USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 846 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: B 341 ASN : amide:sc= -0.175 K(o=-0.18,f=-1.2!) USER MOD Set 1.2: B 349 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 MET CE :methyl -115:sc= -0.178 (180deg=-0.532) USER MOD Single : A 8 ASN : amide:sc= -4.17 K(o=-4.2,f=-4.9!) USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 11 MET CE :methyl 172:sc= -2.15 (180deg=-2.31) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 295 SER OG : rot 180:sc= 0 USER MOD Single : B 297 GLN : amide:sc= -0.112 X(o=-0.11,f=0.027) USER MOD Single : B 298 ASN : amide:sc= -0.0253 X(o=-0.025,f=0) USER MOD Single : B 299 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.16) USER MOD Single : B 300 GLN :FLIP amide:sc= -0.351 F(o=-3!,f=-0.35) USER MOD Single : B 305 ASN :FLIP amide:sc=-0.00667 F(o=-1.1,f=-0.0067) USER MOD Single : B 306 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 309 ASN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : B 310 TYR OH : rot 37:sc= 0.882 USER MOD Single : B 312 ASN : amide:sc= -0.653 K(o=-0.65,f=-1.3!) USER MOD Single : B 313 LYS NZ :NH3+ -128:sc= -1.1 (180deg=-2.27!) USER MOD Single : B 315 LYS NZ :NH3+ -169:sc= -0.032 (180deg=-0.191) USER MOD Single : B 316 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : B 319 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : B 321 GLN :FLIP amide:sc= -1.7 F(o=-2.7!,f=-1.7) USER MOD Single : B 325 TYR OH : rot 180:sc= 0 USER MOD Single : B 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 333 HIS : no HD1:sc= -0.234 X(o=-0.23,f=0.0018) USER MOD Single : B 334 THR OG1 : rot 72:sc= 0.925 USER MOD Single : B 335 TYR OH : rot 180:sc= 0 USER MOD Single : B 336 GLN :FLIP amide:sc= -1.2 F(o=-4.1!,f=-1.2) USER MOD Single : B 337 LYS NZ :NH3+ 136:sc= 0.773 (180deg=-0.471) USER MOD Single : B 339 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 343 LYS NZ :NH3+ 168:sc= -0.0266 (180deg=-0.209) USER MOD Single : B 348 ASN : amide:sc= -0.297 K(o=-0.3,f=-3.2!) USER MOD Single : B 350 THR OG1 : rot 180:sc= 0 USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN :FLIP amide:sc= -0.0674 F(o=-1.1,f=-0.067) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 367 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 368 ASN : amide:sc= -0.353 K(o=-0.35,f=-1.2) USER MOD Single : B 369 GLN :FLIP amide:sc= 0.853 F(o=-0.27,f=0.85) USER MOD Single : B 374 SER OG : rot 78:sc= 1.24 USER MOD Single : B 378 GLN :FLIP amide:sc= -0.601 F(o=-1.4,f=-0.6) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 6 -9.595 8.976 3.687 1.00 0.00 N ATOM 2 CA ARG A 6 -9.025 7.608 3.566 1.00 0.00 C ATOM 3 C ARG A 6 -7.500 7.653 3.539 1.00 0.00 C ATOM 4 O ARG A 6 -6.901 8.190 2.607 1.00 0.00 O ATOM 5 CB ARG A 6 -9.547 6.929 2.297 1.00 0.00 C ATOM 6 CG ARG A 6 -9.029 5.514 2.107 1.00 0.00 C ATOM 7 CD ARG A 6 -9.641 4.858 0.882 1.00 0.00 C ATOM 8 NE ARG A 6 -11.091 4.731 1.000 1.00 0.00 N ATOM 9 CZ ARG A 6 -11.858 4.150 0.082 1.00 0.00 C ATOM 10 NH1 ARG A 6 -11.316 3.640 -1.015 1.00 0.00 N ATOM 11 NH2 ARG A 6 -13.170 4.078 0.263 1.00 0.00 N ATOM 0 HA ARG A 6 -9.338 7.032 4.437 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -10.636 6.907 2.329 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.265 7.529 1.432 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.944 5.533 2.007 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -9.257 4.920 2.992 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -9.399 5.445 -0.004 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -9.200 3.871 0.740 1.00 0.00 H new ATOM 0 HE ARG A 6 -11.541 5.109 1.834 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -10.307 3.692 -1.157 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -11.908 3.195 -1.717 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -13.591 4.468 1.106 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -13.758 3.632 -0.441 1.00 0.00 H new ATOM 27 N MET A 7 -6.880 7.082 4.567 1.00 0.00 N ATOM 28 CA MET A 7 -5.424 7.053 4.667 1.00 0.00 C ATOM 29 C MET A 7 -4.935 5.679 5.118 1.00 0.00 C ATOM 30 O MET A 7 -4.948 5.364 6.307 1.00 0.00 O ATOM 31 CB MET A 7 -4.934 8.134 5.636 1.00 0.00 C ATOM 32 CG MET A 7 -5.997 8.617 6.613 1.00 0.00 C ATOM 33 SD MET A 7 -6.489 7.348 7.797 1.00 0.00 S ATOM 34 CE MET A 7 -4.991 7.185 8.767 1.00 0.00 C ATOM 0 H MET A 7 -7.364 6.632 5.344 1.00 0.00 H new ATOM 0 HA MET A 7 -5.013 7.254 3.678 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.086 7.745 6.200 1.00 0.00 H new ATOM 0 HB3 MET A 7 -4.570 8.985 5.061 1.00 0.00 H new ATOM 0 HG2 MET A 7 -5.619 9.485 7.154 1.00 0.00 H new ATOM 0 HG3 MET A 7 -6.874 8.946 6.055 1.00 0.00 H new ATOM 0 HE1 MET A 7 -4.574 6.188 8.627 1.00 0.00 H new ATOM 0 HE2 MET A 7 -4.265 7.931 8.443 1.00 0.00 H new ATOM 0 HE3 MET A 7 -5.222 7.337 9.821 1.00 0.00 H new ATOM 44 N ASN A 8 -4.504 4.862 4.159 1.00 0.00 N ATOM 45 CA ASN A 8 -4.018 3.520 4.463 1.00 0.00 C ATOM 46 C ASN A 8 -3.357 2.879 3.244 1.00 0.00 C ATOM 47 O ASN A 8 -2.253 2.342 3.337 1.00 0.00 O ATOM 48 CB ASN A 8 -5.173 2.647 4.953 1.00 0.00 C ATOM 49 CG ASN A 8 -6.313 2.591 3.956 1.00 0.00 C ATOM 50 OD1 ASN A 8 -6.476 1.607 3.234 1.00 0.00 O ATOM 51 ND2 ASN A 8 -7.099 3.659 3.898 1.00 0.00 N ATOM 0 H ASN A 8 -4.482 5.106 3.169 1.00 0.00 H new ATOM 0 HA ASN A 8 -3.267 3.601 5.248 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -4.808 1.637 5.142 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -5.542 3.035 5.902 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -7.875 3.686 3.236 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -6.927 4.453 4.515 1.00 0.00 H new ATOM 58 N ILE A 9 -4.040 2.939 2.105 1.00 0.00 N ATOM 59 CA ILE A 9 -3.520 2.361 0.870 1.00 0.00 C ATOM 60 C ILE A 9 -3.516 3.387 -0.260 1.00 0.00 C ATOM 61 O ILE A 9 -2.534 3.513 -0.991 1.00 0.00 O ATOM 62 CB ILE A 9 -4.345 1.130 0.436 1.00 0.00 C ATOM 63 CG1 ILE A 9 -4.331 0.058 1.532 1.00 0.00 C ATOM 64 CG2 ILE A 9 -3.814 0.564 -0.874 1.00 0.00 C ATOM 65 CD1 ILE A 9 -2.949 -0.473 1.854 1.00 0.00 C ATOM 0 H ILE A 9 -4.954 3.382 2.011 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.496 2.048 1.072 1.00 0.00 H new ATOM 0 HB ILE A 9 -5.376 1.446 0.279 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.770 0.474 2.439 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.966 -0.772 1.222 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.408 -0.303 -1.163 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -3.879 1.325 -1.652 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -2.774 0.264 -0.746 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.022 -1.227 2.638 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.514 -0.920 0.960 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.315 0.345 2.196 1.00 0.00 H new ATOM 77 N GLN A 10 -4.620 4.118 -0.396 1.00 0.00 N ATOM 78 CA GLN A 10 -4.741 5.133 -1.438 1.00 0.00 C ATOM 79 C GLN A 10 -3.606 6.149 -1.342 1.00 0.00 C ATOM 80 O GLN A 10 -3.132 6.667 -2.356 1.00 0.00 O ATOM 81 CB GLN A 10 -6.092 5.845 -1.332 1.00 0.00 C ATOM 82 CG GLN A 10 -6.339 6.855 -2.442 1.00 0.00 C ATOM 83 CD GLN A 10 -7.706 7.505 -2.349 1.00 0.00 C ATOM 84 OE1 GLN A 10 -8.259 7.662 -1.261 1.00 0.00 O ATOM 85 NE2 GLN A 10 -8.258 7.887 -3.495 1.00 0.00 N ATOM 0 H GLN A 10 -5.442 4.026 0.201 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.677 4.635 -2.406 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -6.888 5.100 -1.347 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -6.150 6.354 -0.370 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.571 7.627 -2.402 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -6.242 6.358 -3.407 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.763 7.737 -4.374 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -9.177 8.330 -3.496 1.00 0.00 H new ATOM 94 N MET A 11 -3.172 6.425 -0.116 1.00 0.00 N ATOM 95 CA MET A 11 -2.093 7.376 0.119 1.00 0.00 C ATOM 96 C MET A 11 -0.797 6.896 -0.527 1.00 0.00 C ATOM 97 O MET A 11 -0.182 7.612 -1.320 1.00 0.00 O ATOM 98 CB MET A 11 -1.888 7.580 1.622 1.00 0.00 C ATOM 99 CG MET A 11 -0.738 8.518 1.958 1.00 0.00 C ATOM 100 SD MET A 11 -0.535 8.760 3.733 1.00 0.00 S ATOM 101 CE MET A 11 -2.090 9.544 4.145 1.00 0.00 C ATOM 0 H MET A 11 -3.552 6.002 0.731 1.00 0.00 H new ATOM 0 HA MET A 11 -2.370 8.328 -0.334 1.00 0.00 H new ATOM 0 HB2 MET A 11 -2.807 7.975 2.055 1.00 0.00 H new ATOM 0 HB3 MET A 11 -1.705 6.613 2.090 1.00 0.00 H new ATOM 0 HG2 MET A 11 0.186 8.117 1.542 1.00 0.00 H new ATOM 0 HG3 MET A 11 -0.910 9.483 1.481 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.179 9.629 5.228 1.00 0.00 H new ATOM 0 HE2 MET A 11 -2.126 10.538 3.699 1.00 0.00 H new ATOM 0 HE3 MET A 11 -2.914 8.943 3.759 1.00 0.00 H new ATOM 111 N LEU A 12 -0.389 5.677 -0.185 1.00 0.00 N ATOM 112 CA LEU A 12 0.834 5.102 -0.729 1.00 0.00 C ATOM 113 C LEU A 12 0.736 4.956 -2.244 1.00 0.00 C ATOM 114 O LEU A 12 1.745 5.007 -2.948 1.00 0.00 O ATOM 115 CB LEU A 12 1.115 3.740 -0.088 1.00 0.00 C ATOM 116 CG LEU A 12 1.106 3.723 1.443 1.00 0.00 C ATOM 117 CD1 LEU A 12 1.268 2.303 1.962 1.00 0.00 C ATOM 118 CD2 LEU A 12 2.204 4.621 1.994 1.00 0.00 C ATOM 0 H LEU A 12 -0.888 5.070 0.466 1.00 0.00 H new ATOM 0 HA LEU A 12 1.658 5.777 -0.499 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.372 3.028 -0.447 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.087 3.388 -0.433 1.00 0.00 H new ATOM 0 HG LEU A 12 0.145 4.106 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.259 2.311 3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.447 1.686 1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.214 1.893 1.610 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.182 4.596 3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.173 4.268 1.643 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.044 5.643 1.651 1.00 0.00 H new ATOM 130 N LEU A 13 -0.484 4.774 -2.741 1.00 0.00 N ATOM 131 CA LEU A 13 -0.711 4.625 -4.174 1.00 0.00 C ATOM 132 C LEU A 13 -0.338 5.903 -4.919 1.00 0.00 C ATOM 133 O LEU A 13 0.438 5.870 -5.875 1.00 0.00 O ATOM 134 CB LEU A 13 -2.172 4.266 -4.454 1.00 0.00 C ATOM 135 CG LEU A 13 -2.572 2.832 -4.097 1.00 0.00 C ATOM 136 CD1 LEU A 13 -4.069 2.637 -4.276 1.00 0.00 C ATOM 137 CD2 LEU A 13 -1.801 1.831 -4.948 1.00 0.00 C ATOM 0 H LEU A 13 -1.330 4.726 -2.173 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.074 3.815 -4.531 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -2.811 4.953 -3.899 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.373 4.429 -5.513 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.322 2.658 -3.050 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.336 1.612 -4.018 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.606 3.327 -3.625 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -4.340 2.832 -5.314 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.100 0.818 -4.679 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -2.019 2.005 -6.002 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.732 1.952 -4.773 1.00 0.00 H new ATOM 149 N GLU A 14 -0.895 7.026 -4.476 1.00 0.00 N ATOM 150 CA GLU A 14 -0.615 8.315 -5.101 1.00 0.00 C ATOM 151 C GLU A 14 0.862 8.671 -4.973 1.00 0.00 C ATOM 152 O GLU A 14 1.457 9.234 -5.893 1.00 0.00 O ATOM 153 CB GLU A 14 -1.471 9.413 -4.468 1.00 0.00 C ATOM 154 CG GLU A 14 -2.965 9.192 -4.633 1.00 0.00 C ATOM 155 CD GLU A 14 -3.380 9.083 -6.087 1.00 0.00 C ATOM 156 OE1 GLU A 14 -3.595 10.136 -6.724 1.00 0.00 O ATOM 157 OE2 GLU A 14 -3.489 7.945 -6.590 1.00 0.00 O ATOM 0 H GLU A 14 -1.542 7.070 -3.688 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.863 8.237 -6.159 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -1.237 9.477 -3.405 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.203 10.372 -4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.254 8.282 -4.107 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.504 10.016 -4.166 1.00 0.00 H new ATOM 164 N ALA A 15 1.448 8.340 -3.826 1.00 0.00 N ATOM 165 CA ALA A 15 2.857 8.622 -3.576 1.00 0.00 C ATOM 166 C ALA A 15 3.745 7.937 -4.610 1.00 0.00 C ATOM 167 O ALA A 15 4.617 8.567 -5.211 1.00 0.00 O ATOM 168 CB ALA A 15 3.242 8.181 -2.172 1.00 0.00 C ATOM 0 H ALA A 15 0.968 7.876 -3.055 1.00 0.00 H new ATOM 0 HA ALA A 15 3.008 9.698 -3.661 1.00 0.00 H new ATOM 0 HB1 ALA A 15 4.296 8.397 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 15 2.637 8.719 -1.443 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.069 7.110 -2.067 1.00 0.00 H new ATOM 174 N ALA A 16 3.516 6.642 -4.812 1.00 0.00 N ATOM 175 CA