ATOM 0 H GLU A 47 -14.708 4.362 2.647 1.00 0.00 H new ATOM 0 HA GLU A 47 -14.576 3.595 5.410 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -14.202 2.008 2.844 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -14.407 1.319 4.443 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.454 3.079 3.050 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.490 1.326 3.057 1.00 0.00 H new ATOM 728 N ILE A 48 -11.874 3.517 3.542 1.00 0.00 N ATOM 729 CA ILE A 48 -10.419 3.456 3.556 1.00 0.00 C ATOM 730 C ILE A 48 -9.850 4.415 4.587 1.00 0.00 C ATOM 731 O ILE A 48 -9.120 4.013 5.493 1.00 0.00 O ATOM 732 CB ILE A 48 -9.856 3.801 2.165 1.00 0.00 C ATOM 733 CG1 ILE A 48 -9.878 2.570 1.269 1.00 0.00 C ATOM 734 CG2 ILE A 48 -8.444 4.355 2.267 1.00 0.00 C ATOM 735 CD1 ILE A 48 -11.243 1.934 1.118 1.00 0.00 C ATOM 0 H ILE A 48 -12.273 3.725 2.626 1.00 0.00 H new ATOM 0 HA ILE A 48 -10.126 2.440 3.821 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.489 4.571 1.724 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -9.508 2.847 0.282 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -9.187 1.829 1.672 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -8.072 4.590 1.270 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.451 5.260 2.874 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.795 3.613 2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.169 1.065 0.465 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.610 1.623 2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.935 2.656 0.684 1.00 0.00 H new ATOM 747 N LYS A 49 -10.207 5.683 4.442 1.00 0.00 N ATOM 748 CA LYS A 49 -9.762 6.722 5.356 1.00 0.00 C ATOM 749 C LYS A 49 -9.949 6.285 6.802 1.00 0.00 C ATOM 750 O LYS A 49 -9.216 6.716 7.690 1.00 0.00 O ATOM 751 CB LYS A 49 -10.558 7.996 5.085 1.00 0.00 C ATOM 752 CG LYS A 49 -10.478 9.035 6.188 1.00 0.00 C ATOM 753 CD LYS A 49 -11.866 9.383 6.697 1.00 0.00 C ATOM 754 CE LYS A 49 -12.469 8.235 7.484 1.00 0.00 C ATOM 755 NZ LYS A 49 -11.685 7.933 8.712 1.00 0.00 N ATOM 0 H LYS A 49 -10.810 6.018 3.691 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.700 6.909 5.195 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.201 8.442 4.157 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.603 7.730 4.929 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -9.868 8.656 7.008 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.986 9.933 5.814 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.812 10.270 7.328 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -12.513 9.629 5.855 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -13.494 8.482 7.759 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -12.514 7.347 6.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -12.183 7.213 9.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.746 7.575 8.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.577 8.800 9.277 1.00 0.00 H new ATOM 769 N ASP A 50 -10.935 5.421 7.024 1.00 0.00 N ATOM 770 CA ASP A 50 -11.227 4.919 8.361 1.00 0.00 C ATOM 771 C ASP A 50 -10.190 3.885 8.784 1.00 0.00 C ATOM 772 O ASP A 50 -9.555 4.022 9.827 1.00 0.00 O ATOM 773 CB ASP A 50 -12.630 4.311 8.400 1.00 0.00 C ATOM 774 CG ASP A 50 -13.050 3.893 9.798 1.00 0.00 C ATOM 775 OD1 ASP A 50 -12.264 4.104 10.745 1.00 0.00 O ATOM 776 OD2 ASP A 50 -14.167 3.355 9.944 1.00 0.00 O ATOM 0 H ASP A 50 -11.545 5.054 6.294 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.185 5.753 9.061 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.346 5.035 8.011 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.664 3.444 7.741 1.00 0.00 H new ATOM 781 N LEU A 51 -10.019 2.857 7.961 1.00 0.00 N ATOM 782 CA LEU A 51 -9.053 1.798 8.239 1.00 0.00 C ATOM 783 C LEU A 51 -7.669 2.373 8.487 1.00 0.00 C ATOM 784 O LEU A 51 -6.907 1.869 9.311 1.00 0.00 O ATOM 785 CB LEU A 51 -8.973 0.841 7.052 1.00 0.00 C ATOM 786 CG LEU A 51 -7.936 -0.281 7.183 1.00 0.00 C ATOM 787 CD1 LEU A 51 -8.141 -1.063 8.472 1.00 0.00 C ATOM 788 CD2 LEU A 51 -8.006 -1.209 5.980 1.00 0.00 C ATOM 0 H LEU A 51 -10.539 2.733 7.092 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.388 1.269 9.131 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -9.954 0.391 6.903 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -8.748 1.419 6.155 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.945 0.173 7.217 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -7.393 -1.853 8.541 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.040 -0.392 9.325 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.137 -1.505 8.475 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.264 -2.000 6.087 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.001 -1.650 5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.803 -0.642 5.071 1.00 0.00 H new ATOM 800 N MET A 52 -7.345 3.409 7.732 1.00 0.00 N ATOM 801 CA MET A 52 -6.045 4.048 7.818 1.00 0.00 C ATOM 802 C MET A 52 -5.900 4.899 9.074 1.00 0.00 C ATOM 803 O MET A 52 -5.096 4.599 9.946 1.00 0.00 O ATOM 804 CB MET A 52 -5.842 4.904 6.570 1.00 0.00 C ATOM 805 CG MET A 52 -4.528 5.643 6.530 1.00 0.00 C ATOM 806 SD MET A 52 -4.078 6.166 4.868 1.00 0.00 S ATOM 807 CE MET A 52 -3.816 4.581 4.086 1.00 0.00 C ATOM 0 H MET A 52 -7.973 3.828 7.046 1.00 0.00 H new ATOM 0 HA MET A 52 -5.282 3.272 7.878 1.00 0.00 H new ATOM 0 HB2 MET A 52 -5.913 4.265 5.690 1.00 0.00 H new ATOM 0 HB3 MET A 52 -6.654 5.628 6.504 1.00 0.00 H new ATOM 0 HG2 MET A 52 -4.587 6.517 7.178 1.00 0.00 H new ATOM 0 HG3 MET A 52 -3.743 5.002 6.930 1.00 0.00 H new ATOM 0 HE1 MET A 52 -2.832 4.565 3.617 1.00 0.00 H new ATOM 0 HE2 MET A 52 -3.874 3.792 4.835 1.00 0.00 H new ATOM 0 HE3 MET A 52 -4.582 4.418 3.328 1.00 0.00 H new ATOM 817 N ASP A 53 -6.667 5.967 9.157 1.00 0.00 N ATOM 818 CA ASP A 53 -6.587 6.863 10.314 1.00 0.00 C ATOM 819 C ASP A 53 -6.779 6.110 11.627 1.00 0.00 C ATOM 820 O ASP A 53 -6.317 6.554 12.680 1.00 0.00 O ATOM 821 CB ASP A 53 -7.637 7.971 10.228 1.00 0.00 C ATOM 822 CG ASP A 53 -8.975 7.532 10.788 1.00 0.00 C ATOM 823 OD1 ASP A 53 -9.625 6.664 10.173 1.00 0.00 O ATOM 824 OD2 ASP A 53 -9.360 8.042 11.860 1.00 0.00 O ATOM 0 H ASP A 53 -7.349 6.242 8.450 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.589 7.301 10.297 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -7.285 8.846 10.774 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -7.761 8.273 9.188 1.00 0.00 H new ATOM 829 N ALA A 54 -7.487 4.989 11.568 1.00 0.00 N ATOM 830 CA ALA A 54 -7.765 4.203 12.763 1.00 0.00 C ATOM 831 C ALA A 54 -6.643 3.217 13.101 1.00 0.00 C ATOM 832 O ALA A 54 -6.309 3.034 14.272 1.00 0.00 O ATOM 833 CB ALA A 54 -9.077 3.453 12.600 1.00 0.00 C ATOM 0 H ALA A 54 -7.878 4.605 10.708 1.00 0.00 H new ATOM 0 HA ALA A 54 -7.836 4.906 13.593 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.276 2.868 13.498 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.887 4.166 12.444 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.010 2.786 11.740 1.00 0.00 H new ATOM 839 N ALA A 55 -6.082 2.562 12.085 1.00 0.00 N ATOM 840 CA ALA A 55 -5.026 1.575 12.313 1.00 0.00 C ATOM 841 C ALA A 55 -3.639 2.135 12.042 1.00 0.00 C ATOM 842 O ALA A 55 -2.710 1.890 12.812 1.00 0.00 O ATOM 843 CB ALA A 55 -5.268 0.340 11.459 1.00 0.00 C ATOM 0 H ALA A 55 -6.337 2.694 11.106 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.063 1.303 13.368 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.476 -0.387 11.638 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.230 -0.100 11.721 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.272 0.621 10.406 1.00 0.00 H new ATOM 849 N ASP A 56 -3.500 2.877 10.948 1.00 0.00 N ATOM 850 CA ASP A 56 -2.214 3.465 10.580 1.00 0.00 C ATOM 851 C ASP A 56 -1.569 4.124 11.798 1.00 0.00 C ATOM 852 O ASP A 56 -1.910 5.251 12.159 1.00 0.00 O ATOM 853 CB ASP A 56 -2.387 4.495 9.456 1.00 0.00 C ATOM 854 CG ASP A 56 -1.062 4.969 8.890 1.00 0.00 C ATOM 855 OD1 ASP A 56 -0.008 4.563 9.424 1.00 0.00 O ATOM 856 OD2 ASP A 56 -1.077 5.752 7.917 1.00 0.00 O ATOM 0 H ASP A 56 -4.260 3.086 10.301 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.564 2.668 10.220 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.984 4.057 8.656 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -2.943 5.352 9.836 1.00 0.00 H new ATOM 861 N ILE A 57 -0.650 3.401 12.433 1.00 0.00 N ATOM 862 CA ILE A 57 0.038 3.893 13.622 1.00 0.00 C ATOM 863 C ILE A 57 0.686 5.247 13.364 1.00 0.00 C ATOM 864 O ILE A 57 1.002 5.987 14.295 1.00 0.00 O ATOM 865 CB ILE A 57 1.131 2.904 14.076 1.00 0.00 C ATOM 866 CG1 ILE A 57 0.600 1.468 14.048 1.00 0.00 C ATOM 867 CG2 ILE A 57 1.633 3.266 15.469 1.00 0.00 C ATOM 868 CD1 ILE A 57 -0.549 1.217 15.002 1.00 0.00 C ATOM 0 H ILE A 57 -0.364 2.467 12.141 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.714 3.994 14.405 1.00 0.00 H new ATOM 0 HB ILE A 57 1.969 2.972 13.382 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.276 1.231 13.035 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.415 0.786 14.289 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.404 2.558 15.773 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.050 4.273 15.455 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.804 3.227 16.176 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.868 0.178 14.922 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.225 1.420 16.023 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.382 1.873 14.749 1.00 0.00 H new ATOM 