USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 747 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 39:sc= 0.198 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.327 X(o=-0.33,f=0) USER MOD Single : A 11 LYS NZ :NH3+ -145:sc= 1.02 (180deg=0.00804) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.37 K(o=1.4,f=-3.7!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.134 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00734 USER MOD Single : A 28 LYS NZ :NH3+ -137:sc= 0.732 (180deg=-0.609!) USER MOD Single : A 32 MET CE :methyl -128:sc= -0.36 (180deg=-1.44) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 92:sc= 1.31 USER MOD Single : A 40 GLN : amide:sc= 0.157 X(o=0.16,f=-0.088) USER MOD Single : A 48 CYS SG : rot 57:sc= -0.195 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.024 X(o=-0.024,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0905 X(o=-0.091,f=-0.044) USER MOD Single : A 60 ASN : amide:sc= 0.944 K(o=0.94,f=-2.4!) USER MOD Single : A 63 LYS NZ :NH3+ -164:sc= -0.0239 (180deg=-0.269) USER MOD Single : A 68 MET CE :methyl -165:sc= -0.0484 (180deg=-0.317) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot -35:sc= 0.167 USER MOD Single : A 79 SER OG : rot 180:sc=-0.00765 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0511 USER MOD Single : A 91 LYS NZ :NH3+ -140:sc= 0.26 (180deg=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.696 6.089 3.549 1.00 25.00 N ATOM 2 CA GLY A 1 7.629 6.836 2.264 1.00 25.00 C ATOM 3 C GLY A 1 7.370 5.985 1.029 1.00 25.00 C ATOM 4 O GLY A 1 7.623 4.800 0.973 1.00 25.00 O ATOM 0 H1 GLY A 1 7.875 6.754 4.328 1.00 25.00 H new ATOM 0 H2 GLY A 1 6.794 5.599 3.713 1.00 25.00 H new ATOM 0 H3 GLY A 1 8.466 5.391 3.505 1.00 25.00 H new ATOM 0 HA2 GLY A 1 6.842 7.586 2.340 1.00 25.00 H new ATOM 0 HA3 GLY A 1 8.568 7.372 2.125 1.00 25.00 H new ATOM 9 N SER A 2 6.828 6.624 -0.011 1.00 25.00 N ATOM 10 CA SER A 2 6.507 5.929 -1.254 1.00 25.00 C ATOM 11 C SER A 2 7.770 5.418 -1.941 1.00 25.00 C ATOM 12 O SER A 2 8.713 6.185 -2.165 1.00 25.00 O ATOM 13 CB SER A 2 5.774 6.885 -2.193 1.00 25.00 C ATOM 14 OG SER A 2 6.531 8.071 -2.364 1.00 25.00 O ATOM 0 H SER A 2 6.604 7.619 -0.014 1.00 25.00 H new ATOM 0 HA SER A 2 5.874 5.074 -1.016 1.00 25.00 H new ATOM 0 HB2 SER A 2 5.610 6.406 -3.158 1.00 25.00 H new ATOM 0 HB3 SER A 2 4.792 7.126 -1.786 1.00 25.00 H new ATOM 0 HG SER A 2 7.483 7.846 -2.418 1.00 25.00 H new ATOM 20 N MET A 3 7.755 4.135 -2.292 1.00 25.00 N ATOM 21 CA MET A 3 8.854 3.479 -3.016 1.00 25.00 C ATOM 22 C MET A 3 10.218 3.683 -2.337 1.00 25.00 C ATOM 23 O MET A 3 11.190 4.118 -2.958 1.00 25.00 O ATOM 24 CB MET A 3 8.874 3.950 -4.479 1.00 25.00 C ATOM 25 CG MET A 3 9.502 2.939 -5.433 1.00 25.00 C ATOM 26 SD MET A 3 9.376 3.476 -7.150 1.00 25.00 S ATOM 27 CE MET A 3 9.998 2.024 -8.017 1.00 25.00 C ATOM 0 H MET A 3 6.976 3.511 -2.083 1.00 25.00 H new ATOM 0 HA MET A 3 8.668 2.405 -2.994 1.00 25.00 H new ATOM 0 HB2 MET A 3 7.853 4.156 -4.800 1.00 25.00 H new ATOM 0 HB3 MET A 3 9.424 4.889 -4.543 1.00 25.00 H new ATOM 0 HG2 MET A 3 10.551 2.795 -5.173 1.00 25.00 H new ATOM 0 HG3 MET A 3 9.009 1.974 -5.316 1.00 25.00 H new ATOM 0 HE1 MET A 3 9.980 2.206 -9.091 1.00 25.00 H new ATOM 0 HE2 MET A 3 11.021 1.822 -7.700 1.00 25.00 H new ATOM 0 HE3 MET A 3 9.369 1.164 -7.785 1.00 25.00 H new ATOM 37 N LYS A 4 10.283 3.360 -1.051 1.00 25.00 N ATOM 38 CA LYS A 4 11.533 3.445 -0.297 1.00 25.00 C ATOM 39 C LYS A 4 11.917 2.057 0.159 1.00 25.00 C ATOM 40 O LYS A 4 11.059 1.295 0.575 1.00 25.00 O ATOM 41 CB LYS A 4 11.385 4.374 0.918 1.00 25.00 C ATOM 42 CG LYS A 4 11.029 5.822 0.563 1.00 25.00 C ATOM 43 CD LYS A 4 12.089 6.479 -0.320 1.00 25.00 C ATOM 44 CE LYS A 4 11.697 7.900 -0.662 1.00 25.00 C ATOM 45 NZ LYS A 4 12.682 8.489 -1.627 1.00 25.00 N ATOM 0 H LYS A 4 9.484 3.036 -0.505 1.00 25.00 H new ATOM 0 HA LYS A 4 12.309 3.860 -0.940 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.614 3.973 1.576 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.318 4.369 1.481 1.00 25.00 H new ATOM 0 HG2 LYS A 4 10.068 5.842 0.049 1.00 25.00 H new ATOM 0 HG3 LYS A 4 10.913 6.401 1.479 1.00 25.00 H new ATOM 0 HD2 LYS A 4 13.050 6.476 0.194 1.00 25.00 H new ATOM 0 HD3 LYS A 4 12.215 5.901 -1.236 1.00 25.00 H new ATOM 0 HE2 LYS A 4 10.697 7.915 -1.096 1.00 25.00 H new ATOM 0 HE3 LYS A 4 11.660 8.503 0.245 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 12.404 9.465 -1.855 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 13.630 8.491 -1.198 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 12.697 7.921 -2.498 1.00 25.00 H new ATOM 59 N TYR A 5 13.215 1.780 0.095 1.00 25.00 N ATOM 60 CA TYR A 5 13.808 0.504 0.484 1.00 25.00 C ATOM 61 C TYR A 5 13.325 -0.716 -0.321 1.00 25.00 C ATOM 62 O TYR A 5 12.424 -0.633 -1.142 1.00 25.00 O ATOM 63 CB TYR A 5 13.625 0.297 1.986 1.00 25.00 C ATOM 64 CG TYR A 5 14.468 1.235 2.829 1.00 25.00 C ATOM 65 CD1 TYR A 5 15.861 1.347 2.615 1.00 25.00 C ATOM 66 CD2 TYR A 5 13.886 2.003 3.859 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.655 2.199 3.419 1.00 25.00 C ATOM 68 CE2 TYR A 5 14.686 2.858 4.667 1.00 25.00 C ATOM 69 CZ TYR A 5 16.064 2.941 4.438 1.00 25.00 C ATOM 70 OH TYR A 5 16.843 3.755 5.220 1.00 25.00 O ATOM 0 H TYR A 5 13.903 2.455 -0.238 1.00 25.00 H new ATOM 0 HA TYR A 5 14.868 0.572 0.239 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.574 0.437 2.240 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.879 -0.733 2.237 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.326 0.774 1.826 1.00 25.00 H new ATOM 0 HD2 TYR A 5 12.822 1.941 4.036 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.718 2.273 3.242 1.00 25.00 H new ATOM 0 HE2 TYR A 5 14.231 3.441 5.454 1.00 25.00 H new ATOM 0 HH TYR A 5 16.281 4.205 5.885 1.00 25.00 H new ATOM 80 N LEU A 6 14.028 -1.826 -0.138 1.00 25.00 N ATOM 81 CA LEU A 6 13.784 -3.053 -0.897 1.00 25.00 C ATOM 82 C LEU A 6 12.553 -3.812 -0.390 1.00 25.00 C ATOM 83 O LEU A 6 11.877 -4.486 -1.157 1.00 25.00 O ATOM 84 CB LEU A 6 15.008 -3.977 -0.782 1.00 25.00 C ATOM 85 CG LEU A 6 16.378 -3.460 -1.249 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.458 -4.483 -0.860 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.413 -3.219 -2.753 1.00 25.00 C ATOM 0 H LEU A 6 14.785 -1.905 0.541 1.00 25.00 H new ATOM 0 HA LEU A 6 13.605 -2.764 -1.933 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.105 -4.266 0.264 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.789 -4.884 -1.345 1.00 25.00 H new ATOM 0 HG LEU A 6 16.566 -2.504 -0.761 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.434 -4.124 -1.188 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.464 -4.612 0.222 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.243 -5.439 -1.339 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.399 -2.854 -3.040 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.205 -4.152 -3.276 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.660 -2.478 -3.020 1.00 25.00 H new ATOM 99 N ASN A 7 12.313 -3.718 0.915 1.00 25.00 N ATOM 100 CA ASN A 7 11.180 -4.375 1.598 1.00 25.00 C ATOM 101 C ASN A 7 11.051 -5.885 1.307 1.00 25.00 C ATOM 102 O ASN A 7 9.955 -6.380 1.053 1.00 25.00 O ATOM 103 CB ASN A 7 9.849 -3.684 1.242 1.00 25.00 C ATOM 104 CG ASN A 7 9.850 -2.201 1.530 1.00 25.00 C ATOM 105 OD1 ASN A 7 9.329 -1.425 0.759 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.395 -1.809 2.655 1.00 25.00 N ATOM 0 H ASN A 7 12.904 -3.177 1.546 1.00 25.00 H new ATOM 0 HA ASN A 7 11.397 -4.272 2.661 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.637 -3.842 0.184 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.042 -4.155 1.802 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.390 -0.821 2.907 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.824 -2.492 3.279 1.00 25.00 H new ATOM 113 N VAL A 8 12.155 -6.619 1.362 1.00 25.00 N ATOM 114 CA VAL A 8 12.132 -8.063 1.096 1.00 25.00 C ATOM 115 C VAL A 8 12.223 -8.780 2.436 1.00 25.00 C ATOM 116 O VAL A 8 12.642 -8.195 3.419 1.00 25.00 O ATOM 117 CB VAL A 8 13.300 -8.506 0.123 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.838 -7.318 -0.652 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.460 -9.173 0.862 1.00 25.00 C ATOM 0 H VAL A 8 13.077 -6.246 1.587 1.00 25.00 H new ATOM 0 HA VAL A 8 11.205 -8.328 0.587 1.00 25.00 H new ATOM 0 HB VAL A 8 12.863 -9.235 -0.560 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.639 -7.648 -1.313 1.00 25.00 H new ATOM 0 HG12 VAL A 8 13.037 -6.877 -1.245 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.225 -6.574 0.045 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.232 -9.456 0.147 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.877 -8.476 1.589 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.099 -10.063 1.378 1.00 25.00 H new ATOM 129 N LEU A 9 11.859 -10.048 2.477 1.00 25.00 N ATOM 130 CA LEU A 9 11.984 -10.831 3.706 1.00 25.00 C ATOM 131 C LEU A 9 13.224 -11.709 3.624 1.00 25.00 C ATOM 132 O LEU A 9 13.549 -12.244 2.563 1.00 25.00 O ATOM 133 CB LEU A 9 10.739 -11.696 3.922 1.00 25.00 C ATOM 134 CG LEU A 9 9.414 -10.934 4.088 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.275 -11.936 4.263 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.446 -9.978 5.286 1.00 25.00 C ATOM 0 H LEU A 9 11.476 -10.561 1.683 1.00 25.00 H new ATOM 0 HA LEU A 9 12.078 -10.150 4.552 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.641 -12.376 3.076 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.896 -12.310 4.808 1.00 25.00 H new ATOM 0 HG LEU A 9 9.258 -10.333 3.192 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.333 -11.400 4.381 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.218 -12.580 3.385 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.459 -12.545 5.148 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.490 -9.461 5.365 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.628 -10.545 6.199 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.243 -9.247 5.147 1.00 25.00 H new ATOM 148 N ALA A 10 13.918 -11.866 4.739 1.00 25.00 N ATOM 149 CA ALA A 10 15.112 -12.705 4.792 1.00 25.00 C ATOM 150 C ALA A 10 15.084 -13.574 6.054 1.00 25.00 C ATOM 151 O ALA A 10 14.634 -13.119 7.096 1.00 25.00 O ATOM 152 CB ALA A 10 16.349 -11.831 4.771 1.00 25.00 C ATOM 0 H ALA A 10 13.677 -11.423 5.625 1.00 25.00 H new ATOM 0 HA ALA A 10 15.134 -13.362 3.923 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.239 -12.459 4.811 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.362 -11.241 3.855 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.337 -11.163 5.633 1.00 25.00 H new ATOM 158 N LYS A 11 15.568 -14.809 5.948 1.00 25.00 N ATOM 159 CA LYS A 11 15.617 -15.740 7.081 1.00 25.00 C ATOM 160 C LYS A 11 17.031 -15.867 7.620 1.00 25.00 C ATOM 161 O LYS A 11 17.981 -16.026 6.856 1.00 25.00 O ATOM 162 CB LYS A 11 15.134 -17.135 6.664 1.00 25.00 C ATOM 163 CG LYS A 11 15.300 -18.205 7.768 1.00 25.00 C ATOM 164 CD LYS A 11 14.425 -19.433 7.557 1.00 25.00 C ATOM 165 CE LYS A 11 12.983 -19.154 7.977 1.00 25.00 C ATOM 166 NZ LYS A 11 12.527 -19.939 9.181 1.00 25.00 N ATOM 0 H LYS A 11 15.937 -15.195 5.079 1.00 25.00 H new ATOM 0 HA LYS A 11 14.963 -15.338 7.854 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.083 -17.077 6.382 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.685 -17.451 5.778 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.344 -18.515 7.809 1.00 25.00 H new ATOM 0 HG3 LYS A 11 15.061 -17.760 8.734 