ALA A 16 4.294 5.867 -5.772 1.00 0.00 C ATOM 176 C ALA A 16 4.077 6.373 -7.194 1.00 0.00 C ATOM 177 O ALA A 16 5.021 6.472 -7.977 1.00 0.00 O ATOM 178 CB ALA A 16 3.936 4.392 -5.675 1.00 0.00 C ATOM 0 H ALA A 16 2.798 6.108 -4.323 1.00 0.00 H new ATOM 0 HA ALA A 16 5.349 5.991 -5.528 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.525 3.826 -6.397 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.151 4.031 -4.669 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.875 4.260 -5.889 1.00 0.00 H new ATOM 184 N ASP A 17 2.828 6.692 -7.522 1.00 0.00 N ATOM 185 CA ASP A 17 2.490 7.187 -8.852 1.00 0.00 C ATOM 186 C ASP A 17 3.115 8.556 -9.091 1.00 0.00 C ATOM 187 O ASP A 17 3.360 8.950 -10.231 1.00 0.00 O ATOM 188 CB ASP A 17 0.972 7.270 -9.022 1.00 0.00 C ATOM 189 CG ASP A 17 0.571 7.711 -10.416 1.00 0.00 C ATOM 190 OD1 ASP A 17 0.445 8.934 -10.639 1.00 0.00 O ATOM 191 OD2 ASP A 17 0.380 6.834 -11.284 1.00 0.00 O ATOM 0 H ASP A 17 2.034 6.617 -6.886 1.00 0.00 H new ATOM 0 HA ASP A 17 2.890 6.487 -9.586 1.00 0.00 H new ATOM 0 HB2 ASP A 17 0.531 6.296 -8.811 1.00 0.00 H new ATOM 0 HB3 ASP A 17 0.565 7.969 -8.291 1.00 0.00 H new ATOM 196 N TYR A 18 3.369 9.275 -8.003 1.00 0.00 N ATOM 197 CA TYR A 18 3.970 10.601 -8.080 1.00 0.00 C ATOM 198 C TYR A 18 5.456 10.504 -8.417 1.00 0.00 C ATOM 199 O TYR A 18 5.911 11.049 -9.423 1.00 0.00 O ATOM 200 CB TYR A 18 3.775 11.341 -6.753 1.00 0.00 C ATOM 201 CG TYR A 18 4.510 12.661 -6.670 1.00 0.00 C ATOM 202 CD1 TYR A 18 3.925 13.837 -7.124 1.00 0.00 C ATOM 203 CD2 TYR A 18 5.790 12.730 -6.134 1.00 0.00 C ATOM 204 CE1 TYR A 18 4.596 15.043 -7.046 1.00 0.00 C ATOM 205 CE2 TYR A 18 6.466 13.932 -6.053 1.00 0.00 C ATOM 206 CZ TYR A 18 5.865 15.085 -6.510 1.00 0.00 C ATOM 207 OH TYR A 18 6.536 16.283 -6.430 1.00 0.00 O ATOM 0 H TYR A 18 3.167 8.960 -7.054 1.00 0.00 H new ATOM 0 HA TYR A 18 3.476 11.159 -8.875 1.00 0.00 H new ATOM 0 HB2 TYR A 18 2.710 11.520 -6.602 1.00 0.00 H new ATOM 0 HB3 TYR A 18 4.110 10.699 -5.938 1.00 0.00 H new ATOM 0 HD1 TYR A 18 2.931 13.808 -7.544 1.00 0.00 H new ATOM 0 HD2 TYR A 18 6.264 11.829 -5.775 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.128 15.948 -7.403 1.00 0.00 H new ATOM 0 HE2 TYR A 18 7.461 13.968 -5.634 1.00 0.00 H new ATOM 0 HH TYR A 18 7.417 16.138 -6.026 1.00 0.00 H new ATOM 217 N LEU A 19 6.205 9.809 -7.566 1.00 0.00 N ATOM 218 CA LEU A 19 7.641 9.640 -7.767 1.00 0.00 C ATOM 219 C LEU A 19 7.928 8.967 -9.104 1.00 0.00 C ATOM 220 O LEU A 19 8.876 9.328 -9.803 1.00 0.00 O ATOM 221 CB LEU A 19 8.236 8.806 -6.631 1.00 0.00 C ATOM 222 CG LEU A 19 7.867 9.274 -5.225 1.00 0.00 C ATOM 223 CD1 LEU A 19 8.301 8.249 -4.189 1.00 0.00 C ATOM 224 CD2 LEU A 19 8.495 10.629 -4.930 1.00 0.00 C ATOM 0 H LEU A 19 5.841 9.353 -6.729 1.00 0.00 H new ATOM 0 HA LEU A 19 8.102 10.628 -7.770 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.911 7.772 -6.751 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.322 8.812 -6.726 1.00 0.00 H new ATOM 0 HG LEU A 19 6.783 9.378 -5.172 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.029 8.600 -3.194 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.804 7.299 -4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.381 8.112 -4.243 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.221 10.946 -3.924 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.580 10.551 -5.003 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.135 11.362 -5.652 1.00 0.00 H new ATOM 236 N GLU A 20 7.103 7.986 -9.450 1.00 0.00 N ATOM 237 CA GLU A 20 7.263 7.255 -10.703 1.00 0.00 C ATOM 238 C GLU A 20 7.086 8.181 -11.904 1.00 0.00 C ATOM 239 O GLU A 20 7.993 8.330 -12.723 1.00 0.00 O ATOM 240 CB GLU A 20 6.259 6.102 -10.776 1.00 0.00 C ATOM 241 CG GLU A 20 6.397 5.251 -12.028 1.00 0.00 C ATOM 242 CD GLU A 20 5.457 4.061 -12.031 1.00 0.00 C ATOM 243 OE1 GLU A 20 4.280 4.236 -12.410 1.00 0.00 O ATOM 244 OE2 GLU A 20 5.898 2.956 -11.652 1.00 0.00 O ATOM 0 H GLU A 20 6.315 7.677 -8.880 1.00 0.00 H new ATOM 0 HA GLU A 20 8.274 6.849 -10.731 1.00 0.00 H new ATOM 0 HB2 GLU A 20 6.385 5.466 -9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 20 5.248 6.508 -10.733 1.00 0.00 H new ATOM 0 HG2 GLU A 20 6.200 5.867 -12.905 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.425 4.898 -12.111 1.00 0.00 H new ATOM 251 N ARG A 21 5.913 8.799 -12.002 1.00 0.00 N ATOM 252 CA ARG A 21 5.617 9.711 -13.102 1.00 0.00 C ATOM 253 C ARG A 21 4.546 10.719 -12.696 1.00 0.00 C ATOM 254 O ARG A 21 3.348 10.407 -12.859 1.00 0.00 O ATOM 255 CB ARG A 21 5.159 8.926 -14.334 1.00 0.00 C ATOM 256 CG ARG A 21 4.934 9.793 -15.563 1.00 0.00 C ATOM 257 CD ARG A 21 4.477 8.963 -16.752 1.00 0.00 C ATOM 258 NE ARG A 21 5.450 7.932 -17.105 1.00 0.00 N ATOM 259 CZ ARG A 21 5.274 7.055 -18.089 1.00 0.00 C ATOM 260 NH1 ARG A 21 4.164 7.080 -18.818 1.00 0.00 N ATOM 261 NH2 ARG A 21 6.207 6.147 -18.343 1.00 0.00 N ATOM 262 OXT ARG A 21 4.916 11.813 -12.220 1.00 0.00 O ATOM 0 H ARG A 21 5.152 8.685 -11.333 1.00 0.00 H new ATOM 0 HA ARG A 21 6.529 10.256 -13.348 1.00 0.00 H new ATOM 0 HB2 ARG A 21 5.905 8.166 -14.568 1.00 0.00 H new ATOM 0 HB3 ARG A 21 4.234 8.401 -14.096 1.00 0.00 H new ATOM 0 HG2 ARG A 21 4.187 10.555 -15.341 1.00 0.00 H new ATOM 0 HG3 ARG A 21 5.857 10.315 -15.815 1.00 0.00 H new ATOM 0 HD2 ARG A 21 3.520 8.495 -16.521 1.00 0.00 H new ATOM 0 HD3 ARG A 21 4.314 9.616 -17.609 1.00 0.00 H new ATOM 0 HE ARG A 21 6.314 7.882 -16.566 1.00 0.00 H new ATOM 0 HH11 ARG A 21 3.442 7.774 -18.624 1.00 0.00 H new ATOM 0 HH12 ARG A 21 4.034 6.405 -19.572 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.059 6.121 -17.784 1.00 0.00 H new ATOM 0 HH22 ARG A 21 6.072 5.474 -19.098 1.00 0.00 H new TER 276 ARG A 21 ATOM 277 N SER B 295 -9.865 13.954 -3.681 1.00 0.00 N ATOM 278 CA SER B 295 -10.132 15.167 -2.865 1.00 0.00 C ATOM 279 C SER B 295 -9.633 14.981 -1.436 1.00 0.00 C ATOM 280 O SER B 295 -9.345 15.953 -0.738 1.00 0.00 O ATOM 281 CB SER B 295 -11.631 15.472 -2.856 1.00 0.00 C ATOM 282 OG SER B 295 -11.914 16.619 -2.073 1.00 0.00 O ATOM 0 HA SER B 295 -9.596 16.004 -3.311 1.00 0.00 H new ATOM 0 HB2 SER B 295 -11.979 15.630 -3.877 1.00 0.00 H new ATOM 0 HB3 SER B 295 -12.177 14.615 -2.462 1.00 0.00 H new ATOM 0 HG SER B 295 -12.878 16.793 -2.085 1.00 0.00 H new ATOM 290 N LEU B 296 -9.535 13.723 -1.011 1.00 0.00 N ATOM 291 CA LEU B 296 -9.073 13.394 0.336 1.00 0.00 C ATOM 292 C LEU B 296 -9.913 14.106 1.392 1.00 0.00 C ATOM 293 O LEU B 296 -10.953 14.690 1.085 1.00 0.00 O ATOM 294 CB LEU B 296 -7.595 13.762 0.506 1.00 0.00 C ATOM 295 CG LEU B 296 -6.618 12.973 -0.371 1.00 0.00 C ATOM 296 CD1 LEU B 296 -6.658 13.473 -1.807 1.00 0.00 C ATOM 297 CD2 LEU B 296 -5.206 13.068 0.187 1.00 0.00 C ATOM 0 H LEU B 296 -9.770 12.912 -1.583 1.00 0.00 H new ATOM 0 HA LEU B 296 -9.186 12.319 0.473 1.00 0.00 H new ATOM 0 HB2 LEU B 296 -7.475 14.824 0.290 1.00 0.00 H new ATOM 0 HB3 LEU B 296 -7.319 13.616 1.550 1.00 0.00 H new ATOM 0 HG LEU B 296 -6.923 11.927 -0.366 1.00 0.00 H new ATOM 0 HD11 LEU B 296 -5.956 12.899 -2.412 1.00 0.00 H new ATOM 0 HD12 LEU B 296 -7.665 13.352 -2.206 1.00 0.00 H new ATOM 0 HD13 LEU B 296 -6.381 14.527 -1.833 1.00 0.00 H new ATOM 0 HD21 LEU B 296 -4.525 12.502 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU B 296 -4.894 14.112 0.213 1.00 0.00 H new ATOM 0 HD23 LEU B 296 -5.185 12.658 1.197 1.00 0.00 H new ATOM 309 N GLN B 297 -9.459 14.048 2.640 1.00 0.00 N ATOM 310 CA GLN B 297 -10.167 14.688 3.743 1.00 0.00 C ATOM 311 C GLN B 297 -9.182 15.270 4.752 1.00 0.00 C ATOM 312 O GLN B 297 -9.512 16.194 5.495 1.00 0.00 O ATOM 313 CB GLN B 297 -11.093 13.683 4.433 1.00 0.00 C ATOM 314 CG GLN B 297 -11.950 14.294 5.530 1.00 0.00 C ATOM 315 CD GLN B 297 -12.862 15.392 5.017 1.00 0.00 C ATOM 316 OE1 GLN B 297 -12.487 16.564 4.990 1.00 0.00 O ATOM 317 NE2 GLN B 297 -14.069 15.016 4.607 1.00 0.00 N ATOM 0 H GLN B 297 -8.604 13.564 2.913 1.00 0.00 H new ATOM 0 HA GLN B 297 -10.767 15.502 3.337 1.00 0.00 H new ATOM 0 HB2 GLN B 297 -11.744 13.230 3.685 1.00 0.00 H new ATOM 0 HB3 GLN B 297 -10.491 12.881 4.859 1.00 0.00 H new ATOM 0 HG2 GLN B 297 -12.553 13.512 5.992 1.00 0.00 H new ATOM 0 HG3 GLN B 297 -11.303 14.699 6.308 1.00 0.00 H new ATOM 0 HE21 GLN B 297 -14.338 14.033 4.647 1.00 0.00 H new ATOM 0 HE22 GLN B 297 -14.726 15.711 4.252 1.00 0.00 H new ATOM 326 N ASN B 298 -7.970 14.724 4.768 1.00 0.00 N ATOM 327 CA ASN B 298 -6.933 15.186 5.685 1.00 0.00 C ATOM 328 C ASN B 298 -6.367 16.531 5.238 1.00 0.00 C ATOM 329 O ASN B 298 -6.631 16.989 4.126 1.00 0.00 O ATOM 330 CB ASN B 298 -5.808 14.153 5.775 1.00 0.00 C ATOM 331 CG ASN B 298 -6.301 12.797 6.240 1.00 0.00 C ATOM 332 OD1 ASN B 298 -6.316 12.505 7.437 1.00 0.00 O ATOM 333 ND2 ASN B 298 -6.709 11.958 5.294 1.00 0.00 N ATOM 0 H ASN B 298 -7.681 13.961 4.156 1.00 0.00 H new ATOM 0 HA ASN B 298 -7.384 15.312 6.669 1.00 0.00 H new ATOM 0 HB2 ASN B 298 -5.336 14.049 4.798 1.00 0.00 H new ATOM 0 HB3 ASN B 298 -5.043 14.513 6.462 1.00 0.00 H new ATOM 0 HD21 ASN B 298 -7.052 11.031 5.547 1.00 0.00 H new ATOM 0 HD22 ASN B 298 -6.680 12.241 4.314 1.00 0.00 H new ATOM 340 N ASN B 299 -5.585 17.157 6.113 1.00 0.00 N ATOM 341 CA ASN B 299 -4.978 18.448 5.810 1.00 0.00 C ATOM 342 C ASN B 299 -3.562 18.528 6.374 1.00 0.00 C ATOM 343 O ASN B 299 -2.961 19.601 6.417 1.00 0.00 O ATOM 344 CB ASN B 299 -5.831 19.585 6.377 1.00 0.00 C ATOM 345 CG ASN B 299 -7.216 19.632 5.762 1.00 0.00 C ATOM 346 OD1 ASN B 299 -8.156 19.022 6.273 1.00 0.00 O ATOM 347 ND2 ASN B 299 -7.349 20.357 4.658 1.00 0.00 N ATOM 0 H ASN B 299 -5.357 16.791 7.037 1.00 0.00 H new ATOM 0 HA ASN B 299 -4.926 18.551 4.726 1.00 0.00 H new ATOM 0 HB2 ASN B 299 -5.920 19.465 7.457 1.00 0.00 H new ATOM 0 HB3 ASN B 299 -5.327 20.535 6.203 1.00 0.00 H new ATOM 0 HD21 ASN B 299 -8.257 20.425 4.199 1.00 0.00 H new ATOM 0 HD22 ASN B 299 -6.543 20.846 4.269 1.00 0.00 H new ATOM 354 N GLN B 300 -3.034 17.384 6.804 1.00 0.00 N ATOM 355 CA GLN B 300 -1.692 17.322 7.362 1.00 0.00 C ATOM 356 C GLN B 300 -0.686 16.858 6.304 1.00 0.00 C ATOM 357 O GLN B 300 -0.747 15.716 5.848 1.00 0.00 O ATOM 358 CB GLN B 300 -1.672 16.375 8.565 1.00 0.00 C ATOM 359 CG GLN B 300 -0.276 15.990 9.010 1.00 0.00 C ATOM 360 CD GLN B 300 -0.263 15.266 10.342 1.00 0.00 C ATOM 361 OE1 GLN B 300 -0.341 13.941 10.296 1.00 0.00 O flip ATOM 362 NE2 GLN B 300 -0.179 15.890 11.400 1.00 0.00 N flip ATOM 0 H GLN B 300 -3.519 16.487 6.775 1.00 0.00 H new ATOM 0 HA GLN B 300 -1.405 18.321 7.690 1.00 0.00 H new ATOM 0 HB2 GLN B 300 -2.192 16.848 9.398 1.00 0.00 H new ATOM 0 HB3 GLN B 300 -2.227 15.471 8.314 1.00 0.00 H new ATOM 0 HG2 GLN B 300 0.180 15.354 8.251 1.00 0.00 H new ATOM 0 HG3 GLN B 300 0.338 16.888 9.084 1.00 0.00 H new ATOM 0 HE21 GLN B 300 -0.121 16.908 11.388 1.00 0.00 H new ATOM 0 HE22 GLN B 300 -0.167 15.389 12.288 1.00 0.00 H new ATOM 371 N PRO B 301 0.252 17.738 5.895 1.00 0.00 N ATOM 372 CA PRO B 301 1.263 17.405 4.886 1.00 0.00 C ATOM 373 C PRO B 301 2.327 16.445 5.412 1.00 0.00 C ATOM 374 O PRO B 301 3.258 16.084 4.692 1.00 0.00 O ATOM 375 CB PRO B 301 1.902 18.760 4.536 1.00 0.00 C ATOM 376 CG PRO B 301 1.050 19.796 5.196 1.00 0.00 C ATOM 377 CD PRO B 301 0.403 19.120 6.368 1.00 0.00 C ATOM 0 HA PRO B 301 0.814 16.897 4.032 1.00 0.00 H new ATOM 0 HB2 PRO B 301 2.930 18.812 4.896 1.00 0.00 H new ATOM 0 HB3 PRO B 301 1.934 18.910 3.457 1.00 0.00 H new ATOM 0 HG2 PRO B 301 1.651 20.646 5.520 1.00 0.00 H new ATOM 0 HG3 PRO B 301 0.300 20.181 4.505 1.00 0.00 H new ATOM 0 HD2 PRO B 301 1.023 19.177 7.262 1.00 0.00 H new ATOM 0 HD3 PRO B 301 -0.558 19.571 6.617 1.00 0.00 H new ATOM 385 N VAL B 302 2.187 16.036 6.669 1.00 0.00 N ATOM 386 CA VAL B 302 3.143 15.119 7.282 1.00 0.00 C ATOM 387 C VAL B 302 2.940 13.693 6.776 1.00 0.00 C ATOM 388 O VAL B 302 3.907 12.981 6.504 1.00 0.00 O ATOM 389 CB VAL B 302 3.034 15.130 8.820 1.00 0.00 C ATOM 390 CG1 VAL B 302 4.078 14.214 9.441 1.00 0.00 C ATOM 391 CG2 VAL B 302 3.174 16.547 9.355 1.00 0.00 C ATOM 0 H VAL B 302 1.424 16.324 7.282 1.00 0.00 H new ATOM 0 HA VAL B 302 4.137 15.465 6.997 1.00 0.00 H new ATOM 0 HB VAL B 302 2.048 14.756 9.096 1.00 0.00 H new ATOM 0 HG11 VAL B 302 3.983 14.237 10.527 1.00 0.00 H new ATOM 0 HG12 VAL B 302 3.926 13.195 9.085 1.00 0.00 H new ATOM 0 HG13 VAL B 302 5.074 14.553 9.157 1.00 0.00 H new ATOM 0 HG21 VAL B 302 3.094 16.535 10.442 1.00 0.00 H new ATOM 0 HG22 VAL B 302 4.145 16.951 9.067 1.00 0.00 H new ATOM 0 HG23 VAL B 302 2.383 17.172 8.940 1.00 0.00 H new ATOM 401 N GLU B 303 1.681 13.283 6.654 1.00 0.00 N ATOM 402 CA GLU B 303 1.358 11.941 6.182 1.00 0.00 C ATOM 403 C