880 N ASP A 58 0.885 5.558 12.091 1.00 0.00 N ATOM 881 CA ASP A 58 1.505 6.816 11.696 1.00 0.00 C ATOM 882 C ASP A 58 0.691 7.504 10.606 1.00 0.00 C ATOM 883 O ASP A 58 1.246 7.958 9.608 1.00 0.00 O ATOM 884 CB ASP A 58 2.934 6.577 11.210 1.00 0.00 C ATOM 885 CG ASP A 58 3.831 6.014 12.296 1.00 0.00 C ATOM 886 OD1 ASP A 58 3.978 6.676 13.346 1.00 0.00 O ATOM 887 OD2 ASP A 58 4.388 4.915 12.095 1.00 0.00 O ATOM 0 H ASP A 58 0.625 4.954 11.311 1.00 0.00 H new ATOM 0 HA ASP A 58 1.533 7.468 12.569 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.916 5.889 10.365 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.353 7.516 10.848 1.00 0.00 H new ATOM 892 N LYS A 59 -0.630 7.527 10.792 1.00 0.00 N ATOM 893 CA LYS A 59 -1.553 8.102 9.824 1.00 0.00 C ATOM 894 C LYS A 59 -0.965 9.281 9.058 1.00 0.00 C ATOM 895 O LYS A 59 -1.067 10.439 9.468 1.00 0.00 O ATOM 896 CB LYS A 59 -2.843 8.538 10.514 1.00 0.00 C ATOM 897 CG LYS A 59 -3.792 9.263 9.589 1.00 0.00 C ATOM 898 CD LYS A 59 -4.260 8.378 8.448 1.00 0.00 C ATOM 899 CE LYS A 59 -5.055 9.170 7.420 1.00 0.00 C ATOM 900 NZ LYS A 59 -6.234 9.847 8.026 1.00 0.00 N ATOM 0 H LYS A 59 -1.086 7.146 11.621 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.760 7.316 9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.343 7.661 10.924 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.597 9.187 11.355 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.656 9.611 10.156 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.299 10.147 9.184 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.398 7.917 7.966 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -4.876 7.569 8.842 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.408 9.915 6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -5.389 8.501 6.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -7.103 9.505 7.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -6.271 9.635 9.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.153 10.875 7.889 1.00 0.00 H new ATOM 914 N SER A 60 -0.378 8.950 7.920 1.00 0.00 N ATOM 915 CA SER A 60 0.214 9.925 7.017 1.00 0.00 C ATOM 916 C SER A 60 -0.356 9.698 5.624 1.00 0.00 C ATOM 917 O SER A 60 0.219 10.116 4.618 1.00 0.00 O ATOM 918 CB SER A 60 1.737 9.781 6.991 1.00 0.00 C ATOM 919 OG SER A 60 2.289 9.942 8.286 1.00 0.00 O ATOM 0 H SER A 60 -0.298 7.987 7.593 1.00 0.00 H new ATOM 0 HA SER A 60 -0.022 10.932 7.360 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.006 8.801 6.598 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.164 10.523 6.316 1.00 0.00 H new ATOM 0 HG SER A 60 2.284 9.081 8.753 1.00 0.00 H new ATOM 925 N GLY A 61 -1.484 8.992 5.589 1.00 0.00 N ATOM 926 CA GLY A 61 -2.121 8.665 4.330 1.00 0.00 C ATOM 927 C GLY A 61 -1.296 7.651 3.567 1.00 0.00 C ATOM 928 O GLY A 61 -1.384 7.551 2.341 1.00 0.00 O ATOM 0 H GLY A 61 -1.968 8.641 6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.119 8.267 4.513 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.243 9.568 3.732 1.00 0.00 H new ATOM 932 N THR A 62 -0.481 6.904 4.319 1.00 0.00 N ATOM 933 CA THR A 62 0.402 5.892 3.753 1.00 0.00 C ATOM 934 C THR A 62 0.825 4.880 4.822 1.00 0.00 C ATOM 935 O THR A 62 1.262 5.265 5.906 1.00 0.00 O ATOM 936 CB THR A 62 1.646 6.560 3.164 1.00 0.00 C ATOM 937 OG1 THR A 62 1.286 7.562 2.231 1.00 0.00 O ATOM 938 CG2 THR A 62 2.572 5.591 2.462 1.00 0.00 C ATOM 0 H THR A 62 -0.419 6.987 5.334 1.00 0.00 H new ATOM 0 HA THR A 62 -0.140 5.365 2.967 1.00 0.00 H new ATOM 0 HB THR A 62 2.173 6.987 4.017 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.342 7.460 1.989 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.433 6.131 2.068 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.911 4.834 3.169 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.040 5.109 1.642 1.00 0.00 H new ATOM 946 N ILE A 63 0.682 3.591 4.515 1.00 0.00 N ATOM 947 CA ILE A 63 1.033 2.536 5.444 1.00 0.00 C ATOM 948 C ILE A 63 2.294 1.807 5.009 1.00 0.00 C ATOM 949 O ILE A 63 2.411 1.373 3.864 1.00 0.00 O ATOM 950 CB ILE A 63 -0.111 1.515 5.579 1.00 0.00 C ATOM 951 CG1 ILE A 63 -1.326 2.159 6.253 1.00 0.00 C ATOM 952 CG2 ILE A 63 0.352 0.290 6.355 1.00 0.00 C ATOM 953 CD1 ILE A 63 -2.526 1.240 6.352 1.00 0.00 C ATOM 0 H ILE A 63 0.322 3.258 3.621 1.00 0.00 H new ATOM 0 HA ILE A 63 1.212 3.012 6.408 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.405 1.192 4.580 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.045 2.484 7.255 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.609 3.052 5.696 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.471 -0.420 6.440 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.184 -0.180 5.830 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.675 0.591 7.351 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.347 1.765 6.840 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.834 0.935 5.352 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.262 0.358 6.935 1.00 0.00 H new ATOM 965 N ASP A 64 3.226 1.663 5.936 1.00 0.00 N ATOM 966 CA ASP A 64 4.473 0.974 5.661 1.00 0.00 C ATOM 967 C ASP A 64 4.458 -0.408 6.298 1.00 0.00 C ATOM 968 O ASP A 64 3.570 -0.714 7.089 1.00 0.00 O ATOM 969 CB ASP A 64 5.673 1.784 6.154 1.00 0.00 C ATOM 970 CG ASP A 64 5.774 3.139 5.483 1.00 0.00 C ATOM 971 OD1 ASP A 64 5.885 3.181 4.240 1.00 0.00 O ATOM 972 OD2 ASP A 64 5.746 4.160 6.202 1.00 0.00 O ATOM 0 H ASP A 64 3.141 2.016 6.889 1.00 0.00 H new ATOM 0 HA ASP A 64 4.571 0.862 4.581 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.596 1.921 7.233 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.588 1.221 5.969 1.00 0.00 H new ATOM 977 N TYR A 65 5.423 -1.245 5.917 1.00 0.00 N ATOM 978 CA TYR A 65 5.509 -2.612 6.422 1.00 0.00 C ATOM 979 C TYR A 65 5.065 -2.705 7.873 1.00 0.00 C ATOM 980 O TYR A 65 4.280 -3.581 8.234 1.00 0.00 O ATOM 981 CB TYR A 65 6.935 -3.147 6.288 1.00 0.00 C ATOM 982 CG TYR A 65 7.097 -4.546 6.840 1.00 0.00 C ATOM 983 CD1 TYR A 65 6.249 -5.570 6.441 1.00 0.00 C ATOM 984 CD2 TYR A 65 8.089 -4.838 7.768 1.00 0.00 C ATOM 985 CE1 TYR A 65 6.383 -6.846 6.949 1.00 0.00 C ATOM 986 CE2 TYR A 65 8.231 -6.114 8.280 1.00 0.00 C ATOM 987 CZ TYR A 65 7.376 -7.114 7.868 1.00 0.00 C ATOM 988 OH TYR A 65 7.511 -8.385 8.378 1.00 0.00 O ATOM 0 H TYR A 65 6.159 -0.997 5.256 1.00 0.00 H new ATOM 0 HA TYR A 65 4.835 -3.220 5.819 1.00 0.00 H new ATOM 0 HB2 TYR A 65 7.221 -3.142 5.236 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.619 -2.476 6.808 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.471 -5.365 5.721 1.00 0.00 H new ATOM 0 HD2 TYR A 65 8.759 -4.056 8.094 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.714 -7.631 6.629 1.00 0.00 H new ATOM 0 HE2 TYR A 65 9.008 -6.327 8.999 1.00 0.00 H new ATOM 0 HH TYR A 65 8.258 -8.406 9.012 1.00 0.00 H new ATOM 998 N GLY A 66 5.567 -1.802 8.703 1.00 0.00 N ATOM 999 CA GLY A 66 5.199 -1.818 10.099 1.00 0.00 C ATOM 1000 C GLY A 66 3.745 -1.452 10.316 1.00 0.00 C ATOM 1001 O GLY A 66 2.988 -2.220 10.908 1.00 0.00 O ATOM 0 H GLY A 66 6.218 -1.064 8.435 1.00 0.00 H new ATOM 0 HA2 GLY A 66 5.387 -2.810 10.510 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.832 -1.121 10.647 1.00 0.00 H new ATOM 1005 N GLU A 67 3.354 -0.277 9.832 1.00 0.00 N ATOM 1006 CA GLU A 67 1.984 0.193 9.965 1.00 0.00 C ATOM 1007 C GLU A 67 1.002 -0.836 9.400 1.00 0.00 C ATOM 1008 O GLU A 67 -0.173 -0.857 9.770 1.00 0.00 O ATOM 1009 CB GLU A 67 1.834 1.532 9.243 1.00 0.00 C ATOM 1010 CG GLU A 67 2.885 2.555 9.653 1.00 0.00 C ATOM 1011 CD GLU A 67 2.847 3.813 8.808 1.00 0.00 C ATOM 1012 OE1 GLU A 67 1.957 3.919 7.943 1.00 0.00 O ATOM 1013 OE2 GLU A 67 3.709 4.692 9.013 1.00 0.00 O ATOM 0 H GLU A 67 3.973 0.369 9.342 1.00 0.00 H new ATOM 0 HA GLU A 67 1.755 0.328 11.022 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.897 1.367 8.167 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.843 1.938 9.445 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.736 2.822 10.699 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.874 2.103 9.577 1.00 0.00 H new ATOM 1020 N PHE A 68 1.499 -1.692 8.507 1.00 0.00 N ATOM 1021 CA PHE A 68 0.689 -2.733 7.891 1.00 0.00 C ATOM 1022 C PHE A 68 0.296 -3.785 8.908 1.00 0.00 C ATOM 1023 O PHE A 68 -0.883 -3.991 9.202 1.00 0.00 O ATOM 1024 CB PHE A 68 1.489 -3.419 6.787 1.00 0.00 C ATOM 1025 CG PHE A 68 0.701 -4.431 6.012 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -0.338 -4.025 5.198 1.00 0.00 C ATOM 1027 CD2 PHE A 68 0.994 -5.782 6.099 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -1.075 -4.947 4.485 1.00 0.00 C ATOM 1029 CE2 PHE A 68 0.260 -6.709 5.387 1.00 0.00 C ATOM 1030 CZ PHE A 68 -0.776 -6.290 4.578 1.00 0.00 C ATOM 0 H PHE A 68 2.470 -1.681 8.194 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.208 -2.265 7.486 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.866 -2.662 6.100 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.356 -3.908 7.230 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.576 -2.974 5.119 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.805 -6.113 6.730 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.887 -4.617 3.854 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.496 -7.760 5.463 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.352 -7.012 4.019 1.00 0.00 H new ATOM 1040 N ILE A 69 1.312 -4.467 9.414 1.00 0.00 N ATOM 1041 CA ILE A 69 1.129 -5.536 10.377 1.00 0.00 C ATOM 1042 C ILE A 69 0.282 -5.085 11.563 