USER MOD reduce.3.24.130724 H: found=0, std=0, add=625, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 621 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 HIS :FLIP no HD1:sc= -0.0251 F(o=-1.3,f=-0.36) USER MOD Set 1.2: A 63 GLN : amide:sc= -0.335 K(o=-0.36,f=-3.2!) USER MOD Set 2.1: A 26 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 30 TYR OH : rot 155:sc= 0.672 USER MOD Set 2.3: A 62 HIS : no HD1:sc= 0.0602 K(o=0.73,f=-3.9) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.31 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= -0.716 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 MET CE :methyl 137:sc= -0.976 (180deg=-3.1!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0.127 K(o=0.13,f=-1.7) USER MOD Single : A 29 GLN : amide:sc= 0.191 X(o=0.19,f=-0.004) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.472 X(o=-0.47,f=-0.023) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.252 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.00124 USER MOD Single : A 74 CYS SG : rot 180:sc= -0.135 USER MOD Single : A 77 ASN : amide:sc= -0.166 X(o=-0.17,f=-0.2) USER MOD Single : A 78 SER OG : rot 51:sc= 0.197 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 22:sc= 0.0371 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.548 8.393 -4.650 1.00 0.00 N ATOM 2 CA GLY A 1 -0.666 7.429 -3.572 1.00 0.00 C ATOM 3 C GLY A 1 0.683 6.965 -3.059 1.00 0.00 C ATOM 4 O GLY A 1 1.568 7.780 -2.797 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.497 8.679 -4.966 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.029 9.229 -4.313 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.034 7.963 -5.445 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.230 7.873 -2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.235 6.567 -3.920 1.00 0.00 H new ATOM 8 N SER A 2 0.840 5.654 -2.913 1.00 0.00 N ATOM 9 CA SER A 2 2.089 5.083 -2.422 1.00 0.00 C ATOM 10 C SER A 2 2.474 3.845 -3.226 1.00 0.00 C ATOM 11 O SER A 2 3.504 3.824 -3.899 1.00 0.00 O ATOM 12 CB SER A 2 1.963 4.724 -0.941 1.00 0.00 C ATOM 13 OG SER A 2 3.202 4.278 -0.417 1.00 0.00 O ATOM 0 H SER A 2 0.118 4.966 -3.128 1.00 0.00 H new ATOM 0 HA SER A 2 2.873 5.831 -2.542 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.620 5.594 -0.381 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.210 3.946 -0.815 1.00 0.00 H new ATOM 0 HG SER A 2 3.095 4.056 0.532 1.00 0.00 H new ATOM 19 N SER A 3 1.637 2.815 -3.151 1.00 0.00 N ATOM 20 CA SER A 3 1.890 1.570 -3.868 1.00 0.00 C ATOM 21 C SER A 3 0.608 1.036 -4.499 1.00 0.00 C ATOM 22 O SER A 3 0.073 0.013 -4.074 1.00 0.00 O ATOM 23 CB SER A 3 2.481 0.523 -2.922 1.00 0.00 C ATOM 24 OG SER A 3 2.957 -0.602 -3.640 1.00 0.00 O ATOM 0 H SER A 3 0.778 2.818 -2.601 1.00 0.00 H new ATOM 0 HA SER A 3 2.607 1.777 -4.663 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.297 0.965 -2.350 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.723 0.207 -2.205 1.00 0.00 H new ATOM 0 HG SER A 3 3.331 -1.256 -3.013 1.00 0.00 H new ATOM 30 N GLY A 4 0.119 1.739 -5.516 1.00 0.00 N ATOM 31 CA GLY A 4 -1.097 1.322 -6.190 1.00 0.00 C ATOM 32 C GLY A 4 -2.344 1.873 -5.529 1.00 0.00 C ATOM 33 O GLY A 4 -2.264 2.556 -4.508 1.00 0.00 O ATOM 0 H GLY A 4 0.543 2.590 -5.885 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.064 1.651 -7.229 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.147 0.233 -6.202 1.00 0.00 H new ATOM 37 N SER A 5 -3.501 1.578 -6.113 1.00 0.00 N ATOM 38 CA SER A 5 -4.771 2.054 -5.577 1.00 0.00 C ATOM 39 C SER A 5 -5.943 1.499 -6.382 1.00 0.00 C ATOM 40 O SER A 5 -6.928 1.023 -5.819 1.00 0.00 O ATOM 41 CB SER A 5 -4.811 3.583 -5.585 1.00 0.00 C ATOM 42 OG SER A 5 -3.804 4.115 -6.428 1.00 0.00 O ATOM 0 H SER A 5 -3.585 1.012 -6.957 1.00 0.00 H new ATOM 0 HA SER A 5 -4.859 1.701 -4.550 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.790 3.923 -5.924 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.677 3.959 -4.571 1.00 0.00 H new ATOM 0 HG SER A 5 -3.852 5.094 -6.417 1.00 0.00 H new ATOM 48 N SER A 6 -5.827 1.564 -7.705 1.00 0.00 N ATOM 49 CA SER A 6 -6.877 1.073 -8.589 1.00 0.00 C ATOM 50 C SER A 6 -6.279 0.403 -9.823 1.00 0.00 C ATOM 51 O SER A 6 -5.193 0.764 -10.274 1.00 0.00 O ATOM 52 CB SER A 6 -7.795 2.221 -9.013 1.00 0.00 C ATOM 53 OG SER A 6 -9.035 2.160 -8.331 1.00 0.00 O ATOM 0 H SER A 6 -5.016 1.952 -8.188 1.00 0.00 H new ATOM 0 HA SER A 6 -7.461 0.333 -8.042 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.309 3.175 -8.806 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.965 2.176 -10.089 1.00 0.00 H new ATOM 0 HG SER A 6 -9.603 2.905 -8.618 1.00 0.00 H new ATOM 59 N GLY A 7 -6.997 -0.577 -10.364 1.00 0.00 N ATOM 60 CA GLY A 7 -6.523 -1.283 -11.539 1.00 0.00 C ATOM 61 C GLY A 7 -7.089 -0.714 -12.825 1.00 0.00 C ATOM 62 O GLY A 7 -6.375 -0.573 -13.818 1.00 0.00 O ATOM 0 H GLY A 7 -7.899 -0.894 -10.009 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.435 -1.236 -11.573 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.794 -2.336 -11.461 1.00 0.00 H new ATOM 66 N VAL A 8 -8.377 -0.387 -12.809 1.00 0.00 N ATOM 67 CA VAL A 8 -9.040 0.169 -13.983 1.00 0.00 C ATOM 68 C VAL A 8 -8.372 1.465 -14.428 1.00 0.00 C ATOM 69 O VAL A 8 -8.449 1.846 -15.596 1.00 0.00 O ATOM 70 CB VAL A 8 -10.531 0.440 -13.710 1.00 0.00 C ATOM 71 CG1 VAL A 8 -11.246 0.836 -14.993 1.00 0.00 C ATOM 72 CG2 VAL A 8 -11.187 -0.779 -13.079 1.00 0.00 C ATOM 0 H VAL A 8 -8.983 -0.497 -11.996 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.953 -0.573 -14.777 1.00 0.00 H new ATOM 0 HB VAL A 8 -10.609 1.270 -13.008 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.298 1.023 -14.780 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.791 1.740 -15.399 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.161 0.029 -15.721 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.240 -0.570 -12.893 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.100 -1.630 -13.755 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.691 -1.012 -12.137 1.00 0.00 H new ATOM 82 N SER A 9 -7.716 2.139 -13.489 1.00 0.00 N ATOM 83 CA SER A 9 -7.036 3.395 -13.784 1.00 0.00 C ATOM 84 C SER A 9 -5.792 3.154 -14.633 1.00 0.00 C ATOM 85 O SER A 9 -5.356 4.029 -15.382 1.00 0.00 O ATOM 86 CB SER A 9 -6.652 4.108 -12.486 1.00 0.00 C ATOM 87 OG SER A 9 -5.819 3.290 -11.682 1.00 0.00 O ATOM 0 H SER A 9 -7.641 1.837 -12.518 1.00 0.00 H new ATOM 0 HA SER A 9 -7.722 4.027 -14.348 1.00 0.00 H new ATOM 0 HB2 SER A 9 -6.137 5.040 -12.718 1.00 0.00 H new ATOM 0 HB3 SER A 9 -7.553 4.371 -11.932 1.00 0.00 H new ATOM 0 HG SER A 9 -5.586 3.769 -10.859 1.00 0.00 H new ATOM 93 N LYS A 10 -5.222 1.959 -14.510 1.00 0.00 N ATOM 94 CA LYS A 10 -4.028 1.599 -15.266 1.00 0.00 C ATOM 95 C LYS A 10 -4.359 0.583 -16.354 1.00 0.00 C ATOM 96 O LYS A 10 -3.490 -0.162 -16.806 1.00 0.00 O ATOM 97 CB LYS A 10 -2.960 1.029 -14.329 1.00 0.00 C ATOM 98 CG LYS A 10 -2.598 1.958 -13.183 1.00 0.00 C ATOM 99 CD LYS A 10 -1.113 2.277 -13.171 1.00 0.00 C ATOM 100 CE LYS A 10 -0.764 3.346 -14.195 1.00 0.00 C ATOM 101 NZ LYS A 10 -0.788 4.711 -13.602 1.00 0.00 N ATOM 0 H LYS A 10 -5.568 1.224 -13.894 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.643 2.501 -15.741 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -3.315 0.083 -13.920 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -2.062 0.810 -14.906 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -3.169 2.883 -13.269 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.879 1.496 -12.237 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -0.820 2.615 -12.177 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -0.544 1.371 -13.380 1.00 0.00 H new ATOM 0 HE2 LYS A 10 0.226 3.146 -14.606 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -1.469 3.298 -15.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -0.545 5.411 -14.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -1.739 4.912 -13.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -0.097 4.765 -12.827 1.00 0.00 H new ATOM 115 N TRP A 11 -5.620 0.560 -16.772 1.00 0.00 N ATOM 116 CA TRP A 11 -6.064 -0.364 -17.809 1.00 0.00 C ATOM 117 C TRP A 11 -5.545 0.062 -19.177 1.00 0.00 C ATOM 118 O TRP A 11 -5.723 1.209 -19.589 1.00 0.00 O ATOM 119 CB TRP A 11 -7.592 -0.442 -17.831 1.00 0.00 C ATOM 120 CG TRP A 11 -8.136 -1.640 -17.114 1.00 0.00 C ATOM 121 CD1 TRP A 11 -7.553 -2.310 -16.076 1.00 0.00 C ATOM 122 CD2 TRP A 11 -9.372 -2.312 -17.383 1.00 0.00 C ATOM 123 NE1 TRP A 11 -8.351 -3.357 -15.684 1.00 0.00 N ATOM 124 CE2 TRP A 11 -9.473 -3.380 -16.470 1.00 0.00 C ATOM 125 CE3 TRP A 11 -10.403 -2.115 -18.305 1.00 0.00 C ATOM 126 CZ2 TRP A 11 -10.564 -4.245 -16.455 1.00 0.00 C ATOM 127 CZ3 TRP A 11 -11.484 -2.975 -18.289 1.00 0.00 C ATOM 128 CH2 TRP A 11 -11.559 -4.028 -17.369 1.00 0.00 C ATOM 0 H TRP A 11 -6.352 1.170 -16.409 1.00 0.00 H new ATOM 0 HA TRP A 11 -5.660 -1.350 -17.579 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -8.001 0.461 -17.377 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -7.933 -0.461 -18.866 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -6.604 -2.054 -15.629 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -8.142 -4.011 -14.930 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -10.356 -1.305 -19.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -10.623 -5.058 -15.