GLU B 303 1.896 11.716 4.773 1.00 0.00 C ATOM 404 O GLU B 303 2.421 10.647 4.463 1.00 0.00 O ATOM 405 CB GLU B 303 -0.155 11.713 6.205 1.00 0.00 C ATOM 406 CG GLU B 303 -0.763 11.795 7.596 1.00 0.00 C ATOM 407 CD GLU B 303 -2.247 11.484 7.603 1.00 0.00 C ATOM 408 OE1 GLU B 303 -3.052 12.423 7.425 1.00 0.00 O ATOM 409 OE2 GLU B 303 -2.605 10.301 7.787 1.00 0.00 O ATOM 0 H GLU B 303 0.869 13.860 6.875 1.00 0.00 H new ATOM 0 HA GLU B 303 1.833 11.226 6.853 1.00 0.00 H new ATOM 0 HB2 GLU B 303 -0.635 12.452 5.564 1.00 0.00 H new ATOM 0 HB3 GLU B 303 -0.373 10.733 5.780 1.00 0.00 H new ATOM 0 HG2 GLU B 303 -0.246 11.098 8.256 1.00 0.00 H new ATOM 0 HG3 GLU B 303 -0.603 12.795 8.000 1.00 0.00 H new ATOM 416 N PHE B 304 1.760 12.730 3.925 1.00 0.00 N ATOM 417 CA PHE B 304 2.238 12.650 2.549 1.00 0.00 C ATOM 418 C PHE B 304 3.744 12.408 2.518 1.00 0.00 C ATOM 419 O PHE B 304 4.234 11.555 1.775 1.00 0.00 O ATOM 420 CB PHE B 304 1.895 13.940 1.798 1.00 0.00 C ATOM 421 CG PHE B 304 2.266 13.913 0.343 1.00 0.00 C ATOM 422 CD1 PHE B 304 1.526 13.169 -0.561 1.00 0.00 C ATOM 423 CD2 PHE B 304 3.356 14.632 -0.120 1.00 0.00 C ATOM 424 CE1 PHE B 304 1.866 13.143 -1.901 1.00 0.00 C ATOM 425 CE2 PHE B 304 3.701 14.611 -1.457 1.00 0.00 C ATOM 426 CZ PHE B 304 2.955 13.865 -2.349 1.00 0.00 C ATOM 0 H PHE B 304 1.322 13.619 4.167 1.00 0.00 H new ATOM 0 HA PHE B 304 1.744 11.812 2.058 1.00 0.00 H new ATOM 0 HB2 PHE B 304 0.825 14.127 1.887 1.00 0.00 H new ATOM 0 HB3 PHE B 304 2.405 14.775 2.278 1.00 0.00 H new ATOM 0 HD1 PHE B 304 0.674 12.603 -0.215 1.00 0.00 H new ATOM 0 HD2 PHE B 304 3.943 15.216 0.573 1.00 0.00 H new ATOM 0 HE1 PHE B 304 1.281 12.559 -2.596 1.00 0.00 H new ATOM 0 HE2 PHE B 304 4.553 15.177 -1.805 1.00 0.00 H new ATOM 0 HZ PHE B 304 3.223 13.846 -3.395 1.00 0.00 H new ATOM 436 N ASN B 305 4.472 13.165 3.335 1.00 0.00 N ATOM 437 CA ASN B 305 5.922 13.037 3.412 1.00 0.00 C ATOM 438 C ASN B 305 6.317 11.631 3.854 1.00 0.00 C ATOM 439 O ASN B 305 7.256 11.041 3.317 1.00 0.00 O ATOM 440 CB ASN B 305 6.494 14.074 4.381 1.00 0.00 C ATOM 441 CG ASN B 305 8.003 13.984 4.515 1.00 0.00 C ATOM 442 OD1 ASN B 305 8.671 13.556 3.450 1.00 0.00 O flip ATOM 443 ND2 ASN B 305 8.563 14.299 5.565 1.00 0.00 N flip ATOM 0 H ASN B 305 4.079 13.874 3.954 1.00 0.00 H new ATOM 0 HA ASN B 305 6.335 13.215 2.419 1.00 0.00 H new ATOM 0 HB2 ASN B 305 6.223 15.073 4.039 1.00 0.00 H new ATOM 0 HB3 ASN B 305 6.038 13.939 5.362 1.00 0.00 H new ATOM 0 HD21 ASN B 305 8.012 14.623 6.360 1.00 0.00 H new ATOM 0 HD22 ASN B 305 9.578 14.236 5.640 1.00 0.00 H new ATOM 450 N HIS B 306 5.593 11.099 4.835 1.00 0.00 N ATOM 451 CA HIS B 306 5.865 9.761 5.345 1.00 0.00 C ATOM 452 C HIS B 306 5.612 8.715 4.264 1.00 0.00 C ATOM 453 O HIS B 306 6.326 7.717 4.171 1.00 0.00 O ATOM 454 CB HIS B 306 4.995 9.468 6.569 1.00 0.00 C ATOM 455 CG HIS B 306 5.344 8.184 7.256 1.00 0.00 C ATOM 456 ND1 HIS B 306 4.763 6.975 6.932 1.00 0.00 N ATOM 457 CD2 HIS B 306 6.221 7.922 8.254 1.00 0.00 C ATOM 458 CE1 HIS B 306 5.268 6.026 7.701 1.00 0.00 C ATOM 459 NE2 HIS B 306 6.155 6.574 8.510 1.00 0.00 N ATOM 0 H HIS B 306 4.815 11.574 5.291 1.00 0.00 H new ATOM 0 HA HIS B 306 6.913 9.715 5.639 1.00 0.00 H new ATOM 0 HB2 HIS B 306 5.093 10.289 7.279 1.00 0.00 H new ATOM 0 HB3 HIS B 306 3.950 9.434 6.262 1.00 0.00 H new ATOM 0 HD2 HIS B 306 6.854 8.639 8.755 1.00 0.00 H new ATOM 0 HE1 HIS B 306 5.000 4.980 7.672 1.00 0.00 H new ATOM 0 HE2 HIS B 306 6.703 6.077 9.212 1.00 0.00 H new ATOM 468 N ALA B 307 4.588 8.955 3.449 1.00 0.00 N ATOM 469 CA ALA B 307 4.236 8.040 2.369 1.00 0.00 C ATOM 470 C ALA B 307 5.373 7.925 1.360 1.00 0.00 C ATOM 471 O ALA B 307 5.808 6.823 1.024 1.00 0.00 O ATOM 472 CB ALA B 307 2.963 8.506 1.679 1.00 0.00 C ATOM 0 H ALA B 307 3.987 9.777 3.517 1.00 0.00 H new ATOM 0 HA ALA B 307 4.063 7.054 2.800 1.00 0.00 H new ATOM 0 HB1 ALA B 307 2.711 7.815 0.875 1.00 0.00 H new ATOM 0 HB2 ALA B 307 2.147 8.535 2.401 1.00 0.00 H new ATOM 0 HB3 ALA B 307 3.117 9.503 1.266 1.00 0.00 H new ATOM 478 N ILE B 308 5.851 9.070 0.883 1.00 0.00 N ATOM 479 CA ILE B 308 6.940 9.099 -0.088 1.00 0.00 C ATOM 480 C ILE B 308 8.214 8.483 0.487 1.00 0.00 C ATOM 481 O ILE B 308 8.952 7.798 -0.219 1.00 0.00 O ATOM 482 CB ILE B 308 7.233 10.541 -0.560 1.00 0.00 C ATOM 483 CG1 ILE B 308 6.086 11.050 -1.438 1.00 0.00 C ATOM 484 CG2 ILE B 308 8.558 10.606 -1.311 1.00 0.00 C ATOM 485 CD1 ILE B 308 6.284 12.463 -1.944 1.00 0.00 C ATOM 0 H ILE B 308 5.502 9.990 1.153 1.00 0.00 H new ATOM 0 HA ILE B 308 6.618 8.506 -0.944 1.00 0.00 H new ATOM 0 HB ILE B 308 7.313 11.184 0.316 1.00 0.00 H new ATOM 0 HG12 ILE B 308 5.970 10.382 -2.291 1.00 0.00 H new ATOM 0 HG13 ILE B 308 5.158 11.005 -0.869 1.00 0.00 H new ATOM 0 HG21 ILE B 308 8.743 11.630 -1.634 1.00 0.00 H new ATOM 0 HG22 ILE B 308 9.365 10.281 -0.654 1.00 0.00 H new ATOM 0 HG23 ILE B 308 8.514 9.953 -2.183 1.00 0.00 H new ATOM 0 HD11 ILE B 308 5.431 12.752 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE B 308 6.369 13.144 -1.097 1.00 0.00 H new ATOM 0 HD13 ILE B 308 7.194 12.511 -2.542 1.00 0.00 H new ATOM 497 N ASN B 309 8.464 8.728 1.770 1.00 0.00 N ATOM 498 CA ASN B 309 9.655 8.199 2.429 1.00 0.00 C ATOM 499 C ASN B 309 9.640 6.672 2.466 1.00 0.00 C ATOM 500 O ASN B 309 10.651 6.024 2.193 1.00 0.00 O ATOM 501 CB ASN B 309 9.761 8.752 3.851 1.00 0.00 C ATOM 502 CG ASN B 309 11.074 8.390 4.516 1.00 0.00 C ATOM 503 OD1 ASN B 309 11.197 7.337 5.143 1.00 0.00 O ATOM 504 ND2 ASN B 309 12.065 9.265 4.385 1.00 0.00 N ATOM 0 H ASN B 309 7.860 9.287 2.373 1.00 0.00 H new ATOM 0 HA ASN B 309 10.523 8.516 1.852 1.00 0.00 H new ATOM 0 HB2 ASN B 309 9.657 9.837 3.825 1.00 0.00 H new ATOM 0 HB3 ASN B 309 8.935 8.367 4.450 1.00 0.00 H new ATOM 0 HD21 ASN B 309 12.972 9.077 4.813 1.00 0.00 H new ATOM 0 HD22 ASN B 309 11.919 10.125 3.857 1.00 0.00 H new ATOM 511 N TYR B 310 8.486 6.103 2.804 1.00 0.00 N ATOM 512 CA TYR B 310 8.340 4.652 2.887 1.00 0.00 C ATOM 513 C TYR B 310 8.475 4.001 1.513 1.00 0.00 C ATOM 514 O TYR B 310 9.309 3.115 1.315 1.00 0.00 O ATOM 515 CB TYR B 310 6.985 4.298 3.504 1.00 0.00 C ATOM 516 CG TYR B 310 6.745 2.811 3.643 1.00 0.00 C ATOM 517 CD1 TYR B 310 7.546 2.030 4.468 1.00 0.00 C ATOM 518 CD2 TYR B 310 5.716 2.189 2.948 1.00 0.00 C ATOM 519 CE1 TYR B 310 7.327 0.671 4.596 1.00 0.00 C ATOM 520 CE2 TYR B 310 5.490 0.832 3.072 1.00 0.00 C ATOM 521 CZ TYR B 310 6.297 0.078 3.896 1.00 0.00 C ATOM 522 OH TYR B 310 6.075 -1.273 4.019 1.00 0.00 O ATOM 0 H TYR B 310 7.638 6.625 3.025 1.00 0.00 H new ATOM 0 HA TYR B 310 9.139 4.268 3.521 1.00 0.00 H new ATOM 0 HB2 TYR B 310 6.913 4.761 4.488 1.00 0.00 H new ATOM 0 HB3 TYR B 310 6.194 4.728 2.890 1.00 0.00 H new ATOM 0 HD1 TYR B 310 8.352 2.492 5.018 1.00 0.00 H new ATOM 0 HD2 TYR B 310 5.082 2.776 2.300 1.00 0.00 H new ATOM 0 HE1 TYR B 310 7.959 0.077 5.240 1.00 0.00 H new ATOM 0 HE2 TYR B 310 4.684 0.364 2.526 1.00 0.00 H new ATOM 0 HH TYR B 310 6.247 -1.550 4.943 1.00 0.00 H new ATOM 532 N VAL B 311 7.650 4.443 0.568 1.00 0.00 N ATOM 533 CA VAL B 311 7.679 3.903 -0.787 1.00 0.00 C ATOM 534 C VAL B 311 9.076 4.016 -1.388 1.00 0.00 C ATOM 535 O VAL B 311 9.535 3.116 -2.093 1.00 0.00 O ATOM 536 CB VAL B 311 6.668 4.623 -1.701 1.00 0.00 C ATOM 537 CG1 VAL B 311 6.707 4.045 -3.109 1.00 0.00 C ATOM 538 CG2 VAL B 311 5.266 4.528 -1.119 1.00 0.00 C ATOM 0 H VAL B 311 6.954 5.173 0.716 1.00 0.00 H new ATOM 0 HA VAL B 311 7.402 2.851 -0.720 1.00 0.00 H new ATOM 0 HB VAL B 311 6.946 5.675 -1.760 1.00 0.00 H new ATOM 0 HG11 VAL B 311 5.986 4.568 -3.737 1.00 0.00 H new ATOM 0 HG12 VAL B 311 7.707 4.168 -3.525 1.00 0.00 H new ATOM 0 HG13 VAL B 311 6.456 2.985 -3.074 1.00 0.00 H new ATOM 0 HG21 VAL B 311 4.564 5.041 -1.776 1.00 0.00 H new ATOM 0 HG22 VAL B 311 4.980 3.480 -1.029 1.00 0.00 H new ATOM 0 HG23 VAL B 311 5.249 4.994 -0.134 1.00 0.00 H new ATOM 548 N ASN B 312 9.748 5.127 -1.103 1.00 0.00 N ATOM 549 CA ASN B 312 11.099 5.353 -1.606 1.00 0.00 C ATOM 550 C ASN B 312 12.075 4.395 -0.934 1.00 0.00 C ATOM 551 O ASN B 312 13.027 3.923 -1.556 1.00 0.00 O ATOM 552 CB ASN B 312 11.527 6.801 -1.350 1.00 0.00 C ATOM 553 CG ASN B 312 12.799 7.176 -2.089 1.00 0.00 C ATOM 554 OD1 ASN B 312 13.661 6.334 -2.338 1.00 0.00 O ATOM 555 ND2 ASN B 312 12.922 8.450 -2.443 1.00 0.00 N ATOM 0 H ASN B 312 9.380 5.884 -0.527 1.00 0.00 H new ATOM 0 HA ASN B 312 11.106 5.170 -2.681 1.00 0.00 H new ATOM 0 HB2 ASN B 312 10.724 7.472 -1.654 1.00 0.00 H new ATOM 0 HB3 ASN B 312 11.677 6.947 -0.280 1.00 0.00 H new ATOM 0 HD21 ASN B 312 13.755 8.763 -2.941 1.00 0.00 H new ATOM 0 HD22 ASN B 312 12.183 9.116 -2.217 1.00 0.00 H new ATOM 562 N LYS B 313 11.827 4.112 0.341 1.00 0.00 N ATOM 563 CA LYS B 313 12.679 3.208 1.103 1.00 0.00 C ATOM 564 C LYS B 313 12.646 1.806 0.507 1.00 0.00 C ATOM 565 O LYS B 313 13.667 1.123 0.445 1.00 0.00 O ATOM 566 CB LYS B 313 12.237 3.163 2.567 1.00 0.00 C ATOM 567 CG LYS B 313 13.150 2.329 3.450 1.00 0.00 C ATOM 568 CD LYS B 313 12.703 2.362 4.901 1.00 0.00 C ATOM 569 CE LYS B 313 13.604 1.511 5.780 1.00 0.00 C ATOM 570 NZ LYS B 313 13.606 0.083 5.358 1.00 0.00 N ATOM 0 H LYS B 313 11.043 4.496 0.868 1.00 0.00 H new ATOM 0 HA LYS B 313 13.701 3.584 1.054 1.00 0.00 H new ATOM 0 HB2 LYS B 313 12.197 4.180 2.958 1.00 0.00 H new ATOM 0 HB3 LYS B 313 11.226 2.760 2.621 1.00 0.00 H new ATOM 0 HG2 LYS B 313 13.160 1.299 3.095 1.00 0.00 H new ATOM 0 HG3 LYS B 313 14.171 2.702 3.374 1.00 0.00 H new ATOM 0 HD2 LYS B 313 12.708 3.391 5.261 1.00 0.00 H new ATOM 0 HD3 LYS B 313 11.676 2.003 4.975 1.00 0.00 H new ATOM 0 HE2 LYS B 313 14.621 1.902 5.743 1.00 0.00 H new ATOM 0 HE3 LYS B 313 13.273 1.583 6.816 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 13.398 -0.522 6.178 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 12.881 -0.064 4.627 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 14.540 -0.164 4.974 1.00 0.00 H new ATOM 584 N ILE B 314 11.463 1.382 0.073 1.00 0.00 N ATOM 585 CA ILE B 314 11.296 0.062 -0.525 1.00 0.00 C ATOM 586 C ILE B 314 11.947 0.003 -1.902 1.00 0.00 C ATOM 587 O ILE B 314 12.658 -0.948 -2.225 1.00 0.00 O ATOM 588 CB ILE B 314 9.807 -0.312 -0.666 1.00 0.00 C ATOM 589 CG1 ILE B 314 9.118 -0.289 0.701 1.00 0.00 C ATOM 590 CG2 ILE B 314 9.666 -1.681 -1.318 1.00 0.00 C ATOM 591 CD1 ILE B 314 7.630 -0.561 0.635 1.00 0.00 C ATOM 0 H ILE B 314 10.606 1.933 0.124 1.00 0.00 H new ATOM 0 HA ILE B 314 11.780 -0.650 0.143 1.00 0.00 H new ATOM 0 HB ILE B 314 9.321 0.425 -1.305 1.00 0.00 H new ATOM 0 HG12 ILE B 314 9.586 -1.032 1.347 1.00 0.00 H new ATOM 0 HG13 ILE B 314 9.281 0.684 1.164 1.00 0.00 H new ATOM 0 HG21 ILE B 314 8.610 -1.932 -1.411 1.00 0.00 H new ATOM 0 HG22 ILE B 314 10.123 -1.662 -2.307 1.00 0.00 H new ATOM 0 HG23 ILE B 314 10.164 -2.430 -0.703 1.00 0.00 H new ATOM 0 HD11 ILE B 314 7.209 -0.529 1.640 1.00 0.00 H new ATOM 0 HD12 ILE B 314 7.149 0.196 0.016 1.00 0.00 H new ATOM 0 HD13 ILE B 314 7.459 -1.546 0.202 1.00 0.00 H new ATOM 603 N LYS B 315 11.691 1.026 -2.711 1.00 0.00 N ATOM 604 CA LYS B 315 12.242 1.096 -4.058 1.00 0.00 C ATOM 605 C LYS B 315 13.768 1.127 -4.026 1.00 0.00 C ATOM 606 O LYS B 315 14.426 0.619 -4.933 1.00 0.00 O ATOM 607 CB LYS B 315 11.706 2.332 -4.783 1.00 0.00 C ATOM 608 CG LYS B 315 12.087 2.392 -6.252 1.00 0.00 C ATOM 609 CD LYS B 315 11.568 3.661 -6.907 1.00 0.00 C ATOM 610 CE LYS B 315 11.874 3.686 -8.395 1.00 0.00 C ATOM 611 NZ LYS B 315 13.337 3.598 -8.662 1.00 0.00 N ATOM 0 H LYS B 315 11.104 1.820 -2.455 1.00 0.00 H new ATOM 0 HA LYS B 315 11.931 0.202 -4.598 1.00 0.00 H new ATOM 0 HB2 LYS B 315 10.619 2.350 -4.698 1.00 0.00 H new ATOM 0 HB3 LYS B 315 12.079 3.226 -4.283 1.00 0.00 H new ATOM 0 HG2 LYS B 315 13.172 2.347 -6.350 1.00 0.00 H new ATOM 0 HG3 LYS B 315 11.684 1.522 -6.770 1.00 0.00 H new ATOM 0 HD2 LYS B 315 10.491 3.736 -6.755 1.00 0.00 H new ATOM 0 HD3 LYS B 315 12.019 4.530 -6.427 1.00 0.00 H new ATOM 0 HE2 LYS B 315 11.365 2.856 -8.884 1.00 0.00 H new ATOM 0 HE3 LYS B 315 11.480 4.604 -8.832 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 13.520 3.804 -9.665 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 13.840 4.289 -8.069 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 13.674 2.640 -8.439 1.00 0.00 H new ATOM 625 N ASN B 316 14.325 1.728 -2.979 1.00 0.00 N ATOM 626 CA ASN B 316 15.774 1.823 -2.835 1.00 0.00 C ATOM 627 C ASN B 316 16.355 0.532 -2.266 1.00 0.00 C ATOM 628 O ASN B 316 17.407 0.066 -2.706 1.00 0.00 O ATOM 629 CB ASN B 316 16.142 3.004 -1.934 1.00 0.00 C ATOM 630 CG ASN B 316 17.642 3.205 -1.829 1.00 0.00 C ATOM 631 OD1 ASN B 316 18.298 2.627 -0.962 1.00 0.00 O