USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 646 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 211 THR OG1 : rot 140:sc= -2.87! USER MOD Set 1.2: B 218 SER OG : rot 49:sc= 0.526 USER MOD Set 2.1: A 6 TYR OH : rot 180:sc= -0.2 USER MOD Set 2.2: B 212 ASN : amide:sc= -6.13! C(o=-6.3!,f=-12!) USER MOD Set 3.1: A 21 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 45 THR OG1 : rot 101:sc= 1.27 USER MOD Set 4.1: A 13 ASN : amide:sc= 0.00204 X(o=0.0045,f=0) USER MOD Set 4.2: B 207 THR OG1 : rot -170:sc= 0.00251 USER MOD Set 5.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -3.77! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 150:sc= -3.22! USER MOD Single : A 12 ASN : amide:sc= -7.25! C(o=-7.3!,f=-24!) USER MOD Single : A 14 SER OG : rot 44:sc= -0.0096 USER MOD Single : A 15 ASN : amide:sc= -0.0453 X(o=-0.045,f=-0.047) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 42:sc= 0.122 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -160:sc= -0.326 USER MOD Single : A 40 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0987) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.591 F(o=-1.3!,f=-0.59) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.55! USER MOD Single : B 206 TYR OH : rot 30:sc= -0.145 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN : amide:sc= -0.384 X(o=-0.38,f=-0.42) USER MOD Single : B 221 TYR OH : rot 67:sc= -2.63! USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.582 USER MOD Single : B 227 MET CE :methyl -132:sc= -1.69 (180deg=-4.5!) USER MOD Single : B 228 THR OG1 : rot 180:sc=-0.00653 USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.861 F(o=-1.7!,f=-0.86) USER MOD Single : B 245 THR OG1 : rot 88:sc= 0.307 USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.273 -20.253 -6.770 1.00 0.00 N ATOM 26 CA LYS A 3 -0.186 -20.015 -5.836 1.00 0.00 C ATOM 27 C LYS A 3 -0.633 -18.990 -4.792 1.00 0.00 C ATOM 28 O LYS A 3 -1.689 -18.375 -4.933 1.00 0.00 O ATOM 29 CB LYS A 3 1.086 -19.614 -6.586 1.00 0.00 C ATOM 30 CG LYS A 3 1.780 -20.840 -7.184 1.00 0.00 C ATOM 31 CD LYS A 3 0.755 -21.869 -7.665 1.00 0.00 C ATOM 32 CE LYS A 3 1.440 -23.025 -8.396 1.00 0.00 C ATOM 33 NZ LYS A 3 0.916 -24.324 -7.918 1.00 0.00 N ATOM 0 HA LYS A 3 0.063 -20.930 -5.299 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.838 -18.909 -7.380 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.767 -19.102 -5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.412 -20.534 -8.017 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.433 -21.293 -6.438 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.194 -22.254 -6.814 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.037 -21.389 -8.329 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.275 -22.933 -9.470 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.517 -22.979 -8.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.392 -25.098 -8.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.095 -24.416 -6.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.108 -24.372 -8.095 1.00 0.00 H new ATOM 47 N ALA A 4 0.192 -18.839 -3.766 1.00 0.00 N ATOM 48 CA ALA A 4 -0.104 -17.901 -2.699 1.00 0.00 C ATOM 49 C ALA A 4 0.830 -16.695 -2.811 1.00 0.00 C ATOM 50 O ALA A 4 1.942 -16.715 -2.287 1.00 0.00 O ATOM 51 CB ALA A 4 0.018 -18.609 -1.348 1.00 0.00 C ATOM 0 H ALA A 4 1.066 -19.352 -3.652 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.127 -17.534 -2.784 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.204 -17.904 -0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.687 -19.439 -1.307 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.033 -18.988 -1.226 1.00 0.00 H new ATOM 57 N THR A 5 0.344 -15.671 -3.499 1.00 0.00 N ATOM 58 CA THR A 5 1.122 -14.458 -3.687 1.00 0.00 C ATOM 59 C THR A 5 0.207 -13.232 -3.679 1.00 0.00 C ATOM 60 O THR A 5 -1.008 -13.359 -3.807 1.00 0.00 O ATOM 61 CB THR A 5 1.926 -14.608 -4.980 1.00 0.00 C ATOM 62 OG1 THR A 5 0.935 -14.799 -5.985 1.00 0.00 O ATOM 63 CG2 THR A 5 2.744 -15.901 -5.014 1.00 0.00 C ATOM 0 H THR A 5 -0.579 -15.657 -3.933 1.00 0.00 H new ATOM 0 HA THR A 5 1.824 -14.306 -2.867 1.00 0.00 H new ATOM 0 HB THR A 5 2.593 -13.753 -5.094 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.369 -14.903 -6.857 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.295 -15.958 -5.952 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.445 -15.910 -4.180 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.074 -16.757 -4.934 1.00 0.00 H new ATOM 71 N TYR A 6 0.829 -12.072 -3.528 1.00 0.00 N ATOM 72 CA TYR A 6 0.087 -10.823 -3.502 1.00 0.00 C ATOM 73 C TYR A 6 0.795 -9.746 -4.327 1.00 0.00 C ATOM 74 O TYR A 6 2.022 -9.666 -4.326 1.00 0.00 O ATOM 75 CB TYR A 6 0.050 -10.384 -2.036 1.00 0.00 C ATOM 76 CG TYR A 6 -1.267 -10.699 -1.325 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.546 -11.991 -0.930 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.175 -9.690 -1.079 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.786 -12.286 -0.260 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.416 -9.985 -0.409 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.660 -11.269 -0.033 1.00 0.00 C ATOM 82 OH TYR A 6 -4.831 -11.548 0.600 1.00 0.00 O ATOM 0 H TYR A 6 1.838 -11.971 -3.422 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.909 -10.960 -3.923 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.865 -10.871 -1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.231 -9.310 -1.984 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.835 -12.781 -1.123 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.956 -8.679 -1.389 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.017 -13.293 0.055 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.136 -9.205 -0.210 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.356 -10.726 0.695 1.00 0.00 H new ATOM 92 N THR A 7 -0.010 -8.945 -5.010 1.00 0.00 N ATOM 93 CA THR A 7 0.525 -7.877 -5.838 1.00 0.00 C ATOM 94 C THR A 7 0.089 -6.515 -5.296 1.00 0.00 C ATOM 95 O THR A 7 -1.095 -6.183 -5.317 1.00 0.00 O ATOM 96 CB THR A 7 0.079 -8.128 -7.280 1.00 0.00 C ATOM 97 OG1 THR A 7 0.248 -9.532 -7.455 1.00 0.00 O ATOM 98 CG2 THR A 7 1.033 -7.507 -8.304 1.00 0.00 C ATOM 0 H THR A 7 -1.028 -9.014 -5.007 1.00 0.00 H new ATOM 0 HA THR A 7 1.615 -7.867 -5.817 1.00 0.00 H new ATOM 0 HB THR A 7 -0.923 -7.725 -7.426 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.020 -9.783 -8.364 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.671 -7.714 -9.311 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.080 -6.429 -8.150 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.028 -7.935 -8.181 1.00 0.00 H new ATOM 106 N VAL A 8 1.071 -5.760 -4.824 1.00 0.00 N ATOM 107 CA VAL A 8 0.805 -4.441 -4.277 1.00 0.00 C ATOM 108 C VAL A 8 1.275 -3.377 -5.271 1.00 0.00 C ATOM 109 O VAL A 8 2.428 -3.388 -5.698 1.00 0.00 O ATOM 110 CB VAL A 8 1.457 -4.303 -2.900 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.422 -2.850 -2.419 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.793 -5.233 -1.882 1.00 0.00 C ATOM 0 H VAL A 8 2.052 -6.037 -4.809 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.265 -4.298 -4.130 1.00 0.00 H new ATOM 0 HB VAL A 8 2.502 -4.600 -2.994 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.892 -2.780 -1.438 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.962 -2.220 -3.126 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.387 -2.514 -2.350 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.276 -5.115 -0.912 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.264 -4.981 -1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.894 -6.266 -2.214 1.00 0.00 H new ATOM 122 N THR A 9 0.358 -2.483 -5.610 1.00 0.00 N ATOM 123 CA THR A 9 0.665 -1.414 -6.546 1.00 0.00 C ATOM 124 C THR A 9 0.468 -0.051 -5.881 1.00 0.00 C ATOM 125 O THR A 9 -0.609 0.244 -5.366 1.00 0.00 O ATOM 126 CB THR A 9 -0.201 -1.614 -7.791 1.00 0.00 C ATOM 127 OG1 THR A 9 -0.089 -3.006 -8.073 1.00 0.00 O ATOM 128 CG2 THR A 9 0.389 -0.934 -9.029 1.00 0.00 C ATOM 0 H THR A 9 -0.598 -2.477 -5.254 1.00 0.00 H new ATOM 0 HA THR A 9 1.711 -1.443 -6.852 1.00 0.00 H new ATOM 0 HB THR A 9 -1.201 -1.224 -7.604 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.622 -3.223 -8.866 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.264 -1.106 -9.885 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.476 0.138 -8.849 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.376 -1.348 -9.236 1.00 0.00 H new ATOM 136 N VAL A 10 1.527 0.747 -5.913 1.00 0.00 N ATOM 137 CA VAL A 10 1.483 2.072 -5.321 1.00 0.00 C ATOM 138 C VAL A 10 1.843 3.112 -6.383 1.00 0.00 C ATOM 139 O VAL A 10 2.903 3.032 -7.002 1.00 0.00 O ATOM 140 CB VAL A 10 2.399 2.127 -4.096 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.747 3.573 -3.736 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.766 1.403 -2.906 1.00 0.00 C ATOM 0 H VAL A 10 2.420 0.500 -6.340 1.00 0.00 H new ATOM 0 HA VAL A 10 0.477 2.301 -4.970 1.00 0.00 H new ATOM 0 HB VAL A 10 3.326 1.612 -4.347 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.399 3.584 -2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.258 4.044 -4.576 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.832 4.123 -3.513 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.437 1.457 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.817 1.877 -2.655 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.592 0.359 -3.166 1.00 0.00 H new ATOM 152 N THR A 11 0.940 4.065 -6.562 1.00 0.00 N ATOM 153 CA THR A 11 1.148 5.121 -7.539 1.00 0.00 C ATOM 154 C THR A 11 0.928 6.492 -6.897 1.00 0.00 C ATOM 155 O THR A 11 0.027 6.659 -6.076 1.00 0.00 O ATOM 156 CB THR A 11 0.227 4.851 -8.730 1.00 0.00 C ATOM 157 OG1 THR A 11 0.674 3.597 -9.237 1.00 0.00 O ATOM 158 CG2 THR A 11 0.463 5.826 -9.885 1.00 0.00 C ATOM 0 H THR A 11 0.062 4.128 -6.047 1.00 0.00 H new ATOM 0 HA THR A 11 2.176 5.129 -7.901 1.00 0.00 H new ATOM 0 HB THR A 11 -0.812 4.915 -8.407 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.080 3.121 -9.644 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.216 5.590 -10.704 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.281 6.845 -9.544 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.493 