USER MOD reduce.3.24.130724 H: found=0, std=0, add=686, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 704 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 17 SER OG : rot 180:sc=-7.2e-06 USER MOD Set 1.2: B 209 MET CE :methyl -168:sc= -0.0168 (180deg=0) USER MOD Single : A 9 MET CE :methyl 180:sc= -0.407 (180deg=-0.407) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 162:sc= -0.0347 (180deg=-0.395) USER MOD Single : A 23 GLN : amide:sc= -0.391 K(o=-0.39,f=-2.8!) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 32 ASN :FLIP amide:sc= -4.4! C(o=-5.2!,f=-4.4!) USER MOD Single : A 45 GLN : amide:sc= -0.506 X(o=-0.51,f=-0.25) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : B 217 SER OG : rot 180:sc= 0 USER MOD Single : B 218 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : B 222 LYS NZ :NH3+ 130:sc= -0.0171 (180deg=-0.34) USER MOD Single : B 223 GLN : amide:sc= -0.487 K(o=-0.49,f=-4!) USER MOD Single : B 230 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : B 232 ASN :FLIP amide:sc= 0.155! F(o=-0.85,f=0.15!) USER MOD Single : B 245 GLN : amide:sc= -0.386 K(o=-0.39,f=-1.2) USER MOD Single : B 246 TYR OH : rot 30:sc= -2.81! USER MOD Single : B 249 ASN : amide:sc= -2.06! C(o=-2.1!,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 111 N MET A 9 -14.392 -14.192 6.500 1.00 1.00 N ATOM 112 CA MET A 9 -13.235 -13.570 5.866 1.00 1.00 C ATOM 113 C MET A 9 -12.723 -14.451 4.732 1.00 1.00 C ATOM 114 O MET A 9 -13.210 -15.563 4.533 1.00 1.00 O ATOM 115 CB MET A 9 -12.121 -13.369 6.896 1.00 1.00 C ATOM 116 CG MET A 9 -12.722 -12.864 8.206 1.00 1.00 C ATOM 117 SD MET A 9 -13.702 -11.377 7.891 1.00 1.00 S ATOM 118 CE MET A 9 -12.423 -10.163 8.297 1.00 1.00 C ATOM 0 HA MET A 9 -13.535 -12.603 5.463 1.00 1.00 H new ATOM 0 HB2 MET A 9 -11.593 -14.308 7.064 1.00 1.00 H new ATOM 0 HB3 MET A 9 -11.389 -12.654 6.520 1.00 1.00 H new ATOM 0 HG2 MET A 9 -13.348 -13.637 8.652 1.00 1.00 H new ATOM 0 HG3 MET A 9 -11.929 -12.644 8.921 1.00 1.00 H new ATOM 0 HE1 MET A 9 -12.822 -9.157 8.168 1.00 1.00 H new ATOM 0 HE2 MET A 9 -12.108 -10.299 9.332 1.00 1.00 H new ATOM 0 HE3 MET A 9 -11.567 -10.301 7.636 1.00 1.00 H new ATOM 128 N GLY A 10 -11.737 -13.944 3.990 1.00 1.00 N ATOM 129 CA GLY A 10 -11.154 -14.690 2.868 1.00 1.00 C ATOM 130 C GLY A 10 -9.673 -14.965 3.099 1.00 1.00 C ATOM 131 O GLY A 10 -9.035 -15.664 2.314 1.00 1.00 O ATOM 0 H GLY A 10 -11.325 -13.024 4.143 1.00 1.00 H new ATOM 0 HA2 GLY A 10 -11.686 -15.633 2.739 1.00 1.00 H new ATOM 0 HA3 GLY A 10 -11.282 -14.123 1.946 1.00 1.00 H new ATOM 135 N ARG A 11 -9.140 -14.413 4.182 1.00 1.00 N ATOM 136 CA ARG A 11 -7.730 -14.600 4.521 1.00 1.00 C ATOM 137 C ARG A 11 -6.847 -14.113 3.378 1.00 1.00 C ATOM 138 O ARG A 11 -6.957 -14.584 2.248 1.00 1.00 O ATOM 139 CB ARG A 11 -7.446 -16.076 4.785 1.00 1.00 C ATOM 140 CG ARG A 11 -6.016 -16.237 5.302 1.00 1.00 C ATOM 141 CD ARG A 11 -5.737 -17.717 5.575 1.00 1.00 C ATOM 142 NE ARG A 11 -5.718 -18.468 4.325 1.00 1.00 N ATOM 143 CZ ARG A 11 -5.832 -19.791 4.316 1.00 1.00 C ATOM 144 NH1 ARG A 11 -5.969 -20.443 5.439 1.00 1.00 N ATOM 145 NH2 ARG A 11 -5.806 -20.440 3.184 1.00 1.00 N ATOM 0 H ARG A 11 -9.659 -13.833 4.841 1.00 1.00 H new ATOM 0 HA ARG A 11 -7.509 -14.023 5.419 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -8.154 -16.468 5.515 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -7.580 -16.652 3.869 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -5.307 -15.851 4.569 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -5.880 -15.656 6.214 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -4.781 -17.825 6.087 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -6.501 -18.122 6.239 1.00 1.00 H new ATOM 0 HE ARG A 11 -5.615 -17.968 3.442 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -5.989 -19.936 6.324 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -6.057 -21.459 5.431 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -5.698 -19.931 2.307 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -5.894 -21.456 3.177 1.00 1.00 H new ATOM 159 N ILE A 12 -5.976 -13.159 3.681 1.00 1.00 N ATOM 160 CA ILE A 12 -5.079 -12.586 2.669 1.00 1.00 C ATOM 161 C ILE A 12 -3.653 -12.538 3.187 1.00 1.00 C ATOM 162 O ILE A 12 -3.414 -12.302 4.371 1.00 1.00 O ATOM 163 CB ILE A 12 -5.537 -11.164 2.298 1.00 1.00 C ATOM 164 CG1 ILE A 12 -7.074 -11.113 2.139 1.00 1.00 C ATOM 165 CG2 ILE A 12 -4.873 -10.719 0.985 1.00 1.00 C ATOM 166 CD1 ILE A 12 -7.506 -11.809 0.841 1.00 1.00 C ATOM 0 H ILE A 12 -5.867 -12.763 4.614 1.00 1.00 H new ATOM 0 HA ILE A 12 -5.114 -13.220 1.783 1.00 1.00 H new ATOM 0 HB ILE A 12 -5.240 -10.490 3.101 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -7.550 -11.596 2.993 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -7.410 -10.076 2.131 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -5.205 -9.712 0.733 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -3.790 -10.725 1.105 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -5.153 -11.404 0.185 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -8.591 -11.763 0.747 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -7.046 -11.308 -0.011 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -7.188 -12.851 0.864 1.00 1.00 H new ATOM 178 N LEU A 13 -2.706 -12.774 2.284 1.00 1.00 N ATOM 179 CA LEU A 13 -1.297 -12.767 2.639 1.00 1.00 C ATOM 180 C LEU A 13 -0.662 -11.452 2.257 1.00 1.00 C ATOM 181 O LEU A 13 -0.813 -10.978 1.130 1.00 1.00 O ATOM 182 CB LEU A 13 -0.584 -13.905 1.917 1.00 1.00 C ATOM 183 CG LEU A 13 -1.043 -15.258 2.484 1.00 1.00 C ATOM 184 CD1 LEU A 13 -0.849 -16.346 1.432 1.00 1.00 C ATOM 185 CD2 LEU A 13 -0.217 -15.621 3.728 1.00 1.00 C ATOM 0 H LEU A 13 -2.892 -12.972 1.301 1.00 1.00 H new ATOM 0 HA LEU A 13 -1.207 -12.900 3.717 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -0.796 -13.858 0.849 1.00 1.00 H new ATOM 0 HB3 LEU A 13 0.495 -13.800 2.032 1.00 1.00 H new ATOM 0 HG LEU A 13 -2.096 -15.183 2.756 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -1.175 -17.305 1.836 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -1.438 -16.106 0.547 1.00 1.00 H new ATOM 0 HD13 LEU A 13 0.205 -16.406 1.161 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -0.552 -16.581 4.120 1.00 1.00 H new ATOM 0 HD22 LEU A 13 0.837 -15.687 3.458 1.00 1.00 H new ATOM 0 HD23 LEU A 13 -0.349 -14.852 4.490 1.00 1.00 H new ATOM 197 N LEU A 14 0.043 -10.860 3.212 1.00 1.00 N ATOM 198 CA LEU A 14 0.710 -9.577 2.991 1.00 1.00 C ATOM 199 C LEU A 14 2.192 -9.676 3.321 1.00 1.00 C ATOM 200 O LEU A 14 2.571 -10.218 4.359 1.00 1.00 O ATOM 201 CB LEU A 14 0.065 -8.488 3.859 1.00 1.00 C ATOM 202 CG LEU A 14 0.685 -7.119 3.528 1.00 1.00 C ATOM 203 CD1 LEU A 14 0.444 -6.759 2.048 1.00 1.00 C ATOM 204 CD2 LEU A 14 0.059 -6.049 4.430 1.00 1.00 C ATOM 0 H LEU A 14 0.170 -11.245 4.148 1.00 1.00 H new ATOM 0 HA LEU A 14 0.600 -9.315 1.939 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -1.011 -8.462 3.685 1.00 1.00 H new ATOM 0 HB3 LEU A 14 0.211 -8.718 4.914 1.00 1.00 H new ATOM 0 HG LEU A 14 1.760 -7.165 3.702 1.00 1.00 H new ATOM 0 HD11 LEU A 14 0.889 -5.788 1.833 1.00 1.00 H new ATOM 0 HD12 LEU A 14 0.900 -7.517 1.410 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -0.628 -6.718 1.853 1.00 1.00 H new ATOM 0 HD21 LEU A 14 0.496 -5.077 4.199 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -1.017 -6.013 4.259 1.00 1.00 H new ATOM 0 HD23 LEU A 14 0.253 -6.295 5.474 1.00 1.00 H new ATOM 216 N ASP A 15 3.027 -9.145 2.429 1.00 1.00 N ATOM 217 CA ASP A 15 4.478 -9.168 2.627 1.00 1.00 C ATOM 218 C ASP A 15 5.018 -7.763 2.877 1.00 1.00 C ATOM 219 O ASP A 15 4.976 -6.906 1.993 1.00 1.00 O ATOM 220 CB ASP A 15 5.157 -9.757 1.394 1.00 1.00 C ATOM 221 CG ASP A 15 6.649 -9.923 1.659 1.00 1.00 C ATOM 222 OD1 ASP A 15 7.117 -9.385 2.650 1.00 1.00 O ATOM 223 OD2 ASP A 15 7.299 -10.592 0.874 1.00 1.00 O ATOM 0 H ASP A 15 2.726 -8.695 1.565 1.00 1.00 H new ATOM 0 HA ASP A 15 4.693 -9.785 3.500 1.00 1.00 H new ATOM 0 HB2 ASP A 15 4.712 -10.721 1.148 1.00 1.00 H new ATOM 0 HB3 ASP A 15 5.001 -9.105 0.535 1.00 1.00 H new ATOM 229 N LEU A 16 5.525 -7.535 4.088 1.00 1.00 N ATOM 230 CA LEU A 16 6.083 -6.231 4.466 1.00 1.00 C ATOM 231 C LEU A 16 7.514 -6.381 4.962 1.00 1.00 C ATOM 232 O LEU A 16 7.857 -7.370 5.610 1.00 1.00 O ATOM 233 CB LEU A 16 5.219 -5.590 5.558 1.00 1.00 C ATOM 234 CG LEU A 16 3.913 -5.061 4.945 1.00 1.00 C ATOM 235 CD1 LEU A 16 2.896 -4.795 6.060 1.00 1.00 C ATOM 236 CD2 LEU A 16 4.167 -3.752 4.165 1.00 1.00 C ATOM 0 H LEU A 16 5.562 -8.236 4.828 1.00 1.00 H new ATOM 0 HA LEU A 16 6.087 -5.589 3.585 1.00 1.00 H new ATOM 0 HB2 LEU A 16 4.997 -6.322 6.335 1.00 1.00 H new ATOM 0 HB3 LEU A 16 5.764 -4.775 6.034 1.00 1.00 H new ATOM 0 HG LEU A 16 3.524 -5.811 4.256 1.00 1.00 H new ATOM 0 HD11 LEU A 16 1.969 -4.420 5.625 1.00 1.00 H new ATOM 0 HD12 LEU A 16 2.695 -5.721 6.598 1.00 1.00 H new ATOM 0 HD13 LEU A 16 3.299 -4.054 6.751 1.00 1.00 H new ATOM 0 HD21 LEU A 16 3.230 -3.394 3.739 1.00 1.00 H new ATOM 0 HD22 LEU A 16 4.569 -2.998 4.841 1.00 1.00 H new ATOM 0 HD23 LEU A 16 4.882 -3.939 3.363 1.00 1.00 H new ATOM 248 N SER A 17 8.340 -5.391 4.651 1.00 1.00 N ATOM 249 CA SER A 17 9.731 -5.414 5.063 1.00 1.00 C ATOM 250 C SER A 17 9.826 -5.507 6.583 1.00 1.00 C ATOM 251 O SER A 17 8.914 -5.093 7.301 1.00 1.00 O ATOM 252 CB SER A 17 10.436 -4.147 4.571 1.00 1.00 C ATOM 253 OG SER A 17 10.780 -4.299 3.201 1.00 1.00 O ATOM 0 H SER A 17 8.069 -4.566 4.116 1.00 1.00 H new ATOM 0 HA SER A 17 10.217 -6.287 4.627 1.00 1.00 H new ATOM 0 HB2 SER A 17 9.785 -3.282 4.700 1.00 1.00 H new ATOM 0 HB3 SER A 17 11.332 -3.963 5.164 1.00 