ATOM 632 ND2 ASN B 316 18.191 4.030 -2.712 1.00 0.00 N ATOM 0 H ASN B 316 13.796 2.156 -2.219 1.00 0.00 H new ATOM 0 HA ASN B 316 16.201 1.983 -3.825 1.00 0.00 H new ATOM 0 HB2 ASN B 316 15.683 3.912 -2.324 1.00 0.00 H new ATOM 0 HB3 ASN B 316 15.729 2.841 -0.938 1.00 0.00 H new ATOM 0 HD21 ASN B 316 19.195 4.206 -2.689 1.00 0.00 H new ATOM 0 HD22 ASN B 316 17.609 4.487 -3.413 1.00 0.00 H new ATOM 639 N ARG B 317 15.664 -0.042 -1.285 1.00 0.00 N ATOM 640 CA ARG B 317 16.111 -1.279 -0.652 1.00 0.00 C ATOM 641 C ARG B 317 16.047 -2.447 -1.631 1.00 0.00 C ATOM 642 O ARG B 317 16.830 -3.393 -1.536 1.00 0.00 O ATOM 643 CB ARG B 317 15.254 -1.582 0.580 1.00 0.00 C ATOM 644 CG ARG B 317 15.654 -2.856 1.308 1.00 0.00 C ATOM 645 CD ARG B 317 17.050 -2.751 1.901 1.00 0.00 C ATOM 646 NE ARG B 317 17.414 -3.950 2.648 1.00 0.00 N ATOM 647 CZ ARG B 317 18.651 -4.220 3.053 1.00 0.00 C ATOM 648 NH1 ARG B 317 19.642 -3.384 2.775 1.00 0.00 N ATOM 649 NH2 ARG B 317 18.899 -5.332 3.732 1.00 0.00 N ATOM 0 H ARG B 317 14.791 0.330 -0.911 1.00 0.00 H new ATOM 0 HA ARG B 317 17.148 -1.146 -0.343 1.00 0.00 H new ATOM 0 HB2 ARG B 317 15.320 -0.743 1.272 1.00 0.00 H new ATOM 0 HB3 ARG B 317 14.211 -1.661 0.275 1.00 0.00 H new ATOM 0 HG2 ARG B 317 14.936 -3.062 2.102 1.00 0.00 H new ATOM 0 HG3 ARG B 317 15.615 -3.698 0.617 1.00 0.00 H new ATOM 0 HD2 ARG B 317 17.773 -2.588 1.102 1.00 0.00 H new ATOM 0 HD3 ARG B 317 17.101 -1.884 2.559 1.00 0.00 H new ATOM 0 HE ARG B 317 16.678 -4.619 2.872 1.00 0.00 H new ATOM 0 HH11 ARG B 317 19.456 -2.530 2.249 1.00 0.00 H new ATOM 0 HH12 ARG B 317 20.590 -3.595 3.088 1.00 0.00 H new ATOM 0 HH21 ARG B 317 18.140 -5.980 3.944 1.00 0.00 H new ATOM 0 HH22 ARG B 317 19.848 -5.539 4.043 1.00 0.00 H new ATOM 663 N PHE B 318 15.110 -2.374 -2.571 1.00 0.00 N ATOM 664 CA PHE B 318 14.940 -3.426 -3.568 1.00 0.00 C ATOM 665 C PHE B 318 15.240 -2.909 -4.970 1.00 0.00 C ATOM 666 O PHE B 318 14.752 -3.456 -5.960 1.00 0.00 O ATOM 667 CB PHE B 318 13.517 -3.986 -3.513 1.00 0.00 C ATOM 668 CG PHE B 318 13.213 -4.730 -2.245 1.00 0.00 C ATOM 669 CD1 PHE B 318 13.585 -6.057 -2.100 1.00 0.00 C ATOM 670 CD2 PHE B 318 12.555 -4.103 -1.199 1.00 0.00 C ATOM 671 CE1 PHE B 318 13.308 -6.745 -0.934 1.00 0.00 C ATOM 672 CE2 PHE B 318 12.275 -4.787 -0.031 1.00 0.00 C ATOM 673 CZ PHE B 318 12.652 -6.109 0.102 1.00 0.00 C ATOM 0 H PHE B 318 14.456 -1.597 -2.663 1.00 0.00 H new ATOM 0 HA PHE B 318 15.648 -4.223 -3.338 1.00 0.00 H new ATOM 0 HB2 PHE B 318 12.808 -3.165 -3.622 1.00 0.00 H new ATOM 0 HB3 PHE B 318 13.365 -4.653 -4.361 1.00 0.00 H new ATOM 0 HD1 PHE B 318 14.097 -6.559 -2.907 1.00 0.00 H new ATOM 0 HD2 PHE B 318 12.258 -3.069 -1.297 1.00 0.00 H new ATOM 0 HE1 PHE B 318 13.604 -7.779 -0.833 1.00 0.00 H new ATOM 0 HE2 PHE B 318 11.762 -4.288 0.777 1.00 0.00 H new ATOM 0 HZ PHE B 318 12.434 -6.645 1.014 1.00 0.00 H new ATOM 683 N GLN B 319 16.048 -1.856 -5.049 1.00 0.00 N ATOM 684 CA GLN B 319 16.416 -1.269 -6.334 1.00 0.00 C ATOM 685 C GLN B 319 17.044 -2.318 -7.248 1.00 0.00 C ATOM 686 O GLN B 319 16.930 -2.239 -8.471 1.00 0.00 O ATOM 687 CB GLN B 319 17.387 -0.105 -6.127 1.00 0.00 C ATOM 688 CG GLN B 319 17.761 0.614 -7.414 1.00 0.00 C ATOM 689 CD GLN B 319 18.689 1.792 -7.179 1.00 0.00 C ATOM 690 OE1 GLN B 319 19.537 1.688 -6.162 1.00 0.00 O flip ATOM 691 NE2 GLN B 319 18.647 2.783 -7.908 1.00 0.00 N flip ATOM 0 H GLN B 319 16.460 -1.392 -4.240 1.00 0.00 H new ATOM 0 HA GLN B 319 15.510 -0.894 -6.810 1.00 0.00 H new ATOM 0 HB2 GLN B 319 16.940 0.611 -5.437 1.00 0.00 H new ATOM 0 HB3 GLN B 319 18.294 -0.480 -5.654 1.00 0.00 H new ATOM 0 HG2 GLN B 319 18.241 -0.091 -8.093 1.00 0.00 H new ATOM 0 HG3 GLN B 319 16.854 0.964 -7.907 1.00 0.00 H new ATOM 0 HE21 GLN B 319 17.980 2.821 -8.678 1.00 0.00 H new ATOM 0 HE22 GLN B 319 19.280 3.566 -7.742 1.00 0.00 H new ATOM 700 N GLY B 320 17.705 -3.301 -6.643 1.00 0.00 N ATOM 701 CA GLY B 320 18.338 -4.356 -7.414 1.00 0.00 C ATOM 702 C GLY B 320 17.329 -5.247 -8.112 1.00 0.00 C ATOM 703 O GLY B 320 17.524 -5.632 -9.264 1.00 0.00 O ATOM 0 H GLY B 320 17.813 -3.385 -5.632 1.00 0.00 H new ATOM 0 HA2 GLY B 320 19.001 -3.912 -8.156 1.00 0.00 H new ATOM 0 HA3 GLY B 320 18.959 -4.962 -6.754 1.00 0.00 H new ATOM 707 N GLN B 321 16.248 -5.574 -7.409 1.00 0.00 N ATOM 708 CA GLN B 321 15.199 -6.421 -7.966 1.00 0.00 C ATOM 709 C GLN B 321 13.903 -5.629 -8.144 1.00 0.00 C ATOM 710 O GLN B 321 13.111 -5.513 -7.209 1.00 0.00 O ATOM 711 CB GLN B 321 14.952 -7.627 -7.056 1.00 0.00 C ATOM 712 CG GLN B 321 14.008 -8.661 -7.652 1.00 0.00 C ATOM 713 CD GLN B 321 13.771 -9.839 -6.726 1.00 0.00 C ATOM 714 OE1 GLN B 321 12.600 -10.456 -6.839 1.00 0.00 O flip ATOM 715 NE2 GLN B 321 14.632 -10.193 -5.920 1.00 0.00 N flip ATOM 0 H GLN B 321 16.076 -5.265 -6.452 1.00 0.00 H new ATOM 0 HA GLN B 321 15.528 -6.774 -8.943 1.00 0.00 H new ATOM 0 HB2 GLN B 321 15.906 -8.105 -6.834 1.00 0.00 H new ATOM 0 HB3 GLN B 321 14.542 -7.278 -6.108 1.00 0.00 H new ATOM 0 HG2 GLN B 321 13.054 -8.187 -7.881 1.00 0.00 H new ATOM 0 HG3 GLN B 321 14.419 -9.022 -8.595 1.00 0.00 H new ATOM 0 HE21 GLN B 321 15.518 -9.690 -5.867 1.00 0.00 H new ATOM 0 HE22 GLN B 321 14.459 -10.989 -5.306 1.00 0.00 H new ATOM 724 N PRO B 322 13.673 -5.062 -9.345 1.00 0.00 N ATOM 725 CA PRO B 322 12.463 -4.279 -9.626 1.00 0.00 C ATOM 726 C PRO B 322 11.195 -5.123 -9.555 1.00 0.00 C ATOM 727 O PRO B 322 10.085 -4.591 -9.529 1.00 0.00 O ATOM 728 CB PRO B 322 12.683 -3.767 -11.054 1.00 0.00 C ATOM 729 CG PRO B 322 13.677 -4.703 -11.649 1.00 0.00 C ATOM 730 CD PRO B 322 14.565 -5.133 -10.517 1.00 0.00 C ATOM 0 HA PRO B 322 12.319 -3.484 -8.894 1.00 0.00 H new ATOM 0 HB2 PRO B 322 11.752 -3.767 -11.621 1.00 0.00 H new ATOM 0 HB3 PRO B 322 13.056 -2.743 -11.053 1.00 0.00 H new ATOM 0 HG2 PRO B 322 13.182 -5.561 -12.105 1.00 0.00 H new ATOM 0 HG3 PRO B 322 14.254 -4.213 -12.434 1.00 0.00 H new ATOM 0 HD2 PRO B 322 14.952 -6.141 -10.669 1.00 0.00 H new ATOM 0 HD3 PRO B 322 15.427 -4.474 -10.408 1.00 0.00 H new ATOM 738 N ASP B 323 11.366 -6.441 -9.519 1.00 0.00 N ATOM 739 CA ASP B 323 10.234 -7.358 -9.452 1.00 0.00 C ATOM 740 C ASP B 323 9.486 -7.209 -8.131 1.00 0.00 C ATOM 741 O ASP B 323 8.255 -7.202 -8.100 1.00 0.00 O ATOM 742 CB ASP B 323 10.709 -8.802 -9.618 1.00 0.00 C ATOM 743 CG ASP B 323 9.557 -9.784 -9.709 1.00 0.00 C ATOM 744 OD1 ASP B 323 9.040 -10.194 -8.648 1.00 0.00 O ATOM 745 OD2 ASP B 323 9.171 -10.143 -10.841 1.00 0.00 O ATOM 0 H ASP B 323 12.278 -6.898 -9.535 1.00 0.00 H new ATOM 0 HA ASP B 323 9.552 -7.109 -10.265 1.00 0.00 H new ATOM 0 HB2 ASP B 323 11.320 -8.879 -10.517 1.00 0.00 H new ATOM 0 HB3 ASP B 323 11.346 -9.071 -8.775 1.00 0.00 H new ATOM 750 N ILE B 324 10.239 -7.091 -7.042 1.00 0.00 N ATOM 751 CA ILE B 324 9.651 -6.946 -5.715 1.00 0.00 C ATOM 752 C ILE B 324 8.845 -5.654 -5.606 1.00 0.00 C ATOM 753 O ILE B 324 7.730 -5.650 -5.082 1.00 0.00 O ATOM 754 CB ILE B 324 10.737 -6.962 -4.617 1.00 0.00 C ATOM 755 CG1 ILE B 324 11.533 -8.272 -4.669 1.00 0.00 C ATOM 756 CG2 ILE B 324 10.112 -6.766 -3.242 1.00 0.00 C ATOM 757 CD1 ILE B 324 10.701 -9.506 -4.388 1.00 0.00 C ATOM 0 H ILE B 324 11.259 -7.093 -7.053 1.00 0.00 H new ATOM 0 HA ILE B 324 8.984 -7.795 -5.568 1.00 0.00 H new ATOM 0 HB ILE B 324 11.424 -6.136 -4.800 1.00 0.00 H new ATOM 0 HG12 ILE B 324 11.989 -8.370 -5.654 1.00 0.00 H new ATOM 0 HG13 ILE B 324 12.346 -8.221 -3.945 1.00 0.00 H new ATOM 0 HG21 ILE B 324 10.893 -6.780 -2.482 1.00 0.00 H new ATOM 0 HG22 ILE B 324 9.593 -5.808 -3.211 1.00 0.00 H new ATOM 0 HG23 ILE B 324 9.402 -7.569 -3.047 1.00 0.00 H new ATOM 0 HD11 ILE B 324 11.334 -10.392 -4.443 1.00 0.00 H new ATOM 0 HD12 ILE B 324 10.266 -9.432 -3.391 1.00 0.00 H new ATOM 0 HD13 ILE B 324 9.904 -9.583 -5.127 1.00 0.00 H new ATOM 769 N TYR B 325 9.415 -4.561 -6.104 1.00 0.00 N ATOM 770 CA TYR B 325 8.751 -3.262 -6.062 1.00 0.00 C ATOM 771 C TYR B 325 7.434 -3.298 -6.833 1.00 0.00 C ATOM 772 O TYR B 325 6.376 -2.963 -6.293 1.00 0.00 O ATOM 773 CB TYR B 325 9.672 -2.185 -6.642 1.00 0.00 C ATOM 774 CG TYR B 325 9.117 -0.781 -6.538 1.00 0.00 C ATOM 775 CD1 TYR B 325 8.810 -0.223 -5.303 1.00 0.00 C ATOM 776 CD2 TYR B 325 8.905 -0.013 -7.676 1.00 0.00 C ATOM 777 CE1 TYR B 325 8.306 1.060 -5.205 1.00 0.00 C ATOM 778 CE2 TYR B 325 8.402 1.272 -7.586 1.00 0.00 C ATOM 779 CZ TYR B 325 8.104 1.803 -6.349 1.00 0.00 C ATOM 780 OH TYR B 325 7.604 3.081 -6.255 1.00 0.00 O ATOM 0 H TYR B 325 10.336 -4.549 -6.542 1.00 0.00 H new ATOM 0 HA TYR B 325 8.530 -3.022 -5.022 1.00 0.00 H new ATOM 0 HB2 TYR B 325 10.631 -2.225 -6.126 1.00 0.00 H new ATOM 0 HB3 TYR B 325 9.865 -2.412 -7.691 1.00 0.00 H new ATOM 0 HD1 TYR B 325 8.968 -0.802 -4.405 1.00 0.00 H new ATOM 0 HD2 TYR B 325 9.137 -0.426 -8.647 1.00 0.00 H new ATOM 0 HE1 TYR B 325 8.072 1.479 -4.237 1.00 0.00 H new ATOM 0 HE2 TYR B 325 8.243 1.857 -8.480 1.00 0.00 H new ATOM 0 HH TYR B 325 7.523 3.467 -7.152 1.00 0.00 H new ATOM 790 N LYS B 326 7.506 -3.708 -8.096 1.00 0.00 N ATOM 791 CA LYS B 326 6.322 -3.792 -8.942 1.00 0.00 C ATOM 792 C LYS B 326 5.270 -4.697 -8.310 1.00 0.00 C ATOM 793 O LYS B 326 4.071 -4.446 -8.428 1.00 0.00 O ATOM 794 CB LYS B 326 6.695 -4.314 -10.331 1.00 0.00 C ATOM 795 CG LYS B 326 7.675 -3.421 -11.075 1.00 0.00 C ATOM 796 CD LYS B 326 8.044 -4.009 -12.428 1.00 0.00 C ATOM 797 CE LYS B 326 9.123 -3.191 -13.118 1.00 0.00 C ATOM 798 NZ LYS B 326 9.495 -3.767 -14.439 1.00 0.00 N ATOM 0 H LYS B 326 8.373 -3.987 -8.555 1.00 0.00 H new ATOM 0 HA LYS B 326 5.904 -2.790 -9.041 1.00 0.00 H new ATOM 0 HB2 LYS B 326 7.127 -5.310 -10.232 1.00 0.00 H new ATOM 0 HB3 LYS B 326 5.788 -4.418 -10.926 1.00 0.00 H new ATOM 0 HG2 LYS B 326 7.236 -2.433 -11.213 1.00 0.00 H new ATOM 0 HG3 LYS B 326 8.576 -3.289 -10.476 1.00 0.00 H new ATOM 0 HD2 LYS B 326 8.391 -5.034 -12.297 1.00 0.00 H new ATOM 0 HD3 LYS B 326 7.158 -4.051 -13.061 1.00 0.00 H new ATOM 0 HE2 LYS B 326 8.772 -2.168 -13.254 1.00 0.00 H new ATOM 0 HE3 LYS B 326 10.006 -3.143 -12.481 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 10.233 -3.181 -14.878 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 9.854 -4.734 -14.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 8.658 -3.789 -15.056 1.00 0.00 H new ATOM 812 N ALA B 327 5.729 -5.748 -7.637 1.00 0.00 N ATOM 813 CA ALA B 327 4.829 -6.688 -6.982 1.00 0.00 C ATOM 814 C ALA B 327 3.993 -5.987 -5.917 1.00 0.00 C ATOM 815 O ALA B 327 2.763 -6.012 -5.965 1.00 0.00 O ATOM 816 CB ALA B 327 5.618 -7.835 -6.369 1.00 0.00 C ATOM 0 H ALA B 327 6.719 -5.969 -7.532 1.00 0.00 H new ATOM 0 HA ALA B 327 4.151 -7.093 -7.734 1.00 0.00 H new ATOM 0 HB1 ALA B 327 4.933 -8.529 -5.883 1.00 0.00 H new ATOM 0 HB2 ALA B 327 6.169 -8.357 -7.152 1.00 0.00 H new ATOM 0 HB3 ALA B 327 6.319 -7.442 -5.632 1.00 0.00 H new ATOM 822 N PHE B 328 4.671 -5.358 -4.959 1.00 0.00 N ATOM 823 CA PHE B 328 3.998 -4.642 -3.879 1.00 0.00 C ATOM 824 C PHE B 328 2.970 -3.659 -4.436 1.00 0.00 C ATOM 825 O PHE B 328 1.830 -3.601 -3.964 1.00 0.00 O ATOM 826 CB PHE B 328 5.027 -3.902 -3.020 1.00 0.00 C ATOM 827 CG PHE B 328 4.431 -3.118 -1.884 1.00 0.00 C ATOM 828 CD1 PHE B 328 3.607 -3.731 -0.951 1.00 0.00 C ATOM 829 CD2 PHE B 328 4.704 -1.766 -1.744 1.00 0.00 C ATOM 830 CE1 PHE B 328 3.068 -3.010 0.097 1.00 0.00 C ATOM 831 CE2 PHE B 328 4.166 -1.041 -0.699 1.00 0.00 C ATOM 832 CZ PHE B 328 3.348 -1.663 0.223 1.00 0.00 C ATOM 0 H PHE B 328 5.689 -5.330 -4.910 1.00 0.00 H new ATOM 0 HA PHE B 328 3.473 -5.369 -3.259 1.00 0.00 H new ATOM 0 HB2 PHE B 328 5.734 -4.626 -2.615 1.00 0.00 H new ATOM 0 HB3 PHE B 328 5.595 -3.223 -3.657 1.00 0.00 H new ATOM 0 HD1 PHE B 328 3.384 -4.784 -1.045 1.00 0.00 H new ATOM 0 HD2 PHE B 328 5.345 -1.274 -2.461 1.00 0.00 H new ATOM 0 HE1 PHE B 328 2.428 -3.499 0.817 1.00 0.00 H new ATOM 0 HE2 PHE B 328 4.385 0.012 -0.603 1.00 0.00 H new ATOM 0 HZ PHE B 328 2.928 -1.097 1.041 1.00 0.00 H new ATOM 842 N LEU B 329 3.378 -2.891 -5.443 1.00 0.00 N ATOM 843 CA LEU B 329 2.490 -1.915 -6.065 1.00 0.00 C ATOM 844 C LEU B 329 1.217 -2.586 -6.568 1.00 0.00 C ATOM 845 O LEU B 329 0.111 -2.138 -6.270 1.00 0.00 O ATOM 846 CB LEU B 329 3.196 -1.205 -7.222 1.00 0.00 C ATOM 847 CG LEU B 329 4.367 -0.306 -6.817 1.00 0.00 C ATOM 848 CD1 LEU B 329 5.058 0.253 -8.049 1.00 0.00 C ATOM 849 CD2 LEU B 329 3.889 0.825 -5.918 1.00 0.00 C ATOM 0 H LEU B 329 4.315 -2.926 -5.844 1.00 0.00 H new ATOM 0 HA LEU B 329 2.221 -1.176 -5.310 1.00 0.00 H new ATOM 0 HB2 LEU B 329 3.561 -1.958 -7.921 1.00 0.00 H new ATOM 0 HB3 LEU B 329 2.464 -0.601 -7.758 1.00 0.00 H new ATOM 0 HG LEU B 329 5.085 -0.908 -6.260 1.00 0.00 H new ATOM 0 HD11 LEU B 329 5.888 