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.452 -19.728 6.508 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.820 -20.270 8.133 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.878 -18.090 8.190 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.323 -19.378 7.139 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.522 -20.185 9.075 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 13.090 -20.810 9.261 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.654 -19.365 10.039 1.00 25.00 H new ATOM 180 N ALA A 12 17.151 -15.876 8.932 1.00 25.00 N ATOM 181 CA ALA A 12 18.419 -16.118 9.605 1.00 25.00 C ATOM 182 C ALA A 12 18.814 -17.596 9.499 1.00 25.00 C ATOM 183 O ALA A 12 18.013 -18.474 9.818 1.00 25.00 O ATOM 184 CB ALA A 12 18.272 -15.721 11.054 1.00 25.00 C ATOM 0 H ALA A 12 16.370 -15.715 9.568 1.00 25.00 H new ATOM 0 HA ALA A 12 19.204 -15.528 9.132 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.213 -15.895 11.576 1.00 25.00 H new ATOM 0 HB2 ALA A 12 18.012 -14.664 11.117 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.485 -16.317 11.516 1.00 25.00 H new ATOM 190 N LEU A 13 20.042 -17.874 9.082 1.00 25.00 N ATOM 191 CA LEU A 13 20.546 -19.250 9.044 1.00 25.00 C ATOM 192 C LEU A 13 21.209 -19.610 10.355 1.00 25.00 C ATOM 193 O LEU A 13 21.388 -20.779 10.657 1.00 25.00 O ATOM 194 CB LEU A 13 21.600 -19.423 7.950 1.00 25.00 C ATOM 195 CG LEU A 13 21.213 -19.309 6.476 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.766 -19.722 6.203 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.473 -17.923 5.962 1.00 25.00 C ATOM 0 H LEU A 13 20.710 -17.171 8.765 1.00 25.00 H new ATOM 0 HA LEU A 13 19.688 -19.893 8.850 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.381 -18.685 8.136 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.050 -20.406 8.089 1.00 25.00 H new ATOM 0 HG LEU A 13 21.846 -20.014 5.936 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.553 -19.619 5.139 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.621 -20.760 6.503 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.091 -19.082 6.772 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.190 -17.866 4.911 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.886 -17.206 6.536 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.533 -17.689 6.066 1.00 25.00 H new ATOM 209 N TYR A 14 21.595 -18.594 11.108 1.00 25.00 N ATOM 210 CA TYR A 14 22.294 -18.775 12.372 1.00 25.00 C ATOM 211 C TYR A 14 21.772 -17.742 13.351 1.00 25.00 C ATOM 212 O TYR A 14 21.202 -16.734 12.932 1.00 25.00 O ATOM 213 CB TYR A 14 23.796 -18.552 12.186 1.00 25.00 C ATOM 214 CG TYR A 14 24.417 -19.420 11.114 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.889 -20.714 11.415 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.538 -18.953 9.789 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.479 -21.523 10.408 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.107 -19.768 8.778 1.00 25.00 C ATOM 219 CZ TYR A 14 25.577 -21.043 9.102 1.00 25.00 C ATOM 220 OH TYR A 14 26.139 -21.832 8.131 1.00 25.00 O ATOM 0 H TYR A 14 21.433 -17.618 10.861 1.00 25.00 H new ATOM 0 HA TYR A 14 22.127 -19.788 12.738 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.970 -17.505 11.938 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.302 -18.743 13.133 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.801 -21.094 12.422 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.192 -17.960 9.541 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.851 -22.507 10.653 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.177 -19.405 7.763 1.00 25.00 H new ATOM 0 HH TYR A 14 26.132 -21.353 7.276 1.00 25.00 H new ATOM 230 N ASP A 15 22.011 -17.963 14.633 1.00 25.00 N ATOM 231 CA ASP A 15 21.715 -16.966 15.653 1.00 25.00 C ATOM 232 C ASP A 15 22.678 -15.792 15.447 1.00 25.00 C ATOM 233 O ASP A 15 23.799 -15.975 14.954 1.00 25.00 O ATOM 234 CB ASP A 15 21.940 -17.556 17.054 1.00 25.00 C ATOM 235 CG ASP A 15 21.032 -18.743 17.349 1.00 25.00 C ATOM 236 OD1 ASP A 15 21.518 -19.755 17.879 1.00 25.00 O ATOM 237 OD2 ASP A 15 19.826 -18.664 17.057 1.00 25.00 O ATOM 0 H ASP A 15 22.411 -18.828 14.995 1.00 25.00 H new ATOM 0 HA ASP A 15 20.677 -16.645 15.571 1.00 25.00 H new ATOM 0 HB2 ASP A 15 22.980 -17.868 17.149 1.00 25.00 H new ATOM 0 HB3 ASP A 15 21.770 -16.781 17.801 1.00 25.00 H new ATOM 242 N ASN A 16 22.273 -14.600 15.856 1.00 25.00 N ATOM 243 CA ASN A 16 23.148 -13.435 15.802 1.00 25.00 C ATOM 244 C ASN A 16 23.023 -12.638 17.079 1.00 25.00 C ATOM 245 O ASN A 16 21.920 -12.356 17.543 1.00 25.00 O ATOM 246 CB ASN A 16 22.819 -12.521 14.621 1.00 25.00 C ATOM 247 CG ASN A 16 23.915 -11.519 14.369 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.055 -11.905 14.149 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.605 -10.258 14.448 1.00 25.00 N ATOM 0 H ASN A 16 21.343 -14.412 16.230 1.00 25.00 H new ATOM 0 HA ASN A 16 24.166 -13.805 15.677 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.665 -13.124 13.726 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.884 -11.996 14.817 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.326 -9.547 14.325 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.641 -9.980 14.633 1.00 25.00 H new ATOM 256 N VAL A 17 24.159 -12.246 17.624 1.00 25.00 N ATOM 257 CA VAL A 17 24.209 -11.432 18.819 1.00 25.00 C ATOM 258 C VAL A 17 24.707 -10.084 18.352 1.00 25.00 C ATOM 259 O VAL A 17 25.722 -9.991 17.665 1.00 25.00 O ATOM 260 CB VAL A 17 25.160 -12.040 19.888 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.225 -11.142 21.135 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.673 -13.448 20.285 1.00 25.00 C ATOM 0 H VAL A 17 25.076 -12.485 17.247 1.00 25.00 H new ATOM 0 HA VAL A 17 23.233 -11.366 19.300 1.00 25.00 H new ATOM 0 HB VAL A 17 26.159 -12.110 19.458 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.896 -11.587 21.869 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.596 -10.156 20.855 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.229 -11.045 21.566 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.344 -13.867 21.034 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.666 -13.382 20.697 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.664 -14.091 19.405 1.00 25.00 H new ATOM 272 N ALA A 18 23.939 -9.060 18.671 1.00 25.00 N ATOM 273 CA ALA A 18 24.271 -7.704 18.289 1.00 25.00 C ATOM 274 C ALA A 18 25.419 -7.225 19.174 1.00 25.00 C ATOM 275 O ALA A 18 25.324 -7.259 20.400 1.00 25.00 O ATOM 276 CB ALA A 18 23.052 -6.813 18.449 1.00 25.00 C ATOM 0 H ALA A 18 23.071 -9.145 19.200 1.00 25.00 H new ATOM 0 HA ALA A 18 24.579 -7.664 17.244 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.306 -5.793 18.160 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.247 -7.180 17.813 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.726 -6.825 19.489 1.00 25.00 H new ATOM 282 N GLU A 19 26.507 -6.830 18.540 1.00 25.00 N ATOM 283 CA GLU A 19 27.712 -6.382 19.241 1.00 25.00 C ATOM 284 C GLU A 19 27.825 -4.877 19.092 1.00 25.00 C ATOM 285 O GLU A 19 28.487 -4.194 19.864 1.00 25.00 O ATOM 286 CB GLU A 19 28.926 -7.074 18.629 1.00 25.00 C ATOM 287 CG GLU A 19 28.905 -8.573 18.877 1.00 25.00 C ATOM 288 CD GLU A 19 29.942 -9.334 18.060 1.00 25.00 C ATOM 289 OE1 GLU A 19 29.821 -10.579 17.977 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.740 -8.694 17.351 1.00 25.00 O ATOM 0 H GLU A 19 26.588 -6.808 17.523 1.00 25.00 H new ATOM 0 HA GLU A 19 27.661 -6.634 20.300 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.951 -6.883 17.556 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.837 -6.649 19.049 1.00 25.00 H new ATOM 0 HG2 GLU A 19 29.078 -8.761 19.937 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.913 -8.959 18.642 1.00 25.00 H new ATOM 297 N SER A 20 27.113 -4.374 18.099 1.00 25.00 N ATOM 298 CA SER A 20 27.027 -2.945 17.834 1.00 25.00 C ATOM 299 C SER A 20 25.629 -2.493 18.215 1.00 25.00 C ATOM 300 O SER A 20 24.663 -3.236 18.032 1.00 25.00 O ATOM 301 CB SER A 20 27.275 -2.683 16.345 1.00 25.00 C ATOM 302 OG SER A 20 26.981 -1.341 15.994 1.00 25.00 O ATOM 0 H SER A 20 26.575 -4.947 17.449 1.00 25.00 H new ATOM 0 HA SER A 20 27.774 -2.398 18.409 1.00 25.00 H new ATOM 0 HB2 SER A 20 28.315 -2.903 16.105 1.00 25.00 H new ATOM 0 HB3 SER A 20 26.661 -3.358 15.749 1.00 25.00 H new ATOM 0 HG SER A 20 27.152 -1.208 15.038 1.00 25.00 H new ATOM 308 N PRO A 21 25.483 -1.251 18.709 1.00 25.00 N ATOM 309 CA PRO A 21 24.136 -0.758 19.012 1.00 25.00 C ATOM 310 C PRO A 21 23.303 -0.501 17.752 1.00 25.00 C ATOM 311 O PRO A 21 22.099 -0.273 17.839 1.00 25.00 O ATOM 312 CB PRO A 21 24.416 0.542 19.768 1.00 25.00 C ATOM 313 CG PRO A 21 25.709 1.009 19.207 1.00 25.00 C ATOM 314 CD PRO A 21 26.508 -0.231 19.007 1.00 25.00 C ATOM 0 HA PRO A 21 23.546 -1.479 19.578 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.624 1.274 19.611 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.484 0.373 20.843 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.563 1.541 18.267 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.210 1.697 19.888 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.219 -0.124 18.188 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.083 -0.487 19.897 1.00 25.00 H new ATOM 322 N ASP A 22 23.935 -0.576 16.587 1.00 25.00 N ATOM 323 CA ASP A 22 23.238 -0.407 15.322 1.00 25.00 C ATOM 324 C ASP A 22 22.849 -1.757 14.762 1.00 25.00 C ATOM 325 O ASP A 22 22.295 -1.824 13.695 1.00 25.00 O ATOM 326 CB ASP A 22 24.153 0.280 14.302 1.00 25.00 C ATOM 327 CG ASP A 22 23.542 1.547 13.734 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.571 1.722 12.495 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.026 2.366 14.526 1.00 25.00 O ATOM 0 H ASP A 22 24.935 -0.754 16.494 1.00 25.00 H new ATOM 0 HA ASP A 22 22.351 0.200 15.502 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.104 0.520 14.776 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.368 -0.412 13.488 1.00 25.00 H new ATOM 334 N GLU A 23 23.200 -2.838 15.444 1.00 25.00 N ATOM 335 CA GLU A 23 23.004 -4.189 14.915 1.00 25.00 C ATOM 336 C GLU A 23 21.773 -4.868 15.520 1.00 25.00 C ATOM 337 O GLU A 23 21.393 -4.601 16.662 1.00 25.00 O ATOM 338 CB GLU A 23 24.267 -5.018 15.198 1.00 25.00 C ATOM 339 CG GLU A 23 24.317 -6.373 14.506 1.00 25.00 C ATOM 340 CD GLU A 23 25.572 -7.157 14.833 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.744 -8.255 14.256 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.371 -6.724 15.697 1.00 25.00 O ATOM 0 H GLU A 23 23.625 -2.810 16.371 1.00 25.00 H new ATOM 0 HA GLU A 23 22.831 -4.120 13.841 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.139 -4.439 14.893 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.348 -5.173 16.274 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.444 -6.957 14.798 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.257 -6.227 13.428 1.00 25.00 H new ATOM 349 N LEU A 24 21.157 -5.763 14.756 1.00 25.00 N ATOM 350 CA LEU A 24 20.025 -6.542 15.245 1.00 25.00 C ATOM 351 C LEU A 24 20.464 -7.888 15.789 1.00 25.00 C ATOM 352 O LEU A 24 21.327 -8.562 15.229 1.00 25.00 O ATOM 353 CB LEU A 24 19.015 -6.788 14.130 1.00 25.00 C ATOM 354 CG LEU A 24 18.214 -5.562 13.684 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.362 -5.936 12.494 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.345 -5.034 14.825 1.00 25.00 C ATOM 0 H LEU A 24 21.423 -5.968 13.793 1.00 25.00 H new ATOM 0 HA LEU A 24 19.569 -5.960 