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -12.286 -2.833 -18.999 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -12.419 -4.682 -17.381 1.00 0.00 H new ATOM 139 N SER A 12 -4.902 -0.867 -19.878 1.00 0.00 N ATOM 140 CA SER A 12 -4.354 -0.585 -21.199 1.00 0.00 C ATOM 141 C SER A 12 -5.456 -0.165 -22.166 1.00 0.00 C ATOM 142 O SER A 12 -6.641 -0.419 -21.946 1.00 0.00 O ATOM 143 CB SER A 12 -3.622 -1.813 -21.744 1.00 0.00 C ATOM 144 OG SER A 12 -3.793 -2.930 -20.888 1.00 0.00 O ATOM 0 H SER A 12 -4.748 -1.821 -19.553 1.00 0.00 H new ATOM 0 HA SER A 12 -3.646 0.238 -21.103 1.00 0.00 H new ATOM 0 HB2 SER A 12 -3.998 -2.052 -22.739 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.560 -1.590 -21.849 1.00 0.00 H new ATOM 0 HG SER A 12 -3.317 -3.702 -21.259 1.00 0.00 H new ATOM 150 N PRO A 13 -5.059 0.494 -23.265 1.00 0.00 N ATOM 151 CA PRO A 13 -5.997 0.963 -24.289 1.00 0.00 C ATOM 152 C PRO A 13 -6.612 -0.185 -25.082 1.00 0.00 C ATOM 153 O PRO A 13 -7.657 -0.026 -25.713 1.00 0.00 O ATOM 154 CB PRO A 13 -5.124 1.833 -25.198 1.00 0.00 C ATOM 155 CG PRO A 13 -3.744 1.302 -25.018 1.00 0.00 C ATOM 156 CD PRO A 13 -3.663 0.831 -23.592 1.00 0.00 C ATOM 0 HA PRO A 13 -6.844 1.493 -23.853 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -5.443 1.763 -26.238 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -5.184 2.884 -24.916 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -3.547 0.484 -25.711 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -3.000 2.074 -25.217 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -3.007 -0.033 -23.491 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -3.272 1.607 -22.934 1.00 0.00 H new ATOM 164 N SER A 14 -5.958 -1.341 -25.044 1.00 0.00 N ATOM 165 CA SER A 14 -6.439 -2.516 -25.762 1.00 0.00 C ATOM 166 C SER A 14 -7.293 -3.395 -24.853 1.00 0.00 C ATOM 167 O SER A 14 -8.160 -4.133 -25.322 1.00 0.00 O ATOM 168 CB SER A 14 -5.261 -3.323 -26.311 1.00 0.00 C ATOM 169 OG SER A 14 -5.702 -4.308 -27.229 1.00 0.00 O ATOM 0 H SER A 14 -5.093 -1.490 -24.524 1.00 0.00 H new ATOM 0 HA SER A 14 -7.055 -2.176 -26.594 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.555 -2.654 -26.802 1.00 0.00 H new ATOM 0 HB3 SER A 14 -4.728 -3.800 -25.489 1.00 0.00 H new ATOM 0 HG SER A 14 -4.931 -4.809 -27.567 1.00 0.00 H new ATOM 175 N GLN A 15 -7.042 -3.310 -23.551 1.00 0.00 N ATOM 176 CA GLN A 15 -7.787 -4.098 -22.576 1.00 0.00 C ATOM 177 C GLN A 15 -9.251 -3.674 -22.538 1.00 0.00 C ATOM 178 O GLN A 15 -10.152 -4.513 -22.557 1.00 0.00 O ATOM 179 CB GLN A 15 -7.164 -3.951 -21.187 1.00 0.00 C ATOM 180 CG GLN A 15 -5.989 -4.884 -20.944 1.00 0.00 C ATOM 181 CD GLN A 15 -6.425 -6.269 -20.506 1.00 0.00 C ATOM 182 OE1 GLN A 15 -6.325 -7.233 -21.265 1.00 0.00 O ATOM 183 NE2 GLN A 15 -6.912 -6.374 -19.275 1.00 0.00 N ATOM 0 H GLN A 15 -6.329 -2.704 -23.147 1.00 0.00 H new ATOM 0 HA GLN A 15 -7.739 -5.144 -22.879 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -6.833 -2.921 -21.054 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -7.929 -4.140 -20.433 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -5.399 -4.965 -21.857 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -5.340 -4.454 -20.182 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -6.977 -5.548 -18.680 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -7.221 -7.281 -18.925 1.00 0.00 H new ATOM 192 N VAL A 16 -9.482 -2.366 -22.484 1.00 0.00 N ATOM 193 CA VAL A 16 -10.838 -1.830 -22.444 1.00 0.00 C ATOM 194 C VAL A 16 -11.689 -2.405 -23.571 1.00 0.00 C ATOM 195 O VAL A 16 -12.894 -2.603 -23.414 1.00 0.00 O ATOM 196 CB VAL A 16 -10.837 -0.294 -22.548 1.00 0.00 C ATOM 197 CG1 VAL A 16 -12.260 0.243 -22.535 1.00 0.00 C ATOM 198 CG2 VAL A 16 -10.018 0.316 -21.420 1.00 0.00 C ATOM 0 H VAL A 16 -8.748 -1.658 -22.467 1.00 0.00 H new ATOM 0 HA VAL A 16 -11.266 -2.121 -21.485 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.376 -0.012 -23.495 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -12.239 1.330 -22.609 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -12.812 -0.168 -23.380 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -12.750 -0.048 -21.606 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -10.028 1.402 -21.509 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.447 0.027 -20.461 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -8.991 -0.043 -21.481 1.00 0.00 H new ATOM 208 N VAL A 17 -11.054 -2.671 -24.708 1.00 0.00 N ATOM 209 CA VAL A 17 -11.753 -3.224 -25.862 1.00 0.00 C ATOM 210 C VAL A 17 -12.354 -4.588 -25.538 1.00 0.00 C ATOM 211 O VAL A 17 -13.440 -4.926 -26.010 1.00 0.00 O ATOM 212 CB VAL A 17 -10.812 -3.365 -27.073 1.00 0.00 C ATOM 213 CG1 VAL A 17 -11.550 -3.976 -28.255 1.00 0.00 C ATOM 214 CG2 VAL A 17 -10.219 -2.015 -27.446 1.00 0.00 C ATOM 0 H VAL A 17 -10.057 -2.513 -24.855 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.553 -2.527 -26.112 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.995 -4.033 -26.800 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.869 -4.068 -29.101 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -11.923 -4.963 -27.981 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -12.388 -3.336 -28.531 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.557 -2.133 -28.304 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.022 -1.323 -27.700 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -9.653 -1.620 -26.602 1.00 0.00 H new ATOM 224 N ASP A 18 -11.642 -5.365 -24.730 1.00 0.00 N ATOM 225 CA ASP A 18 -12.106 -6.692 -24.342 1.00 0.00 C ATOM 226 C ASP A 18 -13.301 -6.595 -23.398 1.00 0.00 C ATOM 227 O ASP A 18 -14.122 -7.509 -23.326 1.00 0.00 O ATOM 228 CB ASP A 18 -10.975 -7.476 -23.674 1.00 0.00 C ATOM 229 CG ASP A 18 -11.331 -8.933 -23.455 1.00 0.00 C ATOM 230 OD1 ASP A 18 -12.351 -9.385 -24.016 1.00 0.00 O ATOM 231 OD2 ASP A 18 -10.590 -9.621 -22.721 1.00 0.00 O ATOM 0 H ASP A 18 -10.742 -5.099 -24.331 1.00 0.00 H new ATOM 0 HA ASP A 18 -12.419 -7.219 -25.243 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -10.079 -7.413 -24.292 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -10.735 -7.016 -22.716 1.00 0.00 H new ATOM 236 N TRP A 19 -13.390 -5.484 -22.677 1.00 0.00 N ATOM 237 CA TRP A 19 -14.484 -5.268 -21.737 1.00 0.00 C ATOM 238 C TRP A 19 -15.799 -5.043 -22.475 1.00 0.00 C ATOM 239 O TRP A 19 -16.834 -5.594 -22.099 1.00 0.00 O ATOM 240 CB TRP A 19 -14.180 -4.071 -20.835 1.00 0.00 C ATOM 241 CG TRP A 19 -15.333 -3.678 -19.961 1.00 0.00 C ATOM 242 CD1 TRP A 19 -15.891 -4.419 -18.959 1.00 0.00 C ATOM 243 CD2 TRP A 19 -16.068 -2.451 -20.013 1.00 0.00 C ATOM 244 NE1 TRP A 19 -16.930 -3.726 -18.385 1.00 0.00 N ATOM 245 CE2 TRP A 19 -17.058 -2.515 -19.013 1.00 0.00 C ATOM 246 CE3 TRP A 19 -15.986 -1.303 -20.806 1.00 0.00 C ATOM 247 CZ2 TRP A 19 -17.957 -1.476 -18.788 1.00 0.00 C ATOM 248 CZ3 TRP A 19 -16.879 -0.272 -20.581 1.00 0.00 C ATOM 249 CH2 TRP A 19 -17.854 -0.364 -19.579 1.00 0.00 C ATOM 0 H TRP A 19 -12.718 -4.718 -22.725 1.00 0.00 H new ATOM 0 HA TRP A 19 -14.583 -6.162 -21.121 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -13.321 -4.307 -20.207 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -13.897 -3.220 -21.455 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -15.564 -5.404 -18.661 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -17.512 -4.059 -17.616 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -15.238 -1.223 -21.581 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -18.709 -1.545 -18.016 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -16.824 0.620 -21.188 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -18.537 0.458 -19.428 1.00 0.00 H new ATOM 260 N MET A 20 -15.752 -4.232 -23.526 1.00 0.00 N ATOM 261 CA MET A 20 -16.941 -3.937 -24.317 1.00 0.00 C ATOM 262 C MET A 20 -17.500 -5.206 -24.953 1.00 0.00 C ATOM 263 O MET A 20 -18.683 -5.276 -25.288 1.00 0.00 O ATOM 264 CB MET A 20 -16.615 -2.909 -25.403 1.00 0.00 C ATOM 265 CG MET A 20 -16.030 -1.616 -24.859 1.00 0.00 C ATOM 266 SD MET A 20 -17.276 -0.335 -24.623 1.00 0.00 S ATOM 267 CE MET A 20 -17.752 -0.008 -26.318 1.00 0.00 C ATOM 0 H MET A 20 -14.904 -3.767 -23.850 1.00 0.00 H new ATOM 0 HA MET A 20 -17.697 -3.523 -23.650 1.00 0.00 H new ATOM 0 HB2 MET A 20 -15.910 -3.349 -26.108 1.00 0.00 H new ATOM 0 HB3 MET A 20 -17.523 -2.681 -25.961 1.00 0.00 H new ATOM 0 HG2 MET A 20 -15.537 -1.817 -23.908 1.00 0.00 H new ATOM 0 HG3 MET A 20 -15.265 -1.251 -25.544 1.00 0.00 H new ATOM 0 HE1 MET A 20 -18.836 0.084 -26.380 1.00 0.00 H new ATOM 0 HE2 MET A 20 -17.289 0.920 -26.653 1.00 0.00 H new ATOM 0 HE3 MET A 20 -17.421 -0.829 -26.954 1.00 0.00 H new ATOM 277 N LYS A 21 -16.642 -6.207 -25.118 1.00 0.00 N ATOM 278 CA LYS A 21 -17.049 -7.474 -25.713 1.00 0.00 C ATOM 279 C LYS A 21 -18.040 -8.205 -24.812 1.00 0.00 C ATOM 280 O LYS A 21 -18.695 -9.155 -25.236 1.00 0.00 O ATOM 281 CB LYS A 21 -15.826 -8.358 -25.967 1.00 0.00 C ATOM 282 CG LYS A 21 -14.855 -7.777 -26.979 1.00 0.00 C ATOM 283 CD LYS A 21 -14.191 -8.866 -27.804 1.00 0.00 C ATOM 284 CE LYS A 21 -13.485 -8.290 -29.023 1.00 0.00 C ATOM 285 NZ LYS A 21 -13.087 -9.353 -29.987 1.00 0.00 N ATOM 0 H LYS A 21 -15.659 -6.165 -24.848 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.538 -7.260 -26.663 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.302 -8.519 -25.025 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.161 -9.335 -26.316 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.384 -7.091 -27.640 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -14.092 -7.196 -26.461 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.472 -9.404 -27.186 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.941 -9.589 -28.124 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.142 -7.577 -29.520 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.600 -7.739 -28.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.609 -8.920 -30.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.440 -10.020 -29.