1.00 H new ATOM 0 HG SER A 17 11.230 -3.488 2.885 1.00 1.00 H new ATOM 259 N ASN A 18 10.932 -6.057 7.062 1.00 1.00 N ATOM 260 CA ASN A 18 11.145 -6.206 8.498 1.00 1.00 C ATOM 261 C ASN A 18 11.246 -4.844 9.173 1.00 1.00 C ATOM 262 O ASN A 18 10.765 -4.656 10.290 1.00 1.00 O ATOM 263 CB ASN A 18 12.417 -7.011 8.762 1.00 1.00 C ATOM 264 CG ASN A 18 12.210 -8.462 8.343 1.00 1.00 C ATOM 265 OD1 ASN A 18 11.466 -9.199 8.991 1.00 1.00 O ATOM 266 ND2 ASN A 18 12.824 -8.918 7.286 1.00 1.00 N ATOM 0 H ASN A 18 11.694 -6.407 6.482 1.00 1.00 H new ATOM 0 HA ASN A 18 10.291 -6.739 8.916 1.00 1.00 H new ATOM 0 HB2 ASN A 18 13.252 -6.580 8.210 1.00 1.00 H new ATOM 0 HB3 ASN A 18 12.675 -6.962 9.820 1.00 1.00 H new ATOM 0 HD21 ASN A 18 12.688 -9.886 6.995 1.00 1.00 H new ATOM 0 HD22 ASN A 18 13.440 -8.306 6.750 1.00 1.00 H new ATOM 273 N GLU A 19 11.880 -3.897 8.491 1.00 1.00 N ATOM 274 CA GLU A 19 12.046 -2.556 9.038 1.00 1.00 C ATOM 275 C GLU A 19 10.691 -1.942 9.375 1.00 1.00 C ATOM 276 O GLU A 19 10.556 -1.237 10.368 1.00 1.00 O ATOM 277 CB GLU A 19 12.770 -1.668 8.024 1.00 1.00 C ATOM 278 CG GLU A 19 14.197 -2.180 7.817 1.00 1.00 C ATOM 279 CD GLU A 19 15.015 -1.978 9.088 1.00 1.00 C ATOM 280 OE1 GLU A 19 16.009 -2.666 9.246 1.00 1.00 O ATOM 281 OE2 GLU A 19 14.637 -1.133 9.883 1.00 1.00 O ATOM 0 H GLU A 19 12.285 -4.031 7.565 1.00 1.00 H new ATOM 0 HA GLU A 19 12.637 -2.626 9.951 1.00 1.00 H new ATOM 0 HB2 GLU A 19 12.232 -1.669 7.076 1.00 1.00 H new ATOM 0 HB3 GLU A 19 12.791 -0.637 8.378 1.00 1.00 H new ATOM 0 HG2 GLU A 19 14.178 -3.237 7.552 1.00 1.00 H new ATOM 0 HG3 GLU A 19 14.665 -1.651 6.986 1.00 1.00 H new ATOM 289 N VAL A 20 9.693 -2.225 8.550 1.00 1.00 N ATOM 290 CA VAL A 20 8.347 -1.701 8.780 1.00 1.00 C ATOM 291 C VAL A 20 7.729 -2.323 10.032 1.00 1.00 C ATOM 292 O VAL A 20 7.116 -1.628 10.842 1.00 1.00 O ATOM 293 CB VAL A 20 7.462 -2.002 7.566 1.00 1.00 C ATOM 294 CG1 VAL A 20 6.023 -1.573 7.855 1.00 1.00 C ATOM 295 CG2 VAL A 20 7.987 -1.241 6.348 1.00 1.00 C ATOM 0 H VAL A 20 9.785 -2.810 7.720 1.00 1.00 H new ATOM 0 HA VAL A 20 8.416 -0.623 8.926 1.00 1.00 H new ATOM 0 HB VAL A 20 7.484 -3.073 7.363 1.00 1.00 H new ATOM 0 HG11 VAL A 20 5.398 -1.789 6.989 1.00 1.00 H new ATOM 0 HG12 VAL A 20 5.647 -2.120 8.719 1.00 1.00 H new ATOM 0 HG13 VAL A 20 5.997 -0.503 8.063 1.00 1.00 H new ATOM 0 HG21 VAL A 20 7.357 -1.456 5.485 1.00 1.00 H new ATOM 0 HG22 VAL A 20 7.969 -0.170 6.552 1.00 1.00 H new ATOM 0 HG23 VAL A 20 9.010 -1.553 6.137 1.00 1.00 H new ATOM 305 N ILE A 21 7.893 -3.632 10.184 1.00 1.00 N ATOM 306 CA ILE A 21 7.338 -4.330 11.338 1.00 1.00 C ATOM 307 C ILE A 21 7.837 -3.678 12.623 1.00 1.00 C ATOM 308 O ILE A 21 7.092 -3.548 13.594 1.00 1.00 O ATOM 309 CB ILE A 21 7.747 -5.809 11.305 1.00 1.00 C ATOM 310 CG1 ILE A 21 7.078 -6.496 10.106 1.00 1.00 C ATOM 311 CG2 ILE A 21 7.303 -6.495 12.602 1.00 1.00 C ATOM 312 CD1 ILE A 21 7.623 -7.920 9.946 1.00 1.00 C ATOM 0 H ILE A 21 8.401 -4.227 9.529 1.00 1.00 H new ATOM 0 HA ILE A 21 6.250 -4.266 11.305 1.00 1.00 H new ATOM 0 HB ILE A 21 8.830 -5.884 11.210 1.00 1.00 H new ATOM 0 HG12 ILE A 21 5.998 -6.525 10.249 1.00 1.00 H new ATOM 0 HG13 ILE A 21 7.264 -5.923 9.198 1.00 1.00 H new ATOM 0 HG21 ILE A 21 7.594 -7.545 12.576 1.00 1.00 H new ATOM 0 HG22 ILE A 21 7.778 -6.007 13.453 1.00 1.00 H new ATOM 0 HG23 ILE A 21 6.220 -6.421 12.700 1.00 1.00 H new ATOM 0 HD11 ILE A 21 7.143 -8.400 9.093 1.00 1.00 H new ATOM 0 HD12 ILE A 21 8.700 -7.881 9.782 1.00 1.00 H new ATOM 0 HD13 ILE A 21 7.414 -8.493 10.849 1.00 1.00 H new ATOM 324 N LYS A 22 9.096 -3.258 12.615 1.00 1.00 N ATOM 325 CA LYS A 22 9.676 -2.603 13.778 1.00 1.00 C ATOM 326 C LYS A 22 8.965 -1.277 14.046 1.00 1.00 C ATOM 327 O LYS A 22 8.722 -0.914 15.197 1.00 1.00 O ATOM 328 CB LYS A 22 11.171 -2.361 13.560 1.00 1.00 C ATOM 329 CG LYS A 22 11.901 -3.706 13.529 1.00 1.00 C ATOM 330 CD LYS A 22 13.397 -3.470 13.320 1.00 1.00 C ATOM 331 CE LYS A 22 14.131 -4.812 13.323 1.00 1.00 C ATOM 332 NZ LYS A 22 13.688 -5.622 12.153 1.00 1.00 N ATOM 0 H LYS A 22 9.730 -3.359 11.822 1.00 1.00 H new ATOM 0 HA LYS A 22 9.548 -3.253 14.643 1.00 1.00 H new ATOM 0 HB2 LYS A 22 11.332 -1.825 12.625 1.00 1.00 H new ATOM 0 HB3 LYS A 22 11.570 -1.736 14.358 1.00 1.00 H new ATOM 0 HG2 LYS A 22 11.734 -4.244 14.462 1.00 1.00 H new ATOM 0 HG3 LYS A 22 11.505 -4.328 12.727 1.00 1.00 H new ATOM 0 HD2 LYS A 22 13.566 -2.953 12.375 1.00 1.00 H new ATOM 0 HD3 LYS A 22 13.788 -2.828 14.109 1.00 1.00 H new ATOM 0 HE2 LYS A 22 15.208 -4.650 13.280 1.00 1.00 H new ATOM 0 HE3 LYS A 22 13.926 -5.349 14.249 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 14.379 -6.379 11.973 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 12.758 -6.043 12.354 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 13.618 -5.011 11.314 1.00 1.00 H new ATOM 346 N GLN A 23 8.635 -0.557 12.973 1.00 1.00 N ATOM 347 CA GLN A 23 7.956 0.724 13.104 1.00 1.00 C ATOM 348 C GLN A 23 6.561 0.518 13.686 1.00 1.00 C ATOM 349 O GLN A 23 6.171 1.189 14.637 1.00 1.00 O ATOM 350 CB GLN A 23 7.848 1.386 11.724 1.00 1.00 C ATOM 351 CG GLN A 23 9.243 1.681 11.188 1.00 1.00 C ATOM 352 CD GLN A 23 9.158 2.206 9.760 1.00 1.00 C ATOM 353 OE1 GLN A 23 8.067 2.473 9.257 1.00 1.00 O ATOM 354 NE2 GLN A 23 10.255 2.368 9.070 1.00 1.00 N ATOM 0 H GLN A 23 8.827 -0.840 12.012 1.00 1.00 H new ATOM 0 HA GLN A 23 8.527 1.367 13.774 1.00 1.00 H new ATOM 0 HB2 GLN A 23 7.314 0.731 11.036 1.00 1.00 H new ATOM 0 HB3 GLN A 23 7.273 2.309 11.796 1.00 1.00 H new ATOM 0 HG2 GLN A 23 9.737 2.415 11.824 1.00 1.00 H new ATOM 0 HG3 GLN A 23 9.850 0.776 11.215 1.00 1.00 H new ATOM 0 HE21 GLN A 23 11.158 2.146 9.489 1.00 1.00 H new ATOM 0 HE22 GLN A 23 10.208 2.716 8.112 1.00 1.00 H new ATOM 363 N LEU A 24 5.822 -0.423 13.111 1.00 1.00 N ATOM 364 CA LEU A 24 4.470 -0.717 13.576 1.00 1.00 C ATOM 365 C LEU A 24 4.497 -1.190 15.019 1.00 1.00 C ATOM 366 O LEU A 24 3.632 -0.828 15.814 1.00 1.00 O ATOM 367 CB LEU A 24 3.838 -1.792 12.690 1.00 1.00 C ATOM 368 CG LEU A 24 3.505 -1.203 11.310 1.00 1.00 C ATOM 369 CD1 LEU A 24 3.249 -2.343 10.319 1.00 1.00 C ATOM 370 CD2 LEU A 24 2.248 -0.305 11.388 1.00 1.00 C ATOM 0 H LEU A 24 6.133 -0.994 12.325 1.00 1.00 H new ATOM 0 HA LEU A 24 3.875 0.194 13.517 1.00 1.00 H new ATOM 0 HB2 LEU A 24 4.522 -2.634 12.580 1.00 1.00 H new ATOM 0 HB3 LEU A 24 2.932 -2.176 13.159 1.00 1.00 H new ATOM 0 HG LEU A 24 4.349 -0.599 10.977 1.00 1.00 H new ATOM 0 HD11 LEU A 24 3.013 -1.927 9.339 1.00 1.00 H new ATOM 0 HD12 LEU A 24 4.140 -2.966 10.243 1.00 1.00 H new ATOM 0 HD13 LEU A 24 2.412 -2.948 10.668 1.00 1.00 H new ATOM 0 HD21 LEU A 24 2.030 0.102 10.401 1.00 1.00 H new ATOM 0 HD22 LEU A 24 1.399 -0.896 11.733 1.00 1.00 H new ATOM 0 HD23 LEU A 24 2.428 0.513 12.086 1.00 1.00 H new ATOM 382 N ASP A 25 5.491 -1.998 15.352 1.00 1.00 N ATOM 383 CA ASP A 25 5.614 -2.514 16.707 1.00 1.00 C ATOM 384 C ASP A 25 5.670 -1.367 17.711 1.00 1.00 C ATOM 385 O ASP A 25 4.968 -1.380 18.721 1.00 1.00 O ATOM 386 CB ASP A 25 6.886 -3.352 16.827 1.00 1.00 C ATOM 387 CG ASP A 25 7.023 -3.902 18.243 1.00 1.00 C ATOM 388 OD1 ASP A 25 6.227 -3.523 19.086 1.00 1.00 O ATOM 389 OD2 ASP A 25 7.922 -4.696 18.463 1.00 1.00 O ATOM 0 H ASP A 25 6.219 -2.309 14.709 1.00 1.00 H new ATOM 0 HA ASP A 25 4.743 -3.133 16.923 1.00 1.00 H new ATOM 0 HB2 ASP A 25 6.858 -4.174 16.111 1.00 1.00 H new ATOM 0 HB3 ASP A 25 7.756 -2.743 16.580 1.00 1.00 H new ATOM 395 N ASP A 26 6.506 -0.376 17.428 1.00 1.00 N ATOM 396 CA ASP A 26 6.642 0.771 18.321 1.00 1.00 C ATOM 397 C ASP A 26 5.300 1.478 18.494 1.00 1.00 C ATOM 398 O ASP A 26 4.897 1.806 19.609 1.00 1.00 O ATOM 399 CB ASP A 26 7.676 1.747 17.755 1.00 1.00 C ATOM 400 CG ASP A 26 7.979 2.836 18.781 1.00 1.00 C ATOM 401 OD1 ASP A 26 7.261 2.912 19.764 1.00 1.00 O ATOM 402 OD2 ASP A 26 8.926 3.575 18.567 1.00 1.00 O ATOM 0 H ASP A 26 7.095 -0.341 16.596 1.00 1.00 H new ATOM 0 HA ASP A 26 6.975 0.417 19.297 1.00 1.00 H new ATOM 0 HB2 ASP A 26 8.591 1.213 17.498 1.00 1.00 H new ATOM 0 HB3 ASP A 26 7.300 2.196 16.836 1.00 1.00 H new ATOM 408 N LEU A 27 4.613 1.706 17.384 1.00 1.00 N ATOM 409 CA LEU A 27 3.316 2.364 17.417 1.00 1.00 C ATOM 410 C LEU A 27 2.257 1.451 18.027 1.00 1.00 C ATOM 411 O LEU A 27 1.342 1.918 18.702 1.00 1.00 O ATOM 412 CB LEU A 27 2.895 2.781 15.996 1.00 1.00 C ATOM 413 CG LEU A 27 3.534 4.126 15.617 1.00 1.00 C ATOM 414 CD1 LEU A 27 5.010 3.926 15.289 1.00 1.00 C ATOM 415 CD2 LEU A 27 2.815 4.707 14.398 1.00 1.00 C ATOM 0 H LEU A 27 4.932 1.445 16.451 1.00 1.00 H new ATOM 0 HA LEU A 27 3.403 3.254 18.040 1.00 1.00 H new ATOM 0 HB2 LEU A 27 3.196 2.015 15.282 1.00 1.00 H new ATOM 0 HB3 LEU A 27 1.809 2.859 15.941 1.00 1.00 H new ATOM 0 HG LEU A 27 3.444 4.814 16.457 1.00 1.00 H new ATOM 0 HD11 LEU A 27 5.456 4.884 15.021 1.00 1.00 H new ATOM 0 HD12 LEU A 27 5.524 3.517 16.159 1.00 1.00 H new ATOM 0 HD13 LEU A 27 5.106 3.234 14.452 1.00 1.00 H new ATOM 0 HD21 LEU A 27 3.268 5.661 14.129 1.00 1.00 H new ATOM 0 HD22 LEU A 27 2.902 4.015 13.560 1.00 1.00 H new ATOM 0 HD23 LEU A 27 1.762 4.859 14.635 1.00 1.00 H new ATOM 427 N GLU A 28 2.378 0.155 17.772 1.00 1.00 N ATOM 428 CA GLU A 28 1.414 -0.801 18.288 1.00 1.00 C ATOM 429 C GLU A 28 1.497 -0.879 19.808 1.00 1.00 C ATOM 430 O GLU A 28 0.477 -0.941 20.494 1.00 1.00 O ATOM 431 CB GLU A 28 1.691 -2.181 17.687 1.00 1.00 C ATOM 432 CG GLU A 28 0.520 -3.115 17.989 1.00 1.00 C ATOM 433 CD GLU A 28 0.820 -4.518 17.474 1.00 1.00 C ATOM 434 OE1 GLU A 28 1.966 -4.776 17.146 1.00 1.00 O ATOM 435 OE2 GLU A 28 -0.102 -5.315 17.418 1.00 1.00 O ATOM 0 H GLU A 28 3.129 -0.254 17.215 1.00 1.00 H new ATOM 0 HA GLU A 28 0.412 -0.473 