5.738 -10.231 1.00 0.00 H new ATOM 166 N ASN A 12 1.764 7.439 -7.297 1.00 0.00 N ATOM 167 CA ASN A 12 1.671 8.790 -6.772 1.00 0.00 C ATOM 168 C ASN A 12 0.943 9.677 -7.784 1.00 0.00 C ATOM 169 O ASN A 12 1.544 10.146 -8.749 1.00 0.00 O ATOM 170 CB ASN A 12 3.061 9.386 -6.535 1.00 0.00 C ATOM 171 CG ASN A 12 4.002 9.059 -7.696 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.585 8.740 -8.798 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.292 9.155 -7.389 1.00 0.00 N ATOM 0 H ASN A 12 2.509 7.297 -7.979 1.00 0.00 H new ATOM 0 HA ASN A 12 1.130 8.748 -5.826 1.00 0.00 H new ATOM 0 HB2 ASN A 12 2.982 10.467 -6.419 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.475 8.995 -5.605 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.000 8.956 -8.095 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.573 9.427 -6.447 1.00 0.00 H new ATOM 180 N ASN A 13 -0.341 9.880 -7.528 1.00 0.00 N ATOM 181 CA ASN A 13 -1.157 10.702 -8.405 1.00 0.00 C ATOM 182 C ASN A 13 -0.537 12.097 -8.512 1.00 0.00 C ATOM 183 O ASN A 13 -0.867 12.858 -9.421 1.00 0.00 O ATOM 184 CB ASN A 13 -2.576 10.858 -7.851 1.00 0.00 C ATOM 185 CG ASN A 13 -3.588 10.109 -8.719 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.017 10.575 -9.762 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.946 8.923 -8.233 1.00 0.00 N ATOM 0 H ASN A 13 -0.836 9.490 -6.726 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.201 10.215 -9.379 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.616 10.478 -6.830 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.840 11.915 -7.808 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.617 8.346 -8.740 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.549 8.591 -7.354 1.00 0.00 H new ATOM 194 N SER A 14 0.350 12.389 -7.574 1.00 0.00 N ATOM 195 CA SER A 14 1.020 13.678 -7.552 1.00 0.00 C ATOM 196 C SER A 14 2.100 13.725 -8.635 1.00 0.00 C ATOM 197 O SER A 14 2.338 14.774 -9.234 1.00 0.00 O ATOM 198 CB SER A 14 1.633 13.957 -6.179 1.00 0.00 C ATOM 199 OG SER A 14 1.654 15.349 -5.876 1.00 0.00 O ATOM 0 H SER A 14 0.621 11.755 -6.823 1.00 0.00 H new ATOM 0 HA SER A 14 0.279 14.452 -7.753 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.064 13.428 -5.414 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.649 13.564 -6.149 1.00 0.00 H new ATOM 0 HG SER A 14 0.798 15.752 -6.131 1.00 0.00 H new ATOM 205 N ASN A 15 2.725 12.577 -8.854 1.00 0.00 N ATOM 206 CA ASN A 15 3.773 12.474 -9.854 1.00 0.00 C ATOM 207 C ASN A 15 3.276 11.620 -11.022 1.00 0.00 C ATOM 208 O ASN A 15 3.968 11.476 -12.029 1.00 0.00 O ATOM 209 CB ASN A 15 5.022 11.804 -9.276 1.00 0.00 C ATOM 210 CG ASN A 15 6.282 12.270 -10.008 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.246 12.699 -11.150 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.396 12.164 -9.288 1.00 0.00 N ATOM 0 H ASN A 15 2.525 11.710 -8.355 1.00 0.00 H new ATOM 0 HA ASN A 15 4.024 13.482 -10.184 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.106 12.038 -8.215 1.00 0.00 H new ATOM 0 HB3 ASN A 15 4.929 10.721 -9.358 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.290 12.450 -9.687 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.356 11.796 -8.337 1.00 0.00 H new ATOM 219 N GLY A 16 2.080 11.077 -10.849 1.00 0.00 N ATOM 220 CA GLY A 16 1.482 10.242 -11.877 1.00 0.00 C ATOM 221 C GLY A 16 2.337 9.001 -12.140 1.00 0.00 C ATOM 222 O GLY A 16 2.131 8.299 -13.129 1.00 0.00 O ATOM 0 H GLY A 16 1.509 11.199 -10.013 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.481 9.940 -11.569 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.373 10.815 -12.798 1.00 0.00 H new ATOM 226 N VAL A 17 3.278 8.767 -11.237 1.00 0.00 N ATOM 227 CA VAL A 17 4.165 7.623 -11.359 1.00 0.00 C ATOM 228 C VAL A 17 3.548 6.425 -10.634 1.00 0.00 C ATOM 229 O VAL A 17 2.960 6.578 -9.565 1.00 0.00 O ATOM 230 CB VAL A 17 5.558 7.983 -10.840 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.457 6.746 -10.778 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.195 9.081 -11.695 1.00 0.00 C ATOM 0 H VAL A 17 3.445 9.351 -10.417 1.00 0.00 H new ATOM 0 HA VAL A 17 4.285 7.343 -12.406 1.00 0.00 H new ATOM 0 HB VAL A 17 5.448 8.369 -9.826 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.441 7.030 -10.406 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.015 6.008 -10.109 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.556 6.318 -11.775 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.185 9.318 -11.304 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.285 8.734 -12.725 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.570 9.974 -11.666 1.00 0.00 H new ATOM 242 N SER A 18 3.704 5.260 -11.246 1.00 0.00 N ATOM 243 CA SER A 18 3.169 4.037 -10.671 1.00 0.00 C ATOM 244 C SER A 18 4.311 3.077 -10.332 1.00 0.00 C ATOM 245 O SER A 18 5.362 3.105 -10.969 1.00 0.00 O ATOM 246 CB SER A 18 2.179 3.367 -11.627 1.00 0.00 C ATOM 247 OG SER A 18 2.420 3.728 -12.985 1.00 0.00 O ATOM 0 H SER A 18 4.192 5.137 -12.133 1.00 0.00 H new ATOM 0 HA SER A 18 2.634 4.293 -9.757 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.250 2.284 -11.522 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.162 3.648 -11.352 1.00 0.00 H new ATOM 0 HG SER A 18 1.769 3.279 -13.563 1.00 0.00 H new ATOM 253 N VAL A 19 4.065 2.249 -9.326 1.00 0.00 N ATOM 254 CA VAL A 19 5.058 1.281 -8.894 1.00 0.00 C ATOM 255 C VAL A 19 4.352 0.075 -8.271 1.00 0.00 C ATOM 256 O VAL A 19 3.572 0.225 -7.332 1.00 0.00 O ATOM 257 CB VAL A 19 6.057 1.945 -7.944 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.695 0.915 -7.010 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.125 2.717 -8.722 1.00 0.00 C ATOM 0 H VAL A 19 3.192 2.229 -8.798 1.00 0.00 H new ATOM 0 HA VAL A 19 5.632 0.917 -9.746 1.00 0.00 H new ATOM 0 HB VAL A 19 5.509 2.659 -7.329 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.401 1.414 -6.346 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.919 0.431 -6.417 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.221 0.165 -7.601 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.822 3.179 -8.023 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.666 2.032 -9.374 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.649 3.491 -9.324 1.00 0.00 H new ATOM 269 N ASP A 20 4.653 -1.094 -8.819 1.00 0.00 N ATOM 270 CA ASP A 20 4.056 -2.325 -8.328 1.00 0.00 C ATOM 271 C ASP A 20 5.165 -3.290 -7.905 1.00 0.00 C ATOM 272 O ASP A 20 6.228 -3.329 -8.522 1.00 0.00 O ATOM 273 CB ASP A 20 3.225 -3.007 -9.417 1.00 0.00 C ATOM 274 CG ASP A 20 2.906 -2.131 -10.630 1.00 0.00 C ATOM 275 OD1 ASP A 20 2.762 -0.906 -10.424 1.00 0.00 O ATOM 276 OD2 ASP A 20 2.814 -2.705 -11.737 1.00 0.00 O ATOM 0 H ASP A 20 5.301 -1.214 -9.597 1.00 0.00 H new ATOM 0 HA ASP A 20 3.410 -2.075 -7.486 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.759 -3.894 -9.758 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.288 -3.348 -8.978 1.00 0.00 H new ATOM 281 N TYR A 21 4.878 -4.047 -6.855 1.00 0.00 N ATOM 282 CA TYR A 21 5.838 -5.009 -6.342 1.00 0.00 C ATOM 283 C TYR A 21 5.145 -6.307 -5.925 1.00 0.00 C ATOM 284 O TYR A 21 4.180 -6.282 -5.161 1.00 0.00 O ATOM 285 CB TYR A 21 6.467 -4.361 -5.107 1.00 0.00 C ATOM 286 CG TYR A 21 7.878 -3.818 -5.339 1.00 0.00 C ATOM 287 CD1 TYR A 21 8.084 -2.796 -6.243 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.945 -4.349 -4.643 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.413 -2.284 -6.461 1.00 0.00 C ATOM 290 CE2 TYR A 21 10.273 -3.838 -4.861 1.00 0.00 C ATOM 291 CZ TYR A 21 10.441 -2.831 -5.759 1.00 0.00 C ATOM 292 OH TYR A 21 11.696 -2.348 -5.965 1.00 0.00 O ATOM 0 H TYR A 21 3.995 -4.013 -6.346 1.00 0.00 H new ATOM 0 HA TYR A 21 6.576 -5.258 -7.105 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.826 -3.546 -4.771 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.499 -5.094 -4.301 1.00 0.00 H new ATOM 0 HD1 TYR A 21 7.249 -2.380 -6.787 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.784 -5.148 -3.935 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.589 -1.484 -7.166 1.00 0.00 H new ATOM 0 HE2 TYR A 21 11.117 -4.245 -4.324 1.00 0.00 H new ATOM 0 HH TYR A 21 12.330 -2.832 -5.395 1.00 0.00 H new ATOM 302 N GLU A 22 5.660 -7.411 -6.446 1.00 0.00 N ATOM 303 CA GLU A 22 5.102 -8.716 -6.138 1.00 0.00 C ATOM 304 C GLU A 22 5.792 -9.311 -4.908 1.00 0.00 C ATOM 305 O GLU A 22 6.981 -9.623 -4.951 1.00 0.00 O ATOM 306 CB GLU A 22 5.212 -9.657 -7.339 1.00 0.00 C ATOM 307 CG GLU A 22 4.729 -11.063 -6.979 1.00 0.00 C ATOM 308 CD GLU A 22 5.107 -12.068 -8.069 1.00 0.00 C ATOM 309 OE1 GLU A 22 5.088 -11.659 -9.249 1.00 0.00 O ATOM 310 OE2 GLU A 22 5.407 -13.224 -7.696 1.00 0.00 O ATOM 0 H GLU A 22 6.459 -7.428 -7.080 1.00 0.00 H new ATOM 0 HA GLU A 22 4.043 -8.593 -5.912 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.621 -9.266 -8.167 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.247 -9.700 -7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.167 -11.370 -6.029 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.647 -11.057 -6.844 1.00 0.00 H new ATOM 317 N THR A 23 5.017 -9.452 -3.843 1.00 0.00 N ATOM 318 CA THR A 23 5.538 -10.005 -2.606 1.00 0.00 C ATOM 319 C THR A 23 4.546 -11.005 -2.008 1.00 0.00 C ATOM 320 O THR A 23 3.375 -10.682 -1.812 1.00 0.00 O ATOM 321 CB THR A 23 5.865 -8.840 -1.669 1.00 0.00 C ATOM 322 OG1 THR A 23 6.684 -9.426 -0.660 1.00 0.00 O ATOM 323 CG2 THR A 23 4.637 -8.339 -0.908 1.00 0.00 C ATOM 0 H THR A 23 4.031 -9.192 -3.812 1.00 0.00 H new ATOM 0 HA THR A 23 6.454 -10.569 -2.780 1.00 0.00 H new ATOM 0 HB THR A 23 6.294 -8.020 -2.245 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.944 -8.740 -0.010 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.924 -7.513 -0.258 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.883 -7.997 -1.618 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.227 -9.149 -0.305 1.00 0.00 H new ATOM 331 N GLU A 24 5.051 -12.200 -1.735 1.00 0.00 N ATOM 332 CA GLU A 24 4.223 -13.248 -1.165 1.00 0.00 C ATOM 333 C GLU A 24 4.245 -13.169 0.363 1.00 0.00 C ATOM 334 O GLU A 24 5.154 -13.695 1.003 1.00 0.00 O ATOM 335 CB GLU A 24 4.677 -14.628 -1.648 1.00 0.00 C ATOM 336 CG GLU A 24 4.205 -15.726 -0.692 1.00 0.00 C ATOM 337 CD GLU A 