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.934 -9.862 -30.311 1.00 0.00 H new ATOM 299 N GLY A 22 -18.144 -7.753 -23.565 1.00 0.00 N ATOM 300 CA GLY A 22 -19.058 -8.375 -22.625 1.00 0.00 C ATOM 301 C GLY A 22 -20.151 -7.430 -22.168 1.00 0.00 C ATOM 302 O GLY A 22 -20.734 -7.614 -21.099 1.00 0.00 O ATOM 0 H GLY A 22 -17.612 -6.968 -23.190 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.510 -9.252 -23.089 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -18.499 -8.726 -21.757 1.00 0.00 H new ATOM 306 N LEU A 23 -20.430 -6.414 -22.978 1.00 0.00 N ATOM 307 CA LEU A 23 -21.460 -5.435 -22.650 1.00 0.00 C ATOM 308 C LEU A 23 -22.621 -5.515 -23.636 1.00 0.00 C ATOM 309 O LEU A 23 -22.700 -6.441 -24.444 1.00 0.00 O ATOM 310 CB LEU A 23 -20.869 -4.024 -22.654 1.00 0.00 C ATOM 311 CG LEU A 23 -19.597 -3.826 -21.829 1.00 0.00 C ATOM 312 CD1 LEU A 23 -19.164 -2.369 -21.856 1.00 0.00 C ATOM 313 CD2 LEU A 23 -19.812 -4.294 -20.397 1.00 0.00 C ATOM 0 H LEU A 23 -19.957 -6.247 -23.866 1.00 0.00 H new ATOM 0 HA LEU A 23 -21.838 -5.662 -21.653 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -20.656 -3.744 -23.686 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -21.628 -3.333 -22.286 1.00 0.00 H new ATOM 0 HG LEU A 23 -18.803 -4.427 -22.272 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -18.257 -2.248 -21.263 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -18.968 -2.067 -22.885 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -19.956 -1.746 -21.439 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -18.896 -4.146 -19.824 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -20.620 -3.720 -19.944 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -20.073 -5.352 -20.395 1.00 0.00 H new ATOM 325 N ASP A 24 -23.518 -4.538 -23.566 1.00 0.00 N ATOM 326 CA ASP A 24 -24.674 -4.496 -24.455 1.00 0.00 C ATOM 327 C ASP A 24 -24.244 -4.631 -25.912 1.00 0.00 C ATOM 328 O ASP A 24 -23.161 -4.186 -26.293 1.00 0.00 O ATOM 329 CB ASP A 24 -25.449 -3.193 -24.257 1.00 0.00 C ATOM 330 CG ASP A 24 -26.933 -3.426 -24.055 1.00 0.00 C ATOM 331 OD1 ASP A 24 -27.332 -3.763 -22.921 1.00 0.00 O ATOM 332 OD2 ASP A 24 -27.696 -3.274 -25.032 1.00 0.00 O ATOM 0 H ASP A 24 -23.467 -3.764 -22.903 1.00 0.00 H new ATOM 0 HA ASP A 24 -25.323 -5.336 -24.208 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -25.047 -2.662 -23.394 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -25.300 -2.550 -25.124 1.00 0.00 H new ATOM 337 N ASP A 25 -25.098 -5.247 -26.721 1.00 0.00 N ATOM 338 CA ASP A 25 -24.807 -5.440 -28.137 1.00 0.00 C ATOM 339 C ASP A 25 -24.721 -4.101 -28.862 1.00 0.00 C ATOM 340 O ASP A 25 -24.052 -3.982 -29.889 1.00 0.00 O ATOM 341 CB ASP A 25 -25.880 -6.317 -28.785 1.00 0.00 C ATOM 342 CG ASP A 25 -25.389 -6.991 -30.052 1.00 0.00 C ATOM 343 OD1 ASP A 25 -24.308 -7.614 -30.011 1.00 0.00 O ATOM 344 OD2 ASP A 25 -26.086 -6.893 -31.084 1.00 0.00 O ATOM 0 H ASP A 25 -25.998 -5.622 -26.421 1.00 0.00 H new ATOM 0 HA ASP A 25 -23.842 -5.940 -28.219 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -26.202 -7.078 -28.074 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -26.753 -5.707 -29.016 1.00 0.00 H new ATOM 349 N CYS A 26 -25.401 -3.097 -28.321 1.00 0.00 N ATOM 350 CA CYS A 26 -25.403 -1.766 -28.917 1.00 0.00 C ATOM 351 C CYS A 26 -24.044 -1.093 -28.751 1.00 0.00 C ATOM 352 O CYS A 26 -23.691 -0.187 -29.506 1.00 0.00 O ATOM 353 CB CYS A 26 -26.494 -0.902 -28.283 1.00 0.00 C ATOM 354 SG CYS A 26 -28.153 -1.216 -28.930 1.00 0.00 S ATOM 0 H CYS A 26 -25.958 -3.179 -27.471 1.00 0.00 H new ATOM 0 HA CYS A 26 -25.607 -1.873 -29.982 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -26.497 -1.072 -27.206 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -26.247 0.148 -28.439 1.00 0.00 H new ATOM 0 HG CYS A 26 -29.006 -0.439 -28.331 1.00 0.00 H new ATOM 360 N LEU A 27 -23.287 -1.542 -27.756 1.00 0.00 N ATOM 361 CA LEU A 27 -21.966 -0.982 -27.488 1.00 0.00 C ATOM 362 C LEU A 27 -20.878 -1.804 -28.171 1.00 0.00 C ATOM 363 O LEU A 27 -19.714 -1.764 -27.772 1.00 0.00 O ATOM 364 CB LEU A 27 -21.710 -0.928 -25.981 1.00 0.00 C ATOM 365 CG LEU A 27 -22.899 -0.519 -25.112 1.00 0.00 C ATOM 366 CD1 LEU A 27 -22.554 -0.652 -23.637 1.00 0.00 C ATOM 367 CD2 LEU A 27 -23.331 0.904 -25.435 1.00 0.00 C ATOM 0 H LEU A 27 -23.564 -2.291 -27.122 1.00 0.00 H new ATOM 0 HA LEU A 27 -21.938 0.030 -27.892 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -21.369 -1.911 -25.655 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -20.894 -0.230 -25.796 1.00 0.00 H new ATOM 0 HG LEU A 27 -23.731 -1.188 -25.330 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -23.413 -0.356 -23.034 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -22.295 -1.687 -23.416 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -21.707 -0.008 -23.402 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -24.179 1.178 -24.807 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -22.503 1.587 -25.246 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -23.621 0.967 -26.484 1.00 0.00 H new ATOM 379 N GLN A 28 -21.264 -2.547 -29.204 1.00 0.00 N ATOM 380 CA GLN A 28 -20.321 -3.377 -29.943 1.00 0.00 C ATOM 381 C GLN A 28 -19.744 -2.617 -31.133 1.00 0.00 C ATOM 382 O GLN A 28 -18.532 -2.608 -31.347 1.00 0.00 O ATOM 383 CB GLN A 28 -21.004 -4.658 -30.423 1.00 0.00 C ATOM 384 CG GLN A 28 -21.523 -5.532 -29.293 1.00 0.00 C ATOM 385 CD GLN A 28 -20.411 -6.084 -28.424 1.00 0.00 C ATOM 386 OE1 GLN A 28 -19.392 -6.558 -28.927 1.00 0.00 O ATOM 387 NE2 GLN A 28 -20.600 -6.027 -27.111 1.00 0.00 N ATOM 0 H GLN A 28 -22.223 -2.591 -29.548 1.00 0.00 H new ATOM 0 HA GLN A 28 -19.503 -3.640 -29.272 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -21.835 -4.393 -31.077 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -20.298 -5.234 -31.021 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -22.208 -4.951 -28.675 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -22.096 -6.359 -29.712 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -21.460 -5.626 -26.736 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -19.885 -6.384 -26.477 1.00 0.00 H new ATOM 396 N GLN A 29 -20.621 -1.982 -31.905 1.00 0.00 N ATOM 397 CA GLN A 29 -20.197 -1.221 -33.074 1.00 0.00 C ATOM 398 C GLN A 29 -19.169 -0.162 -32.691 1.00 0.00 C ATOM 399 O GLN A 29 -18.351 0.250 -33.514 1.00 0.00 O ATOM 400 CB GLN A 29 -21.404 -0.559 -33.742 1.00 0.00 C ATOM 401 CG GLN A 29 -22.031 0.547 -32.907 1.00 0.00 C ATOM 402 CD GLN A 29 -23.451 0.865 -33.332 1.00 0.00 C ATOM 403 OE1 GLN A 29 -23.731 1.040 -34.518 1.00 0.00 O ATOM 404 NE2 GLN A 29 -24.356 0.942 -32.364 1.00 0.00 N ATOM 0 H GLN A 29 -21.628 -1.980 -31.742 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.734 -1.912 -33.778 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -21.096 -0.147 -34.703 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -22.157 -1.319 -33.947 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -22.027 0.252 -31.858 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -21.422 1.447 -32.987 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -24.080 0.790 -31.394 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -25.328 1.153 -32.590 1.00 0.00 H new ATOM 413 N TYR A 30 -19.215 0.275 -31.437 1.00 0.00 N ATOM 414 CA TYR A 30 -18.289 1.288 -30.946 1.00 0.00 C ATOM 415 C TYR A 30 -16.910 0.687 -30.690 1.00 0.00 C ATOM 416 O TYR A 30 -15.898 1.387 -30.734 1.00 0.00 O ATOM 417 CB TYR A 30 -18.828 1.922 -29.663 1.00 0.00 C ATOM 418 CG TYR A 30 -20.214 2.507 -29.812 1.00 0.00 C ATOM 419 CD1 TYR A 30 -20.561 3.245 -30.937 1.00 0.00 C ATOM 420 CD2 TYR A 30 -21.178 2.320 -28.829 1.00 0.00 C ATOM 421 CE1 TYR A 30 -21.827 3.782 -31.077 1.00 0.00 C ATOM 422 CE2 TYR A 30 -22.446 2.851 -28.961 1.00 0.00 C ATOM 423 CZ TYR A 30 -22.766 3.582 -30.087 1.00 0.00 C ATOM 424 OH TYR A 30 -24.027 4.113 -30.223 1.00 0.00 O ATOM 0 H TYR A 30 -19.884 -0.057 -30.742 1.00 0.00 H new ATOM 0 HA TYR A 30 -18.193 2.058 -31.711 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -18.843 1.169 -28.875 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -18.144 2.707 -29.341 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -19.829 3.402 -31.715 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -20.931 1.749 -27.946 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -22.079 4.355 -31.957 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -23.183 2.695 -28.187 1.00 0.00 H new ATOM 0 HH TYR A 30 -24.662 3.586 -29.695 1.00 0.00 H new ATOM 434 N ILE A 31 -16.880 -0.614 -30.422 1.00 0.00 N ATOM 435 CA ILE A 31 -15.626 -1.310 -30.161 1.00 0.00 C ATOM 436 C ILE A 31 -14.607 -1.040 -31.262 1.00 0.00 C ATOM 437 O ILE A 31 -13.440 -0.758 -30.989 1.00 0.00 O ATOM 438 CB ILE A 31 -15.842 -2.830 -30.037 1.00 0.00 C ATOM 439 CG1 ILE A 31 -16.861 -3.135 -28.938 1.00 0.00 C ATOM 440 CG2 ILE A 31 -14.522 -3.531 -29.752 1.00 0.00 C ATOM 441 CD1 ILE A 31 -17.156 -4.610 -28.780 1.00 0.00 C ATOM 0 H ILE A 31 -17.709 -1.207 -30.380 1.00 0.00 H new ATOM 0 HA ILE A 31 -15.243 -0.927 -29.215 1.00 0.00 H new ATOM 0 HB ILE A 31 -16.233 -3.204 -30.983 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -16.490 -2.744 -27.991 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -17.790 -2.609 -29.159 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -14.691 -4.604 -29.667 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -13.824 -3.337 -30.566 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -14.104 -3.154 -28.818 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -17.886 -4.752 -27.983 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -17.557 -5.003 -29.714 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -16.237 -5.140 -28.528 1.00 0.00 H new ATOM 453 N LYS A 32 -15.056 -1.126 -32.510 1.00 0.00 N ATOM 454 CA LYS A 32 -14.185 -0.888 -33.655 1.00 0.00 C ATOM 455 C LYS A 32 -13.559 0.501 -33.583 1.00 0.00 C ATOM 456 O LYS A 32 -12.463 0.725 -34.094 1.00 0.00 O ATOM 457 CB LYS A 32 -14.971 -1.039 -34.959 1.00 0.00 C ATOM 458 CG LYS A 32 -15.562 -2.424 -35.157 1.00 0.00 C ATOM 459 CD LYS A 32 -16.927 -2.358 -35.822 1.00 0.00 C ATOM 460 CE LYS A 32 -17.043 -3.365 -36.956 1.00 0.00 C ATOM 461 NZ LYS A 32 -16.504 -2.824 -38.235 1.00 0.00 N ATOM 0 H LYS A 32 -16.019 -1.359 -32.754 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.385 -1.628 -33.632 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -15.776 -0.304 -34.975 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -14.314 -0.810 -35.798 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -14.888 -3.025 -35.767 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -15.650 -2.924 -34.193 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -17.703 -2.551 -35.082 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -17.097 -1.353 -36.208 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -16.504 -4.275 -36.691 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -18.089 -3.642 -37.