18.010 1.00 1.00 H new ATOM 0 HB2 GLU A 28 1.835 -2.098 16.610 1.00 1.00 H new ATOM 0 HB3 GLU A 28 2.612 -2.591 18.101 1.00 1.00 H new ATOM 0 HG2 GLU A 28 0.337 -3.145 19.063 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -0.388 -2.734 17.522 1.00 1.00 H new ATOM 443 N VAL A 29 2.721 -0.883 20.329 1.00 1.00 N ATOM 444 CA VAL A 29 2.926 -0.956 21.772 1.00 1.00 C ATOM 445 C VAL A 29 2.420 0.308 22.461 1.00 1.00 C ATOM 446 O VAL A 29 1.758 0.239 23.497 1.00 1.00 O ATOM 447 CB VAL A 29 4.416 -1.147 22.085 1.00 1.00 C ATOM 448 CG1 VAL A 29 4.652 -1.005 23.593 1.00 1.00 C ATOM 449 CG2 VAL A 29 4.856 -2.541 21.632 1.00 1.00 C ATOM 0 H VAL A 29 3.579 -0.837 19.779 1.00 1.00 H new ATOM 0 HA VAL A 29 2.362 -1.809 22.149 1.00 1.00 H new ATOM 0 HB VAL A 29 4.994 -0.389 21.557 1.00 1.00 H new ATOM 0 HG11 VAL A 29 5.711 -1.142 23.810 1.00 1.00 H new ATOM 0 HG12 VAL A 29 4.340 -0.013 23.918 1.00 1.00 H new ATOM 0 HG13 VAL A 29 4.073 -1.760 24.125 1.00 1.00 H new ATOM 0 HG21 VAL A 29 5.914 -2.678 21.854 1.00 1.00 H new ATOM 0 HG22 VAL A 29 4.274 -3.296 22.160 1.00 1.00 H new ATOM 0 HG23 VAL A 29 4.694 -2.643 20.559 1.00 1.00 H new ATOM 459 N GLN A 30 2.738 1.461 21.880 1.00 1.00 N ATOM 460 CA GLN A 30 2.318 2.733 22.452 1.00 1.00 C ATOM 461 C GLN A 30 0.799 2.822 22.507 1.00 1.00 C ATOM 462 O GLN A 30 0.234 3.333 23.474 1.00 1.00 O ATOM 463 CB GLN A 30 2.871 3.891 21.620 1.00 1.00 C ATOM 464 CG GLN A 30 4.377 4.022 21.854 1.00 1.00 C ATOM 465 CD GLN A 30 4.936 5.170 21.021 1.00 1.00 C ATOM 466 OE1 GLN A 30 4.180 5.894 20.372 1.00 1.00 O ATOM 467 NE2 GLN A 30 6.223 5.384 20.999 1.00 1.00 N ATOM 0 H GLN A 30 3.281 1.540 21.020 1.00 1.00 H new ATOM 0 HA GLN A 30 2.710 2.798 23.467 1.00 1.00 H new ATOM 0 HB2 GLN A 30 2.671 3.719 20.562 1.00 1.00 H new ATOM 0 HB3 GLN A 30 2.369 4.819 21.892 1.00 1.00 H new ATOM 0 HG2 GLN A 30 4.575 4.199 22.911 1.00 1.00 H new ATOM 0 HG3 GLN A 30 4.877 3.091 21.587 1.00 1.00 H new ATOM 0 HE21 GLN A 30 6.849 4.784 21.537 1.00 1.00 H new ATOM 0 HE22 GLN A 30 6.603 6.151 20.444 1.00 1.00 H new ATOM 476 N ARG A 31 0.144 2.323 21.466 1.00 1.00 N ATOM 477 CA ARG A 31 -1.313 2.351 21.406 1.00 1.00 C ATOM 478 C ARG A 31 -1.907 1.165 22.150 1.00 1.00 C ATOM 479 O ARG A 31 -3.127 1.060 22.284 1.00 1.00 O ATOM 480 CB ARG A 31 -1.779 2.330 19.951 1.00 1.00 C ATOM 481 CG ARG A 31 -1.416 3.656 19.283 1.00 1.00 C ATOM 482 CD ARG A 31 -1.831 3.621 17.812 1.00 1.00 C ATOM 483 NE ARG A 31 -3.284 3.548 17.700 1.00 1.00 N ATOM 484 CZ ARG A 31 -3.880 3.494 16.515 1.00 1.00 C ATOM 485 NH1 ARG A 31 -3.164 3.511 15.427 1.00 1.00 N ATOM 486 NH2 ARG A 31 -5.182 3.430 16.437 1.00 1.00 N ATOM 0 H ARG A 31 0.595 1.897 20.656 1.00 1.00 H new ATOM 0 HA ARG A 31 -1.656 3.269 21.883 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.310 1.502 19.419 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.856 2.170 19.905 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -1.916 4.480 19.793 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -0.344 3.834 19.364 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -1.464 4.512 17.302 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -1.377 2.761 17.319 1.00 1.00 H new ATOM 0 HE ARG A 31 -3.852 3.538 18.547 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -2.147 3.566 15.486 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -3.620 3.470 14.516 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -5.744 3.421 17.288 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -5.637 3.389 15.525 1.00 1.00 H new ATOM 500 N ASN A 32 -1.040 0.271 22.629 1.00 1.00 N ATOM 501 CA ASN A 32 -1.487 -0.904 23.364 1.00 1.00 C ATOM 502 C ASN A 32 -2.682 -1.537 22.675 1.00 1.00 C ATOM 503 O ASN A 32 -3.652 -1.922 23.329 1.00 1.00 O ATOM 504 CB ASN A 32 -1.857 -0.525 24.798 1.00 1.00 C ATOM 505 CG ASN A 32 -2.956 0.531 24.795 1.00 1.00 C ATOM 506 OD1 ASN A 32 -2.684 1.745 25.186 1.00 1.00 O flip ATOM 507 ND2 ASN A 32 -4.093 0.244 24.420 1.00 1.00 N flip ATOM 0 H ASN A 32 -0.028 0.342 22.519 1.00 1.00 H new ATOM 0 HA ASN A 32 -0.670 -1.625 23.387 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -2.193 -1.409 25.341 1.00 1.00 H new ATOM 0 HB3 ASN A 32 -0.979 -0.145 25.320 1.00 1.00 H new ATOM 0 HD21 ASN A 32 -4.305 -0.706 24.114 1.00 1.00 H new ATOM 0 HD22 ASN A 32 -4.823 0.956 24.415 1.00 1.00 H new ATOM 514 N LEU A 33 -2.615 -1.640 21.347 1.00 1.00 N ATOM 515 CA LEU A 33 -3.712 -2.225 20.579 1.00 1.00 C ATOM 516 C LEU A 33 -3.178 -3.205 19.540 1.00 1.00 C ATOM 517 O LEU A 33 -2.040 -3.074 19.085 1.00 1.00 O ATOM 518 CB LEU A 33 -4.512 -1.106 19.890 1.00 1.00 C ATOM 519 CG LEU A 33 -5.468 -0.449 20.903 1.00 1.00 C ATOM 520 CD1 LEU A 33 -5.857 0.944 20.408 1.00 1.00 C ATOM 521 CD2 LEU A 33 -6.744 -1.294 21.075 1.00 1.00 C ATOM 0 H LEU A 33 -1.821 -1.329 20.787 1.00 1.00 H new ATOM 0 HA LEU A 33 -4.366 -2.771 21.259 1.00 1.00 H new ATOM 0 HB2 LEU A 33 -3.832 -0.359 19.481 1.00 1.00 H new ATOM 0 HB3 LEU A 33 -5.079 -1.514 19.053 1.00 1.00 H new ATOM 0 HG LEU A 33 -4.958 -0.378 21.864 1.00 1.00 H new ATOM 0 HD11 LEU A 33 -6.534 1.409 21.125 1.00 1.00 H new ATOM 0 HD12 LEU A 33 -4.961 1.557 20.304 1.00 1.00 H new ATOM 0 HD13 LEU A 33 -6.354 0.861 19.441 1.00 1.00 H new ATOM 0 HD21 LEU A 33 -7.405 -0.812 21.795 1.00 1.00 H new ATOM 0 HD22 LEU A 33 -7.254 -1.382 20.116 1.00 1.00 H new ATOM 0 HD23 LEU A 33 -6.477 -2.287 21.436 1.00 1.00 H new ATOM 533 N PRO A 34 -3.970 -4.181 19.165 1.00 1.00 N ATOM 534 CA PRO A 34 -3.561 -5.204 18.160 1.00 1.00 C ATOM 535 C PRO A 34 -3.229 -4.582 16.805 1.00 1.00 C ATOM 536 O PRO A 34 -3.842 -3.600 16.390 1.00 1.00 O ATOM 537 CB PRO A 34 -4.788 -6.139 18.060 1.00 1.00 C ATOM 538 CG PRO A 34 -5.934 -5.346 18.606 1.00 1.00 C ATOM 539 CD PRO A 34 -5.340 -4.426 19.660 1.00 1.00 C ATOM 0 HA PRO A 34 -2.652 -5.726 18.457 1.00 1.00 H new ATOM 0 HB2 PRO A 34 -4.972 -6.437 17.028 1.00 1.00 H new ATOM 0 HB3 PRO A 34 -4.634 -7.053 18.633 1.00 1.00 H new ATOM 0 HG2 PRO A 34 -6.423 -4.773 17.818 1.00 1.00 H new ATOM 0 HG3 PRO A 34 -6.690 -6.000 19.040 1.00 1.00 H new ATOM 0 HD2 PRO A 34 -5.907 -3.499 19.750 1.00 1.00 H new ATOM 0 HD3 PRO A 34 -5.334 -4.893 20.645 1.00 1.00 H new ATOM 547 N ARG A 35 -2.254 -5.171 16.123 1.00 1.00 N ATOM 548 CA ARG A 35 -1.847 -4.679 14.814 1.00 1.00 C ATOM 549 C ARG A 35 -2.995 -4.815 13.818 1.00 1.00 C ATOM 550 O ARG A 35 -3.247 -3.919 13.018 1.00 1.00 O ATOM 551 CB ARG A 35 -0.642 -5.470 14.310 1.00 1.00 C ATOM 552 CG ARG A 35 -0.167 -4.885 12.978 1.00 1.00 C ATOM 553 CD ARG A 35 1.113 -5.593 12.533 1.00 1.00 C ATOM 554 NE ARG A 35 1.547 -5.085 11.236 1.00 1.00 N ATOM 555 CZ ARG A 35 2.653 -5.536 10.654 1.00 1.00 C ATOM 556 NH1 ARG A 35 3.375 -6.449 11.245 1.00 1.00 N ATOM 557 NH2 ARG A 35 3.019 -5.065 9.493 1.00 1.00 N ATOM 0 H ARG A 35 -1.734 -5.984 16.452 1.00 1.00 H new ATOM 0 HA ARG A 35 -1.577 -3.627 14.908 1.00 1.00 H new ATOM 0 HB2 ARG A 35 0.163 -5.432 15.043 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -0.909 -6.519 14.184 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -0.942 -5.003 12.221 1.00 1.00 H new ATOM 0 HG3 ARG A 35 0.015 -3.815 13.083 1.00 1.00 H new ATOM 0 HD2 ARG A 35 1.898 -5.439 13.273 1.00 1.00 H new ATOM 0 HD3 ARG A 35 0.940 -6.667 12.471 1.00 1.00 H new ATOM 0 HE ARG A 35 0.991 -4.370 10.767 1.00 1.00 H new ATOM 0 HH11 ARG A 35 3.090 -6.816 12.153 1.00 1.00 H new ATOM 0 HH12 ARG A 35 4.224 -6.796 10.799 1.00 1.00 H new ATOM 0 HH21 ARG A 35 2.456 -4.350 9.032 1.00 1.00 H new ATOM 0 HH22 ARG A 35 3.868 -5.412 9.047 1.00 1.00 H new ATOM 571 N ALA A 36 -3.685 -5.945 13.868 1.00 1.00 N ATOM 572 CA ALA A 36 -4.799 -6.181 12.953 1.00 1.00 C ATOM 573 C ALA A 36 -5.725 -4.972 12.927 1.00 1.00 C ATOM 574 O ALA A 36 -6.197 -4.567 11.866 1.00 1.00 O ATOM 575 CB ALA A 36 -5.585 -7.417 13.401 1.00 1.00 C ATOM 0 H ALA A 36 -3.499 -6.705 14.522 1.00 1.00 H new ATOM 0 HA ALA A 36 -4.401 -6.346 11.952 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -6.415 -7.589 12.715 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -4.928 -8.286 13.400 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -5.973 -7.257 14.407 1.00 1.00 H new ATOM 581 N ASP A 37 -5.973 -4.385 14.091 1.00 1.00 N ATOM 582 CA ASP A 37 -6.832 -3.209 14.166 1.00 1.00 C ATOM 583 C ASP A 37 -6.199 -2.041 13.413 1.00 1.00 C ATOM 584 O ASP A 37 -6.894 -1.272 12.750 1.00 1.00 O ATOM 585 CB ASP A 37 -7.051 -2.827 15.634 1.00 1.00 C ATOM 586 CG ASP A 37 -7.867 -1.544 15.728 1.00 1.00 C ATOM 587 OD1 ASP A 37 -8.943 -1.508 15.157 1.00 1.00 O ATOM 588 OD2 ASP A 37 -7.403 -0.619 16.373 1.00 1.00 O ATOM 0 H ASP A 37 -5.597 -4.698 14.986 1.00 1.00 H new ATOM 0 HA ASP A 37 -7.792 -3.441 13.705 1.00 1.00 H new ATOM 0 HB2 ASP A 37 -7.567 -3.634 16.154 1.00 1.00 H new ATOM 0 HB3 ASP A 37 -6.090 -2.692 16.130 1.00 1.00 H new ATOM 594 N LEU A 38 -4.880 -1.909 13.521 1.00 1.00 N ATOM 595 CA LEU A 38 -4.179 -0.824 12.845 1.00 1.00 C ATOM 596 C LEU A 38 -4.348 -0.959 11.339 1.00 1.00 C ATOM 597 O LEU A 38 -4.622 0.021 10.646 1.00 1.00 O ATOM 598 CB LEU A 38 -2.690 -0.866 13.213 1.00 1.00 C ATOM 599 CG LEU A 38 -2.519 -0.643 14.724 1.00 1.00 C ATOM 600 CD1 LEU A 38 -1.033 -0.756 15.091 1.00 1.00 C ATOM 601 CD2 LEU A 38 -3.047 0.749 15.122 1.00 1.00 C ATOM 0 H LEU A 38 -4.282 -2.532 14.064 1.00 1.00 H new ATOM 0 HA LEU A 38 -4.599 0.130 13.163 1.00 1.00 H new ATOM 0 HB2 LEU A 38 -2.263 -1.827 12.928 1.00 1.00 H new ATOM 0 HB3 LEU A 38 -2.148 -0.099 12.660 1.00 1.00 H new ATOM 0 HG LEU A 38 -3.088 -1.401 15.262 1.00 1.00 H new ATOM 0 HD11 LEU A 38 -0.910 -0.598 16.162 1.00 1.00 H new ATOM 0 HD12 LEU A 38 -0.667 -1.748 14.826 1.00 1.00 H new ATOM 0 HD13 LEU A 38 -0.465 -0.002 14.546 