24 5.328 -16.144 0.259 1.00 0.00 C ATOM 338 OE1 GLU A 24 6.463 -16.305 -0.238 1.00 0.00 O ATOM 339 OE2 GLU A 24 5.026 -16.294 1.462 1.00 0.00 O ATOM 0 H GLU A 24 6.022 -12.465 -1.898 1.00 0.00 H new ATOM 0 HA GLU A 24 3.198 -13.099 -1.503 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.282 -14.816 -2.647 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.764 -14.651 -1.725 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.350 -15.370 -0.117 1.00 0.00 H new ATOM 0 HG3 GLU A 24 3.867 -16.590 -1.264 1.00 0.00 H new ATOM 346 N THR A 25 3.232 -12.506 0.904 1.00 0.00 N ATOM 347 CA THR A 25 3.123 -12.350 2.344 1.00 0.00 C ATOM 348 C THR A 25 1.695 -12.647 2.805 1.00 0.00 C ATOM 349 O THR A 25 0.765 -11.918 2.465 1.00 0.00 O ATOM 350 CB THR A 25 3.598 -10.942 2.704 1.00 0.00 C ATOM 351 OG1 THR A 25 2.976 -10.105 1.733 1.00 0.00 O ATOM 352 CG2 THR A 25 5.097 -10.748 2.458 1.00 0.00 C ATOM 0 H THR A 25 2.480 -12.071 0.370 1.00 0.00 H new ATOM 0 HA THR A 25 3.756 -13.065 2.869 1.00 0.00 H new ATOM 0 HB THR A 25 3.373 -10.741 3.751 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.048 -10.391 1.601 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.382 -9.732 2.730 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.660 -11.457 3.065 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.318 -10.917 1.404 1.00 0.00 H new ATOM 360 N PRO A 26 1.563 -13.747 3.594 1.00 0.00 N ATOM 361 CA PRO A 26 0.264 -14.149 4.105 1.00 0.00 C ATOM 362 C PRO A 26 -0.182 -13.235 5.249 1.00 0.00 C ATOM 363 O PRO A 26 -0.843 -12.224 5.017 1.00 0.00 O ATOM 364 CB PRO A 26 0.442 -15.596 4.538 1.00 0.00 C ATOM 365 CG PRO A 26 1.940 -15.806 4.684 1.00 0.00 C ATOM 366 CD PRO A 26 2.643 -14.634 4.017 1.00 0.00 C ATOM 0 HA PRO A 26 -0.526 -14.064 3.359 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.073 -15.788 5.479 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.022 -16.279 3.800 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.216 -15.868 5.737 1.00 0.00 H new ATOM 0 HG3 PRO A 26 2.241 -16.745 4.220 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.320 -14.132 4.709 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.242 -14.963 3.167 1.00 0.00 H new ATOM 374 N MET A 27 0.198 -13.622 6.456 1.00 0.00 N ATOM 375 CA MET A 27 -0.154 -12.849 7.636 1.00 0.00 C ATOM 376 C MET A 27 0.672 -11.564 7.717 1.00 0.00 C ATOM 377 O MET A 27 0.228 -10.572 8.291 1.00 0.00 O ATOM 378 CB MET A 27 0.088 -13.693 8.890 1.00 0.00 C ATOM 379 CG MET A 27 -0.715 -14.993 8.840 1.00 0.00 C ATOM 380 SD MET A 27 -1.716 -15.149 10.310 1.00 0.00 S ATOM 381 CE MET A 27 -3.344 -15.157 9.578 1.00 0.00 C ATOM 0 H MET A 27 0.747 -14.461 6.644 1.00 0.00 H new ATOM 0 HA MET A 27 -1.207 -12.577 7.568 1.00 0.00 H new ATOM 0 HB2 MET A 27 1.150 -13.921 8.980 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.192 -13.123 9.776 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.350 -15.004 7.954 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.039 -15.844 8.758 1.00 0.00 H new ATOM 0 HE1 MET A 27 -4.095 -15.249 10.362 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.502 -14.227 9.032 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.430 -16.000 8.892 1.00 0.00 H new ATOM 391 N THR A 28 1.860 -11.625 7.133 1.00 0.00 N ATOM 392 CA THR A 28 2.753 -10.479 7.131 1.00 0.00 C ATOM 393 C THR A 28 2.026 -9.237 6.609 1.00 0.00 C ATOM 394 O THR A 28 2.445 -8.112 6.873 1.00 0.00 O ATOM 395 CB THR A 28 3.992 -10.846 6.314 1.00 0.00 C ATOM 396 OG1 THR A 28 3.739 -12.178 5.878 1.00 0.00 O ATOM 397 CG2 THR A 28 5.249 -10.969 7.178 1.00 0.00 C ATOM 0 H THR A 28 2.225 -12.451 6.658 1.00 0.00 H new ATOM 0 HA THR A 28 3.076 -10.228 8.141 1.00 0.00 H new ATOM 0 HB THR A 28 4.154 -10.092 5.543 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.584 -12.606 5.626 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.099 -11.231 6.548 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.444 -10.018 7.674 1.00 0.00 H new ATOM 0 HG23 THR A 28 5.100 -11.746 7.928 1.00 0.00 H new ATOM 405 N LEU A 29 0.949 -9.485 5.879 1.00 0.00 N ATOM 406 CA LEU A 29 0.160 -8.402 5.318 1.00 0.00 C ATOM 407 C LEU A 29 -0.433 -7.567 6.454 1.00 0.00 C ATOM 408 O LEU A 29 -0.541 -6.346 6.341 1.00 0.00 O ATOM 409 CB LEU A 29 -0.889 -8.949 4.346 1.00 0.00 C ATOM 410 CG LEU A 29 -0.376 -9.347 2.961 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.315 -10.357 2.298 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.150 -8.113 2.085 1.00 0.00 C ATOM 0 H LEU A 29 0.604 -10.420 5.663 1.00 0.00 H new ATOM 0 HA LEU A 29 0.792 -7.738 4.729 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.359 -9.821 4.802 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.667 -8.196 4.221 1.00 0.00 H new ATOM 0 HG LEU A 29 0.590 -9.837 3.082 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.927 -10.623 1.315 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.382 -11.252 2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.306 -9.916 2.190 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.215 -8.424 1.106 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.090 -7.573 1.968 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.586 -7.462 2.556 1.00 0.00 H new ATOM 424 N LEU A 30 -0.799 -8.256 7.524 1.00 0.00 N ATOM 425 CA LEU A 30 -1.378 -7.593 8.680 1.00 0.00 C ATOM 426 C LEU A 30 -0.258 -6.982 9.525 1.00 0.00 C ATOM 427 O LEU A 30 -0.488 -6.035 10.276 1.00 0.00 O ATOM 428 CB LEU A 30 -2.277 -8.557 9.457 1.00 0.00 C ATOM 429 CG LEU A 30 -3.157 -9.480 8.612 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.164 -10.230 9.487 1.00 0.00 C ATOM 431 CD2 LEU A 30 -3.843 -8.705 7.486 1.00 0.00 C ATOM 0 H LEU A 30 -0.706 -9.268 7.615 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.025 -6.774 8.365 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.647 -9.174 10.097 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.922 -7.972 10.113 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.516 -10.228 8.144 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.777 -10.879 8.862 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.630 -10.833 10.221 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.803 -9.513 10.002 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.462 -9.385 6.901 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.468 -7.921 7.913 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.088 -8.256 6.841 1.00 0.00 H new ATOM 443 N VAL A 31 0.931 -7.547 9.374 1.00 0.00 N ATOM 444 CA VAL A 31 2.086 -7.070 10.113 1.00 0.00 C ATOM 445 C VAL A 31 2.369 -5.616 9.728 1.00 0.00 C ATOM 446 O VAL A 31 2.354 -5.270 8.547 1.00 0.00 O ATOM 447 CB VAL A 31 3.281 -7.994 9.872 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.546 -7.439 10.528 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.984 -9.412 10.365 1.00 0.00 C ATOM 0 H VAL A 31 1.119 -8.332 8.750 1.00 0.00 H new ATOM 0 HA VAL A 31 1.887 -7.090 11.184 1.00 0.00 H new ATOM 0 HB VAL A 31 3.456 -8.042 8.797 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.380 -8.116 10.341 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.773 -6.459 10.109 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.388 -7.346 11.603 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.849 -10.049 10.182 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.770 -9.388 11.434 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.121 -9.810 9.831 1.00 0.00 H new ATOM 459 N PRO A 32 2.625 -4.784 10.772 1.00 0.00 N ATOM 460 CA PRO A 32 2.909 -3.375 10.554 1.00 0.00 C ATOM 461 C PRO A 32 4.325 -3.181 10.006 1.00 0.00 C ATOM 462 O PRO A 32 4.536 -2.388 9.090 1.00 0.00 O ATOM 463 CB PRO A 32 2.701 -2.718 11.908 1.00 0.00 C ATOM 464 CG PRO A 32 2.761 -3.841 12.931 1.00 0.00 C ATOM 465 CD PRO A 32 2.650 -5.159 12.182 1.00 0.00 C ATOM 0 HA PRO A 32 2.258 -2.925 9.804 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.471 -1.972 12.102 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.741 -2.204 11.949 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.695 -3.798 13.491 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.951 -3.743 13.654 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.494 -5.812 12.403 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.746 -5.700 12.464 1.00 0.00 H new ATOM 473 N GLU A 33 5.257 -3.918 10.592 1.00 0.00 N ATOM 474 CA GLU A 33 6.647 -3.836 10.173 1.00 0.00 C ATOM 475 C GLU A 33 6.779 -4.203 8.694 1.00 0.00 C ATOM 476 O GLU A 33 7.512 -3.551 7.953 1.00 0.00 O ATOM 477 CB GLU A 33 7.534 -4.731 11.042 1.00 0.00 C ATOM 478 CG GLU A 33 7.138 -4.630 12.516 1.00 0.00 C ATOM 479 CD GLU A 33 8.326 -4.951 13.426 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.749 -6.128 13.413 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.785 -4.014 14.114 1.00 0.00 O ATOM 0 H GLU A 33 5.078 -4.574 11.352 1.00 0.00 H new ATOM 0 HA GLU A 33 6.986 -2.808 10.303 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.450 -5.766 10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.578 -4.441 10.922 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.772 -3.626 12.730 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.319 -5.319 12.724 1.00 0.00 H new ATOM 488 N VAL A 34 6.057 -5.245 8.309 1.00 0.00 N ATOM 489 CA VAL A 34 6.085 -5.707 6.932 1.00 0.00 C ATOM 490 C VAL A 34 5.287 -4.737 6.058 1.00 0.00 C ATOM 491 O VAL A 34 5.730 -4.364 4.973 1.00 0.00 O ATOM 492 CB VAL A 34 5.570 -7.146 6.852 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.403 -7.588 5.397 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.493 -8.101 7.612 1.00 0.00 C ATOM 0 H VAL A 34 5.449 -5.782 8.927 1.00 0.00 H new ATOM 0 HA VAL A 34 7.107 -5.721 6.554 1.00 0.00 H new ATOM 0 HB VAL A 34 4.589 -7.178 7.327 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.036 -8.614 5.368 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.689 -6.933 4.897 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.365 -7.532 4.887 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.105 -9.117 7.540 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.492 -8.063 7.179 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.540 -7.804 8.660 1.00 0.00 H new ATOM 504 N ALA A 35 4.123 -4.356 6.563 1.00 0.00 N ATOM 