16.046 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.545 -7.188 13.266 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.316 -7.557 14.460 1.00 25.00 H new ATOM 0 HG LEU A 24 18.903 -4.767 13.401 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.788 -5.068 12.170 1.00 25.00 H new ATOM 0 HD12 LEU A 24 18.003 -6.272 11.679 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.679 -6.739 12.773 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.786 -4.163 14.483 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.649 -5.811 15.142 1.00 25.00 H new ATOM 0 HD23 LEU A 24 17.980 -4.751 15.665 1.00 25.00 H new ATOM 368 N SER A 25 19.804 -8.301 16.854 1.00 25.00 N ATOM 369 CA SER A 25 20.042 -9.590 17.475 1.00 25.00 C ATOM 370 C SER A 25 18.824 -10.446 17.193 1.00 25.00 C ATOM 371 O SER A 25 17.686 -10.007 17.372 1.00 25.00 O ATOM 372 CB SER A 25 20.240 -9.420 18.980 1.00 25.00 C ATOM 373 OG SER A 25 19.398 -8.390 19.481 1.00 25.00 O ATOM 0 H SER A 25 19.082 -7.748 17.316 1.00 25.00 H new ATOM 0 HA SER A 25 20.942 -10.057 17.076 1.00 25.00 H new ATOM 0 HB2 SER A 25 20.019 -10.358 19.490 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.282 -9.180 19.191 1.00 25.00 H new ATOM 0 HG SER A 25 19.536 -8.295 20.447 1.00 25.00 H new ATOM 379 N PHE A 26 19.069 -11.648 16.708 1.00 25.00 N ATOM 380 CA PHE A 26 17.997 -12.571 16.338 1.00 25.00 C ATOM 381 C PHE A 26 18.399 -14.033 16.439 1.00 25.00 C ATOM 382 O PHE A 26 19.571 -14.367 16.603 1.00 25.00 O ATOM 383 CB PHE A 26 17.501 -12.277 14.919 1.00 25.00 C ATOM 384 CG PHE A 26 18.582 -12.229 13.878 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.215 -13.403 13.421 1.00 25.00 C ATOM 386 CD2 PHE A 26 18.934 -11.000 13.301 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.179 -13.345 12.379 1.00 25.00 C ATOM 388 CE2 PHE A 26 19.876 -10.935 12.270 1.00 25.00 C ATOM 389 CZ PHE A 26 20.493 -12.114 11.792 1.00 25.00 C ATOM 0 H PHE A 26 20.008 -12.017 16.558 1.00 25.00 H new ATOM 0 HA PHE A 26 17.196 -12.406 17.059 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.776 -13.040 14.636 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.975 -11.322 14.922 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.965 -14.354 13.867 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.471 -10.092 13.658 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.667 -14.247 12.041 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.134 -9.980 11.837 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.202 -12.065 10.979 1.00 25.00 H new ATOM 399 N ARG A 27 17.405 -14.897 16.334 1.00 25.00 N ATOM 400 CA ARG A 27 17.574 -16.338 16.412 1.00 25.00 C ATOM 401 C ARG A 27 17.623 -16.929 15.009 1.00 25.00 C ATOM 402 O ARG A 27 17.029 -16.394 14.075 1.00 25.00 O ATOM 403 CB ARG A 27 16.357 -16.908 17.166 1.00 25.00 C ATOM 404 CG ARG A 27 16.490 -18.338 17.656 1.00 25.00 C ATOM 405 CD ARG A 27 17.304 -18.410 18.938 1.00 25.00 C ATOM 406 NE ARG A 27 17.706 -19.794 19.227 1.00 25.00 N ATOM 407 CZ ARG A 27 16.962 -20.700 19.850 1.00 25.00 C ATOM 408 NH1 ARG A 27 15.753 -20.438 20.291 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.443 -21.898 20.030 1.00 25.00 N ATOM 0 H ARG A 27 16.437 -14.611 16.189 1.00 25.00 H new ATOM 0 HA ARG A 27 18.502 -16.586 16.927 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.154 -16.268 18.024 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.488 -16.848 16.511 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.499 -18.759 17.828 1.00 25.00 H new ATOM 0 HG3 ARG A 27 16.966 -18.946 16.886 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.190 -17.781 18.847 1.00 25.00 H new ATOM 0 HD3 ARG A 27 16.718 -18.016 19.768 1.00 25.00 H new ATOM 0 HE ARG A 27 18.636 -20.083 18.923 1.00 25.00 H new ATOM 0 HH11 ARG A 27 15.352 -19.509 20.160 1.00 25.00 H new ATOM 0 HH12 ARG A 27 15.215 -21.163 20.765 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.378 -22.128 19.694 1.00 25.00 H new ATOM 0 HH22 ARG A 27 16.884 -22.606 20.507 1.00 25.00 H new ATOM 423 N LYS A 28 18.265 -18.075 14.880 1.00 25.00 N ATOM 424 CA LYS A 28 18.222 -18.853 13.653 1.00 25.00 C ATOM 425 C LYS A 28 16.763 -19.131 13.333 1.00 25.00 C ATOM 426 O LYS A 28 16.002 -19.570 14.186 1.00 25.00 O ATOM 427 CB LYS A 28 18.961 -20.178 13.850 1.00 25.00 C ATOM 428 CG LYS A 28 18.814 -21.135 12.680 1.00 25.00 C ATOM 429 CD LYS A 28 19.596 -22.404 12.919 1.00 25.00 C ATOM 430 CE LYS A 28 19.430 -23.369 11.752 1.00 25.00 C ATOM 431 NZ LYS A 28 20.118 -24.663 12.036 1.00 25.00 N ATOM 0 H LYS A 28 18.830 -18.493 15.619 1.00 25.00 H new ATOM 0 HA LYS A 28 18.699 -18.305 12.840 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.020 -19.974 14.011 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.589 -20.661 14.753 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.761 -21.375 12.531 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.164 -20.655 11.766 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.651 -22.166 13.053 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.256 -22.878 13.840 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.370 -23.547 11.569 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.840 -22.925 10.845 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.631 -24.977 11.187 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 20.791 -24.534 12.819 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 19.413 -25.380 12.300 1.00 25.00 H new ATOM 445 N GLY A 29 16.387 -18.887 12.090 1.00 25.00 N ATOM 446 CA GLY A 29 15.029 -19.131 11.650 1.00 25.00 C ATOM 447 C GLY A 29 14.142 -17.905 11.695 1.00 25.00 C ATOM 448 O GLY A 29 13.039 -17.952 11.147 1.00 25.00 O ATOM 0 H GLY A 29 17.006 -18.519 11.368 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.051 -19.515 10.630 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.589 -19.909 12.274 1.00 25.00 H new ATOM 452 N ASP A 30 14.607 -16.817 12.290 1.00 25.00 N ATOM 453 CA ASP A 30 13.812 -15.591 12.373 1.00 25.00 C ATOM 454 C ASP A 30 13.715 -14.951 11.007 1.00 25.00 C ATOM 455 O ASP A 30 14.541 -15.212 10.125 1.00 25.00 O ATOM 456 CB ASP A 30 14.447 -14.584 13.338 1.00 25.00 C ATOM 457 CG ASP A 30 14.182 -14.923 14.797 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.758 -14.246 15.676 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.395 -15.853 15.068 1.00 25.00 O ATOM 0 H ASP A 30 15.528 -16.753 12.723 1.00 25.00 H new ATOM 0 HA ASP A 30 12.821 -15.860 12.740 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.523 -14.551 13.166 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.059 -13.588 13.124 1.00 25.00 H new ATOM 464 N ILE A 31 12.710 -14.100 10.841 1.00 25.00 N ATOM 465 CA ILE A 31 12.492 -13.374 9.593 1.00 25.00 C ATOM 466 C ILE A 31 12.573 -11.888 9.886 1.00 25.00 C ATOM 467 O ILE A 31 11.901 -11.396 10.785 1.00 25.00 O ATOM 468 CB ILE A 31 11.085 -13.659 8.983 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.901 -15.159 8.693 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.886 -12.843 7.679 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.928 -15.765 7.767 1.00 25.00 C ATOM 0 H ILE A 31 12.023 -13.893 11.566 1.00 25.00 H new ATOM 0 HA ILE A 31 13.250 -13.699 8.881 1.00 25.00 H new ATOM 0 HB ILE A 31 10.336 -13.354 9.714 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.923 -15.701 9.638 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.912 -15.311 8.262 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.900 -13.053 7.265 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.968 -11.779 7.900 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.650 -13.123 6.954 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.711 -16.824 7.626 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.894 -15.256 6.804 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.921 -15.653 8.202 1.00 25.00 H new ATOM 483 N MET A 32 13.361 -11.176 9.098 1.00 25.00 N ATOM 484 CA MET A 32 13.461 -9.728 9.210 1.00 25.00 C ATOM 485 C MET A 32 13.236 -9.118 7.845 1.00 25.00 C ATOM 486 O MET A 32 13.443 -9.771 6.812 1.00 25.00 O ATOM 487 CB MET A 32 14.827 -9.323 9.758 1.00 25.00 C ATOM 488 CG MET A 32 15.999 -9.879 8.976 1.00 25.00 C ATOM 489 SD MET A 32 17.282 -10.411 10.102 1.00 25.00 S ATOM 490 CE MET A 32 16.535 -11.935 10.816 1.00 25.00 C ATOM 0 H MET A 32 13.946 -11.580 8.367 1.00 25.00 H new ATOM 0 HA MET A 32 12.704 -9.364 9.904 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.894 -8.235 9.768 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.904 -9.656 10.793 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.672 -10.717 8.361 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.389 -9.119 8.299 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.567 -11.881 11.904 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.499 -12.021 10.488 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.096 -12.807 10.479 1.00 25.00 H new ATOM 500 N THR A 33 12.791 -7.876 7.848 1.00 25.00 N ATOM 501 CA THR A 33 12.514 -7.153 6.613 1.00 25.00 C ATOM 502 C THR A 33 13.773 -6.429 6.174 1.00 25.00 C ATOM 503 O THR A 33 14.212 -5.517 6.848 1.00 25.00 O ATOM 504 CB THR A 33 11.402 -6.109 6.828 1.00 25.00 C ATOM 505 OG1 THR A 33 10.205 -6.778 7.230 1.00 25.00 O ATOM 506 CG2 THR A 33 11.120 -5.331 5.558 1.00 25.00 C ATOM 0 H THR A 33 12.611 -7.340 8.697 1.00 25.00 H new ATOM 0 HA THR A 33 12.191 -7.868 5.856 1.00 25.00 H new ATOM 0 HB THR A 33 11.735 -5.411 7.596 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.493 -6.119 7.370 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.330 -4.603 5.745 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.024 -4.812 5.241 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.802 -6.018 4.774 1.00 25.00 H new ATOM 514 N VAL A 34 14.357 -6.830 5.057 1.00 25.00 N ATOM 515 CA VAL A 34 15.561 -6.182 4.546 1.00 25.00 C ATOM 516 C VAL A 34 15.158 -4.894 3.869 1.00 25.00 C ATOM 517 O VAL A 34 14.309 -4.878 2.968 1.00 25.00 O ATOM 518 CB VAL A 34 16.321 -7.058 3.542 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.637 -6.393 3.105 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.604 -8.412 4.160 1.00 25.00 C ATOM 0 H VAL A 34 14.019 -7.602 4.483 1.00 25.00 H new ATOM 0 HA VAL A 34 16.228 -6.001 5.389 1.00 25.00 H new ATOM 0 HB VAL A 34 15.698 -7.183 2.656 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.152 -7.039 2.394 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.421 -5.434 2.634 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.272 -6.235 3.977 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.144 -9.033 3.445 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.209 -8.283 5.058 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.663 -8.896 4.423 1.00 25.00 H new ATOM 530 N LEU A 35 15.760 -3.814 4.320 1.00 25.00 N ATOM 531 CA LEU A 35 15.476 -2.498 3.808 1.00 25.00 C ATOM 532 C LEU A 35 16.505 -2.141 2.757 1.00 25.00 C ATOM 533 O LEU A 35 16.151 -1.761 1.656 1.00 25.00 O ATOM 534 CB LEU A 35 15.503 -1.507 4.960 1.00 25.00 C ATOM 535 CG LEU A 35 14.446 -1.791 6.036 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.708 -0.896 7.196 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.023 -1.579 5.517 1.00 25.00 C ATOM 0 H LEU A 35 16.465 -3.829 5.057 1.00 25.00 H new ATOM 0 HA LEU A 35 14.489 -2.470 3.346 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.491 -1.523 5.420 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.350 -0.502 4.568 1.00 25.00 H new ATOM 0 HG LEU A 35 14.520 -2.838 6.331 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.967 -1.082 7.973 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.705 -1.094 7.590 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.644 0.144 6.875 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.310 -1.792 6.313 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.905 -0.546 5.191 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.839 -2.248 4.677 1.00 25.00 H new ATOM 549 N GLU A 36 17.776 -2.341 3.058 1.00 25.00 N ATOM 550 CA GLU A 36 18.818 -2.148 2.053 1.00 25.00 C ATOM 551 C GLU A 36 19.990 -3.052 2.368 1.00 25.00 C ATOM 552 O GLU A 36 20.016 -3.693 3.412 1.00 25.00 O ATOM 553 CB GLU A 36 19.243 -0.675 1.951 1.00 25.00 C ATOM 554 CG GLU A 36 20.160 -0.156 2.981 1.00 25.00 C ATOM 555 CD GLU A 36 20.245 1.366 2.946 1.00 25.00 C ATOM 556 OE1 GLU A 36 19.867 1.968 1.920 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.633 1.960 3.972 1.00 25.00 O ATOM 0 H GLU A 36 18.113 -2.633 3.975 1.00 25.00 H new ATOM 0 HA GLU A 36 18.420 -2.418 1.075 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.712 -0.528 0.978 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.341 -0.063 1.966 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.821 -0.479 3.966 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.153 -0.579 2.831 1.00 25.00 H new ATOM 564 N ARG A 37 20.949 -3.123 1.462 1.00 25.00 N ATOM 565 CA ARG A 37 22.132 -3.945 1.661 1.00 25.00 C ATOM 566 C ARG A 37 23.309 -3.031 1.519 1.00 25.00 C ATOM 567 O ARG A 37 23.217 -2.053 0.788 1.00 25.00 O ATOM 568 CB ARG A 37 22.237 -5.018 0.588 1.00 25.00 C ATOM 569 CG ARG A 37 21.063 -5.979 0.529 1.00 25.00 C ATOM 570 CD ARG A 37 21.388 -7.136 -0.413 1.00 25.00 C ATOM 571 NE ARG A 37 22.011 -6.650 -1.658 1.00 25.00 N ATOM 572 CZ ARG A 37 21.366 -6.260 -2.750 1.00 25.00 C ATOM 573 NH1 ARG A 37 20.057 -6.304 -2.850 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.054 -5.814 -3.762 1.00 25.00 N ATOM 0 H ARG A 37 20.932 -2.618 0.576 1.00 25.00 H new ATOM 0 HA ARG A 37 22.089 -4.434 2.634 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.339 -4.532 -0.382 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.149 -5.591 0.756 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.843 -6.361 1.526 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.171 -5.457 0.184 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.060 -7.836 0.084 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.476 -7.684 -0.649 1.00 25.00 H new ATOM 0 HE ARG A 37 23.030 -6.610 -1.682 1.00 25.00 H new ATOM 0 HH11 ARG A 37 19.497 -6.648 -2.070 1.00 25.00 H new ATOM 0 HH12 ARG A 37 19.600 -5.994 -3.708 1.00 25.00 H new ATOM 0 HH21 ARG A 37 23.072 -5.769 -3.707 1.00 25.00 H new ATOM 0 HH22 ARG A 37 21.575 -5.510 -4.610 1.00 25.00 H new ATOM 588 N ASP A 38 24.393 -3.373 2.198 1.00 25.00 N ATOM 589 CA ASP A 38 25.665 -2.662 2.099 1.00 25.00 C ATOM 590 C ASP A 38 25.425 -1.200 2.503 1.00 25.00 C ATOM 591 O ASP A 38 25.964 -0.240 1.946 1.00 25.00 O ATOM 592 CB ASP A 38 26.243 -2.890 0.698 1.00 25.00 C ATOM 593 CG ASP A 38 26.170 -4.379 0.291 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.499 -4.696 -0.730 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.616 -5.246 1.094 1.00 25.00 O ATOM 0 H ASP A 38 24.418 -4.163 2.843 1.00 25.00 H new ATOM 0 HA ASP A 38 26.428 -3.033 2.783 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.695 -2.287 -0.026 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.280 -2.555 0.672 1.00 25.00 H new ATOM 600 N THR A 39 24.543 -1.079 3.487 1.00 25.00 N ATOM 601 CA THR A 39 24.078 0.198 4.020 1.00 25.00 C ATOM 602 C THR A 39 25.226 0.952 4.669 1.00 25.00 C ATOM 603 O THR A 39 26.126 0.345 5.214 1.00 25.00 O ATOM 604 CB THR A 39 22.966 -0.043 5.074 1.00 25.00 C ATOM 605 OG1 THR A 39 22.558 1.195 5.660 1.00 25.00 O ATOM 606 CG2 THR A 39 23.397 -0.982 6.156 1.00 25.00 C ATOM 0 H THR A 39 24.120 -1.884 3.948 1.00 25.00 H new ATOM 0 HA THR A 39 23.681 0.791 3.196 1.00 25.00 H new ATOM 0 HB THR A 39 22.129 -0.501 4.546 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.797 1.559 5.160 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.582 -1.116 6.867 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.659 -1.945 5.719 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.264 -0.570 6.672 1.00 25.00 H new ATOM 614 N GLN A 40 25.195 2.279 4.588 1.00 25.00 N ATOM 615 CA GLN A 40 26.236 3.162 5.148 1.00 25.00 C ATOM 616 C GLN A 40 27.637 2.888 4.578 1.00 25.00 C ATOM 617 O GLN A 40 28.635 3.358 5.109 1.00 25.00 O ATOM 618 CB GLN A 40 26.273 3.082 6.686 1.00 25.00 C ATOM 619 CG GLN A 40 24.902 3.014 7.336 1.00 25.00 C ATOM 620 CD GLN A 40 24.948 3.261 8.834 1.00 25.00 C ATOM 621 OE1 GLN A 40 25.492 4.251 9.293 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.364 2.367 9.593 1.00 25.00 N ATOM 0 H GLN A 40 24.440 2.787 4.127 1.00 25.00 H new ATOM 0 HA GLN A 40 25.956 4.171 4.846 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.847 2.203 6.980 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.804 3.952 7.072 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.247 3.751 6.871 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.464 2.034 7.147 1.00 25.00 H new ATOM 0 HE21 GLN A 40 23.919 1.552 9.171 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.354 2.486 10.606 1.00 25.00 H new ATOM 631 N GLY A 41 27.697 2.116 3.500 1.00 25.00 N ATOM 632 CA GLY A 41 28.973 1.735 2.910 1.00 25.00 C ATOM 633 C GLY A 41 29.588 0.558 3.645 1.00 25.00 C ATOM 634 O GLY A 41 30.763 0.245 3.469 1.00 25.00 O ATOM 0 H GLY A 41 26.879 1.743 3.018 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.829 1.477 1.861 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.657 2.583 2.939 1.00 25.00 H new ATOM 638 N LEU A 42 28.798 -0.088 4.490 1.00 25.00 N ATOM 639 CA LEU A 42 29.257 -1.225 5.262 1.00 25.00 C ATOM 640 C LEU A 42 29.028 -2.484 4.441 1.00 25.00 C ATOM 641 O LEU A 42 27.971 -3.101 4.511 1.00 25.00 O ATOM 642 CB LEU A 42 28.479 -1.298 6.574 1.00 25.00 C ATOM 643 CG LEU A 42 28.540 -0.072 7.484 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.443 -0.193 8.521 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.875 0.052 8.171 1.00 25.00 C ATOM 0 H LEU A 42 27.824 0.163 4.657 1.00 25.00 H new ATOM 0 HA LEU A 42 30.317 -1.126 5.494 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.433 -1.493 6.338 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.844 -2.157 7.137 1.00 25.00 H new ATOM 0 HG LEU A 42 28.404 0.822 6.875 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.469 0.674 9.182 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.475 -0.240 8.023 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.594 -1.100 9.106 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.876 0.936 8.808 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.054 -0.834 8.780 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.662 0.143 7.423 1.00 25.00 H new ATOM 657 N ASP A 43 30.007 -2.846 3.633 1.00 25.00 N ATOM 658 CA ASP A 43 29.882 -4.021 2.767 1.00 25.00 C ATOM 659 C ASP A 43 29.571 -5.266 3.589 1.00 25.00 C ATOM 660 O ASP A 43 30.236 -5.566 4.586 1.00 25.00 O ATOM 661 CB ASP A 43 31.167 -4.268 1.975 1.00 25.00 C ATOM 662 CG ASP A 43 31.207 -3.501 0.666 1.00 25.00 C ATOM 663 OD1 ASP A 43 30.231 -3.600 -0.109 1.00 25.00 O ATOM 664 OD2 ASP A 43 32.238 -2.858 0.381 1.00 25.00 O ATOM 0 H ASP A 43 30.896 -2.352 3.553 1.00 25.00 H new ATOM 0 HA ASP A 43 29.065 -3.821 2.073 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.025 -3.983 2.584 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.263 -5.334 1.769 1.00 25.00 H new ATOM 669 N GLY A 44 28.542 -5.990 3.173 1.00 25.00 N ATOM 670 CA GLY A 44 28.151 -7.206 3.865 1.00 25.00 C ATOM 671 C GLY A 44 27.157 -6.984 4.987 1.00 25.00 C ATOM 672 O GLY A 44 26.528 -7.943 5.443 1.00 25.00 O ATOM 0 H GLY A 44 27.966 -5.757 2.364 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.720 -7.900 3.143 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.043 -7.683 4.272 1.00 25.00 H new ATOM 676 N TRP A 45 26.979 -5.748 5.430 1.00 25.00 N ATOM 677 CA TRP A 45 26.002 -5.433 6.452 1.00 25.00 C ATOM 678 C TRP A 45 24.712 -5.025 5.760 1.00 25.00 C ATOM 679 O TRP A 45 24.711 -4.180 4.877 1.00 25.00 O ATOM 680 CB TRP A 45 26.533 -4.280 7.289 1.00 25.00 C ATOM 681 CG TRP A 45 27.577 -4.709 8.277 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.913 -4.468 8.236 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.364 -5.454 9.484 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.551 -4.976 9.327 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.629 -5.600 10.123 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.227 -5.998 10.100 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.772 -6.271 11.353 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.364 -6.662 11.329 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.632 -6.795 11.944 1.00 25.00 C ATOM 0 H TRP A 45 27.506 -4.943 5.091 1.00 25.00 H new ATOM 0 HA TRP A 45 25.817 -6.291 7.099 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.954 -3.522 6.629 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.705 -3.813 7.822 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.409 -3.938 7.436 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.550 -4.903 9.519 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.257 -5.907 9.634 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.740 -6.374 11.822 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.491 -7.077 11.811 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.713 -7.313 12.888 1.00 25.00 H new ATOM 700 N TRP A 46 23.604 -5.635 6.142 1.00 25.00 N ATOM 701 CA TRP A 46 22.322 -5.365 5.497 1.00 25.00 C ATOM 702 C TRP A 46 21.371 -4.737 6.499 1.00 25.00 C ATOM 703 O TRP A 46 21.165 -5.270 7.580 1.00 25.00 O ATOM 704 CB TRP A 46 21.733 -6.668 4.935 1.00 25.00 C ATOM 705 CG TRP A 46 22.591 -7.319 3.847 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.715 -6.820 3.258 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.382 -8.602 3.222 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.216 -7.667 2.319 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.426 -8.782 2.264 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.420 -9.622 3.374 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.519 -9.937 1.458 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.527 -10.792 2.583 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.564 -10.930 1.624 1.00 25.00 C ATOM 0 H TRP A 46 23.561 -6.321 6.895 1.00 25.00 H new ATOM 0 HA TRP A 46 22.470 -4.670 4.671 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.600 -7.377 5.752 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.743 -6.462 4.528 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.155 -5.866 3.507 1.00 25.00 H new ATOM 0 HE1 TRP A 46 25.045 -7.498 1.749 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.613 -9.513 4.084 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.311 -10.045 0.732 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.810 -11.590 2.711 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.611 -11.821 1.015 1.00 25.00 H new ATOM 724 N LEU A 47 20.804 -3.594 6.146 1.00 25.00 N ATOM 725 CA LEU A 47 19.864 -2.898 7.014 1.00 25.00 C ATOM 726 C LEU A 47 18.565 -3.664 7.001 1.00 25.00 C ATOM 727 O LEU A 47 17.979 -3.868 5.942 1.00 25.00 O ATOM 728 CB LEU A 47 19.611 -1.483 6.492 1.00 25.00 C ATOM 729 CG LEU A 47 