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -16.601 -3.540 -38.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -17.035 -1.970 -38.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -15.499 -2.584 -38.114 1.00 0.00 H new ATOM 475 N ASN A 33 -14.264 1.430 -32.945 1.00 0.00 N ATOM 476 CA ASN A 33 -13.776 2.797 -32.806 1.00 0.00 C ATOM 477 C ASN A 33 -12.883 2.934 -31.577 1.00 0.00 C ATOM 478 O ASN A 33 -11.965 3.754 -31.551 1.00 0.00 O ATOM 479 CB ASN A 33 -14.951 3.772 -32.708 1.00 0.00 C ATOM 480 CG ASN A 33 -15.625 4.003 -34.047 1.00 0.00 C ATOM 481 OD1 ASN A 33 -14.978 3.971 -35.093 1.00 0.00 O ATOM 482 ND2 ASN A 33 -16.932 4.237 -34.019 1.00 0.00 N ATOM 0 H ASN A 33 -15.174 1.261 -32.517 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.186 3.037 -33.690 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.682 3.385 -31.998 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.597 4.724 -32.313 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -17.440 4.399 -34.889 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -17.428 4.254 -33.128 1.00 0.00 H new ATOM 489 N PHE A 34 -13.159 2.126 -30.559 1.00 0.00 N ATOM 490 CA PHE A 34 -12.382 2.157 -29.325 1.00 0.00 C ATOM 491 C PHE A 34 -10.989 1.572 -29.546 1.00 0.00 C ATOM 492 O PHE A 34 -10.038 1.933 -28.855 1.00 0.00 O ATOM 493 CB PHE A 34 -13.104 1.381 -28.222 1.00 0.00 C ATOM 494 CG PHE A 34 -14.061 2.221 -27.426 1.00 0.00 C ATOM 495 CD1 PHE A 34 -15.072 2.930 -28.056 1.00 0.00 C ATOM 496 CD2 PHE A 34 -13.950 2.303 -26.047 1.00 0.00 C ATOM 497 CE1 PHE A 34 -15.953 3.704 -27.326 1.00 0.00 C ATOM 498 CE2 PHE A 34 -14.828 3.076 -25.312 1.00 0.00 C ATOM 499 CZ PHE A 34 -15.832 3.777 -25.952 1.00 0.00 C ATOM 0 H PHE A 34 -13.915 1.441 -30.564 1.00 0.00 H new ATOM 0 HA PHE A 34 -12.277 3.197 -29.017 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -13.649 0.550 -28.670 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -12.364 0.950 -27.548 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -15.172 2.877 -29.130 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -13.168 1.756 -25.541 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.736 4.252 -27.829 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -14.730 3.132 -24.238 1.00 0.00 H new ATOM 0 HZ PHE A 34 -16.521 4.381 -25.379 1.00 0.00 H new ATOM 509 N GLU A 35 -10.881 0.667 -30.513 1.00 0.00 N ATOM 510 CA GLU A 35 -9.605 0.031 -30.823 1.00 0.00 C ATOM 511 C GLU A 35 -8.646 1.024 -31.472 1.00 0.00 C ATOM 512 O GLU A 35 -7.471 1.095 -31.111 1.00 0.00 O ATOM 513 CB GLU A 35 -9.820 -1.168 -31.749 1.00 0.00 C ATOM 514 CG GLU A 35 -9.549 -2.507 -31.085 1.00 0.00 C ATOM 515 CD GLU A 35 -8.069 -2.829 -31.004 1.00 0.00 C ATOM 516 OE1 GLU A 35 -7.509 -3.306 -32.013 1.00 0.00 O ATOM 517 OE2 GLU A 35 -7.472 -2.604 -29.930 1.00 0.00 O ATOM 0 H GLU A 35 -11.660 0.358 -31.095 1.00 0.00 H new ATOM 0 HA GLU A 35 -9.164 -0.315 -29.888 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -10.847 -1.155 -32.114 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -9.171 -1.065 -32.619 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -9.972 -2.502 -30.080 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.058 -3.294 -31.641 1.00 0.00 H new ATOM 524 N ARG A 36 -9.156 1.788 -32.433 1.00 0.00 N ATOM 525 CA ARG A 36 -8.345 2.776 -33.135 1.00 0.00 C ATOM 526 C ARG A 36 -8.045 3.972 -32.235 1.00 0.00 C ATOM 527 O ARG A 36 -6.957 4.542 -32.288 1.00 0.00 O ATOM 528 CB ARG A 36 -9.059 3.245 -34.404 1.00 0.00 C ATOM 529 CG ARG A 36 -8.113 3.718 -35.495 1.00 0.00 C ATOM 530 CD ARG A 36 -8.838 3.907 -36.818 1.00 0.00 C ATOM 531 NE ARG A 36 -7.962 3.668 -37.962 1.00 0.00 N ATOM 532 CZ ARG A 36 -8.398 3.565 -39.212 1.00 0.00 C ATOM 533 NH1 ARG A 36 -9.692 3.681 -39.479 1.00 0.00 N ATOM 534 NH2 ARG A 36 -7.539 3.347 -40.200 1.00 0.00 N ATOM 0 H ARG A 36 -10.127 1.742 -32.743 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.401 2.305 -33.411 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.667 2.428 -34.792 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.740 4.057 -34.149 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -7.651 4.658 -35.195 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -7.309 2.993 -35.620 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -9.689 3.228 -36.865 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -9.236 4.920 -36.872 1.00 0.00 H new ATOM 0 HE ARG A 36 -6.961 3.575 -37.791 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.356 3.850 -38.723 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -10.024 3.601 -40.440 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.543 3.258 -39.999 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.875 3.268 -41.160 1.00 0.00 H new ATOM 548 N GLU A 37 -9.020 4.344 -31.411 1.00 0.00 N ATOM 549 CA GLU A 37 -8.860 5.473 -30.501 1.00 0.00 C ATOM 550 C GLU A 37 -7.954 5.104 -29.331 1.00 0.00 C ATOM 551 O GLU A 37 -7.379 5.975 -28.677 1.00 0.00 O ATOM 552 CB GLU A 37 -10.223 5.933 -29.980 1.00 0.00 C ATOM 553 CG GLU A 37 -10.829 7.071 -30.783 1.00 0.00 C ATOM 554 CD GLU A 37 -10.964 8.348 -29.975 1.00 0.00 C ATOM 555 OE1 GLU A 37 -11.822 8.390 -29.069 1.00 0.00 O ATOM 556 OE2 GLU A 37 -10.210 9.305 -30.250 1.00 0.00 O ATOM 0 H GLU A 37 -9.927 3.881 -31.355 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.396 6.290 -31.054 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -10.910 5.087 -29.989 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.118 6.248 -28.942 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -10.209 7.263 -31.659 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -11.811 6.771 -31.148 1.00 0.00 H new ATOM 563 N LYS A 38 -7.831 3.807 -29.071 1.00 0.00 N ATOM 564 CA LYS A 38 -6.994 3.320 -27.980 1.00 0.00 C ATOM 565 C LYS A 38 -7.455 3.893 -26.644 1.00 0.00 C ATOM 566 O LYS A 38 -6.644 4.367 -25.848 1.00 0.00 O ATOM 567 CB LYS A 38 -5.530 3.691 -28.228 1.00 0.00 C ATOM 568 CG LYS A 38 -4.964 3.107 -29.511 1.00 0.00 C ATOM 569 CD LYS A 38 -4.213 1.812 -29.250 1.00 0.00 C ATOM 570 CE LYS A 38 -3.592 1.261 -30.525 1.00 0.00 C ATOM 571 NZ LYS A 38 -2.113 1.432 -30.540 1.00 0.00 N ATOM 0 H LYS A 38 -8.301 3.073 -29.601 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.086 2.235 -27.941 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.440 4.777 -28.262 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.929 3.347 -27.386 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.774 2.923 -30.217 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.294 3.830 -29.976 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.432 1.986 -28.509 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.895 1.074 -28.827 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.836 0.203 -30.620 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.025 1.767 -31.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -1.728 1.044 -31.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -1.880 2.443 -30.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -1.697 0.928 -29.731 1.00 0.00 H new ATOM 585 N ILE A 39 -8.761 3.844 -26.404 1.00 0.00 N ATOM 586 CA ILE A 39 -9.328 4.356 -25.162 1.00 0.00 C ATOM 587 C ILE A 39 -8.752 3.627 -23.953 1.00 0.00 C ATOM 588 O ILE A 39 -9.036 2.451 -23.731 1.00 0.00 O ATOM 589 CB ILE A 39 -10.862 4.220 -25.146 1.00 0.00 C ATOM 590 CG1 ILE A 39 -11.471 4.919 -26.364 1.00 0.00 C ATOM 591 CG2 ILE A 39 -11.432 4.796 -23.858 1.00 0.00 C ATOM 592 CD1 ILE A 39 -11.123 6.388 -26.454 1.00 0.00 C ATOM 0 H ILE A 39 -9.446 3.455 -27.052 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.064 5.412 -25.106 1.00 0.00 H new ATOM 0 HB ILE A 39 -11.118 3.162 -25.192 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -11.130 4.417 -27.269 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -12.555 4.812 -26.330 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.517 4.692 -23.862 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.019 4.258 -23.005 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -11.169 5.851 -23.783 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -11.588 6.818 -27.341 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -11.489 6.904 -25.566 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.041 6.502 -26.520 1.00 0.00 H new ATOM 604 N SER A 40 -7.941 4.336 -23.173 1.00 0.00 N ATOM 605 CA SER A 40 -7.323 3.756 -21.987 1.00 0.00 C ATOM 606 C SER A 40 -8.270 3.823 -20.793 1.00 0.00 C ATOM 607 O SER A 40 -9.258 4.555 -20.810 1.00 0.00 O ATOM 608 CB SER A 40 -6.018 4.485 -21.658 1.00 0.00 C ATOM 609 OG SER A 40 -6.194 5.382 -20.576 1.00 0.00 O ATOM 0 H SER A 40 -7.697 5.312 -23.341 1.00 0.00 H new ATOM 0 HA SER A 40 -7.104 2.709 -22.197 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.244 3.758 -21.410 1.00 0.00 H new ATOM 0 HB3 SER A 40 -5.672 5.032 -22.535 1.00 0.00 H new ATOM 0 HG SER A 40 -5.346 5.834 -20.384 1.00 0.00 H new ATOM 615 N GLY A 41 -7.960 3.051 -19.755 1.00 0.00 N ATOM 616 CA GLY A 41 -8.793 3.036 -18.567 1.00 0.00 C ATOM 617 C GLY A 41 -8.897 4.401 -17.915 1.00 0.00 C ATOM 618 O GLY A 41 -9.990 4.844 -17.560 1.00 0.00 O ATOM 0 H GLY A 41 -7.147 2.436 -19.716 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.791 2.686 -18.831 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -8.385 2.324 -17.850 1.00 0.00 H new ATOM 622 N ASP A 42 -7.760 5.067 -17.755 1.00 0.00 N ATOM 623 CA ASP A 42 -7.728 6.389 -17.141 1.00 0.00 C ATOM 624 C ASP A 42 -8.722 7.327 -17.818 1.00 0.00 C ATOM 625 O ASP A 42 -9.259 8.237 -17.187 1.00 0.00 O ATOM 626 CB ASP A 42 -6.318 6.978 -17.219 1.00 0.00 C ATOM 627 CG ASP A 42 -6.106 8.107 -16.231 1.00 0.00 C ATOM 628 OD1 ASP A 42 -7.103 8.576 -15.642 1.00 0.00 O ATOM 629 OD2 ASP A 42 -4.943 8.522 -16.044 1.00 0.00 O ATOM 0 H ASP A 42 -6.847 4.713 -18.042 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.011 6.282 -16.094 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -5.588 6.191 -17.029 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.136 7.344 -18.229 1.00 0.00 H new ATOM 634 N GLN A 43 -8.961 7.099 -19.105 1.00 0.00 N ATOM 635 CA GLN A 43 -9.889 7.925 -19.868 1.00 0.00 C ATOM 636 C GLN A 43 -11.300 7.347 -19.818 1.00 0.00 C ATOM 637 O GLN A 43 -12.285 8.076 -19.938 1.00 0.00 O ATOM 638 CB GLN A 43 -9.425 8.044 -21.320 1.00 0.00 C ATOM 639 CG GLN A 43 -8.377 9.123 -21.538 1.00 0.00 C ATOM 640 CD GLN A 43 -8.465 9.753 -22.914 1.00 0.00 C ATOM 641 OE1 GLN A 43 -7.487 9.775 -23.663 1.00 0.00 O ATOM 642 NE2 GLN A 43 -9.639 10.270 -23.255 1.00 0.00 N ATOM 0 H GLN A 43 -8.525 6.349 -19.641 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.906 8.918 -19.418 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -9.020 7.085 -21.643 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -10.288 8.254 -21.952 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -8.495 9.897 -20.780 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -7.385 8.693 -21.402 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -10.423 10.230 -22.603 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -9.758 10.707 -24.169 1.00 0.00 H new ATOM 651 N LEU A 44 -11.389 6.034 -19.640 1.00 0.00 N ATOM 652 CA LEU A 44 -12.680 5.357 -19.575 1.00 0.00 C ATOM 653 C LEU A 44 -13.394 5.672 -18.264 1.00 0.00 C ATOM 654 O LEU A 44 -14.609 5.871 -18.239 1.00 0.00 O ATOM 655 CB LEU A 44 -12.493 3.845 -19.716 1.00 0.00 C ATOM 656 CG LEU A 44 -13.769 3.004 -19.673 1.00 0.00 C ATOM 657 CD1 LEU A 44 -14.538 3.133 -20.978 1.00 0.00 C ATOM 658 CD2 LEU A 44 -13.437 1.546 -19.389 1.00 0.00 C ATOM 0 H LEU A 44 -10.583 5.417 -19.538 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.295 5.719 -20.399 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -11.984 3.649 -20.660 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -11.831 3.505 -18.920 1.00 0.00 H new ATOM 0 HG LEU A 44 -14.400 3.376 -18.866 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -15.443 2.527 -20.928 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -14.808 4.177 -21.140 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -13.915 2.788 -21.803 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -14.357 0.962 -19.362 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -12.786 1.161 -20.174 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -12.930 1.469 -18.427 1.00 0.00 H new ATOM 670 N LEU A 45 -12.632 5.717 -17.177 1.00 0.00 N ATOM 671 CA LEU A 45 -13.191 6.010 -15.862 1.00 0.00 C ATOM 672 C LEU A 45 -13.726 7.438 -15.804 1.00 0.00 C ATOM 673 O LEU A 45 -14.681 7.724 -15.082 1.00 0.00 O ATOM 674 CB LEU A 45 -12.131 5.807 -14.778 1.00 0.00 C ATOM 675 CG LEU A 45 -11.836 4.357 -14.392 1.00 0.00 C ATOM 676 CD1 LEU A 45 -10.348 4.162 -14.144 1.00 0.00 C ATOM 677 CD2 LEU A 45 -12.640 3.959 -13.162 1.00 0.00 C ATOM 0 H LEU A 45 -11.625 5.554 -17.180 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.019 5.323 -15.685 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -11.203 6.269 -15.115 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -12.447 6.343 -13.883 1.00 0.00 H new ATOM 0 HG LEU A 45 -12.132 3.713 -15.220 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -10.158 3.124 -13.871 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -9.793 4.406 -15.050 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -10.025 4.816 -13.334 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -12.418 2.924 -12.901 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -12.374 4.608 -12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -13.704 4.059 -13.375 1.00 0.00 H new ATOM 689 N ARG A 46 -13.106 8.328 -16.571 1.00 0.00 N ATOM 690 CA ARG A 46 -13.521 9.726 -16.607 1.00 0.00 C ATOM 691 C ARG A 46 -14.168 10.066 -17.947 1.00 0.00 C ATOM 692 O ARG A 46 -14.152 11.218 -18.380 1.00 0.00 O ATOM 693 CB ARG A 46 -12.321 10.642 -16.361 1.00 0.00 C ATOM 694 CG ARG A 46 -11.281 10.595 -17.468 1.00 0.00 C ATOM 695 CD ARG A 46 -11.186 11.924 -18.201 1.00 0.00 C ATOM 696 NE ARG A 46 -9.824 12.210 -18.643 1.00 0.00 N ATOM 697 CZ ARG A 46 -9.476 13.324 -19.278 1.00 0.00 C ATOM 698 NH1 ARG A 46 -10.385 14.252 -19.542 1.00 0.00 N ATOM 699 NH2 ARG A 46 -8.216 13.512 -19.648 1.00 0.00 N ATOM 0 H ARG A 46 -12.315 8.107 -17.176 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.256 9.882 -15.818 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.674 11.667 -16.249 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -11.849 10.363 -15.419 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -10.309 10.342 -17.045 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.536 9.806 -18.175 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -11.852 11.910 -19.064 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.530 12.724 -17.546 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.100 11.517 -18.454 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -11.354 14.112 -19.257 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.115 15.106 -20.030 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -7.513 12.801 -19.445 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -7.950 14.368 -20.135 1.00 0.00 H new ATOM 713 N ILE A 47 -14.736 9.056 -18.597 1.00 0.00 N ATOM 714 CA ILE A 47 -15.388 9.248 -19.886 1.00 0.00 C ATOM 715 C ILE A 47 -16.655 10.086 -19.741 1.00 0.00 C ATOM 716 O ILE A 47 -17.478 9.840 -18.859 1.00 0.00 O ATOM 717 CB ILE A 47 -15.749 7.902 -20.541 1.00 0.00 C ATOM 718 CG1 ILE A 47 -16.290 8.126 -21.954 1.00 0.00 C ATOM 719 CG2 ILE A 47 -16.766 7.155 -19.691 1.00 0.00 C ATOM 720 CD1 ILE A 47 -15.756 7.140 -22.970 1.00 0.00 C ATOM 0 H ILE A 47 -14.758 8.096 -18.252 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.677 9.774 -20.524 1.00 0.00 H new ATOM 0 HB ILE A 47 -14.846 7.295 -20.610 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -17.378 8.060 -21.932 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -16.039 9.137 -22.274 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -17.011 6.206 -20.167 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.346 6.968 -18.703 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -17.670 7.756 -19.593 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -16.182 7.359 -23.949 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.670 7.222 -23.021 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -16.030 6.128 -22.673 1.00 0.00 H new ATOM 732 N THR A 48 -16.806 11.076 -20.615 1.00 0.00 N ATOM 733 CA THR A 48 -17.972 11.950 -20.586 1.00 0.00 C ATOM 734 C THR A 48 -18.742 11.883 -21.899 1.00 0.00 C ATOM 735 O THR A 48 -18.233 11.386 -22.904 1.00 0.00 O ATOM 736 CB THR A 48 -17.571 13.412 -20.312 1.00 0.00 C ATOM 737 OG1 THR A 48 -18.741 14.235 -20.239 1.00 0.00 O ATOM 738 CG2 THR A 48 -16.646 13.932 -21.402 1.00 0.00 C ATOM 0 H THR A 48 -16.135 11.293 -21.352 1.00 0.00 H new ATOM 0 HA THR A 48 -18.611 11.598 -19.776 1.00 0.00 H new ATOM 0 HB THR A 48 -17.042 13.449 -19.360 1.00 0.00 H new ATOM 0 HG1 THR A 48 -18.478 15.162 -20.063 1.00 0.00 H new ATOM 0 HG21 THR A 48 -16.376 14.966 -21.187 1.00 0.00 H new ATOM 0 HG22 THR A 48 -15.744 13.321 -21.436 1.00 0.00 H new ATOM 0 HG23 THR A 48 -17.154 13.882 -22.365 1.00 0.00 H new ATOM 746 N HIS A 49 -19.972 12.388 -21.885 1.00 0.00 N ATOM 747 CA HIS A 49 -20.812 12.386 -23.077 1.00 0.00 C ATOM 748 C HIS A 49 -20.079 13.012 -24.260 1.00 0.00 C ATOM 749 O HIS A 49 -20.312 12.645 -25.411 1.00 0.00 O ATOM 750 CB HIS A 49 -22.113 13.144 -22.810 1.00 0.00 C ATOM 751 CG HIS A 49 -23.229 12.267 -22.332 1.00 0.00 C ATOM 752 ND1 HIS A 49 -24.256 11.696 -23.004 1.00 0.00 N flip ATOM 753 CD2 HIS A 49 -23.377 11.887 -21.015 1.00 0.00 C flip ATOM 754 CE1 HIS A 49 -24.997 10.988 -22.089 1.00 0.00 C flip ATOM 755 NE2 HIS A 49 -24.445 11.119 -20.897 1.00 0.00 N flip ATOM 0 H HIS A 49 -20.408 12.803 -21.062 1.00 0.00 H new ATOM 0 HA HIS A 49 -21.047 11.351 -23.324 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -21.927 13.919 -22.066 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -22.424 13.648 -23.725 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -22.722 12.173 -20.206 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -25.887 10.417 -22.309 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -24.785 