505 CA ALA A 35 3.258 -3.437 5.843 1.00 0.00 C ATOM 506 C ALA A 35 3.973 -2.094 5.679 1.00 0.00 C ATOM 507 O ALA A 35 4.001 -1.531 4.585 1.00 0.00 O ATOM 508 CB ALA A 35 1.926 -3.302 6.582 1.00 0.00 C ATOM 0 H ALA A 35 3.758 -4.667 7.463 1.00 0.00 H new ATOM 0 HA ALA A 35 3.039 -3.818 4.846 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.278 -2.612 6.041 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.445 -4.278 6.646 1.00 0.00 H new ATOM 0 HB3 ALA A 35 2.105 -2.919 7.587 1.00 0.00 H new ATOM 514 N ALA A 36 4.533 -1.619 6.782 1.00 0.00 N ATOM 515 CA ALA A 36 5.247 -0.354 6.774 1.00 0.00 C ATOM 516 C ALA A 36 6.391 -0.423 5.761 1.00 0.00 C ATOM 517 O ALA A 36 6.549 0.475 4.936 1.00 0.00 O ATOM 518 CB ALA A 36 5.739 -0.036 8.188 1.00 0.00 C ATOM 0 H ALA A 36 4.507 -2.088 7.687 1.00 0.00 H new ATOM 0 HA ALA A 36 4.586 0.457 6.468 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.275 0.913 8.182 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.886 0.033 8.863 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.407 -0.828 8.527 1.00 0.00 H new ATOM 524 N GLU A 37 7.159 -1.499 5.856 1.00 0.00 N ATOM 525 CA GLU A 37 8.283 -1.698 4.958 1.00 0.00 C ATOM 526 C GLU A 37 7.797 -1.783 3.510 1.00 0.00 C ATOM 527 O GLU A 37 8.487 -1.339 2.593 1.00 0.00 O ATOM 528 CB GLU A 37 9.078 -2.947 5.343 1.00 0.00 C ATOM 529 CG GLU A 37 10.191 -2.603 6.336 1.00 0.00 C ATOM 530 CD GLU A 37 10.540 -3.811 7.209 1.00 0.00 C ATOM 531 OE1 GLU A 37 10.862 -4.864 6.616 1.00 0.00 O ATOM 532 OE2 GLU A 37 10.476 -3.654 8.446 1.00 0.00 O ATOM 0 H GLU A 37 7.024 -2.242 6.542 1.00 0.00 H new ATOM 0 HA GLU A 37 8.950 -0.841 5.047 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.409 -3.687 5.783 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.509 -3.398 4.449 1.00 0.00 H new ATOM 0 HG2 GLU A 37 11.077 -2.273 5.794 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.876 -1.772 6.968 1.00 0.00 H new ATOM 539 N VAL A 38 6.614 -2.356 3.349 1.00 0.00 N ATOM 540 CA VAL A 38 6.028 -2.505 2.028 1.00 0.00 C ATOM 541 C VAL A 38 5.608 -1.131 1.503 1.00 0.00 C ATOM 542 O VAL A 38 5.986 -0.742 0.399 1.00 0.00 O ATOM 543 CB VAL A 38 4.871 -3.505 2.078 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.721 -3.060 1.171 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.346 -4.912 1.710 1.00 0.00 C ATOM 0 H VAL A 38 6.045 -2.723 4.112 1.00 0.00 H new ATOM 0 HA VAL A 38 6.760 -2.910 1.329 1.00 0.00 H new ATOM 0 HB VAL A 38 4.498 -3.534 3.102 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.912 -3.788 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.355 -2.087 1.498 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.076 -2.988 0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.504 -5.603 1.753 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.758 -4.905 0.701 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.115 -5.232 2.413 1.00 0.00 H new ATOM 555 N ILE A 39 4.831 -0.433 2.319 1.00 0.00 N ATOM 556 CA ILE A 39 4.354 0.889 1.951 1.00 0.00 C ATOM 557 C ILE A 39 5.554 1.808 1.710 1.00 0.00 C ATOM 558 O ILE A 39 5.570 2.574 0.747 1.00 0.00 O ATOM 559 CB ILE A 39 3.376 1.418 3.001 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.127 0.538 3.079 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.028 2.885 2.739 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.513 0.334 1.692 1.00 0.00 C ATOM 0 H ILE A 39 4.520 -0.759 3.234 1.00 0.00 H new ATOM 0 HA ILE A 39 3.791 0.846 1.019 1.00 0.00 H new ATOM 0 HB ILE A 39 3.864 1.373 3.975 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.385 -0.428 3.512 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.394 0.999 3.741 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.331 3.235 3.500 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.936 3.486 2.774 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.568 2.980 1.755 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.627 -0.295 1.775 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.234 1.300 1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.240 -0.149 1.040 1.00 0.00 H new ATOM 574 N LYS A 40 6.528 1.703 2.601 1.00 0.00 N ATOM 575 CA LYS A 40 7.729 2.516 2.497 1.00 0.00 C ATOM 576 C LYS A 40 8.569 2.028 1.315 1.00 0.00 C ATOM 577 O LYS A 40 9.124 2.834 0.569 1.00 0.00 O ATOM 578 CB LYS A 40 8.486 2.526 3.827 1.00 0.00 C ATOM 579 CG LYS A 40 9.997 2.584 3.597 1.00 0.00 C ATOM 580 CD LYS A 40 10.617 1.186 3.666 1.00 0.00 C ATOM 581 CE LYS A 40 12.064 1.204 3.173 1.00 0.00 C ATOM 582 NZ LYS A 40 12.892 2.085 4.026 1.00 0.00 N ATOM 0 H LYS A 40 6.511 1.068 3.399 1.00 0.00 H new ATOM 0 HA LYS A 40 7.469 3.555 2.297 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.172 3.384 4.422 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.236 1.632 4.399 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.203 3.029 2.624 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.458 3.227 4.346 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.583 0.819 4.692 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.031 0.494 3.061 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.470 0.193 3.183 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.098 1.551 2.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.893 1.982 3.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.599 3.074 3.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.767 1.820 5.024 1.00 0.00 H new ATOM 596 N ASP A 41 8.636 0.711 1.180 1.00 0.00 N ATOM 597 CA ASP A 41 9.398 0.107 0.102 1.00 0.00 C ATOM 598 C ASP A 41 8.837 0.580 -1.241 1.00 0.00 C ATOM 599 O ASP A 41 9.593 0.948 -2.139 1.00 0.00 O ATOM 600 CB ASP A 41 9.299 -1.418 0.145 1.00 0.00 C ATOM 601 CG ASP A 41 9.763 -2.133 -1.126 1.00 0.00 C ATOM 602 OD1 ASP A 41 10.996 -2.225 -1.309 1.00 0.00 O ATOM 603 OD2 ASP A 41 8.873 -2.571 -1.887 1.00 0.00 O ATOM 0 H ASP A 41 8.174 0.046 1.800 1.00 0.00 H new ATOM 0 HA ASP A 41 10.440 0.404 0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.891 -1.782 0.985 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.263 -1.694 0.342 1.00 0.00 H new ATOM 608 N LEU A 42 7.516 0.553 -1.335 1.00 0.00 N ATOM 609 CA LEU A 42 6.845 0.974 -2.554 1.00 0.00 C ATOM 610 C LEU A 42 7.155 2.449 -2.818 1.00 0.00 C ATOM 611 O LEU A 42 7.539 2.817 -3.928 1.00 0.00 O ATOM 612 CB LEU A 42 5.348 0.665 -2.475 1.00 0.00 C ATOM 613 CG LEU A 42 4.917 -0.704 -3.002 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.010 -1.418 -1.998 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.263 -0.581 -4.379 1.00 0.00 C ATOM 0 H LEU A 42 6.892 0.247 -0.588 1.00 0.00 H new ATOM 0 HA LEU A 42 7.219 0.411 -3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.035 0.746 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.809 1.432 -3.031 1.00 0.00 H new ATOM 0 HG LEU A 42 5.809 -1.319 -3.123 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.718 -2.389 -2.398 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.546 -1.558 -1.059 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.119 -0.816 -1.821 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.966 -1.569 -4.730 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.383 0.058 -4.308 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.973 -0.144 -5.081 1.00 0.00 H new ATOM 627 N VAL A 43 6.978 3.254 -1.781 1.00 0.00 N ATOM 628 CA VAL A 43 7.235 4.681 -1.888 1.00 0.00 C ATOM 629 C VAL A 43 8.722 4.907 -2.169 1.00 0.00 C ATOM 630 O VAL A 43 9.078 5.691 -3.046 1.00 0.00 O ATOM 631 CB VAL A 43 6.749 5.395 -0.625 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.641 6.594 -0.296 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.286 5.822 -0.766 1.00 0.00 C ATOM 0 H VAL A 43 6.660 2.946 -0.862 1.00 0.00 H new ATOM 0 HA VAL A 43 6.679 5.109 -2.722 1.00 0.00 H new ATOM 0 HB VAL A 43 6.814 4.691 0.205 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.274 7.084 0.606 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.663 6.253 -0.133 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.622 7.300 -1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.965 6.327 0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.185 6.501 -1.612 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.664 4.942 -0.931 1.00 0.00 H new ATOM 643 N ASN A 44 9.548 4.205 -1.406 1.00 0.00 N ATOM 644 CA ASN A 44 10.988 4.321 -1.562 1.00 0.00 C ATOM 645 C ASN A 44 11.367 4.006 -3.011 1.00 0.00 C ATOM 646 O ASN A 44 12.282 4.616 -3.563 1.00 0.00 O ATOM 647 CB ASN A 44 11.722 3.329 -0.656 1.00 0.00 C ATOM 648 CG ASN A 44 12.286 4.031 0.581 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.359 4.583 1.360 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.483 4.070 0.813 1.00 0.00 N flip ATOM 0 H ASN A 44 9.248 3.555 -0.679 1.00 0.00 H new ATOM 0 HA ASN A 44 11.275 5.337 -1.292 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.039 2.537 -0.349 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.532 2.855 -1.211 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.141 3.625 0.173 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.826 4.547 1.647 1.00 0.00 H new ATOM 657 N THR A 45 10.645 3.056 -3.585 1.00 0.00 N ATOM 658 CA THR A 45 10.894 2.653 -4.959 1.00 0.00 C ATOM 659 C THR A 45 10.420 3.739 -5.927 1.00 0.00 C ATOM 660 O THR A 45 11.105 4.050 -6.900 1.00 0.00 O ATOM 661 CB THR A 45 10.216 1.300 -5.184 1.00 0.00 C ATOM 662 OG1 THR A 45 10.856 0.432 -4.254 1.00 0.00 O ATOM 663 CG2 THR A 45 10.553 0.698 -6.550 1.00 0.00 C ATOM 0 H THR A 45 9.887 2.553 -3.124 1.00 0.00 H new ATOM 0 HA THR A 45 11.961 2.534 -5.150 1.00 0.00 H new ATOM 0 HB THR A 45 9.136 1.415 -5.094 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.279 0.308 -3.472 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.047 -0.261 -6.660 1.00 0.00 H new ATOM 0 HG22 THR A 45 10.222 1.375 -7.338 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.630 0.551 -6.627 1.00 0.00 H new ATOM 925 N LYS B 203 -2.443 17.799 -7.610 1.00 0.00 N ATOM 926 CA LYS B 203 -2.843 17.390 -6.273 1.00 0.00 C ATOM 927 C LYS B 203 -1.919 16.272 -5.788 1.00 0.00 C ATOM 928 O LYS B 203 -1.316 15.566 -6.595 1.00 0.00 O ATOM 929 CB LYS B 203 -4.327 17.014 -6.250 1.00 0.00 C ATOM 930 CG LYS B 203 -4.970 17.403 -4.917 1.00 0.00 C ATOM 931 CD