1.00 0.00 C ATOM 1043 O ILE A 69 -0.584 -5.823 12.029 1.00 0.00 O ATOM 1044 CB ILE A 69 2.480 -6.059 10.897 1.00 0.00 C ATOM 1045 CG1 ILE A 69 3.525 -6.120 9.775 1.00 0.00 C ATOM 1046 CG2 ILE A 69 2.288 -7.434 11.493 1.00 0.00 C ATOM 1047 CD1 ILE A 69 3.121 -6.992 8.603 1.00 0.00 C ATOM 0 H ILE A 69 2.286 -4.293 9.167 1.00 0.00 H new ATOM 0 HA ILE A 69 0.609 -6.339 9.854 1.00 0.00 H new ATOM 0 HB ILE A 69 2.846 -5.370 11.659 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.715 -5.109 9.414 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.463 -6.493 10.186 1.00 0.00 H new ATOM 0 HG21 ILE A 69 3.243 -7.807 11.862 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.577 -7.377 12.318 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.905 -8.111 10.730 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.912 -6.983 7.853 1.00 0.00 H new ATOM 0 HD12 ILE A 69 2.960 -8.013 8.948 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.200 -6.608 8.164 1.00 0.00 H new ATOM 1059 N ALA A 70 0.534 -3.871 12.045 1.00 0.00 N ATOM 1060 CA ALA A 70 -0.212 -3.327 13.176 1.00 0.00 C ATOM 1061 C ALA A 70 -1.709 -3.319 12.884 1.00 0.00 C ATOM 1062 O ALA A 70 -2.534 -3.491 13.782 1.00 0.00 O ATOM 1063 CB ALA A 70 0.274 -1.923 13.500 1.00 0.00 C ATOM 0 H ALA A 70 1.248 -3.246 11.671 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.038 -3.966 14.042 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.290 -1.529 14.345 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.334 -1.954 13.754 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.128 -1.278 12.633 1.00 0.00 H new ATOM 1069 N ALA A 71 -2.045 -3.116 11.616 1.00 0.00 N ATOM 1070 CA ALA A 71 -3.436 -3.083 11.184 1.00 0.00 C ATOM 1071 C ALA A 71 -4.017 -4.491 11.083 1.00 0.00 C ATOM 1072 O ALA A 71 -5.222 -4.688 11.241 1.00 0.00 O ATOM 1073 CB ALA A 71 -3.555 -2.363 9.849 1.00 0.00 C ATOM 0 H ALA A 71 -1.369 -2.971 10.866 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.010 -2.537 11.933 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.599 -2.345 9.537 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.190 -1.341 9.953 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -2.961 -2.886 9.099 1.00 0.00 H new ATOM 1303 N VAL A 85 -20.005 -0.100 12.370 1.00 0.00 N ATOM 1304 CA VAL A 85 -19.686 0.660 13.577 1.00 0.00 C ATOM 1305 C VAL A 85 -18.329 1.354 13.463 1.00 0.00 C ATOM 1306 O VAL A 85 -18.087 2.368 14.123 1.00 0.00 O ATOM 1307 CB VAL A 85 -19.686 -0.242 14.828 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -18.573 -1.276 14.747 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -19.557 0.594 16.094 1.00 0.00 C ATOM 0 HA VAL A 85 -20.464 1.416 13.681 1.00 0.00 H new ATOM 0 HB VAL A 85 -20.638 -0.772 14.866 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -18.592 -1.901 15.640 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -18.719 -1.899 13.864 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -17.610 -0.770 14.679 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -19.559 -0.062 16.965 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -18.624 1.156 16.065 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -20.396 1.287 16.160 1.00 0.00 H new ATOM 1319 N SER A 86 -17.453 0.802 12.624 1.00 0.00 N ATOM 1320 CA SER A 86 -16.119 1.363 12.417 1.00 0.00 C ATOM 1321 C SER A 86 -16.179 2.883 12.291 1.00 0.00 C ATOM 1322 O SER A 86 -15.382 3.597 12.900 1.00 0.00 O ATOM 1323 CB SER A 86 -15.478 0.762 11.166 1.00 0.00 C ATOM 1324 OG SER A 86 -16.262 1.027 10.015 1.00 0.00 O ATOM 0 H SER A 86 -17.645 -0.036 12.075 1.00 0.00 H new ATOM 0 HA SER A 86 -15.510 1.113 13.286 1.00 0.00 H new ATOM 0 HB2 SER A 86 -14.478 1.174 11.032 1.00 0.00 H new ATOM 0 HB3 SER A 86 -15.364 -0.315 11.293 1.00 0.00 H new ATOM 0 HG SER A 86 -15.913 1.820 9.557 1.00 0.00 H new ATOM 1330 N ALA A 87 -17.134 3.369 11.505 1.00 0.00 N ATOM 1331 CA ALA A 87 -17.305 4.801 11.309 1.00 0.00 C ATOM 1332 C ALA A 87 -18.262 5.376 12.345 1.00 0.00 C ATOM 1333 O ALA A 87 -18.051 6.473 12.854 1.00 0.00 O ATOM 1334 CB ALA A 87 -17.801 5.088 9.907 1.00 0.00 C ATOM 0 H ALA A 87 -17.801 2.791 10.994 1.00 0.00 H new ATOM 0 HA ALA A 87 -16.336 5.283 11.437 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -17.923 6.163 9.777 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -17.078 4.715 9.182 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -18.759 4.592 9.751 1.00 0.00 H new ATOM 1340 N PHE A 88 -19.310 4.614 12.661 1.00 0.00 N ATOM 1341 CA PHE A 88 -20.300 5.025 13.656 1.00 0.00 C ATOM 1342 C PHE A 88 -19.606 5.603 14.884 1.00 0.00 C ATOM 1343 O PHE A 88 -20.180 6.398 15.624 1.00 0.00 O ATOM 1344 CB PHE A 88 -21.148 3.820 14.055 1.00 0.00 C ATOM 1345 CG PHE A 88 -22.484 4.184 14.625 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -23.392 4.914 13.874 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -22.837 3.791 15.903 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -24.625 5.245 14.389 1.00 0.00 C ATOM 1349 CE2 PHE A 88 -24.071 4.120 16.426 1.00 0.00 C ATOM 1350 CZ PHE A 88 -24.966 4.847 15.669 1.00 0.00 C ATOM 0 H PHE A 88 -19.495 3.704 12.239 1.00 0.00 H new ATOM 0 HA PHE A 88 -20.942 5.794 13.226 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -21.297 3.187 13.181 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -20.600 3.228 14.788 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -23.129 5.226 12.874 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -22.139 3.220 16.498 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -25.325 5.814 13.795 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -24.335 3.809 17.426 1.00 0.00 H new ATOM 0 HZ PHE A 88 -25.933 5.105 16.076 1.00 0.00 H new ATOM 1360 N SER A 89 -18.360 5.203 15.082 1.00 0.00 N ATOM 1361 CA SER A 89 -17.569 5.686 16.198 1.00 0.00 C ATOM 1362 C SER A 89 -16.816 6.960 15.821 1.00 0.00 C ATOM 1363 O SER A 89 -16.792 7.925 16.584 1.00 0.00 O ATOM 1364 CB SER A 89 -16.592 4.609 16.636 1.00 0.00 C ATOM 1365 OG SER A 89 -15.798 5.044 17.725 1.00 0.00 O ATOM 0 H SER A 89 -17.874 4.540 14.478 1.00 0.00 H new ATOM 0 HA SER A 89 -18.240 5.922 17.024 1.00 0.00 H new ATOM 0 HB2 SER A 89 -17.141 3.711 16.920 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.948 4.338 15.800 1.00 0.00 H new ATOM 0 HG SER A 89 -15.180 4.329 17.985 1.00 0.00 H new ATOM 1371 N TYR A 90 -16.196 6.955 14.639 1.00 0.00 N ATOM 1372 CA TYR A 90 -15.440 8.109 14.169 1.00 0.00 C ATOM 1373 C TYR A 90 -16.379 9.146 13.557 1.00 0.00 C ATOM 1374 O TYR A 90 -16.514 10.253 14.081 1.00 0.00 O ATOM 1375 CB TYR A 90 -14.388 7.665 13.149 1.00 0.00 C ATOM 1376 CG TYR A 90 -13.284 8.679 12.923 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -12.867 9.516 13.952 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -12.650 8.795 11.690 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -11.857 10.436 13.761 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -11.638 9.714 11.493 1.00 0.00 C ATOM 1381 CZ TYR A 90 -11.245 10.532 12.531 1.00 0.00 C ATOM 1382 OH TYR A 90 -10.237 11.448 12.337 1.00 0.00 O ATOM 0 H TYR A 90 -16.205 6.165 13.994 1.00 0.00 H new ATOM 0 HA TYR A 90 -14.931 8.568 15.017 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -13.944 6.728 13.485 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -14.881 7.462 12.198 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -13.343 9.445 14.919 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -12.954 8.156 10.874 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -11.548 11.078 14.572 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -11.156 9.792 10.529 1.00 0.00 H new ATOM 0 HH TYR A 90 -9.912 11.386 11.415 1.00 0.00 H new ATOM 1392 N PHE A 91 -17.049 8.777 12.463 1.00 0.00 N ATOM 1393 CA PHE A 91 -17.998 9.677 11.815 1.00 0.00 C ATOM 1394 C PHE A 91 -19.050 10.107 12.821 1.00 0.00 C ATOM 1395 O PHE A 91 -19.117 11.279 13.188 1.00 0.00 O ATOM 1396 CB PHE A 91 -18.655 9.009 10.606 1.00 0.00 C ATOM 1397 CG PHE A 91 -17.726 8.855 9.438 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -16.507 8.216 9.584 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -18.071 9.358 8.195 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -15.649 8.079 8.513 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -17.216 9.226 7.119 1.00 0.00 C ATOM 1402 CZ PHE A 91 -16.003 8.585 7.280 1.00 0.00 C ATOM 0 H PHE A 91 -16.951 7.867 12.012 1.00 0.00 H new ATOM 0 HA PHE A 91 -17.460 10.554 11.455 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -19.026 8.027 10.899 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -19.520 9.598 10.299 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -16.224 7.820 10.548 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -19.019 9.859 8.066 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -14.702 7.576 8.640 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -17.495 9.623 6.154 1.00 0.00 H new ATOM 0 HZ PHE A 91 -15.332 8.480 6.440 1.00 0.00 H new ATOM 1412 N ASP A 92 -19.843 9.147 13.301 1.00 0.00 N ATOM 1413 CA ASP A 92 -20.844 9.449 14.313 1.00 0.00 C ATOM 1414 C ASP A 92 -20.137 9.593 15.650 1.00 0.00 C ATOM 1415 O ASP A 92 -20.276 8.758 16.541 1.00 0.00 O ATOM 1416 CB ASP A 92 -21.910 8.352 14.384 1.00 0.00 C ATOM 1417 CG ASP A 92 -22.995 8.663 15.399 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -22.975 9.774 15.969 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -23.869 7.800 15.615 1.00 0.00 O ATOM 0 H ASP A 92 -19.810 8.171 13.008 1.00 0.00 H new ATOM 0 HA ASP A 92 -21.355 10.376 14.055 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -22.362 8.225 13.400 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -21.436 7.405 14.642 1.00 0.00 H new ATOM 1424 N LYS A 93 -19.335 10.643 15.752 1.00 0.00 N ATOM 1425 CA LYS A 93 -18.549 10.897 16.942 1.00 0.00 C ATOM 1426 C LYS A 93 -19.426 10.968 18.181 1.00 0.00 C ATOM 1427 O LYS A 93 -18.970 10.702 19.293 1.00 0.00 O ATOM 1428 CB LYS A 93 -17.753 12.188 16.772 1.00 0.00 C ATOM 1429 CG LYS A 93 -16.479 12.236 17.600 1.00 0.00 C ATOM 1430 CD LYS A 93 -15.599 13.416 17.208 1.00 0.00 C ATOM 1431 CE LYS A 93 -15.248 13.387 15.725 1.00 0.00 C ATOM 1432 NZ LYS A 93 -14.282 14.462 15.363 1.00 0.00 N ATOM 0 H LYS A 93 -19.214 11.337 15.014 1.00 0.00 H new ATOM 0 HA LYS A 93 -17.856 10.066 17.078 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -17.496 12.310 15.720 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -18.385 13.033 17.046 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.734 12.307 18.657 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -15.923 11.308 17.468 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.114 14.348 17.442 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -14.684 13.400 17.799 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -14.823 12.416 15.471 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -16.157 13.501 15.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -14.429 14.741 14.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -14.431 15.285 15.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -13.311 14.111 15.483 1.00 0.00 H new ATOM 1446 N ASP A 94 -20.686 11.321 17.981 1.00 0.00 N ATOM 1447 CA ASP A 94 -21.629 11.418 19.083 1.00 0.00 C ATOM 1448 C ASP A 94 -22.229 10.052 19.404 1.00 0.00 C ATOM 1449 O ASP A 94 -22.726 9.833 20.510 1.00 0.00 O ATOM 1450 CB ASP A 94 -22.736 12.413 18.738 1.00 0.00 C ATOM 1451 CG ASP A 94 -22.226 13.837 18.632 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -21.006 14.046 18.808 1.00 0.00 O ATOM 1453 OD2 ASP A 94 -23.044 14.744 18.372 1.00 0.00 O ATOM 0 H ASP A 94 -21.079 11.545 17.067 1.00 0.00 H new ATOM 0 HA ASP A 94 -21.095 11.772 19.965 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -23.197 12.125 17.794 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -23.514 12.365 19.500 1.00 0.00 H new ATOM 1458 N GLY A 95 -22.163 9.137 18.432 1.00 0.00 N ATOM 1459 CA GLY A 95 -22.689 7.803 18.621 1.00 0.00 C ATOM 1460 C GLY A 95 -23.983 7.821 19.399 1.00 0.00 C ATOM 1461 O GLY A 95 -24.072 7.309 20.515 1.00 0.00 O ATOM 0 H GLY A 95 -21.751 9.305 17.514 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -22.854 7.335 17.650 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -21.955 7.193 19.148 1.00 0.00 H new ATOM 1465 N SER A 96 -24.991 8.379 18.761 1.00 0.00 N ATOM 1466 CA SER A 96 -26.331 8.455 19.311 1.00 0.00 C ATOM 1467 C SER A 96 -27.249 7.777 18.317 1.00 0.00 C ATOM 1468 O SER A 96 -28.361 7.353 18.633 1.00 0.00 O ATOM 1469 CB SER A 96 -26.752 9.910 19.530 1.00 0.00 C ATOM 1470 OG SER A 96 -26.719 10.639 18.315 1.00 0.00 O ATOM 0 H SER A 96 -24.903 8.798 17.835 1.00 0.00 H new ATOM 0 HA SER A 96 -26.377 7.965 20.283 1.00 0.00 H new ATOM 0 HB2 SER A 96 -27.758 9.942 19.950 1.00 0.00 H new ATOM 0 HB3 SER A 96 -26.088 10.378 20.257 1.00 0.00 H new ATOM 0 HG SER A 96 -26.994 11.565 18.481 1.00 0.00 H new ATOM 1476 N GLY A 97 -26.725 7.671 17.101 1.00 0.00 N ATOM 1477 CA GLY A 97 -27.419 7.038 16.017 1.00 0.00 C ATOM 1478 C GLY A 97 -27.577 7.951 14.824 1.00 0.00 C ATOM 1479 O GLY A 97 -28.087 7.541 13.790 1.00 0.00 O ATOM 0 H GLY A 97 -25.802 8.027 16.852 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -26.877 6.142 15.716 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -28.403 6.716 16.358 1.00 0.00 H new ATOM 1483 N TYR A 98 -27.126 9.189 14.966 1.00 0.00 N ATOM 1484 CA TYR A 98 -27.216 10.160 13.882 1.00 0.00 C ATOM 1485 C TYR A 98 -25.925 10.952 13.727 1.00 0.00 C ATOM 1486 O TYR A 98 -25.194 11.181 14.691 1.00 0.00 O ATOM 1487 CB TYR A 98 -28.351 11.160 14.111 1.00 0.00 C ATOM 1488 CG TYR A 98 -29.453 10.682 15.021 1.00 0.00 C ATOM 1489 CD1 TYR A 98 -29.285 10.686 16.398 1.00 0.00 C ATOM 1490 CD2 TYR A 98 -30.669 10.259 14.507 1.00 0.00 C ATOM 1491 CE1 TYR A 98 -30.297 10.274 17.239 1.00 0.00 C ATOM 1492 CE2 TYR A 98 -31.689 9.849 15.342 1.00 0.00 C ATOM 1493 CZ TYR A 98 -31.499 9.857 16.708 1.00 0.00 C ATOM 1494 OH TYR A 98 -32.513 9.447 17.544 1.00 0.00 O ATOM 0 H TYR A 98 -26.695 9.546 15.819 1.00 0.00 H new ATOM 0 HA TYR A 98 -27.408 9.580 12.979 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -27.929 12.075 14.527 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -28.786 11.419 13.146 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -28.347 11.017 16.818 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -30.821 10.250 13.438 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -30.149 10.278 18.309 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -32.632 9.523 14.927 1.00 0.00 H new ATOM 0 HH TYR A 98 -33.292 9.186 17.010 1.00 0.00 H new ATOM 1504 N ILE A 99 -25.682 11.397 12.503 1.00 0.00 N ATOM 1505 CA ILE A 99 -24.523 12.204 12.177 1.00 0.00 C ATOM 1506 C ILE A 99 -24.971 13.416 11.384 1.00 0.00 C ATOM 1507 O ILE A 99 -25.237 13.313 10.193 1.00 0.00 O ATOM 1508 CB ILE A 99 -23.514 11.419 11.320 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -23.009 10.193 12.062 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -22.355 12.312 10.907 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -22.105 9.325 11.213 1.00 0.00 C ATOM 0 H ILE A 99 -26.289 11.205 11.706 1.00 0.00 H new ATOM 0 HA ILE A 99 -24.043 12.496 13.111 1.00 0.00 H new ATOM 0 HB ILE A 99 -24.026 11.081 10.419 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -22.468 10.511 12.953 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -23.860 9.602 12.400 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -21.652 11.739 10.302 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -22.733 13.153 10.326 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -21.848 12.685 11.797 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -21.775 8.465 11.795 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -22.651 8.981 10.335 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -21.237 9.904 10.897 1.00 0.00 H new ATOM 1523 N THR A 100 -25.036 14.562 12.031 1.00 0.00 N ATOM 1524 CA THR A 100 -25.446 15.767 11.349 1.00 0.00 C ATOM 1525 C THR A 100 -24.273 16.318 10.562 1.00 0.00 C ATOM 1526 O THR A 100 -23.123 16.069 10.917 1.00 0.00 O ATOM 1527 CB THR A 100 -25.961 16.789 12.364 1.00 0.00 C ATOM 1528 OG1 THR A 100 -24.915 17.218 13.217 1.00 0.00 O ATOM 1529 CG2 THR A 100 -27.075 16.244 13.241 1.00 0.00 C ATOM 0 H THR A 100 -24.812 14.682 13.019 1.00 0.00 H new ATOM 0 HA THR A 100 -26.257 15.545 10.655 1.00 0.00 H new ATOM 0 HB THR A 100 -26.352 17.617 11.773 1.00 0.00 H new ATOM 0 HG1 THR A 100 -25.263 17.872 13.858 1.00 0.00 H new ATOM 0 HG21 THR A 100 -27.398 17.015 13.940 1.00 0.00 H new ATOM 0 HG22 THR A 100 -27.917 15.945 12.616 1.00 0.00 H new ATOM 0 HG23 THR A 100 -26.711 15.380 13.797 1.00 0.00 H new ATOM 1537 N LEU A 101 -24.563 17.018 9.467 1.00 0.00 N ATOM 1538 CA LEU A 101 -23.519 17.564 8.602 1.00 0.00 C ATOM 1539 C LEU A 101 -22.286 17.999 9.391 1.00 0.00 C ATOM 1540 O LEU A 101 -21.166 17.853 8.915 1.00 0.00 O ATOM 1541 CB LEU A 101 -24.065 18.763 7.837 1.00 0.00 C ATOM 1542 CG LEU A 101 -24.819 19.773 8.702 1.00 0.00 C ATOM 1543 CD1 LEU A 101 -24.681 21.174 8.129 1.00 0.00 C ATOM 1544 CD2 LEU A 101 -26.289 19.391 8.808 1.00 0.00 C ATOM 0 H LEU A 101 -25.514 17.221 9.157 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.218 16.773 7.915 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -23.237 19.272 7.344 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -24.732 18.405 7.053 1.00 0.00 H new ATOM 0 HG LEU A 101 -24.383 19.761 9.701 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -25.224 21.879 8.758 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -23.628 21.452 8.098 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -25.092 21.196 7.120 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -26.811 20.121 9.427 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -26.734 19.376 7.813 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -26.376 18.403 9.260 1.00 0.00 H new ATOM 1556 N ASP A 102 -22.482 18.513 10.597 1.00 0.00 N ATOM 1557 CA ASP A 102 -21.357 18.935 11.426 1.00 0.00 C ATOM 1558 C ASP A 102 -20.352 17.796 11.585 1.00 0.00 C ATOM 1559 O ASP A 102 -19.169 17.949 11.279 1.00 0.00 O ATOM 1560 CB ASP A 102 -21.846 19.399 12.799 1.00 0.00 C ATOM 1561 CG ASP A 102 -22.806 20.569 12.707 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -23.869 20.416 12.069 1.00 0.00 O ATOM 1563 OD2 ASP A 102 -22.495 21.637 13.275 1.00 0.00 O ATOM 0 H ASP A 102 -23.399 18.648 11.022 1.00 0.00 H new ATOM 0 HA ASP A 102 -20.863 19.771 10.930 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -22.337 18.569 13.306 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -20.989 19.683 13.410 1.00 0.00 H new ATOM 1568 N GLU A 103 -20.836 16.650 12.056 1.00 0.00 N ATOM 1569 CA GLU A 103 -19.991 15.475 12.250 1.00 0.00 C ATOM 1570 C GLU A 103 -19.471 14.944 10.918 1.00 0.00 C ATOM 1571 O GLU A 103 -18.393 14.354 10.854 1.00 0.00 O ATOM 1572 CB GLU A 103 -20.770 