18.616 -0.623 7.280 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.040 -0.437 8.725 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.460 0.730 6.599 1.00 25.00 C ATOM 0 H LEU A 47 20.980 -3.125 5.258 1.00 25.00 H new ATOM 0 HA LEU A 47 20.271 -2.833 8.023 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.565 -0.957 6.461 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.255 -1.559 5.464 1.00 25.00 H new ATOM 0 HG LEU A 47 17.659 -1.145 7.290 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.305 0.179 9.244 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.107 -1.410 9.212 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.013 0.054 8.758 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.752 1.340 7.160 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.426 1.234 6.565 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.090 0.586 5.584 1.00 25.00 H new ATOM 743 N CYS A 48 18.106 -4.082 8.165 1.00 25.00 N ATOM 744 CA CYS A 48 16.850 -4.797 8.272 1.00 25.00 C ATOM 745 C CYS A 48 16.034 -4.277 9.432 1.00 25.00 C ATOM 746 O CYS A 48 16.517 -3.496 10.249 1.00 25.00 O ATOM 747 CB CYS A 48 17.105 -6.300 8.450 1.00 25.00 C ATOM 748 SG CYS A 48 18.291 -7.000 7.270 1.00 25.00 S ATOM 0 H CYS A 48 18.587 -3.938 9.053 1.00 25.00 H new ATOM 0 HA CYS A 48 16.290 -4.636 7.351 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.469 -6.478 9.462 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.158 -6.831 8.354 1.00 25.00 H new ATOM 0 HG CYS A 48 19.418 -6.358 7.355 1.00 25.00 H new ATOM 754 N SER A 49 14.796 -4.729 9.499 1.00 25.00 N ATOM 755 CA SER A 49 13.891 -4.369 10.571 1.00 25.00 C ATOM 756 C SER A 49 13.341 -5.650 11.192 1.00 25.00 C ATOM 757 O SER A 49 12.952 -6.588 10.486 1.00 25.00 O ATOM 758 CB SER A 49 12.796 -3.456 10.028 1.00 25.00 C ATOM 759 OG SER A 49 11.545 -4.111 9.921 1.00 25.00 O ATOM 0 H SER A 49 14.389 -5.359 8.808 1.00 25.00 H new ATOM 0 HA SER A 49 14.406 -3.813 11.354 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.694 -2.589 10.681 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.092 -3.083 9.047 1.00 25.00 H new ATOM 0 HG SER A 49 10.877 -3.485 9.571 1.00 25.00 H new ATOM 765 N LEU A 50 13.412 -5.712 12.512 1.00 25.00 N ATOM 766 CA LEU A 50 13.043 -6.888 13.292 1.00 25.00 C ATOM 767 C LEU A 50 12.657 -6.413 14.689 1.00 25.00 C ATOM 768 O LEU A 50 13.294 -5.513 15.215 1.00 25.00 O ATOM 769 CB LEU A 50 14.255 -7.809 13.401 1.00 25.00 C ATOM 770 CG LEU A 50 14.070 -9.107 14.191 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.939 -10.284 13.278 1.00 25.00 C ATOM 772 CD2 LEU A 50 15.248 -9.268 15.117 1.00 25.00 C ATOM 0 H LEU A 50 13.734 -4.932 13.085 1.00 25.00 H new ATOM 0 HA LEU A 50 12.218 -7.422 12.822 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.575 -8.069 12.392 1.00 25.00 H new ATOM 0 HB3 LEU A 50 15.069 -7.246 13.859 1.00 25.00 H new ATOM 0 HG LEU A 50 13.148 -9.055 14.770 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.809 -11.190 13.869 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.074 -10.147 12.629 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.839 -10.374 12.669 1.00 25.00 H new ATOM 0 HD21 LEU A 50 15.137 -10.188 15.691 1.00 25.00 H new ATOM 0 HD22 LEU A 50 16.167 -9.314 14.532 1.00 25.00 H new ATOM 0 HD23 LEU A 50 15.294 -8.419 15.799 1.00 25.00 H new ATOM 784 N HIS A 51 11.606 -6.996 15.262 1.00 25.00 N ATOM 785 CA HIS A 51 11.119 -6.647 16.614 1.00 25.00 C ATOM 786 C HIS A 51 10.795 -5.150 16.749 1.00 25.00 C ATOM 787 O HIS A 51 10.916 -4.576 17.823 1.00 25.00 O ATOM 788 CB HIS A 51 12.147 -7.040 17.697 1.00 25.00 C ATOM 789 CG HIS A 51 12.495 -8.497 17.711 1.00 25.00 C ATOM 790 ND1 HIS A 51 13.666 -9.007 18.214 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.794 -9.584 17.283 1.00 25.00 C ATOM 792 CE1 HIS A 51 13.638 -10.330 18.076 1.00 25.00 C ATOM 793 NE2 HIS A 51 12.517 -10.734 17.514 1.00 25.00 N ATOM 0 H HIS A 51 11.060 -7.728 14.808 1.00 25.00 H new ATOM 0 HA HIS A 51 10.199 -7.213 16.761 1.00 25.00 H new ATOM 0 HB2 HIS A 51 13.058 -6.461 17.545 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.753 -6.762 18.675 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.815 -9.549 16.829 1.00 25.00 H new ATOM 0 HE1 HIS A 51 14.435 -10.990 18.386 1.00 25.00 H new ATOM 0 HE2 HIS A 51 12.243 -11.692 17.297 1.00 25.00 H new ATOM 801 N GLY A 52 10.392 -4.521 15.650 1.00 25.00 N ATOM 802 CA GLY A 52 10.083 -3.098 15.677 1.00 25.00 C ATOM 803 C GLY A 52 11.309 -2.206 15.806 1.00 25.00 C ATOM 804 O GLY A 52 11.188 -1.029 16.125 1.00 25.00 O ATOM 0 H GLY A 52 10.273 -4.968 14.741 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.548 -2.835 14.765 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.410 -2.898 16.511 1.00 25.00 H new ATOM 808 N ARG A 53 12.489 -2.758 15.550 1.00 25.00 N ATOM 809 CA ARG A 53 13.737 -2.017 15.624 1.00 25.00 C ATOM 810 C ARG A 53 14.392 -2.160 14.272 1.00 25.00 C ATOM 811 O ARG A 53 14.158 -3.139 13.574 1.00 25.00 O ATOM 812 CB ARG A 53 14.635 -2.591 16.706 1.00 25.00 C ATOM 813 CG ARG A 53 15.705 -1.609 17.168 1.00 25.00 C ATOM 814 CD ARG A 53 17.047 -2.240 16.972 1.00 25.00 C ATOM 815 NE ARG A 53 18.172 -1.439 17.485 1.00 25.00 N ATOM 816 CZ ARG A 53 18.559 -1.376 18.754 1.00 25.00 C ATOM 817 NH1 ARG A 53 17.928 -2.009 19.715 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.602 -0.668 19.072 1.00 25.00 N ATOM 0 H ARG A 53 12.605 -3.736 15.284 1.00 25.00 H new ATOM 0 HA ARG A 53 13.560 -0.971 15.874 1.00 25.00 H new ATOM 0 HB2 ARG A 53 14.025 -2.885 17.560 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.115 -3.495 16.331 1.00 25.00 H new ATOM 0 HG2 ARG A 53 15.637 -0.681 16.601 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.557 -1.353 18.217 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.054 -3.213 17.464 1.00 25.00 H new ATOM 0 HD3 ARG A 53 17.199 -2.420 15.908 1.00 25.00 H new ATOM 0 HE ARG A 53 18.698 -0.886 16.808 1.00 25.00 H new ATOM 0 HH11 ARG A 53 17.108 -2.576 19.500 1.00 25.00 H new ATOM 0 HH12 ARG A 53 18.258 -1.934 20.677 1.00 25.00 H new ATOM 0 HH21 ARG A 53 20.117 -0.166 18.349 1.00 25.00 H new ATOM 0 HH22 ARG A 53 19.905 -0.615 20.044 1.00 25.00 H new ATOM 832 N GLN A 54 15.219 -1.201 13.917 1.00 25.00 N ATOM 833 CA GLN A 54 15.963 -1.244 12.671 1.00 25.00 C ATOM 834 C GLN A 54 17.431 -1.355 13.019 1.00 25.00 C ATOM 835 O GLN A 54 17.859 -0.829 14.045 1.00 25.00 O ATOM 836 CB GLN A 54 15.706 0.030 11.876 1.00 25.00 C ATOM 837 CG GLN A 54 14.946 -0.215 10.608 1.00 25.00 C ATOM 838 CD GLN A 54 14.563 1.068 9.899 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.408 1.273 9.569 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.522 1.924 9.652 1.00 25.00 N ATOM 0 H GLN A 54 15.396 -0.370 14.481 1.00 25.00 H new ATOM 0 HA GLN A 54 15.653 -2.094 12.063 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.150 0.733 12.496 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.659 0.501 11.637 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.550 -0.828 9.940 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.044 -0.784 10.834 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.477 1.718 9.944 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.314 2.797 9.168 1.00 25.00 H new ATOM 849 N GLY A 55 18.189 -2.044 12.185 1.00 25.00 N ATOM 850 CA GLY A 55 19.608 -2.195 12.427 1.00 25.00 C ATOM 851 C GLY A 55 20.289 -3.026 11.363 1.00 25.00 C ATOM 852 O GLY A 55 19.620 -3.635 10.525 1.00 25.00 O ATOM 0 H GLY A 55 17.847 -2.504 11.341 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.074 -1.210 12.468 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.760 -2.661 13.401 1.00 25.00 H new ATOM 856 N ILE A 56 21.610 -3.037 11.375 1.00 25.00 N ATOM 857 CA ILE A 56 22.392 -3.787 10.402 1.00 25.00 C ATOM 858 C ILE A 56 22.450 -5.257 10.813 1.00 25.00 C ATOM 859 O ILE A 56 22.224 -5.610 11.974 1.00 25.00 O ATOM 860 CB ILE A 56 23.829 -3.191 10.255 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.616 -3.352 11.569 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.729 -1.698 9.884 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.015 -2.781 11.543 1.00 25.00 C ATOM 0 H ILE A 56 22.172 -2.528 12.057 1.00 25.00 H new ATOM 0 HA ILE A 56 21.907 -3.711 9.429 1.00 25.00 H new ATOM 0 HB ILE A 56 24.357 -3.729 9.467 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.057 -2.871 12.372 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.676 -4.413 11.813 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.731 -1.281 9.781 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.193 -1.593 8.941 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.192 -1.164 10.668 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.491 -2.941 12.510 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.596 -3.277 10.766 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.968 -1.712 11.334 1.00 25.00 H new ATOM 875 N VAL A 57 22.708 -6.106 9.835 1.00 25.00 N ATOM 876 CA VAL A 57 22.763 -7.557 10.028 1.00 25.00 C ATOM 877 C VAL A 57 23.879 -8.120 9.154 1.00 25.00 C ATOM 878 O VAL A 57 24.017 -7.706 8.004 1.00 25.00 O ATOM 879 CB VAL A 57 21.433 -8.214 9.561 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.490 -9.719 9.614 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.257 -7.684 10.379 1.00 25.00 C ATOM 0 H VAL A 57 22.888 -5.813 8.875 1.00 25.00 H new ATOM 0 HA VAL A 57 22.932 -7.766 11.084 1.00 25.00 H new ATOM 0 HB VAL A 57 21.285 -7.939 8.517 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.538 -10.131 9.279 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.289 -10.076 8.964 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.684 -10.040 10.637 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.335 -8.155 10.038 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.414 -7.914 11.433 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.182 -6.604 10.251 1.00 25.00 H new ATOM 891 N PRO A 58 24.660 -9.089 9.657 1.00 25.00 N ATOM 892 CA PRO A 58 25.660 -9.717 8.791 1.00 25.00 C ATOM 893 C PRO A 58 24.986 -10.582 7.713 1.00 25.00 C ATOM 894 O PRO A 58 24.390 -11.629 7.996 1.00 25.00 O ATOM 895 CB PRO A 58 26.488 -10.545 9.775 1.00 25.00 C ATOM 896 CG PRO A 58 25.546 -10.884 10.864 1.00 25.00 C ATOM 897 CD PRO A 58 24.644 -9.696 10.999 1.00 25.00 C ATOM 0 HA PRO A 58 26.269 -9.008 8.230 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.885 -11.443 9.301 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.340 -9.979 10.150 1.00 25.00 H new ATOM 0 HG2 PRO A 58 24.978 -11.783 10.625 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.077 -11.081 11.795 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.636 -9.990 11.293 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.007 -9.002 11.757 1.00 25.00 H new ATOM 905 N GLY A 59 25.050 -10.119 6.473 1.00 25.00 N ATOM 906 CA GLY A 59 24.376 -10.781 5.368 1.00 25.00 C ATOM 907 C GLY A 59 24.828 -12.203 5.119 1.00 25.00 C ATOM 908 O GLY A 59 24.077 -13.011 4.593 1.00 25.00 O ATOM 0 H GLY A 59 25.566 -9.281 6.207 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.303 -10.783 5.562 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.535 -10.198 4.461 1.00 25.00 H new ATOM 912 N ASN A 60 26.037 -12.543 5.539 1.00 25.00 N ATOM 913 CA ASN A 60 26.549 -13.905 5.362 1.00 25.00 C ATOM 914 C ASN A 60 25.950 -14.906 6.365 1.00 25.00 C ATOM 915 O ASN A 60 26.202 -16.105 6.265 1.00 25.00 O ATOM 916 CB ASN A 60 28.083 -13.920 5.427 1.00 25.00 C ATOM 917 CG ASN A 60 28.620 -13.667 6.814 