LYS B 203 -6.487 17.538 -5.059 1.00 0.00 C ATOM 932 CE LYS B 203 -6.909 19.008 -5.060 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.304 19.146 -5.535 1.00 0.00 N ATOM 0 HA LYS B 203 -2.736 18.219 -5.573 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -4.845 17.514 -7.068 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.437 15.942 -6.412 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -4.737 16.651 -4.164 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.549 18.345 -4.567 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -6.813 17.062 -5.984 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -6.980 17.015 -4.240 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.818 19.419 -4.055 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.242 19.584 -5.701 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.575 20.150 -5.530 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.380 18.772 -6.503 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.939 18.613 -4.907 1.00 0.00 H new ATOM 947 N ALA B 204 -1.834 16.147 -4.472 1.00 0.00 N ATOM 948 CA ALA B 204 -0.992 15.127 -3.870 1.00 0.00 C ATOM 949 C ALA B 204 -1.869 13.976 -3.373 1.00 0.00 C ATOM 950 O ALA B 204 -2.587 14.120 -2.384 1.00 0.00 O ATOM 951 CB ALA B 204 -0.158 15.750 -2.748 1.00 0.00 C ATOM 0 H ALA B 204 -2.334 16.735 -3.805 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.298 14.720 -4.605 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.474 14.985 -2.296 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.468 16.543 -3.157 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.821 16.167 -1.990 1.00 0.00 H new ATOM 957 N THR B 205 -1.784 12.860 -4.082 1.00 0.00 N ATOM 958 CA THR B 205 -2.561 11.685 -3.725 1.00 0.00 C ATOM 959 C THR B 205 -1.795 10.410 -4.083 1.00 0.00 C ATOM 960 O THR B 205 -0.880 10.442 -4.905 1.00 0.00 O ATOM 961 CB THR B 205 -3.922 11.791 -4.417 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.600 12.107 -5.769 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.732 12.995 -3.935 1.00 0.00 C ATOM 0 H THR B 205 -1.189 12.745 -4.902 1.00 0.00 H new ATOM 0 HA THR B 205 -2.730 11.634 -2.649 1.00 0.00 H new ATOM 0 HB THR B 205 -4.491 10.878 -4.241 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.425 12.192 -6.290 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.688 13.023 -4.458 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.907 12.910 -2.862 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.179 13.911 -4.141 1.00 0.00 H new ATOM 971 N TYR B 206 -2.196 9.319 -3.448 1.00 0.00 N ATOM 972 CA TYR B 206 -1.559 8.035 -3.689 1.00 0.00 C ATOM 973 C TYR B 206 -2.601 6.931 -3.874 1.00 0.00 C ATOM 974 O TYR B 206 -3.659 6.961 -3.248 1.00 0.00 O ATOM 975 CB TYR B 206 -0.731 7.735 -2.438 1.00 0.00 C ATOM 976 CG TYR B 206 0.778 7.894 -2.637 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.372 9.125 -2.451 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.544 6.806 -3.002 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.792 9.275 -2.638 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.964 6.955 -3.190 1.00 0.00 C ATOM 981 CZ TYR B 206 3.518 8.183 -2.999 1.00 0.00 C ATOM 982 OH TYR B 206 4.859 8.324 -3.176 1.00 0.00 O ATOM 0 H TYR B 206 -2.955 9.297 -2.766 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.952 8.071 -4.594 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.053 8.397 -1.634 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.939 6.715 -2.113 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.772 9.976 -2.165 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.079 5.842 -3.147 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.270 10.233 -2.495 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.575 6.112 -3.476 1.00 0.00 H new ATOM 0 HH TYR B 206 5.194 9.034 -2.589 1.00 0.00 H new ATOM 992 N THR B 207 -2.266 5.983 -4.737 1.00 0.00 N ATOM 993 CA THR B 207 -3.160 4.871 -5.012 1.00 0.00 C ATOM 994 C THR B 207 -2.475 3.543 -4.686 1.00 0.00 C ATOM 995 O THR B 207 -1.566 3.118 -5.397 1.00 0.00 O ATOM 996 CB THR B 207 -3.613 4.979 -6.469 1.00 0.00 C ATOM 997 OG1 THR B 207 -3.918 6.361 -6.637 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.947 4.271 -6.722 1.00 0.00 C ATOM 0 H THR B 207 -1.388 5.962 -5.255 1.00 0.00 H new ATOM 0 HA THR B 207 -4.045 4.908 -4.377 1.00 0.00 H new ATOM 0 HB THR B 207 -2.847 4.555 -7.119 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.367 6.495 -7.498 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.223 4.378 -7.771 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.849 3.213 -6.479 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.720 4.717 -6.096 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.939 2.924 -3.610 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.382 1.653 -3.180 1.00 0.00 C ATOM 1008 C VAL B 208 -3.344 0.525 -3.561 1.00 0.00 C ATOM 1009 O VAL B 208 -4.525 0.569 -3.216 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.074 1.695 -1.682 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.714 0.304 -1.156 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.962 2.701 -1.379 1.00 0.00 C ATOM 0 H VAL B 208 -3.694 3.279 -3.024 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.436 1.460 -3.687 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.975 2.025 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.500 0.363 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.550 -0.375 -1.321 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.835 -0.068 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.763 2.711 -0.307 1.00 0.00 H new ATOM 0 HG22 VAL B 208 -0.057 2.414 -1.914 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.273 3.695 -1.700 1.00 0.00 H new ATOM 1022 N THR B 209 -2.805 -0.458 -4.266 1.00 0.00 N ATOM 1023 CA THR B 209 -3.600 -1.595 -4.697 1.00 0.00 C ATOM 1024 C THR B 209 -3.097 -2.879 -4.035 1.00 0.00 C ATOM 1025 O THR B 209 -1.912 -3.002 -3.730 1.00 0.00 O ATOM 1026 CB THR B 209 -3.564 -1.644 -6.225 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.627 -0.276 -6.619 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.831 -2.262 -6.821 1.00 0.00 C ATOM 0 H THR B 209 -1.826 -0.491 -4.550 1.00 0.00 H new ATOM 0 HA THR B 209 -4.639 -1.492 -4.385 1.00 0.00 H new ATOM 0 HB THR B 209 -2.694 -2.215 -6.549 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.607 -0.216 -7.597 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.754 -2.273 -7.908 1.00 0.00 H new ATOM 0 HG22 THR B 209 -4.945 -3.282 -6.455 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.698 -1.672 -6.525 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.023 -3.805 -3.834 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.688 -5.075 -3.214 1.00 0.00 C ATOM 1038 C VAL B 210 -4.455 -6.198 -3.916 1.00 0.00 C ATOM 1039 O VAL B 210 -5.683 -6.252 -3.851 1.00 0.00 O ATOM 1040 CB VAL B 210 -3.964 -5.013 -1.709 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.434 -6.370 -1.182 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.732 -4.524 -0.946 1.00 0.00 C ATOM 0 H VAL B 210 -5.005 -3.701 -4.090 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.625 -5.286 -3.327 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.767 -4.294 -1.544 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.623 -6.299 -0.111 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.351 -6.661 -1.694 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.663 -7.118 -1.365 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -2.955 -4.489 0.120 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.901 -5.207 -1.121 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.461 -3.527 -1.293 1.00 0.00 H new ATOM 1052 N THR B 211 -3.700 -7.067 -4.571 1.00 0.00 N ATOM 1053 CA THR B 211 -4.293 -8.185 -5.285 1.00 0.00 C ATOM 1054 C THR B 211 -3.774 -9.511 -4.725 1.00 0.00 C ATOM 1055 O THR B 211 -2.569 -9.690 -4.561 1.00 0.00 O ATOM 1056 CB THR B 211 -4.004 -8.002 -6.776 1.00 0.00 C ATOM 1057 OG1 THR B 211 -4.893 -6.962 -7.177 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.441 -9.207 -7.610 1.00 0.00 C ATOM 0 H THR B 211 -2.682 -7.020 -4.622 1.00 0.00 H new ATOM 0 HA THR B 211 -5.374 -8.211 -5.150 1.00 0.00 H new ATOM 0 HB THR B 211 -2.937 -7.829 -6.920 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.433 -6.361 -7.799 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.213 -9.025 -8.660 1.00 0.00 H new ATOM 0 HG22 THR B 211 -3.908 -10.096 -7.272 1.00 0.00 H new ATOM 0 HG23 THR B 211 -5.514 -9.361 -7.493 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.711 -10.406 -4.446 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.364 -11.709 -3.908 1.00 0.00 C ATOM 1068 C ASN B 212 -4.302 -12.727 -5.048 1.00 0.00 C ATOM 1069 O ASN B 212 -5.331 -13.244 -5.480 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.415 -12.189 -2.904 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.944 -11.022 -2.067 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.432 -9.916 -2.101 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.997 -11.331 -1.314 1.00 0.00 N ATOM 0 H ASN B 212 -5.710 -10.253 -4.583 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.400 -11.620 -3.407 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.240 -12.665 -3.434 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.980 -12.944 -2.249 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.424 -10.621 -0.719 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.377 -12.277 -1.332 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.084 -12.985 -5.503 1.00 0.00 N ATOM 1081 CA ASN B 213 -2.874 -13.931 -6.585 1.00 0.00 C ATOM 1082 C ASN B 213 -3.406 -15.304 -6.167 1.00 0.00 C ATOM 1083 O ASN B 213 -3.583 -16.187 -7.006 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.386 -14.080 -6.906 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.084 -13.623 -8.334 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.331 -14.323 -9.303 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.537 -12.413 -8.411 1.00 0.00 N ATOM 0 H ASN B 213 -2.233 -12.555 -5.141 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.397 -13.557 -7.465 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.798 -13.493 -6.201 