14.381 12.979 1.00 0.00 C ATOM 1573 CG GLU A 103 -21.213 14.776 14.379 1.00 0.00 C ATOM 1574 CD GLU A 103 -21.985 13.674 15.078 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -21.417 12.578 15.263 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -23.158 13.908 15.438 1.00 0.00 O ATOM 0 H GLU A 103 -21.813 16.510 12.311 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.135 15.772 12.856 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -21.649 14.119 12.390 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.150 13.487 13.042 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -20.337 15.035 14.974 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.834 15.670 14.321 1.00 0.00 H new ATOM 1583 N ILE A 104 -20.239 15.161 9.853 1.00 0.00 N ATOM 1584 CA ILE A 104 -19.847 14.704 8.523 1.00 0.00 C ATOM 1585 C ILE A 104 -18.702 15.548 7.970 1.00 0.00 C ATOM 1586 O ILE A 104 -17.596 15.050 7.759 1.00 0.00 O ATOM 1587 CB ILE A 104 -21.031 14.764 7.533 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -22.072 13.694 7.864 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -20.543 14.602 6.100 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -23.325 13.795 7.021 1.00 0.00 C ATOM 0 H ILE A 104 -21.134 15.649 9.885 1.00 0.00 H new ATOM 0 HA ILE A 104 -19.521 13.669 8.629 1.00 0.00 H new ATOM 0 HB ILE A 104 -21.501 15.742 7.630 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -21.627 12.709 7.724 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -22.343 13.775 8.917 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -21.393 14.647 5.419 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -19.843 15.403 5.861 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -20.043 13.640 5.993 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -24.021 13.007 7.308 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -23.793 14.767 7.179 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -23.065 13.684 5.968 1.00 0.00 H new ATOM 1602 N GLN A 105 -18.988 16.824 7.731 1.00 0.00 N ATOM 1603 CA GLN A 105 -18.004 17.754 7.192 1.00 0.00 C ATOM 1604 C GLN A 105 -16.680 17.653 7.946 1.00 0.00 C ATOM 1605 O GLN A 105 -15.611 17.614 7.337 1.00 0.00 O ATOM 1606 CB GLN A 105 -18.537 19.188 7.260 1.00 0.00 C ATOM 1607 CG GLN A 105 -19.952 19.367 6.711 1.00 0.00 C ATOM 1608 CD GLN A 105 -20.184 18.739 5.345 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -19.874 17.569 5.119 1.00 0.00 O ATOM 1610 NE2 GLN A 105 -20.772 19.512 4.435 1.00 0.00 N ATOM 0 H GLN A 105 -19.903 17.240 7.905 1.00 0.00 H new ATOM 0 HA GLN A 105 -17.825 17.488 6.150 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -18.520 19.519 8.298 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -17.861 19.840 6.706 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -20.660 18.937 7.419 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -20.172 20.433 6.649 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -21.012 20.477 4.664 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -20.982 19.140 3.509 1.00 0.00 H new ATOM 1619 N GLN A 106 -16.760 17.611 9.272 1.00 0.00 N ATOM 1620 CA GLN A 106 -15.567 17.514 10.108 1.00 0.00 C ATOM 1621 C GLN A 106 -14.826 16.197 9.875 1.00 0.00 C ATOM 1622 O GLN A 106 -13.597 16.170 9.799 1.00 0.00 O ATOM 1623 CB GLN A 106 -15.945 17.636 11.586 1.00 0.00 C ATOM 1624 CG GLN A 106 -14.752 17.544 12.526 1.00 0.00 C ATOM 1625 CD GLN A 106 -15.136 17.648 13.993 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -16.426 17.812 14.269 1.00 0.00 O flip ATOM 1627 NE2 GLN A 106 -14.277 17.580 14.873 1.00 0.00 N flip ATOM 0 H GLN A 106 -17.637 17.643 9.791 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.903 18.333 9.832 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -16.451 18.588 11.746 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -16.657 16.850 11.837 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -14.237 16.598 12.358 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -14.046 18.338 12.285 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -13.297 17.454 14.620 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -14.546 17.650 15.854 1.00 0.00 H new ATOM 1636 N ALA A 107 -15.581 15.107 9.782 1.00 0.00 N ATOM 1637 CA ALA A 107 -14.999 13.782 9.578 1.00 0.00 C ATOM 1638 C ALA A 107 -14.468 13.592 8.160 1.00 0.00 C ATOM 1639 O ALA A 107 -13.872 12.561 7.850 1.00 0.00 O ATOM 1640 CB ALA A 107 -16.025 12.706 9.902 1.00 0.00 C ATOM 0 H ALA A 107 -16.599 15.114 9.845 1.00 0.00 H new ATOM 0 HA ALA A 107 -14.149 13.694 10.255 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -15.582 11.722 9.747 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -16.338 12.803 10.941 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -16.891 12.821 9.250 1.00 0.00 H new ATOM 1646 N CYS A 108 -14.681 14.582 7.298 1.00 0.00 N ATOM 1647 CA CYS A 108 -14.213 14.493 5.917 1.00 0.00 C ATOM 1648 C CYS A 108 -13.314 15.675 5.556 1.00 0.00 C ATOM 1649 O CYS A 108 -13.787 16.719 5.107 1.00 0.00 O ATOM 1650 CB CYS A 108 -15.402 14.413 4.956 1.00 0.00 C ATOM 1651 SG CYS A 108 -16.532 15.819 5.047 1.00 0.00 S ATOM 0 H CYS A 108 -15.170 15.447 7.527 1.00 0.00 H new ATOM 0 HA CYS A 108 -13.621 13.583 5.822 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -15.025 14.331 3.937 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -15.960 13.500 5.163 1.00 0.00 H new ATOM 0 HG CYS A 108 -15.931 16.823 5.614 1.00 0.00 H new ATOM 1657 N LYS A 109 -12.011 15.497 5.756 1.00 0.00 N ATOM 1658 CA LYS A 109 -11.037 16.542 5.454 1.00 0.00 C ATOM 1659 C LYS A 109 -10.561 16.456 4.004 1.00 0.00 C ATOM 1660 O LYS A 109 -10.562 17.453 3.281 1.00 0.00 O ATOM 1661 CB LYS A 109 -9.840 16.434 6.401 1.00 0.00 C ATOM 1662 CG LYS A 109 -10.212 16.566 7.870 1.00 0.00 C ATOM 1663 CD LYS A 109 -8.986 16.473 8.764 1.00 0.00 C ATOM 1664 CE LYS A 109 -9.360 16.560 10.235 1.00 0.00 C ATOM 1665 NZ LYS A 109 -10.270 15.455 10.643 1.00 0.00 N ATOM 0 H LYS A 109 -11.605 14.638 6.126 1.00 0.00 H new ATOM 0 HA LYS A 109 -11.525 17.506 5.595 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -9.349 15.474 6.244 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -9.116 17.208 6.147 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -10.713 17.520 8.036 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -10.921 15.783 8.139 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -8.467 15.533 8.575 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -8.292 17.276 8.516 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -8.455 16.528 10.842 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -9.842 17.518 10.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -10.313 15.406 11.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -11.223 15.632 10.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -9.911 14.554 10.268 1.00 0.00 H new ATOM 1679 N ASP A 110 -10.141 15.262 3.593 1.00 0.00 N ATOM 1680 CA ASP A 110 -9.648 15.044 2.234 1.00 0.00 C ATOM 1681 C ASP A 110 -10.779 15.109 1.211 1.00 0.00 C ATOM 1682 O ASP A 110 -10.536 15.270 0.014 1.00 0.00 O ATOM 1683 CB ASP A 110 -8.944 13.689 2.141 1.00 0.00 C ATOM 1684 CG ASP A 110 -7.760 13.585 3.083 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -7.964 13.705 4.309 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -6.629 13.384 2.593 1.00 0.00 O ATOM 0 H ASP A 110 -10.132 14.429 4.182 1.00 0.00 H new ATOM 0 HA ASP A 110 -8.939 15.840 2.006 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -9.657 12.896 2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -8.605 13.528 1.117 1.00 0.00 H new ATOM 1691 N PHE A 111 -12.011 14.978 1.687 1.00 0.00 N ATOM 1692 CA PHE A 111 -13.181 15.018 0.815 1.00 0.00 C ATOM 1693 C PHE A 111 -13.334 16.376 0.143 1.00 0.00 C ATOM 1694 O PHE A 111 -14.146 16.537 -0.770 1.00 0.00 O ATOM 1695 CB PHE A 111 -14.445 14.696 1.615 1.00 0.00 C ATOM 1696 CG PHE A 111 -14.632 13.229 1.888 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -13.588 12.458 2.376 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -15.856 12.623 1.657 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -13.761 11.112 2.627 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -16.035 11.275 1.906 1.00 0.00 C ATOM 1701 CZ PHE A 111 -14.987 10.520 2.391 1.00 0.00 C ATOM 0 H PHE A 111 -12.227 14.843 2.675 1.00 0.00 H new ATOM 0 HA PHE A 111 -13.038 14.268 0.037 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -14.410 15.231 2.564 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -15.313 15.069 1.071 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -12.628 12.916 2.562 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -16.680 13.210 1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -12.940 10.523 3.007 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -16.994 10.814 1.721 1.00 0.00 H new ATOM 0 HZ PHE A 111 -15.125 9.467 2.586 1.00 0.00 H new ATOM 1711 N GLY A 112 -12.567 17.353 0.605 1.00 0.00 N ATOM 1712 CA GLY A 112 -12.656 18.683 0.041 1.00 0.00 C ATOM 1713 C GLY A 112 -13.820 19.451 0.626 1.00 0.00 C ATOM 1714 O GLY A 112 -14.466 20.239 -0.064 1.00 0.00 O ATOM 0 H GLY A 112 -11.887 17.249 1.358 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -11.729 19.224 0.231 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.770 18.615 -1.041 1.00 0.00 H new ATOM 1718 N LEU A 113 -14.082 19.199 1.909 1.00 0.00 N ATOM 1719 CA LEU A 113 -15.173 19.843 2.635 1.00 0.00 C ATOM 1720 C LEU A 113 -15.369 21.289 2.184 1.00 0.00 C ATOM 1721 O LEU A 113 -14.540 22.159 2.451 1.00 0.00 O ATOM 1722 CB LEU A 113 -14.904 19.743 4.151 1.00 0.00 C ATOM 1723 CG LEU A 113 -15.728 20.656 5.081 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -15.086 22.029 5.209 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -17.162 20.788 4.595 1.00 0.00 C ATOM 0 H LEU A 113 -13.543 18.542 2.473 1.00 0.00 H new ATOM 0 HA LEU A 113 -16.105 19.325 2.412 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -15.075 18.710 4.456 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -13.848 19.955 4.320 1.00 0.00 H new ATOM 0 HG LEU A 113 -15.743 20.189 6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -15.688 22.652 5.870 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -14.083 21.924 5.623 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -15.026 22.496 4.226 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -17.717 21.438 5.272 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -17.169 21.217 3.593 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -17.630 19.804 4.571 1.00 0.00 H new ATOM 1737 N ASP A 114 -16.481 21.528 1.491 1.00 0.00 N ATOM 1738 CA ASP A 114 -16.805 22.861 1.000 1.00 0.00 C ATOM 1739 C ASP A 114 -18.290 22.984 0.665 1.00 0.00 C ATOM 1740 O ASP A 114 -18.888 22.070 0.098 1.00 0.00 O ATOM 1741 CB ASP A 114 -15.951 23.205 -0.222 1.00 0.00 C ATOM 1742 CG ASP A 114 -16.187 24.617 -0.718 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -15.973 25.565 0.066 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -16.581 24.775 -1.891 1.00 0.00 O ATOM 0 H ASP A 114 -17.171 20.814 1.258 1.00 0.00 H new ATOM 0 HA ASP A 114 -16.581 23.572 1.795 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -14.897 23.083 0.030 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.170 22.500 -1.024 1.00 0.00 H new ATOM 1749 N ASP A 115 -18.876 24.124 1.033 1.00 0.00 N ATOM 1750 CA ASP A 115 -20.297 24.392 0.798 1.00 0.00 C ATOM 1751 C ASP A 115 -20.717 24.139 -0.653 1.00 0.00 C ATOM 1752 O ASP A 115 -21.907 24.155 -0.966 1.00 0.00 O ATOM 1753 CB ASP A 115 -20.627 25.837 1.179 1.00 0.00 C ATOM 1754 CG ASP A 115 -20.348 26.129 2.642 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -19.178 26.004 3.060 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -21.300 26.482 3.368 1.00 0.00 O ATOM 0 H ASP A 115 -18.383 24.885 1.500 1.00 0.00 H new ATOM 0 HA ASP A 115 -20.856 23.698 1.425 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -20.042 26.516 0.558 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -21.677 26.035 0.966 1.00 0.00 H new ATOM 1761 N ILE A 116 -19.750 23.911 -1.536 1.00 0.00 N ATOM 1762 CA ILE A 116 -20.052 23.664 -2.942 1.00 0.00 C ATOM 1763 C ILE A 116 -20.270 22.177 -3.219 1.00 0.00 C ATOM 1764 O ILE A 116 -21.334 21.776 -3.692 1.00 0.00 O ATOM 1765 CB ILE A 116 -18.932 24.191 -3.862 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -18.787 25.707 -3.704 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -19.221 23.826 -5.313 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -17.673 26.303 -4.543 1.00 0.00 C ATOM 0 H ILE A 116 -18.757 23.892 -1.305 1.00 0.00 H new ATOM 0 HA ILE A 116 -20.974 24.203 -3.159 1.00 0.00 H new ATOM 0 HB ILE A 116 -17.991 23.723 -3.573 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -19.729 26.184 -3.975 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -18.603 25.938 -2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -18.422 24.205 -5.950 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -19.280 22.742 -5.411 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -20.169 24.270 -5.618 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -17.630 27.380 -4.379 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -16.722 25.854 -4.256 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -17.865 26.104 -5.597 1.00 0.00 H new ATOM 1780 N HIS A 117 -19.254 21.363 -2.941 1.00 0.00 N ATOM 1781 CA HIS A 117 -19.342 19.925 -3.183 1.00 0.00 C ATOM 1782 C HIS A 117 -19.860 19.181 -1.960 1.00 0.00 C ATOM 1783 O HIS A 117 -20.876 18.488 -2.025 1.00 0.00 O ATOM 1784 CB HIS A 117 -17.970 19.362 -3.552 1.00 0.00 C ATOM 1785 CG HIS A 117 -17.135 20.290 -4.370 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -17.486 20.722 -5.630 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -15.952 20.876 -4.086 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -16.552 21.537 -6.088 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -15.609 21.648 -5.170 1.00 0.00 N ATOM 0 H HIS A 117 -18.364 21.673 -2.550 1.00 0.00 H new ATOM 0 HA HIS A 117 -20.041 19.781 -4.007 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -17.431 19.115 -2.637 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -18.106 18.431 -4.102 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -15.382 20.760 -3.176 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -16.559 22.029 -7.050 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -14.764 22.214 -5.252 1.00 0.00 H new ATOM 1798 N ILE A 118 -19.133 19.309 -0.853 1.00 0.00 N ATOM 1799 CA ILE A 118 -19.486 18.630 0.387 1.00 0.00 C ATOM 1800 C ILE A 118 -20.964 18.824 0.732 1.00 0.00 C ATOM 1801 O ILE A 118 -21.576 17.984 1.390 1.00 0.00 O ATOM 1802 CB ILE A 118 -18.619 19.125 1.566 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -18.357 17.988 2.552 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -19.281 20.294 2.271 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -17.437 16.921 2.004 1.00 0.00 C ATOM 0 H ILE A 118 -18.291 19.881 -0.792 1.00 0.00 H new ATOM 0 HA ILE A 118 -19.297 17.568 0.227 1.00 0.00 H new ATOM 0 HB ILE A 118 -17.664 19.465 1.165 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -17.923 18.399 3.463 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -19.307 17.531 2.830 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -18.651 20.625 3.097 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -19.416 21.115 1.567 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -20.252 19.984 2.657 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -17.293 16.144 2.755 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -17.880 16.483 1.109 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -16.474 17.365 1.752 1.00 0.00 H new ATOM 1817 N ASP A 119 -21.527 19.943 0.288 1.00 0.00 N ATOM 1818 CA ASP A 119 -22.929 20.250 0.547 1.00 0.00 C ATOM 1819 C ASP A 119 -23.818 19.246 -0.167 1.00 0.00 C ATOM 1820 O ASP A 119 -24.685 18.625 0.448 1.00 0.00 O ATOM 1821 CB ASP A 119 -23.264 21.670 0.091 1.00 0.00 C ATOM 1822 CG ASP A 119 -24.719 22.027 0.331 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -25.150 21.999 1.502 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -25.424 22.334 -0.652 1.00 0.00 O ATOM 0 H ASP A 119 -21.033 20.653 -0.253 1.00 0.00 H new ATOM 0 HA ASP A 119 -23.107 20.185 1.620 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -22.627 22.378 0.621 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -23.039 21.770 -0.971 1.00 0.00 H new ATOM 1829 N ASP A 120 -23.576 19.068 -1.463 1.00 0.00 N ATOM 1830 CA ASP A 120 -24.339 18.107 -2.245 1.00 0.00 C ATOM 1831 C ASP A 120 -24.212 16.741 -1.590 1.00 0.00 C ATOM 1832 O ASP A 120 -25.114 15.915 -1.666 1.00 0.00 O ATOM 1833 CB ASP A 120 -23.827 18.060 -3.688 1.00 0.00 C ATOM 1834 CG ASP A 120 -24.617 17.100 -4.558 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -24.597 15.884 -4.272 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -25.255 17.566 -5.525 1.00 0.00 O ATOM 0 H ASP A 120 -22.863 19.574 -1.988 1.00 0.00 H new ATOM 0 HA ASP A 120 -25.387 18.406 -2.274 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -23.876 19.060 -4.120 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -22.778 17.764 -3.688 1.00 0.00 H new ATOM 1841 N MET A 121 -23.073 16.546 -0.927 1.00 0.00 N ATOM 1842 CA MET A 121 -22.755 15.328 -0.211 1.00 0.00 C ATOM 1843 C MET A 121 -23.681 15.152 0.991 1.00 0.00 C ATOM 1844 O MET A 121 -24.164 14.057 1.256 1.00 0.00 O ATOM 1845 CB MET A 121 -21.285 15.368 0.195 1.00 0.00 C ATOM 1846 CG MET A 121 -20.939 14.513 1.390 1.00 0.00 C ATOM 1847 SD MET A 121 -19.163 14.225 1.517 1.00 0.00 S ATOM 1848 CE MET A 121 -18.975 13.952 3.273 1.00 0.00 C ATOM 0 H MET A 121 -22.336 17.249 -0.876 1.00 0.00 H new ATOM 0 HA MET A 121 -22.914 14.462 -0.854 1.00 0.00 H new ATOM 0 HB2 MET A 121 -20.679 15.047 -0.652 1.00 0.00 H new ATOM 0 HB3 MET A 121 -21.009 16.400 0.411 1.00 0.00 H new ATOM 0 HG2 MET A 121 -21.294 14.998 2.299 1.00 0.00 H new ATOM 0 HG3 MET A 121 -21.458 13.557 1.315 1.00 0.00 H new ATOM 0 HE1 MET A 121 -18.015 13.472 3.466 1.00 0.00 H new ATOM 0 HE2 MET A 121 -19.015 14.907 3.796 1.00 0.00 H new ATOM 0 HE3 MET A 121 -19.780 13.309 3.630 1.00 0.00 H new ATOM 1858 N ILE A 122 -23.971 16.251 1.675 1.00 0.00 N ATOM 1859 CA ILE A 122 -24.898 16.238 2.806 1.00 0.00 C ATOM 1860 C ILE A 122 -26.208 15.693 2.324 1.00 0.00 C ATOM 1861 O ILE A 122 -26.848 14.860 2.962 1.00 0.00 O ATOM 1862 CB ILE A 122 -25.112 17.662 3.306 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -23.768 18.307 3.556 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -25.962 17.689 4.560 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -22.871 17.498 4.467 1.00 0.00 C ATOM 0 H ILE A 122 -23.577 17.169 1.467 1.00 0.00 H new ATOM 0 HA ILE A 122 -24.497 15.627 3.615 1.00 0.00 H new ATOM 0 HB ILE A 122 -25.650 18.224 2.543 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -23.263 