1.00 1.00 H new ATOM 0 HD21 LEU A 38 -2.920 0.893 16.195 1.00 1.00 H new ATOM 0 HD22 LEU A 38 -2.491 1.517 14.584 1.00 1.00 H new ATOM 0 HD23 LEU A 38 -4.105 0.823 14.869 1.00 1.00 H new ATOM 613 N LEU A 39 -4.199 -2.179 10.841 1.00 1.00 N ATOM 614 CA LEU A 39 -4.352 -2.426 9.417 1.00 1.00 C ATOM 615 C LEU A 39 -5.784 -2.134 8.988 1.00 1.00 C ATOM 616 O LEU A 39 -6.013 -1.516 7.950 1.00 1.00 O ATOM 617 CB LEU A 39 -3.990 -3.882 9.105 1.00 1.00 C ATOM 618 CG LEU A 39 -2.480 -4.094 9.304 1.00 1.00 C ATOM 619 CD1 LEU A 39 -2.165 -5.591 9.210 1.00 1.00 C ATOM 620 CD2 LEU A 39 -1.671 -3.322 8.236 1.00 1.00 C ATOM 0 H LEU A 39 -3.975 -3.004 11.397 1.00 1.00 H new ATOM 0 HA LEU A 39 -3.682 -1.768 8.864 1.00 1.00 H new ATOM 0 HB2 LEU A 39 -4.550 -4.554 9.755 1.00 1.00 H new ATOM 0 HB3 LEU A 39 -4.269 -4.125 8.080 1.00 1.00 H new ATOM 0 HG LEU A 39 -2.198 -3.715 10.286 1.00 1.00 H new ATOM 0 HD11 LEU A 39 -1.095 -5.747 9.350 1.00 1.00 H new ATOM 0 HD12 LEU A 39 -2.715 -6.128 9.983 1.00 1.00 H new ATOM 0 HD13 LEU A 39 -2.461 -5.964 8.229 1.00 1.00 H new ATOM 0 HD21 LEU A 39 -0.606 -3.487 8.397 1.00 1.00 H new ATOM 0 HD22 LEU A 39 -1.947 -3.677 7.243 1.00 1.00 H new ATOM 0 HD23 LEU A 39 -1.889 -2.257 8.314 1.00 1.00 H new ATOM 632 N ARG A 40 -6.743 -2.587 9.790 1.00 1.00 N ATOM 633 CA ARG A 40 -8.145 -2.381 9.478 1.00 1.00 C ATOM 634 C ARG A 40 -8.434 -0.899 9.327 1.00 1.00 C ATOM 635 O ARG A 40 -9.084 -0.468 8.376 1.00 1.00 O ATOM 636 CB ARG A 40 -8.983 -2.954 10.617 1.00 1.00 C ATOM 637 CG ARG A 40 -8.892 -4.478 10.604 1.00 1.00 C ATOM 638 CD ARG A 40 -9.933 -5.086 9.650 1.00 1.00 C ATOM 639 NE ARG A 40 -11.277 -4.697 10.065 1.00 1.00 N ATOM 640 CZ ARG A 40 -12.342 -5.027 9.344 1.00 1.00 C ATOM 641 NH1 ARG A 40 -12.198 -5.714 8.246 1.00 1.00 N ATOM 642 NH2 ARG A 40 -13.533 -4.661 9.735 1.00 1.00 N ATOM 0 H ARG A 40 -6.571 -3.097 10.657 1.00 1.00 H new ATOM 0 HA ARG A 40 -8.391 -2.880 8.541 1.00 1.00 H new ATOM 0 HB2 ARG A 40 -8.629 -2.567 11.573 1.00 1.00 H new ATOM 0 HB3 ARG A 40 -10.022 -2.641 10.511 1.00 1.00 H new ATOM 0 HG2 ARG A 40 -7.891 -4.783 10.298 1.00 1.00 H new ATOM 0 HG3 ARG A 40 -9.048 -4.863 11.612 1.00 1.00 H new ATOM 0 HD2 ARG A 40 -9.746 -4.748 8.631 1.00 1.00 H new ATOM 0 HD3 ARG A 40 -9.845 -6.172 9.647 1.00 1.00 H new ATOM 0 HE ARG A 40 -11.400 -4.162 10.925 1.00 1.00 H new ATOM 0 HH11 ARG A 40 -11.267 -5.998 7.941 1.00 1.00 H new ATOM 0 HH12 ARG A 40 -13.016 -5.968 7.692 1.00 1.00 H new ATOM 0 HH21 ARG A 40 -13.645 -4.122 10.594 1.00 1.00 H new ATOM 0 HH22 ARG A 40 -14.352 -4.914 9.182 1.00 1.00 H new ATOM 656 N GLU A 41 -7.931 -0.129 10.272 1.00 1.00 N ATOM 657 CA GLU A 41 -8.123 1.325 10.247 1.00 1.00 C ATOM 658 C GLU A 41 -7.327 1.950 9.102 1.00 1.00 C ATOM 659 O GLU A 41 -7.809 2.853 8.418 1.00 1.00 O ATOM 660 CB GLU A 41 -7.677 1.947 11.572 1.00 1.00 C ATOM 661 CG GLU A 41 -8.610 1.487 12.691 1.00 1.00 C ATOM 662 CD GLU A 41 -8.097 1.985 14.038 1.00 1.00 C ATOM 663 OE1 GLU A 41 -8.713 1.660 15.040 1.00 1.00 O ATOM 664 OE2 GLU A 41 -7.097 2.683 14.048 1.00 1.00 O ATOM 0 H GLU A 41 -7.389 -0.473 11.065 1.00 1.00 H new ATOM 0 HA GLU A 41 -9.184 1.523 10.097 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -6.651 1.654 11.796 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -7.689 3.034 11.498 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -9.617 1.865 12.514 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -8.675 0.399 12.697 1.00 1.00 H new ATOM 672 N ALA A 42 -6.109 1.460 8.897 1.00 1.00 N ATOM 673 CA ALA A 42 -5.260 1.976 7.831 1.00 1.00 C ATOM 674 C ALA A 42 -5.965 1.839 6.486 1.00 1.00 C ATOM 675 O ALA A 42 -6.034 2.795 5.714 1.00 1.00 O ATOM 676 CB ALA A 42 -3.937 1.206 7.798 1.00 1.00 C ATOM 0 H ALA A 42 -5.691 0.712 9.450 1.00 1.00 H new ATOM 0 HA ALA A 42 -5.059 3.030 8.023 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -3.308 1.598 6.999 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -3.424 1.322 8.753 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -4.135 0.149 7.619 1.00 1.00 H new ATOM 682 N VAL A 43 -6.500 0.649 6.213 1.00 1.00 N ATOM 683 CA VAL A 43 -7.204 0.421 4.958 1.00 1.00 C ATOM 684 C VAL A 43 -8.485 1.258 4.915 1.00 1.00 C ATOM 685 O VAL A 43 -8.731 1.985 3.953 1.00 1.00 O ATOM 686 CB VAL A 43 -7.547 -1.066 4.822 1.00 1.00 C ATOM 687 CG1 VAL A 43 -8.452 -1.282 3.607 1.00 1.00 C ATOM 688 CG2 VAL A 43 -6.255 -1.870 4.646 1.00 1.00 C ATOM 0 H VAL A 43 -6.459 -0.158 6.835 1.00 1.00 H new ATOM 0 HA VAL A 43 -6.561 0.718 4.129 1.00 1.00 H new ATOM 0 HB VAL A 43 -8.068 -1.399 5.720 1.00 1.00 H new ATOM 0 HG11 VAL A 43 -8.692 -2.341 3.516 1.00 1.00 H new ATOM 0 HG12 VAL A 43 -9.372 -0.711 3.732 1.00 1.00 H new ATOM 0 HG13 VAL A 43 -7.937 -0.948 2.706 1.00 1.00 H new ATOM 0 HG21 VAL A 43 -6.496 -2.929 4.549 1.00 1.00 H new ATOM 0 HG22 VAL A 43 -5.736 -1.532 3.749 1.00 1.00 H new ATOM 0 HG23 VAL A 43 -5.613 -1.722 5.514 1.00 1.00 H new ATOM 698 N ASP A 44 -9.295 1.148 5.965 1.00 1.00 N ATOM 699 CA ASP A 44 -10.541 1.892 6.030 1.00 1.00 C ATOM 700 C ASP A 44 -10.269 3.370 5.789 1.00 1.00 C ATOM 701 O ASP A 44 -10.942 4.010 4.980 1.00 1.00 O ATOM 702 CB ASP A 44 -11.180 1.693 7.406 1.00 1.00 C ATOM 703 CG ASP A 44 -11.803 0.301 7.511 1.00 1.00 C ATOM 704 OD1 ASP A 44 -11.993 -0.325 6.482 1.00 1.00 O ATOM 705 OD2 ASP A 44 -12.084 -0.114 8.624 1.00 1.00 O ATOM 0 H ASP A 44 -9.110 0.555 6.774 1.00 1.00 H new ATOM 0 HA ASP A 44 -11.224 1.529 5.262 1.00 1.00 H new ATOM 0 HB2 ASP A 44 -10.428 1.821 8.185 1.00 1.00 H new ATOM 0 HB3 ASP A 44 -11.943 2.453 7.572 1.00 1.00 H new ATOM 711 N GLN A 45 -9.270 3.906 6.482 1.00 1.00 N ATOM 712 CA GLN A 45 -8.911 5.302 6.323 1.00 1.00 C ATOM 713 C GLN A 45 -8.414 5.561 4.904 1.00 1.00 C ATOM 714 O GLN A 45 -8.682 6.611 4.321 1.00 1.00 O ATOM 715 CB GLN A 45 -7.820 5.672 7.335 1.00 1.00 C ATOM 716 CG GLN A 45 -8.449 5.908 8.711 1.00 1.00 C ATOM 717 CD GLN A 45 -9.248 7.207 8.704 1.00 1.00 C ATOM 718 OE1 GLN A 45 -10.408 7.226 9.119 1.00 1.00 O ATOM 719 NE2 GLN A 45 -8.697 8.302 8.255 1.00 1.00 N ATOM 0 H GLN A 45 -8.700 3.394 7.155 1.00 1.00 H new ATOM 0 HA GLN A 45 -9.792 5.918 6.502 1.00 1.00 H new ATOM 0 HB2 GLN A 45 -7.081 4.873 7.395 1.00 1.00 H new ATOM 0 HB3 GLN A 45 -7.295 6.569 7.006 1.00 1.00 H new ATOM 0 HG2 GLN A 45 -9.100 5.073 8.971 1.00 1.00 H new ATOM 0 HG3 GLN A 45 -7.671 5.954 9.473 1.00 1.00 H new ATOM 0 HE21 GLN A 45 -7.737 8.286 7.912 1.00 1.00 H new ATOM 0 HE22 GLN A 45 -9.227 9.174 8.248 1.00 1.00 H new ATOM 728 N TYR A 46 -7.686 4.594 4.360 1.00 1.00 N ATOM 729 CA TYR A 46 -7.148 4.722 3.011 1.00 1.00 C ATOM 730 C TYR A 46 -8.281 4.862 2.000 1.00 1.00 C ATOM 731 O TYR A 46 -8.217 5.685 1.089 1.00 1.00 O ATOM 732 CB TYR A 46 -6.296 3.499 2.671 1.00 1.00 C ATOM 733 CG TYR A 46 -5.572 3.734 1.364 1.00 1.00 C ATOM 734 CD1 TYR A 46 -4.596 4.737 1.280 1.00 1.00 C ATOM 735 CD2 TYR A 46 -5.868 2.953 0.238 1.00 1.00 C ATOM 736 CE1 TYR A 46 -3.920 4.960 0.074 1.00 1.00 C ATOM 737 CE2 TYR A 46 -5.190 3.177 -0.968 1.00 1.00 C ATOM 738 CZ TYR A 46 -4.217 4.180 -1.049 1.00 1.00 C ATOM 739 OH TYR A 46 -3.552 4.402 -2.237 1.00 1.00 O ATOM 0 H TYR A 46 -7.455 3.718 4.828 1.00 1.00 H new ATOM 0 HA TYR A 46 -6.525 5.616 2.966 1.00 1.00 H new ATOM 0 HB2 TYR A 46 -5.577 3.311 3.468 1.00 1.00 H new ATOM 0 HB3 TYR A 46 -6.927 2.613 2.595 1.00 1.00 H new ATOM 0 HD1 TYR A 46 -4.365 5.339 2.147 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -6.618 2.179 0.300 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -3.169 5.734 0.011 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -5.418 2.575 -1.835 1.00 1.00 H new ATOM 0 HH TYR A 46 -3.876 3.774 -2.916 1.00 1.00 H new ATOM 749 N LEU A 47 -9.317 4.053 2.172 1.00 1.00 N ATOM 750 CA LEU A 47 -10.465 4.088 1.270 1.00 1.00 C ATOM 751 C LEU A 47 -11.137 5.455 1.308 1.00 1.00 C ATOM 752 O LEU A 47 -11.562 5.975 0.278 1.00 1.00 O ATOM 753 CB LEU A 47 -11.476 3.011 1.661 1.00 1.00 C ATOM 754 CG LEU A 47 -10.904 1.621 1.340 1.00 1.00 C ATOM 755 CD1 LEU A 47 -11.811 0.543 1.949 1.00 1.00 C ATOM 756 CD2 LEU A 47 -10.798 1.416 -0.192 1.00 1.00 C ATOM 0 H LEU A 47 -9.389 3.367 2.923 1.00 1.00 H new ATOM 0 HA LEU A 47 -10.108 3.898 0.258 1.00 1.00 H new ATOM 0 HB2 LEU A 47 -11.706 3.083 2.724 1.00 1.00 H new ATOM 0 HB3 LEU A 47 -12.411 3.163 1.122 1.00 1.00 H new ATOM 0 HG LEU A 47 -9.905 1.543 1.768 1.00 1.00 H new ATOM 0 HD11 LEU A 47 -11.407 -0.443 1.722 1.00 1.00 H new ATOM 0 HD12 LEU A 47 -11.859 0.676 3.030 1.00 1.00 H new ATOM 0 HD13 LEU A 47 -12.813 0.630 1.528 1.00 1.00 H new ATOM 0 HD21 LEU A 47 -10.391 0.426 -0.399 1.00 1.00 H new ATOM 0 HD22 LEU A 47 -11.788 1.502 -0.640 1.00 1.00 H new ATOM 0 HD23 LEU A 47 -10.140 2.175 -0.616 1.00 1.00 H new ATOM 768 N ILE A 48 -11.236 6.031 2.497 1.00 1.00 N ATOM 769 CA ILE A 48 -11.866 7.336 2.643 1.00 1.00 C ATOM 770 C ILE A 48 -11.096 8.370 1.847 1.00 1.00 C ATOM 771 O ILE A 48 -11.685 9.201 1.162 1.00 1.00 O ATOM 772 CB ILE A 48 -11.898 7.723 4.130 1.00 1.00 C ATOM 773 CG1 ILE A 48 -12.831 6.771 4.895 1.00 1.00 C ATOM 774 CG2 ILE A 48 -12.400 9.161 4.282 1.00 1.00 C ATOM 775 CD1 ILE A 48 -12.722 7.025 6.408 1.00 1.00 C ATOM 0 H ILE A 48 -10.893 5.622 3.366 1.00 1.00 H new ATOM 0 HA ILE A 48 -12.887 7.294 2.264 1.00 1.00 H new ATOM 0 HB ILE A 48 -10.890 7.648 4.538 1.00 1.00 H new ATOM 0 HG12 ILE A 48 -13.860 6.917 4.567 1.00 1.00 H new ATOM 0 HG13 ILE A 48 -12.569 5.737 4.672 1.00 1.00 H new ATOM 0 HG21 ILE A 48 -12.420 9.429 5.338 1.00 1.00 H new ATOM 0 HG22 ILE A 48 -11.733 9.838 3.748 1.00 1.00 H new ATOM 0 HG23 ILE A 48 -13.405 9.241 3.868 1.00 1.00 H new ATOM 0 HD11 ILE A 48 -13.387 6.345 6.940 1.00 1.00 H new ATOM 0 HD12 ILE A 48 -11.695 