USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 743 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 7 SER OG : rot 180:sc= -0.181 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.22 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 38 THR OG1 : rot 42:sc= 0.0767 USER MOD Single : A 43 THR OG1 : rot 20:sc= 0.607 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.605 USER MOD Single : A 49 GLN :FLIP amide:sc= -0.193 F(o=-0.83,f=-0.19) USER MOD Single : B 7 SER OG : rot 180:sc= -0.531 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.221 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ -160:sc=-0.00833 (180deg=-0.166) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN :FLIP amide:sc= 0.238 F(o=-1.6!,f=0.24) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : B 38 THR OG1 : rot 33:sc= 0.137 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.603 USER MOD Single : B 49 GLN : amide:sc= -1.76 K(o=-1.8,f=-2.6) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.685 -2.519 1.130 1.00 0.00 N ATOM 17 CA ARG A 3 5.119 -2.654 1.356 1.00 0.00 C ATOM 18 C ARG A 3 5.724 -3.687 0.409 1.00 0.00 C ATOM 19 O ARG A 3 5.224 -4.805 0.293 1.00 0.00 O ATOM 20 CB ARG A 3 5.393 -3.053 2.807 1.00 0.00 C ATOM 21 CG ARG A 3 6.841 -3.432 3.071 1.00 0.00 C ATOM 22 CD ARG A 3 7.038 -4.939 3.039 1.00 0.00 C ATOM 23 NE ARG A 3 6.312 -5.609 4.114 1.00 0.00 N ATOM 24 CZ ARG A 3 6.257 -6.929 4.253 1.00 0.00 C ATOM 25 NH1 ARG A 3 6.884 -7.717 3.389 1.00 0.00 N ATOM 26 NH2 ARG A 3 5.576 -7.465 5.258 1.00 0.00 N ATOM 0 HA ARG A 3 5.585 -1.689 1.158 1.00 0.00 H new ATOM 0 HB2 ARG A 3 5.118 -2.225 3.461 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.752 -3.894 3.071 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.482 -2.964 2.324 1.00 0.00 H new ATOM 0 HG3 ARG A 3 7.148 -3.045 4.042 1.00 0.00 H new ATOM 0 HD2 ARG A 3 6.702 -5.328 2.078 1.00 0.00 H new ATOM 0 HD3 ARG A 3 8.101 -5.167 3.122 1.00 0.00 H new ATOM 0 HE ARG A 3 5.820 -5.032 4.796 1.00 0.00 H new ATOM 0 HH11 ARG A 3 7.410 -7.310 2.616 1.00 0.00 H new ATOM 0 HH12 ARG A 3 6.840 -8.730 3.498 1.00 0.00 H new ATOM 0 HH21 ARG A 3 5.094 -6.863 5.925 1.00 0.00 H new ATOM 0 HH22 ARG A 3 5.535 -8.479 5.363 1.00 0.00 H new ATOM 40 N VAL A 4 6.803 -3.303 -0.265 1.00 0.00 N ATOM 41 CA VAL A 4 7.477 -4.196 -1.201 1.00 0.00 C ATOM 42 C VAL A 4 8.812 -4.674 -0.641 1.00 0.00 C ATOM 43 O VAL A 4 9.674 -3.868 -0.290 1.00 0.00 O ATOM 44 CB VAL A 4 7.719 -3.508 -2.558 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.370 -4.472 -3.537 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.415 -2.964 -3.119 1.00 0.00 C ATOM 0 H VAL A 4 7.229 -2.380 -0.181 1.00 0.00 H new ATOM 0 HA VAL A 4 6.820 -5.053 -1.348 1.00 0.00 H new ATOM 0 HB VAL A 4 8.399 -2.670 -2.405 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.533 -3.968 -4.490 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.326 -4.808 -3.136 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.718 -5.332 -3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.605 -2.481 -4.078 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.709 -3.783 -3.258 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.995 -2.237 -2.424 1.00 0.00 H new ATOM 56 N ARG A 5 8.976 -5.990 -0.559 1.00 0.00 N ATOM 57 CA ARG A 5 10.205 -6.577 -0.041 1.00 0.00 C ATOM 58 C ARG A 5 10.737 -7.650 -0.986 1.00 0.00 C ATOM 59 O ARG A 5 10.040 -8.615 -1.301 1.00 0.00 O ATOM 60 CB ARG A 5 9.964 -7.178 1.345 1.00 0.00 C ATOM 61 CG ARG A 5 11.206 -7.798 1.965 1.00 0.00 C ATOM 62 CD ARG A 5 10.848 -8.925 2.921 1.00 0.00 C ATOM 63 NE ARG A 5 11.728 -8.956 4.086 1.00 0.00 N ATOM 64 CZ ARG A 5 11.577 -8.164 5.142 1.00 0.00 C ATOM 65 NH1 ARG A 5 10.584 -7.286 5.180 1.00 0.00 N ATOM 66 NH2 ARG A 5 12.419 -8.251 6.163 1.00 0.00 N ATOM 0 H ARG A 5 8.272 -6.670 -0.845 1.00 0.00 H new ATOM 0 HA ARG A 5 10.950 -5.785 0.038 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.587 -6.400 2.009 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.187 -7.939 1.272 1.00 0.00 H new ATOM 0 HG2 ARG A 5 11.855 -8.180 1.177 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.769 -7.032 2.498 1.00 0.00 H new ATOM 0 HD2 ARG A 5 9.816 -8.807 3.250 1.00 0.00 H new ATOM 0 HD3 ARG A 5 10.908 -9.878 2.396 1.00 0.00 H new ATOM 0 HE ARG A 5 12.501 -9.622 4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 5 9.934 -7.217 4.397 1.00 0.00 H new ATOM 0 HH12 ARG A 5 10.471 -6.679 5.992 1.00 0.00 H new ATOM 0 HH21 ARG A 5 13.183 -8.926 6.138 1.00 0.00 H new ATOM 0 HH22 ARG A 5 12.302 -7.643 6.973 1.00 0.00 H new ATOM 80 N ILE A 6 11.975 -7.473 -1.437 1.00 0.00 N ATOM 81 CA ILE A 6 12.600 -8.426 -2.346 1.00 0.00 C ATOM 82 C ILE A 6 13.868 -9.015 -1.738 1.00 0.00 C ATOM 83 O ILE A 6 14.773 -8.285 -1.334 1.00 0.00 O ATOM 84 CB ILE A 6 12.947 -7.771 -3.696 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.698 -7.148 -4.322 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.564 -8.795 -4.638 1.00 0.00 C ATOM 87 CD1 ILE A 6 11.975 -6.401 -5.608 1.00 0.00 C ATOM 0 H ILE A 6 12.564 -6.679 -1.188 1.00 0.00 H new ATOM 0 HA ILE A 6 11.876 -9.224 -2.514 1.00 0.00 H new ATOM 0 HB ILE A 6 13.676 -6.980 -3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 6 10.969 -7.934 -4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.244 -6.464 -3.605 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.804 -8.317 -5.588 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.475 -9.196 -4.193 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.856 -9.606 -4.808 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.045 -5.986 -5.995 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.680 -5.593 -5.415 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.400 -7.085 -6.342 1.00 0.00 H new ATOM 99 N SER A 7 13.927 -10.342 -1.677 1.00 0.00 N ATOM 100 CA SER A 7 15.084 -11.030 -1.116 1.00 0.00 C ATOM 101 C SER A 7 15.864 -11.758 -2.207 1.00 0.00 C ATOM 102 O SER A 7 15.308 -12.573 -2.944 1.00 0.00 O ATOM 103 CB SER A 7 14.641 -12.024 -0.041 1.00 0.00 C ATOM 104 OG SER A 7 13.299 -11.790 0.348 1.00 0.00 O ATOM 0 H SER A 7 13.188 -10.961 -2.009 1.00 0.00 H new ATOM 0 HA SER A 7 15.736 -10.283 -0.663 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.741 -13.042 -0.419 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.294 -11.940 0.827 1.00 0.00 H new ATOM 0 HG SER A 7 13.039 -12.439 1.035 1.00 0.00 H new ATOM 110 N ILE A 8 17.155 -11.458 -2.303 1.00 0.00 N ATOM 111 CA ILE A 8 18.012 -12.084 -3.302 1.00 0.00 C ATOM 112 C ILE A 8 19.022 -13.023 -2.650 1.00 0.00 C ATOM 113 O ILE A 8 19.641 -12.684 -1.641 1.00 0.00 O ATOM 114 CB ILE A 8 18.769 -11.032 -4.133 1.00 0.00 C ATOM 115 CG1 ILE A 8 19.803 -10.312 -3.265 1.00 0.00 C ATOM 116 CG2 ILE A 8 17.794 -10.035 -4.741 1.00 0.00 C ATOM 117 CD1 ILE A 8 20.446 -9.126 -3.949 1.00 0.00 C ATOM 0 H ILE A 8 17.630 -10.785 -1.701 1.00 0.00 H new ATOM 0 HA ILE A 8 17.360 -12.657 -3.962 1.00 0.00 H new ATOM 0 HB ILE A 8 19.292 -11.539 -4.944 1.00 0.00 H new ATOM 0 HG12 ILE A 8 19.323 -9.975 -2.346 1.00 0.00 H new ATOM 0 HG13 ILE A 8 20.580 -11.020 -2.977 1.00 0.00 H new ATOM 0 HG21 ILE A 8 18.345 -9.298 -5.325 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.092 -10.561 -5.389 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.246 -9.531 -3.945 1.00 0.00 H new ATOM 0 HD11 ILE A 8 21.168 -8.665 -3.275 1.00 0.00 H new ATOM 0 HD12 ILE A 8 20.955 -9.460 -4.853 1.00 0.00 H new ATOM 0 HD13 ILE A 8 19.679 -8.398 -4.213 1.00 0.00 H new ATOM 129 N THR A 9 19.185 -14.206 -3.234 1.00 0.00 N ATOM 130 CA THR A 9 20.120 -15.194 -2.711 1.00 0.00 C ATOM 131 C THR A 9 21.297 -15.394 -3.660 1.00 0.00 C ATOM 132 O THR A 9 21.177 -16.073 -4.678 1.00 0.00 O ATOM 133 CB THR A 9 19.430 -16.551 -2.476 1.00 0.00 C ATOM 134 OG1 THR A 9 18.008 -16.397 -2.550 1.00 0.00 O ATOM 135 CG2 THR A 9 19.812 -17.125 -1.120 1.00 0.00 C ATOM 0 H THR A 9 18.681 -14.503 -4.070 1.00 0.00 H new ATOM 0 HA THR A 9 20.485 -14.810 -1.759 1.00 0.00 H new ATOM 0 HB THR A 9 19.762 -17.241 -3.252 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.577 -17.264 -2.401 1.00 0.00 H new ATOM 0 HG21 THR A 9 19.313 -18.083 -0.977 1.00 0.00 H new ATOM 0 HG22 THR A 9 20.892 -17.268 -1.077 1.00 0.00 H new ATOM 0 HG23 THR A 9 19.506 -16.435 -0.334 1.00 0.00 H new ATOM 143 N ALA A 10 22.434 -14.797 -3.317 1.00 0.00 N ATOM 144 CA ALA A 10 23.634 -14.912 -4.137 1.00 0.00 C ATOM 145 C ALA A 10 24.694 -15.760 -3.443 1.00 0.00 C ATOM 146 O ALA A 10 24.570 -16.081 -2.261 1.00 0.00 O ATOM 147 CB ALA A 10 24.187 -13.532 -4.459 1.00 0.00 C ATOM 0 H ALA A 10 22.549 -14.229 -2.477 1.00 0.00 H new ATOM 0 HA ALA A 10 23.362 -15.409 -5.068 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.083 -13.633 -5.072 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.438 -12.958 -5.004 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.437 -13.015 -3.533 1.00 0.00 H new ATOM 153 N ARG A 11 25.736 -16.121 -4.185 1.00 0.00 N ATOM 154 CA ARG A 11 26.817 -16.934 -3.641 1.00 0.00 C ATOM 155 C ARG A 11 27.677 -16.120 -2.678 1.00 0.00 C ATOM 156 O ARG A 11 28.077 -16.608 -1.621 1.00 0.00 O ATOM 157 CB ARG A 11 27.684 -17.490 -4.771 1.00 0.00 C ATOM 158 CG ARG A 11 28.288 -16.416 -5.661 1.00 0.00 C ATOM 159 CD ARG A 11 29.045 -17.022 -6.832 1.00 0.00 C ATOM 160 NE ARG A 11 30.195 -16.210 -7.220 1.00 0.00 N ATOM 161 CZ ARG A 11 30.844 -16.357 -8.370 1.00 0.00 C ATOM 162 NH1 ARG A 11 30.457 -17.279 -9.240 1.00 0.00 N ATOM 163 NH2 ARG A 11 31.881 -15.579 -8.652 1.00 0.00 N ATOM 0 H ARG A 11 25.854 -15.863 -5.165 1.00 0.00 H new ATOM 0 HA ARG A 11 26.373 -17.764 -3.092 1.00 0.00 H new ATOM 0 HB2 ARG A 11 28.488 -18.087 -4.340 1.00 0.00 H new ATOM 0 HB3 ARG A 11 27.081 -18.161 -5.383 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.498 -15.765 -6.035 1.00 0.00 H new ATOM 0 HG3 ARG A 11 28.963 -15.793 -5.074 1.00 0.00 H new ATOM 0 HD2 ARG A 11 29.382 -18.024 -6.566 1.00 0.00 H new ATOM 0 HD3 ARG A 11 28.372 -17.127 -7.683 1.00 0.00 H new ATOM 0 HE ARG A 11 30.518 -15.491 -6.573 1.00 0.00 H new ATOM 0 HH11 ARG A 11 29.659 -17.878 -9.027 1.00 0.00 H new ATOM 0 HH12 ARG A 11 30.957 -17.390 -10.122 1.00 0.00 H new ATOM 0 HH21 ARG A 11 32.181 -14.867 -7.986 1.00 0.00 H new ATOM 0 HH22 ARG A 11 32.379 -15.693 -9.535 1.00 0.00 H new ATOM 177 N THR A 12 27.959 -14.876 -3.052 1.00 0.00 N ATOM 178 CA THR A 12 28.773 -13.995 -2.224 1.00 0.00 C ATOM 179 C THR A 12 28.126 -12.623 -2.079 1.00 0.00 C ATOM 180 O THR A 12 27.272 -12.240 -2.879 1.00 0.00 O ATOM 181 CB THR A 12 30.188 -13.823 -2.809 1.00 0.00 C ATOM 182 OG1 THR A 12 30.908 -12.833 -2.067 1.00 0.00 O ATOM 183 CG2 THR A 12 30.123 -13.418 -4.274 1.00 0.00 C ATOM 0 H THR A 12 27.635 -14.456 -3.923 1.00 0.00 H new ATOM 0 HA THR A 12 28.847 -14.464 -1.243 1.00 0.00 H new ATOM 0 HB THR A 12 30.706 -14.779 -2.736 1.00 0.00 H new ATOM 0 HG1 THR A 12 31.807 -12.731 -2.444 1.00 0.00 H new ATOM 0 HG21 THR A 12 31.134 -13.303 -4.665 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.600 -14.188 -4.841 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.588 -12.473 -4.367 1.00 0.00 H new ATOM 191 N LYS A 13 28.537 -11.885 -1.054 1.00 0.00 N ATOM 192 CA LYS A 13 27.998 -10.553 -0.804 1.00 0.00 C ATOM 193 C LYS A 13 28.232 -9.638 -2.002 1.00 0.00 C ATOM 194 O LYS A 13 27.384 -8.813 -2.341 1.00 0.00 O ATOM 195 CB LYS A 13 28.640 -9.947 0.446 1.00 0.00 C ATOM 196 CG LYS A 13 30.156 -10.040 0.458 1.00 0.00 C ATOM 197 CD LYS A 13 30.752 -9.276 1.628 1.00 0.00 C ATOM 198 CE LYS A 13 31.983 -9.977 2.183 1.00 0.00 C ATOM 199 NZ LYS A 13 31.806 -10.360 3.611 1.00 0.00 N ATOM 0 H LYS A 13 29.242 -12.187 -0.382 1.00 0.00 H new ATOM 0 HA LYS A 13 26.924 -10.647 -0.645 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.348 -8.900 0.522 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.246 -10.453 1.328 1.00 0.00 H new ATOM 0 HG2 LYS A 13 30.457 -11.086 0.514 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.553 -9.644 -0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 13 31.019 -8.269 1.308 1.00 0.00 H new ATOM 0 HD3 LYS A 13 30.005 -9.173 2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 13 32.191 -10.868 1.591 1.00 0.00 H new ATOM 0 HE3 LYS A 13 32.848 -9.321 2.