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.002 -13.003 7.629 1.00 25.00 O ATOM 919 ND2 ASN A 60 29.789 -14.168 7.069 1.00 25.00 N ATOM 0 H ASN A 60 26.683 -11.904 6.002 1.00 25.00 H new ATOM 0 HA ASN A 60 26.233 -14.232 4.371 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.446 -14.885 5.074 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.477 -13.164 4.748 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.223 -14.012 7.979 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.274 -14.718 6.360 1.00 25.00 H new ATOM 926 N ARG A 61 25.110 -14.427 7.279 1.00 25.00 N ATOM 927 CA ARG A 61 24.349 -15.305 8.183 1.00 25.00 C ATOM 928 C ARG A 61 22.865 -15.211 7.838 1.00 25.00 C ATOM 929 O ARG A 61 22.012 -15.736 8.565 1.00 25.00 O ATOM 930 CB ARG A 61 24.553 -14.892 9.649 1.00 25.00 C ATOM 931 CG ARG A 61 25.987 -15.022 10.151 1.00 25.00 C ATOM 932 CD ARG A 61 26.068 -14.638 11.625 1.00 25.00 C ATOM 933 NE ARG A 61 27.415 -14.854 12.175 1.00 25.00 N ATOM 934 CZ ARG A 61 27.784 -14.614 13.429 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.974 -14.113 14.322 1.00 25.00 N ATOM 936 NH2 ARG A 61 29.004 -14.892 13.787 1.00 25.00 N ATOM 0 H ARG A 61 24.934 -13.432 7.419 1.00 25.00 H new ATOM 0 HA ARG A 61 24.705 -16.328 8.057 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.232 -13.857 9.769 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.905 -15.502 10.278 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.336 -16.046 10.015 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.645 -14.381 9.564 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.791 -13.590 11.743 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.346 -15.224 12.193 1.00 25.00 H new ATOM 0 HE ARG A 61 28.126 -15.219 11.541 1.00 25.00 H new ATOM 0 HH11 ARG A 61 26.012 -13.888 14.069 1.00 25.00 H new ATOM 0 HH12 ARG A 61 27.303 -13.946 15.273 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.657 -15.286 13.110 1.00 25.00 H new ATOM 0 HH22 ARG A 61 29.307 -14.715 14.745 1.00 25.00 H new ATOM 950 N LEU A 62 22.556 -14.532 6.741 1.00 25.00 N ATOM 951 CA LEU A 62 21.176 -14.271 6.349 1.00 25.00 C ATOM 952 C LEU A 62 20.871 -14.779 4.946 1.00 25.00 C ATOM 953 O LEU A 62 21.722 -14.776 4.067 1.00 25.00 O ATOM 954 CB LEU A 62 20.919 -12.762 6.409 1.00 25.00 C ATOM 955 CG LEU A 62 19.488 -12.326 6.727 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.035 -12.757 8.079 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.365 -10.821 6.588 1.00 25.00 C ATOM 0 H LEU A 62 23.251 -14.148 6.100 1.00 25.00 H new ATOM 0 HA LEU A 62 20.524 -14.804 7.041 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.582 -12.333 7.161 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.202 -12.329 5.450 1.00 25.00 H new ATOM 0 HG LEU A 62 18.836 -12.821 6.007 1.00 25.00 H new ATOM 0 HD11 LEU A 62 18.013 -12.418 8.245 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.072 -13.844 8.146 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.689 -12.325 8.837 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.343 -10.517 6.816 1.00 25.00 H new ATOM 0 HD22 LEU A 62 20.052 -10.334 7.281 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.612 -10.529 5.567 1.00 25.00 H new ATOM 969 N LYS A 63 19.639 -15.212 4.733 1.00 25.00 N ATOM 970 CA LYS A 63 19.210 -15.681 3.417 1.00 25.00 C ATOM 971 C LYS A 63 18.029 -14.897 2.934 1.00 25.00 C ATOM 972 O LYS A 63 16.964 -14.941 3.530 1.00 25.00 O ATOM 973 CB LYS A 63 18.829 -17.162 3.468 1.00 25.00 C ATOM 974 CG LYS A 63 18.262 -17.703 2.152 1.00 25.00 C ATOM 975 CD LYS A 63 17.927 -19.186 2.252 1.00 25.00 C ATOM 976 CE LYS A 63 19.175 -20.064 2.230 1.00 25.00 C ATOM 977 NZ LYS A 63 19.926 -19.969 0.925 1.00 25.00 N ATOM 0 H LYS A 63 18.916 -15.250 5.451 1.00 25.00 H new ATOM 0 HA LYS A 63 20.045 -15.542 2.731 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.709 -17.744 3.739 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.093 -17.311 4.258 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.365 -17.144 1.885 1.00 25.00 H new ATOM 0 HG3 LYS A 63 18.985 -17.546 1.352 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.372 -19.370 3.172 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.274 -19.465 1.425 1.00 25.00 H new ATOM 0 HE2 LYS A 63 19.835 -19.772 3.047 1.00 25.00 H new ATOM 0 HE3 LYS A 63 18.889 -21.101 2.406 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 20.593 -20.764 0.849 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 19.252 -20.006 0.133 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 20.451 -19.072 0.891 1.00 25.00 H new ATOM 991 N ILE A 64 18.203 -14.243 1.805 1.00 25.00 N ATOM 992 CA ILE A 64 17.126 -13.492 1.186 1.00 25.00 C ATOM 993 C ILE A 64 16.101 -14.479 0.633 1.00 25.00 C ATOM 994 O ILE A 64 16.445 -15.393 -0.123 1.00 25.00 O ATOM 995 CB ILE A 64 17.673 -12.596 0.045 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.764 -11.643 0.569 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.552 -11.788 -0.587 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.334 -10.699 1.715 1.00 25.00 C ATOM 0 H ILE A 64 19.085 -14.215 1.293 1.00 25.00 H new ATOM 0 HA ILE A 64 16.658 -12.845 1.928 1.00 25.00 H new ATOM 0 HB ILE A 64 18.110 -13.250 -0.709 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.608 -12.241 0.912 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.121 -11.036 -0.263 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.957 -11.166 -1.385 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.803 -12.465 -0.999 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.090 -11.153 0.169 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.177 -10.073 2.007 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.513 -10.067 1.377 1.00 25.00 H new ATOM 0 HD13 ILE A 64 18.008 -11.290 2.571 1.00 25.00 H new ATOM 1010 N LEU A 65 14.851 -14.319 1.035 1.00 25.00 N ATOM 1011 CA LEU A 65 13.782 -15.210 0.604 1.00 25.00 C ATOM 1012 C LEU A 65 13.085 -14.616 -0.613 1.00 25.00 C ATOM 1013 O LEU A 65 11.982 -14.100 -0.520 1.00 25.00 O ATOM 1014 CB LEU A 65 12.777 -15.427 1.740 1.00 25.00 C ATOM 1015 CG LEU A 65 13.358 -15.972 3.055 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.233 -16.064 4.075 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.037 -17.345 2.867 1.00 25.00 C ATOM 0 H LEU A 65 14.548 -13.575 1.664 1.00 25.00 H new ATOM 0 HA LEU A 65 14.209 -16.177 0.336 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.284 -14.478 1.949 1.00 25.00 H new ATOM 0 HB3 LEU A 65 12.008 -16.116 1.392 1.00 25.00 H new ATOM 0 HG LEU A 65 14.133 -15.290 3.406 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.626 -16.449 5.016 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.807 -15.074 4.238 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.459 -16.735 3.703 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.432 -17.689 3.823 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.307 -18.064 2.496 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.852 -17.253 2.149 1.00 25.00 H new ATOM 1029 N VAL A 66 13.746 -14.703 -1.758 1.00 25.00 N ATOM 1030 CA VAL A 66 13.204 -14.162 -3.013 1.00 25.00 C ATOM 1031 C VAL A 66 11.924 -14.916 -3.405 1.00 25.00 C ATOM 1032 O VAL A 66 11.065 -14.394 -4.099 1.00 25.00 O ATOM 1033 CB VAL A 66 14.253 -14.289 -4.175 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.796 -13.527 -5.430 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.624 -13.746 -3.735 1.00 25.00 C ATOM 0 H VAL A 66 14.661 -15.143 -1.852 1.00 25.00 H new ATOM 0 HA VAL A 66 12.976 -13.108 -2.854 1.00 25.00 H new ATOM 0 HB VAL A 66 14.338 -15.349 -4.414 1.00 25.00 H new ATOM 0 HG11 VAL A 66 14.545 -13.636 -6.215 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.846 -13.933 -5.777 1.00 25.00 H new ATOM 0 HG13 VAL A 66 13.673 -12.471 -5.190 1.00 25.00 H new ATOM 0 HG21 VAL A 66 16.335 -13.844 -4.556 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.528 -12.695 -3.461 1.00 25.00 H new ATOM 0 HG23 VAL A 66 15.981 -14.313 -2.876 1.00 25.00 H new ATOM 1045 N GLY A 67 11.819 -16.165 -2.970 1.00 25.00 N ATOM 1046 CA GLY A 67 10.655 -16.986 -3.289 1.00 25.00 C ATOM 1047 C GLY A 67 10.818 -17.722 -4.604 1.00 25.00 C ATOM 1048 O GLY A 67 10.303 -18.818 -4.777 1.00 25.00 O ATOM 0 H GLY A 67 12.522 -16.632 -2.397 1.00 25.00 H new ATOM 0 HA2 GLY A 67 10.491 -17.707 -2.489 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.768 -16.354 -3.336 1.00 25.00 H new ATOM 1052 N MET A 68 11.603 -17.134 -5.497 1.00 25.00 N ATOM 1053 CA MET A 68 11.910 -17.680 -6.827 1.00 25.00 C ATOM 1054 C MET A 68 12.896 -18.865 -6.792 1.00 25.00 C ATOM 1055 O MET A 68 13.710 -19.040 -7.692 1.00 25.00 O ATOM 1056 CB MET A 68 12.515 -16.541 -7.656 1.00 25.00 C ATOM 1057 CG MET A 68 12.240 -16.604 -9.152 1.00 25.00 C ATOM 1058 SD MET A 68 13.136 -15.296 -10.035 1.00 25.00 S ATOM 1059 CE MET A 68 12.389 -13.791 -9.359 1.00 25.00 C ATOM 0 H MET A 68 12.060 -16.240 -5.318 1.00 25.00 H new ATOM 0 HA MET A 68 10.987 -18.067 -7.259 1.00 25.00 H new ATOM 0 HB2 MET A 68 12.134 -15.594 -7.273 1.00 25.00 H new ATOM 0 HB3 MET A 68 13.594 -16.536 -7.502 1.00 25.00 H new ATOM 0 HG2 MET A 68 12.538 -17.578 -9.539 1.00 25.00 H new ATOM 0 HG3 MET A 68 11.170 -16.502 -9.333 1.00 25.00 H new ATOM 0 HE1 MET A 68 12.647 -12.941 -9.991 1.00 25.00 H new ATOM 0 HE2 MET A 68 11.305 -13.905 -9.328 1.00 25.00 H new ATOM 0 HE3 MET A 68 12.765 -13.620 -8.350 1.00 25.00 H new ATOM 1069 N TYR A 69 12.868 -19.636 -5.715 1.00 25.00 N ATOM 1070 CA TYR A 69 13.810 -20.731 -5.516 1.00 25.00 C ATOM 1071 C TYR A 69 13.097 -21.924 -4.908 1.00 25.00 C ATOM 1072 O TYR A 69 12.458 -21.807 -3.866 1.00 25.00 O ATOM 1073 CB TYR A 69 14.939 -20.294 -4.574 1.00 25.00 C ATOM 1074 CG TYR A 69 15.888 -19.282 -5.185 1.00 25.00 C ATOM 1075 CD1 TYR A 69 15.587 -17.899 -5.184 1.00 25.00 C ATOM 1076 CD2 TYR A 69 17.096 -19.703 -5.781 1.00 25.00 C ATOM 1077 CE1 TYR A 69 16.480 -16.962 -5.768 1.00 25.00 C ATOM 1078 CE2 TYR A 69 17.988 -18.763 -6.361 1.00 25.00 C ATOM 1079 CZ TYR A 69 17.668 -17.402 -6.347 1.00 25.00 C ATOM 1080 OH TYR A 69 18.523 -16.487 -6.904 1.00 25.00 O ATOM 0 H TYR A 69 12.195 -19.522 -4.957 1.00 25.00 H new ATOM 0 HA TYR A 69 14.229 -21.006 -6.484 1.00 25.00 H new ATOM 0 HB2 TYR A 69 14.502 -19.869 -3.671 1.00 25.00 H new ATOM 0 HB3 TYR A 69 15.507 -21.173 -4.270 1.00 25.00 H new ATOM 0 HD1 TYR A 69 14.668 -17.553 -4.734 1.00 25.00 H new ATOM 0 HD2 TYR A 69 17.345 -20.754 -5.796 1.00 25.00 H new ATOM 0 HE1 TYR A 69 16.238 -15.909 -5.763 1.00 25.00 H new ATOM 0 HE2 TYR A 69 18.911 -19.098 -6.811 1.00 25.00 H new ATOM 0 HH TYR A 69 19.308 -16.950 -7.265 1.00 25.00 H new ATOM 1090 N ASP A 70 13.240 -23.080 -5.537 1.00 25.00 N ATOM 1091 CA ASP A 70 12.617 -24.313 -5.051 1.00 25.00 C ATOM 1092 C ASP A 70 13.286 -24.828 -3.789 1.00 25.00 C ATOM 1093 O ASP A 70 12.649 -25.469 -2.950 1.00 25.00 O ATOM 1094 CB ASP A 70 12.724 -25.386 -6.124 1.00 25.00 C ATOM 1095 CG ASP A 70 12.005 -24.997 -7.382 1.00 25.00 C ATOM 1096 OD1 ASP A 70 10.775 -24.808 -7.326 1.00 25.00 O ATOM 1097 OD2 ASP A 70 12.693 -24.754 -8.391 1.00 25.00 O ATOM 0 H ASP A 70 13.785 -23.196 -6.391 1.00 25.00 H new ATOM 0 HA ASP A 70 11.575 -24.088 -4.822 1.00 25.00 H new ATOM 0 HB2 ASP A 70 13.775 -25.570 -6.349 1.00 25.00 H new ATOM 0 HB3 ASP A 70 12.311 -26.321 -5.745 1.00 25.00 H new ATOM 1102 N LYS A 71 14.578 -24.541 -3.657 1.00 25.00 N ATOM 1103 CA LYS A 71 15.390 -25.001 -2.518 1.00 25.00 C ATOM 1104 C LYS A 71 15.108 -24.188 -1.244 1.00 25.00 C ATOM 1105 O LYS A 71 15.986 -23.539 -0.671 1.00 25.00 O ATOM 1106 CB LYS A 71 16.880 -24.969 -2.897 1.00 25.00 C ATOM 1107 CG LYS A 71 17.765 -25.842 -1.986 1.00 25.00 C ATOM 1108 CD LYS A 71 19.227 -25.898 -2.453 1.00 25.00 C ATOM 1109 CE LYS A 71 19.396 -26.758 -3.717 1.00 25.00 C ATOM 1110 NZ LYS A 71 20.849 -26.946 -4.082 1.00 25.00 N ATOM 0 H LYS A 71 15.099 -23.983 -4.334 1.00 25.00 H new ATOM 0 HA LYS A 71 15.111 -26.030 -2.290 1.00 25.00 H new ATOM 0 HB2 LYS A 71 16.992 -25.304 -3.928 1.00 25.00 H new ATOM 0 HB3 LYS A 71 17.235 -23.939 -2.856 1.00 25.00 H new ATOM 0 HG2 LYS A 71 17.728 -25.452 -0.969 1.00 25.00 H new ATOM 0 HG3 LYS A 71 17.360 -26.853 -1.954 1.00 25.00 H new ATOM 0 HD2 LYS A 71 19.583 -24.887 -2.652 1.00 25.00 H new ATOM 0 HD3 LYS A 71 19.848 -26.303 -1.654 1.00 25.00 H new ATOM 0 HE2 LYS A 71 18.933 -27.732 -3.558 1.00 25.00 H new ATOM 0 HE3 LYS A 71 18.871 -26.288 -4.549 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 20.919 -27.531 -4.939 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 21.285 -26.019 -4.259 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 21.345 -27.418 -3.299 1.00 25.00 H new ATOM 1124 N LYS A 72 13.855 -24.223 -0.821 1.00 25.00 N ATOM 1125 CA LYS A 72 13.404 -23.551 0.390 1.00 25.00 C ATOM 1126 C LYS A 72 13.835 -24.422 1.563 1.00 25.00 C ATOM 1127 O LYS A 72 13.854 -25.644 1.449 1.00 25.00 O ATOM 1128 CB LYS A 72 11.879 -23.400 0.358 1.00 25.00 C ATOM 1129 CG LYS A 72 11.406 -22.435 -0.733 1.00 25.00 C ATOM 1130 CD LYS A 72 9.915 -22.552 -1.062 1.00 25.00 C ATOM 1131 CE LYS A 72 9.641 -23.726 -2.019 1.00 25.00 C ATOM 1132 NZ LYS A 72 8.226 -23.708 -2.548 1.00 25.00 N ATOM 0 H LYS A 72 13.114 -24.723 -1.312 1.00 25.00 H new ATOM 0 HA LYS A 72 13.834 -22.553 0.478 1.00 25.00 H new ATOM 0 HB2 LYS A 72 11.424 -24.377 0.196 1.00 25.00 H new ATOM 0 HB3 LYS A 72 11.532 -23.044 1.328 1.00 25.00 H new ATOM 0 HG2 LYS A 72 11.619 -21.414 -0.418 1.00 25.00 H new ATOM 0 HG3 LYS A 72 11.983 -22.616 -1.640 1.00 25.00 H new ATOM 0 HD2 LYS A 72 9.348 -22.691 -0.142 1.00 25.00 H new ATOM 0 HD3 LYS A 72 9.567 -21.623 -1.514 1.00 25.00 H new ATOM 0 HE2 LYS A 72 10.340 -23.684 -2.854 1.00 25.00 H new ATOM 0 HE3 LYS A 72 9.822 -24.667 -1.499 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 8.084 -24.515 -3.188 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 7.558 -23.774 -1.754 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 8.061 -22.822 -3.067 1.00 25.00 H new ATOM 1146 N PRO A 73 14.163 -23.813 2.716 1.00 25.00 N ATOM 1147 CA PRO A 73 14.644 -24.646 3.826 1.00 25.00 C ATOM 1148 C PRO A 73 13.566 -25.527 4.453 1.00 25.00 C ATOM 1149 O PRO A 73 13.871 -26.486 5.138 1.00 25.00 O ATOM 1150 CB PRO A 73 15.176 -23.610 4.822 1.00 25.00 C ATOM 1151 CG PRO A 73 14.355 -22.402 4.570 1.00 25.00 C ATOM 1152 CD PRO A 73 14.156 -22.381 3.074 1.00 25.00 C ATOM 0 HA PRO A 73 15.389 -25.369 3.495 1.00 25.00 H new ATOM 0 HB2 PRO A 73 15.069 -23.956 5.850 1.00 25.00 H new ATOM 0 HB3 PRO A 73 16.236 -23.411 4.661 1.00 25.00 H new ATOM 0 HG2 PRO A 73 13.402 -22.454 5.096 1.00 25.00 H new ATOM 0 HG3 PRO A 73 14.861 -21.500 4.915 1.00 25.00 H new ATOM 0 HD2 PRO A 73 13.217 -21.901 2.799 1.00 25.00 H new ATOM 0 HD3 PRO A 73 14.953 -21.835 2.569 1.00 25.00 H new ATOM 1160 N ALA A 74 12.302 -25.233 4.169 1.00 25.00 N ATOM 1161 CA ALA A 74 11.196 -26.047 4.667 1.00 25.00 C ATOM 1162 C ALA A 74 11.252 -27.471 4.093 1.00 25.00 C ATOM 1163 O ALA A 74 10.746 -28.406 4.693 1.00 25.00 O ATOM 1164 CB ALA A 74 9.859 -25.380 4.305 1.00 25.00 C ATOM 0 H ALA A 74 12.016 -24.438 3.597 1.00 25.00 H new ATOM 0 HA ALA A 74 11.283 -26.120 5.751 1.00 25.00 H new ATOM 0 HB1 ALA A 74 9.036 -25.989 4.678 1.00 25.00 H new ATOM 0 HB2 ALA A 74 9.812 -24.390 4.758 1.00 25.00 H new ATOM 0 HB3 ALA A 74 9.780 -25.287 3.222 1.00 25.00 H new ATOM 1170 N GLY A 75 11.892 -27.627 2.939 1.00 25.00 N ATOM 1171 CA GLY A 75 11.999 -28.936 2.312 1.00 25.00 C ATOM 1172 C GLY A 75 13.107 -29.791 2.895 1.00 25.00 C ATOM 1173 O GLY A 75 13.292 -30.923 2.481 1.00 25.00 O ATOM 0 H GLY A 75 12.340 -26.869 2.424 1.00 25.00 H new ATOM 0 HA2 GLY A 75 11.050 -29.461 2.419 1.00 25.00 H new ATOM 0 HA3 GLY A 75 12.173 -28.806 1.244 1.00 25.00 H new ATOM 1177 N SER A 76 13.852 -29.251 3.851 1.00 25.00 N ATOM 1178 CA SER A 76 14.943 -29.991 4.483 1.00 25.00 C ATOM 1179 C SER A 76 14.425 -30.824 5.653 1.00 25.00 C ATOM 1180 O SER A 76 15.147 -31.659 6.192 1.00 25.00 O ATOM 1181 CB SER A 76 16.010 -29.021 4.995 1.00 25.00 C ATOM 1182 OG SER A 76 17.173 -29.718 5.403 1.00 25.00 O ATOM 0 H SER A 76 13.723 -28.304 4.207 1.00 25.00 H new ATOM 0 HA SER A 76 15.377 -30.655 3.736 1.00 25.00 H new ATOM 0 HB2 SER A 76 16.265 -28.308 4.211 1.00 25.00 H new ATOM 0 HB3 SER A 76 15.613 -28.446 5.832 1.00 25.00 H new ATOM 0 HG SER A 76 16.918 -30.578 5.797 1.00 25.00 H new ATOM 1188 N GLY A 77 13.186 -30.576 6.054 1.00 25.00 N ATOM 1189 CA GLY A 77 12.615 -31.276 7.191 1.00 25.00 C ATOM 1190 C GLY A 77 13.252 -30.822 8.491 1.00 25.00 C ATOM 1191 O GLY A 77 13.780 -29.713 8.579 1.00 25.00 O ATOM 0 H GLY A 77 12.563 -29.900 5.612 1.00 25.00 H new ATOM 0 HA2 GLY A 77 11.540 -31.099 7.228 1.00 25.00 H new ATOM 0 HA3 GLY A 77 12.757 -32.350 7.069 1.00 25.00 H new ATOM 1195 N GLY A 78 13.216 -31.686 9.494 1.00 25.00 N ATOM 1196 CA GLY A 78 13.856 -31.410 10.769 1.00 25.00 C ATOM 1197 C GLY A 78 14.516 -32.699 11.195 1.00 25.00 C ATOM 1198 O GLY A 78 14.038 -33.768 10.821 1.00 25.00 O ATOM 0 H GLY A 78 12.746 -32.590 9.447 1.00 25.00 H new ATOM 0 HA2 GLY A 78 14.590 -30.610 10.671 1.00 25.00 H new ATOM 0 HA3 GLY A 78 13.125 -31.083 11.509 1.00 25.00 H new ATOM 1202 N SER A 79 15.624 -32.614 11.914 1.00 25.00 N ATOM 1203 CA SER A 79 16.384 -33.795 12.306 1.00 25.00 C ATOM 1204 C SER A 79 17.235 -33.425 13.512 1.00 25.00 C ATOM 1205 O SER A 79 17.341 -32.246 13.848 1.00 25.00 O ATOM 1206 CB SER A 79 17.283 -34.244 11.147 1.00 25.00 C ATOM 1207 OG SER A 79 17.887 -35.502 11.415 1.00 25.00 O ATOM 0 H SER A 79 16.021 -31.733 12.241 1.00 25.00 H new ATOM 0 HA SER A 79 15.711 -34.615 12.556 1.00 25.00 H new ATOM 0 HB2 SER A 79 16.694 -34.309 10.232 1.00 25.00 H new ATOM 0 HB3 SER A 79 18.057 -33.496 10.975 1.00 25.00 H new ATOM 0 HG SER A 79 18.452 -35.762 10.658 1.00 25.00 H new ATOM 1213 N GLY A 80 17.851 -34.423 14.130 1.00 25.00 N ATOM 1214 CA GLY A 80 18.710 -34.210 15.285 1.00 25.00 C ATOM 1215 C GLY A 80 18.215 -35.007 16.473 1.00 25.00 C ATOM 1216 O GLY A 80 17.029 -35.303 16.574 1.00 25.00 O ATOM 0 H GLY A 80 17.770 -35.399 13.846 1.00 25.00 H new ATOM 0 HA2 GLY A 80 19.732 -34.503 15.044 1.00 25.00 H new ATOM 0 HA3 GLY A 80 18.734 -33.150 15.536 1.00 25.00 H new ATOM 1220 N SER A 81 19.127 -35.387 17.357 1.00 25.00 N ATOM 1221 CA SER A 81 18.783 -36.185 18.539 1.00 25.00 C ATOM 1222 C SER A 81 19.820 -35.951 19.637 1.00 25.00 C ATOM 1223 O SER A 81 20.122 -36.825 20.436 1.00 25.00 O ATOM 1224 CB SER A 81 18.721 -37.674 18.174 1.00 25.00 C ATOM 1225 OG SER A 81 17.656 -38.313 18.857 1.00 25.00 O ATOM 0 H SER A 81 20.118 -35.157 17.282 1.00 25.00 H new ATOM 0 HA SER A 81 17.803 -35.878 18.904 1.00 25.00 H new ATOM 0 HB2 SER A 81 18.588 -37.785 17.098 1.00 25.00 H new ATOM 0 HB3 SER A 81 19.665 -38.156 18.430 1.00 25.00 H new ATOM 0 HG SER A 81 17.631 -39.261 18.610 1.00 25.00 H new ATOM 1231 N GLY A 82 20.399 -34.761 19.631 1.00 25.00 N ATOM 1232 CA GLY A 82 21.437 -34.414 20.582 1.00 25.00 C ATOM 1233 C GLY A 82 21.656 -32.928 20.464 1.00 25.00 C ATOM 1234 O GLY A 82 20.940 -32.282 19.705 1.00 25.00 O ATOM 0 H GLY A 82 20.165 -34.017 18.974 1.00 25.00 H new ATOM 0 HA2 GLY A 82 21.138 -34.681 21.595 1.00 25.00 H new ATOM 0 HA3 GLY A 82 22.356 -34.959 20.367 1.00 25.00 H new ATOM 1238 N LEU A 83 22.614 -32.381 21.201 1.00 25.00 N ATOM 1239 CA LEU A 83 22.866 -30.938 21.171 1.00 25.00 C ATOM 1240 C LEU A 83 23.324 -30.495 19.785 1.00 25.00 C ATOM 1241 O LEU A 83 22.817 -29.512 19.251 1.00 25.00 O ATOM 1242 CB LEU A 83 23.939 -30.558 22.202 1.00 25.00 C ATOM 1243 CG LEU A 83 23.611 -30.853 23.676 1.00 25.00 C ATOM 1244 CD1 LEU A 83 24.847 -30.591 24.534 1.00 25.00 C ATOM 1245 CD2 LEU A 83 22.441 -30.000 24.178 1.00 25.00 C ATOM 0 H LEU A 83 23.228 -32.906 21.824 1.00 25.00 H new ATOM 0 HA LEU A 83 21.932 -30.433 21.416 1.00 25.00 H new ATOM 0 HB2 LEU A 83 24.859 -31.083 21.946 1.00 25.00 H new ATOM 0 HB3 LEU A 83 24.143 -29.492 22.105 1.00 25.00 H new ATOM 0 HG LEU A 83 23.316 -31.900 23.754 1.00 25.00 H new ATOM 0 HD11 LEU A 83 24.616 -30.800 25.579 1.00 25.00 H new ATOM 0 HD12 LEU A 83 25.661 -31.238 24.206 1.00 25.00 H new ATOM 0 HD13 LEU A 83 25.148 -29.548 24.430 1.00 25.00 H new ATOM 0 HD21 LEU A 83 22.240 -30.237 25.223 1.00 25.00 H new ATOM 0 HD22 LEU A 83 22.696 -28.944 24.088 1.00 25.00 H new ATOM 0 HD23 LEU A 83 21.554 -30.211 23.581 1.00 25.00 H new ATOM 1257 N THR A 84 24.250 -31.265 19.212 1.00 25.00 N ATOM 1258 CA THR A 84 24.848 -30.995 17.892 1.00 25.00 C ATOM 1259 C THR A 84 25.633 -29.668 17.888 1.00 25.00 C ATOM 1260 O THR A 84 25.599 -28.912 18.854 1.00 25.00 O ATOM 1261 CB THR A 84 23.763 -31.006 16.761 1.00 25.00 C ATOM 1262 OG1 THR A 84 22.642 -31.787 17.188 1.00 25.00 O ATOM 1263 CG2 THR A 84 24.292 -31.639 15.471 1.00 25.00 C ATOM 0 H THR A 84 24.615 -32.108 19.654 1.00 25.00 H new ATOM 0 HA THR A 84 25.554 -31.799 17.687 1.00 25.00 H new ATOM 0 HB THR A 84 23.486 -29.970 16.568 1.00 25.00 H new ATOM 0 HG1 THR A 84 21.961 -31.794 16.483 1.00 25.00 H new ATOM 0 HG21 THR A 84 23.509 -31.627 14.712 1.00 25.00 H new ATOM 0 HG22 THR A 84 25.152 -31.073 15.114 1.00 25.00 H new ATOM 0 HG23 THR A 84 24.592 -32.669 15.667 1.00 25.00 H new ATOM 1271 N ASP A 85 26.362 -29.408 16.812 1.00 25.00 N ATOM 1272 CA ASP A 85 27.155 -28.189 16.682 1.00 25.00 C ATOM 1273 C ASP A 85 26.859 -27.548 15.337 1.00 25.00 C ATOM 1274 O ASP A 85 26.757 -28.235 14.321 1.00 25.00 O ATOM 1275 CB ASP A 85 28.651 -28.507 16.755 1.00 25.00 C ATOM 1276 CG ASP A 85 29.120 -28.775 18.168 1.00 25.00 C ATOM 1277 OD1 ASP A 85 29.290 -29.960 18.532 1.00 25.00 O ATOM 1278 OD2 ASP A 85 29.361 -27.794 18.906 1.00 25.00 O ATOM 0 H ASP A 85 26.422 -30.031 16.007 1.00 25.00 H new ATOM 0 HA ASP A 85 26.895 -27.513 17.497 1.00 25.00 H new ATOM 0 HB2 ASP A 85 28.865 -29.377 16.134 1.00 25.00 H new ATOM 0 HB3 ASP A 85 29.217 -27.673 16.340 1.00 25.00 H new ATOM 1283 N GLU A 86 26.744 -26.229 15.331 1.00 25.00 N ATOM 1284 CA GLU A 86 26.535 -25.471 14.099 1.00 25.00 C ATOM 1285 C GLU A 86 27.167 -24.095 14.283 1.00 25.00 C ATOM 1286 O GLU A 86 26.559 -23.177 14.830 1.00 25.00 O ATOM 1287 CB GLU A 86 25.044 -25.345 13.780 1.00 25.00 C ATOM 1288 CG GLU A 86 24.775 -24.708 12.425 1.00 25.00 C ATOM 1289 CD GLU A 86 23.295 -24.543 12.159 1.00 25.00 C ATOM 1290 OE1 GLU A 86 22.786 -25.092 11.154 1.00 25.00 O ATOM 1291 OE2 GLU A 86 22.615 -23.878 12.966 1.00 25.00 O ATOM 0 H GLU A 86 26.792 -25.654 16.172 1.00 25.00 H new ATOM 0 HA GLU A 86 26.999 -25.989 13.260 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.588 -26.335 13.806 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.561 -24.751 14.556 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.262 -23.734 12.379 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.218 -25.323 11.641 1.00 25.00 H new ATOM 1298 N LEU A 87 28.427 -23.975 13.898 1.00 25.00 N ATOM 1299 CA LEU A 87 29.154 -22.726 14.099 1.00 25.00 C ATOM 1300 C LEU A 87 28.867 -21.755 12.961 1.00 25.00 C ATOM 1301 O LEU A 87 28.963 -22.102 11.783 1.00 25.00 O ATOM 1302 