10.699 -20.032 1.00 0.00 H new ATOM 763 N GLN A 50 -19.193 13.959 -23.967 1.00 0.00 N ATOM 764 CA GLN A 50 -18.428 14.637 -25.007 1.00 0.00 C ATOM 765 C GLN A 50 -17.446 13.678 -25.672 1.00 0.00 C ATOM 766 O GLN A 50 -17.316 13.658 -26.895 1.00 0.00 O ATOM 767 CB GLN A 50 -17.674 15.831 -24.419 1.00 0.00 C ATOM 768 CG GLN A 50 -17.775 17.090 -25.264 1.00 0.00 C ATOM 769 CD GLN A 50 -16.846 17.066 -26.461 1.00 0.00 C ATOM 770 OE1 GLN A 50 -15.700 17.510 -26.381 1.00 0.00 O ATOM 771 NE2 GLN A 50 -17.335 16.546 -27.580 1.00 0.00 N ATOM 0 H GLN A 50 -18.987 14.274 -23.019 1.00 0.00 H new ATOM 0 HA GLN A 50 -19.127 14.995 -25.763 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -18.062 16.040 -23.422 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -16.623 15.565 -24.302 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -18.802 17.210 -25.609 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -17.543 17.957 -24.646 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -18.290 16.190 -27.602 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.755 16.503 -28.418 1.00 0.00 H new ATOM 780 N GLU A 51 -16.757 12.885 -24.857 1.00 0.00 N ATOM 781 CA GLU A 51 -15.785 11.924 -25.368 1.00 0.00 C ATOM 782 C GLU A 51 -16.469 10.862 -26.224 1.00 0.00 C ATOM 783 O GLU A 51 -16.031 10.568 -27.336 1.00 0.00 O ATOM 784 CB GLU A 51 -15.036 11.259 -24.211 1.00 0.00 C ATOM 785 CG GLU A 51 -13.886 12.092 -23.672 1.00 0.00 C ATOM 786 CD GLU A 51 -12.575 11.801 -24.375 1.00 0.00 C ATOM 787 OE1 GLU A 51 -12.174 10.619 -24.419 1.00 0.00 O ATOM 788 OE2 GLU A 51 -11.948 12.756 -24.881 1.00 0.00 O ATOM 0 H GLU A 51 -16.853 12.889 -23.842 1.00 0.00 H new ATOM 0 HA GLU A 51 -15.071 12.463 -25.991 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.739 11.058 -23.402 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.651 10.296 -24.545 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.126 13.150 -23.782 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -13.772 11.900 -22.605 1.00 0.00 H new ATOM 795 N LEU A 52 -17.545 10.289 -25.696 1.00 0.00 N ATOM 796 CA LEU A 52 -18.291 9.258 -26.411 1.00 0.00 C ATOM 797 C LEU A 52 -18.693 9.741 -27.801 1.00 0.00 C ATOM 798 O LEU A 52 -18.647 8.983 -28.768 1.00 0.00 O ATOM 799 CB LEU A 52 -19.536 8.860 -25.617 1.00 0.00 C ATOM 800 CG LEU A 52 -19.311 7.888 -24.458 1.00 0.00 C ATOM 801 CD1 LEU A 52 -20.152 8.288 -23.255 1.00 0.00 C ATOM 802 CD2 LEU A 52 -19.632 6.464 -24.885 1.00 0.00 C ATOM 0 H LEU A 52 -17.921 10.520 -24.776 1.00 0.00 H new ATOM 0 HA LEU A 52 -17.644 8.388 -26.523 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -19.995 9.766 -25.221 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -20.254 8.414 -26.305 1.00 0.00 H new ATOM 0 HG LEU A 52 -18.260 7.932 -24.172 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -19.979 7.585 -22.440 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -19.873 9.292 -22.934 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -21.207 8.274 -23.528 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -19.466 5.787 -24.047 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -20.674 6.404 -25.199 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -18.986 6.179 -25.716 1.00 0.00 H new ATOM 814 N GLU A 53 -19.084 11.009 -27.891 1.00 0.00 N ATOM 815 CA GLU A 53 -19.492 11.593 -29.163 1.00 0.00 C ATOM 816 C GLU A 53 -18.352 11.539 -30.177 1.00 0.00 C ATOM 817 O GLU A 53 -18.573 11.295 -31.363 1.00 0.00 O ATOM 818 CB GLU A 53 -19.944 13.041 -28.964 1.00 0.00 C ATOM 819 CG GLU A 53 -20.871 13.545 -30.056 1.00 0.00 C ATOM 820 CD GLU A 53 -20.682 15.021 -30.347 1.00 0.00 C ATOM 821 OE1 GLU A 53 -20.463 15.791 -29.389 1.00 0.00 O ATOM 822 OE2 GLU A 53 -20.754 15.406 -31.533 1.00 0.00 O ATOM 0 H GLU A 53 -19.127 11.650 -27.099 1.00 0.00 H new ATOM 0 HA GLU A 53 -20.328 11.010 -29.550 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -20.450 13.126 -28.002 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.065 13.684 -28.920 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.697 12.974 -30.968 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -21.905 13.366 -29.761 1.00 0.00 H new ATOM 829 N ASP A 54 -17.134 11.770 -29.701 1.00 0.00 N ATOM 830 CA ASP A 54 -15.958 11.748 -30.564 1.00 0.00 C ATOM 831 C ASP A 54 -15.719 10.348 -31.120 1.00 0.00 C ATOM 832 O ASP A 54 -15.297 10.187 -32.266 1.00 0.00 O ATOM 833 CB ASP A 54 -14.725 12.223 -29.794 1.00 0.00 C ATOM 834 CG ASP A 54 -13.515 12.399 -30.691 1.00 0.00 C ATOM 835 OD1 ASP A 54 -13.690 12.859 -31.839 1.00 0.00 O ATOM 836 OD2 ASP A 54 -12.394 12.078 -30.245 1.00 0.00 O ATOM 0 H ASP A 54 -16.935 11.975 -28.722 1.00 0.00 H new ATOM 0 HA ASP A 54 -16.137 12.425 -31.399 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -14.950 13.169 -29.302 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -14.491 11.504 -29.009 1.00 0.00 H new ATOM 841 N LEU A 55 -15.989 9.337 -30.301 1.00 0.00 N ATOM 842 CA LEU A 55 -15.802 7.950 -30.710 1.00 0.00 C ATOM 843 C LEU A 55 -16.813 7.557 -31.783 1.00 0.00 C ATOM 844 O LEU A 55 -16.564 6.659 -32.586 1.00 0.00 O ATOM 845 CB LEU A 55 -15.936 7.019 -29.503 1.00 0.00 C ATOM 846 CG LEU A 55 -14.758 7.012 -28.527 1.00 0.00 C ATOM 847 CD1 LEU A 55 -15.249 6.821 -27.101 1.00 0.00 C ATOM 848 CD2 LEU A 55 -13.762 5.925 -28.901 1.00 0.00 C ATOM 0 H LEU A 55 -16.338 9.452 -29.350 1.00 0.00 H new ATOM 0 HA LEU A 55 -14.800 7.853 -31.128 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -16.836 7.296 -28.954 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -16.086 6.003 -29.868 1.00 0.00 H new ATOM 0 HG LEU A 55 -14.253 7.976 -28.589 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -14.398 6.819 -26.420 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -15.923 7.636 -26.836 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -15.779 5.872 -27.023 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -12.931 5.935 -28.196 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -14.254 4.953 -28.868 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -13.386 6.107 -29.908 1.00 0.00 H new ATOM 860 N GLY A 56 -17.954 8.240 -31.792 1.00 0.00 N ATOM 861 CA GLY A 56 -18.984 7.950 -32.772 1.00 0.00 C ATOM 862 C GLY A 56 -20.351 7.772 -32.142 1.00 0.00 C ATOM 863 O GLY A 56 -21.373 7.872 -32.820 1.00 0.00 O ATOM 0 H GLY A 56 -18.183 8.989 -31.138 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -19.026 8.760 -33.501 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -18.718 7.044 -33.317 1.00 0.00 H new ATOM 867 N VAL A 57 -20.370 7.506 -30.839 1.00 0.00 N ATOM 868 CA VAL A 57 -21.622 7.313 -30.117 1.00 0.00 C ATOM 869 C VAL A 57 -22.473 8.577 -30.146 1.00 0.00 C ATOM 870 O VAL A 57 -22.310 9.467 -29.312 1.00 0.00 O ATOM 871 CB VAL A 57 -21.368 6.912 -28.652 1.00 0.00 C ATOM 872 CG1 VAL A 57 -22.672 6.528 -27.969 1.00 0.00 C ATOM 873 CG2 VAL A 57 -20.363 5.772 -28.578 1.00 0.00 C ATOM 0 H VAL A 57 -19.533 7.419 -30.263 1.00 0.00 H new ATOM 0 HA VAL A 57 -22.157 6.507 -30.619 1.00 0.00 H new ATOM 0 HB VAL A 57 -20.949 7.770 -28.127 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -22.472 6.248 -26.935 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -23.357 7.376 -27.989 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -23.123 5.685 -28.493 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -20.196 5.502 -27.535 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -20.751 4.909 -29.119 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -19.421 6.088 -29.027 1.00 0.00 H new ATOM 883 N SER A 58 -23.384 8.648 -31.112 1.00 0.00 N ATOM 884 CA SER A 58 -24.260 9.805 -31.252 1.00 0.00 C ATOM 885 C SER A 58 -25.520 9.638 -30.407 1.00 0.00 C ATOM 886 O SER A 58 -26.011 10.596 -29.809 1.00 0.00 O ATOM 887 CB SER A 58 -24.641 10.008 -32.720 1.00 0.00 C ATOM 888 OG SER A 58 -25.189 8.824 -33.273 1.00 0.00 O ATOM 0 H SER A 58 -23.534 7.918 -31.809 1.00 0.00 H new ATOM 0 HA SER A 58 -23.720 10.683 -30.899 1.00 0.00 H new ATOM 0 HB2 SER A 58 -25.364 10.820 -32.803 1.00 0.00 H new ATOM 0 HB3 SER A 58 -23.761 10.306 -33.290 1.00 0.00 H new ATOM 0 HG SER A 58 -25.426 8.980 -34.211 1.00 0.00 H new ATOM 894 N ARG A 59 -26.037 8.415 -30.361 1.00 0.00 N ATOM 895 CA ARG A 59 -27.239 8.122 -29.591 1.00 0.00 C ATOM 896 C ARG A 59 -27.051 8.500 -28.124 1.00 0.00 C ATOM 897 O ARG A 59 -25.937 8.790 -27.687 1.00 0.00 O ATOM 898 CB ARG A 59 -27.594 6.638 -29.705 1.00 0.00 C ATOM 899 CG ARG A 59 -28.870 6.376 -30.488 1.00 0.00 C ATOM 900 CD ARG A 59 -30.092 6.385 -29.583 1.00 0.00 C ATOM 901 NE ARG A 59 -31.018 7.461 -29.925 1.00 0.00 N ATOM 902 CZ ARG A 59 -32.275 7.512 -29.499 1.00 0.00 C ATOM 903 NH1 ARG A 59 -32.753 6.552 -28.719 1.00 0.00 N ATOM 904 NH2 ARG A 59 -33.056 8.524 -29.853 1.00 0.00 N ATOM 0 H ARG A 59 -25.642 7.611 -30.848 1.00 0.00 H new ATOM 0 HA ARG A 59 -28.056 8.717 -30.000 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -26.769 6.111 -30.184 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -27.700 6.220 -28.704 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -28.984 7.134 -31.263 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -28.797 5.413 -30.993 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -30.606 5.427 -29.658 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -29.774 6.496 -28.546 1.00 0.00 H new ATOM 0 HE ARG A 59 -30.681 8.215 -30.524 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -32.155 5.772 -28.445 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -33.719 6.593 -28.393 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -32.691 9.264 -30.453 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -34.021 8.562 -29.525 1.00 0.00 H