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 32.666 -10.835 3.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 31.632 -9.507 4.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 30.996 -11.006 3.699 1.00 0.00 H new ATOM 213 N LYS A 14 29.387 -9.791 -2.641 1.00 0.00 N ATOM 214 CA LYS A 14 29.732 -8.981 -3.803 1.00 0.00 C ATOM 215 C LYS A 14 28.691 -9.141 -4.906 1.00 0.00 C ATOM 216 O LYS A 14 28.307 -8.168 -5.555 1.00 0.00 O ATOM 217 CB LYS A 14 31.114 -9.373 -4.331 1.00 0.00 C ATOM 218 CG LYS A 14 32.209 -8.389 -3.957 1.00 0.00 C ATOM 219 CD LYS A 14 32.757 -8.667 -2.567 1.00 0.00 C ATOM 220 CE LYS A 14 32.344 -7.586 -1.579 1.00 0.00 C ATOM 221 NZ LYS A 14 33.461 -6.646 -1.286 1.00 0.00 N ATOM 0 H LYS A 14 30.100 -10.469 -2.373 1.00 0.00 H new ATOM 0 HA LYS A 14 29.751 -7.936 -3.494 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.375 -10.358 -3.945 1.00 0.00 H new ATOM 0 HB3 LYS A 14 31.068 -9.458 -5.417 1.00 0.00 H new ATOM 0 HG2 LYS A 14 33.017 -8.448 -4.686 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.816 -7.373 -3.998 1.00 0.00 H new ATOM 0 HD2 LYS A 14 32.397 -9.636 -2.220 1.00 0.00 H new ATOM 0 HD3 LYS A 14 33.845 -8.727 -2.609 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.498 -7.030 -1.982 1.00 0.00 H new ATOM 0 HE3 LYS A 14 32.008 -8.051 -0.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 33.139 -5.925 -0.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 34.260 -7.172 -0.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.765 -6.183 -2.166 1.00 0.00 H new ATOM 235 N GLU A 15 28.236 -10.374 -5.111 1.00 0.00 N ATOM 236 CA GLU A 15 27.239 -10.659 -6.135 1.00 0.00 C ATOM 237 C GLU A 15 25.898 -10.021 -5.782 1.00 0.00 C ATOM 238 O GLU A 15 25.307 -9.306 -6.589 1.00 0.00 O ATOM 239 CB GLU A 15 27.068 -12.170 -6.306 1.00 0.00 C ATOM 240 CG GLU A 15 27.852 -12.743 -7.474 1.00 0.00 C ATOM 241 CD GLU A 15 29.340 -12.470 -7.368 1.00 0.00 C ATOM 242 OE1 GLU A 15 29.734 -11.289 -7.470 1.00 0.00 O ATOM 243 OE2 GLU A 15 30.110 -13.436 -7.183 1.00 0.00 O ATOM 0 H GLU A 15 28.542 -11.190 -4.581 1.00 0.00 H new ATOM 0 HA GLU A 15 27.589 -10.232 -7.075 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.382 -12.669 -5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 15 26.010 -12.394 -6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 15 27.687 -13.819 -7.525 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.474 -12.318 -8.404 1.00 0.00 H new ATOM 250 N ALA A 16 25.425 -10.287 -4.569 1.00 0.00 N ATOM 251 CA ALA A 16 24.156 -9.739 -4.107 1.00 0.00 C ATOM 252 C ALA A 16 24.178 -8.214 -4.121 1.00 0.00 C ATOM 253 O ALA A 16 23.202 -7.574 -4.510 1.00 0.00 O ATOM 254 CB ALA A 16 23.837 -10.251 -2.710 1.00 0.00 C ATOM 0 H ALA A 16 25.902 -10.879 -3.889 1.00 0.00 H new ATOM 0 HA ALA A 16 23.375 -10.071 -4.791 1.00 0.00 H new ATOM 0 HB1 ALA A 16 22.887 -9.834 -2.378 1.00 0.00 H new ATOM 0 HB2 ALA A 16 23.769 -11.339 -2.728 1.00 0.00 H new ATOM 0 HB3 ALA A 16 24.627 -9.948 -2.022 1.00 0.00 H new ATOM 260 N GLU A 17 25.299 -7.640 -3.694 1.00 0.00 N ATOM 261 CA GLU A 17 25.446 -6.190 -3.657 1.00 0.00 C ATOM 262 C GLU A 17 25.238 -5.586 -5.043 1.00 0.00 C ATOM 263 O GLU A 17 24.619 -4.531 -5.186 1.00 0.00 O ATOM 264 CB GLU A 17 26.830 -5.809 -3.126 1.00 0.00 C ATOM 265 CG GLU A 17 26.847 -5.497 -1.639 1.00 0.00 C ATOM 266 CD GLU A 17 27.328 -4.090 -1.343 1.00 0.00 C ATOM 267 OE1 GLU A 17 28.385 -3.699 -1.881 1.00 0.00 O ATOM 268 OE2 GLU A 17 26.647 -3.380 -0.574 1.00 0.00 O ATOM 0 H GLU A 17 26.117 -8.156 -3.370 1.00 0.00 H new ATOM 0 HA GLU A 17 24.684 -5.791 -2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.524 -6.626 -3.325 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.194 -4.941 -3.675 1.00 0.00 H new ATOM 0 HG2 GLU A 17 25.844 -5.627 -1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.492 -6.212 -1.129 1.00 0.00 H new ATOM 275 N LYS A 18 25.759 -6.262 -6.061 1.00 0.00 N ATOM 276 CA LYS A 18 25.631 -5.794 -7.436 1.00 0.00 C ATOM 277 C LYS A 18 24.164 -5.700 -7.844 1.00 0.00 C ATOM 278 O LYS A 18 23.768 -4.783 -8.564 1.00 0.00 O ATOM 279 CB LYS A 18 26.376 -6.734 -8.387 1.00 0.00 C ATOM 280 CG LYS A 18 27.865 -6.833 -8.100 1.00 0.00 C ATOM 281 CD LYS A 18 28.683 -6.069 -9.128 1.00 0.00 C ATOM 282 CE LYS A 18 30.172 -6.327 -8.958 1.00 0.00 C ATOM 283 NZ LYS A 18 30.988 -5.143 -9.345 1.00 0.00 N ATOM 0 H LYS A 18 26.274 -7.136 -5.960 1.00 0.00 H new ATOM 0 HA LYS A 18 26.072 -4.799 -7.498 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.935 -7.729 -8.321 1.00 0.00 H new ATOM 0 HB3 LYS A 18 26.234 -6.389 -9.411 1.00 0.00 H new ATOM 0 HG2 LYS A 18 28.071 -6.440 -7.104 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.167 -7.880 -8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 18 28.374 -6.362 -10.131 1.00 0.00 H new ATOM 0 HD3 LYS A 18 28.484 -5.002 -9.032 1.00 0.00 H new ATOM 0 HE2 LYS A 18 30.379 -6.587 -7.920 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.464 -7.183 -9.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.997 -5.359 -9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.810 -4.910 -10.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 30.728 -4.332 -8.748 1.00 0.00 H new ATOM 297 N PHE A 19 23.363 -6.652 -7.378 1.00 0.00 N ATOM 298 CA PHE A 19 21.939 -6.676 -7.694 1.00 0.00 C ATOM 299 C PHE A 19 21.191 -5.601 -6.912 1.00 0.00 C ATOM 300 O PHE A 19 20.286 -4.952 -7.437 1.00 0.00 O ATOM 301 CB PHE A 19 21.349 -8.053 -7.384 1.00 0.00 C ATOM 302 CG PHE A 19 21.505 -9.039 -8.506 1.00 0.00 C ATOM 303 CD1 PHE A 19 22.677 -9.763 -8.652 1.00 0.00 C ATOM 304 CD2 PHE A 19 20.479 -9.242 -9.415 1.00 0.00 C ATOM 305 CE1 PHE A 19 22.823 -10.670 -9.685 1.00 0.00 C ATOM 306 CE2 PHE A 19 20.619 -10.148 -10.450 1.00 0.00 C ATOM 307 CZ PHE A 19 21.793 -10.864 -10.584 1.00 0.00 C ATOM 0 H PHE A 19 23.675 -7.417 -6.780 1.00 0.00 H new ATOM 0 HA PHE A 19 21.825 -6.472 -8.759 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.829 -8.452 -6.491 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.289 -7.942 -7.154 1.00 0.00 H new ATOM 0 HD1 PHE A 19 23.486 -9.617 -7.951 1.00 0.00 H new ATOM 0 HD2 PHE A 19 19.559 -8.686 -9.314 1.00 0.00 H new ATOM 0 HE1 PHE A 19 23.743 -11.227 -9.789 1.00 0.00 H new ATOM 0 HE2 PHE A 19 19.812 -10.296 -11.152 1.00 0.00 H new ATOM 0 HZ PHE A 19 21.905 -11.574 -11.390 1.00 0.00 H new ATOM 317 N ALA A 20 21.574 -5.419 -5.652 1.00 0.00 N ATOM 318 CA ALA A 20 20.941 -4.423 -4.797 1.00 0.00 C ATOM 319 C ALA A 20 20.999 -3.038 -5.432 1.00 0.00 C ATOM 320 O ALA A 20 20.024 -2.288 -5.400 1.00 0.00 O ATOM 321 CB ALA A 20 21.603 -4.406 -3.427 1.00 0.00 C ATOM 0 H ALA A 20 22.320 -5.949 -5.201 1.00 0.00 H new ATOM 0 HA ALA A 20 19.892 -4.696 -4.678 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.120 -3.657 -2.799 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.504 -5.387 -2.963 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.659 -4.161 -3.536 1.00 0.00 H new ATOM 327 N ALA A 21 22.150 -2.704 -6.008 1.00 0.00 N ATOM 328 CA ALA A 21 22.334 -1.409 -6.651 1.00 0.00 C ATOM 329 C ALA A 21 21.249 -1.153 -7.692 1.00 0.00 C ATOM 330 O ALA A 21 20.685 -0.061 -7.758 1.00 0.00 O ATOM 331 CB ALA A 21 23.712 -1.330 -7.292 1.00 0.00 C ATOM 0 H ALA A 21 22.968 -3.312 -6.042 1.00 0.00 H new ATOM 0 HA ALA A 21 22.256 -0.637 -5.886 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.836 -0.358 -7.769 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.477 -1.459 -6.527 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.811 -2.116 -8.040 1.00 0.00 H new ATOM 337 N ILE A 22 20.963 -2.166 -8.502 1.00 0.00 N ATOM 338 CA ILE A 22 19.945 -2.050 -9.539 1.00 0.00 C ATOM 339 C ILE A 22 18.552 -1.923 -8.930 1.00 0.00 C ATOM 340 O ILE A 22 17.781 -1.035 -9.298 1.00 0.00 O ATOM 341 CB ILE A 22 19.968 -3.262 -10.489 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.339 -3.386 -11.158 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.871 -3.135 -11.536 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.728 -4.812 -11.478 1.00 0.00 C ATOM 0 H ILE A 22 21.421 -3.076 -8.461 1.00 0.00 H new ATOM 0 HA ILE A 22 20.175 -1.149 -10.107 1.00 0.00 H new ATOM 0 HB ILE A 22 19.785 -4.165 -9.907 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.339 -2.803 -12.079 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.094 -2.950 -10.504 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.900 -3.999 -12.200 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.900 -3.089 -11.042 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.026 -2.226 -12.117 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.710 -4.824 -11.950 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.761 -5.395 -10.558 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.994 -5.246 -12.157 1.00 0.00 H new ATOM 356 N LEU A 23 18.237 -2.813 -7.997 1.00 0.00 N ATOM 357 CA LEU A 23 16.937 -2.800 -7.334 1.00 0.00 C ATOM 358 C LEU A 23 16.636 -1.422 -6.753 1.00 0.00 C ATOM 359 O LEU A 23 15.500 -0.950 -6.807 1.00 0.00 O ATOM 360 CB LEU A 23 16.897 -3.853 -6.225 1.00 0.00 C ATOM 361 CG LEU A 23 15.979 -5.051 -6.470 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.530 -4.599 -6.577 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.400 -5.798 -7.727 1.00 0.00 C ATOM 0 H LEU A 23 18.864 -3.554 -7.682 1.00 0.00 H new ATOM 0 HA LEU A 23 16.175 -3.035 -8.077 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.910 -4.223 -6.066 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.587 -3.366 -5.300 1.00 0.00 H new ATOM 0 HG LEU A 23 16.066 -5.730 -5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.891 -5.465 -6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.232 -4.109 -5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.427 -3.899 -7.406 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.735 -6.647 -7.885 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.343 -5.128 -8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.424 -6.155 -7.613 1.00 0.00 H new ATOM 375 N ILE A 24 17.661 -0.782 -6.201 1.00 0.00 N ATOM 376 CA ILE A 24 17.507 0.543 -5.614 1.00 0.00 C ATOM 377 C ILE A 24 17.051 1.557 -6.657 1.00 0.00 C ATOM 378 O ILE A 24 16.176 2.383 -6.396 1.00 0.00 O ATOM 379 CB ILE A 24 18.821 1.034 -4.977 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.247 0.095 -3.847 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.660 2.456 -4.460 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.747 -0.049 -3.715 1.00 0.00 C ATOM 0 H ILE A 24 18.607 -1.160 -6.148 1.00 0.00 H new ATOM 0 HA ILE A 24 16.747 0.457 -4.838 1.00 0.00 H new ATOM 0 HB ILE A 24 19.600 1.032 -5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.841 0.465 -2.905 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.809 -0.888 -4.018 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.597 2.789 -4.013 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.398 3.116 -5.287 1.00 0.00 H new ATOM 0 HG23 ILE A 24 17.870 2.483 -3.710 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.976 -0.729 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.157 -0.448 -4.643 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.190 0.926 -3.513 1.00 0.00 H new ATOM 394 N LYS A 25 17.649 1.489 -7.842 1.00 0.00 N ATOM 395 CA LYS A 25 17.303 2.398 -8.928 1.00 0.00 C ATOM 396 C LYS A 25 15.870 2.166 -9.397 1.00 0.00 C ATOM 397 O LYS A 25 15.128 3.115 -9.649 1.00 0.00 O ATOM 398 CB LYS A 25 18.270 2.216 -10.100 1.00 0.00 C ATOM 399 CG LYS A 25 19.728 2.405 -9.721 1.00 0.00 C ATOM 400 CD LYS A 25 20.205 3.815 -10.024 1.00 0.00 C ATOM 401 CE LYS A 25 19.454 4.848 -9.198 1.00 0.00 C ATOM 402 NZ LYS A 25 20.212 6.124 -9.081 1.00 0.00 N ATOM 0 H LYS A 25 18.376 0.813 -8.074 1.00 0.00 H new ATOM 0 HA LYS A 25 17.383 3.418 -8.553 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.138 1.218 -10.517 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.013 2.926 -10.886 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.859 2.196 -8.659 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.342 1.687 -10.265 1.00 0.00 H new ATOM 0 HD2 LYS A 25 21.273 3.891 -9.819 1.00 0.00 H new ATOM 0 HD3 LYS A 25 20.068 4.026 -11.084 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.484 5.043 -9.655 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.262 4.447 -8.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.666 6.801 -8.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.127 5.943 -8.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.373 6.520 -10.029 1.00 0.00 H new ATOM 416 N VAL A 26 15.487 0.898 -9.509 1.00 0.00 N ATOM 417 CA VAL A 26 14.142 0.542 -9.945 1.00 0.00 C ATOM 418 C VAL A 26 13.097 1.006 -8.936 1.00 0.00 C ATOM 419 O VAL A 26 12.029 1.491 -9.312 1.00 0.00 O ATOM 420 CB VAL A 26 14.002 -0.978 -10.149 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.686 -1.306 -10.838 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.180 -1.519 -10.945 1.00 0.00 C ATOM 0 H VAL A 26 16.089 0.101 -9.304 1.00 0.00 H new ATOM 0 HA VAL A 26 13.974 1.046 -10.897 1.00 0.00 H new ATOM 0 HB VAL A 26 14.002 -1.460 -9.171 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.605 -2.385 -10.973 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.857 -0.954 -10.225 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.652 -0.815 -11.810 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.065 -2.594 -11.080 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.214 -1.033 -11.920 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.106 -1.318 -10.406 1.00 0.00 H new ATOM 432 N PHE A 27 13.411 0.855 -7.654 1.00 0.00 N ATOM 433 CA PHE A 27 12.499 1.259 -6.590 1.00 0.00 C ATOM 434 C PHE A 27 12.370 2.778 -6.532 1.00 0.00 C ATOM 435 O PHE A 27 11.276 3.312 -6.350 1.00 0.00 O ATOM 436 CB PHE A 27 12.986 0.725 -5.242 1.00 0.00 C ATOM 437 CG PHE A 27 12.413 -0.617 -4.886 1.00 0.00 C ATOM 438 CD1 PHE A 27 11.042 -0.805 -4.825 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.246 -1.690 -4.612 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.511 -2.039 -4.498 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.721 -2.926 -4.285 1.00 0.00 C ATOM 442 CZ PHE A 27 11.352 -3.101 -4.227 1.00 0.00 C ATOM 0 H PHE A 27 14.290 0.456 -7.326 1.00 0.00 H new ATOM 0 HA PHE A 27 11.518 0.837 -6.807 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.074 0.654 -5.260 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.727 1.440 -4.462 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.380 0.022 -5.035 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.317 -1.559 -4.654 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.440 -2.173 -4.454 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.381 -3.755 -4.075 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.940 -4.066 -3.970 1.00 0.00 H new ATOM 452 N ALA A 28 13.495 3.468 -6.687 1.00 0.00 N ATOM 453 CA ALA A 28 13.509 4.925 -6.653 1.00 0.00 C ATOM 454 C ALA A 28 12.663 5.508 -7.781 1.00 0.00 C ATOM 455 O ALA A 28 11.875 6.427 -7.565 1.00 0.00 O ATOM 456 CB ALA A 28 14.937 5.442 -6.741 1.00 0.00 C ATOM 0 H ALA A 28 14.409 3.041 -6.837 1.00 0.00 H new ATOM 0 HA ALA A 28 13.076 5.246 -5.705 1.00 0.00 H new ATOM 0 HB1 ALA A 28 14.932 6.532 -6.714 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.514 5.061 -5.898 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.390 5.104 -7.673 1.00 0.00 H new ATOM 462 N GLU A 29 12.835 4.967 -8.983 1.00 0.00 N ATOM 463 CA GLU A 29 12.088 5.436 -10.145 1.00 0.00 C ATOM 464 C GLU A 29 10.612 5.069 -10.027 1.00 0.00 C ATOM 465 O GLU A 29 9.760 5.645 -10.705 1.00 0.00 O ATOM 466 CB GLU A 29 12.672 4.842 -11.428 1.00 0.00 C ATOM 467 CG GLU A 29 12.101 3.479 -11.782 1.00 0.00 C ATOM 468 CD GLU A 29 11.025 3.556 -12.847 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.370 3.803 -14.022 1.00 0.00 O ATOM 470 OE2 GLU A 29 9.838 3.370 -12.507 1.00 0.00 O ATOM 0 H GLU A 29 13.484 4.205 -9.178 1.00 0.00 H new ATOM 0 HA GLU A 29 12.172 6.522 -10.185 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.488 5.529 -12.254 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.753 4.757 -11.320 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.906 2.831 -12.130 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.687 3.019 -10.885 1.00 0.00 H new ATOM 477 N LEU A 30 10.315 4.105 -9.161 1.00 0.00 N ATOM 478 CA LEU A 30 8.942 3.659 -8.954 1.00 0.00 C ATOM 479 C LEU A 30 8.282 4.438 -7.821 1.00 0.00 C ATOM 480 O LEU A 30 7.124 4.197 -7.480 1.00 0.00 O ATOM 481 CB LEU A 30 8.913 2.162 -8.642 1.00 0.00 C ATOM 482 CG LEU A 30 8.833 1.227 -9.849 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.583 -0.067 -9.573 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.382 0.938 -10.205 1.00 0.00 C ATOM 0 H LEU A 30 11.007 3.618 -8.591 1.00 0.00 H new ATOM 0 HA LEU A 30 8.384 3.844 -9.872 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.808 1.912 -8.073 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.058 1.962 -7.996 1.00 0.00 H new ATOM 0 HG LEU A 30 9.303 1.722 -10.699 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.515 -0.720 -10.443 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.630 0.156 -9.368 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.142 -0.566 -8.710 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.345 0.271 -11.066 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.887 0.464 -9.357 1.00 0.00 H new ATOM 0 HD23 LEU A 30 6.874 1.871 -10.447 1.00 0.00 H new ATOM 496 N GLY A 31 9.026 5.377 -7.242 1.00 0.00 N ATOM 497 CA GLY A 31 8.495 6.179 -6.156 1.00 0.00 C ATOM 498 C GLY A 31 8.702 5.530 -4.802 1.00 0.00 C ATOM 499 O GLY A 31 8.174 6.000 -3.793 1.00 0.00 O ATOM 0 H GLY A 31 9.987 5.596 -7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 31 8.974 7.158 -6.163 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.430 6.344 -6.317 1.00 0.00 H new ATOM 503 N TYR A 32 9.471 4.448 -4.778 1.00 0.00 N ATOM 504 CA TYR A 32 9.744 3.731 -3.537 1.00 0.00 C ATOM 505 C TYR A 32 11.050 4.207 -2.909 1.00 0.00 C ATOM 506 O TYR A 32 11.769 3.430 -2.282 1.00 0.00 O ATOM 507 CB TYR A 32 9.809 2.225 -3.798 1.00 0.00 C ATOM 508 CG TYR A 32 8.478 1.618 -4.179 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.901 1.882 -5.415 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.797 0.781 -3.304 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.684 1.331 -5.768 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.581 0.224 -3.649 1.00 0.00 C ATOM 513 CZ TYR A 32 6.029 0.502 -4.882 1.00 0.00 C ATOM 514 OH TYR A 32 4.817 -0.050 -5.229 1.00 0.00 O ATOM 0 H TYR A 32 9.917 4.047 -5.603 1.00 0.00 H new ATOM 0 HA TYR A 32 8.931 3.938 -2.841 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.527 2.034 -4.595 1.00 0.00 H new ATOM 0 HB3 TYR A 32 10.184 1.726 -2.904 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.413 2.529 -6.112 1.00 0.00 H new ATOM 0 HD2 TYR A 32 8.226 0.562 -2.337 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.248 1.548 -6.732 1.00 0.00 H new ATOM 0 HE2 TYR A 32 6.065 -0.426 -2.957 1.00 0.00 H new ATOM 0 HH TYR A 32 4.490 -0.610 -4.494 1.00 0.00 H new ATOM 524 N ASN A 33 11.348 5.491 -3.080 1.00 0.00 N ATOM 525 CA ASN A 33 12.567 6.073 -2.530 1.00 0.00 C ATOM 526 C ASN A 33 12.708 5.739 -1.048 1.00 0.00 C ATOM 527 O ASN A 33 11.734 5.376 -0.388 1.00 0.00 O ATOM 528 CB ASN A 33 12.565 7.590 -2.725 1.00 0.00 C ATOM 529 CG ASN A 33 13.887 8.105 -3.261 1.00 0.00 C ATOM 530 OD1 ASN A 33 14.085 8.199 -4.472 1.00 0.00 O ATOM 531 ND2 ASN A 33 14.801 8.442 -2.358 1.00 0.00 N ATOM 0 H ASN A 33 10.762 6.148 -3.595 1.00 0.00 H new ATOM 0 HA ASN A 33 13.417 5.646 -3.063 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.765 7.864 -3.413 1.00 0.00 H new ATOM 0 HB3 ASN A 33 12.348 8.076 -1.774 1.00 0.00 H new ATOM 0 HD21 ASN A 33 15.709 8.795 -2.659 1.00 0.00 H new ATOM 0 HD22 ASN A 33 14.594 8.348 -1.364 1.00 0.00 H new ATOM 538 N ASP A 34 13.925 5.865 -0.532 1.00 0.00 N ATOM 539 CA ASP A 34 14.194 5.579 0.872 1.00 0.00 C ATOM 540 C ASP A 34 14.053 4.088 1.160 1.00 0.00 C ATOM 541 O ASP A 34 13.211 3.677 1.958 1.00 0.00 O ATOM 542 CB ASP A 34 13.245 6.376 1.768 1.00 0.00 C ATOM 543 CG ASP A 34 13.857 6.702 3.116 1.00 0.00 C ATOM 544 OD1 ASP A 34 14.578 7.717 3.211 1.00 0.00 O ATOM 545 OD2 ASP A 34 13.616 5.940 4.077 1.00 0.00 O ATOM 0 H ASP A 34 14.742 6.164 -1.065 1.00 0.00 H new ATOM 0 HA ASP A 34 15.220 5.877 1.087 1.00 0.00 H new ATOM 0 HB2 ASP A 34 12.967 7.302 1.265 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.327 5.807 1.917 1.00 0.00 H new ATOM 550 N ILE A 35 14.882 3.283 0.503 1.00 0.00 N ATOM 551 CA ILE A 35 14.849 1.838 0.689 1.00 0.00 C ATOM 552 C ILE A 35 15.780 1.407 1.817 1.00 0.00 C ATOM 553 O ILE A 35 16.807 2.038 2.063 1.00 0.00 O ATOM 554 CB ILE A 35 15.247 1.095 -0.601 