6.856 6.732 1.00 1.00 H new ATOM 0 HD13 ILE A 48 -13.006 8.055 6.625 1.00 1.00 H new ATOM 1413 N MET B 209 12.477 -10.165 3.154 1.00 1.00 N ATOM 1414 CA MET B 209 11.288 -9.560 3.730 1.00 1.00 C ATOM 1415 C MET B 209 10.641 -10.509 4.734 1.00 1.00 C ATOM 1416 O MET B 209 11.263 -11.475 5.175 1.00 1.00 O ATOM 1417 CB MET B 209 10.295 -9.220 2.623 1.00 1.00 C ATOM 1418 CG MET B 209 10.872 -8.113 1.739 1.00 1.00 C ATOM 1419 SD MET B 209 9.684 -7.694 0.440 1.00 1.00 S ATOM 1420 CE MET B 209 8.748 -6.455 1.374 1.00 1.00 C ATOM 0 HA MET B 209 11.576 -8.646 4.250 1.00 1.00 H new ATOM 0 HB2 MET B 209 10.086 -10.106 2.024 1.00 1.00 H new ATOM 0 HB3 MET B 209 9.348 -8.897 3.056 1.00 1.00 H new ATOM 0 HG2 MET B 209 11.094 -7.232 2.341 1.00 1.00 H new ATOM 0 HG3 MET B 209 11.812 -8.441 1.295 1.00 1.00 H new ATOM 0 HE1 MET B 209 7.830 -6.213 0.839 1.00 1.00 H new ATOM 0 HE2 MET B 209 8.500 -6.852 2.358 1.00 1.00 H new ATOM 0 HE3 MET B 209 9.350 -5.554 1.488 1.00 1.00 H new ATOM 1430 N GLY B 210 9.392 -10.229 5.089 1.00 1.00 N ATOM 1431 CA GLY B 210 8.656 -11.063 6.042 1.00 1.00 C ATOM 1432 C GLY B 210 7.284 -11.424 5.488 1.00 1.00 C ATOM 1433 O GLY B 210 6.871 -10.913 4.448 1.00 1.00 O ATOM 0 H GLY B 210 8.865 -9.432 4.733 1.00 1.00 H new ATOM 0 HA2 GLY B 210 9.221 -11.972 6.251 1.00 1.00 H new ATOM 0 HA3 GLY B 210 8.545 -10.533 6.988 1.00 1.00 H new ATOM 1437 N ARG B 211 6.583 -12.309 6.192 1.00 1.00 N ATOM 1438 CA ARG B 211 5.248 -12.745 5.775 1.00 1.00 C ATOM 1439 C ARG B 211 4.241 -12.495 6.888 1.00 1.00 C ATOM 1440 O ARG B 211 4.467 -12.867 8.039 1.00 1.00 O ATOM 1441 CB ARG B 211 5.272 -14.233 5.428 1.00 1.00 C ATOM 1442 CG ARG B 211 3.898 -14.652 4.903 1.00 1.00 C ATOM 1443 CD ARG B 211 3.959 -16.098 4.413 1.00 1.00 C ATOM 1444 NE ARG B 211 4.220 -17.000 5.529 1.00 1.00 N ATOM 1445 CZ ARG B 211 4.440 -18.295 5.329 1.00 1.00 C ATOM 1446 NH1 ARG B 211 4.424 -18.780 4.117 1.00 1.00 N ATOM 1447 NH2 ARG B 211 4.671 -19.082 6.343 1.00 1.00 N ATOM 0 H ARG B 211 6.915 -12.740 7.055 1.00 1.00 H new ATOM 0 HA ARG B 211 4.952 -12.174 4.895 1.00 1.00 H new ATOM 0 HB2 ARG B 211 6.037 -14.431 4.677 1.00 1.00 H new ATOM 0 HB3 ARG B 211 5.532 -14.820 6.309 1.00 1.00 H new ATOM 0 HG2 ARG B 211 3.151 -14.555 5.691 1.00 1.00 H new ATOM 0 HG3 ARG B 211 3.591 -13.994 4.090 1.00 1.00 H new ATOM 0 HD2 ARG B 211 3.018 -16.366 3.932 1.00 1.00 H new ATOM 0 HD3 ARG B 211 4.742 -16.202 3.662 1.00 1.00 H new ATOM 0 HE ARG B 211 4.234 -16.630 6.480 1.00 1.00 H new ATOM 0 HH11 ARG B 211 4.243 -18.165 3.324 1.00 1.00 H new ATOM 0 HH12 ARG B 211 4.593 -19.774 3.963 1.00 1.00 H new ATOM 0 HH21 ARG B 211 4.683 -18.703 7.290 1.00 1.00 H new ATOM 0 HH22 ARG B 211 4.840 -20.076 6.189 1.00 1.00 H new ATOM 1461 N ILE B 212 3.129 -11.853 6.537 1.00 1.00 N ATOM 1462 CA ILE B 212 2.080 -11.540 7.510 1.00 1.00 C ATOM 1463 C ILE B 212 0.718 -11.950 6.967 1.00 1.00 C ATOM 1464 O ILE B 212 0.436 -11.786 5.781 1.00 1.00 O ATOM 1465 CB ILE B 212 2.071 -10.047 7.804 1.00 1.00 C ATOM 1466 CG1 ILE B 212 3.437 -9.630 8.361 1.00 1.00 C ATOM 1467 CG2 ILE B 212 0.988 -9.738 8.837 1.00 1.00 C ATOM 1468 CD1 ILE B 212 3.531 -8.104 8.414 1.00 1.00 C ATOM 0 H ILE B 212 2.929 -11.539 5.587 1.00 1.00 H new ATOM 0 HA ILE B 212 2.284 -12.092 8.427 1.00 1.00 H new ATOM 0 HB ILE B 212 1.867 -9.497 6.886 1.00 1.00 H new ATOM 0 HG12 ILE B 212 3.576 -10.047 9.358 1.00 1.00 H new ATOM 0 HG13 ILE B 212 4.233 -10.031 7.734 1.00 1.00 H new ATOM 0 HG21 ILE B 212 0.981 -8.669 9.048 1.00 1.00 H new ATOM 0 HG22 ILE B 212 0.016 -10.037 8.445 1.00 1.00 H new ATOM 0 HG23 ILE B 212 1.194 -10.288 9.755 1.00 1.00 H new ATOM 0 HD11 ILE B 212 4.504 -7.813 8.811 1.00 1.00 H new ATOM 0 HD12 ILE B 212 3.412 -7.697 7.410 1.00 1.00 H new ATOM 0 HD13 ILE B 212 2.744 -7.713 9.059 1.00 1.00 H new ATOM 1480 N LEU B 213 -0.121 -12.481 7.844 1.00 1.00 N ATOM 1481 CA LEU B 213 -1.462 -12.919 7.459 1.00 1.00 C ATOM 1482 C LEU B 213 -2.486 -11.878 7.869 1.00 1.00 C ATOM 1483 O LEU B 213 -2.512 -11.440 9.019 1.00 1.00 O ATOM 1484 CB LEU B 213 -1.791 -14.263 8.133 1.00 1.00 C ATOM 1485 CG LEU B 213 -1.190 -15.410 7.329 1.00 1.00 C ATOM 1486 CD1 LEU B 213 0.335 -15.278 7.303 1.00 1.00 C ATOM 1487 CD2 LEU B 213 -1.584 -16.742 7.969 1.00 1.00 C ATOM 0 H LEU B 213 0.100 -12.621 8.830 1.00 1.00 H new ATOM 0 HA LEU B 213 -1.493 -13.044 6.377 1.00 1.00 H new ATOM 0 HB2 LEU B 213 -1.398 -14.275 9.150 1.00 1.00 H new ATOM 0 HB3 LEU B 213 -2.871 -14.387 8.208 1.00 1.00 H new ATOM 0 HG LEU B 213 -1.569 -15.375 6.307 1.00 1.00 H new ATOM 0 HD11 LEU B 213 0.762 -16.100 6.727 1.00 1.00 H new ATOM 0 HD12 LEU B 213 0.610 -14.330 6.841 1.00 1.00 H new ATOM 0 HD13 LEU B 213 0.720 -15.310 8.322 1.00 1.00 H new ATOM 0 HD21 LEU B 213 -1.155 -17.563 7.395 1.00 1.00 H new ATOM 0 HD22 LEU B 213 -1.209 -16.779 8.992 1.00 1.00 H new ATOM 0 HD23 LEU B 213 -2.670 -16.834 7.978 1.00 1.00 H new ATOM 1499 N LEU B 214 -3.323 -11.479 6.914 1.00 1.00 N ATOM 1500 CA LEU B 214 -4.354 -10.478 7.170 1.00 1.00 C ATOM 1501 C LEU B 214 -5.731 -11.024 6.809 1.00 1.00 C ATOM 1502 O LEU B 214 -5.911 -11.627 5.752 1.00 1.00 O ATOM 1503 CB LEU B 214 -4.076 -9.217 6.347 1.00 1.00 C ATOM 1504 CG LEU B 214 -5.050 -8.101 6.758 1.00 1.00 C ATOM 1505 CD1 LEU B 214 -4.815 -7.690 8.228 1.00 1.00 C ATOM 1506 CD2 LEU B 214 -4.846 -6.891 5.840 1.00 1.00 C ATOM 0 H LEU B 214 -3.307 -11.833 5.958 1.00 1.00 H new ATOM 0 HA LEU B 214 -4.337 -10.232 8.232 1.00 1.00 H new ATOM 0 HB2 LEU B 214 -3.048 -8.890 6.502 1.00 1.00 H new ATOM 0 HB3 LEU B 214 -4.185 -9.434 5.284 1.00 1.00 H new ATOM 0 HG LEU B 214 -6.072 -8.468 6.663 1.00 1.00 H new ATOM 0 HD11 LEU B 214 -5.514 -6.899 8.501 1.00 1.00 H new ATOM 0 HD12 LEU B 214 -4.972 -8.552 8.876 1.00 1.00 H new ATOM 0 HD13 LEU B 214 -3.794 -7.328 8.346 1.00 1.00 H new ATOM 0 HD21 LEU B 214 -5.535 -6.096 6.127 1.00 1.00 H new ATOM 0 HD22 LEU B 214 -3.820 -6.533 5.932 1.00 1.00 H new ATOM 0 HD23 LEU B 214 -5.038 -7.182 4.807 1.00 1.00 H new ATOM 1518 N ASP B 215 -6.702 -10.802 7.693 1.00 1.00 N ATOM 1519 CA ASP B 215 -8.070 -11.264 7.462 1.00 1.00 C ATOM 1520 C ASP B 215 -8.967 -10.102 7.054 1.00 1.00 C ATOM 1521 O ASP B 215 -9.267 -9.222 7.860 1.00 1.00 O ATOM 1522 CB ASP B 215 -8.618 -11.909 8.730 1.00 1.00 C ATOM 1523 CG ASP B 215 -8.633 -10.899 9.873 1.00 1.00 C ATOM 1524 OD1 ASP B 215 -9.265 -11.184 10.877 1.00 1.00 O ATOM 1525 OD2 ASP B 215 -8.009 -9.860 9.731 1.00 1.00 O ATOM 0 H ASP B 215 -6.568 -10.306 8.574 1.00 1.00 H new ATOM 0 HA ASP B 215 -8.056 -11.997 6.655 1.00 1.00 H new ATOM 0 HB2 ASP B 215 -9.627 -12.280 8.551 1.00 1.00 H new ATOM 0 HB3 ASP B 215 -8.006 -12.768 9.003 1.00 1.00 H new ATOM 1531 N LEU B 216 -9.397 -10.106 5.796 1.00 1.00 N ATOM 1532 CA LEU B 216 -10.267 -9.049 5.276 1.00 1.00 C ATOM 1533 C LEU B 216 -11.623 -9.611 4.897 1.00 1.00 C ATOM 1534 O LEU B 216 -11.710 -10.683 4.298 1.00 1.00 O ATOM 1535 CB LEU B 216 -9.625 -8.407 4.042 1.00 1.00 C ATOM 1536 CG LEU B 216 -8.458 -7.507 4.475 1.00 1.00 C ATOM 1537 CD1 LEU B 216 -7.592 -7.162 3.252 1.00 1.00 C ATOM 1538 CD2 LEU B 216 -8.986 -6.203 5.121 1.00 1.00 C ATOM 0 H LEU B 216 -9.159 -10.828 5.116 1.00 1.00 H new ATOM 0 HA LEU B 216 -10.399 -8.299 6.056 1.00 1.00 H new ATOM 0 HB2 LEU B 216 -9.268 -9.180 3.362 1.00 1.00 H new ATOM 0 HB3 LEU B 216 -10.366 -7.822 3.498 1.00 1.00 H new ATOM 0 HG LEU B 216 -7.859 -8.043 5.211 1.00 1.00 H new ATOM 0 HD11 LEU B 216 -6.764 -6.523 3.561 1.00 1.00 H new ATOM 0 HD12 LEU B 216 -7.199 -8.079 2.814 1.00 1.00 H new ATOM 0 HD13 LEU B 216 -8.198 -6.638 2.513 1.00 1.00 H new ATOM 0 HD21 LEU B 216 -8.144 -5.579 5.421 1.00 1.00 H new ATOM 0 HD22 LEU B 216 -9.600 -5.663 4.400 1.00 1.00 H new ATOM 0 HD23 LEU B 216 -9.586 -6.448 5.997 1.00 1.00 H new ATOM 1550 N SER B 217 -12.672 -8.879 5.268 1.00 1.00 N ATOM 1551 CA SER B 217 -14.038 -9.294 4.972 1.00 1.00 C ATOM 1552 C SER B 217 -14.170 -9.647 3.488 1.00 1.00 C ATOM 1553 O SER B 217 -13.189 -9.939 2.810 1.00 1.00 O ATOM 1554 CB SER B 217 -15.027 -8.172 5.342 1.00 1.00 C ATOM 1555 OG SER B 217 -16.147 -8.743 6.010 1.00 1.00 O ATOM 0 H SER B 217 -12.600 -7.996 5.774 1.00 1.00 H new ATOM 0 HA SER B 217 -14.274 -10.177 5.566 1.00 1.00 H new ATOM 0 HB2 SER B 217 -14.540 -7.438 5.984 1.00 1.00 H new ATOM 0 HB3 SER B 217 -15.352 -7.646 4.445 1.00 1.00 H new ATOM 0 HG SER B 217 -16.780 -8.035 6.250 1.00 1.00 H new ATOM 1561 N ASN B 218 -15.392 -9.591 2.979 1.00 1.00 N ATOM 1562 CA ASN B 218 -15.643 -9.888 1.566 1.00 1.00 C ATOM 1563 C ASN B 218 -16.048 -8.627 0.810 1.00 1.00 C ATOM 1564 O ASN B 218 -15.643 -8.425 -0.335 1.00 1.00 O ATOM 1565 CB ASN B 218 -16.753 -10.932 1.459 1.00 1.00 C ATOM 1566 CG ASN B 218 -16.276 -12.256 2.049 1.00 1.00 C ATOM 1567 OD1 ASN B 218 -15.172 -12.711 1.743 1.00 1.00 O ATOM 1568 ND2 ASN B 218 -17.041 -12.900 2.886 1.00 1.00 N ATOM 0 H ASN B 218 -16.224 -9.345 3.515 1.00 1.00 H new ATOM 0 HA ASN B 218 -14.726 -10.275 1.121 1.00 1.00 H new ATOM 0 HB2 ASN B 218 -17.642 -10.587 1.988 1.00 1.00 H new ATOM 0 HB3 ASN B 218 -17.036 -11.069 0.415 1.00 1.00 H new ATOM 0 HD21 ASN B 218 -16.726 -13.782 3.289 1.00 1.00 H new ATOM 0 HD22 ASN B 218 -17.954 -12.521 3.137 1.00 1.00 H new ATOM 1575 N GLU B 219 -16.839 -7.779 1.454 1.00 1.00 N ATOM 1576 CA GLU B 219 -17.283 -6.540 0.827 1.00 1.00 C ATOM 1577 C GLU B 219 -16.108 -5.594 0.613 1.00 1.00 C ATOM 1578 O GLU B 219 -16.085 -4.832 -0.350 1.00 1.00 O ATOM 1579 CB GLU B 219 -18.343 -5.862 1.697 1.00 1.00 C ATOM 1580 CG GLU B 219 -19.620 -6.705 1.698 1.00 1.00 C ATOM 1581 CD GLU B 219 -20.648 -6.091 2.641 1.00 1.00 C ATOM 1582 OE1 GLU B 219 -21.727 -6.649 2.753 1.00 1.00 O ATOM 1583 OE2 GLU B 219 -20.343 -5.072 3.238 1.00 1.00 O ATOM 0 