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.086 -15.121 -6.783 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.298 -12.018 -9.321 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.357 -11.880 -7.560 1.00 0.00 H new ATOM 1094 N SER B 214 -3.649 -15.440 -4.871 1.00 0.00 N ATOM 1095 CA SER B 214 -4.157 -16.689 -4.333 1.00 0.00 C ATOM 1096 C SER B 214 -5.664 -16.788 -4.575 1.00 0.00 C ATOM 1097 O SER B 214 -6.187 -17.875 -4.815 1.00 0.00 O ATOM 1098 CB SER B 214 -3.852 -16.809 -2.838 1.00 0.00 C ATOM 1099 OG SER B 214 -5.040 -16.856 -2.052 1.00 0.00 O ATOM 0 H SER B 214 -3.503 -14.705 -4.179 1.00 0.00 H new ATOM 0 HA SER B 214 -3.657 -17.511 -4.846 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.263 -17.709 -2.659 1.00 0.00 H new ATOM 0 HB3 SER B 214 -3.243 -15.962 -2.523 1.00 0.00 H new ATOM 0 HG SER B 214 -4.802 -16.934 -1.104 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.320 -15.639 -4.505 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.757 -15.584 -4.714 1.00 0.00 C ATOM 1107 C ASN B 215 -8.048 -14.865 -6.033 1.00 0.00 C ATOM 1108 O ASN B 215 -9.206 -14.720 -6.423 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.447 -14.807 -3.591 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.640 -15.590 -3.036 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.585 -16.791 -2.831 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.716 -14.843 -2.807 1.00 0.00 N ATOM 0 H ASN B 215 -5.883 -14.739 -4.307 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.135 -16.606 -4.731 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.734 -14.607 -2.791 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.784 -13.841 -3.966 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.565 -15.271 -2.437 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.693 -13.842 -3.001 1.00 0.00 H new ATOM 1119 N GLY B 216 -6.978 -14.432 -6.683 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.104 -13.732 -7.950 1.00 0.00 C ATOM 1121 C GLY B 216 -7.949 -12.466 -7.795 1.00 0.00 C ATOM 1122 O GLY B 216 -8.386 -11.882 -8.785 1.00 0.00 O ATOM 0 H GLY B 216 -6.019 -14.552 -6.356 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.115 -13.470 -8.325 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.561 -14.390 -8.689 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.154 -12.079 -6.545 1.00 0.00 N ATOM 1127 CA VAL B 217 -8.939 -10.894 -6.247 1.00 0.00 C ATOM 1128 C VAL B 217 -8.016 -9.675 -6.196 1.00 0.00 C ATOM 1129 O VAL B 217 -6.876 -9.775 -5.747 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.729 -11.100 -4.953 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.414 -9.804 -4.515 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.747 -12.232 -5.106 1.00 0.00 C ATOM 0 H VAL B 217 -7.790 -12.566 -5.726 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.672 -10.714 -7.034 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.023 -11.386 -4.173 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.968 -9.979 -3.593 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.661 -9.034 -4.345 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.101 -9.474 -5.294 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.295 -12.357 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.445 -11.988 -5.906 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.227 -13.159 -5.349 1.00 0.00 H new ATOM 1142 N SER B 218 -8.543 -8.553 -6.662 1.00 0.00 N ATOM 1143 CA SER B 218 -7.781 -7.316 -6.675 1.00 0.00 C ATOM 1144 C SER B 218 -8.613 -6.181 -6.075 1.00 0.00 C ATOM 1145 O SER B 218 -9.839 -6.189 -6.169 1.00 0.00 O ATOM 1146 CB SER B 218 -7.338 -6.956 -8.095 1.00 0.00 C ATOM 1147 OG SER B 218 -6.653 -5.708 -8.140 1.00 0.00 O ATOM 0 H SER B 218 -9.490 -8.474 -7.034 1.00 0.00 H new ATOM 0 HA SER B 218 -6.886 -7.460 -6.070 1.00 0.00 H new ATOM 0 HB2 SER B 218 -6.688 -7.741 -8.482 1.00 0.00 H new ATOM 0 HB3 SER B 218 -8.210 -6.915 -8.747 1.00 0.00 H new ATOM 0 HG SER B 218 -5.965 -5.687 -7.442 1.00 0.00 H new ATOM 1153 N VAL B 219 -7.912 -5.232 -5.470 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.572 -4.093 -4.855 1.00 0.00 C ATOM 1155 C VAL B 219 -7.610 -2.903 -4.831 1.00 0.00 C ATOM 1156 O VAL B 219 -6.460 -3.038 -4.414 1.00 0.00 O ATOM 1157 CB VAL B 219 -9.085 -4.473 -3.464 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -10.003 -3.386 -2.901 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -9.794 -5.829 -3.494 1.00 0.00 C ATOM 0 H VAL B 219 -6.895 -5.229 -5.393 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.443 -3.796 -5.439 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.224 -4.559 -2.801 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -10.353 -3.682 -1.912 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -9.453 -2.448 -2.826 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.858 -3.253 -3.564 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.149 -6.076 -2.494 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.641 -5.782 -4.178 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.097 -6.596 -3.832 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.115 -1.766 -5.287 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.314 -0.554 -5.324 1.00 0.00 C ATOM 1171 C ASP B 220 -7.852 0.438 -4.291 1.00 0.00 C ATOM 1172 O ASP B 220 -9.051 0.472 -4.022 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.385 0.111 -6.700 1.00 0.00 C ATOM 1174 CG ASP B 220 -7.912 -0.784 -7.824 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.126 -1.074 -7.797 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.086 -1.157 -8.686 1.00 0.00 O ATOM 0 H ASP B 220 -9.068 -1.658 -5.634 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.281 -0.825 -5.108 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.022 0.992 -6.629 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.388 0.460 -6.970 1.00 0.00 H new ATOM 1181 N TYR B 221 -6.936 1.222 -3.740 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.303 2.212 -2.741 1.00 0.00 C ATOM 1183 C TYR B 221 -6.572 3.534 -2.986 1.00 0.00 C ATOM 1184 O TYR B 221 -5.345 3.563 -3.071 1.00 0.00 O ATOM 1185 CB TYR B 221 -6.857 1.639 -1.395 1.00 0.00 C ATOM 1186 CG TYR B 221 -7.417 0.247 -1.095 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -6.995 -0.840 -1.833 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.344 0.078 -0.087 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -7.522 -2.150 -1.552 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -8.871 -1.232 0.195 1.00 0.00 C ATOM 1191 CZ TYR B 221 -8.434 -2.282 -0.551 1.00 0.00 C ATOM 1192 OH TYR B 221 -8.931 -3.519 -0.285 1.00 0.00 O ATOM 0 H TYR B 221 -5.942 1.192 -3.966 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.374 2.413 -2.775 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -5.768 1.594 -1.374 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -7.163 2.321 -0.602 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -6.269 -0.708 -2.622 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -8.674 0.929 0.491 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -7.201 -3.009 -2.123 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.597 -1.378 0.981 1.00 0.00 H new ATOM 0 HH TYR B 221 -8.217 -4.090 0.068 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.357 4.596 -3.094 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.799 5.917 -3.327 1.00 0.00 C ATOM 1204 C GLU B 222 -6.745 6.710 -2.018 1.00 0.00 C ATOM 1205 O GLU B 222 -7.782 7.049 -1.450 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.602 6.671 -4.390 1.00 0.00 C ATOM 1207 CG GLU B 222 -7.020 8.066 -4.630 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.627 8.705 -5.881 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -8.873 8.680 -5.982 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -6.833 9.205 -6.705 1.00 0.00 O ATOM 0 H GLU B 222 -8.374 4.568 -3.024 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.782 5.799 -3.701 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.598 6.106 -5.322 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.641 6.756 -4.073 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.213 8.699 -3.764 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.938 7.999 -4.740 1.00 0.00 H new ATOM 1217 N THR B 223 -5.525 6.981 -1.579 1.00 0.00 N ATOM 1218 CA THR B 223 -5.322 7.727 -0.349 1.00 0.00 C ATOM 1219 C THR B 223 -4.170 8.722 -0.512 1.00 0.00 C ATOM 1220 O THR B 223 -3.196 8.440 -1.207 1.00 0.00 O ATOM 1221 CB THR B 223 -5.099 6.720 0.782 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.563 7.399 1.947 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.616 6.472 1.061 1.00 0.00 C ATOM 0 H THR B 223 -4.667 6.698 -2.053 1.00 0.00 H new ATOM 0 HA THR B 223 -6.197 8.328 -0.102 1.00 0.00 H new ATOM 0 HB THR B 223 -5.583 5.777 0.529 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.457 6.817 2.729 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.514 5.750 1.872 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.138 6.080 0.164 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.138 7.409 1.347 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.322 9.864 0.141 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.307 10.902 0.077 1.00 0.00 C ATOM 1233 C GLU B 224 -2.479 10.916 1.364 1.00 0.00 C ATOM 1234 O GLU B 224 -2.871 11.536 2.351 1.00 0.00 O ATOM 1235 CB GLU B 224 -3.939 12.271 -0.183 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.416 12.278 0.215 1.00 0.00 C ATOM 1237 CD GLU B 224 -6.028 13.668 0.027 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -6.083 14.110 -1.140 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -6.429 14.255 1.055 1.00 0.00 O ATOM 0 H GLU B 224 -5.132 10.094 0.717 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.641 10.681 -0.757 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.403 13.035 0.380 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.842 12.526 -1.238 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.962 11.552 -0.387 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.517 11.970 1.256 1.00 0.00 H new ATOM 1246 N THR B 225 -1.351 10.225 1.311 1.00 0.00 N ATOM 1247 CA THR B 225 -0.464 10.149 2.460 1.00 0.00 C ATOM 1248 C THR