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.107 0.186 -1.064 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.518 0.289 -0.378 1.00 0.00 C ATOM 557 CD1 ILE A 35 13.066 0.899 -1.899 1.00 0.00 C ATOM 0 H ILE A 35 15.584 3.607 -0.162 1.00 0.00 H new ATOM 0 HA ILE A 35 13.823 1.577 0.948 1.00 0.00 H new ATOM 0 HB ILE A 35 15.440 1.831 -1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.523 -0.638 -1.643 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.623 -0.250 -0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.786 -0.230 -1.298 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.328 0.959 -0.090 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.352 -0.441 0.415 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.289 0.193 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.622 1.706 -1.316 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.536 1.312 -2.792 1.00 0.00 H new ATOM 569 N ASN A 36 15.413 0.327 2.499 1.00 0.00 N ATOM 570 CA ASN A 36 16.216 -0.190 3.602 1.00 0.00 C ATOM 571 C ASN A 36 16.608 -1.643 3.355 1.00 0.00 C ATOM 572 O ASN A 36 15.752 -2.498 3.125 1.00 0.00 O ATOM 573 CB ASN A 36 15.446 -0.074 4.919 1.00 0.00 C ATOM 574 CG ASN A 36 15.713 1.238 5.631 1.00 0.00 C ATOM 575 OD1 ASN A 36 15.396 2.311 5.119 1.00 0.00 O ATOM 576 ND2 ASN A 36 16.299 1.157 6.820 1.00 0.00 N ATOM 0 H ASN A 36 14.565 -0.207 2.308 1.00 0.00 H new ATOM 0 HA ASN A 36 17.126 0.407 3.667 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.378 -0.166 4.722 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.722 -0.902 5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.503 2.006 7.347 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.545 0.246 7.206 1.00 0.00 H new ATOM 583 N VAL A 37 17.908 -1.917 3.405 1.00 0.00 N ATOM 584 CA VAL A 37 18.413 -3.267 3.189 1.00 0.00 C ATOM 585 C VAL A 37 18.746 -3.948 4.512 1.00 0.00 C ATOM 586 O VAL A 37 19.358 -3.348 5.396 1.00 0.00 O ATOM 587 CB VAL A 37 19.670 -3.260 2.298 1.00 0.00 C ATOM 588 CG1 VAL A 37 20.826 -2.574 3.010 1.00 0.00 C ATOM 589 CG2 VAL A 37 20.046 -4.678 1.896 1.00 0.00 C ATOM 0 H VAL A 37 18.630 -1.222 3.593 1.00 0.00 H new ATOM 0 HA VAL A 37 17.622 -3.824 2.686 1.00 0.00 H new ATOM 0 HB VAL A 37 19.448 -2.697 1.391 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.705 -2.579 2.365 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.551 -1.545 3.242 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.051 -3.106 3.934 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.936 -4.654 1.267 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.249 -5.268 2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.223 -5.130 1.343 1.00 0.00 H new ATOM 599 N THR A 38 18.339 -5.207 4.642 1.00 0.00 N ATOM 600 CA THR A 38 18.593 -5.970 5.857 1.00 0.00 C ATOM 601 C THR A 38 19.195 -7.333 5.535 1.00 0.00 C ATOM 602 O THR A 38 18.591 -8.137 4.824 1.00 0.00 O ATOM 603 CB THR A 38 17.302 -6.173 6.673 1.00 0.00 C ATOM 604 OG1 THR A 38 16.235 -6.581 5.810 1.00 0.00 O ATOM 605 CG2 THR A 38 16.913 -4.892 7.397 1.00 0.00 C ATOM 0 H THR A 38 17.832 -5.719 3.920 1.00 0.00 H new ATOM 0 HA THR A 38 19.303 -5.393 6.450 1.00 0.00 H new ATOM 0 HB THR A 38 17.486 -6.950 7.415 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.567 -7.245 5.171 1.00 0.00 H new ATOM 0 HG21 THR A 38 15.999 -5.059 7.966 1.00 0.00 H new ATOM 0 HG22 THR A 38 17.715 -4.600 8.075 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.747 -4.098 6.668 1.00 0.00 H new ATOM 613 N TRP A 39 20.388 -7.587 6.061 1.00 0.00 N ATOM 614 CA TRP A 39 21.072 -8.854 5.829 1.00 0.00 C ATOM 615 C TRP A 39 21.038 -9.727 7.079 1.00 0.00 C ATOM 616 O TRP A 39 21.146 -9.228 8.199 1.00 0.00 O ATOM 617 CB TRP A 39 22.520 -8.605 5.405 1.00 0.00 C ATOM 618 CG TRP A 39 23.296 -7.786 6.392 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.472 -6.432 6.374 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.001 -8.270 7.540 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.245 -6.045 7.442 1.00 0.00 N ATOM 622 CE2 TRP A 39 24.582 -7.153 8.173 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.198 -9.537 8.096 1.00 0.00 C ATOM 624 CZ2 TRP A 39 25.345 -7.268 9.332 1.00 0.00 C ATOM 625 CZ3 TRP A 39 24.956 -9.649 9.246 1.00 0.00 C ATOM 626 CH2 TRP A 39 25.521 -8.521 9.855 1.00 0.00 C ATOM 0 H TRP A 39 20.902 -6.932 6.651 1.00 0.00 H new ATOM 0 HA TRP A 39 20.552 -9.379 5.028 1.00 0.00 H new ATOM 0 HB2 TRP A 39 23.020 -9.563 5.266 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.526 -8.099 4.439 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.064 -5.764 5.630 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.523 -5.087 7.656 1.00 0.00 H new ATOM 0 HE3 TRP A 39 23.766 -10.413 7.635 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 25.783 -6.400 9.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.116 -10.624 9.683 1.00 0.00 H new ATOM 0 HH2 TRP A 39 26.107 -8.642 10.754 1.00 0.00 H new ATOM 668 N THR A 43 22.118 -13.757 3.542 1.00 0.00 N ATOM 669 CA THR A 43 21.032 -13.403 2.636 1.00 0.00 C ATOM 670 C THR A 43 20.654 -11.934 2.779 1.00 0.00 C ATOM 671 O THR A 43 20.428 -11.445 3.886 1.00 0.00 O ATOM 672 CB THR A 43 19.784 -14.270 2.890 1.00 0.00 C ATOM 673 OG1 THR A 43 20.167 -15.524 3.465 1.00 0.00 O ATOM 674 CG2 THR A 43 19.021 -14.511 1.597 1.00 0.00 C ATOM 0 HA THR A 43 21.392 -13.585 1.624 1.00 0.00 H new ATOM 0 HB THR A 43 19.133 -13.737 3.583 1.00 0.00 H new ATOM 0 HG1 THR A 43 21.060 -15.443 3.861 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.144 -15.125 1.801 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.705 -13.556 1.177 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.666 -15.025 0.884 1.00 0.00 H new ATOM 682 N VAL A 44 20.585 -11.233 1.652 1.00 0.00 N ATOM 683 CA VAL A 44 20.232 -9.818 1.651 1.00 0.00 C ATOM 684 C VAL A 44 18.815 -9.606 1.131 1.00 0.00 C ATOM 685 O VAL A 44 18.428 -10.164 0.104 1.00 0.00 O ATOM 686 CB VAL A 44 21.211 -8.995 0.793 1.00 0.00 C ATOM 687 CG1 VAL A 44 21.370 -9.621 -0.585 1.00 0.00 C ATOM 688 CG2 VAL A 44 20.740 -7.553 0.681 1.00 0.00 C ATOM 0 H VAL A 44 20.769 -11.622 0.727 1.00 0.00 H new ATOM 0 HA VAL A 44 20.292 -9.476 2.684 1.00 0.00 H new ATOM 0 HB VAL A 44 22.185 -8.998 1.282 1.00 0.00 H new ATOM 0 HG11 VAL A 44 22.065 -9.026 -1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 44 21.757 -10.635 -0.482 1.00 0.00 H new ATOM 0 HG13 VAL A 44 20.402 -9.651 -1.085 1.00 0.00 H new ATOM 0 HG21 VAL A 44 21.444 -6.987 0.071 1.00 0.00 H new ATOM 0 HG22 VAL A 44 19.755 -7.527 0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 44 20.683 -7.110 1.675 1.00 0.00 H new ATOM 698 N THR A 45 18.043 -8.793 1.847 1.00 0.00 N ATOM 699 CA THR A 45 16.668 -8.507 1.458 1.00 0.00 C ATOM 700 C THR A 45 16.389 -7.008 1.488 1.00 0.00 C ATOM 701 O THR A 45 16.642 -6.339 2.490 1.00 0.00 O ATOM 702 CB THR A 45 15.663 -9.223 2.380 1.00 0.00 C ATOM 703 OG1 THR A 45 16.043 -10.593 2.548 1.00 0.00 O ATOM 704 CG2 THR A 45 14.255 -9.148 1.808 1.00 0.00 C ATOM 0 H THR A 45 18.347 -8.322 2.699 1.00 0.00 H new ATOM 0 HA THR A 45 16.544 -8.877 0.440 1.00 0.00 H new ATOM 0 HB THR A 45 15.671 -8.723 3.348 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.400 -11.041 3.137 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.563 -9.660 2.476 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.958 -8.104 1.709 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.234 -9.626 0.829 1.00 0.00 H new ATOM 712 N VAL A 46 15.866 -6.487 0.383 1.00 0.00 N ATOM 713 CA VAL A 46 15.551 -5.067 0.283 1.00 0.00 C ATOM 714 C VAL A 46 14.112 -4.792 0.705 1.00 0.00 C ATOM 715 O VAL A 46 13.198 -5.536 0.350 1.00 0.00 O ATOM 716 CB VAL A 46 15.762 -4.544 -1.151 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.688 -5.088 -2.081 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.773 -3.023 -1.167 1.00 0.00 C ATOM 0 H VAL A 46 15.651 -7.027 -0.455 1.00 0.00 H new ATOM 0 HA VAL A 46 16.231 -4.545 0.956 1.00 0.00 H new ATOM 0 HB VAL A 46 16.730 -4.895 -1.509 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.853 -4.708 -3.089 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.733 -6.177 -2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.707 -4.769 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.923 -2.671 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.821 -2.648 -0.790 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.583 -2.658 -0.535 1.00 0.00 H new ATOM 728 N GLU A 47 13.919 -3.719 1.465 1.00 0.00 N ATOM 729 CA GLU A 47 12.590 -3.346 1.936 1.00 0.00 C ATOM 730 C GLU A 47 12.276 -1.894 1.588 1.00 0.00 C ATOM 731 O GLU A 47 13.055 -0.990 1.888 1.00 0.00 O ATOM 732 CB GLU A 47 12.484 -3.554 3.449 1.00 0.00 C ATOM 733 CG GLU A 47 11.502 -4.643 3.846 1.00 0.00 C ATOM 734 CD GLU A 47 10.687 -4.275 5.072 1.00 0.00 C ATOM 735 OE1 GLU A 47 11.245 -4.318 6.189 1.00 0.00 O ATOM 736 OE2 GLU A 47 9.494 -3.944 4.914 1.00 0.00 O ATOM 0 H GLU A 47 14.665 -3.093 1.768 1.00 0.00 H new ATOM 0 HA GLU A 47 11.863 -3.986 1.436 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.469 -3.804 3.843 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.182 -2.616 3.916 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.828 -4.841 3.012 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.048 -5.566 4.041 1.00 0.00 H new ATOM 743 N GLY A 48 11.129 -1.679 0.952 1.00 0.00 N ATOM 744 CA GLY A 48 10.732 -0.335 0.572 1.00 0.00 C ATOM 745 C GLY A 48 9.327 0.005 1.028 1.00 0.00 C ATOM 746 O GLY A 48 8.595 -0.863 1.504 1.00 0.00 O ATOM 0 H GLY A 48 10.467 -2.411 0.693 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.433 0.382 0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.793 -0.234 -0.512 1.00 0.00 H new ATOM 750 N GLN A 49 8.951 1.272 0.886 1.00 0.00 N ATOM 751 CA GLN A 49 7.625 1.725 1.290 1.00 0.00 C ATOM 752 C GLN A 49 7.018 2.641 0.234 1.00 0.00 C ATOM 753 O GLN A 49 7.731 3.379 -0.448 1.00 0.00 O ATOM 754 CB GLN A 49 7.700 2.454 2.633 1.00 0.00 C ATOM 755 CG GLN A 49 8.290 3.851 2.535 1.00 0.00 C ATOM 756 CD GLN A 49 9.407 4.085 3.532 1.00 0.00 C ATOM 757 OE1 GLN A 49 10.515 4.645 3.060 1.00 0.00 O flip ATOM 758 NE2 GLN A 49 9.277 3.765 4.714 1.00 0.00 N flip ATOM 0 H GLN A 49 9.545 2.003 0.494 1.00 0.00 H new ATOM 0 HA GLN A 49 6.985 0.849 1.395 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.698 2.521 3.057 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.300 1.863 3.325 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.670 4.011 1.526 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.502 4.586 2.699 1.00 0.00 H new ATOM 0 HE21 GLN A 49 8.408 3.337 5.034 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.038 3.928 5.373 1.00 0.00 H new ATOM 767 N LEU A 50 5.697 2.591 0.103 1.00 0.00 N ATOM 768 CA LEU A 50 4.992 3.416 -0.871 1.00 0.00 C ATOM 769 C LEU A 50 3.802 4.121 -0.228 1.00 0.00 C ATOM 770 O LEU A 50 3.059 3.522 0.548 1.00 0.00 O ATOM 771 CB LEU A 50 4.518 2.560 -2.047 1.00 0.00 C ATOM 772 CG LEU A 50 4.546 3.231 -3.421 1.00 0.00 C