0.890 -7.743 1.00 0.00 H new ATOM 0 HD12 LEU B 329 5.436 -0.568 -8.658 1.00 0.00 H new ATOM 0 HD13 LEU B 329 4.346 0.839 -8.631 1.00 0.00 H new ATOM 0 HD21 LEU B 329 4.736 1.453 -5.641 1.00 0.00 H new ATOM 0 HD22 LEU B 329 3.151 1.425 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU B 329 3.437 0.408 -5.018 1.00 0.00 H new ATOM 861 N GLU B 330 1.382 -3.665 -7.328 1.00 0.00 N ATOM 862 CA GLU B 330 0.245 -4.401 -7.871 1.00 0.00 C ATOM 863 C GLU B 330 -0.692 -4.852 -6.756 1.00 0.00 C ATOM 864 O GLU B 330 -1.911 -4.860 -6.926 1.00 0.00 O ATOM 865 CB GLU B 330 0.725 -5.610 -8.676 1.00 0.00 C ATOM 866 CG GLU B 330 1.445 -5.238 -9.963 1.00 0.00 C ATOM 867 CD GLU B 330 0.564 -4.457 -10.918 1.00 0.00 C ATOM 868 OE1 GLU B 330 -0.174 -5.093 -11.699 1.00 0.00 O ATOM 869 OE2 GLU B 330 0.611 -3.209 -10.885 1.00 0.00 O ATOM 0 H GLU B 330 2.292 -4.049 -7.582 1.00 0.00 H new ATOM 0 HA GLU B 330 -0.305 -3.733 -8.534 1.00 0.00 H new ATOM 0 HB2 GLU B 330 1.393 -6.207 -8.055 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -0.132 -6.238 -8.918 1.00 0.00 H new ATOM 0 HG2 GLU B 330 2.328 -4.646 -9.723 1.00 0.00 H new ATOM 0 HG3 GLU B 330 1.793 -6.146 -10.456 1.00 0.00 H new ATOM 876 N ILE B 331 -0.118 -5.232 -5.617 1.00 0.00 N ATOM 877 CA ILE B 331 -0.912 -5.672 -4.477 1.00 0.00 C ATOM 878 C ILE B 331 -1.841 -4.558 -4.012 1.00 0.00 C ATOM 879 O ILE B 331 -3.045 -4.764 -3.849 1.00 0.00 O ATOM 880 CB ILE B 331 -0.021 -6.107 -3.294 1.00 0.00 C ATOM 881 CG1 ILE B 331 0.898 -7.257 -3.709 1.00 0.00 C ATOM 882 CG2 ILE B 331 -0.881 -6.514 -2.103 1.00 0.00 C ATOM 883 CD1 ILE B 331 1.920 -7.629 -2.654 1.00 0.00 C ATOM 0 H ILE B 331 0.890 -5.244 -5.461 1.00 0.00 H new ATOM 0 HA ILE B 331 -1.497 -6.530 -4.808 1.00 0.00 H new ATOM 0 HB ILE B 331 0.600 -5.261 -3.000 1.00 0.00 H new ATOM 0 HG12 ILE B 331 0.290 -8.132 -3.938 1.00 0.00 H new ATOM 0 HG13 ILE B 331 1.419 -6.982 -4.626 1.00 0.00 H new ATOM 0 HG21 ILE B 331 -0.238 -6.818 -1.277 1.00 0.00 H new ATOM 0 HG22 ILE B 331 -1.496 -5.669 -1.792 1.00 0.00 H new ATOM 0 HG23 ILE B 331 -1.525 -7.346 -2.387 1.00 0.00 H new ATOM 0 HD11 ILE B 331 2.536 -8.451 -3.018 1.00 0.00 H new ATOM 0 HD12 ILE B 331 2.553 -6.768 -2.441 1.00 0.00 H new ATOM 0 HD13 ILE B 331 1.407 -7.936 -1.743 1.00 0.00 H new ATOM 895 N LEU B 332 -1.273 -3.374 -3.805 1.00 0.00 N ATOM 896 CA LEU B 332 -2.051 -2.226 -3.355 1.00 0.00 C ATOM 897 C LEU B 332 -3.110 -1.842 -4.386 1.00 0.00 C ATOM 898 O LEU B 332 -4.249 -1.537 -4.031 1.00 0.00 O ATOM 899 CB LEU B 332 -1.134 -1.033 -3.076 1.00 0.00 C ATOM 900 CG LEU B 332 0.101 -1.337 -2.221 1.00 0.00 C ATOM 901 CD1 LEU B 332 0.787 -0.045 -1.812 1.00 0.00 C ATOM 902 CD2 LEU B 332 -0.273 -2.153 -0.990 1.00 0.00 C ATOM 0 H LEU B 332 -0.280 -3.185 -3.941 1.00 0.00 H new ATOM 0 HA LEU B 332 -2.557 -2.507 -2.431 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -0.802 -0.621 -4.029 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -1.717 -0.257 -2.579 1.00 0.00 H new ATOM 0 HG LEU B 332 0.793 -1.929 -2.820 1.00 0.00 H new ATOM 0 HD11 LEU B 332 1.663 -0.274 -1.205 1.00 0.00 H new ATOM 0 HD12 LEU B 332 1.096 0.501 -2.703 1.00 0.00 H new ATOM 0 HD13 LEU B 332 0.095 0.567 -1.234 1.00 0.00 H new ATOM 0 HD21 LEU B 332 0.622 -2.354 -0.401 1.00 0.00 H new ATOM 0 HD22 LEU B 332 -0.987 -1.593 -0.385 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -0.722 -3.096 -1.301 1.00 0.00 H new ATOM 914 N HIS B 333 -2.728 -1.857 -5.662 1.00 0.00 N ATOM 915 CA HIS B 333 -3.654 -1.515 -6.738 1.00 0.00 C ATOM 916 C HIS B 333 -4.870 -2.435 -6.719 1.00 0.00 C ATOM 917 O HIS B 333 -6.008 -1.976 -6.821 1.00 0.00 O ATOM 918 CB HIS B 333 -2.957 -1.600 -8.098 1.00 0.00 C ATOM 919 CG HIS B 333 -2.091 -0.418 -8.409 1.00 0.00 C ATOM 920 ND1 HIS B 333 -2.600 0.830 -8.701 1.00 0.00 N ATOM 921 CD2 HIS B 333 -0.744 -0.298 -8.479 1.00 0.00 C ATOM 922 CE1 HIS B 333 -1.605 1.666 -8.937 1.00 0.00 C ATOM 923 NE2 HIS B 333 -0.468 1.006 -8.808 1.00 0.00 N ATOM 0 H HIS B 333 -1.788 -2.101 -5.974 1.00 0.00 H new ATOM 0 HA HIS B 333 -3.989 -0.490 -6.578 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -2.347 -2.503 -8.127 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -3.713 -1.700 -8.877 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -0.021 -1.082 -8.308 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -1.704 2.711 -9.192 1.00 0.00 H new ATOM 0 HE2 HIS B 333 0.464 1.401 -8.933 1.00 0.00 H new ATOM 932 N THR B 334 -4.622 -3.735 -6.589 1.00 0.00 N ATOM 933 CA THR B 334 -5.699 -4.716 -6.552 1.00 0.00 C ATOM 934 C THR B 334 -6.630 -4.444 -5.377 1.00 0.00 C ATOM 935 O THR B 334 -7.852 -4.470 -5.522 1.00 0.00 O ATOM 936 CB THR B 334 -5.154 -6.153 -6.446 1.00 0.00 C ATOM 937 OG1 THR B 334 -4.231 -6.405 -7.512 1.00 0.00 O ATOM 938 CG2 THR B 334 -6.286 -7.169 -6.500 1.00 0.00 C ATOM 0 H THR B 334 -3.686 -4.132 -6.508 1.00 0.00 H new ATOM 0 HA THR B 334 -6.252 -4.623 -7.487 1.00 0.00 H new ATOM 0 HB THR B 334 -4.643 -6.254 -5.489 1.00 0.00 H new ATOM 0 HG1 THR B 334 -3.403 -5.906 -7.353 1.00 0.00 H new ATOM 0 HG21 THR B 334 -5.875 -8.176 -6.423 1.00 0.00 H new ATOM 0 HG22 THR B 334 -6.973 -6.993 -5.672 1.00 0.00 H new ATOM 0 HG23 THR B 334 -6.822 -7.067 -7.444 1.00 0.00 H new ATOM 946 N TYR B 335 -6.042 -4.180 -4.214 1.00 0.00 N ATOM 947 CA TYR B 335 -6.819 -3.893 -3.014 1.00 0.00 C ATOM 948 C TYR B 335 -7.720 -2.682 -3.238 1.00 0.00 C ATOM 949 O TYR B 335 -8.845 -2.632 -2.742 1.00 0.00 O ATOM 950 CB TYR B 335 -5.889 -3.642 -1.824 1.00 0.00 C ATOM 951 CG TYR B 335 -6.616 -3.228 -0.563 1.00 0.00 C ATOM 952 CD1 TYR B 335 -7.097 -4.177 0.330 1.00 0.00 C ATOM 953 CD2 TYR B 335 -6.824 -1.886 -0.270 1.00 0.00 C ATOM 954 CE1 TYR B 335 -7.766 -3.800 1.479 1.00 0.00 C ATOM 955 CE2 TYR B 335 -7.492 -1.502 0.878 1.00 0.00 C ATOM 956 CZ TYR B 335 -7.960 -2.462 1.748 1.00 0.00 C ATOM 957 OH TYR B 335 -8.625 -2.083 2.892 1.00 0.00 O ATOM 0 H TYR B 335 -5.031 -4.159 -4.078 1.00 0.00 H new ATOM 0 HA TYR B 335 -7.445 -4.758 -2.795 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -5.318 -4.548 -1.623 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -5.172 -2.866 -2.091 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -6.946 -5.226 0.123 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -6.458 -1.131 -0.950 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -8.135 -4.550 2.163 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -7.646 -0.455 1.092 1.00 0.00 H new ATOM 0 HH TYR B 335 -8.676 -1.105 2.932 1.00 0.00 H new ATOM 967 N GLN B 336 -7.213 -1.708 -3.988 1.00 0.00 N ATOM 968 CA GLN B 336 -7.965 -0.493 -4.283 1.00 0.00 C ATOM 969 C GLN B 336 -9.193 -0.811 -5.131 1.00 0.00 C ATOM 970 O GLN B 336 -10.305 -0.394 -4.809 1.00 0.00 O ATOM 971 CB GLN B 336 -7.068 0.512 -5.014 1.00 0.00 C ATOM 972 CG GLN B 336 -7.497 1.964 -4.853 1.00 0.00 C ATOM 973 CD GLN B 336 -8.855 2.253 -5.462 1.00 0.00 C ATOM 974 OE1 GLN B 336 -9.899 2.176 -4.645 1.00 0.00 O flip ATOM 975 NE2 GLN B 336 -8.964 2.555 -6.650 1.00 0.00 N flip ATOM 0 H GLN B 336 -6.282 -1.737 -4.403 1.00 0.00 H new ATOM 0 HA GLN B 336 -8.300 -0.056 -3.342 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -6.047 0.404 -4.648 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -7.054 0.265 -6.075 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -7.520 2.214 -3.792 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -6.752 2.610 -5.317 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -8.135 2.602 -7.242 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -9.883 2.758 -7.042 1.00 0.00 H new ATOM 984 N LYS B 337 -8.985 -1.556 -6.212 1.00 0.00 N ATOM 985 CA LYS B 337 -10.076 -1.926 -7.108 1.00 0.00 C ATOM 986 C LYS B 337 -11.147 -2.730 -6.374 1.00 0.00 C ATOM 987 O LYS B 337 -12.338 -2.595 -6.655 1.00 0.00 O ATOM 988 CB LYS B 337 -9.540 -2.728 -8.296 1.00 0.00 C ATOM 989 CG LYS B 337 -10.617 -3.145 -9.286 1.00 0.00 C ATOM 990 CD LYS B 337 -10.034 -3.936 -10.447 1.00 0.00 C ATOM 991 CE LYS B 337 -9.623 -5.337 -10.022 1.00 0.00 C ATOM 992 NZ LYS B 337 -10.780 -6.125 -9.513 1.00 0.00 N ATOM 0 H LYS B 337 -8.072 -1.915 -6.489 1.00 0.00 H new ATOM 0 HA LYS B 337 -10.533 -1.007 -7.475 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -8.791 -2.132 -8.817 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -9.036 -3.620 -7.924 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -11.368 -3.748 -8.775 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -11.125 -2.259 -9.667 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -10.769 -4.000 -11.249 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -9.169 -3.409 -10.849 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -9.175 -5.856 -10.869 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -8.859 -5.272 -9.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -10.747 -7.086 -9.909 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -10.735 -6.176 -8.475 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -11.667 -5.663 -9.799 1.00 0.00 H new ATOM 1006 N GLU B 338 -10.717 -3.565 -5.433 1.00 0.00 N ATOM 1007 CA GLU B 338 -11.641 -4.392 -4.662 1.00 0.00 C ATOM 1008 C GLU B 338 -12.464 -3.545 -3.695 1.00 0.00 C ATOM 1009 O GLU B 338 -13.685 -3.683 -3.619 1.00 0.00 O ATOM 1010 CB GLU B 338 -10.873 -5.465 -3.889 1.00 0.00 C ATOM 1011 CG GLU B 338 -10.185 -6.485 -4.783 1.00 0.00 C ATOM 1012 CD GLU B 338 -11.157 -7.228 -5.678 1.00 0.00 C ATOM 1013 OE1 GLU B 338 -11.676 -8.280 -5.249 1.00 0.00 O ATOM 1014 OE2 GLU B 338 -11.399 -6.758 -6.811 1.00 0.00 O ATOM 0 H GLU B 338 -9.735 -3.687 -5.186 1.00 0.00 H new ATOM 0 HA GLU B 338 -12.324 -4.873 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -10.125 -4.982 -3.260 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -11.562 -5.984 -3.223 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -9.443 -5.979 -5.401 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -9.648 -7.202 -4.162 1.00 0.00 H new ATOM 1021 N GLN B 339 -11.784 -2.672 -2.960 1.00 0.00 N ATOM 1022 CA GLN B 339 -12.445 -1.803 -1.992 1.00 0.00 C ATOM 1023 C GLN B 339 -13.459 -0.897 -2.682 1.00 0.00 C ATOM 1024 O GLN B 339 -14.576 -0.715 -2.198 1.00 0.00 O ATOM 1025 CB GLN B 339 -11.407 -0.957 -1.250 1.00 0.00 C ATOM 1026 CG GLN B 339 -11.982 -0.168 -0.085 1.00 0.00 C ATOM 1027 CD GLN B 339 -10.940 0.689 0.609 1.00 0.00 C ATOM 1028 OE1 GLN B 339 -9.984 1.150 -0.014 1.00 0.00 O ATOM 1029 NE2 GLN B 339 -11.123 0.907 1.907 1.00 0.00 N ATOM 0 H GLN B 339 -10.773 -2.547 -3.016 1.00 0.00 H new ATOM 0 HA GLN B 339 -12.975 -2.430 -1.274 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -10.616 -1.610 -0.880 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -10.945 -0.264 -1.954 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -12.790 0.469 -0.446 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -12.419 -0.858 0.637 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -11.930 0.505 2.383 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -10.456 1.477 2.427 1.00 0.00 H new ATOM 1038 N ARG B 340 -13.059 -0.333 -3.817 1.00 0.00 N ATOM 1039 CA ARG B 340 -13.927 0.554 -4.581 1.00 0.00 C ATOM 1040 C ARG B 340 -15.133 -0.203 -5.125 1.00 0.00 C ATOM 1041 O ARG B 340 -16.256 0.300 -5.100 1.00 0.00 O ATOM 1042 CB ARG B 340 -13.147 1.194 -5.730 1.00 0.00 C ATOM 1043 CG ARG B 340 -13.982 2.127 -6.590 1.00 0.00 C ATOM 1044 CD ARG B 340 -13.176 2.674 -7.756 1.00 0.00 C ATOM 1045 NE ARG B 340 -13.971 3.556 -8.608 1.00 0.00 N ATOM 1046 CZ ARG B 340 -13.658 3.840 -9.868 1.00 0.00 C ATOM 1047 NH1 ARG B 340 -12.570 3.317 -10.419 1.00 0.00 N ATOM 1048 NH2 ARG B 340 -14.431 4.649 -10.578 1.00 0.00 N ATOM 0 H ARG B 340 -12.137 -0.475 -4.228 1.00 0.00 H new ATOM 0 HA ARG B 340 -14.286 1.338 -3.914 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -12.304 1.750 -5.320 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -12.734 0.406 -6.360 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -14.855 1.594 -6.967 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -14.351 2.953 -5.982 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -12.313 3.220 -7.375 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -12.792 1.845 -8.351 1.00 0.00 H new ATOM 0 HE ARG B 340 -14.812 3.977 -8.214 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -11.971 2.695 -9.875 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -12.332 3.537 -11.386 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -15.267 5.054 -10.158 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -14.190 4.866 -11.545 1.00 0.00 H new ATOM 1062 N ASN B 341 -14.891 -1.415 -5.619 1.00 0.00 N ATOM 1063 CA ASN B 341 -15.958 -2.244 -6.166 