B 225 0.987 10.377 2.030 1.00 0.00 C ATOM 1249 O THR B 225 1.578 9.535 1.357 1.00 0.00 O ATOM 1250 CB THR B 225 -0.690 8.799 3.144 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.658 7.859 2.073 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.102 8.662 3.718 1.00 0.00 C ATOM 0 H THR B 225 -1.030 9.712 0.490 1.00 0.00 H new ATOM 0 HA THR B 225 -0.684 10.936 3.182 1.00 0.00 H new ATOM 0 HB THR B 225 0.040 8.670 3.943 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.795 6.955 2.427 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.209 7.686 4.192 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.272 9.445 4.457 1.00 0.00 H new ATOM 0 HG23 THR B 225 -2.832 8.757 2.914 1.00 0.00 H new ATOM 1260 N PRO B 226 1.532 11.551 2.448 1.00 0.00 N ATOM 1261 CA PRO B 226 2.902 11.900 2.113 1.00 0.00 C ATOM 1262 C PRO B 226 3.894 11.099 2.958 1.00 0.00 C ATOM 1263 O PRO B 226 4.391 10.063 2.522 1.00 0.00 O ATOM 1264 CB PRO B 226 2.995 13.399 2.350 1.00 0.00 C ATOM 1265 CG PRO B 226 1.818 13.754 3.246 1.00 0.00 C ATOM 1266 CD PRO B 226 0.861 12.573 3.246 1.00 0.00 C ATOM 0 HA PRO B 226 3.158 11.656 1.082 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.940 13.661 2.825 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.948 13.947 1.409 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.160 13.969 4.259 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.318 14.651 2.882 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.667 12.220 4.259 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.102 12.844 2.813 1.00 0.00 H new ATOM 1274 N MET B 227 4.152 11.611 4.153 1.00 0.00 N ATOM 1275 CA MET B 227 5.075 10.956 5.064 1.00 0.00 C ATOM 1276 C MET B 227 4.437 9.717 5.696 1.00 0.00 C ATOM 1277 O MET B 227 5.133 8.763 6.040 1.00 0.00 O ATOM 1278 CB MET B 227 5.489 11.936 6.164 1.00 0.00 C ATOM 1279 CG MET B 227 5.883 13.290 5.573 1.00 0.00 C ATOM 1280 SD MET B 227 5.358 14.607 6.659 1.00 0.00 S ATOM 1281 CE MET B 227 3.621 14.220 6.799 1.00 0.00 C ATOM 0 H MET B 227 3.738 12.472 4.511 1.00 0.00 H new ATOM 0 HA MET B 227 5.951 10.640 4.498 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.666 12.068 6.867 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.326 11.524 6.727 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.963 13.334 5.431 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.427 13.414 4.591 1.00 0.00 H new ATOM 0 HE1 MET B 227 3.033 15.123 6.637 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.353 13.473 6.051 1.00 0.00 H new ATOM 0 HE3 MET B 227 3.415 13.827 7.795 1.00 0.00 H new ATOM 1291 N THR B 228 3.121 9.772 5.830 1.00 0.00 N ATOM 1292 CA THR B 228 2.381 8.668 6.414 1.00 0.00 C ATOM 1293 C THR B 228 2.735 7.357 5.709 1.00 0.00 C ATOM 1294 O THR B 228 2.785 6.301 6.340 1.00 0.00 O ATOM 1295 CB THR B 228 0.891 9.009 6.349 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.854 10.284 5.714 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.286 9.262 7.732 1.00 0.00 C ATOM 0 H THR B 228 2.547 10.565 5.544 1.00 0.00 H new ATOM 0 HA THR B 228 2.650 8.522 7.460 1.00 0.00 H new ATOM 0 HB THR B 228 0.354 8.195 5.862 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.076 10.581 5.630 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.773 9.500 7.628 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.399 8.369 8.347 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.800 10.097 8.207 1.00 0.00 H new ATOM 1305 N LEU B 229 2.972 7.466 4.410 1.00 0.00 N ATOM 1306 CA LEU B 229 3.321 6.302 3.612 1.00 0.00 C ATOM 1307 C LEU B 229 4.493 5.571 4.271 1.00 0.00 C ATOM 1308 O LEU B 229 4.585 4.346 4.199 1.00 0.00 O ATOM 1309 CB LEU B 229 3.584 6.707 2.162 1.00 0.00 C ATOM 1310 CG LEU B 229 2.351 6.833 1.265 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.674 7.623 -0.005 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.758 5.459 0.951 1.00 0.00 C ATOM 0 H LEU B 229 2.929 8.342 3.890 1.00 0.00 H new ATOM 0 HA LEU B 229 2.488 5.600 3.575 1.00 0.00 H new ATOM 0 HB2 LEU B 229 4.107 7.663 2.162 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.258 5.975 1.718 1.00 0.00 H new ATOM 0 HG LEU B 229 1.591 7.395 1.808 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.780 7.697 -0.624 1.00 0.00 H new ATOM 0 HD12 LEU B 229 3.013 8.623 0.265 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.460 7.112 -0.562 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.883 5.578 0.312 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.502 4.850 0.438 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.465 4.968 1.879 1.00 0.00 H new ATOM 1324 N LEU B 230 5.361 6.354 4.896 1.00 0.00 N ATOM 1325 CA LEU B 230 6.524 5.796 5.565 1.00 0.00 C ATOM 1326 C LEU B 230 6.123 5.324 6.964 1.00 0.00 C ATOM 1327 O LEU B 230 6.775 4.453 7.539 1.00 0.00 O ATOM 1328 CB LEU B 230 7.677 6.801 5.561 1.00 0.00 C ATOM 1329 CG LEU B 230 7.939 7.516 4.234 1.00 0.00 C ATOM 1330 CD1 LEU B 230 9.149 8.447 4.343 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.089 6.512 3.090 1.00 0.00 C ATOM 0 H LEU B 230 5.282 7.369 4.953 1.00 0.00 H new ATOM 0 HA LEU B 230 6.892 4.923 5.027 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.479 7.554 6.324 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.588 6.280 5.856 1.00 0.00 H new ATOM 0 HG LEU B 230 7.074 8.138 4.004 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.314 8.943 3.386 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.964 9.196 5.113 1.00 0.00 H new ATOM 0 HD13 LEU B 230 10.033 7.866 4.607 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.274 7.047 2.159 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.926 5.845 3.298 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.174 5.927 2.997 1.00 0.00 H new ATOM 1343 N VAL B 231 5.055 5.920 7.473 1.00 0.00 N ATOM 1344 CA VAL B 231 4.560 5.572 8.793 1.00 0.00 C ATOM 1345 C VAL B 231 4.065 4.125 8.783 1.00 0.00 C ATOM 1346 O VAL B 231 3.330 3.723 7.881 1.00 0.00 O ATOM 1347 CB VAL B 231 3.485 6.569 9.230 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.866 6.158 10.567 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.051 7.989 9.300 1.00 0.00 C ATOM 0 H VAL B 231 4.518 6.643 6.994 1.00 0.00 H new ATOM 0 HA VAL B 231 5.361 5.636 9.529 1.00 0.00 H new ATOM 0 HB VAL B 231 2.695 6.560 8.479 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.105 6.884 10.854 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.409 5.173 10.469 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.642 6.124 11.332 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.267 8.678 9.613 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.869 8.019 10.020 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.421 8.282 8.317 1.00 0.00 H new ATOM 1359 N PRO B 232 4.497 3.361 9.822 1.00 0.00 N ATOM 1360 CA PRO B 232 4.105 1.968 9.939 1.00 0.00 C ATOM 1361 C PRO B 232 2.653 1.844 10.408 1.00 0.00 C ATOM 1362 O PRO B 232 1.906 1.002 9.910 1.00 0.00 O ATOM 1363 CB PRO B 232 5.098 1.360 10.917 1.00 0.00 C ATOM 1364 CG PRO B 232 5.716 2.531 11.663 1.00 0.00 C ATOM 1365 CD PRO B 232 5.367 3.803 10.908 1.00 0.00 C ATOM 0 HA PRO B 232 4.133 1.442 8.985 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.600 0.677 11.605 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.861 0.784 10.392 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.336 2.577 12.683 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.797 2.412 11.731 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.861 4.521 11.554 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.261 4.294 10.524 1.00 0.00 H new ATOM 1373 N GLU B 233 2.297 2.695 11.358 1.00 0.00 N ATOM 1374 CA GLU B 233 0.948 2.692 11.899 1.00 0.00 C ATOM 1375 C GLU B 233 -0.069 2.962 10.789 1.00 0.00 C ATOM 1376 O GLU B 233 -1.157 2.389 10.786 1.00 0.00 O ATOM 1377 CB GLU B 233 0.809 3.712 13.031 1.00 0.00 C ATOM 1378 CG GLU B 233 2.051 3.714 13.923 1.00 0.00 C ATOM 1379 CD GLU B 233 1.727 4.267 15.313 1.00 0.00 C ATOM 1380 OE1 GLU B 233 1.673 5.509 15.431 1.00 0.00 O ATOM 1381 OE2 GLU B 233 1.541 3.433 16.226 1.00 0.00 O ATOM 0 H GLU B 233 2.919 3.392 11.768 1.00 0.00 H new ATOM 0 HA GLU B 233 0.747 1.706 12.317 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.656 4.707 12.612 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.072 3.479 13.629 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.440 2.700 14.013 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.834 4.316 13.461 1.00 0.00 H new ATOM 1388 N VAL B 234 0.320 3.836 9.872 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.544 4.189 8.759 1.00 0.00 C ATOM 1390 C VAL B 234 -0.429 3.120 7.670 1.00 0.00 C ATOM 1391 O VAL B 234 -1.439 2.648 7.150 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.203 5.593 8.256 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -1.158 6.023 7.142 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.209 6.604 9.405 1.00 0.00 C ATOM 0 H VAL B 234 1.223 4.310 9.878 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.586 4.217 9.079 1.00 0.00 H new ATOM 0 HB VAL B 234 0.804 5.565 7.841 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.894 7.024 6.802 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -1.082 5.325 6.308 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.180 6.026 7.520 1.00 0.00 H new ATOM 0 HG21 VAL B 234 0.036 7.594 9.020 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.198 6.628 9.863 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.530 6.311 10.151 1.00 0.00 H new ATOM 1404 N ALA B 235 0.810 2.769 7.359 1.00 0.00 N ATOM 1405 CA ALA B 235 1.070 1.764 6.342 1.00 0.00 C ATOM 1406 C ALA B 235 0.477 0.427 6.789 1.00 0.00 C ATOM 1407 O ALA B 235 -0.169 -0.264 6.004 1.00 0.00 O ATOM 1408 CB ALA B 235 2.576 1.678 6.082 1.00 0.00 C ATOM 0 H ALA B 235 1.645 3.162 7.793 1.00 0.00 H new ATOM 0 HA ALA B 235 0.593 2.037 5.401 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.771 0.924 5.319 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.942 2.645 5.738 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.089 1.403 7.003 1.00 0.00 H new ATOM 1414 N ALA B 236 0.720 0.101 8.051 1.00 0.00 N ATOM 1415 CA ALA B 236 0.218 -1.142 8.612 1.00 0.00 C ATOM 1416 C ALA B 236 -1.301 -1.197 8.442 1.00 0.00 