H GLU B 219 -17.184 -7.924 2.403 1.00 1.00 H new ATOM 0 HA GLU B 219 -17.716 -6.782 -0.144 1.00 1.00 H new ATOM 0 HB2 GLU B 219 -17.972 -5.744 2.715 1.00 1.00 H new ATOM 0 HB3 GLU B 219 -18.555 -4.862 1.317 1.00 1.00 H new ATOM 0 HG2 GLU B 219 -20.028 -6.763 0.689 1.00 1.00 H new ATOM 0 HG3 GLU B 219 -19.392 -7.725 2.009 1.00 1.00 H new ATOM 1591 N VAL B 220 -15.132 -5.656 1.510 1.00 1.00 N ATOM 1592 CA VAL B 220 -13.947 -4.807 1.404 1.00 1.00 C ATOM 1593 C VAL B 220 -13.099 -5.207 0.198 1.00 1.00 C ATOM 1594 O VAL B 220 -12.609 -4.351 -0.538 1.00 1.00 O ATOM 1595 CB VAL B 220 -13.115 -4.913 2.687 1.00 1.00 C ATOM 1596 CG1 VAL B 220 -11.807 -4.132 2.521 1.00 1.00 C ATOM 1597 CG2 VAL B 220 -13.912 -4.337 3.860 1.00 1.00 C ATOM 0 H VAL B 220 -15.135 -6.281 2.316 1.00 1.00 H new ATOM 0 HA VAL B 220 -14.272 -3.775 1.268 1.00 1.00 H new ATOM 0 HB VAL B 220 -12.885 -5.960 2.883 1.00 1.00 H new ATOM 0 HG11 VAL B 220 -11.218 -4.210 3.435 1.00 1.00 H new ATOM 0 HG12 VAL B 220 -11.239 -4.546 1.688 1.00 1.00 H new ATOM 0 HG13 VAL B 220 -12.032 -3.084 2.322 1.00 1.00 H new ATOM 0 HG21 VAL B 220 -13.321 -4.412 4.773 1.00 1.00 H new ATOM 0 HG22 VAL B 220 -14.144 -3.290 3.663 1.00 1.00 H new ATOM 0 HG23 VAL B 220 -14.839 -4.898 3.981 1.00 1.00 H new ATOM 1607 N ILE B 221 -12.929 -6.508 0.002 1.00 1.00 N ATOM 1608 CA ILE B 221 -12.135 -7.003 -1.116 1.00 1.00 C ATOM 1609 C ILE B 221 -12.675 -6.431 -2.421 1.00 1.00 C ATOM 1610 O ILE B 221 -11.911 -6.093 -3.325 1.00 1.00 O ATOM 1611 CB ILE B 221 -12.183 -8.536 -1.151 1.00 1.00 C ATOM 1612 CG1 ILE B 221 -11.474 -9.096 0.088 1.00 1.00 C ATOM 1613 CG2 ILE B 221 -11.475 -9.048 -2.411 1.00 1.00 C ATOM 1614 CD1 ILE B 221 -11.712 -10.606 0.185 1.00 1.00 C ATOM 0 H ILE B 221 -13.326 -7.235 0.597 1.00 1.00 H new ATOM 0 HA ILE B 221 -11.099 -6.687 -0.991 1.00 1.00 H new ATOM 0 HB ILE B 221 -13.223 -8.863 -1.161 1.00 1.00 H new ATOM 0 HG12 ILE B 221 -10.405 -8.890 0.031 1.00 1.00 H new ATOM 0 HG13 ILE B 221 -11.846 -8.602 0.985 1.00 1.00 H new ATOM 0 HG21 ILE B 221 -11.512 -10.137 -2.432 1.00 1.00 H new ATOM 0 HG22 ILE B 221 -11.974 -8.651 -3.295 1.00 1.00 H new ATOM 0 HG23 ILE B 221 -10.436 -8.720 -2.403 1.00 1.00 H new ATOM 0 HD11 ILE B 221 -11.206 -10.998 1.067 1.00 1.00 H new ATOM 0 HD12 ILE B 221 -12.781 -10.801 0.263 1.00 1.00 H new ATOM 0 HD13 ILE B 221 -11.318 -11.094 -0.706 1.00 1.00 H new ATOM 1626 N LYS B 222 -13.997 -6.322 -2.510 1.00 1.00 N ATOM 1627 CA LYS B 222 -14.626 -5.771 -3.700 1.00 1.00 C ATOM 1628 C LYS B 222 -14.228 -4.308 -3.882 1.00 1.00 C ATOM 1629 O LYS B 222 -13.990 -3.852 -5.001 1.00 1.00 O ATOM 1630 CB LYS B 222 -16.148 -5.885 -3.592 1.00 1.00 C ATOM 1631 CG LYS B 222 -16.546 -7.363 -3.609 1.00 1.00 C ATOM 1632 CD LYS B 222 -18.063 -7.485 -3.467 1.00 1.00 C ATOM 1633 CE LYS B 222 -18.465 -8.960 -3.522 1.00 1.00 C ATOM 1634 NZ LYS B 222 -17.928 -9.666 -2.324 1.00 1.00 N ATOM 0 H LYS B 222 -14.647 -6.606 -1.777 1.00 1.00 H new ATOM 0 HA LYS B 222 -14.287 -6.339 -4.566 1.00 1.00 H new ATOM 0 HB2 LYS B 222 -16.495 -5.413 -2.673 1.00 1.00 H new ATOM 0 HB3 LYS B 222 -16.623 -5.359 -4.420 1.00 1.00 H new ATOM 0 HG2 LYS B 222 -16.219 -7.828 -4.539 1.00 1.00 H new ATOM 0 HG3 LYS B 222 -16.050 -7.893 -2.796 1.00 1.00 H new ATOM 0 HD2 LYS B 222 -18.387 -7.044 -2.524 1.00 1.00 H new ATOM 0 HD3 LYS B 222 -18.559 -6.932 -4.265 1.00 1.00 H new ATOM 0 HE2 LYS B 222 -19.551 -9.051 -3.555 1.00 1.00 H new ATOM 0 HE3 LYS B 222 -18.079 -9.420 -4.432 1.00 1.00 H new ATOM 0 HZ1 LYS B 222 -18.690 -10.211 -1.872 1.00 1.00 H new ATOM 0 HZ2 LYS B 222 -17.165 -10.311 -2.614 1.00 1.00 H new ATOM 0 HZ3 LYS B 222 -17.554 -8.969 -1.649 1.00 1.00 H new ATOM 1648 N GLN B 223 -14.159 -3.575 -2.768 1.00 1.00 N ATOM 1649 CA GLN B 223 -13.792 -2.169 -2.815 1.00 1.00 C ATOM 1650 C GLN B 223 -12.364 -2.015 -3.327 1.00 1.00 C ATOM 1651 O GLN B 223 -12.092 -1.199 -4.204 1.00 1.00 O ATOM 1652 CB GLN B 223 -13.905 -1.559 -1.412 1.00 1.00 C ATOM 1653 CG GLN B 223 -15.355 -1.604 -0.949 1.00 1.00 C ATOM 1654 CD GLN B 223 -15.481 -1.009 0.450 1.00 1.00 C ATOM 1655 OE1 GLN B 223 -14.906 -1.531 1.404 1.00 1.00 O ATOM 1656 NE2 GLN B 223 -16.210 0.059 0.629 1.00 1.00 N ATOM 0 H GLN B 223 -14.352 -3.933 -1.833 1.00 1.00 H new ATOM 0 HA GLN B 223 -14.469 -1.649 -3.493 1.00 1.00 H new ATOM 0 HB2 GLN B 223 -13.273 -2.108 -0.714 1.00 1.00 H new ATOM 0 HB3 GLN B 223 -13.548 -0.529 -1.423 1.00 1.00 H new ATOM 0 HG2 GLN B 223 -15.984 -1.050 -1.646 1.00 1.00 H new ATOM 0 HG3 GLN B 223 -15.712 -2.634 -0.947 1.00 1.00 H new ATOM 0 HE21 GLN B 223 -16.686 0.490 -0.163 1.00 1.00 H new ATOM 0 HE22 GLN B 223 -16.304 0.462 1.561 1.00 1.00 H new ATOM 1665 N LEU B 224 -11.455 -2.811 -2.777 1.00 1.00 N ATOM 1666 CA LEU B 224 -10.057 -2.753 -3.187 1.00 1.00 C ATOM 1667 C LEU B 224 -9.911 -3.136 -4.654 1.00 1.00 C ATOM 1668 O LEU B 224 -9.161 -2.504 -5.397 1.00 1.00 O ATOM 1669 CB LEU B 224 -9.229 -3.707 -2.313 1.00 1.00 C ATOM 1670 CG LEU B 224 -8.905 -3.041 -0.959 1.00 1.00 C ATOM 1671 CD1 LEU B 224 -8.662 -4.119 0.101 1.00 1.00 C ATOM 1672 CD2 LEU B 224 -7.640 -2.175 -1.089 1.00 1.00 C ATOM 0 H LEU B 224 -11.658 -3.499 -2.052 1.00 1.00 H new ATOM 0 HA LEU B 224 -9.695 -1.733 -3.061 1.00 1.00 H new ATOM 0 HB2 LEU B 224 -9.780 -4.633 -2.149 1.00 1.00 H new ATOM 0 HB3 LEU B 224 -8.305 -3.973 -2.826 1.00 1.00 H new ATOM 0 HG LEU B 224 -9.747 -2.415 -0.664 1.00 1.00 H new ATOM 0 HD11 LEU B 224 -8.433 -3.645 1.056 1.00 1.00 H new ATOM 0 HD12 LEU B 224 -9.556 -4.734 0.206 1.00 1.00 H new ATOM 0 HD13 LEU B 224 -7.824 -4.746 -0.203 1.00 1.00 H new ATOM 0 HD21 LEU B 224 -7.418 -1.709 -0.129 1.00 1.00 H new ATOM 0 HD22 LEU B 224 -6.800 -2.801 -1.391 1.00 1.00 H new ATOM 0 HD23 LEU B 224 -7.804 -1.401 -1.839 1.00 1.00 H new ATOM 1684 N ASP B 225 -10.627 -4.173 -5.061 1.00 1.00 N ATOM 1685 CA ASP B 225 -10.560 -4.631 -6.438 1.00 1.00 C ATOM 1686 C ASP B 225 -11.046 -3.543 -7.387 1.00 1.00 C ATOM 1687 O ASP B 225 -10.434 -3.291 -8.423 1.00 1.00 O ATOM 1688 CB ASP B 225 -11.419 -5.883 -6.611 1.00 1.00 C ATOM 1689 CG ASP B 225 -11.134 -6.527 -7.963 1.00 1.00 C ATOM 1690 OD1 ASP B 225 -11.816 -7.483 -8.296 1.00 1.00 O ATOM 1691 OD2 ASP B 225 -10.239 -6.057 -8.646 1.00 1.00 O ATOM 0 H ASP B 225 -11.256 -4.709 -4.462 1.00 1.00 H new ATOM 0 HA ASP B 225 -9.522 -4.866 -6.675 1.00 1.00 H new ATOM 0 HB2 ASP B 225 -11.209 -6.592 -5.810 1.00 1.00 H new ATOM 0 HB3 ASP B 225 -12.475 -5.623 -6.538 1.00 1.00 H new ATOM 1697 N ASP B 226 -12.151 -2.899 -7.028 1.00 1.00 N ATOM 1698 CA ASP B 226 -12.708 -1.840 -7.862 1.00 1.00 C ATOM 1699 C ASP B 226 -11.717 -0.689 -8.001 1.00 1.00 C ATOM 1700 O ASP B 226 -11.513 -0.160 -9.094 1.00 1.00 O ATOM 1701 CB ASP B 226 -14.013 -1.331 -7.247 1.00 1.00 C ATOM 1702 CG ASP B 226 -14.677 -0.328 -8.185 1.00 1.00 C ATOM 1703 OD1 ASP B 226 -15.789 0.081 -7.893 1.00 1.00 O ATOM 1704 OD2 ASP B 226 -14.065 0.013 -9.184 1.00 1.00 O ATOM 0 H ASP B 226 -12.675 -3.089 -6.174 1.00 1.00 H new ATOM 0 HA ASP B 226 -12.909 -2.246 -8.854 1.00 1.00 H new ATOM 0 HB2 ASP B 226 -14.687 -2.167 -7.060 1.00 1.00 H new ATOM 0 HB3 ASP B 226 -13.812 -0.862 -6.284 1.00 1.00 H new ATOM 1710 N LEU B 227 -11.105 -0.308 -6.888 1.00 1.00 N ATOM 1711 CA LEU B 227 -10.133 0.775 -6.889 1.00 1.00 C ATOM 1712 C LEU B 227 -8.822 0.318 -7.514 1.00 1.00 C ATOM 1713 O LEU B 227 -8.085 1.122 -8.080 1.00 1.00 O ATOM 1714 CB LEU B 227 -9.888 1.273 -5.452 1.00 1.00 C ATOM 1715 CG LEU B 227 -10.973 2.288 -5.036 1.00 1.00 C ATOM 1716 CD1 LEU B 227 -12.235 1.555 -4.584 1.00 1.00 C ATOM 1717 CD2 LEU B 227 -10.449 3.152 -3.886 1.00 1.00 C ATOM 0 H LEU B 227 -11.265 -0.733 -5.974 1.00 1.00 H new ATOM 0 HA LEU B 227 -10.534 1.596 -7.484 1.00 1.00 H new ATOM 0 HB2 LEU B 227 -9.890 0.428 -4.763 1.00 1.00 H new ATOM 0 HB3 LEU B 227 -8.904 1.737 -5.385 1.00 1.00 H new ATOM 0 HG LEU B 227 -11.215 2.919 -5.891 1.00 1.00 H new ATOM 0 HD11 LEU B 227 -12.993 2.282 -4.293 1.00 1.00 H new ATOM 0 HD12 LEU B 227 -12.614 0.944 -5.403 1.00 1.00 H new ATOM 0 HD13 LEU B 227 -11.999 0.916 -3.733 1.00 1.00 H new ATOM 0 HD21 LEU B 227 -11.215 3.869 -3.592 1.00 1.00 H new ATOM 0 HD22 LEU B 227 -10.202 2.516 -3.036 1.00 1.00 H new ATOM 0 HD23 LEU B 227 -9.556 3.687 -4.210 1.00 1.00 H new ATOM 1729 N GLU B 228 -8.537 -0.970 -7.401 1.00 1.00 N ATOM 1730 CA GLU B 228 -7.310 -1.514 -7.951 1.00 1.00 C ATOM 1731 C GLU B 228 -7.330 -1.489 -9.473 1.00 1.00 C ATOM 1732 O GLU B 228 -6.316 -1.216 -10.114 1.00 1.00 O ATOM 1733 CB GLU B 228 -7.124 -2.949 -7.464 1.00 1.00 C ATOM 1734 CG GLU B 228 -5.823 -3.517 -8.034 1.00 1.00 C ATOM 1735 CD GLU B 228 -6.048 -4.060 -9.443 1.00 1.00 C ATOM 1736 OE1 GLU B 228 -5.209 -3.814 -10.294 1.00 1.00 O ATOM 1737 OE2 GLU B 228 -7.055 -4.718 -9.648 1.00 1.00 O ATOM 0 H GLU B 228 -9.136 -1.653 -6.936 1.00 1.00 H new ATOM 0 HA GLU B 228 -6.479 -0.896 -7.611 1.00 1.00 H new ATOM 0 HB2 GLU B 228 -7.098 -2.974 -6.375 1.00 1.00 H new ATOM 0 HB3 GLU B 228 -7.969 -3.563 -7.777 1.00 1.00 H new ATOM 0 HG2 GLU B 228 -5.059 -2.740 -8.055 1.00 1.00 H new ATOM 0 HG3 GLU B 228 -5.452 -4.312 -7.387 1.00 1.00 H new ATOM 1745 N VAL B 229 -8.487 -1.781 -10.045 1.00 1.00 N ATOM 1746 CA VAL B 229 -8.625 -1.797 -11.497 1.00 1.00 C ATOM 1747 C VAL B 229 -8.320 -0.421 -12.080 1.00 1.00 C ATOM 1748 O VAL B 229 -7.623 -0.307 -13.089 1.00 1.00 O ATOM 1749 CB VAL B 229 -10.051 -2.219 -11.884 1.00 1.00 C ATOM 1750 CG1 VAL B 229 -10.264 -2.017 -13.391 1.00 1.00 C ATOM 1751 CG2 VAL B 229 -10.270 -3.698 -11.532 1.00 1.00 C ATOM 0 H VAL B 229 -9.339 -2.009 -9.533 1.00 1.00 H new ATOM 0 HA VAL B 229 -7.913 -2.515 -11.903 1.00 1.00 H new ATOM 0 HB VAL B 229 -10.764 -1.606 -11.332 1.00 1.00 H new ATOM 0 HG11 VAL B 229 -11.277 -2.318 -13.659 1.00 1.00 H new ATOM 0 HG12 VAL B 229 -10.120 -0.966 -13.641 1.00 1.00 H new ATOM 0 HG13 VAL B 229 -9.547 -2.623 -13.944 1.00 1.00 H new ATOM 0 HG21 VAL B 229 -11.283 -3.992 -11.809 1.00 1.00 H new ATOM 0 HG22 VAL B 229 -9.553 -4.312 -12.077 1.00 1.00 H new ATOM 0 HG23 VAL B 229 -10.130 -3.842 -10.461 1.00 1.00 H new ATOM 1761 N GLN B 230 -8.846 0.618 -11.447 1.00 1.00 N ATOM 1762 CA GLN B 230 -8.615 1.976 -11.920 1.00 1.00 C ATOM 1763 C GLN B 230 -7.141 2.347 -11.789 1.00 1.00 C ATOM 1764 O GLN B 230 -6.564 2.963 -12.684 1.00 1.00 O ATOM 1765 CB GLN B 230 -9.472 2.956 -11.116 1.00 1.00 C ATOM 1766 CG GLN B 230 -10.950 2.725 -11.441 1.00 1.00 C ATOM 1767 CD GLN B 230 -11.820 3.660 -10.607 1.00 1.00 C ATOM 1768 OE1 GLN B 230 -11.523 3.910 -9.438 1.00 1.00 O ATOM 1769 NE2 GLN B 230 -12.880 4.201 -11.144 1.00 1.00 N ATOM 0 H GLN B 230 -9.430 0.549 -10.613 1.00 1.00 H new ATOM 0 HA GLN B 230 -8.893 2.031 -12.972 1.00 1.00 H new ATOM 0 HB2 GLN B 230 -9.297 2.818 -10.049 1.00 1.00 H new ATOM 0 HB3 GLN B 230 -9.192 3.982 -11.355 1.00 1.00 H new ATOM 0 HG2 GLN B 230 -11.129 2.898 -12.502 1.00 1.00 H new ATOM 0 HG3 GLN B 230 -11.218 1.688 -11.238 1.00 1.00 H new ATOM 0 HE21 GLN B 230 -13.124 3.993 -12.112 1.00 1.00 H new ATOM 0 HE22 GLN B 230 -13.464 4.832 -10.595 1.00 1.00 H new ATOM 1778 N ARG B 231 -6.539 1.966 -10.669 1.00 1.00 N ATOM 1779 CA ARG B 231 -5.132 2.258 -10.427 1.00 1.00 C ATOM 1780 C ARG B 231 -4.247 1.409 -11.325 1.00 1.00 C ATOM 1781 O ARG B 231 -3.146 1.817 -11.698 1.00 1.00 O ATOM 1782 CB ARG B 231 -4.792 1.996 -8.959 1.00 1.00 C ATOM 1783 CG ARG B 231 -5.515 3.029 -8.056 1.00 1.00 C ATOM 1784 CD ARG B 231 -4.590 4.213 -7.753 1.00 1.00 C ATOM 1785 NE ARG B 231 -4.276 4.933 -8.982 1.00 1.00 N ATOM 1786 CZ ARG B 231 -3.190 5.692 -9.076 1.00 1.00 C ATOM 1787 NH1 ARG B 231 -2.380 5.795 -8.061 1.00 1.00 N ATOM 1788 NH2 ARG B 231 -2.933 6.329 -10.186 1.00 1.00 N ATOM 0 H ARG B 231 -7.001 1.456 -9.916 1.00 1.00 H new ATOM 0 HA ARG B 231 -4.950 3.308 -10.656 1.00 1.00 H new ATOM 0 HB2 ARG B 231 -5.092 0.985 -8.682 1.00 1.00 H new ATOM 0 HB3 ARG B 231 -3.714 2.061 -8.809 1.00 1.00 H new ATOM 0 HG2 ARG B 231 -6.420 3.383 -8.550 1.00 1.00 H new ATOM 0 HG3 ARG B 231 -5.825 2.554 -7.125 1.00 1.00 H new ATOM 0 HD2 ARG B 231 -5.069 4.885 -7.041 1.00 1.00 H new ATOM 0 HD3 ARG B 231 -3.672 3.857 -7.287 1.00 1.00 H new ATOM 0 HE ARG B 231 -4.902 4.852 -9.784 1.00 1.00 H new ATOM 0 HH11 ARG B 231 -2.580 5.293 -7.196 1.00 1.00 H new ATOM 0 HH12 ARG B 231 -1.546 6.377 -8.131 1.00 1.00 H new ATOM 0 HH21 ARG B 231 -3.566 6.244 -10.981 1.00 1.00 H new ATOM 0 HH22 ARG B 231 -2.099 6.912 -10.258 1.00 1.00 H new ATOM 1802 N ASN B 232 -4.735 0.222 -11.661 1.00 1.00 N ATOM 1803 CA ASN B 232 -3.984 -0.688 -12.509 1.00 1.00 C ATOM 1804 C ASN B 232 -2.666 -1.053 -11.853 1.00 1.00 C ATOM 1805 O ASN B 232 -1.619 -1.043 -12.497 1.00 1.00 O ATOM 1806 CB ASN B 232 -3.715 -0.038 -13.868 1.00 1.00 C ATOM 1807 CG ASN B 232 -3.277 -1.097 -14.875 1.00 1.00 C ATOM 1808 OD1 ASN B 232 -4.158 -1.608 -15.690 1.00 1.00 O flip ATOM 1809 ND2 ASN B 232 -2.103 -1.464 -14.922 1.00 1.00 N flip ATOM 0 H ASN B 232 -5.644 -0.130 -11.360 1.00 1.00 H new ATOM 0 HA ASN B 232 -4.574 -1.593 -12.652 1.00 1.00 H new ATOM 0 HB2 ASN B 232 -4.614 0.465 -14.224 1.00 1.00 H new ATOM 0 HB3 ASN B 232 -2.942 0.724 -13.769 1.00 1.00 H new ATOM 0 HD21 ASN B 232 -1.417 -1.062 -14.283 1.00 1.00 H new ATOM 0 HD22 ASN B 232 -1.816 -2.170 -15.600 1.00 1.00 H new ATOM 1816 N LEU B 233 -2.719 -1.371 -10.560 1.00 1.00 N ATOM 1817 CA LEU B 233 -1.503 -1.731 -9.823 1.00 1.00 C ATOM 1818 C LEU B 233 -1.762 -2.905 -8.880 1.00 1.00 C ATOM 1819 O LEU B 233 -2.886 -3.115 -8.438 1.00 1.00 O ATOM 1820 CB LEU B 233 -1.017 -0.519 -9.016 1.00 1.00 C ATOM 1821 CG LEU B 233 -0.263 0.458 -9.941 1.00 1.00 C ATOM 1822 CD1 LEU B 233 -0.302 1.865 -9.344 1.00 1.00 C ATOM 1823 CD2 LEU B 233 1.205 0.022 -10.112 1.00 1.00 C ATOM 0 H LEU B 233 -3.575 -1.388 -10.006 1.00 1.00 H new ATOM 0 HA LEU B 233 -0.739 -2.030 -10.541 1.00 1.00 H new ATOM 0 HB2 LEU B 233 -1.866 -0.015 -8.554 1.00 1.00 H new ATOM 0 HB3 LEU B 233 -0.363 -0.847 -8.208 1.00 1.00 H new ATOM 0 HG LEU B 233 -0.749 0.454 -10.917 1.00 1.00 H new ATOM 0 HD11 LEU B 233 0.231 2.553 -10.000 1.00 1.00 H new ATOM 0 HD12 LEU B 233 -1.338 2.189 -9.243 1.00 1.00 H new ATOM 0 HD13 LEU B 233 0.173 1.857 -8.363 1.00 1.00 H new ATOM 0 HD21 LEU B 233 1.719 0.724 -10.768 1.00 1.00 H new ATOM 0 HD22 LEU B 233 1.696 0.008 -9.139 1.00 1.00 H new ATOM 0 HD23 LEU B 233 1.240 -0.975 -10.550 1.00 1.00 H new ATOM 1835 N PRO B 234 -0.746 -3.662 -8.558 1.00 1.00 N ATOM 1836 CA PRO B 234 -0.883 -4.826 -7.634 1.00 1.00 C ATOM 1837 C PRO B 234 -1.396 -4.405 -6.255 1.00 1.00 C ATOM 1838 O PRO B 234 -1.060 -3.333 -5.755 1.00 1.00 O ATOM 1839 CB PRO B 234 0.551 -5.401 -7.552 1.00 1.00 C ATOM 1840 CG PRO B 234 1.450 -4.301 -8.029 1.00 1.00 C ATOM 1841 CD PRO B 234 0.638 -3.507 -9.039 1.00 1.00 C ATOM 0 HA PRO B 234 -1.611 -5.554 -7.991 1.00 1.00 H new ATOM 0 HB2 PRO B 234 0.798 -5.696 -6.532 1.00 1.00 H new ATOM 0 HB3 PRO B 234 0.654 -6.290 -8.174 1.00 1.00 H new ATOM 0 HG2 PRO B 234 1.767 -3.669 -7.200 1.00 1.00 H new ATOM 0 HG3 PRO B 234 2.353 -4.705 -8.486 1.00 1.00 H new ATOM 0 HD2 PRO B 234 0.940 -2.460 -9.064 1.00 1.00 H new ATOM 0 HD3 PRO B 234 0.759 -3.898 -10.049 1.00 1.00 H new ATOM 1849 N ARG B 235 -2.212 -5.259 -5.645 1.00 1.00 N ATOM 1850 CA ARG B 235 -2.762 -4.968 -4.328 1.00 1.00 C ATOM 1851 C ARG B 235 -1.641 -4.757 -3.320 1.00 1.00 C ATOM 1852 O ARG B 235 -1.702 -3.851 -2.489 1.00 1.00 O ATOM 1853 CB ARG B 235 -3.650 -6.130 -3.880 1.00 1.00 C ATOM 1854 CG ARG B 235 -2.804 -7.389 -3.663 1.00 1.00 C ATOM 1855 CD ARG B 235 -3.722 -8.586 -3.411 1.00 1.00 C ATOM 1856 NE ARG B 235 -2.921 -9.783 -3.177 1.00 1.00 N ATOM 1857 CZ ARG B 235 -2.482 -10.527 -4.190 1.00 1.00 C ATOM 1858 NH1 ARG B 235 -2.763 -10.187 -5.418 1.00 1.00 N ATOM 1859 NH2 ARG B 235 -1.766 -11.593 -3.955 1.00 1.00 N ATOM 0 H ARG B 235 -2.505 -6.153 -6.040 1.00 1.00 H new ATOM 0 HA ARG B 235 -3.355 -4.055 -4.385 1.00 1.00 H new ATOM 0 HB2 ARG B 235 -4.167 -5.867 -2.957 1.00 1.00 H new ATOM 0 HB3 ARG B 235 -4.416 -6.323 -4.631 1.00 1.00 H new ATOM 0 HG2 ARG B 235 -2.179 -7.575 -4.537 1.00 1.00 H new ATOM 0 HG3 ARG B 235 -2.133 -7.247 -2.816 1.00 1.00 H new ATOM 0 HD2 ARG B 235 -4.361 -8.391 -2.550 1.00 1.00 H new ATOM 0 HD3 ARG B 235 -4.379 -8.739 -4.267 1.00 1.00 H new ATOM 0 HE ARG B 235 -2.693 -10.054 -2.220 1.00 1.00 H new ATOM 0 HH11 ARG B 235 -3.319 -9.352 -5.601 1.00 1.00 H new ATOM 0 HH12 ARG B 235 -2.427 -10.757 -6.195 1.00 1.00 H new ATOM 0 HH21 ARG B 235 -1.543 -11.856 -2.995 1.00 1.00 H new ATOM 0 HH22 ARG B 235 -1.430 -12.163 -4.731 1.00 1.00 H new ATOM 1873 N ALA B 236 -0.620 -5.600 -3.392 1.00 1.00 N ATOM 1874 CA ALA B 236 0.503 -5.496 -2.471 1.00 1.00 C ATOM 1875 C ALA B 236 1.016 -4.064 -2.430 1.00 1.00 C ATOM 1876 O ALA B 236 1.375 -3.557 -1.367 1.00 1.00 O ATOM 1877 CB ALA B 236 1.632 -6.432 -2.914 1.00 1.00 C ATOM 0 H ALA B 236 -0.546 -6.357 -4.072 1.00 1.00 H new ATOM 0 HA ALA B 236 0.166 -5.784 -1.475 1.00 1.00 H new ATOM 0 HB1 ALA B 236 2.468 -6.348 -2.220 1.00 1.00 H new ATOM 0 HB2 ALA B 236 1.270 -7.460 -2.923 1.00 1.00 H new ATOM 0 HB3 ALA B 236 1.963 -6.155 -3.915 1.00 1.00 H new ATOM 1883 N ASP B 237 1.042 -3.411 -3.587 1.00 1.00 N ATOM 1884 CA ASP B 237 1.509 -2.034 -3.656 1.00 1.00 C ATOM 1885 C ASP B 237 0.498 -1.101 -2.983 1.00 1.00 C ATOM 1886 O ASP B 237 0.875 -0.173 -2.269 1.00 1.00 O ATOM 1887 CB ASP B 237 1.701 -1.625 -5.125 1.00 1.00 C ATOM 1888 CG ASP B 237 3.072 -2.079 -5.623 1.00 1.00 C ATOM 1889 OD1 ASP B 237 3.716 -2.836 -4.915 1.00 1.00 O ATOM 1890 OD2 ASP B 237 3.455 -1.667 -6.705 1.00 1.00 O ATOM 0 H ASP B 237 0.749 -3.809 -4.479 1.00 1.00 H new ATOM 0 HA ASP B 237 2.462 -1.955 -3.134 1.00 1.00 H new ATOM 0 HB2 ASP B 237 0.917 -2.069 -5.739 1.00 1.00 H new ATOM 0 HB3 ASP B 237 1.610 -0.543 -5.224 1.00 1.00 H new ATOM 1896 N LEU B 238 -0.783 -1.356 -3.220 1.00 1.00 N ATOM 1897 CA LEU B 238 -1.833 -0.527 -2.637 1.00 1.00 C ATOM 1898 C LEU B 238 -1.819 -0.640 -1.120 1.00 1.00 C ATOM 1899 O LEU B 238 -1.958 0.357 -0.413 1.00 1.00 O ATOM 1900 CB LEU B 238 -3.199 -0.961 -3.180 1.00 1.00 C ATOM 1901 CG LEU B 238 -3.283 -0.663 -4.686 1.00 1.00 C ATOM 1902 CD1 LEU B 238 -4.593 -1.232 -5.246 1.00 1.00 C ATOM 1903 CD2 LEU B 238 -3.224 0.859 -4.943 1.00 1.00 C ATOM 0 H LEU B 238 -1.118 -2.121 -3.805 1.00 1.00 H new ATOM 0 HA LEU B 238 -1.650 0.512 -2.910 1.00 1.00 H new ATOM 0 HB2 LEU B 238 -3.349 -2.026 -3.002 1.00 1.00 H new ATOM 0 HB3 LEU B 238 -3.994 -0.435 -2.652 1.00 1.00 H new ATOM 0 HG LEU B 238 -2.435 -1.132 -5.185 1.00 1.00 H new ATOM 0 HD11 LEU B 238 -4.654 -1.022 -6.314 1.00 1.00 H new ATOM 0 HD12 LEU B 238 -4.619 -2.310 -5.087 1.00 1.00 H new ATOM 0 HD13 LEU B 238 -5.438 -0.769 -4.736 1.00 1.00 H new ATOM 0 HD21 LEU B 238 -3.285 1.050 -6.014 1.00 1.00 H new ATOM 0 HD22 LEU B 238 -4.060 1.346 -4.440 1.00 1.00 H new ATOM 0 HD23 LEU B 238 -2.286 1.257 -4.556 1.00 1.00 H new ATOM 1915 N LEU B 239 -1.649 -1.858 -0.629 1.00 1.00 N ATOM 1916 CA LEU B 239 -1.618 -2.091 0.808 1.00 1.00 C ATOM 1917 C LEU B 239 -0.430 -1.382 1.441 1.00 1.00 C ATOM 1918 O LEU B 239 -0.554 -0.775 2.506 1.00 1.00 O ATOM 1919 CB LEU B 239 -1.532 -3.594 1.081 1.00 1.00 C ATOM 1920 CG LEU B 239 -2.854 -4.271 0.684 1.00 1.00 C ATOM 1921 CD1 LEU B 239 -2.673 -5.791 0.713 1.00 1.00 C ATOM 1922 CD2 LEU B 239 -3.988 -3.868 1.654 1.00 1.00 C ATOM 0 H LEU B 239 -1.531 -2.696 -1.199 1.00 1.00 H new ATOM 0 HA LEU B 239 -2.532 -1.692 1.248 1.00 1.00 H new ATOM 0 HB2 LEU B 239 -0.706 -4.029 0.517 1.00 