1.00 0.00 C ATOM 1064 C ASN B 341 -17.038 -2.482 -5.118 1.00 0.00 C ATOM 1065 O ASN B 341 -18.230 -2.376 -5.403 1.00 0.00 O ATOM 1066 CB ASN B 341 -15.398 -3.584 -6.645 1.00 0.00 C ATOM 1067 CG ASN B 341 -16.345 -4.308 -7.582 1.00 0.00 C ATOM 1068 OD1 ASN B 341 -17.565 -4.177 -7.474 1.00 0.00 O ATOM 1069 ND2 ASN B 341 -15.787 -5.076 -8.510 1.00 0.00 N ATOM 0 H ASN B 341 -13.966 -1.843 -5.651 1.00 0.00 H new ATOM 0 HA ASN B 341 -16.398 -1.720 -7.014 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -14.448 -3.416 -7.152 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -15.191 -4.217 -5.782 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -16.374 -5.587 -9.170 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -14.771 -5.155 -8.563 1.00 0.00 H new ATOM 1076 N ALA B 342 -16.606 -2.806 -3.905 1.00 0.00 N ATOM 1077 CA ALA B 342 -17.529 -3.058 -2.804 1.00 0.00 C ATOM 1078 C ALA B 342 -18.320 -1.802 -2.450 1.00 0.00 C ATOM 1079 O ALA B 342 -19.537 -1.855 -2.268 1.00 0.00 O ATOM 1080 CB ALA B 342 -16.773 -3.569 -1.587 1.00 0.00 C ATOM 0 H ALA B 342 -15.621 -2.901 -3.658 1.00 0.00 H new ATOM 0 HA ALA B 342 -18.237 -3.822 -3.125 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -17.475 -3.753 -0.773 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -16.260 -4.497 -1.840 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -16.041 -2.824 -1.274 1.00 0.00 H new ATOM 1086 N LYS B 343 -17.621 -0.675 -2.352 1.00 0.00 N ATOM 1087 CA LYS B 343 -18.258 0.594 -2.019 1.00 0.00 C ATOM 1088 C LYS B 343 -19.159 1.068 -3.155 1.00 0.00 C ATOM 1089 O LYS B 343 -20.058 1.884 -2.948 1.00 0.00 O ATOM 1090 CB LYS B 343 -17.199 1.658 -1.714 1.00 0.00 C ATOM 1091 CG LYS B 343 -16.337 1.334 -0.503 1.00 0.00 C ATOM 1092 CD LYS B 343 -17.143 1.364 0.786 1.00 0.00 C ATOM 1093 CE LYS B 343 -16.284 1.010 1.990 1.00 0.00 C ATOM 1094 NZ LYS B 343 -15.160 1.969 2.174 1.00 0.00 N ATOM 0 H LYS B 343 -16.613 -0.615 -2.499 1.00 0.00 H new ATOM 0 HA LYS B 343 -18.873 0.439 -1.133 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -16.555 1.777 -2.585 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -17.695 2.615 -1.550 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -15.889 0.349 -0.629 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -15.518 2.051 -0.437 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -17.573 2.356 0.924 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -17.975 0.663 0.713 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -16.903 1.001 2.887 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -15.885 0.003 1.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.724 1.819 3.106 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -14.449 1.817 1.431 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -15.521 2.943 2.113 1.00 0.00 H new ATOM 1108 N GLU B 344 -18.915 0.549 -4.355 1.00 0.00 N ATOM 1109 CA GLU B 344 -19.706 0.920 -5.524 1.00 0.00 C ATOM 1110 C GLU B 344 -20.831 -0.083 -5.757 1.00 0.00 C ATOM 1111 O GLU B 344 -21.798 0.205 -6.463 1.00 0.00 O ATOM 1112 CB GLU B 344 -18.815 1.002 -6.766 1.00 0.00 C ATOM 1113 CG GLU B 344 -19.512 1.595 -7.980 1.00 0.00 C ATOM 1114 CD GLU B 344 -19.974 3.020 -7.749 1.00 0.00 C ATOM 1115 OE1 GLU B 344 -19.123 3.934 -7.791 1.00 0.00 O ATOM 1116 OE2 GLU B 344 -21.186 3.223 -7.524 1.00 0.00 O ATOM 0 H GLU B 344 -18.177 -0.129 -4.543 1.00 0.00 H new ATOM 0 HA GLU B 344 -20.147 1.899 -5.338 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -17.936 1.603 -6.533 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -18.460 0.002 -7.014 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -18.833 1.571 -8.832 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -20.371 0.976 -8.239 1.00 0.00 H new ATOM 1123 N ALA B 345 -20.697 -1.261 -5.157 1.00 0.00 N ATOM 1124 CA ALA B 345 -21.700 -2.310 -5.295 1.00 0.00 C ATOM 1125 C ALA B 345 -22.911 -2.026 -4.414 1.00 0.00 C ATOM 1126 O ALA B 345 -23.897 -2.763 -4.440 1.00 0.00 O ATOM 1127 CB ALA B 345 -21.097 -3.664 -4.946 1.00 0.00 C ATOM 0 H ALA B 345 -19.902 -1.513 -4.570 1.00 0.00 H new ATOM 0 HA ALA B 345 -22.033 -2.329 -6.333 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -21.856 -4.439 -5.053 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -20.265 -3.876 -5.618 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -20.738 -3.648 -3.917 1.00 0.00 H new ATOM 1133 N GLY B 346 -22.829 -0.952 -3.635 1.00 0.00 N ATOM 1134 CA GLY B 346 -23.923 -0.586 -2.756 1.00 0.00 C ATOM 1135 C GLY B 346 -23.786 -1.194 -1.374 1.00 0.00 C ATOM 1136 O GLY B 346 -23.639 -0.477 -0.385 1.00 0.00 O ATOM 0 H GLY B 346 -22.023 -0.328 -3.597 1.00 0.00 H new ATOM 0 HA2 GLY B 346 -23.967 0.500 -2.669 1.00 0.00 H new ATOM 0 HA3 GLY B 346 -24.865 -0.909 -3.200 1.00 0.00 H new ATOM 1140 N GLY B 347 -23.832 -2.521 -1.309 1.00 0.00 N ATOM 1141 CA GLY B 347 -23.711 -3.207 -0.036 1.00 0.00 C ATOM 1142 C GLY B 347 -23.543 -4.704 -0.199 1.00 0.00 C ATOM 1143 O GLY B 347 -22.639 -5.300 0.387 1.00 0.00 O ATOM 0 H GLY B 347 -23.951 -3.134 -2.116 1.00 0.00 H new ATOM 0 HA2 GLY B 347 -22.857 -2.806 0.510 1.00 0.00 H new ATOM 0 HA3 GLY B 347 -24.597 -3.007 0.567 1.00 0.00 H new ATOM 1147 N ASN B 348 -24.415 -5.313 -0.997 1.00 0.00 N ATOM 1148 CA ASN B 348 -24.357 -6.750 -1.236 1.00 0.00 C ATOM 1149 C ASN B 348 -23.173 -7.102 -2.129 1.00 0.00 C ATOM 1150 O ASN B 348 -23.266 -7.029 -3.354 1.00 0.00 O ATOM 1151 CB ASN B 348 -25.655 -7.239 -1.881 1.00 0.00 C ATOM 1152 CG ASN B 348 -26.866 -7.019 -0.996 1.00 0.00 C ATOM 1153 OD1 ASN B 348 -26.919 -6.065 -0.219 1.00 0.00 O ATOM 1154 ND2 ASN B 348 -27.848 -7.905 -1.109 1.00 0.00 N ATOM 0 H ASN B 348 -25.169 -4.834 -1.488 1.00 0.00 H new ATOM 0 HA ASN B 348 -24.230 -7.246 -0.274 1.00 0.00 H new ATOM 0 HB2 ASN B 348 -25.803 -6.721 -2.828 1.00 0.00 H new ATOM 0 HB3 ASN B 348 -25.565 -8.301 -2.110 1.00 0.00 H new ATOM 0 HD21 ASN B 348 -28.688 -7.810 -0.539 1.00 0.00 H new ATOM 0 HD22 ASN B 348 -27.762 -8.681 -1.766 1.00 0.00 H new ATOM 1161 N TYR B 349 -22.061 -7.480 -1.506 1.00 0.00 N ATOM 1162 CA TYR B 349 -20.855 -7.842 -2.244 1.00 0.00 C ATOM 1163 C TYR B 349 -19.784 -8.380 -1.301 1.00 0.00 C ATOM 1164 O TYR B 349 -19.642 -7.907 -0.174 1.00 0.00 O ATOM 1165 CB TYR B 349 -20.317 -6.630 -3.008 1.00 0.00 C ATOM 1166 CG TYR B 349 -19.134 -6.945 -3.896 1.00 0.00 C ATOM 1167 CD1 TYR B 349 -19.315 -7.532 -5.143 1.00 0.00 C ATOM 1168 CD2 TYR B 349 -17.839 -6.655 -3.489 1.00 0.00 C ATOM 1169 CE1 TYR B 349 -18.238 -7.820 -5.959 1.00 0.00 C ATOM 1170 CE2 TYR B 349 -16.755 -6.939 -4.300 1.00 0.00 C ATOM 1171 CZ TYR B 349 -16.960 -7.521 -5.534 1.00 0.00 C ATOM 1172 OH TYR B 349 -15.885 -7.806 -6.344 1.00 0.00 O ATOM 0 H TYR B 349 -21.970 -7.544 -0.492 1.00 0.00 H new ATOM 0 HA TYR B 349 -21.114 -8.625 -2.956 1.00 0.00 H new ATOM 0 HB2 TYR B 349 -21.117 -6.213 -3.619 1.00 0.00 H new ATOM 0 HB3 TYR B 349 -20.028 -5.860 -2.293 1.00 0.00 H new ATOM 0 HD1 TYR B 349 -20.314 -7.767 -5.479 1.00 0.00 H new ATOM 0 HD2 TYR B 349 -17.675 -6.200 -2.523 1.00 0.00 H new ATOM 0 HE1 TYR B 349 -18.396 -8.277 -6.925 1.00 0.00 H new ATOM 0 HE2 TYR B 349 -15.754 -6.706 -3.969 1.00 0.00 H new ATOM 0 HH TYR B 349 -15.057 -7.532 -5.897 1.00 0.00 H new ATOM 1182 N THR B 350 -19.031 -9.370 -1.771 1.00 0.00 N ATOM 1183 CA THR B 350 -17.971 -9.969 -0.970 1.00 0.00 C ATOM 1184 C THR B 350 -16.615 -9.848 -1.670 1.00 0.00 C ATOM 1185 O THR B 350 -16.339 -10.568 -2.630 1.00 0.00 O ATOM 1186 CB THR B 350 -18.260 -11.453 -0.671 1.00 0.00 C ATOM 1187 OG1 THR B 350 -17.096 -12.079 -0.119 1.00 0.00 O ATOM 1188 CG2 THR B 350 -18.692 -12.190 -1.930 1.00 0.00 C ATOM 0 H THR B 350 -19.136 -9.773 -2.702 1.00 0.00 H new ATOM 0 HA THR B 350 -17.937 -9.421 -0.028 1.00 0.00 H new ATOM 0 HB THR B 350 -19.074 -11.500 0.052 1.00 0.00 H new ATOM 0 HG1 THR B 350 -17.289 -13.021 0.069 1.00 0.00 H new ATOM 0 HG21 THR B 350 -18.889 -13.235 -1.690 1.00 0.00 H new ATOM 0 HG22 THR B 350 -19.597 -11.731 -2.327 1.00 0.00 H new ATOM 0 HG23 THR B 350 -17.899 -12.132 -2.676 1.00 0.00 H new ATOM 1196 N PRO B 351 -15.748 -8.928 -1.203 1.00 0.00 N ATOM 1197 CA PRO B 351 -14.423 -8.723 -1.798 1.00 0.00 C ATOM 1198 C PRO B 351 -13.523 -9.943 -1.641 1.00 0.00 C ATOM 1199 O PRO B 351 -13.656 -10.707 -0.685 1.00 0.00 O ATOM 1200 CB PRO B 351 -13.854 -7.533 -1.018 1.00 0.00 C ATOM 1201 CG PRO B 351 -14.610 -7.519 0.265 1.00 0.00 C ATOM 1202 CD PRO B 351 -15.986 -8.022 -0.065 1.00 0.00 C ATOM 0 HA PRO B 351 -14.485 -8.550 -2.872 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -12.784 -7.649 -0.845 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -13.989 -6.601 -1.566 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -14.129 -8.154 1.009 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -14.651 -6.513 0.684 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -16.437 -8.545 0.779 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -16.659 -7.208 -0.332 1.00 0.00 H new ATOM 1210 N ALA B 352 -12.606 -10.119 -2.587 1.00 0.00 N ATOM 1211 CA ALA B 352 -11.682 -11.246 -2.558 1.00 0.00 C ATOM 1212 C ALA B 352 -10.335 -10.842 -1.966 1.00 0.00 C ATOM 1213 O ALA B 352 -9.476 -11.690 -1.721 1.00 0.00 O ATOM 1214 CB ALA B 352 -11.497 -11.811 -3.959 1.00 0.00 C ATOM 0 H ALA B 352 -12.483 -9.494 -3.384 1.00 0.00 H new ATOM 0 HA ALA B 352 -12.111 -12.018 -1.919 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -10.805 -12.652 -3.924 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -12.459 -12.149 -4.345 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -11.095 -11.037 -4.613 1.00 0.00 H new ATOM 1220 N LEU B 353 -10.156 -9.544 -1.737 1.00 0.00 N ATOM 1221 CA LEU B 353 -8.912 -9.031 -1.174 1.00 0.00 C ATOM 1222 C LEU B 353 -9.191 -7.970 -0.114 1.00 0.00 C ATOM 1223 O LEU B 353 -9.639 -6.868 -0.428 1.00 0.00 O ATOM 1224 CB LEU B 353 -8.031 -8.446 -2.282 1.00 0.00 C ATOM 1225 CG LEU B 353 -6.640 -7.984 -1.836 1.00 0.00 C ATOM 1226 CD1 LEU B 353 -5.825 -9.158 -1.315 1.00 0.00 C ATOM 1227 CD2 LEU B 353 -5.914 -7.302 -2.985 1.00 0.00 C ATOM 0 H LEU B 353 -10.857 -8.829 -1.933 1.00 0.00 H new ATOM 0 HA LEU B 353 -8.386 -9.860 -0.701 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -7.913 -9.196 -3.064 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -8.552 -7.599 -2.728 1.00 0.00 H new ATOM 0 HG LEU B 353 -6.761 -7.265 -1.026 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -4.841 -8.808 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -6.337 -9.607 -0.464 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -5.713 -9.902 -2.104 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -4.927 -6.980 -2.652 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -5.806 -8.002 -3.814 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -6.487 -6.435 -3.314 1.00 0.00 H new ATOM 1239 N THR B 354 -8.921 -8.312 1.144 1.00 0.00 N ATOM 1240 CA THR B 354 -9.144 -7.392 2.255 1.00 0.00 C ATOM 1241 C THR B 354 -7.833 -7.024 2.939 1.00 0.00 C ATOM 1242 O THR B 354 -6.755 -7.397 2.478 1.00 0.00 O ATOM 1243 CB THR B 354 -10.099 -7.996 3.301 1.00 0.00 C ATOM 1244 OG1 THR B 354 -9.584 -9.247 3.773 1.00 0.00 O ATOM 1245 CG2 THR B 354 -11.487 -8.201 2.712 1.00 0.00 C ATOM 0 H THR B 354 -8.547 -9.220 1.419 1.00 0.00 H new ATOM 0 HA THR B 354 -9.596 -6.494 1.833 1.00 0.00 H new ATOM 0 HB THR B 354 -10.175 -7.299 4.136 1.00 0.00 H new ATOM 0 HG1 THR B 354 -10.197 -9.623 4.439 1.00 0.00 H new ATOM 0 HG21 THR B 354 -12.144 -8.629 3.469 1.00 0.00 H new ATOM 0 HG22 THR B 354 -11.888 -7.242 2.383 1.00 0.00 H new ATOM 0 HG23 THR B 354 -11.425 -8.879 1.861 1.00 0.00 H new ATOM 1253 N GLU B 355 -7.934 -6.289 4.044 1.00 0.00 N ATOM 1254 CA GLU B 355 -6.757 -5.867 4.794 1.00 0.00 C ATOM 1255 C GLU B 355 -5.965 -7.070 5.296 1.00 0.00 C ATOM 1256 O GLU B 355 -4.748 -7.138 5.124 1.00 0.00 O ATOM 1257 CB GLU B 355 -7.167 -4.983 5.973 1.00 0.00 C ATOM 1258 CG GLU B 355 -7.917 -3.727 5.559 1.00 0.00 C ATOM 1259 CD GLU B 355 -8.265 -2.837 6.737 1.00 0.00 C ATOM 1260 OE1 GLU B 355 -9.325 -3.061 7.357 1.00 0.00 O ATOM 1261 OE2 GLU B 355 -7.477 -1.916 7.037 1.00 0.00 O ATOM 0 H GLU B 355 -8.820 -5.974 4.439 1.00 0.00 H new ATOM 0 HA GLU B 355 -6.119 -5.293 4.122 1.00 0.00 H new ATOM 0 HB2 GLU B 355 -7.793 -5.563 6.651 1.00 0.00 H new ATOM 0 HB3 GLU B 355 -6.275 -4.697 6.529 1.00 0.00 H new ATOM 0 HG2 GLU B 355 -7.310 -3.164 4.850 1.00 0.00 H new ATOM 0 HG3 GLU B 355 -8.833 -4.010 5.040 1.00 0.00 H new ATOM 1268 N GLN B 356 -6.661 -8.015 5.922 1.00 0.00 N ATOM 1269 CA GLN B 356 -6.021 -9.217 6.446 1.00 0.00 C ATOM 1270 C GLN B 356 -5.361 -10.008 5.321 1.00 0.00 C ATOM 1271 O GLN B 356 -4.232 -10.482 5.458 1.00 