CB LEU A 87 30.660 -22.993 14.208 1.00 25.00 C ATOM 1303 CG LEU A 87 31.089 -23.892 15.383 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.591 -24.153 15.302 1.00 25.00 C ATOM 1305 CD2 LEU A 87 30.750 -23.263 16.742 1.00 25.00 C ATOM 0 H LEU A 87 28.965 -24.716 13.449 1.00 25.00 H new ATOM 0 HA LEU A 87 28.815 -22.276 15.032 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.998 -23.452 13.279 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.176 -22.037 14.297 1.00 25.00 H new ATOM 0 HG LEU A 87 30.537 -24.829 15.304 1.00 25.00 H new ATOM 0 HD11 LEU A 87 32.895 -24.789 16.133 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.824 -24.650 14.360 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.128 -23.206 15.354 1.00 25.00 H new ATOM 0 HD21 LEU A 87 31.070 -23.931 17.542 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.265 -22.307 16.839 1.00 25.00 H new ATOM 0 HD23 LEU A 87 29.674 -23.104 16.811 1.00 25.00 H new ATOM 1317 N ALA A 88 28.492 -20.540 13.328 1.00 25.00 N ATOM 1318 CA ALA A 88 28.172 -19.504 12.357 1.00 25.00 C ATOM 1319 C ALA A 88 29.459 -18.922 11.753 1.00 25.00 C ATOM 1320 O ALA A 88 30.481 -18.829 12.439 1.00 25.00 O ATOM 1321 CB ALA A 88 27.365 -18.398 13.048 1.00 25.00 C ATOM 0 H ALA A 88 28.401 -20.245 14.300 1.00 25.00 H new ATOM 0 HA ALA A 88 27.580 -19.936 11.550 1.00 25.00 H new ATOM 0 HB1 ALA A 88 27.122 -17.619 12.325 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.444 -18.818 13.452 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.954 -17.970 13.859 1.00 25.00 H new ATOM 1327 N PRO A 89 29.410 -18.464 10.487 1.00 25.00 N ATOM 1328 CA PRO A 89 30.618 -17.818 9.961 1.00 25.00 C ATOM 1329 C PRO A 89 30.865 -16.465 10.632 1.00 25.00 C ATOM 1330 O PRO A 89 29.955 -15.891 11.243 1.00 25.00 O ATOM 1331 CB PRO A 89 30.296 -17.654 8.475 1.00 25.00 C ATOM 1332 CG PRO A 89 28.817 -17.519 8.431 1.00 25.00 C ATOM 1333 CD PRO A 89 28.319 -18.464 9.492 1.00 25.00 C ATOM 0 HA PRO A 89 31.527 -18.392 10.143 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.788 -16.776 8.056 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.634 -18.515 7.898 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.506 -16.494 8.635 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.424 -17.782 7.449 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.379 -18.122 9.926 1.00 25.00 H new ATOM 0 HD3 PRO A 89 28.141 -19.462 9.091 1.00 25.00 H new ATOM 1341 N PRO A 90 32.098 -15.937 10.542 1.00 25.00 N ATOM 1342 CA PRO A 90 32.344 -14.659 11.220 1.00 25.00 C ATOM 1343 C PRO A 90 31.636 -13.501 10.525 1.00 25.00 C ATOM 1344 O PRO A 90 31.410 -13.536 9.319 1.00 25.00 O ATOM 1345 CB PRO A 90 33.868 -14.520 11.146 1.00 25.00 C ATOM 1346 CG PRO A 90 34.245 -15.251 9.911 1.00 25.00 C ATOM 1347 CD PRO A 90 33.303 -16.431 9.849 1.00 25.00 C ATOM 0 HA PRO A 90 31.961 -14.637 12.240 1.00 25.00 H new ATOM 0 HB2 PRO A 90 34.170 -13.474 11.096 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.349 -14.949 12.025 1.00 25.00 H new ATOM 0 HG2 PRO A 90 34.141 -14.617 9.030 1.00 25.00 H new ATOM 0 HG3 PRO A 90 35.284 -15.578 9.948 1.00 25.00 H new ATOM 0 HD2 PRO A 90 33.086 -16.720 8.820 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.722 -17.307 10.344 1.00 25.00 H new ATOM 1355 N LYS A 91 31.261 -12.488 11.293 1.00 25.00 N ATOM 1356 CA LYS A 91 30.582 -11.316 10.747 1.00 25.00 C ATOM 1357 C LYS A 91 31.634 -10.370 10.152 1.00 25.00 C ATOM 1358 O LYS A 91 32.797 -10.400 10.567 1.00 25.00 O ATOM 1359 CB LYS A 91 29.777 -10.608 11.854 1.00 25.00 C ATOM 1360 CG LYS A 91 30.610 -10.150 13.061 1.00 25.00 C ATOM 1361 CD LYS A 91 29.790 -9.299 14.033 1.00 25.00 C ATOM 1362 CE LYS A 91 28.719 -10.107 14.777 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.964 -9.227 15.713 1.00 25.00 N ATOM 0 H LYS A 91 31.415 -12.452 12.301 1.00 25.00 H new ATOM 0 HA LYS A 91 29.885 -11.619 9.965 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.279 -9.740 11.423 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.996 -11.283 12.204 1.00 25.00 H new ATOM 0 HG2 LYS A 91 31.001 -11.023 13.584 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.469 -9.576 12.712 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.460 -8.838 14.759 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.310 -8.489 13.483 1.00 25.00 H new ATOM 0 HE2 LYS A 91 28.034 -10.561 14.061 1.00 25.00 H new ATOM 0 HE3 LYS A 91 29.187 -10.921 15.330 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.785 -9.738 16.601 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.522 -8.372 15.912 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.058 -8.956 15.280 1.00 25.00 H new ATOM 1377 N PRO A 92 31.247 -9.533 9.172 1.00 25.00 N ATOM 1378 CA PRO A 92 32.222 -8.569 8.649 1.00 25.00 C ATOM 1379 C PRO A 92 32.539 -7.481 9.694 1.00 25.00 C ATOM 1380 O PRO A 92 31.790 -7.310 10.659 1.00 25.00 O ATOM 1381 CB PRO A 92 31.514 -8.008 7.406 1.00 25.00 C ATOM 1382 CG PRO A 92 30.079 -8.142 7.698 1.00 25.00 C ATOM 1383 CD PRO A 92 29.933 -9.392 8.513 1.00 25.00 C ATOM 0 HA PRO A 92 33.192 -9.006 8.411 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.787 -6.967 7.232 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.789 -8.564 6.510 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.711 -7.275 8.246 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.499 -8.207 6.778 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.127 -9.304 9.241 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.704 -10.254 7.887 1.00 25.00 H new ATOM 1391 N PRO A 93 33.675 -6.771 9.543 1.00 25.00 N ATOM 1392 CA PRO A 93 34.058 -5.770 10.551 1.00 25.00 C ATOM 1393 C PRO A 93 33.243 -4.478 10.474 1.00 25.00 C ATOM 1394 O PRO A 93 32.427 -4.298 9.571 1.00 25.00 O ATOM 1395 CB PRO A 93 35.526 -5.505 10.210 1.00 25.00 C ATOM 1396 CG PRO A 93 35.580 -5.666 8.749 1.00 25.00 C ATOM 1397 CD PRO A 93 34.685 -6.849 8.468 1.00 25.00 C ATOM 0 HA PRO A 93 33.882 -6.127 11.566 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.833 -4.504 10.514 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.188 -6.209 10.715 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.227 -4.771 8.237 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.599 -5.848 8.407 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.228 -6.783 7.481 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.237 -7.788 8.501 1.00 25.00 H new ATOM 1405 N LEU A 94 33.483 -3.581 11.423 1.00 25.00 N ATOM 1406 CA LEU A 94 32.810 -2.284 11.474 1.00 25.00 C ATOM 1407 C LEU A 94 33.818 -1.160 11.736 1.00 25.00 C ATOM 1408 O LEU A 94 34.878 -1.407 12.312 1.00 25.00 O ATOM 1409 CB LEU A 94 31.762 -2.281 12.595 1.00 25.00 C ATOM 1410 CG LEU A 94 30.418 -2.941 12.270 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.515 -2.822 13.456 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.733 -2.281 11.086 1.00 25.00 C ATOM 0 H LEU A 94 34.150 -3.730 12.180 1.00 25.00 H new ATOM 0 HA LEU A 94 32.327 -2.116 10.512 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.189 -2.783 13.463 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.574 -1.247 12.885 1.00 25.00 H new ATOM 0 HG LEU A 94 30.614 -3.984 12.021 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.556 -3.290 13.232 1.00 25.00 H new ATOM 0 HD12 LEU A 94 29.971 -3.320 14.312 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.359 -1.769 13.690 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.784 -2.780 10.890 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.551 -1.230 11.311 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.372 -2.359 10.206 1.00 25.00 H new ATOM 1424 N PRO A 95 33.492 0.083 11.325 1.00 25.00 N ATOM 1425 CA PRO A 95 34.355 1.241 11.574 1.00 25.00 C ATOM 1426 C PRO A 95 34.276 1.756 13.008 1.00 25.00 C ATOM 1427 O PRO A 95 33.386 1.400 13.775 1.00 25.00 O ATOM 1428 CB PRO A 95 33.796 2.289 10.613 1.00 25.00 C ATOM 1429 CG PRO A 95 32.353 1.994 10.580 1.00 25.00 C ATOM 1430 CD PRO A 95 32.271 0.485 10.606 1.00 25.00 C ATOM 0 HA PRO A 95 35.407 0.997 11.427 1.00 25.00 H new ATOM 0 HB2 PRO A 95 33.990 3.302 10.967 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.245 2.206 9.623 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.839 2.434 11.435 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.886 2.401 9.683 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.373 0.141 11.119 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.243 0.068 9.599 1.00 25.00 H new ATOM 1438 N GLU A 96 35.206 2.635 13.337 1.00 25.00 N ATOM 1439 CA GLU A 96 35.326 3.207 14.682 1.00 25.00 C ATOM 1440 C GLU A 96 34.649 4.584 14.788 1.00 25.00 C ATOM 1441 O GLU A 96 35.191 5.513 15.379 1.00 25.00 O ATOM 1442 CB GLU A 96 36.812 3.305 15.059 1.00 25.00 C ATOM 1443 CG GLU A 96 37.513 1.944 15.086 1.00 25.00 C ATOM 1444 CD GLU A 96 38.982 2.056 15.460 1.00 25.00 C ATOM 1445 OE1 GLU A 96 39.827 2.110 14.539 1.00 25.00 O ATOM 1446 OE2 GLU A 96 39.298 2.063 16.671 1.00 25.00 O ATOM 0 H GLU A 96 35.907 2.979 12.681 1.00 25.00 H new ATOM 0 HA GLU A 96 34.810 2.548 15.380 1.00 25.00 H new ATOM 0 HB2 GLU A 96 37.320 3.955 14.347 1.00 25.00 H new ATOM 0 HB3 GLU A 96 36.902 3.774 16.039 1.00 25.00 H new ATOM 0 HG2 GLU A 96 37.008 1.292 15.799 1.00 25.00 H new ATOM 0 HG3 GLU A 96 37.425 1.474 14.107 1.00 25.00 H new ATOM 1453 N GLY A 97 33.460 4.706 14.212 1.00 25.00 N ATOM 1454 CA GLY A 97 32.713 5.957 14.275 1.00 25.00 C ATOM 1455 C GLY A 97 32.701 6.716 12.962 1.00 25.00 C ATOM 1456 O GLY A 97 32.911 6.133 11.898 1.00 25.00 O ATOM 0 H GLY A 97 32.993 3.959 13.698 1.00 25.00 H new ATOM 0 HA2 GLY A 97 31.686 5.744 14.573 1.00 25.00 H new ATOM 0 HA3 GLY A 97 33.145 6.591 15.049 1.00 25.00 H new ATOM 1460 N GLU A 98 32.430 8.014 13.028 1.00 25.00 N ATOM 1461 CA GLU A 98 32.376 8.852 11.828 1.00 25.00 C ATOM 1462 C GLU A 98 33.767 8.971 11.208 1.00 25.00 C ATOM 1463 O GLU A 98 34.693 9.531 11.789 1.00 25.00 O ATOM 1464 CB GLU A 98 31.852 10.255 12.158 1.00 25.00 C ATOM 1465 CG GLU A 98 30.395 10.283 12.602 1.00 25.00 C ATOM 1466 CD GLU A 98 29.870 11.707 12.754 1.00 25.00 C ATOM 1467 OE1 GLU A 98 30.399 12.451 13.609 1.00 25.00 O ATOM 1468 OE2 GLU A 98 28.938 12.082 12.013 1.00 25.00 O ATOM 0 H GLU A 98 32.244 8.513 13.898 1.00 25.00 H new ATOM 0 HA GLU A 98 31.695 8.379 11.121 1.00 25.00 H new ATOM 0 HB2 GLU A 98 32.470 10.687 12.946 1.00 25.00 H new ATOM 0 HB3 GLU A 98 31.966 10.890 11.280 1.00 25.00 H new ATOM 0 HG2 GLU A 98 29.784 9.747 11.875 1.00 25.00 H new ATOM 0 HG3 GLU A 98 30.295 9.757 13.551 1.00 25.00 H new ATOM 1475 N VAL A 99 33.925 8.438 10.000 1.00 25.00 N ATOM 1476 CA VAL A 99 35.214 8.402 9.287 1.00 25.00 C ATOM 1477 C VAL A 99 35.707 9.787 8.773 1.00 25.00 C ATOM 1478 O VAL A 99 36.362 9.955 7.760 1.00 25.00 O ATOM 1479 CB VAL A 99 35.120 7.326 8.156 1.00 25.00 C ATOM 1480 CG1 VAL A 99 34.861 5.918 8.760 1.00 25.00 C ATOM 1481 CG2 VAL A 99 33.997 7.670 7.134 1.00 25.00 C ATOM 1482 OXT VAL A 99 35.413 10.786 9.553 1.00 25.00 O ATOM 0 H VAL A 99 33.159 8.013 9.477 1.00 25.00 H new ATOM 0 HA VAL A 99 35.988 8.119 10.000 1.00 25.00 H new ATOM 0 HB VAL A 99 36.075 7.323 7.631 1.00 25.00 H new ATOM 0 HG11 VAL A 99 34.799 5.183 7.957 1.00 25.00 H new ATOM 0 HG12 VAL A 99 35.678 5.654 9.431 1.00 25.00 H new ATOM 0 HG13 VAL A 99 33.924 5.928 9.316 1.00 25.00 H new ATOM 0 HG21 VAL A 99 33.960 6.901 6.362 1.00 25.00 H new ATOM 0 HG22 VAL A 99 33.037 7.714 7.649 1.00 25.00 H new ATOM 0 HG23 VAL A 99 34.207 8.636 6.675 1.00 25.00 H new TER 1493 VAL A 99