C ATOM 1417 O ALA B 236 -1.844 -2.213 8.011 1.00 0.00 O ATOM 1418 CB ALA B 236 0.645 -1.249 10.077 1.00 0.00 C ATOM 0 H ALA B 236 1.257 0.676 8.700 1.00 0.00 H new ATOM 0 HA ALA B 236 0.639 -1.999 8.086 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.269 -2.181 10.498 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.733 -1.235 10.141 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.238 -0.407 10.637 1.00 0.00 H new ATOM 1424 N GLU B 237 -1.944 -0.091 8.788 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.390 -0.002 8.679 1.00 0.00 C ATOM 1426 C GLU B 237 -3.814 -0.025 7.209 1.00 0.00 C ATOM 1427 O GLU B 237 -4.851 -0.589 6.867 1.00 0.00 O ATOM 1428 CB GLU B 237 -3.916 1.251 9.381 1.00 0.00 C ATOM 1429 CG GLU B 237 -5.388 1.493 9.043 1.00 0.00 C ATOM 1430 CD GLU B 237 -6.181 1.889 10.290 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -6.114 1.119 11.273 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -6.834 2.953 10.233 1.00 0.00 O ATOM 0 H GLU B 237 -1.490 0.750 9.144 1.00 0.00 H new ATOM 0 HA GLU B 237 -3.826 -0.868 9.177 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.800 1.143 10.459 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -3.324 2.116 9.081 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -5.468 2.280 8.293 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -5.817 0.591 8.606 1.00 0.00 H new ATOM 1439 N VAL B 238 -2.988 0.595 6.379 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.265 0.653 4.953 1.00 0.00 C ATOM 1441 C VAL B 238 -3.190 -0.758 4.366 1.00 0.00 C ATOM 1442 O VAL B 238 -4.135 -1.218 3.728 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.307 1.635 4.274 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -2.046 1.230 2.822 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.839 3.066 4.357 1.00 0.00 C ATOM 0 H VAL B 238 -2.127 1.061 6.666 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.273 1.026 4.774 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.357 1.600 4.808 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.362 1.944 2.362 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.603 0.235 2.796 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.987 1.223 2.272 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.139 3.743 3.867 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.808 3.123 3.860 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -2.950 3.353 5.403 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.058 -1.404 4.603 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.849 -2.753 4.106 1.00 0.00 C ATOM 1457 C ILE B 239 -2.953 -3.667 4.641 1.00 0.00 C ATOM 1458 O ILE B 239 -3.595 -4.383 3.875 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.436 -3.234 4.442 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.615 -2.437 3.666 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.300 -4.740 4.209 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.284 -2.403 2.173 1.00 0.00 C ATOM 0 H ILE B 239 -1.276 -1.018 5.132 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.918 -2.773 3.018 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.258 -3.054 5.502 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.665 -1.420 4.054 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.598 -2.884 3.814 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.714 -5.056 4.455 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.010 -5.272 4.842 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.507 -4.966 3.163 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.046 -1.831 1.644 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.258 -3.420 1.783 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.689 -1.934 2.027 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.139 -3.611 5.951 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.156 -4.425 6.597 1.00 0.00 C ATOM 1476 C LYS B 240 -5.536 -4.016 6.079 1.00 0.00 C ATOM 1477 O LYS B 240 -6.361 -4.871 5.761 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.021 -4.341 8.119 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.392 -4.403 8.795 1.00 0.00 C ATOM 1480 CD LYS B 240 -5.906 -3.000 9.121 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.395 -3.030 9.476 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.594 -3.593 10.829 1.00 0.00 N ATOM 0 H LYS B 240 -2.604 -3.016 6.583 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.020 -5.477 6.345 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.397 -5.159 8.478 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.518 -3.413 8.392 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.101 -4.911 8.142 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.324 -4.991 9.710 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.338 -2.585 9.954 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.745 -2.342 8.267 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -7.806 -2.021 9.431 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.937 -3.628 8.744 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.609 -3.606 11.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.220 -4.563 10.860 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.093 -3.006 11.526 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.743 -2.710 6.008 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.009 -2.177 5.534 1.00 0.00 C ATOM 1498 C ASP B 241 -7.280 -2.699 4.121 1.00 0.00 C ATOM 1499 O ASP B 241 -8.397 -3.110 3.811 1.00 0.00 O ATOM 1500 CB ASP B 241 -6.978 -0.649 5.475 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.132 -0.007 4.702 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -8.059 -0.029 3.453 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -9.059 0.491 5.376 1.00 0.00 O ATOM 0 H ASP B 241 -5.055 -2.004 6.271 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.788 -2.495 6.227 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -6.983 -0.261 6.494 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.038 -0.337 5.020 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.238 -2.667 3.304 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.349 -3.132 1.932 1.00 0.00 C ATOM 1510 C LEU B 242 -6.799 -4.594 1.927 1.00 0.00 C ATOM 1511 O LEU B 242 -7.744 -4.954 1.228 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.041 -2.889 1.177 1.00 0.00 C ATOM 1513 CG LEU B 242 -4.909 -1.532 0.483 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -3.923 -0.629 1.228 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -4.528 -1.702 -0.989 1.00 0.00 C ATOM 0 H LEU B 242 -5.313 -2.326 3.566 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.110 -2.563 1.398 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.214 -2.998 1.879 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -4.927 -3.671 0.426 1.00 0.00 H new ATOM 0 HG LEU B 242 -5.881 -1.040 0.509 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -3.847 0.329 0.714 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.276 -0.468 2.247 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -2.943 -1.105 1.255 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -4.441 -0.722 -1.458 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -3.574 -2.224 -1.060 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -5.297 -2.281 -1.499 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.101 -5.397 2.718 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.417 -6.812 2.814 1.00 0.00 C ATOM 1529 C VAL B 243 -7.773 -6.981 3.502 1.00 0.00 C ATOM 1530 O VAL B 243 -8.622 -7.738 3.032 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.286 -7.553 3.530 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.827 -8.745 4.322 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -4.208 -7.996 2.539 1.00 0.00 C ATOM 0 H VAL B 243 -5.318 -5.094 3.298 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.499 -7.254 1.821 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.827 -6.862 4.237 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -5.003 -9.254 4.821 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.541 -8.393 5.067 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -6.324 -9.438 3.643 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.416 -8.520 3.073 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.648 -8.662 1.797 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.791 -7.121 2.039 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.933 -6.266 4.606 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.171 -6.327 5.364 1.00 0.00 C ATOM 1545 C ASN B 244 -10.345 -5.981 4.445 1.00 0.00 C ATOM 1546 O ASN B 244 -11.429 -6.548 4.575 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.162 -5.322 6.517 1.00 0.00 C ATOM 1548 CG ASN B 244 -8.897 -6.021 7.851 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.685 -6.562 7.948 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -9.737 -6.067 8.736 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.226 -5.641 4.994 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.270 -7.335 5.766 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.396 -4.567 6.340 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.119 -4.802 6.559 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.649 -5.631 8.597 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.527 -6.541 9.614 1.00 0.00 H new ATOM 1557 N THR B 245 -10.089 -5.053 3.535 1.00 0.00 N ATOM 1558 CA THR B 245 -11.111 -4.624 2.594 1.00 0.00 C ATOM 1559 C THR B 245 -11.336 -5.697 1.526 1.00 0.00 C ATOM 1560 O THR B 245 -12.474 -5.983 1.159 1.00 0.00 O ATOM 1561 CB THR B 245 -10.687 -3.272 2.018 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.043 -2.335 3.032 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.533 -2.857 0.813 1.00 0.00 C ATOM 0 H THR B 245 -9.189 -4.586 3.429 1.00 0.00 H new ATOM 0 HA THR B 245 -12.074 -4.494 3.088 1.00 0.00 H new ATOM 0 HB THR B 245 -9.638 -3.315 1.726 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.303 -2.244 3.667 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.190 -1.891 0.443 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.434 -3.603 0.025 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.579 -2.781 1.111 1.00 0.00 H new