ATOM 773 CD1 LEU A 50 3.524 4.356 -3.487 1.00 0.00 C ATOM 774 CD2 LEU A 50 5.941 3.758 -3.728 1.00 0.00 C ATOM 0 H LEU A 50 5.092 1.987 0.660 1.00 0.00 H new ATOM 0 HA LEU A 50 5.685 4.173 -1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.136 1.663 -2.090 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.498 2.234 -1.845 1.00 0.00 H new ATOM 0 HG LEU A 50 4.286 2.486 -4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.559 4.822 -4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.527 3.952 -3.311 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.753 5.101 -2.725 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.943 4.232 -4.709 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.229 4.488 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.651 2.931 -3.723 1.00 0.00 H new ATOM 910 N ARG B 3 24.264 -19.766 -9.521 1.00 0.00 N ATOM 911 CA ARG B 3 22.836 -19.617 -9.771 1.00 0.00 C ATOM 912 C ARG B 3 22.257 -18.467 -8.953 1.00 0.00 C ATOM 913 O ARG B 3 22.457 -18.390 -7.741 1.00 0.00 O ATOM 914 CB ARG B 3 22.100 -20.916 -9.436 1.00 0.00 C ATOM 915 CG ARG B 3 20.586 -20.781 -9.455 1.00 0.00 C ATOM 916 CD ARG B 3 20.029 -20.555 -8.058 1.00 0.00 C ATOM 917 NE ARG B 3 20.281 -21.693 -7.178 1.00 0.00 N ATOM 918 CZ ARG B 3 20.191 -21.632 -5.854 1.00 0.00 C ATOM 919 NH1 ARG B 3 19.855 -20.495 -5.261 1.00 0.00 N ATOM 920 NH2 ARG B 3 20.435 -22.711 -5.121 1.00 0.00 N ATOM 0 HA ARG B 3 22.700 -19.392 -10.829 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.397 -21.686 -10.149 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.413 -21.257 -8.449 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.302 -19.950 -10.100 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.145 -21.681 -9.883 1.00 0.00 H new ATOM 0 HD2 ARG B 3 20.478 -19.659 -7.629 1.00 0.00 H new ATOM 0 HD3 ARG B 3 18.956 -20.375 -8.120 1.00 0.00 H new ATOM 0 HE ARG B 3 20.540 -22.583 -7.603 1.00 0.00 H new ATOM 0 HH11 ARG B 3 19.665 -19.664 -5.821 1.00 0.00 H new ATOM 0 HH12 ARG B 3 19.787 -20.451 -4.244 1.00 0.00 H new ATOM 0 HH21 ARG B 3 20.692 -23.588 -5.574 1.00 0.00 H new ATOM 0 HH22 ARG B 3 20.366 -22.663 -4.104 1.00 0.00 H new ATOM 934 N VAL B 4 21.538 -17.572 -9.625 1.00 0.00 N ATOM 935 CA VAL B 4 20.930 -16.426 -8.961 1.00 0.00 C ATOM 936 C VAL B 4 19.417 -16.585 -8.865 1.00 0.00 C ATOM 937 O VAL B 4 18.740 -16.794 -9.872 1.00 0.00 O ATOM 938 CB VAL B 4 21.251 -15.113 -9.701 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.621 -13.929 -8.985 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.756 -14.930 -9.830 1.00 0.00 C ATOM 0 H VAL B 4 21.363 -17.619 -10.629 1.00 0.00 H new ATOM 0 HA VAL B 4 21.352 -16.382 -7.957 1.00 0.00 H new ATOM 0 HB VAL B 4 20.827 -15.167 -10.704 1.00 0.00 H new ATOM 0 HG11 VAL B 4 20.858 -13.011 -9.522 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.539 -14.059 -8.949 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.013 -13.867 -7.970 1.00 0.00 H new ATOM 0 HG21 VAL B 4 22.966 -13.998 -10.355 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.205 -14.896 -8.837 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.177 -15.765 -10.390 1.00 0.00 H new ATOM 950 N ARG B 5 18.893 -16.484 -7.648 1.00 0.00 N ATOM 951 CA ARG B 5 17.459 -16.618 -7.421 1.00 0.00 C ATOM 952 C ARG B 5 16.933 -15.462 -6.574 1.00 0.00 C ATOM 953 O ARG B 5 17.391 -15.243 -5.453 1.00 0.00 O ATOM 954 CB ARG B 5 17.152 -17.949 -6.732 1.00 0.00 C ATOM 955 CG ARG B 5 15.672 -18.172 -6.470 1.00 0.00 C ATOM 956 CD ARG B 5 15.450 -19.105 -5.289 1.00 0.00 C ATOM 957 NE ARG B 5 14.376 -20.061 -5.542 1.00 0.00 N ATOM 958 CZ ARG B 5 14.535 -21.177 -6.246 1.00 0.00 C ATOM 959 NH1 ARG B 5 15.719 -21.474 -6.763 1.00 0.00 N ATOM 960 NH2 ARG B 5 13.510 -21.998 -6.432 1.00 0.00 N ATOM 0 H ARG B 5 19.439 -16.310 -6.805 1.00 0.00 H new ATOM 0 HA ARG B 5 16.959 -16.594 -8.389 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.530 -18.764 -7.350 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.690 -17.991 -5.785 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.188 -17.215 -6.275 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.203 -18.592 -7.360 1.00 0.00 H new ATOM 0 HD2 ARG B 5 16.373 -19.644 -5.075 1.00 0.00 H new ATOM 0 HD3 ARG B 5 15.211 -18.517 -4.403 1.00 0.00 H new ATOM 0 HE ARG B 5 13.453 -19.861 -5.157 1.00 0.00 H new ATOM 0 HH11 ARG B 5 16.510 -20.846 -6.621 1.00 0.00 H new ATOM 0 HH12 ARG B 5 15.839 -22.331 -7.303 1.00 0.00 H new ATOM 0 HH21 ARG B 5 12.598 -21.773 -6.034 1.00 0.00 H new ATOM 0 HH22 ARG B 5 13.634 -22.854 -6.973 1.00 0.00 H new ATOM 974 N ILE B 6 15.969 -14.727 -7.120 1.00 0.00 N ATOM 975 CA ILE B 6 15.381 -13.595 -6.415 1.00 0.00 C ATOM 976 C ILE B 6 13.884 -13.795 -6.206 1.00 0.00 C ATOM 977 O ILE B 6 13.140 -14.030 -7.159 1.00 0.00 O ATOM 978 CB ILE B 6 15.610 -12.277 -7.177 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.105 -12.056 -7.419 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.015 -11.109 -6.405 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.407 -10.834 -8.259 1.00 0.00 C ATOM 0 H ILE B 6 15.579 -14.895 -8.047 1.00 0.00 H new ATOM 0 HA ILE B 6 15.876 -13.535 -5.446 1.00 0.00 H new ATOM 0 HB ILE B 6 15.110 -12.341 -8.143 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.610 -11.960 -6.458 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.519 -12.936 -7.910 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.185 -10.184 -6.956 1.00 0.00 H new ATOM 0 HG22 ILE B 6 13.944 -11.264 -6.279 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.490 -11.040 -5.426 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.485 -10.740 -8.390 1.00 0.00 H new ATOM 0 HD12 ILE B 6 16.931 -10.936 -9.234 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.023 -9.945 -7.759 1.00 0.00 H new ATOM 993 N SER B 7 13.448 -13.699 -4.954 1.00 0.00 N ATOM 994 CA SER B 7 12.039 -13.871 -4.620 1.00 0.00 C ATOM 995 C SER B 7 11.429 -12.557 -4.142 1.00 0.00 C ATOM 996 O SER B 7 11.936 -11.927 -3.214 1.00 0.00 O ATOM 997 CB SER B 7 11.876 -14.944 -3.542 1.00 0.00 C ATOM 998 OG SER B 7 13.047 -15.735 -3.428 1.00 0.00 O ATOM 0 H SER B 7 14.050 -13.503 -4.154 1.00 0.00 H new ATOM 0 HA SER B 7 11.514 -14.188 -5.521 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.658 -14.471 -2.584 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.025 -15.581 -3.784 1.00 0.00 H new ATOM 0 HG SER B 7 12.918 -16.412 -2.731 1.00 0.00 H new ATOM 1004 N ILE B 8 10.339 -12.150 -4.783 1.00 0.00 N ATOM 1005 CA ILE B 8 9.659 -10.912 -4.423 1.00 0.00 C ATOM 1006 C ILE B 8 8.302 -11.194 -3.788 1.00 0.00 C ATOM 1007 O ILE B 8 7.538 -12.030 -4.273 1.00 0.00 O ATOM 1008 CB ILE B 8 9.460 -10.002 -5.650 1.00 0.00 C ATOM 1009 CG1 ILE B 8 8.454 -10.627 -6.618 1.00 0.00 C ATOM 1010 CG2 ILE B 8 10.790 -9.753 -6.346 1.00 0.00 C ATOM 1011 CD1 ILE B 8 8.348 -9.893 -7.936 1.00 0.00 C ATOM 0 H ILE B 8 9.908 -12.659 -5.554 1.00 0.00 H new ATOM 0 HA ILE B 8 10.296 -10.401 -3.701 1.00 0.00 H new ATOM 0 HB ILE B 8 9.064 -9.044 -5.313 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.740 -11.661 -6.809 1.00 0.00 H new ATOM 0 HG13 ILE B 8 7.473 -10.650 -6.144 1.00 0.00 H new ATOM 0 HG21 ILE B 8 10.633 -9.108 -7.211 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.478 -9.269 -5.653 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.213 -10.703 -6.673 1.00 0.00 H new ATOM 0 HD11 ILE B 8 7.617 -10.392 -8.572 1.00 0.00 H new ATOM 0 HD12 ILE B 8 8.032 -8.866 -7.756 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.319 -9.892 -8.431 1.00 0.00 H new ATOM 1023 N THR B 9 8.006 -10.491 -2.700 1.00 0.00 N ATOM 1024 CA THR B 9 6.740 -10.664 -1.998 1.00 0.00 C ATOM 1025 C THR B 9 5.868 -9.421 -2.122 1.00 0.00 C ATOM 1026 O THR B 9 6.012 -8.471 -1.353 1.00 0.00 O ATOM 1027 CB THR B 9 6.963 -10.975 -0.506 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.243 -11.589 -0.320 1.00 0.00 O ATOM 1029 CG2 THR B 9 5.873 -11.893 0.024 1.00 0.00 C ATOM 0 H THR B 9 8.626 -9.796 -2.285 1.00 0.00 H new ATOM 0 HA THR B 9 6.232 -11.508 -2.465 1.00 0.00 H new ATOM 0 HB THR B 9 6.927 -10.037 0.048 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.378 -11.782 0.631 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.052 -12.099 1.079 1.00 0.00 H new ATOM 0 HG22 THR B 9 4.903 -11.411 -0.092 1.00 0.00 H new ATOM 0 HG23 THR B 9 5.882 -12.829 -0.535 1.00 0.00 H new ATOM 1037 N ALA B 10 4.961 -9.433 -3.093 1.00 0.00 N ATOM 1038 CA ALA B 10 4.063 -8.307 -3.315 1.00 0.00 C ATOM 1039 C ALA B 10 2.670 -8.599 -2.768 1.00 0.00 C ATOM 1040 O ALA B 10 2.360 -9.735 -2.407 1.00 0.00 O ATOM 1041 CB ALA B 10 3.990 -7.974 -4.798 1.00 0.00 C ATOM 0 H ALA B 10 4.829 -10.211 -3.739 1.00 0.00 H new ATOM 0 HA ALA B 10 4.462 -7.446 -2.779 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.316 -7.131 -4.949 1.00 0.00 H new ATOM 0 HB2 ALA B 10 4.984 -7.713 -5.162 1.00 0.00 H new ATOM 0 HB3 ALA B 10 3.618 -8.839 -5.347 1.00 0.00 H new ATOM 1047 N ARG B 11 1.835 -7.567 -2.707 1.00 0.00 N ATOM 1048 CA ARG B 11 0.475 -7.713 -2.201 1.00 0.00 C ATOM 1049 C ARG B 11 -0.398 -8.469 -3.199 1.00 0.00 C ATOM 1050 O ARG B 11 -1.239 -9.282 -2.814 1.00 0.00 O ATOM 1051 CB ARG B 11 -0.134 -6.341 -1.911 1.00 0.00 C ATOM 1052 CG ARG B 11 -0.258 -5.457 -3.141 1.00 0.00 C ATOM 1053 CD ARG B 11 -0.825 -4.090 -2.791 1.00 0.00 C ATOM 1054 NE ARG B 11 -2.280 -4.118 -2.664 1.00 0.00 N ATOM 1055 CZ ARG B 11 -3.001 -3.085 -2.241 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -2.404 -1.949 -1.907 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -4.321 -3.187 -2.153 1.00 0.00 N ATOM 0 H ARG B 11 2.076 -6.621 -3.002 1.00 0.00 H new ATOM 0 HA ARG B 11 0.518 -8.286 -1.275 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -1.122 -6.477 -1.471 1.00 0.00 H new ATOM 0 HB3 ARG B 11 0.479 -5.831 -1.168 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.721 -5.338 -3.605 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.902 -5.942 -3.875 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -0.386 -3.744 -1.855 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -0.542 -3.372 -3.561 1.00 0.00 H new ATOM 0 HE ARG B 11 -2.769 -4.977 -2.914 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -1.390 -1.867 -1.975 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -2.959 -1.157 -1.583 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -4.783 -4.059 -2.410 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -4.873 -2.393 -1.828 1.00 0.00 H new ATOM 1071 N THR B 12 -0.193 -8.194 -4.483 1.00 0.00 N ATOM 1072 CA THR B 12 -0.962 -8.845 -5.536 1.00 0.00 C ATOM 1073 C THR B 12 -0.054 -9.326 -6.663 1.00 0.00 C ATOM 1074 O THR B 12 1.063 -8.836 -6.826 1.00 0.00 O ATOM 1075 CB THR B 12 -2.029 -7.900 -6.120 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.608 -8.480 -7.294 1.00 0.00 O ATOM 1077 CG2 THR B 12 -1.423 -6.547 -6.463 1.00 0.00 C ATOM 0 H THR B 12 0.499 -7.525 -4.819 1.00 0.00 H new ATOM 0 HA THR B 12 -1.457 -9.702 -5.081 1.00 0.00 H new ATOM 0 HB THR B 12 -2.804 -7.754 -5.368 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.286 -7.874 -7.658 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.195 -5.896 -6.874 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.009 -6.095 -5.562 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.630 -6.679 -7.199 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.541 -10.288 -7.439 1.00 0.00 N ATOM 1086 CA LYS B 13 0.225 -10.834 -8.553 1.00 0.00 C ATOM 1087 C LYS B 13 0.601 -9.738 -9.545 1.00 0.00 C ATOM 1088 O LYS B 13 1.710 -9.723 -10.079 1.00 0.00 O ATOM 1089 CB LYS B 13 -0.578 -11.926 -9.264 1.00 0.00 C ATOM 1090 CG LYS B 13 -1.948 -11.467 -9.732 1.00 0.00 C ATOM 1091 CD LYS B 13 -2.894 -12.640 -9.922 1.00 0.00 C ATOM 1092 CE LYS B 13 -2.548 -13.440 -11.169 1.00 0.00 C ATOM 1093 NZ LYS B 13 -2.402 -14.892 -10.873 1.00 0.00 N ATOM 0 H LYS B 13 -1.463 -10.706 -7.317 1.00 0.00 H new ATOM 0 HA LYS B 13 1.142 -11.267 -8.153 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -0.010 -12.281 -10.124 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -0.699 -12.774 -8.589 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.369 -10.773 -9.004 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -1.849 -10.922 -10.671 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -2.850 -13.290 -9.048 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -3.918 -12.274 -9.996 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -3.326 -13.299 -11.919 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -1.620 -13.062 -11.