18.457 2.602 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -23.923 19.293 3.994 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -26.094 18.720 4.888 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -26.936 17.248 4.349 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -25.468 17.118 5.347 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -21.924 18.020 4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -23.356 17.369 5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -22.686 16.521 4.021 1.00 0.00 H new ATOM 1877 N LYS A 123 -26.570 16.171 1.155 1.00 0.00 N ATOM 1878 CA LYS A 123 -27.781 15.751 0.492 1.00 0.00 C ATOM 1879 C LYS A 123 -27.523 14.459 -0.276 1.00 0.00 C ATOM 1880 O LYS A 123 -28.449 13.789 -0.732 1.00 0.00 O ATOM 1881 CB LYS A 123 -28.257 16.849 -0.457 1.00 0.00 C ATOM 1882 CG LYS A 123 -28.735 18.123 0.235 1.00 0.00 C ATOM 1883 CD LYS A 123 -29.975 17.889 1.089 1.00 0.00 C ATOM 1884 CE LYS A 123 -29.618 17.451 2.502 1.00 0.00 C ATOM 1885 NZ LYS A 123 -28.880 18.514 3.239 1.00 0.00 N ATOM 0 H LYS A 123 -26.030 16.864 0.637 1.00 0.00 H new ATOM 0 HA LYS A 123 -28.558 15.569 1.234 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -27.443 17.103 -1.135 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -29.070 16.456 -1.068 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -27.934 18.515 0.862 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -28.953 18.882 -0.517 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -30.565 18.805 1.131 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -30.600 17.129 0.621 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -30.528 17.197 3.045 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -29.009 16.548 2.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -28.976 18.358 4.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -27.874 18.483 2.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -29.274 19.445 2.993 1.00 0.00 H new ATOM 1899 N GLU A 124 -26.239 14.137 -0.422 1.00 0.00 N ATOM 1900 CA GLU A 124 -25.802 12.945 -1.142 1.00 0.00 C ATOM 1901 C GLU A 124 -25.741 11.733 -0.225 1.00 0.00 C ATOM 1902 O GLU A 124 -25.691 10.594 -0.688 1.00 0.00 O ATOM 1903 CB GLU A 124 -24.426 13.181 -1.760 1.00 0.00 C ATOM 1904 CG GLU A 124 -23.852 11.987 -2.495 1.00 0.00 C ATOM 1905 CD GLU A 124 -22.681 12.357 -3.383 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -21.671 12.865 -2.852 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -22.772 12.138 -4.609 1.00 0.00 O ATOM 0 H GLU A 124 -25.474 14.696 -0.044 1.00 0.00 H new ATOM 0 HA GLU A 124 -26.531 12.747 -1.927 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -24.492 14.020 -2.453 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -23.733 13.473 -0.971 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -23.531 11.239 -1.770 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -24.633 11.529 -3.102 1.00 0.00 H new ATOM 1914 N ILE A 125 -25.734 11.982 1.077 1.00 0.00 N ATOM 1915 CA ILE A 125 -25.664 10.906 2.042 1.00 0.00 C ATOM 1916 C ILE A 125 -26.922 10.859 2.876 1.00 0.00 C ATOM 1917 O ILE A 125 -27.369 9.790 3.275 1.00 0.00 O ATOM 1918 CB ILE A 125 -24.455 11.057 2.952 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -23.228 11.449 2.121 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -24.234 9.753 3.687 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -22.820 10.418 1.093 1.00 0.00 C ATOM 0 H ILE A 125 -25.776 12.917 1.483 1.00 0.00 H new ATOM 0 HA ILE A 125 -25.565 9.974 1.486 1.00 0.00 H new ATOM 0 HB ILE A 125 -24.624 11.846 3.685 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -23.433 12.391 1.613 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -22.389 11.626 2.794 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -23.369 9.848 4.344 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -25.117 9.516 4.281 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -24.057 8.955 2.966 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -21.945 10.773 0.549 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -22.580 9.480 1.594 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -23.641 10.257 0.394 1.00 0.00 H new ATOM 1933 N ASP A 126 -27.511 12.020 3.109 1.00 0.00 N ATOM 1934 CA ASP A 126 -28.744 12.081 3.862 1.00 0.00 C ATOM 1935 C ASP A 126 -29.877 11.615 2.982 1.00 0.00 C ATOM 1936 O ASP A 126 -30.466 12.392 2.231 1.00 0.00 O ATOM 1937 CB ASP A 126 -29.017 13.485 4.371 1.00 0.00 C ATOM 1938 CG ASP A 126 -30.418 13.622 4.930 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -31.369 13.726 4.128 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -30.568 13.608 6.169 1.00 0.00 O ATOM 0 H ASP A 126 -27.157 12.922 2.790 1.00 0.00 H new ATOM 0 HA ASP A 126 -28.655 11.431 4.733 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -28.292 13.738 5.144 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -28.879 14.199 3.559 1.00 0.00 H new ATOM 1945 N GLN A 127 -30.154 10.334 3.059 1.00 0.00 N ATOM 1946 CA GLN A 127 -31.195 9.738 2.258 1.00 0.00 C ATOM 1947 C GLN A 127 -32.549 9.867 2.943 1.00 0.00 C ATOM 1948 O GLN A 127 -33.574 9.528 2.351 1.00 0.00 O ATOM 1949 CB GLN A 127 -30.887 8.261 1.978 1.00 0.00 C ATOM 1950 CG GLN A 127 -29.410 7.886 2.101 1.00 0.00 C ATOM 1951 CD GLN A 127 -28.970 7.694 3.540 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -29.844 8.020 4.481 1.00 0.00 O flip ATOM 1953 NE2 GLN A 127 -27.845 7.265 3.801 1.00 0.00 N flip ATOM 0 H GLN A 127 -29.668 9.681 3.674 1.00 0.00 H new ATOM 0 HA GLN A 127 -31.233 10.274 1.309 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -31.464 7.646 2.669 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -31.228 8.016 0.972 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -29.225 6.968 1.544 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -28.802 8.665 1.641 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -27.203 7.026 3.046 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -27.556 7.149 4.772 1.00 0.00 H new ATOM 1962 N ASP A 128 -32.567 10.319 4.204 1.00 0.00 N ATOM 1963 CA ASP A 128 -33.838 10.418 4.910 1.00 0.00 C ATOM 1964 C ASP A 128 -34.305 11.851 5.208 1.00 0.00 C ATOM 1965 O ASP A 128 -35.514 12.087 5.190 1.00 0.00 O ATOM 1966 CB ASP A 128 -33.742 9.658 6.234 1.00 0.00 C ATOM 1967 CG ASP A 128 -33.376 8.200 6.050 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -33.223 7.764 4.890 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -33.245 7.491 7.070 1.00 0.00 O ATOM 0 H ASP A 128 -31.746 10.610 4.735 1.00 0.00 H new ATOM 0 HA ASP A 128 -34.578 9.987 4.236 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -32.997 10.137 6.869 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -34.697 9.725 6.756 1.00 0.00 H new ATOM 1974 N ASN A 129 -33.404 12.818 5.475 1.00 0.00 N ATOM 1975 CA ASN A 129 -33.897 14.181 5.755 1.00 0.00 C ATOM 1976 C ASN A 129 -32.845 15.279 6.043 1.00 0.00 C ATOM 1977 O ASN A 129 -32.511 16.092 5.181 1.00 0.00 O ATOM 1978 CB ASN A 129 -34.910 14.144 6.912 1.00 0.00 C ATOM 1979 CG ASN A 129 -34.445 13.335 8.119 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -33.227 12.803 8.068 1.00 0.00 O flip ATOM 1981 ND2 ASN A 129 -35.182 13.195 9.095 1.00 0.00 N flip ATOM 0 H ASN A 129 -32.392 12.695 5.503 1.00 0.00 H new ATOM 0 HA ASN A 129 -34.346 14.482 4.808 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -35.119 15.165 7.231 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -35.848 13.726 6.547 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -36.110 13.618 9.098 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -34.864 12.656 9.901 1.00 0.00 H new ATOM 1988 N ASP A 130 -32.465 15.356 7.320 1.00 0.00 N ATOM 1989 CA ASP A 130 -31.598 16.406 7.887 1.00 0.00 C ATOM 1990 C ASP A 130 -30.143 16.508 7.402 1.00 0.00 C ATOM 1991 O ASP A 130 -29.313 17.017 8.156 1.00 0.00 O ATOM 1992 CB ASP A 130 -31.569 16.202 9.401 1.00 0.00 C ATOM 1993 CG ASP A 130 -32.951 16.262 10.023 1.00 0.00 C ATOM 1994 OD1 ASP A 130 -33.929 16.485 9.280 1.00 0.00 O ATOM 1995 OD2 ASP A 130 -33.054 16.088 11.255 1.00 0.00 O ATOM 0 H ASP A 130 -32.759 14.670 8.015 1.00 0.00 H new ATOM 0 HA ASP A 130 -32.049 17.336 7.540 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -31.115 15.237 9.625 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -30.937 16.965 9.855 1.00 0.00 H new ATOM 2000 N GLY A 131 -29.795 16.072 6.196 1.00 0.00 N ATOM 2001 CA GLY A 131 -28.409 16.214 5.797 1.00 0.00 C ATOM 2002 C GLY A 131 -27.529 15.548 6.820 1.00 0.00 C ATOM 2003 O GLY A 131 -26.465 16.057 7.196 1.00 0.00 O ATOM 0 H GLY A 131 -30.418 15.641 5.513 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -28.252 15.764 4.817 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -28.150 17.269 5.708 1.00 0.00 H new ATOM 2007 N GLN A 132 -28.030 14.434 7.317 1.00 0.00 N ATOM 2008 CA GLN A 132 -27.370 13.684 8.349 1.00 0.00 C ATOM 2009 C GLN A 132 -27.413 12.214 8.037 1.00 0.00 C ATOM 2010 O GLN A 132 -28.132 11.775 7.139 1.00 0.00 O ATOM 2011 CB GLN A 132 -28.017 13.917 9.703 1.00 0.00 C ATOM 2012 CG GLN A 132 -29.420 13.355 9.792 1.00 0.00 C ATOM 2013 CD GLN A 132 -29.855 13.099 11.217 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -29.854 11.829 11.599 1.00 0.00 O flip ATOM 2015 NE2 GLN A 132 -30.152 14.024 11.971 1.00 0.00 N flip ATOM 0 H GLN A 132 -28.913 14.027 7.009 1.00 0.00 H new ATOM 0 HA GLN A 132 -26.336 14.026 8.388 