0.00 O ATOM 1272 CB GLN B 356 -7.047 -10.094 7.167 1.00 0.00 C ATOM 1273 CG GLN B 356 -6.446 -11.328 7.822 1.00 0.00 C ATOM 1274 CD GLN B 356 -5.450 -10.987 8.914 1.00 0.00 C ATOM 1275 OE1 GLN B 356 -5.669 -9.863 9.588 1.00 0.00 O flip ATOM 1276 NE2 GLN B 356 -4.497 -11.729 9.153 1.00 0.00 N flip ATOM 0 H GLN B 356 -7.668 -7.971 6.079 1.00 0.00 H new ATOM 0 HA GLN B 356 -5.253 -8.913 7.157 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -7.550 -9.498 7.929 1.00 0.00 H new ATOM 0 HB3 GLN B 356 -7.809 -10.407 6.453 1.00 0.00 H new ATOM 0 HG2 GLN B 356 -7.246 -11.936 8.243 1.00 0.00 H new ATOM 0 HG3 GLN B 356 -5.952 -11.933 7.062 1.00 0.00 H new ATOM 0 HE21 GLN B 356 -4.367 -12.583 8.610 1.00 0.00 H new ATOM 0 HE22 GLN B 356 -3.838 -11.490 9.894 1.00 0.00 H new ATOM 1285 N GLU B 357 -6.077 -10.145 4.209 1.00 0.00 N ATOM 1286 CA GLU B 357 -5.569 -10.874 3.055 1.00 0.00 C ATOM 1287 C GLU B 357 -4.287 -10.235 2.529 1.00 0.00 C ATOM 1288 O GLU B 357 -3.344 -10.933 2.154 1.00 0.00 O ATOM 1289 CB GLU B 357 -6.627 -10.917 1.952 1.00 0.00 C ATOM 1290 CG GLU B 357 -6.282 -11.863 0.814 1.00 0.00 C ATOM 1291 CD GLU B 357 -6.106 -13.295 1.278 1.00 0.00 C ATOM 1292 OE1 GLU B 357 -7.125 -14.008 1.406 1.00 0.00 O ATOM 1293 OE2 GLU B 357 -4.950 -13.705 1.514 1.00 0.00 O ATOM 0 H GLU B 357 -7.013 -9.759 4.084 1.00 0.00 H new ATOM 0 HA GLU B 357 -5.340 -11.893 3.368 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -7.581 -11.217 2.386 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -6.762 -9.913 1.550 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -7.070 -11.823 0.062 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -5.364 -11.526 0.332 1.00 0.00 H new ATOM 1300 N VAL B 358 -4.257 -8.905 2.504 1.00 0.00 N ATOM 1301 CA VAL B 358 -3.083 -8.181 2.032 1.00 0.00 C ATOM 1302 C VAL B 358 -1.900 -8.415 2.964 1.00 0.00 C ATOM 1303 O VAL B 358 -0.786 -8.662 2.513 1.00 0.00 O ATOM 1304 CB VAL B 358 -3.357 -6.664 1.913 1.00 0.00 C ATOM 1305 CG1 VAL B 358 -2.062 -5.883 1.726 1.00 0.00 C ATOM 1306 CG2 VAL B 358 -4.309 -6.390 0.761 1.00 0.00 C ATOM 0 H VAL B 358 -5.029 -8.310 2.804 1.00 0.00 H new ATOM 0 HA VAL B 358 -2.844 -8.564 1.040 1.00 0.00 H new ATOM 0 HB VAL B 358 -3.820 -6.331 2.842 1.00 0.00 H new ATOM 0 HG11 VAL B 358 -2.287 -4.820 1.645 1.00 0.00 H new ATOM 0 HG12 VAL B 358 -1.408 -6.052 2.582 1.00 0.00 H new ATOM 0 HG13 VAL B 358 -1.563 -6.218 0.817 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -4.493 -5.318 0.688 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -3.866 -6.746 -0.169 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -5.251 -6.909 0.936 1.00 0.00 H new ATOM 1316 N TYR B 359 -2.153 -8.345 4.266 1.00 0.00 N ATOM 1317 CA TYR B 359 -1.105 -8.556 5.258 1.00 0.00 C ATOM 1318 C TYR B 359 -0.459 -9.926 5.074 1.00 0.00 C ATOM 1319 O TYR B 359 0.761 -10.064 5.159 1.00 0.00 O ATOM 1320 CB TYR B 359 -1.679 -8.431 6.672 1.00 0.00 C ATOM 1321 CG TYR B 359 -0.652 -8.605 7.769 1.00 0.00 C ATOM 1322 CD1 TYR B 359 0.158 -7.547 8.161 1.00 0.00 C ATOM 1323 CD2 TYR B 359 -0.496 -9.826 8.416 1.00 0.00 C ATOM 1324 CE1 TYR B 359 1.095 -7.699 9.166 1.00 0.00 C ATOM 1325 CE2 TYR B 359 0.438 -9.985 9.423 1.00 0.00 C ATOM 1326 CZ TYR B 359 1.231 -8.919 9.793 1.00 0.00 C ATOM 1327 OH TYR B 359 2.161 -9.073 10.794 1.00 0.00 O ATOM 0 H TYR B 359 -3.073 -8.144 4.659 1.00 0.00 H new ATOM 0 HA TYR B 359 -0.341 -7.791 5.118 1.00 0.00 H new ATOM 0 HB2 TYR B 359 -2.147 -7.452 6.778 1.00 0.00 H new ATOM 0 HB3 TYR B 359 -2.464 -9.176 6.802 1.00 0.00 H new ATOM 0 HD1 TYR B 359 0.054 -6.589 7.672 1.00 0.00 H new ATOM 0 HD2 TYR B 359 -1.114 -10.663 8.127 1.00 0.00 H new ATOM 0 HE1 TYR B 359 1.717 -6.866 9.458 1.00 0.00 H new ATOM 0 HE2 TYR B 359 0.546 -10.939 9.917 1.00 0.00 H new ATOM 0 HH TYR B 359 2.129 -9.992 11.132 1.00 0.00 H new ATOM 1337 N ALA B 360 -1.287 -10.932 4.813 1.00 0.00 N ATOM 1338 CA ALA B 360 -0.802 -12.294 4.618 1.00 0.00 C ATOM 1339 C ALA B 360 0.066 -12.405 3.366 1.00 0.00 C ATOM 1340 O ALA B 360 1.172 -12.943 3.414 1.00 0.00 O ATOM 1341 CB ALA B 360 -1.974 -13.261 4.539 1.00 0.00 C ATOM 0 H ALA B 360 -2.299 -10.830 4.731 1.00 0.00 H new ATOM 0 HA ALA B 360 -0.181 -12.556 5.475 1.00 0.00 H new ATOM 0 HB1 ALA B 360 -1.600 -14.275 4.393 1.00 0.00 H new ATOM 0 HB2 ALA B 360 -2.547 -13.215 5.465 1.00 0.00 H new ATOM 0 HB3 ALA B 360 -2.616 -12.987 3.702 1.00 0.00 H new ATOM 1347 N GLN B 361 -0.442 -11.894 2.248 1.00 0.00 N ATOM 1348 CA GLN B 361 0.287 -11.942 0.983 1.00 0.00 C ATOM 1349 C GLN B 361 1.611 -11.186 1.075 1.00 0.00 C ATOM 1350 O GLN B 361 2.667 -11.725 0.739 1.00 0.00 O ATOM 1351 CB GLN B 361 -0.570 -11.360 -0.145 1.00 0.00 C ATOM 1352 CG GLN B 361 -1.831 -12.162 -0.426 1.00 0.00 C ATOM 1353 CD GLN B 361 -2.679 -11.553 -1.528 1.00 0.00 C ATOM 1354 OE1 GLN B 361 -2.646 -10.230 -1.641 1.00 0.00 O flip ATOM 1355 NE2 GLN B 361 -3.360 -12.264 -2.267 1.00 0.00 N flip ATOM 0 H GLN B 361 -1.355 -11.442 2.192 1.00 0.00 H new ATOM 0 HA GLN B 361 0.508 -12.987 0.765 1.00 0.00 H new ATOM 0 HB2 GLN B 361 -0.849 -10.338 0.112 1.00 0.00 H new ATOM 0 HB3 GLN B 361 0.028 -11.308 -1.055 1.00 0.00 H new ATOM 0 HG2 GLN B 361 -1.555 -13.179 -0.705 1.00 0.00 H new ATOM 0 HG3 GLN B 361 -2.423 -12.232 0.486 1.00 0.00 H new ATOM 0 HE21 GLN B 361 -3.356 -13.277 -2.146 1.00 0.00 H new ATOM 0 HE22 GLN B 361 -3.928 -11.840 -3.001 1.00 0.00 H new ATOM 1364 N VAL B 362 1.550 -9.939 1.532 1.00 0.00 N ATOM 1365 CA VAL B 362 2.747 -9.115 1.667 1.00 0.00 C ATOM 1366 C VAL B 362 3.745 -9.758 2.626 1.00 0.00 C ATOM 1367 O VAL B 362 4.955 -9.624 2.456 1.00 0.00 O ATOM 1368 CB VAL B 362 2.409 -7.694 2.168 1.00 0.00 C ATOM 1369 CG1 VAL B 362 3.664 -6.837 2.240 1.00 0.00 C ATOM 1370 CG2 VAL B 362 1.369 -7.040 1.272 1.00 0.00 C ATOM 0 H VAL B 362 0.686 -9.477 1.815 1.00 0.00 H new ATOM 0 HA VAL B 362 3.191 -9.039 0.675 1.00 0.00 H new ATOM 0 HB VAL B 362 1.992 -7.779 3.172 1.00 0.00 H new ATOM 0 HG11 VAL B 362 3.404 -5.840 2.595 1.00 0.00 H new ATOM 0 HG12 VAL B 362 4.377 -7.293 2.927 1.00 0.00 H new ATOM 0 HG13 VAL B 362 4.112 -6.764 1.249 1.00 0.00 H new ATOM 0 HG21 VAL B 362 1.146 -6.040 1.644 1.00 0.00 H new ATOM 0 HG22 VAL B 362 1.756 -6.971 0.255 1.00 0.00 H new ATOM 0 HG23 VAL B 362 0.458 -7.639 1.274 1.00 0.00 H new ATOM 1380 N ALA B 363 3.227 -10.456 3.632 1.00 0.00 N ATOM 1381 CA ALA B 363 4.074 -11.122 4.615 1.00 0.00 C ATOM 1382 C ALA B 363 4.873 -12.253 3.978 1.00 0.00 C ATOM 1383 O ALA B 363 6.073 -12.389 4.215 1.00 0.00 O ATOM 1384 CB ALA B 363 3.230 -11.659 5.762 1.00 0.00 C ATOM 0 H ALA B 363 2.226 -10.575 3.788 1.00 0.00 H new ATOM 0 HA ALA B 363 4.778 -10.387 5.005 1.00 0.00 H new ATOM 0 HB1 ALA B 363 3.875 -12.154 6.488 1.00 0.00 H new ATOM 0 HB2 ALA B 363 2.706 -10.834 6.245 1.00 0.00 H new ATOM 0 HB3 ALA B 363 2.504 -12.374 5.376 1.00 0.00 H new ATOM 1390 N ARG B 364 4.198 -13.063 3.169 1.00 0.00 N ATOM 1391 CA ARG B 364 4.842 -14.188 2.500 1.00 0.00 C ATOM 1392 C ARG B 364 5.894 -13.712 1.502 1.00 0.00 C ATOM 1393 O ARG B 364 6.964 -14.310 1.385 1.00 0.00 O ATOM 1394 CB ARG B 364 3.797 -15.049 1.787 1.00 0.00 C ATOM 1395 CG ARG B 364 4.392 -16.208 1.003 1.00 0.00 C ATOM 1396 CD ARG B 364 3.313 -17.019 0.302 1.00 0.00 C ATOM 1397 NE ARG B 364 2.403 -17.657 1.250 1.00 0.00 N ATOM 1398 CZ ARG B 364 1.258 -18.236 0.899 1.00 0.00 C ATOM 1399 NH1 ARG B 364 0.882 -18.251 -0.373 1.00 0.00 N ATOM 1400 NH2 ARG B 364 0.490 -18.802 1.819 1.00 0.00 N ATOM 0 H ARG B 364 3.205 -12.961 2.961 1.00 0.00 H new ATOM 0 HA ARG B 364 5.343 -14.787 3.261 1.00 0.00 H new ATOM 0 HB2 ARG B 364 3.098 -15.442 2.525 1.00 0.00 H new ATOM 0 HB3 ARG B 364 3.222 -14.419 1.108 1.00 0.00 H new ATOM 0 HG2 ARG B 364 5.098 -15.826 0.266 1.00 0.00 H new ATOM 0 HG3 ARG B 364 4.954 -16.854 1.677 1.00 0.00 H new ATOM 0 HD2 ARG B 364 2.745 -16.368 -0.363 1.00 0.00 H new ATOM 0 HD3 ARG B 364 3.780 -17.782 -0.321 1.00 0.00 H new ATOM 0 HE ARG B 364 2.660 -17.659 2.237 1.00 0.00 H new ATOM 0 HH11 ARG B 364 1.471 -17.818 -1.084 1.00 0.00 H new ATOM 0 HH12 ARG B 364 0.004 -18.696 -0.640 1.00 0.00 H new ATOM 0 HH21 ARG B 364 0.777 -18.794 2.798 1.00 0.00 H new ATOM 0 HH22 ARG B 364 -0.388 -19.246 1.548 1.00 0.00 H new ATOM 1414 N LEU B 365 5.587 -12.634 0.785 1.00 0.00 N ATOM 1415 CA LEU B 365 6.510 -12.091 -0.202 1.00 0.00 C ATOM 1416 C LEU B 365 7.659 -11.352 0.489 1.00 0.00 C ATOM 1417 O LEU B 365 8.782 -11.327 -0.015 1.00 0.00 O ATOM 1418 CB LEU B 365 5.749 -11.185 -1.186 1.00 0.00 C ATOM 1419 CG LEU B 365 6.236 -9.744 -1.301 1.00 0.00 C ATOM 1420 CD1 LEU B 365 7.455 -9.660 -2.208 1.00 0.00 C ATOM 1421 CD2 LEU B 365 5.124 -8.846 -1.819 1.00 0.00 C ATOM 0 H LEU B 365 4.709 -12.122 0.870 1.00 0.00 H new ATOM 0 HA LEU B 365 6.951 -12.907 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU B 365 5.796 -11.641 -2.175 1.00 0.00 H new ATOM 0 HB3 LEU B 365 4.700 -11.168 -0.892 1.00 0.00 H new ATOM 0 HG LEU B 365 6.524 -9.399 -0.308 1.00 0.00 H new ATOM 0 HD11 LEU B 365 7.787 -8.624 -2.277 1.00 0.00 H new ATOM 0 HD12 LEU B 365 8.258 -10.271 -1.796 1.00 0.00 H new ATOM 0 HD13 LEU B 365 7.195 -10.024 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU B 365 5.489 -7.822 -1.895 1.00 0.00 H new ATOM 0 HD22 LEU B 365 4.806 -9.192 -2.803 1.00 0.00 H new ATOM 0 HD23 LEU B 365 4.279 -8.880 -1.132 1.00 0.00 H new ATOM 1433 N PHE B 366 7.375 -10.765 1.651 1.00 0.00 N ATOM 1434 CA PHE B 366 8.396 -10.049 2.417 1.00 0.00 C ATOM 1435 C PHE B 366 8.900 -10.914 3.565 1.00 0.00 C ATOM 1436 O PHE B 366 8.314 -10.929 4.648 1.00 0.00 O ATOM 1437 CB PHE B 366 7.848 -8.725 2.968 1.00 0.00 C ATOM 1438 CG PHE B 366 7.700 -7.625 1.945 1.00 0.00 C ATOM 1439 CD1 PHE B 366 8.043 -7.827 0.616 1.00 0.00 C ATOM 1440 CD2 PHE B 366 7.206 -6.386 2.319 1.00 0.00 C ATOM 1441 CE1 PHE B 366 7.897 -6.821 -0.315 1.00 0.00 C ATOM 1442 CE2 PHE B 366 7.059 -5.372 1.391 1.00 0.00 C ATOM 1443 CZ PHE B 366 7.405 -5.590 0.071 1.00 0.00 C ATOM 0 H PHE B 366 6.450 -10.771 2.082 1.00 0.00 H new ATOM 0 HA PHE B 366 9.223 -9.826 1.743 1.00 0.00 H new ATOM 0 HB2 PHE B 366 6.875 -8.912 3.423 1.00 0.00 H new ATOM 0 HB3 PHE B 366 8.509 -8.377 3.762 1.00 0.00 H new ATOM 0 HD1 PHE B 366 8.430 -8.787 0.306 1.00 0.00 H new ATOM 0 HD2 PHE B 366 6.932 -6.210 3.349 1.00 0.00 H new ATOM 0 HE1 PHE B 366 8.167 -6.996 -1.346 1.00 0.00 H new ATOM 0 HE2 PHE B 366 6.674 -4.410 1.697 1.00 0.00 H new ATOM 0 HZ PHE B 366 7.291 -4.800 -0.656 1.00 0.00 H new ATOM 1453 N LYS B 367 9.985 -11.639 3.320 1.00 0.00 N ATOM 1454 CA LYS B 367 10.564 -12.512 4.333 1.00 0.00 C ATOM 1455 C LYS B 367 11.754 -11.842 5.014 1.00 0.00 C ATOM 1456 O LYS B 367 12.524 -11.125 4.374 1.00 0.00 O ATOM 1457 CB LYS B 367 10.995 -13.839 3.705 1.00 0.00 C ATOM 1458 CG LYS B 367 11.499 -14.857 4.715 1.00 0.00 C ATOM 1459 CD LYS B 367 11.803 -16.196 4.057 1.00 0.00 C ATOM 1460 CE LYS B 367 10.536 -16.877 3.561 1.00 0.00 C ATOM 1461 NZ LYS B 367 10.828 -18.167 2.878 1.00 0.00 N ATOM 0 H LYS B 367 10.481 -11.639 2.429 1.00 0.00 H new ATOM 0 HA LYS B 367 9.803 -12.708 5.088 1.00 0.00 H new ATOM 0 HB2 LYS B 367 10.151 -14.265 3.163 1.00 0.00 H new ATOM 0 HB3 LYS B 367 11.780 -13.647 2.973 1.00 0.00 H new ATOM 0 HG2 LYS B 367 12.399 -14.476 5.199 1.00 0.00 H new ATOM 0 HG3 LYS B 367 10.752 -14.996 5.496 1.00 0.00 H new ATOM 0 HD2 LYS B 367 12.486 -16.045 3.221 1.00 0.00 H new ATOM 0 HD3 LYS B 367 12.311 -16.846 4.770 1.00 0.00 H new ATOM 0 HE2 LYS B 367 9.867 -17.056 4.403 1.00 0.00 H new ATOM 0 HE3 LYS B 367 10.013 -16.213 2.873 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 9.938 -18.598 2.556 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 11.446 -17.994 2.