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -2.166 -15.403 -11.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -1.642 -15.030 -10.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -3.295 -15.259 -10.488 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.330 -8.820 -9.786 1.00 0.00 N ATOM 1108 CA LYS B 14 -0.096 -7.718 -10.711 1.00 0.00 C ATOM 1109 C LYS B 14 1.110 -6.891 -10.278 1.00 0.00 C ATOM 1110 O LYS B 14 1.894 -6.438 -11.112 1.00 0.00 O ATOM 1111 CB LYS B 14 -1.336 -6.825 -10.796 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.213 -7.116 -12.002 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.738 -8.542 -11.978 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.135 -9.376 -13.098 1.00 0.00 C ATOM 1115 NZ LYS B 14 -2.574 -8.903 -14.440 1.00 0.00 N ATOM 0 H LYS B 14 -1.254 -8.818 -9.353 1.00 0.00 H new ATOM 0 HA LYS B 14 0.109 -8.140 -11.695 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.927 -6.951 -9.889 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -1.021 -5.782 -10.829 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -3.051 -6.419 -12.021 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -1.642 -6.953 -12.916 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -2.506 -9.000 -11.016 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -3.824 -8.533 -12.074 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.048 -9.335 -13.036 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -2.422 -10.419 -12.969 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -2.437 -9.662 -15.138 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -3.580 -8.643 -14.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -2.012 -8.073 -14.717 1.00 0.00 H new ATOM 1129 N GLU B 15 1.253 -6.699 -8.970 1.00 0.00 N ATOM 1130 CA GLU B 15 2.365 -5.927 -8.429 1.00 0.00 C ATOM 1131 C GLU B 15 3.691 -6.646 -8.661 1.00 0.00 C ATOM 1132 O GLU B 15 4.638 -6.066 -9.191 1.00 0.00 O ATOM 1133 CB GLU B 15 2.162 -5.680 -6.932 1.00 0.00 C ATOM 1134 CG GLU B 15 1.369 -4.421 -6.625 1.00 0.00 C ATOM 1135 CD GLU B 15 2.255 -3.208 -6.420 1.00 0.00 C ATOM 1136 OE1 GLU B 15 3.259 -3.077 -7.152 1.00 0.00 O ATOM 1137 OE2 GLU B 15 1.947 -2.391 -5.527 1.00 0.00 O ATOM 0 H GLU B 15 0.613 -7.067 -8.266 1.00 0.00 H new ATOM 0 HA GLU B 15 2.395 -4.969 -8.948 1.00 0.00 H new ATOM 0 HB2 GLU B 15 1.649 -6.538 -6.497 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.136 -5.613 -6.448 1.00 0.00 H new ATOM 0 HG2 GLU B 15 0.675 -4.225 -7.442 1.00 0.00 H new ATOM 0 HG3 GLU B 15 0.769 -4.583 -5.730 1.00 0.00 H new ATOM 1144 N ALA B 16 3.749 -7.912 -8.261 1.00 0.00 N ATOM 1145 CA ALA B 16 4.957 -8.710 -8.427 1.00 0.00 C ATOM 1146 C ALA B 16 5.338 -8.831 -9.899 1.00 0.00 C ATOM 1147 O ALA B 16 6.514 -8.760 -10.252 1.00 0.00 O ATOM 1148 CB ALA B 16 4.766 -10.090 -7.815 1.00 0.00 C ATOM 0 H ALA B 16 2.974 -8.407 -7.820 1.00 0.00 H new ATOM 0 HA ALA B 16 5.771 -8.203 -7.908 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.676 -10.675 -7.946 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.549 -9.990 -6.751 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.936 -10.595 -8.308 1.00 0.00 H new ATOM 1154 N GLU B 17 4.335 -9.013 -10.752 1.00 0.00 N ATOM 1155 CA GLU B 17 4.567 -9.145 -12.186 1.00 0.00 C ATOM 1156 C GLU B 17 5.288 -7.918 -12.735 1.00 0.00 C ATOM 1157 O GLU B 17 6.176 -8.032 -13.581 1.00 0.00 O ATOM 1158 CB GLU B 17 3.241 -9.343 -12.923 1.00 0.00 C ATOM 1159 CG GLU B 17 2.788 -10.792 -12.981 1.00 0.00 C ATOM 1160 CD GLU B 17 2.994 -11.413 -14.349 1.00 0.00 C ATOM 1161 OE1 GLU B 17 4.023 -11.110 -14.989 1.00 0.00 O ATOM 1162 OE2 GLU B 17 2.127 -12.202 -14.780 1.00 0.00 O ATOM 0 H GLU B 17 3.355 -9.072 -10.476 1.00 0.00 H new ATOM 0 HA GLU B 17 5.198 -10.019 -12.347 1.00 0.00 H new ATOM 0 HB2 GLU B 17 2.470 -8.749 -12.432 1.00 0.00 H new ATOM 0 HB3 GLU B 17 3.339 -8.961 -13.939 1.00 0.00 H new ATOM 0 HG2 GLU B 17 3.336 -11.370 -12.237 1.00 0.00 H new ATOM 0 HG3 GLU B 17 1.733 -10.850 -12.715 1.00 0.00 H new ATOM 1169 N LYS B 18 4.900 -6.744 -12.249 1.00 0.00 N ATOM 1170 CA LYS B 18 5.509 -5.494 -12.689 1.00 0.00 C ATOM 1171 C LYS B 18 7.002 -5.478 -12.380 1.00 0.00 C ATOM 1172 O LYS B 18 7.793 -4.891 -13.120 1.00 0.00 O ATOM 1173 CB LYS B 18 4.824 -4.304 -12.013 1.00 0.00 C ATOM 1174 CG LYS B 18 3.335 -4.217 -12.296 1.00 0.00 C ATOM 1175 CD LYS B 18 3.019 -3.104 -13.281 1.00 0.00 C ATOM 1176 CE LYS B 18 1.518 -2.918 -13.449 1.00 0.00 C ATOM 1177 NZ LYS B 18 1.182 -2.268 -14.746 1.00 0.00 N ATOM 0 H LYS B 18 4.166 -6.632 -11.550 1.00 0.00 H new ATOM 0 HA LYS B 18 5.379 -5.415 -13.768 1.00 0.00 H new ATOM 0 HB2 LYS B 18 4.977 -4.372 -10.936 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.303 -3.383 -12.346 1.00 0.00 H new ATOM 0 HG2 LYS B 18 2.983 -5.168 -12.695 1.00 0.00 H new ATOM 0 HG3 LYS B 18 2.796 -4.044 -11.365 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.466 -2.172 -12.934 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.469 -3.333 -14.247 1.00 0.00 H new ATOM 0 HE2 LYS B 18 1.023 -3.887 -13.389 1.00 0.00 H new ATOM 0 HE3 LYS B 18 1.133 -2.312 -12.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 0.151 -2.159 -14.823 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 1.634 -1.332 -14.793 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 1.527 -2.858 -15.530 1.00 0.00 H new ATOM 1191 N PHE B 19 7.383 -6.126 -11.285 1.00 0.00 N ATOM 1192 CA PHE B 19 8.782 -6.187 -10.879 1.00 0.00 C ATOM 1193 C PHE B 19 9.537 -7.239 -11.686 1.00 0.00 C ATOM 1194 O PHE B 19 10.690 -7.035 -12.067 1.00 0.00 O ATOM 1195 CB PHE B 19 8.889 -6.500 -9.385 1.00 0.00 C ATOM 1196 CG PHE B 19 8.801 -5.283 -8.510 1.00 0.00 C ATOM 1197 CD1 PHE B 19 7.570 -4.756 -8.154 1.00 0.00 C ATOM 1198 CD2 PHE B 19 9.950 -4.665 -8.043 1.00 0.00 C ATOM 1199 CE1 PHE B 19 7.487 -3.636 -7.349 1.00 0.00 C ATOM 1200 CE2 PHE B 19 9.873 -3.544 -7.237 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.640 -3.030 -6.889 1.00 0.00 C ATOM 0 H PHE B 19 6.742 -6.617 -10.662 1.00 0.00 H new ATOM 0 HA PHE B 19 9.233 -5.214 -11.072 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.095 -7.194 -9.110 1.00 0.00 H new ATOM 0 HB3 PHE B 19 9.835 -7.007 -9.195 1.00 0.00 H new ATOM 0 HD1 PHE B 19 6.665 -5.226 -8.510 1.00 0.00 H new ATOM 0 HD2 PHE B 19 10.917 -5.064 -8.312 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.521 -3.235 -7.080 1.00 0.00 H new ATOM 0 HE2 PHE B 19 10.776 -3.071 -6.880 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.577 -2.156 -6.258 1.00 0.00 H new ATOM 1211 N ALA B 20 8.879 -8.364 -11.942 1.00 0.00 N ATOM 1212 CA ALA B 20 9.486 -9.448 -12.705 1.00 0.00 C ATOM 1213 C ALA B 20 9.976 -8.957 -14.063 1.00 0.00 C ATOM 1214 O ALA B 20 11.064 -9.319 -14.509 1.00 0.00 O ATOM 1215 CB ALA B 20 8.496 -10.590 -12.880 1.00 0.00 C ATOM 0 H ALA B 20 7.925 -8.549 -11.632 1.00 0.00 H new ATOM 0 HA ALA B 20 10.349 -9.812 -12.147 1.00 0.00 H new ATOM 0 HB1 ALA B 20 8.963 -11.392 -13.452 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.199 -10.967 -11.901 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.616 -10.230 -13.413 1.00 0.00 H new ATOM 1221 N ALA B 21 9.165 -8.130 -14.715 1.00 0.00 N ATOM 1222 CA ALA B 21 9.517 -7.588 -16.022 1.00 0.00 C ATOM 1223 C ALA B 21 10.882 -6.908 -15.985 1.00 0.00 C ATOM 1224 O ALA B 21 11.707 -7.102 -16.878 1.00 0.00 O ATOM 1225 CB ALA B 21 8.451 -6.611 -16.492 1.00 0.00 C ATOM 0 H ALA B 21 8.260 -7.821 -14.360 1.00 0.00 H new ATOM 0 HA ALA B 21 9.572 -8.416 -16.729 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.727 -6.214 -17.469 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.493 -7.126 -16.567 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.368 -5.792 -15.778 1.00 0.00 H new ATOM 1231 N ILE B 22 11.112 -6.111 -14.947 1.00 0.00 N ATOM 1232 CA ILE B 22 12.377 -5.402 -14.794 1.00 0.00 C ATOM 1233 C ILE B 22 13.519 -6.372 -14.513 1.00 0.00 C ATOM 1234 O ILE B 22 14.569 -6.316 -15.155 1.00 0.00 O ATOM 1235 CB ILE B 22 12.308 -4.365 -13.659 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.202 -3.344 -13.937 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.650 -3.668 -13.495 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.549 -2.803 -12.685 1.00 0.00 C ATOM 0 H ILE B 22 10.439 -5.940 -14.200 1.00 0.00 H new ATOM 0 HA ILE B 22 12.565 -4.885 -15.735 1.00 0.00 H new ATOM 0 HB ILE B 22 12.073 -4.883 -12.729 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.620 -2.514 -14.506 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.440 -3.808 -14.563 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.585 -2.938 -12.688 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.416 -4.405 -13.256 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.912 -3.161 -14.423 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.776 -2.085 -12.959 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.101 -3.624 -12.125 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.299 -2.309 -12.067 1.00 0.00 H new ATOM 1250 N LEU B 23 13.308 -7.263 -13.550 1.00 0.00 N ATOM 1251 CA LEU B 23 14.320 -8.248 -13.184 1.00 0.00 C ATOM 1252 C LEU B 23 14.800 -9.017 -14.410 1.00 0.00 C ATOM 1253 O LEU B 23 15.989 -9.309 -14.546 1.00 0.00 O ATOM 1254 CB LEU B 23 13.760 -9.221 -12.145 1.00 0.00 C ATOM 1255 CG LEU B 23 14.332 -9.096 -10.732 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.823 -9.393 -10.732 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.062 -7.709 -10.168 1.00 0.00 C ATOM 0 