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -27.400 13.462 10.478 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -28.047 14.987 9.906 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -30.116 14.050 9.323 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -29.471 12.424 9.228 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -30.138 14.985 11.629 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -30.413 13.830 12.938 1.00 0.00 H new ATOM 2024 N ILE A 133 -26.649 11.462 8.791 1.00 0.00 N ATOM 2025 CA ILE A 133 -26.588 10.055 8.618 1.00 0.00 C ATOM 2026 C ILE A 133 -26.939 9.346 9.903 1.00 0.00 C ATOM 2027 O ILE A 133 -26.383 9.611 10.958 1.00 0.00 O ATOM 2028 CB ILE A 133 -25.197 9.641 8.181 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -24.800 10.402 6.926 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -25.148 8.151 7.942 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -23.404 10.076 6.489 1.00 0.00 C ATOM 0 H ILE A 133 -26.056 11.821 9.539 1.00 0.00 H new ATOM 0 HA ILE A 133 -27.309 9.776 7.849 1.00 0.00 H new ATOM 0 HB ILE A 133 -24.487 9.883 8.972 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -25.496 10.164 6.122 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -24.881 11.473 7.111 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -24.144 7.866 7.629 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -25.404 7.626 8.863 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -25.861 7.884 7.162 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -23.163 10.642 5.589 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -22.704 10.339 7.282 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -23.329 9.009 6.278 1.00 0.00 H new ATOM 2043 N ASP A 134 -27.843 8.420 9.783 1.00 0.00 N ATOM 2044 CA ASP A 134 -28.281 7.631 10.909 1.00 0.00 C ATOM 2045 C ASP A 134 -27.602 6.280 10.827 1.00 0.00 C ATOM 2046 O ASP A 134 -27.144 5.881 9.761 1.00 0.00 O ATOM 2047 CB ASP A 134 -29.796 7.452 10.854 1.00 0.00 C ATOM 2048 CG ASP A 134 -30.372 6.778 12.086 1.00 0.00 C ATOM 2049 OD1 ASP A 134 -30.418 7.426 13.152 1.00 0.00 O ATOM 2050 OD2 ASP A 134 -30.780 5.602 11.983 1.00 0.00 O ATOM 0 H ASP A 134 -28.302 8.185 8.903 1.00 0.00 H new ATOM 0 HA ASP A 134 -28.023 8.128 11.844 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -30.265 8.428 10.731 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -30.052 6.862 9.974 1.00 0.00 H new ATOM 2055 N TYR A 135 -27.517 5.589 11.948 1.00 0.00 N ATOM 2056 CA TYR A 135 -26.873 4.287 11.977 1.00 0.00 C ATOM 2057 C TYR A 135 -27.330 3.435 10.805 1.00 0.00 C ATOM 2058 O TYR A 135 -26.558 2.650 10.255 1.00 0.00 O ATOM 2059 CB TYR A 135 -27.147 3.606 13.308 1.00 0.00 C ATOM 2060 CG TYR A 135 -27.006 2.097 13.291 1.00 0.00 C ATOM 2061 CD1 TYR A 135 -25.818 1.493 12.897 1.00 0.00 C ATOM 2062 CD2 TYR A 135 -28.061 1.277 13.676 1.00 0.00 C ATOM 2063 CE1 TYR A 135 -25.686 0.117 12.883 1.00 0.00 C ATOM 2064 CE2 TYR A 135 -27.935 -0.099 13.666 1.00 0.00 C ATOM 2065 CZ TYR A 135 -26.748 -0.673 13.268 1.00 0.00 C ATOM 2066 OH TYR A 135 -26.621 -2.043 13.257 1.00 0.00 O ATOM 0 H TYR A 135 -27.883 5.904 12.846 1.00 0.00 H new ATOM 0 HA TYR A 135 -25.795 4.418 11.879 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -26.465 4.012 14.055 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -28.158 3.859 13.628 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -24.984 2.109 12.597 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -28.994 1.723 13.988 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -24.756 -0.336 12.572 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -28.764 -0.722 13.969 1.00 0.00 H new ATOM 0 HH TYR A 135 -27.460 -2.452 13.557 1.00 0.00 H new ATOM 2076 N GLY A 136 -28.574 3.627 10.397 1.00 0.00 N ATOM 2077 CA GLY A 136 -29.082 2.899 9.263 1.00 0.00 C ATOM 2078 C GLY A 136 -28.632 3.539 7.972 1.00 0.00 C ATOM 2079 O GLY A 136 -28.305 2.850 7.009 1.00 0.00 O ATOM 0 H GLY A 136 -29.235 4.271 10.830 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -28.735 1.866 9.303 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -30.171 2.871 9.301 1.00 0.00 H new ATOM 2083 N GLU A 137 -28.604 4.869 7.964 1.00 0.00 N ATOM 2084 CA GLU A 137 -28.172 5.613 6.792 1.00 0.00 C ATOM 2085 C GLU A 137 -26.742 5.257 6.424 1.00 0.00 C ATOM 2086 O GLU A 137 -26.485 4.836 5.301 1.00 0.00 O ATOM 2087 CB GLU A 137 -28.275 7.118 7.024 1.00 0.00 C ATOM 2088 CG GLU A 137 -29.638 7.563 7.516 1.00 0.00 C ATOM 2089 CD GLU A 137 -29.798 9.073 7.525 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -29.655 9.693 6.451 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -30.068 9.634 8.607 1.00 0.00 O ATOM 0 H GLU A 137 -28.876 5.450 8.757 1.00 0.00 H new ATOM 0 HA GLU A 137 -28.834 5.338 5.971 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -27.520 7.418 7.750 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -28.046 7.637 6.093 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -30.409 7.125 6.882 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -29.798 7.180 8.524 1.00 0.00 H new ATOM 2098 N PHE A 138 -25.801 5.447 7.352 1.00 0.00 N ATOM 2099 CA PHE A 138 -24.406 5.147 7.050 1.00 0.00 C ATOM 2100 C PHE A 138 -24.222 3.693 6.654 1.00 0.00 C ATOM 2101 O PHE A 138 -23.286 3.350 5.933 1.00 0.00 O ATOM 2102 CB PHE A 138 -23.455 5.443 8.210 1.00 0.00 C ATOM 2103 CG PHE A 138 -22.117 5.849 7.680 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -21.999 6.939 6.823 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -20.990 5.125 7.998 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -20.769 7.296 6.307 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -19.761 5.474 7.480 1.00 0.00 C ATOM 2108 CZ PHE A 138 -19.648 6.563 6.636 1.00 0.00 C ATOM 0 H PHE A 138 -25.975 5.798 8.294 1.00 0.00 H new ATOM 0 HA PHE A 138 -24.155 5.806 6.219 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -23.865 6.237 8.834 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -23.353 4.561 8.842 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -22.877 7.510 6.559 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -21.069 4.275 8.660 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -20.685 8.147 5.647 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -18.885 4.896 7.734 1.00 0.00 H new ATOM 0 HZ PHE A 138 -18.684 6.839 6.235 1.00 0.00 H new ATOM 2118 N ALA A 139 -25.102 2.838 7.137 1.00 0.00 N ATOM 2119 CA ALA A 139 -25.012 1.425 6.836 1.00 0.00 C ATOM 2120 C ALA A 139 -25.577 1.128 5.448 1.00 0.00 C ATOM 2121 O ALA A 139 -25.066 0.272 4.725 1.00 0.00 O ATOM 2122 CB ALA A 139 -25.735 0.623 7.906 1.00 0.00 C ATOM 0 H ALA A 139 -25.885 3.097 7.738 1.00 0.00 H new ATOM 0 HA ALA A 139 -23.962 1.131 6.832 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -25.664 -0.440 7.674 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -25.276 0.814 8.876 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -26.784 0.919 7.936 1.00 0.00 H new ATOM 2128 N ALA A 140 -26.638 1.844 5.087 1.00 0.00 N ATOM 2129 CA ALA A 140 -27.286 1.673 3.791 1.00 0.00 C ATOM 2130 C ALA A 140 -26.687 2.590 2.725 1.00 0.00 C ATOM 2131 O ALA A 140 -26.928 2.399 1.534 1.00 0.00 O ATOM 2132 CB ALA A 140 -28.777 1.929 3.921 1.00 0.00 C ATOM 0 H ALA A 140 -27.070 2.553 5.679 1.00 0.00 H new ATOM 0 HA ALA A 140 -27.117 0.645 3.470 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -29.254 1.800 2.950 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -29.206 1.224 4.633 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -28.942 2.947 4.274 1.00 0.00 H new ATOM 2138 N MET A 141 -25.907 3.588 3.152 1.00 0.00 N ATOM 2139 CA MET A 141 -25.284 4.519 2.221 1.00 0.00 C ATOM 2140 C MET A 141 -24.431 3.734 1.232 1.00 0.00 C ATOM 2141 O MET A 141 -24.114 4.203 0.139 1.00 0.00 O ATOM 2142 CB MET A 141 -24.458 5.557 2.990 1.00 0.00 C ATOM 2143 CG MET A 141 -23.139 5.032 3.532 1.00 0.00 C ATOM 2144 SD MET A 141 -21.755 5.344 2.419 1.00 0.00 S ATOM 2145 CE MET A 141 -21.670 7.133 2.487 1.00 0.00 C ATOM 0 H MET A 141 -25.696 3.767 4.134 1.00 0.00 H new ATOM 0 HA MET A 141 -26.046 5.062 1.662 1.00 0.00 H new ATOM 0 HB2 MET A 141 -24.256 6.402 2.332 1.00 0.00 H new ATOM 0 HB3 MET A 141 -25.054 5.935 3.821 1.00 0.00 H new ATOM 0 HG2 MET A 141 -22.936 5.498 4.496 1.00 0.00 H new ATOM 0 HG3 MET A 141 -23.224 3.960 3.707 1.00 0.00 H new ATOM 0 HE1 MET A 141 -21.767 7.540 1.481 1.00 0.00 H new ATOM 0 HE2 MET A 141 -22.479 7.512 3.111 1.00 0.00 H new ATOM 0 HE3 MET A 141 -20.712 7.436 2.910 1.00 0.00 H new ATOM 2155 N MET A 142 -24.119 2.506 1.629 1.00 0.00 N ATOM 2156 CA MET A 142 -23.362 1.575 0.811 1.00 0.00 C ATOM 2157 C MET A 142 -24.142 0.268 0.737 1.00 0.00 C ATOM 2158 O MET A 142 -23.614 -0.810 1.010 1.00 0.00 O ATOM 2159 CB MET A 142 -21.966 1.340 1.400 1.00 0.00 C ATOM 2160 CG MET A 142 -21.979 0.825 2.831 1.00 0.00 C ATOM 2161 SD MET A 142 -20.321 0.517 3.471 1.00 0.00 S ATOM 2162 CE MET A 142 -20.701 -0.124 5.100 1.00 0.00 C ATOM 0 H MET A 142 -24.389 2.128 2.537 1.00 0.00 H new ATOM 0 HA MET A 142 -23.226 1.987 -0.189 1.00 0.00 H new ATOM 0 HB2 MET A 142 -21.433 0.626 0.772 1.00 0.00 H new ATOM 0 HB3 MET A 142 -21.406 2.275 1.366 1.00 0.00 H new ATOM 0 HG2 MET A 142 -22.482 1.551 3.470 1.00 0.00 H new ATOM 0 HG3 MET A 142 -22.559 -0.097 2.877 1.00 0.00 H new ATOM 0 HE1 MET A 142 -19.775 -0.362 5.623 1.00 0.00 H new ATOM 0 HE2 MET A 142 -21.254 0.625 5.666 1.00 0.00 H new ATOM 0 HE3 MET A 142 -21.306 -1.026 5.004 1.00 0.00 H new