1.00 H new ATOM 0 HB3 LEU B 239 -1.325 -3.770 2.137 1.00 1.00 H new ATOM 0 HG LEU B 239 -3.125 -3.947 -0.321 1.00 1.00 H new ATOM 0 HD11 LEU B 239 -3.609 -6.274 0.432 1.00 1.00 H new ATOM 0 HD12 LEU B 239 -1.891 -6.078 0.010 1.00 1.00 H new ATOM 0 HD13 LEU B 239 -2.390 -6.105 1.718 1.00 1.00 H new ATOM 0 HD21 LEU B 239 -4.914 -4.358 1.355 1.00 1.00 H new ATOM 0 HD22 LEU B 239 -3.726 -4.174 2.667 1.00 1.00 H new ATOM 0 HD23 LEU B 239 -4.124 -2.787 1.626 1.00 1.00 H new ATOM 1934 N ARG B 240 0.717 -1.462 0.783 1.00 1.00 N ATOM 1935 CA ARG B 240 1.923 -0.826 1.294 1.00 1.00 C ATOM 1936 C ARG B 240 1.720 0.680 1.402 1.00 1.00 C ATOM 1937 O ARG B 240 2.122 1.302 2.386 1.00 1.00 O ATOM 1938 CB ARG B 240 3.106 -1.124 0.369 1.00 1.00 C ATOM 1939 CG ARG B 240 4.383 -0.537 0.968 1.00 1.00 C ATOM 1940 CD ARG B 240 5.572 -0.887 0.075 1.00 1.00 C ATOM 1941 NE ARG B 240 5.437 -0.240 -1.225 1.00 1.00 N ATOM 1942 CZ ARG B 240 6.317 -0.462 -2.197 1.00 1.00 C ATOM 1943 NH1 ARG B 240 7.325 -1.265 -1.995 1.00 1.00 N ATOM 1944 NH2 ARG B 240 6.174 0.128 -3.353 1.00 1.00 N ATOM 0 H ARG B 240 0.838 -1.958 -0.100 1.00 1.00 H new ATOM 0 HA ARG B 240 2.135 -1.226 2.285 1.00 1.00 H new ATOM 0 HB2 ARG B 240 3.215 -2.200 0.237 1.00 1.00 H new ATOM 0 HB3 ARG B 240 2.926 -0.698 -0.618 1.00 1.00 H new ATOM 0 HG2 ARG B 240 4.290 0.545 1.060 1.00 1.00 H new ATOM 0 HG3 ARG B 240 4.541 -0.930 1.972 1.00 1.00 H new ATOM 0 HD2 ARG B 240 6.499 -0.570 0.552 1.00 1.00 H new ATOM 0 HD3 ARG B 240 5.633 -1.968 -0.054 1.00 1.00 H new ATOM 0 HE ARG B 240 4.655 0.393 -1.391 1.00 1.00 H new ATOM 0 HH11 ARG B 240 7.439 -1.723 -1.091 1.00 1.00 H new ATOM 0 HH12 ARG B 240 7.999 -1.435 -2.741 1.00 1.00 H new ATOM 0 HH21 ARG B 240 5.388 0.759 -3.510 1.00 1.00 H new ATOM 0 HH22 ARG B 240 6.849 -0.042 -4.099 1.00 1.00 H new ATOM 1958 N GLU B 241 1.091 1.260 0.387 1.00 1.00 N ATOM 1959 CA GLU B 241 0.836 2.697 0.377 1.00 1.00 C ATOM 1960 C GLU B 241 -0.108 3.080 1.512 1.00 1.00 C ATOM 1961 O GLU B 241 0.065 4.117 2.150 1.00 1.00 O ATOM 1962 CB GLU B 241 0.221 3.108 -0.963 1.00 1.00 C ATOM 1963 CG GLU B 241 1.268 2.985 -2.073 1.00 1.00 C ATOM 1964 CD GLU B 241 2.356 4.036 -1.887 1.00 1.00 C ATOM 1965 OE1 GLU B 241 2.088 5.023 -1.221 1.00 1.00 O ATOM 1966 OE2 GLU B 241 3.439 3.840 -2.411 1.00 1.00 O ATOM 0 H GLU B 241 0.750 0.762 -0.435 1.00 1.00 H new ATOM 0 HA GLU B 241 1.783 3.218 0.516 1.00 1.00 H new ATOM 0 HB2 GLU B 241 -0.638 2.476 -1.189 1.00 1.00 H new ATOM 0 HB3 GLU B 241 -0.144 4.133 -0.907 1.00 1.00 H new ATOM 0 HG2 GLU B 241 1.709 1.988 -2.059 1.00 1.00 H new ATOM 0 HG3 GLU B 241 0.794 3.110 -3.046 1.00 1.00 H new ATOM 1974 N ALA B 242 -1.103 2.238 1.761 1.00 1.00 N ATOM 1975 CA ALA B 242 -2.063 2.506 2.824 1.00 1.00 C ATOM 1976 C ALA B 242 -1.364 2.539 4.180 1.00 1.00 C ATOM 1977 O ALA B 242 -1.615 3.425 4.995 1.00 1.00 O ATOM 1978 CB ALA B 242 -3.146 1.426 2.831 1.00 1.00 C ATOM 0 H ALA B 242 -1.266 1.372 1.247 1.00 1.00 H new ATOM 0 HA ALA B 242 -2.521 3.478 2.641 1.00 1.00 H new ATOM 0 HB1 ALA B 242 -3.860 1.632 3.628 1.00 1.00 H new ATOM 0 HB2 ALA B 242 -3.663 1.423 1.872 1.00 1.00 H new ATOM 0 HB3 ALA B 242 -2.687 0.452 2.998 1.00 1.00 H new ATOM 1984 N VAL B 243 -0.484 1.567 4.415 1.00 1.00 N ATOM 1985 CA VAL B 243 0.242 1.507 5.678 1.00 1.00 C ATOM 1986 C VAL B 243 1.230 2.665 5.786 1.00 1.00 C ATOM 1987 O VAL B 243 1.233 3.404 6.771 1.00 1.00 O ATOM 1988 CB VAL B 243 0.995 0.179 5.776 1.00 1.00 C ATOM 1989 CG1 VAL B 243 1.809 0.147 7.070 1.00 1.00 C ATOM 1990 CG2 VAL B 243 -0.008 -0.976 5.775 1.00 1.00 C ATOM 0 H VAL B 243 -0.260 0.821 3.756 1.00 1.00 H new ATOM 0 HA VAL B 243 -0.475 1.583 6.495 1.00 1.00 H new ATOM 0 HB VAL B 243 1.667 0.078 4.923 1.00 1.00 H new ATOM 0 HG11 VAL B 243 2.345 -0.799 7.139 1.00 1.00 H new ATOM 0 HG12 VAL B 243 2.524 0.970 7.071 1.00 1.00 H new ATOM 0 HG13 VAL B 243 1.139 0.248 7.924 1.00 1.00 H new ATOM 0 HG21 VAL B 243 0.527 -1.923 5.845 1.00 1.00 H new ATOM 0 HG22 VAL B 243 -0.680 -0.875 6.627 1.00 1.00 H new ATOM 0 HG23 VAL B 243 -0.587 -0.954 4.852 1.00 1.00 H new ATOM 2000 N ASP B 244 2.068 2.814 4.765 1.00 1.00 N ATOM 2001 CA ASP B 244 3.063 3.879 4.758 1.00 1.00 C ATOM 2002 C ASP B 244 2.391 5.224 4.997 1.00 1.00 C ATOM 2003 O ASP B 244 2.862 6.027 5.800 1.00 1.00 O ATOM 2004 CB ASP B 244 3.790 3.906 3.414 1.00 1.00 C ATOM 2005 CG ASP B 244 4.998 4.835 3.488 1.00 1.00 C ATOM 2006 OD1 ASP B 244 5.832 4.760 2.600 1.00 1.00 O ATOM 2007 OD2 ASP B 244 5.070 5.609 4.428 1.00 1.00 O ATOM 0 H ASP B 244 2.078 2.216 3.939 1.00 1.00 H new ATOM 0 HA ASP B 244 3.783 3.690 5.555 1.00 1.00 H new ATOM 0 HB2 ASP B 244 4.112 2.900 3.146 1.00 1.00 H new ATOM 0 HB3 ASP B 244 3.110 4.243 2.631 1.00 1.00 H new ATOM 2013 N GLN B 245 1.286 5.460 4.303 1.00 1.00 N ATOM 2014 CA GLN B 245 0.557 6.713 4.451 1.00 1.00 C ATOM 2015 C GLN B 245 0.207 6.959 5.918 1.00 1.00 C ATOM 2016 O GLN B 245 0.328 8.078 6.415 1.00 1.00 O ATOM 2017 CB GLN B 245 -0.726 6.666 3.608 1.00 1.00 C ATOM 2018 CG GLN B 245 -0.399 6.984 2.147 1.00 1.00 C ATOM 2019 CD GLN B 245 -0.087 8.468 1.996 1.00 1.00 C ATOM 2020 OE1 GLN B 245 1.082 8.853 1.936 1.00 1.00 O ATOM 2021 NE2 GLN B 245 -1.065 9.330 1.933 1.00 1.00 N ATOM 0 H GLN B 245 0.877 4.806 3.636 1.00 1.00 H new ATOM 0 HA GLN B 245 1.189 7.530 4.104 1.00 1.00 H new ATOM 0 HB2 GLN B 245 -1.184 5.680 3.681 1.00 1.00 H new ATOM 0 HB3 GLN B 245 -1.451 7.383 3.992 1.00 1.00 H new ATOM 0 HG2 GLN B 245 0.453 6.389 1.818 1.00 1.00 H new ATOM 0 HG3 GLN B 245 -1.241 6.714 1.510 1.00 1.00 H new ATOM 0 HE21 GLN B 245 -2.032 9.009 1.983 1.00 1.00 H new ATOM 0 HE22 GLN B 245 -0.862 10.325 1.834 1.00 1.00 H new ATOM 2030 N TYR B 246 -0.230 5.910 6.601 1.00 1.00 N ATOM 2031 CA TYR B 246 -0.597 6.027 8.007 1.00 1.00 C ATOM 2032 C TYR B 246 0.617 6.408 8.850 1.00 1.00 C ATOM 2033 O TYR B 246 0.529 7.246 9.747 1.00 1.00 O ATOM 2034 CB TYR B 246 -1.177 4.706 8.505 1.00 1.00 C ATOM 2035 CG TYR B 246 -1.644 4.866 9.932 1.00 1.00 C ATOM 2036 CD1 TYR B 246 -2.853 5.521 10.203 1.00 1.00 C ATOM 2037 CD2 TYR B 246 -0.870 4.366 10.986 1.00 1.00 C ATOM 2038 CE1 TYR B 246 -3.287 5.673 11.524 1.00 1.00 C ATOM 2039 CE2 TYR B 246 -1.305 4.519 12.308 1.00 1.00 C ATOM 2040 CZ TYR B 246 -2.513 5.174 12.577 1.00 1.00 C ATOM 2041 OH TYR B 246 -2.941 5.330 13.878 1.00 1.00 O ATOM 0 H TYR B 246 -0.339 4.975 6.209 1.00 1.00 H new ATOM 0 HA TYR B 246 -1.348 6.811 8.104 1.00 1.00 H new ATOM 0 HB2 TYR B 246 -2.009 4.400 7.871 1.00 1.00 H new ATOM 0 HB3 TYR B 246 -0.424 3.920 8.444 1.00 1.00 H new ATOM 0 HD1 TYR B 246 -3.450 5.909 9.391 1.00 1.00 H new ATOM 0 HD2 TYR B 246 0.063 3.862 10.779 1.00 1.00 H new ATOM 0 HE1 TYR B 246 -4.220 6.176 11.731 1.00 1.00 H new ATOM 0 HE2 TYR B 246 -0.708 4.132 13.121 1.00 1.00 H new ATOM 0 HH TYR B 246 -3.921 5.347 13.900 1.00 1.00 H new ATOM 2051 N LEU B 247 1.745 5.778 8.556 1.00 1.00 N ATOM 2052 CA LEU B 247 2.981 6.043 9.289 1.00 1.00 C ATOM 2053 C LEU B 247 3.417 7.489 9.107 1.00 1.00 C ATOM 2054 O LEU B 247 3.913 8.118 10.041 1.00 1.00 O ATOM 2055 CB LEU B 247 4.092 5.108 8.809 1.00 1.00 C ATOM 2056 CG LEU B 247 3.756 3.658 9.190 1.00 1.00 C ATOM 2057 CD1 LEU B 247 4.782 2.713 8.551 1.00 1.00 C ATOM 2058 CD2 LEU B 247 3.774 3.481 10.725 1.00 1.00 C ATOM 0 H LEU B 247 1.833 5.080 7.817 1.00 1.00 H new ATOM 0 HA LEU B 247 2.792 5.864 10.347 1.00 1.00 H new ATOM 0 HB2 LEU B 247 4.208 5.192 7.728 1.00 1.00 H new ATOM 0 HB3 LEU B 247 5.043 5.400 9.255 1.00 1.00 H new ATOM 0 HG LEU B 247 2.757 3.421 8.824 1.00 1.00 H new ATOM 0 HD11 LEU B 247 4.545 1.684 8.820 1.00 1.00 H new ATOM 0 HD12 LEU B 247 4.750 2.821 7.467 1.00 1.00 H new ATOM 0 HD13 LEU B 247 5.780 2.962 8.912 1.00 1.00 H new ATOM 0 HD21 LEU B 247 3.534 2.448 10.975 1.00 1.00 H new ATOM 0 HD22 LEU B 247 4.765 3.726 11.108 1.00 1.00 H new ATOM 0 HD23 LEU B 247 3.036 4.144 11.176 1.00 1.00 H new ATOM 2070 N ILE B 248 3.234 8.013 7.905 1.00 1.00 N ATOM 2071 CA ILE B 248 3.623 9.386 7.623 1.00 1.00 C ATOM 2072 C ILE B 248 2.869 10.344 8.543 1.00 1.00 C ATOM 2073 O ILE B 248 3.456 11.275 9.095 1.00 1.00 O ATOM 2074 CB ILE B 248 3.311 9.722 6.159 1.00 1.00 C ATOM 2075 CG1 ILE B 248 4.254 8.932 5.239 1.00 1.00 C ATOM 2076 CG2 ILE B 248 3.499 11.224 5.918 1.00 1.00 C ATOM 2077 CD1 ILE B 248 3.841 9.115 3.771 1.00 1.00 C ATOM 0 H ILE B 248 2.823 7.514 7.116 1.00 1.00 H new ATOM 0 HA ILE B 248 4.693 9.494 7.798 1.00 1.00 H new ATOM 0 HB ILE B 248 2.278 9.451 5.941 1.00 1.00 H new ATOM 0 HG12 ILE B 248 5.280 9.271 5.380 1.00 1.00 H new ATOM 0 HG13 ILE B 248 4.229 7.875 5.502 1.00 1.00 H new ATOM 0 HG21 ILE B 248 3.276 11.456 4.877 1.00 1.00 H new ATOM 0 HG22 ILE B 248 2.825 11.784 6.567 1.00 1.00 H new ATOM 0 HG23 ILE B 248 4.530 11.502 6.139 1.00 1.00 H new ATOM 0 HD11 ILE B 248 4.517 8.550 3.130 1.00 1.00 H new ATOM 0 HD12 ILE B 248 2.822 8.753 3.632 1.00 1.00 H new ATOM 0 HD13 ILE B 248 3.890 10.172 3.508 1.00 1.00 H new ATOM 2089 N ASN B 249 1.574 10.112 8.711 1.00 1.00 N ATOM 2090 CA ASN B 249 0.766 10.963 9.576 1.00 1.00 C ATOM 2091 C ASN B 249 1.210 10.822 11.027 1.00 1.00 C ATOM 2092 O ASN B 249 1.282 11.805 11.763 1.00 1.00 O ATOM 2093 CB ASN B 249 -0.709 10.583 9.443 1.00 1.00 C ATOM 2094 CG ASN B 249 -1.567 11.510 10.296 1.00 1.00 C ATOM 2095 OD1 ASN B 249 -1.148 11.924 11.376 1.00 1.00 O ATOM 2096 ND2 ASN B 249 -2.747 11.866 9.869 1.00 1.00 N ATOM 0 H ASN B 249 1.064 9.350 8.265 1.00 1.00 H new ATOM 0 HA ASN B 249 0.900 12.001 9.271 1.00 1.00 H new ATOM 0 HB2 ASN B 249 -1.017 10.648 8.399 1.00 1.00 H new ATOM 0 HB3 ASN B 249 -0.856 9.549 9.755 1.00 1.00 H new ATOM 0 HD21 ASN B 249 -3.326 12.490 10.431 1.00 1.00 H new ATOM 0 HD22 ASN B 249 -3.091 11.521 8.973 1.00 1.00 H new