H LEU B 23 12.446 -7.324 -13.009 1.00 0.00 H new ATOM 0 HA LEU B 23 15.170 -7.717 -12.755 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.680 -9.083 -12.092 1.00 0.00 H new ATOM 0 HB3 LEU B 23 13.934 -10.238 -12.497 1.00 0.00 H new ATOM 0 HG LEU B 23 13.837 -9.828 -10.094 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.213 -9.299 -9.718 1.00 0.00 H new ATOM 0 HD12 LEU B 23 15.992 -10.407 -11.093 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.335 -8.686 -11.384 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.476 -7.638 -9.162 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.530 -6.959 -10.806 1.00 0.00 H new ATOM 0 HD23 LEU B 23 12.987 -7.534 -10.131 1.00 0.00 H new ATOM 1269 N ILE B 24 13.869 -9.340 -15.302 1.00 0.00 N ATOM 1270 CA ILE B 24 14.198 -10.072 -16.518 1.00 0.00 C ATOM 1271 C ILE B 24 15.188 -9.293 -17.378 1.00 0.00 C ATOM 1272 O ILE B 24 16.137 -9.860 -17.920 1.00 0.00 O ATOM 1273 CB ILE B 24 12.939 -10.375 -17.351 1.00 0.00 C ATOM 1274 CG1 ILE B 24 11.969 -11.247 -16.551 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.319 -11.057 -18.657 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.514 -10.951 -16.838 1.00 0.00 C ATOM 0 H ILE B 24 12.881 -9.106 -15.205 1.00 0.00 H new ATOM 0 HA ILE B 24 14.652 -11.013 -16.207 1.00 0.00 H new ATOM 0 HB ILE B 24 12.442 -9.434 -17.587 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.169 -12.295 -16.772 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.158 -11.104 -15.487 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.418 -11.265 -19.235 1.00 0.00 H new ATOM 0 HG22 ILE B 24 13.976 -10.403 -19.231 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.836 -11.992 -18.442 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.884 -11.606 -16.236 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.298 -9.912 -16.590 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.310 -11.122 -17.895 1.00 0.00 H new ATOM 1288 N LYS B 25 14.961 -7.989 -17.497 1.00 0.00 N ATOM 1289 CA LYS B 25 15.834 -7.129 -18.287 1.00 0.00 C ATOM 1290 C LYS B 25 17.223 -7.043 -17.664 1.00 0.00 C ATOM 1291 O LYS B 25 18.233 -7.091 -18.366 1.00 0.00 O ATOM 1292 CB LYS B 25 15.230 -5.728 -18.408 1.00 0.00 C ATOM 1293 CG LYS B 25 13.829 -5.719 -18.997 1.00 0.00 C ATOM 1294 CD LYS B 25 13.853 -5.427 -20.488 1.00 0.00 C ATOM 1295 CE LYS B 25 14.609 -6.502 -21.254 1.00 0.00 C ATOM 1296 NZ LYS B 25 14.083 -6.672 -22.637 1.00 0.00 N ATOM 0 H LYS B 25 14.179 -7.505 -17.056 1.00 0.00 H new ATOM 0 HA LYS B 25 15.928 -7.565 -19.282 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.203 -5.266 -17.421 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.881 -5.113 -19.030 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.353 -6.684 -18.822 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.224 -4.969 -18.488 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.832 -5.361 -20.863 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.320 -4.458 -20.663 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.666 -6.241 -21.297 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.536 -7.449 -20.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.625 -7.413 -23.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 13.080 -6.946 -22.596 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.176 -5.776 -23.156 1.00 0.00 H new ATOM 1310 N VAL B 26 17.267 -6.917 -16.341 1.00 0.00 N ATOM 1311 CA VAL B 26 18.532 -6.827 -15.623 1.00 0.00 C ATOM 1312 C VAL B 26 19.339 -8.113 -15.769 1.00 0.00 C ATOM 1313 O VAL B 26 20.558 -8.077 -15.939 1.00 0.00 O ATOM 1314 CB VAL B 26 18.309 -6.541 -14.126 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.627 -6.202 -13.445 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.301 -5.416 -13.944 1.00 0.00 C ATOM 0 H VAL B 26 16.440 -6.875 -15.745 1.00 0.00 H new ATOM 0 HA VAL B 26 19.088 -6.000 -16.064 1.00 0.00 H new ATOM 0 HB VAL B 26 17.906 -7.439 -13.658 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.450 -6.003 -12.388 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.315 -7.041 -13.546 1.00 0.00 H new ATOM 0 HG13 VAL B 26 20.062 -5.318 -13.913 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.155 -5.227 -12.881 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.674 -4.512 -14.426 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.351 -5.702 -14.395 1.00 0.00 H new ATOM 1326 N PHE B 27 18.651 -9.248 -15.701 1.00 0.00 N ATOM 1327 CA PHE B 27 19.304 -10.546 -15.824 1.00 0.00 C ATOM 1328 C PHE B 27 19.794 -10.774 -17.251 1.00 0.00 C ATOM 1329 O PHE B 27 20.899 -11.272 -17.467 1.00 0.00 O ATOM 1330 CB PHE B 27 18.342 -11.664 -15.418 1.00 0.00 C ATOM 1331 CG PHE B 27 18.407 -12.010 -13.958 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.597 -12.424 -13.383 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.277 -11.919 -13.160 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.659 -12.743 -12.039 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.333 -12.237 -11.816 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.526 -12.648 -11.255 1.00 0.00 C ATOM 0 H PHE B 27 17.642 -9.295 -15.561 1.00 0.00 H new ATOM 0 HA PHE B 27 20.166 -10.557 -15.156 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.324 -11.365 -15.667 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.565 -12.555 -16.005 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.486 -12.499 -13.991 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.342 -11.596 -13.594 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.593 -13.066 -11.603 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.445 -12.164 -11.206 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.573 -12.895 -10.205 1.00 0.00 H new ATOM 1346 N ALA B 28 18.963 -10.408 -18.222 1.00 0.00 N ATOM 1347 CA ALA B 28 19.312 -10.571 -19.628 1.00 0.00 C ATOM 1348 C ALA B 28 20.536 -9.737 -19.990 1.00 0.00 C ATOM 1349 O ALA B 28 21.448 -10.217 -20.663 1.00 0.00 O ATOM 1350 CB ALA B 28 18.133 -10.192 -20.511 1.00 0.00 C ATOM 0 H ALA B 28 18.044 -9.997 -18.060 1.00 0.00 H new ATOM 0 HA ALA B 28 19.557 -11.620 -19.797 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.407 -10.318 -21.558 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.283 -10.834 -20.279 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.862 -9.152 -20.330 1.00 0.00 H new ATOM 1356 N GLU B 29 20.549 -8.486 -19.540 1.00 0.00 N ATOM 1357 CA GLU B 29 21.662 -7.586 -19.820 1.00 0.00 C ATOM 1358 C GLU B 29 22.920 -8.031 -19.080 1.00 0.00 C ATOM 1359 O GLU B 29 24.032 -7.633 -19.429 1.00 0.00 O ATOM 1360 CB GLU B 29 21.301 -6.154 -19.420 1.00 0.00 C ATOM 1361 CG GLU B 29 21.578 -5.842 -17.959 1.00 0.00 C ATOM 1362 CD GLU B 29 22.874 -5.081 -17.760 1.00 0.00 C ATOM 1363 OE1 GLU B 29 23.019 -3.991 -18.352 1.00 0.00 O ATOM 1364 OE2 GLU B 29 23.743 -5.575 -17.012 1.00 0.00 O ATOM 0 H GLU B 29 19.802 -8.073 -18.981 1.00 0.00 H new ATOM 0 HA GLU B 29 21.861 -7.617 -20.891 1.00 0.00 H new ATOM 0 HB2 GLU B 29 21.863 -5.459 -20.044 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.244 -5.984 -19.625 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.752 -5.258 -17.553 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.617 -6.773 -17.394 1.00 0.00 H new ATOM 1371 N LEU B 30 22.736 -8.857 -18.056 1.00 0.00 N ATOM 1372 CA LEU B 30 23.856 -9.356 -17.266 1.00 0.00 C ATOM 1373 C LEU B 30 24.373 -10.677 -17.826 1.00 0.00 C ATOM 1374 O LEU B 30 25.342 -11.241 -17.321 1.00 0.00 O ATOM 1375 CB LEU B 30 23.435 -9.538 -15.806 1.00 0.00 C ATOM 1376 CG LEU B 30 23.526 -8.295 -14.921 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.497 -8.359 -13.803 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.929 -8.148 -14.350 1.00 0.00 C ATOM 0 H LEU B 30 21.822 -9.195 -17.753 1.00 0.00 H new ATOM 0 HA LEU B 30 24.660 -8.622 -17.318 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.406 -9.898 -15.788 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.054 -10.319 -15.365 1.00 0.00 H new ATOM 0 HG LEU B 30 23.312 -7.420 -15.534 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.577 -7.466 -13.183 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.497 -8.415 -14.232 1.00 0.00 H new ATOM 0 HD13 LEU B 30 22.679 -9.242 -13.191 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.975 -7.258 -13.723 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.172 -9.026 -13.752 1.00 0.00 H new ATOM 0 HD23 LEU B 30 25.646 -8.054 -15.166 1.00 0.00 H new ATOM 1390 N GLY B 31 23.718 -11.165 -18.876 1.00 0.00 N ATOM 1391 CA GLY B 31 24.127 -12.415 -19.490 1.00 0.00 C ATOM 1392 C GLY B 31 23.476 -13.620 -18.841 1.00 0.00 C ATOM 1393 O GLY B 31 23.890 -14.756 -19.070 1.00 0.00 O ATOM 0 H GLY B 31 22.912 -10.717 -19.312 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.873 -12.396 -20.550 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.211 -12.511 -19.423 1.00 0.00 H new ATOM 1397 N TYR B 32 22.455 -13.372 -18.028 1.00 0.00 N ATOM 1398 CA TYR B 32 21.748 -14.445 -17.340 1.00 0.00 C ATOM 1399 C TYR B 32 20.522 -14.886 -18.134 1.00 0.00 C ATOM 1400 O TYR B 32 19.489 -15.230 -17.561 1.00 0.00 O ATOM 1401 CB TYR B 32 21.327 -13.993 -15.941 1.00 0.00 C ATOM 1402 CG TYR B 32 22.488 -13.817 -14.987 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.425 -12.811 -15.180 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.645 -14.658 -13.892 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.487 -12.648 -14.311 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.703 -14.502 -13.017 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.622 -13.495 -13.232 1.00 0.00 C ATOM 1408 OH TYR B 32 25.677 -13.335 -12.363 1.00 0.00 O ATOM 0 H TYR B 32 22.099 -12.437 -17.830 1.00 0.00 H new ATOM 0 HA TYR B 32 22.426 -15.294 -17.251 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.786 -13.050 -16.020 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.633 -14.724 -15.525 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.322 -12.145 -16.024 1.00 0.00 H new ATOM 0 HD2 TYR B 32 21.928 -15.447 -13.722 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.208 -11.861 -14.476 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.810 -15.164 -12.170 1.00 0.00 H new ATOM 0 HH TYR B 32 25.625 -14.013 -11.657 1.00 0.00 H new ATOM 1418 N ASN B 33 20.646 -14.874 -19.457 1.00 0.00 N ATOM 1419 CA ASN B 33 19.549 -15.273 -20.332 1.00 0.00 C ATOM 1420 C ASN B 33 18.974 -16.619 -19.903 1.00 0.00 C ATOM 1421 O ASN B 33 19.613 -17.375 -19.171 1.00 0.00 O ATOM 1422 CB ASN B 33 20.028 -15.349 -21.783 1.00 0.00 C ATOM 1423 CG ASN B 33 21.434 -15.906 -21.899 1.00 0.00 C ATOM 1424 OD1 ASN B 33 22.428 -15.042 -21.732 1.00 0.00 O flip ATOM 1425 ND2 ASN B 33 21.623 -17.099 -22.137 1.00 0.00 N flip ATOM 0 H ASN B 33 21.495 -14.592 -19.947 1.00 0.00 H new ATOM 0 HA ASN B 33 18.764 -14.521 -20.255 1.00 0.00 H new ATOM 0 HB2 ASN B 33 19.344 -15.974 -22.356 1.00 0.00 H new ATOM 0 HB3 ASN B 33 19.997 -14.353 -22.226 1.00 0.00 H new ATOM 0 HD21 ASN B 33 