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 11.304 -18.811 3.541 1.00 0.00 H new ATOM 1475 N ASN B 368 11.891 -12.081 6.316 1.00 0.00 N ATOM 1476 CA ASN B 368 12.982 -11.507 7.099 1.00 0.00 C ATOM 1477 C ASN B 368 12.922 -9.980 7.092 1.00 0.00 C ATOM 1478 O ASN B 368 13.854 -9.311 7.537 1.00 0.00 O ATOM 1479 CB ASN B 368 14.333 -11.985 6.557 1.00 0.00 C ATOM 1480 CG ASN B 368 15.486 -11.624 7.472 1.00 0.00 C ATOM 1481 OD1 ASN B 368 15.327 -11.546 8.690 1.00 0.00 O ATOM 1482 ND2 ASN B 368 16.658 -11.400 6.888 1.00 0.00 N ATOM 0 H ASN B 368 11.256 -12.672 6.853 1.00 0.00 H new ATOM 0 HA ASN B 368 12.872 -11.846 8.129 1.00 0.00 H new ATOM 0 HB2 ASN B 368 14.305 -13.066 6.423 1.00 0.00 H new ATOM 0 HB3 ASN B 368 14.502 -11.546 5.574 1.00 0.00 H new ATOM 0 HD21 ASN B 368 17.470 -11.152 7.453 1.00 0.00 H new ATOM 0 HD22 ASN B 368 16.746 -11.476 5.875 1.00 0.00 H new ATOM 1489 N GLN B 369 11.816 -9.436 6.593 1.00 0.00 N ATOM 1490 CA GLN B 369 11.634 -7.989 6.531 1.00 0.00 C ATOM 1491 C GLN B 369 10.332 -7.575 7.211 1.00 0.00 C ATOM 1492 O GLN B 369 9.446 -6.995 6.583 1.00 0.00 O ATOM 1493 CB GLN B 369 11.642 -7.514 5.076 1.00 0.00 C ATOM 1494 CG GLN B 369 12.969 -7.741 4.370 1.00 0.00 C ATOM 1495 CD GLN B 369 14.101 -6.944 4.987 1.00 0.00 C ATOM 1496 OE1 GLN B 369 14.303 -5.727 4.496 1.00 0.00 O flip ATOM 1497 NE2 GLN B 369 14.785 -7.415 5.895 1.00 0.00 N flip ATOM 0 H GLN B 369 11.032 -9.975 6.226 1.00 0.00 H new ATOM 0 HA GLN B 369 12.463 -7.520 7.061 1.00 0.00 H new ATOM 0 HB2 GLN B 369 10.855 -8.033 4.529 1.00 0.00 H new ATOM 0 HB3 GLN B 369 11.402 -6.451 5.048 1.00 0.00 H new ATOM 0 HG2 GLN B 369 13.217 -8.802 4.402 1.00 0.00 H new ATOM 0 HG3 GLN B 369 12.869 -7.469 3.319 1.00 0.00 H new ATOM 0 HE21 GLN B 369 14.595 -8.355 6.242 1.00 0.00 H new ATOM 0 HE22 GLN B 369 15.542 -6.865 6.301 1.00 0.00 H new ATOM 1506 N GLU B 370 10.227 -7.878 8.501 1.00 0.00 N ATOM 1507 CA GLU B 370 9.038 -7.542 9.275 1.00 0.00 C ATOM 1508 C GLU B 370 8.955 -6.038 9.518 1.00 0.00 C ATOM 1509 O GLU B 370 7.876 -5.501 9.767 1.00 0.00 O ATOM 1510 CB GLU B 370 9.051 -8.292 10.610 1.00 0.00 C ATOM 1511 CG GLU B 370 7.862 -7.977 11.502 1.00 0.00 C ATOM 1512 CD GLU B 370 7.895 -8.743 12.810 1.00 0.00 C ATOM 1513 OE1 GLU B 370 8.709 -8.384 13.687 1.00 0.00 O ATOM 1514 OE2 GLU B 370 7.110 -9.703 12.957 1.00 0.00 O ATOM 0 H GLU B 370 10.953 -8.357 9.033 1.00 0.00 H new ATOM 0 HA GLU B 370 8.160 -7.845 8.704 1.00 0.00 H new ATOM 0 HB2 GLU B 370 9.072 -9.364 10.414 1.00 0.00 H new ATOM 0 HB3 GLU B 370 9.969 -8.048 11.144 1.00 0.00 H new ATOM 0 HG2 GLU B 370 7.843 -6.908 11.712 1.00 0.00 H new ATOM 0 HG3 GLU B 370 6.941 -8.214 10.970 1.00 0.00 H new ATOM 1521 N ASP B 371 10.098 -5.363 9.441 1.00 0.00 N ATOM 1522 CA ASP B 371 10.149 -3.921 9.651 1.00 0.00 C ATOM 1523 C ASP B 371 9.236 -3.199 8.666 1.00 0.00 C ATOM 1524 O ASP B 371 8.407 -2.379 9.059 1.00 0.00 O ATOM 1525 CB ASP B 371 11.583 -3.411 9.505 1.00 0.00 C ATOM 1526 CG ASP B 371 12.525 -4.043 10.510 1.00 0.00 C ATOM 1527 OD1 ASP B 371 12.625 -3.521 11.640 1.00 0.00 O ATOM 1528 OD2 ASP B 371 13.162 -5.062 10.168 1.00 0.00 O ATOM 0 H ASP B 371 11.000 -5.792 9.235 1.00 0.00 H new ATOM 0 HA ASP B 371 9.801 -3.713 10.663 1.00 0.00 H new ATOM 0 HB2 ASP B 371 11.939 -3.619 8.496 1.00 0.00 H new ATOM 0 HB3 ASP B 371 11.595 -2.328 9.630 1.00 0.00 H new ATOM 1533 N LEU B 372 9.395 -3.510 7.383 1.00 0.00 N ATOM 1534 CA LEU B 372 8.580 -2.896 6.342 1.00 0.00 C ATOM 1535 C LEU B 372 7.116 -3.287 6.502 1.00 0.00 C ATOM 1536 O LEU B 372 6.224 -2.443 6.410 1.00 0.00 O ATOM 1537 CB LEU B 372 9.083 -3.311 4.956 1.00 0.00 C ATOM 1538 CG LEU B 372 10.220 -2.457 4.385 1.00 0.00 C ATOM 1539 CD1 LEU B 372 11.419 -2.450 5.322 1.00 0.00 C ATOM 1540 CD2 LEU B 372 10.622 -2.964 3.008 1.00 0.00 C ATOM 0 H LEU B 372 10.080 -4.183 7.040 1.00 0.00 H new ATOM 0 HA LEU B 372 8.664 -1.814 6.440 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.419 -4.347 5.006 1.00 0.00 H new ATOM 0 HB3 LEU B 372 8.245 -3.281 4.260 1.00 0.00 H new ATOM 0 HG LEU B 372 9.861 -1.432 4.289 1.00 0.00 H new ATOM 0 HD11 LEU B 372 12.212 -1.837 4.894 1.00 0.00 H new ATOM 0 HD12 LEU B 372 11.124 -2.039 6.287 1.00 0.00 H new ATOM 0 HD13 LEU B 372 11.781 -3.469 5.457 1.00 0.00 H new ATOM 0 HD21 LEU B 372 11.431 -2.348 2.615 1.00 0.00 H new ATOM 0 HD22 LEU B 372 10.958 -3.998 3.085 1.00 0.00 H new ATOM 0 HD23 LEU B 372 9.765 -2.910 2.336 1.00 0.00 H new ATOM 1552 N LEU B 373 6.875 -4.573 6.745 1.00 0.00 N ATOM 1553 CA LEU B 373 5.518 -5.075 6.920 1.00 0.00 C ATOM 1554 C LEU B 373 4.831 -4.370 8.086 1.00 0.00 C ATOM 1555 O LEU B 373 3.617 -4.167 8.075 1.00 0.00 O ATOM 1556 CB LEU B 373 5.534 -6.589 7.155 1.00 0.00 C ATOM 1557 CG LEU B 373 4.170 -7.280 7.061 1.00 0.00 C ATOM 1558 CD1 LEU B 373 3.493 -6.961 5.737 1.00 0.00 C ATOM 1559 CD2 LEU B 373 4.325 -8.784 7.227 1.00 0.00 C ATOM 0 H LEU B 373 7.602 -5.284 6.825 1.00 0.00 H new ATOM 0 HA LEU B 373 4.957 -4.867 6.009 1.00 0.00 H new ATOM 0 HB2 LEU B 373 6.205 -7.046 6.428 1.00 0.00 H new ATOM 0 HB3 LEU B 373 5.954 -6.783 8.142 1.00 0.00 H new ATOM 0 HG LEU B 373 3.540 -6.903 7.867 1.00 0.00 H new ATOM 0 HD11 LEU B 373 2.526 -7.462 5.693 1.00 0.00 H new ATOM 0 HD12 LEU B 373 3.347 -5.884 5.653 1.00 0.00 H new ATOM 0 HD13 LEU B 373 4.120 -7.308 4.915 1.00 0.00 H new ATOM 0 HD21 LEU B 373 3.347 -9.260 7.158 1.00 0.00 H new ATOM 0 HD22 LEU B 373 4.974 -9.172 6.442 1.00 0.00 H new ATOM 0 HD23 LEU B 373 4.765 -8.999 8.201 1.00 0.00 H new ATOM 1571 N SER B 374 5.620 -3.999 9.090 1.00 0.00 N ATOM 1572 CA SER B 374 5.094 -3.310 10.262 1.00 0.00 C ATOM 1573 C SER B 374 4.679 -1.889 9.899 1.00 0.00 C ATOM 1574 O SER B 374 3.555 -1.468 10.181 1.00 0.00 O ATOM 1575 CB SER B 374 6.139 -3.285 11.378 1.00 0.00 C ATOM 1576 OG SER B 374 6.472 -4.598 11.794 1.00 0.00 O ATOM 0 H SER B 374 6.626 -4.164 9.115 1.00 0.00 H new ATOM 0 HA SER B 374 4.217 -3.851 10.617 1.00 0.00 H new ATOM 0 HB2 SER B 374 7.035 -2.772 11.030 1.00 0.00 H new ATOM 0 HB3 SER B 374 5.756 -2.717 12.226 1.00 0.00 H new ATOM 0 HG SER B 374 7.083 -5.002 11.143 1.00 0.00 H new ATOM 1582 N GLU B 375 5.594 -1.155 9.271 1.00 0.00 N ATOM 1583 CA GLU B 375 5.322 0.217 8.858 1.00 0.00 C ATOM 1584 C GLU B 375 4.094 0.265 7.956 1.00 0.00 C ATOM 1585 O GLU B 375 3.348 1.244 7.957 1.00 0.00 O ATOM 1586 CB GLU B 375 6.532 0.803 8.124 1.00 0.00 C ATOM 1587 CG GLU B 375 7.796 0.851 8.967 1.00 0.00 C ATOM 1588 CD GLU B 375 7.639 1.704 10.211 1.00 0.00 C ATOM 1589 OE1 GLU B 375 7.799 2.939 10.109 1.00 0.00 O ATOM 1590 OE2 GLU B 375 7.359 1.137 11.287 1.00 0.00 O ATOM 0 H GLU B 375 6.529 -1.488 9.038 1.00 0.00 H new ATOM 0 HA GLU B 375 5.129 0.813 9.750 1.00 0.00 H new ATOM 0 HB2 GLU B 375 6.725 0.210 7.230 1.00 0.00 H new ATOM 0 HB3 GLU B 375 6.290 1.812 7.791 1.00 0.00 H new ATOM 0 HG2 GLU B 375 8.072 -0.162 9.259 1.00 0.00 H new ATOM 0 HG3 GLU B 375 8.615 1.243 8.364 1.00 0.00 H new ATOM 1597 N PHE B 376 3.889 -0.805 7.193 1.00 0.00 N ATOM 1598 CA PHE B 376 2.749 -0.898 6.287 1.00 0.00 C ATOM 1599 C PHE B 376 1.465 -1.162 7.065 1.00 0.00 C ATOM 1600 O PHE B 376 0.412 -0.604 6.754 1.00 0.00 O ATOM 1601 CB PHE B 376 2.981 -2.008 5.259 1.00 0.00 C ATOM 1602 CG PHE B 376 1.821 -2.226 4.327 1.00 0.00 C ATOM 1603 CD1 PHE B 376 1.571 -1.341 3.290 1.00 0.00 C ATOM 1604 CD2 PHE B 376 0.984 -3.319 4.487 1.00 0.00 C ATOM 1605 CE1 PHE B 376 0.507 -1.543 2.431 1.00 0.00 C ATOM 1606 CE2 PHE B 376 -0.081 -3.526 3.631 1.00 0.00 C ATOM 1607 CZ PHE B 376 -0.320 -2.636 2.602 1.00 0.00 C ATOM 0 H PHE B 376 4.500 -1.622 7.185 1.00 0.00 H new ATOM 0 HA PHE B 376 2.646 0.053 5.764 1.00 0.00 H new ATOM 0 HB2 PHE B 376 3.867 -1.766 4.671 1.00 0.00 H new ATOM 0 HB3 PHE B 376 3.192 -2.939 5.785 1.00 0.00 H new ATOM 0 HD1 PHE B 376 2.214 -0.485 3.152 1.00 0.00 H new ATOM 0 HD2 PHE B 376 1.166 -4.017 5.290 1.00 0.00 H new ATOM 0 HE1 PHE B 376 0.322 -0.846 1.627 1.00 0.00 H new ATOM 0 HE2 PHE B 376 -0.725 -4.382 3.766 1.00 0.00 H new ATOM 0 HZ PHE B 376 -1.152 -2.795 1.932 1.00 0.00 H new ATOM 1617 N GLY B 377 1.560 -2.018 8.079 1.00 0.00 N ATOM 1618 CA GLY B 377 0.401 -2.340 8.891 1.00 0.00 C ATOM 1619 C GLY B 377 -0.090 -1.151 9.693 1.00 0.00 C ATOM 1620 O GLY B 377 -1.281 -1.043 9.985 1.00 0.00 O ATOM 0 H GLY B 377 2.420 -2.494 8.352 1.00 0.00 H new ATOM 0 HA2 GLY B 377 -0.403 -2.697 8.247 1.00 0.00 H new ATOM 0 HA3 GLY B 377 0.652 -3.155 9.570 1.00 0.00 H new ATOM 1624 N GLN B 378 0.829 -0.259 10.052 1.00 0.00 N ATOM 1625 CA GLN B 378 0.480 0.929 10.824 1.00 0.00 C ATOM 1626 C GLN B 378 -0.556 1.772 10.088 1.00 0.00 C ATOM 1627 O GLN B 378 -1.424 2.385 10.710 1.00 0.00 O ATOM 1628 CB GLN B 378 1.727 1.768 11.107 1.00 0.00 C ATOM 1629 CG GLN B 378 2.721 1.086 12.033 1.00 0.00 C ATOM 1630 CD GLN B 378 3.905 1.970 12.378 1.00 0.00 C ATOM 1631 OE1 GLN B 378 3.677 3.279 12.421 1.00 0.00 O flip ATOM 1632 NE2 GLN B 378 5.012 1.482 12.607 1.00 0.00 N flip ATOM 0 H GLN B 378 1.819 -0.336 9.821 1.00 0.00 H new ATOM 0 HA GLN B 378 0.050 0.600 11.770 1.00 0.00 H new ATOM 0 HB2 GLN B 378 2.221 1.999 10.163 1.00 0.00 H new ATOM 0 HB3 GLN B 378 1.424 2.717 11.549 1.00 0.00 H new ATOM 0 HG2 GLN B 378 2.213 0.792 12.951 1.00 0.00 H new ATOM 0 HG3 GLN B 378 3.081 0.171 11.562 1.00 0.00 H new ATOM 0 HE21 GLN B 378 5.143 0.471 12.563 1.00 0.00 H new ATOM 0 HE22 GLN B 378 5.798 2.088 12.841 1.00 0.00 H new ATOM 1641 N PHE B 379 -0.460 1.797 8.762 1.00 0.00 N ATOM 1642 CA PHE B 379 -1.393 2.563 7.942 1.00 0.00 C ATOM 1643 C PHE B 379 -2.811 2.024 8.090 1.00 0.00 C ATOM 1644 O PHE B 379 -3.782 2.778 8.031 1.00 0.00 O ATOM 1645 CB PHE B 379 -0.970 2.520 6.472 1.00 0.00 C ATOM 1646 CG PHE B 379 0.363 3.163 6.208 1.00 0.00 C ATOM 1647 CD1 PHE B 379 0.535 4.528 6.380 1.00 0.00 C ATOM 1648 CD2 PHE B 379 1.442 2.404 5.786 1.00 0.00 C ATOM 1649 CE1 PHE B 379 1.758 5.122 6.138 1.00 0.00 C ATOM 1650 CE2 PHE B 379 2.668 2.993 5.541 1.00 0.00 C ATOM 1651 CZ PHE B 379 2.826 4.353 5.718 1.00 0.00 C ATOM 0 H PHE B 379 0.254 1.296 8.233 1.00 0.00 H new ATOM 0 HA PHE B 379 -1.376 3.597 8.286 1.00 0.00 H new ATOM 0 HB2 PHE B 379 -0.934 1.481 6.144 1.00 0.00 H new ATOM 0 HB3 PHE B 379 -1.730 3.018 5.870 1.00 0.00 H new ATOM 0 HD1 PHE B 379 -0.297 5.134 6.707 1.00 0.00 H new ATOM 0 HD2 PHE B 379 1.324 1.340 5.647 1.00 0.00 H new ATOM 0 HE1 PHE B 379 1.879 6.186 6.277 1.00 0.00 H new ATOM 0 HE2 PHE B 379 3.501 2.390 5.212 1.00 0.00 H new ATOM 0 HZ PHE B 379 3.783 4.815 5.528 1.00 0.00 H new ATOM 1661 N LEU B 380 -2.922 0.714 8.284 1.00 0.00 N ATOM 1662 CA LEU B 380 -4.220 0.071 8.441 1.00 0.00 C ATOM 1663 C LEU B 380 -4.875 0.483 9.761 1.00 0.00 C ATOM 1664 O LEU B 380 -4.236 0.435 10.813 1.00 0.00 O ATOM 1665 CB LEU B 380 -4.062 -1.451 8.392 1.00 0.00 C ATOM 1666 CG LEU B 380 -3.409 -1.999 7.122 1.00 0.00 C ATOM 1667 CD1 LEU B 380 -3.100 -3.480 7.280 1.00 0.00 C ATOM 1668 CD2 LEU B 380 -4.308 -1.768 5.916 1.00 0.00 C ATOM 0 H LEU B 380 -2.127 0.077 8.336 1.00 0.00 H new ATOM 0 HA LEU B 380 -4.862 0.393 7.621 1.00 0.00 H new ATOM 0 HB2 LEU B 380 -3.469 -1.766 9.251 1.00 0.00 H new ATOM 0 HB3 LEU B 380 -5.047 -1.906 8.500 1.00 0.00 H new ATOM 0 HG LEU B 380 -2.472 -1.466 6.959 1.00 0.00 H new ATOM 0 HD11 LEU B 380 -2.636 -3.854 6.368 1.00 0.00 H new ATOM 0 HD12 LEU B 380 -2.418 -3.622 8.119 1.00 0.00 H new ATOM 0 HD13 LEU B 380 -4.024 -4.027 7.467 1.00 0.00 H new ATOM 0 HD21 LEU B 380 -3.827 -2.164 5.022 1.00 0.00 H new ATOM 0 HD22 LEU B 380 -5.261 -2.275 6.070 1.00 0.00 H new ATOM 0 HD23 LEU B 380 -4.481 -0.699 5.791 1.00 0.00 H new ATOM 1680 N PRO B 381 -6.160 0.894 9.729 1.00 0.00 N ATOM 1681 CA PRO B 381 -6.884 1.309 10.937 1.00 0.00 C ATOM 1682 C PRO B 381 -7.178 0.136 11.866 1.00 0.00 C ATOM 1683 O PRO B 381 -6.724 -0.984 11.629 1.00 0.00 O ATOM 1684 CB PRO B 381 -8.187 1.897 10.388 1.00 0.00 C ATOM 1685 CG PRO B 381 -8.382 1.223 9.075 1.00 0.00 C ATOM 1686 CD PRO B 381 -7.004 0.990 8.521 1.00 0.00 C ATOM 0 HA PRO B 381 -6.306 2.011 11.538 1.00 0.00 H new ATOM 0 HB2 PRO B 381 -9.023 1.704 11.060 1.00 0.00 H new ATOM 0 HB3 PRO B 381 -8.115 2.978 10.271 1.00 0.00 H new ATOM 0 HG2 PRO B 381 -8.919 0.282 9.195 1.00 0.00 H new ATOM 0 HG3 PRO B 381 -8.974 1.843 8.402 1.00 0.00 H new ATOM 0 HD2 PRO B 381 -6.959 0.078 7.926 1.00 0.00 H new ATOM 0 HD3 PRO B 381 -6.688 1.808 7.874 1.00 0.00 H new ATOM 1694 N ASP B 382 -7.943 0.398 12.922 1.00 0.00 N ATOM 1695 CA ASP B 382 -8.295 -0.637 13.887 1.00 0.00 C ATOM 1696 C ASP B 382 -9.361 -1.570 13.321 1.00 0.00 C ATOM 1697 O ASP B 382 -10.558 -1.328 13.474 1.00 0.00 O ATOM 1698 CB ASP B 382 -8.790 -0.007 15.190 1.00 0.00 C ATOM 1699 CG ASP B 382 -9.172 -1.047 16.225 1.00 0.00 C ATOM 1700 OD1 ASP B 382 -8.283 -1.481 16.987 1.00 0.00 O ATOM 1701 OD2 ASP B 382 -10.361 -1.427 16.273 1.00 0.00 O ATOM 0 H ASP B 382 -8.331 1.318 13.130 1.00 0.00 H new ATOM 0 HA ASP B 382 -7.399 -1.222 14.095 1.00 0.00 H new ATOM 0 HB2 ASP B 382 -8.012 0.638 15.597 1.00 0.00 H new ATOM 0 HB3 ASP B 382 -9.652 0.626 14.980 1.00 0.00 H new ATOM 1706 N ALA B 383 -8.915 -2.633 12.661 1.00 0.00 N ATOM 1707 CA ALA B 383 -9.825 -3.607 12.072 1.00 0.00 C ATOM 1708 C ALA B 383 -9.943 -4.848 12.950 1.00 0.00 C ATOM 1709 O ALA B 383 -10.855 -4.883 13.804 1.00 0.00 O ATOM 1710 CB ALA B 383 -9.358 -3.987 10.675 1.00 0.00 C ATOM 1711 OXT ALA B 383 -9.124 -5.775 12.778 1.00 0.00 O ATOM 0 H ALA B 383 -7.927 -2.842 12.521 1.00 0.00 H new ATOM 0 HA ALA B 383 -10.812 -3.150 12.001 1.00 0.00 H new ATOM 0 HB1 ALA B 383 -10.047 -4.715 10.247 1.00 0.00 H new ATOM 0 HB2 ALA B 383 -9.332 -3.098 10.045 1.00 0.00 H new ATOM 0 HB3 ALA B 383 -8.360 -4.421 10.731 1.00 0.00 H new TER 1717 ALA B 383