20.828 -17.727 -22.258 1.00 0.00 H new ATOM 0 HD22 ASN B 33 22.574 -17.459 -22.213 1.00 0.00 H new ATOM 1432 N ASP B 34 17.763 -16.913 -20.365 1.00 0.00 N ATOM 1433 CA ASP B 34 17.101 -18.169 -20.031 1.00 0.00 C ATOM 1434 C ASP B 34 16.667 -18.182 -18.569 1.00 0.00 C ATOM 1435 O ASP B 34 17.102 -19.031 -17.790 1.00 0.00 O ATOM 1436 CB ASP B 34 18.032 -19.350 -20.311 1.00 0.00 C ATOM 1437 CG ASP B 34 17.275 -20.599 -20.719 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.441 -20.511 -21.644 1.00 0.00 O ATOM 1439 OD2 ASP B 34 17.516 -21.664 -20.112 1.00 0.00 O ATOM 0 H ASP B 34 17.220 -16.299 -20.972 1.00 0.00 H new ATOM 0 HA ASP B 34 16.212 -18.261 -20.655 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.732 -19.078 -21.101 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.624 -19.562 -19.420 1.00 0.00 H new ATOM 1444 N ILE B 35 15.808 -17.237 -18.203 1.00 0.00 N ATOM 1445 CA ILE B 35 15.316 -17.141 -16.835 1.00 0.00 C ATOM 1446 C ILE B 35 14.008 -17.907 -16.666 1.00 0.00 C ATOM 1447 O ILE B 35 13.214 -18.013 -17.600 1.00 0.00 O ATOM 1448 CB ILE B 35 15.095 -15.675 -16.418 1.00 0.00 C ATOM 1449 CG1 ILE B 35 15.987 -15.321 -15.225 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.631 -15.434 -16.081 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.379 -14.881 -15.621 1.00 0.00 C ATOM 0 H ILE B 35 15.438 -16.527 -18.835 1.00 0.00 H new ATOM 0 HA ILE B 35 16.079 -17.582 -16.194 1.00 0.00 H new ATOM 0 HB ILE B 35 15.366 -15.031 -17.254 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.513 -14.525 -14.651 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.062 -16.187 -14.568 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.492 -14.393 -15.788 1.00 0.00 H new ATOM 0 HG22 ILE B 35 13.016 -15.651 -16.955 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.335 -16.085 -15.258 1.00 0.00 H new ATOM 0 HD11 ILE B 35 17.955 -14.646 -14.726 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.872 -15.684 -16.169 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.315 -13.996 -16.254 1.00 0.00 H new ATOM 1463 N ASN B 36 13.791 -18.440 -15.468 1.00 0.00 N ATOM 1464 CA ASN B 36 12.579 -19.196 -15.176 1.00 0.00 C ATOM 1465 C ASN B 36 11.898 -18.667 -13.917 1.00 0.00 C ATOM 1466 O ASN B 36 12.525 -18.541 -12.865 1.00 0.00 O ATOM 1467 CB ASN B 36 12.908 -20.681 -15.006 1.00 0.00 C ATOM 1468 CG ASN B 36 12.836 -21.442 -16.315 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.581 -21.158 -17.253 1.00 0.00 O ATOM 1470 ND2 ASN B 36 11.936 -22.416 -16.384 1.00 0.00 N ATOM 0 H ASN B 36 14.439 -18.362 -14.684 1.00 0.00 H new ATOM 0 HA ASN B 36 11.894 -19.076 -16.016 1.00 0.00 H new ATOM 0 HB2 ASN B 36 13.908 -20.783 -14.584 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.214 -21.125 -14.292 1.00 0.00 H new ATOM 0 HD21 ASN B 36 11.842 -22.963 -17.239 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.339 -22.617 -15.582 1.00 0.00 H new ATOM 1477 N VAL B 37 10.610 -18.361 -14.032 1.00 0.00 N ATOM 1478 CA VAL B 37 9.842 -17.847 -12.904 1.00 0.00 C ATOM 1479 C VAL B 37 8.964 -18.935 -12.296 1.00 0.00 C ATOM 1480 O VAL B 37 8.329 -19.709 -13.013 1.00 0.00 O ATOM 1481 CB VAL B 37 8.954 -16.660 -13.323 1.00 0.00 C ATOM 1482 CG1 VAL B 37 7.886 -17.113 -14.306 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.325 -16.009 -12.100 1.00 0.00 C ATOM 0 H VAL B 37 10.076 -18.460 -14.895 1.00 0.00 H new ATOM 0 HA VAL B 37 10.562 -17.507 -12.160 1.00 0.00 H new ATOM 0 HB VAL B 37 9.579 -15.918 -13.820 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.269 -16.261 -14.591 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.362 -17.529 -15.194 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.261 -17.874 -13.839 1.00 0.00 H new ATOM 0 HG21 VAL B 37 7.701 -15.172 -12.414 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.713 -16.741 -11.573 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.110 -15.647 -11.436 1.00 0.00 H new ATOM 1493 N THR B 38 8.932 -18.989 -10.968 1.00 0.00 N ATOM 1494 CA THR B 38 8.132 -19.982 -10.263 1.00 0.00 C ATOM 1495 C THR B 38 7.327 -19.342 -9.138 1.00 0.00 C ATOM 1496 O THR B 38 7.879 -18.647 -8.285 1.00 0.00 O ATOM 1497 CB THR B 38 9.015 -21.099 -9.675 1.00 0.00 C ATOM 1498 OG1 THR B 38 10.061 -20.530 -8.880 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.618 -21.951 -10.782 1.00 0.00 C ATOM 0 H THR B 38 9.451 -18.356 -10.359 1.00 0.00 H new ATOM 0 HA THR B 38 7.449 -20.415 -10.994 1.00 0.00 H new ATOM 0 HB THR B 38 8.389 -21.735 -9.049 1.00 0.00 H new ATOM 0 HG1 THR B 38 9.739 -19.707 -8.456 1.00 0.00 H new ATOM 0 HG21 THR B 38 10.237 -22.733 -10.343 1.00 0.00 H new ATOM 0 HG22 THR B 38 8.819 -22.407 -11.367 1.00 0.00 H new ATOM 0 HG23 THR B 38 10.230 -21.325 -11.431 1.00 0.00 H new ATOM 1576 N VAL B 44 6.225 -15.078 -5.946 1.00 0.00 N ATOM 1577 CA VAL B 44 6.928 -15.327 -7.199 1.00 0.00 C ATOM 1578 C VAL B 44 8.438 -15.226 -7.011 1.00 0.00 C ATOM 1579 O VAL B 44 8.938 -14.276 -6.408 1.00 0.00 O ATOM 1580 CB VAL B 44 6.491 -14.337 -8.295 1.00 0.00 C ATOM 1581 CG1 VAL B 44 5.083 -14.658 -8.773 1.00 0.00 C ATOM 1582 CG2 VAL B 44 6.577 -12.907 -7.785 1.00 0.00 C ATOM 0 HA VAL B 44 6.670 -16.339 -7.511 1.00 0.00 H new ATOM 0 HB VAL B 44 7.168 -14.437 -9.143 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.791 -13.948 -9.547 1.00 0.00 H new ATOM 0 HG12 VAL B 44 5.058 -15.669 -9.180 1.00 0.00 H new ATOM 0 HG13 VAL B 44 4.389 -14.587 -7.935 1.00 0.00 H new ATOM 0 HG21 VAL B 44 6.265 -12.221 -8.572 1.00 0.00 H new ATOM 0 HG22 VAL B 44 5.924 -12.789 -6.920 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.604 -12.685 -7.496 1.00 0.00 H new ATOM 1592 N THR B 45 9.161 -16.211 -7.533 1.00 0.00 N ATOM 1593 CA THR B 45 10.614 -16.234 -7.423 1.00 0.00 C ATOM 1594 C THR B 45 11.265 -16.476 -8.780 1.00 0.00 C ATOM 1595 O THR B 45 10.955 -17.452 -9.464 1.00 0.00 O ATOM 1596 CB THR B 45 11.086 -17.322 -6.439 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.331 -17.245 -5.225 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.568 -17.167 -6.131 1.00 0.00 C ATOM 0 H THR B 45 8.764 -17.004 -8.037 1.00 0.00 H new ATOM 0 HA THR B 45 10.917 -15.257 -7.047 1.00 0.00 H new ATOM 0 HB THR B 45 10.928 -18.295 -6.904 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.636 -17.941 -4.606 1.00 0.00 H new ATOM 0 HG21 THR B 45 12.878 -17.946 -5.434 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.142 -17.255 -7.053 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.746 -16.189 -5.684 1.00 0.00 H new ATOM 1606 N VAL B 46 12.170 -15.582 -9.166 1.00 0.00 N ATOM 1607 CA VAL B 46 12.866 -15.699 -10.441 1.00 0.00 C ATOM 1608 C VAL B 46 14.157 -16.496 -10.291 1.00 0.00 C ATOM 1609 O VAL B 46 14.902 -16.313 -9.329 1.00 0.00 O ATOM 1610 CB VAL B 46 13.195 -14.315 -11.030 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.292 -13.638 -10.223 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.598 -14.440 -12.492 1.00 0.00 C ATOM 0 H VAL B 46 12.438 -14.768 -8.613 1.00 0.00 H new ATOM 0 HA VAL B 46 12.195 -16.224 -11.121 1.00 0.00 H new ATOM 0 HB VAL B 46 12.301 -13.694 -10.975 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.511 -12.661 -10.654 1.00 0.00 H new ATOM 0 HG12 VAL B 46 13.961 -13.513 -9.192 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.191 -14.253 -10.244 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.827 -13.452 -12.892 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.478 -15.078 -12.574 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.778 -14.880 -13.059 1.00 0.00 H new ATOM 1622 N GLU B 47 14.415 -17.380 -11.250 1.00 0.00 N ATOM 1623 CA GLU B 47 15.617 -18.205 -11.224 1.00 0.00 C ATOM 1624 C GLU B 47 16.393 -18.078 -12.532 1.00 0.00 C ATOM 1625 O GLU B 47 15.837 -18.252 -13.615 1.00 0.00 O ATOM 1626 CB GLU B 47 15.251 -19.670 -10.975 1.00 0.00 C ATOM 1627 CG GLU B 47 16.125 -20.347 -9.933 1.00 0.00 C ATOM 1628 CD GLU B 47 16.363 -21.814 -10.234 1.00 0.00 C ATOM 1629 OE1 GLU B 47 16.711 -22.134 -11.390 1.00 0.00 O ATOM 1630 OE2 GLU B 47 16.202 -22.642 -9.314 1.00 0.00 O ATOM 0 H GLU B 47 13.808 -17.543 -12.054 1.00 0.00 H new ATOM 0 HA GLU B 47 16.251 -17.853 -10.410 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.210 -19.727 -10.656 1.00 0.00 H new ATOM 0 HB3 GLU B 47 15.327 -20.219 -11.913 1.00 0.00 H new ATOM 0 HG2 GLU B 47 17.084 -19.831 -9.878 1.00 0.00 H new ATOM 0 HG3 GLU B 47 15.656 -20.253 -8.954 1.00 0.00 H new ATOM 1637 N GLY B 48 17.682 -17.773 -12.421 1.00 0.00 N ATOM 1638 CA GLY B 48 18.514 -17.626 -13.601 1.00 0.00 C ATOM 1639 C GLY B 48 19.809 -18.408 -13.498 1.00 0.00 C ATOM 1640 O GLY B 48 20.216 -18.805 -12.407 1.00 0.00 O ATOM 0 H GLY B 48 18.165 -17.625 -11.535 1.00 0.00 H new ATOM 0 HA2 GLY B 48 17.959 -17.962 -14.477 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.741 -16.571 -13.752 1.00 0.00 H new ATOM 1644 N GLN B 49 20.456 -18.631 -14.638 1.00 0.00 N ATOM 1645 CA GLN B 49 21.710 -19.373 -14.671 1.00 0.00 C ATOM 1646 C GLN B 49 22.761 -18.629 -15.488 1.00 0.00 C ATOM 1647 O GLN B 49 22.459 -18.061 -16.539 1.00 0.00 O ATOM 1648 CB GLN B 49 21.487 -20.769 -15.256 1.00 0.00 C ATOM 1649 CG GLN B 49 20.879 -20.754 -16.650 1.00 0.00 C ATOM 1650 CD GLN B 49 21.914 -20.528 -17.734 1.00 0.00 C ATOM 1651 OE1 GLN B 49 23.036 -21.030 -17.653 1.00 0.00 O ATOM 1652 NE2 GLN B 49 21.542 -19.770 -18.759 1.00 0.00 N ATOM 0 H GLN B 49 20.132 -18.308 -15.550 1.00 0.00 H new ATOM 0 HA GLN B 49 22.072 -19.470 -13.648 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.440 -21.296 -15.290 1.00 0.00 H new ATOM 0 HB3 GLN B 49 20.834 -21.333 -14.590 1.00 0.00 H new ATOM 0 HG2 GLN B 49 20.370 -21.701 -16.831 1.00 0.00 H new ATOM 0 HG3 GLN B 49 20.124 -19.970 -16.705 1.00 0.00 H new ATOM 0 HE21 GLN B 49 20.602 -19.374 -18.786 1.00 0.00 H new ATOM 0 HE22 GLN B 49 22.196 -19.584 -19.519 1.00 0.00 H new ATOM 1661 N LEU B 50 23.997 -18.635 -14.999 1.00 0.00 N ATOM 1662 CA LEU B 50 25.094 -17.960 -15.684 1.00 0.00 C ATOM 1663 C LEU B 50 26.193 -18.949 -16.058 1.00 0.00 C ATOM 1664 O LEU B 50 26.804 -19.570 -15.189 1.00 0.00 O ATOM 1665 CB LEU B 50 25.669 -16.852 -14.799 1.00 0.00 C ATOM 1666 CG LEU B 50 26.247 -15.640 -15.531 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.523 -16.020 -16.266 1.00 0.00 C ATOM 1668 CD2 LEU B 50 25.224 -15.064 -16.499 1.00 0.00 C ATOM 0 H LEU B 50 24.264 -19.100 -14.131 1.00 0.00 H new ATOM 0 HA LEU B 50 24.701 -17.518 -16.600 1.00 0.00 H new ATOM 0 HB2 LEU B 50 24.883 -16.505 -14.129 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.453 -17.282 -14.176 1.00 0.00 H new ATOM 0 HG LEU B 50 26.490 -14.876 -14.793 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.920 -15.145 -16.781 1.00 0.00 H new ATOM 0 HD12 LEU B 50 28.260 -16.386 -15.551 1.00 0.00 H new ATOM 0 HD13 LEU B 50 27.305 -16.802 -16.994 1.00 0.00 H new ATOM 0 HD21 LEU B 50 25.652 -14.202 -17.011 1.00 0.00 H new ATOM 0 HD22 LEU B 50 24.950 -15.822 -17.232 1.00 0.00 H new ATOM 0 HD23 LEU B 50 24.336 -14.754 -15.948 1.00 0.00 H new