new ATOM 918 N ILE A 60 -28.146 8.493 -27.372 1.00 0.00 N ATOM 919 CA ILE A 60 -28.100 8.835 -25.956 1.00 0.00 C ATOM 920 C ILE A 60 -28.257 7.592 -25.085 1.00 0.00 C ATOM 921 O ILE A 60 -27.533 7.411 -24.108 1.00 0.00 O ATOM 922 CB ILE A 60 -29.199 9.849 -25.586 1.00 0.00 C ATOM 923 CG1 ILE A 60 -29.049 11.123 -26.419 1.00 0.00 C ATOM 924 CG2 ILE A 60 -29.143 10.172 -24.100 1.00 0.00 C ATOM 925 CD1 ILE A 60 -27.764 11.874 -26.150 1.00 0.00 C ATOM 0 H ILE A 60 -29.075 8.255 -27.719 1.00 0.00 H new ATOM 0 HA ILE A 60 -27.124 9.285 -25.771 1.00 0.00 H new ATOM 0 HB ILE A 60 -30.170 9.406 -25.806 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -29.094 10.863 -27.477 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -29.894 11.781 -26.217 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -29.926 10.890 -23.854 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -29.293 9.259 -23.523 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -28.170 10.599 -23.857 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -27.726 12.766 -26.776 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -27.726 12.165 -25.100 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -26.913 11.233 -26.380 1.00 0.00 H new ATOM 937 N GLY A 61 -29.208 6.737 -25.449 1.00 0.00 N ATOM 938 CA GLY A 61 -29.442 5.522 -24.693 1.00 0.00 C ATOM 939 C GLY A 61 -28.208 4.645 -24.608 1.00 0.00 C ATOM 940 O GLY A 61 -28.073 3.838 -23.687 1.00 0.00 O ATOM 0 H GLY A 61 -29.820 6.865 -26.255 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.769 5.782 -23.686 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -30.252 4.960 -25.157 1.00 0.00 H new ATOM 944 N HIS A 62 -27.306 4.801 -25.571 1.00 0.00 N ATOM 945 CA HIS A 62 -26.077 4.016 -25.602 1.00 0.00 C ATOM 946 C HIS A 62 -24.989 4.677 -24.761 1.00 0.00 C ATOM 947 O HIS A 62 -24.266 4.005 -24.026 1.00 0.00 O ATOM 948 CB HIS A 62 -25.592 3.846 -27.042 1.00 0.00 C ATOM 949 CG HIS A 62 -26.644 3.323 -27.971 1.00 0.00 C ATOM 950 ND1 HIS A 62 -26.726 3.689 -29.298 1.00 0.00 N ATOM 951 CD2 HIS A 62 -27.661 2.456 -27.758 1.00 0.00 C ATOM 952 CE1 HIS A 62 -27.749 3.071 -29.860 1.00 0.00 C ATOM 953 NE2 HIS A 62 -28.333 2.316 -28.947 1.00 0.00 N ATOM 0 H HIS A 62 -27.403 5.464 -26.340 1.00 0.00 H new ATOM 0 HA HIS A 62 -26.291 3.034 -25.180 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -25.237 4.808 -27.413 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -24.740 3.166 -27.052 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -27.900 1.965 -26.826 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -28.056 3.167 -30.891 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -29.150 1.725 -29.100 1.00 0.00 H new ATOM 961 N GLN A 63 -24.879 5.997 -24.876 1.00 0.00 N ATOM 962 CA GLN A 63 -23.878 6.747 -24.127 1.00 0.00 C ATOM 963 C GLN A 63 -24.006 6.482 -22.630 1.00 0.00 C ATOM 964 O GLN A 63 -23.035 6.602 -21.884 1.00 0.00 O ATOM 965 CB GLN A 63 -24.018 8.244 -24.406 1.00 0.00 C ATOM 966 CG GLN A 63 -23.375 8.683 -25.712 1.00 0.00 C ATOM 967 CD GLN A 63 -23.207 10.187 -25.803 1.00 0.00 C ATOM 968 OE1 GLN A 63 -22.426 10.782 -25.060 1.00 0.00 O ATOM 969 NE2 GLN A 63 -23.940 10.810 -26.718 1.00 0.00 N ATOM 0 H GLN A 63 -25.470 6.568 -25.480 1.00 0.00 H new ATOM 0 HA GLN A 63 -22.892 6.415 -24.453 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -25.076 8.504 -24.427 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -23.569 8.802 -23.584 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -22.400 8.206 -25.811 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -23.985 8.338 -26.547 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -24.575 10.277 -27.313 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -23.869 11.822 -26.826 1.00 0.00 H new ATOM 978 N GLU A 64 -25.211 6.122 -22.199 1.00 0.00 N ATOM 979 CA GLU A 64 -25.465 5.842 -20.791 1.00 0.00 C ATOM 980 C GLU A 64 -25.263 4.361 -20.486 1.00 0.00 C ATOM 981 O GLU A 64 -24.882 3.990 -19.375 1.00 0.00 O ATOM 982 CB GLU A 64 -26.887 6.262 -20.413 1.00 0.00 C ATOM 983 CG GLU A 64 -26.995 7.710 -19.965 1.00 0.00 C ATOM 984 CD GLU A 64 -27.456 7.843 -18.527 1.00 0.00 C ATOM 985 OE1 GLU A 64 -28.482 7.227 -18.173 1.00 0.00 O ATOM 986 OE2 GLU A 64 -26.788 8.564 -17.755 1.00 0.00 O ATOM 0 H GLU A 64 -26.026 6.018 -22.804 1.00 0.00 H new ATOM 0 HA GLU A 64 -24.754 6.418 -20.199 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.543 6.106 -21.269 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.247 5.615 -19.613 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -26.025 8.195 -20.078 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -27.692 8.237 -20.616 1.00 0.00 H new ATOM 993 N LEU A 65 -25.521 3.517 -21.479 1.00 0.00 N ATOM 994 CA LEU A 65 -25.369 2.076 -21.319 1.00 0.00 C ATOM 995 C LEU A 65 -23.939 1.720 -20.925 1.00 0.00 C ATOM 996 O LEU A 65 -23.714 0.837 -20.097 1.00 0.00 O ATOM 997 CB LEU A 65 -25.748 1.355 -22.614 1.00 0.00 C ATOM 998 CG LEU A 65 -27.214 0.942 -22.748 1.00 0.00 C ATOM 999 CD1 LEU A 65 -27.564 0.683 -24.205 1.00 0.00 C ATOM 1000 CD2 LEU A 65 -27.500 -0.290 -21.901 1.00 0.00 C ATOM 0 H LEU A 65 -25.837 3.807 -22.405 1.00 0.00 H new ATOM 0 HA LEU A 65 -26.038 1.752 -20.522 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -25.495 2.002 -23.454 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -25.130 0.462 -22.703 1.00 0.00 H new ATOM 0 HG LEU A 65 -27.837 1.760 -22.386 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -28.611 0.390 -24.281 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -27.398 1.590 -24.786 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -26.934 -0.117 -24.594 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -28.548 -0.570 -22.008 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -26.868 -1.114 -22.233 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -27.289 -0.069 -20.855 1.00 0.00 H new ATOM 1012 N ILE A 66 -22.976 2.414 -21.522 1.00 0.00 N ATOM 1013 CA ILE A 66 -21.568 2.174 -21.231 1.00 0.00 C ATOM 1014 C ILE A 66 -21.191 2.713 -19.855 1.00 0.00 C ATOM 1015 O ILE A 66 -20.480 2.058 -19.093 1.00 0.00 O ATOM 1016 CB ILE A 66 -20.656 2.819 -22.291 1.00 0.00 C ATOM 1017 CG1 ILE A 66 -21.072 2.373 -23.694 1.00 0.00 C ATOM 1018 CG2 ILE A 66 -19.201 2.463 -22.025 1.00 0.00 C ATOM 1019 CD1 ILE A 66 -20.348 3.106 -24.801 1.00 0.00 C ATOM 0 H ILE A 66 -23.145 3.147 -22.210 1.00 0.00 H new ATOM 0 HA ILE A 66 -21.422 1.094 -21.247 1.00 0.00 H new ATOM 0 HB ILE A 66 -20.762 3.902 -22.229 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -20.887 1.304 -23.796 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.145 2.524 -23.811 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -18.569 2.926 -22.783 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -18.912 2.827 -21.039 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -19.079 1.381 -22.063 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.693 2.738 -25.767 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -20.553 4.174 -24.725 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -19.275 2.935 -24.710 1.00 0.00 H new ATOM 1031 N LEU A 67 -21.673 3.911 -19.543 1.00 0.00 N ATOM 1032 CA LEU A 67 -21.389 4.539 -18.258 1.00 0.00 C ATOM 1033 C LEU A 67 -21.967 3.717 -17.110 1.00 0.00 C ATOM 1034 O LEU A 67 -21.280 3.434 -16.130 1.00 0.00 O ATOM 1035 CB LEU A 67 -21.961 5.957 -18.223 1.00 0.00 C ATOM 1036 CG LEU A 67 -21.389 6.938 -19.247 1.00 0.00 C ATOM 1037 CD1 LEU A 67 -22.313 8.134 -19.417 1.00 0.00 C ATOM 1038 CD2 LEU A 67 -19.997 7.391 -18.831 1.00 0.00 C ATOM 0 H LEU A 67 -22.262 4.467 -20.163 1.00 0.00 H new ATOM 0 HA LEU A 67 -20.307 4.587 -18.137 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -23.039 5.896 -18.371 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -21.799 6.368 -17.226 1.00 0.00 H new ATOM 0 HG LEU A 67 -21.312 6.427 -20.207 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -21.889 8.820 -20.150 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -23.289 7.793 -19.762 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -22.424 8.647 -18.461 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -19.605 8.089 -19.571 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -20.050 7.884 -17.860 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -19.338 6.526 -18.763 1.00 0.00 H new ATOM 1050 N GLU A 68 -23.234 3.336 -17.242 1.00 0.00 N ATOM 1051 CA GLU A 68 -23.904 2.545 -16.216 1.00 0.00 C ATOM 1052 C GLU A 68 -23.085 1.307 -15.863 1.00 0.00 C ATOM 1053 O GLU A 68 -23.132 0.820 -14.734 1.00 0.00 O ATOM 1054 CB GLU A 68 -25.298 2.129 -16.690 1.00 0.00 C ATOM 1055 CG GLU A 68 -25.990 1.148 -15.759 1.00 0.00 C ATOM 1056 CD GLU A 68 -27.457 0.962 -16.093 1.00 0.00 C ATOM 1057 OE1 GLU A 68 -27.860 1.330 -17.216 1.00 0.00 O ATOM 1058 OE2 GLU A 68 -28.202 0.449 -15.232 1.00 0.00 O ATOM 0 H GLU A 68 -23.816 3.562 -18.048 1.00 0.00 H new ATOM 0 HA GLU A 68 -24.001 3.163 -15.323 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -25.918 3.019 -16.792 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -25.217 1.681 -17.681 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -25.484 0.184 -15.812 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -25.897 1.501 -14.732 1.00 0.00 H new ATOM 1065 N ALA A 69 -22.335 0.803 -16.838 1.00 0.00 N ATOM 1066 CA ALA A 69 -21.504 -0.377 -16.630 1.00 0.00 C ATOM 1067 C ALA A 69 -20.173 -0.005 -15.986 1.00 0.00 C ATOM 1068 O ALA A 69 -19.599 -0.787 -15.228 1.00 0.00 O ATOM 1069 CB ALA A 69 -21.271 -1.097 -17.951 1.00 0.00 C ATOM 0 H ALA A 69 -22.286 1.193 -17.779 1.00 0.00 H new ATOM 0 HA ALA A 69 -22.031 -1.047 -15.951 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -20.649 -1.976 -17.782 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -22.228 -1.405 -18.371 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -20.768 -0.426 -18.647 1.00 0.00 H new ATOM 1075 N VAL A 70 -19.687 1.193 -16.292 1.00 0.00 N ATOM 1076 CA VAL A 70 -18.423 1.669 -15.742 1.00 0.00 C ATOM 1077 C VAL A 70 -18.508 1.829 -14.229 1.00 0.00 C ATOM 1078 O VAL A 70 -17.525 1.624 -13.516 1.00 0.00 O ATOM 1079 CB VAL A 70 -18.010 3.015 -16.367 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -16.706 3.508 -15.760 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -17.889 2.885 -17.878 1.00 0.00 C ATOM 0 H VAL A 70 -20.149 1.852 -16.918 1.00 0.00 H new ATOM 0 HA VAL A 70 -17.670 0.919 -15.984 1.00 0.00 H new ATOM 0 HB VAL A 70 -18.785 3.750 -16.149 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.430 4.460 -16.214 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -16.832 3.641 -14.686 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -15.919 2.777 -15.945 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.597 3.845 -18.304 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -17.135 2.136 -18.120 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -18.849 2.581 -18.295 1.00 0.00 H new ATOM 1091 N ASP A 71 -19.689 2.196 -13.744 1.00 0.00 N ATOM 1092 CA ASP A 71 -19.904 2.383 -12.313 1.00 0.00 C ATOM 1093 C ASP A 71 -19.538 1.120 -11.540 1.00 0.00 C ATOM 1094 O ASP A 71 -19.021 1.190 -10.424 1.00 0.00 O ATOM 1095 CB ASP A 71 -21.361 2.759 -12.039 1.00 0.00 C ATOM 1096 CG ASP A 71 -21.526 3.527 -10.743 1.00 0.00 C ATOM 1097 OD1 ASP A 71 -20.499 3.919 -10.151 1.00 0.00 O ATOM 1098 OD2 ASP A 71 -22.683 3.736 -10.320 1.00 0.00 O ATOM 0 H ASP A 71 -20.512 2.370 -14.320 1.00 0.00 H new ATOM 0 HA ASP A 71 -19.258 3.194 -11.976 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -21.740 3.361 -12.865 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -21.966 1.853 -12.001 1.00 0.00 H new ATOM 1103 N LEU A 72 -19.810 -0.034 -12.139 1.00 0.00 N ATOM 1104 CA LEU A 72 -19.511 -1.314 -11.506 1.00 0.00 C ATOM 1105 C LEU A 72 -18.008 -1.575 -11.490 1.00 0.00 C ATOM 1106 O LEU A 72 -17.479 -2.160 -10.544 1.00 0.00 O ATOM 1107 CB LEU A 72 -20.229 -2.448 -12.240 1.00 0.00 C ATOM 1108 CG LEU A 72 -21.703 -2.649 -11.886 1.00 0.00 C ATOM 1109 CD1 LEU A 72 -22.398 -3.487 -12.948 1.00 0.00 C ATOM 1110 CD2 LEU A 72 -21.840 -3.299 -10.517 1.00 0.00 C ATOM 0 H LEU A 72 -20.237 -0.110 -13.062 1.00 0.00 H new ATOM 0 HA LEU A 72 -19.866 -1.274 -10.476 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -20.155 -2.264 -13.312 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -19.698 -3.378 -12.039 1.00 0.00 H new ATOM 0 HG LEU A 72 -22.184 -1.672 -11.851 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -23.446 -3.619 -12.679 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -22.332 -2.981 -13.911 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -21.915 -4.462 -13.016 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -22.896 -3.434 -10.282 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -21.343 -4.269 -10.523 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -21.380 -2.660 -9.763 1.00 0.00 H new ATOM 1122 N LEU A 73 -17.326 -1.137 -12.542 1.00 0.00 N ATOM 1123 CA LEU A 73 -15.882 -1.321 -12.649 1.00 0.00 C ATOM 1124 C LEU A 73 -15.162 -0.660 -11.478 1.00 0.00 C ATOM 1125 O LEU A 73 -14.144 -1.162 -10.999 1.00 0.00 O ATOM 1126 CB LEU A 73 -15.371 -0.743 -13.969 1.00 0.00 C ATOM 1127 CG LEU A 73 -15.215 -1.737 -15.121 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -15.018 -1.002 -16.438 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -14.051 -2.681 -14.857 1.00 0.00 C ATOM 0 H LEU A 73 -17.749 -0.652 -13.333 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.673 -2.391 -12.624 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.054 0.046 -14.286 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.404 -0.274 -13.787 1.00 0.00 H new ATOM 0 HG LEU A 73 -16.128 -2.328 -15.191 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.909 -1.726 -17.246 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -15.883 -0.368 -16.633 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.121 -0.385 -16.380 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.955 -3.381 -15.687 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.131 -2.105 -14.760 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -14.233 -3.234 -13.935 1.00 0.00 H new ATOM 1141 N CYS A 74 -15.696 0.467 -11.021 1.00 0.00 N ATOM 1142 CA CYS A 74 -15.105 1.196 -9.905 1.00 0.00 C ATOM 1143 C CYS A 74 -15.530 0.588 -8.572 1.00 0.00 C ATOM 1144 O CYS A 74 -14.799 0.661 -7.584 1.00 0.00 O ATOM 1145 CB CYS A 74 -15.510 2.670 -9.960 1.00 0.00 C ATOM 1146 SG CYS A 74 -14.116 3.813 -10.099 1.00 0.00 S ATOM 0 H CYS A 74 -16.537 0.896 -11.406 1.00 0.00 H new ATOM 0 HA CYS A 74 -14.021 1.122 -9.988 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -16.176 2.821 -10.809 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -16.078 2.914 -9.062 1.00 0.00 H new ATOM 0 HG CYS A 74 -14.559 5.035 -10.141 1.00 0.00 H new ATOM 1152 N ALA A 75 -16.717 -0.008 -8.552 1.00 0.00 N ATOM 1153 CA ALA A 75 -17.240 -0.629 -7.340 1.00 0.00 C ATOM 1154 C ALA A 75 -16.354 -1.785 -6.890 1.00 0.00 C ATOM 1155 O ALA A 75 -15.918 -1.836 -5.739 1.00 0.00 O ATOM 1156 CB ALA A 75 -18.665 -1.110 -7.567 1.00 0.00 C ATOM 0 H ALA A 75 -17.335 -0.074 -9.361 1.00 0.00 H new ATOM 0 HA ALA A 75 -17.243 0.121 -6.549 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -19.043 -1.571 -6.655 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -19.297 -0.263 -7.834 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -18.678 -1.841 -8.375 1.00 0.00 H new ATOM 1162 N LEU A 76 -16.091 -2.714 -7.803 1.00 0.00 N ATOM 1163 CA LEU A 76 -15.257 -3.871 -7.500 1.00 0.00 C ATOM 1164 C LEU A 76 -13.822 -3.447 -7.205 1.00 0.00 C ATOM 1165 O LEU A 76 -13.163 -4.012 -6.334 1.00 0.00 O ATOM 1166 CB LEU A 76 -15.279 -4.860 -8.667 1.00 0.00 C ATOM 1167 CG LEU A 76 -16.475 -5.812 -8.718 1.00 0.00 C ATOM 1168 CD1 LEU A 76 -16.624 -6.408 -10.109 1.00 0.00 C ATOM 1169 CD2 LEU A 76 -16.326 -6.912 -7.677 1.00 0.00 C ATOM 0 H LEU A 76 -16.444 -2.688 -8.760 1.00 0.00 H new ATOM 0 HA LEU A 76 -15.662 -4.357 -6.612 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.251 -4.293 -9.598 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -14.367 -5.456 -8.629 1.00 0.00 H new ATOM 0 HG LEU A 76 -17.377 -5.244 -8.490 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -17.480 -7.083 -10.126 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -16.778 -5.608 -10.833 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -15.721 -6.961 -10.366 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -17.186 -7.580 -7.728 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -15.415 -7.478 -7.873 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -16.270 -6.467 -6.683 1.00 0.00 H new ATOM 1181 N ASN A 77 -13.345 -2.445 -7.937 1.00 0.00 N ATOM 1182 CA ASN A 77 -11.988 -1.943 -7.753 1.00 0.00 C ATOM 1183 C ASN A 77 -11.965 -0.795 -6.748 1.00 0.00 C ATOM 1184 O ASN A 77 -11.594 0.330 -7.083 1.00 0.00 O ATOM 1185 CB ASN A 77 -11.409 -1.476 -9.091 1.00 0.00 C ATOM 1186 CG ASN A 77 -10.915 -2.630 -9.941 1.00 0.00 C ATOM 1187 OD1 ASN A 77 -9.718 -2.917 -9.982 1.00 0.00 O ATOM 1188 ND2 ASN A 77 -11.836 -3.299 -10.624 1.00 0.00 N ATOM 0 H ASN A 77 -13.878 -1.965 -8.663 1.00 0.00 H new ATOM 0 HA ASN A 77 -11.376 -2.756 -7.364 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -12.171 -0.924 -9.641 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -10.586 -0.786 -8.907 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -11.563 -4.086 -11.213 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -12.817 -3.026 -10.560 1.00 0.00 H new ATOM 1195 N SER A 78 -12.363 -1.089 -5.514 1.00 0.00 N ATOM 1196 CA SER A 78 -12.390 -0.081 -4.460 1.00 0.00 C ATOM 1197 C SER A 78 -10.985 0.434 -4.164 1.00 0.00 C ATOM 1198 O SER A 78 -10.702 1.621 -4.318 1.00 0.00 O ATOM 1199 CB SER A 78 -13.012 -0.661 -3.188 1.00 0.00 C ATOM 1200 OG SER A 78 -14.426 -0.690 -3.279 1.00 0.00 O ATOM 0 H SER A 78 -12.671 -2.016 -5.220 1.00 0.00 H new ATOM 0 HA SER A 78 -12.998 0.755 -4.806 1.00 0.00 H new ATOM 0 HB2 SER A 78 -12.634 -1.670 -3.022 1.00 0.00 H new ATOM 0 HB3 SER A 78 -12.712 -0.063 -2.327 1.00 0.00 H new ATOM 0 HG SER A 78 -14.691 -1.118 -4.120 1.00 0.00 H new ATOM 1206 N GLY A 79 -10.108 -0.470 -3.738 1.00 0.00 N ATOM 1207 CA GLY A 79 -8.742 -0.089 -3.426 1.00 0.00 C ATOM 1208 C GLY A 79 -7.726 -1.063 -3.989 1.00 0.00 C ATOM 1209 O GLY A 79 -8.041 -1.907 -4.828 1.00 0.00 O ATOM 0 H GLY A 79 -10.319 -1.459 -3.603 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.546 0.907 -3.824 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.623 -0.029 -2.344 1.00 0.00 H new ATOM 1213 N PRO A 80 -6.473 -0.951 -3.523 1.00 0.00 N ATOM 1214 CA PRO A 80 -5.381 -1.820 -3.973 1.00 0.00 C ATOM 1215 C PRO A 80 -5.541 -3.254 -3.479 1.00 0.00 C ATOM 1216 O PRO A 80 -6.035 -3.489 -2.376 1.00 0.00 O ATOM 1217 CB PRO A 80 -4.138 -1.176 -3.353 1.00 0.00 C ATOM 1218 CG PRO A 80 -4.646 -0.442 -2.160 1.00 0.00 C ATOM 1219 CD PRO A 80 -6.026 0.032 -2.523 1.00 0.00 C ATOM 0 HA PRO A 80 -5.341 -1.897 -5.060 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -3.401 -1.928 -3.071 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -3.650 -0.500 -4.055 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -4.674 -1.091 -1.285 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -3.997 0.398 -1.913 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.685 0.051 -1.655 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -6.009 1.042 -2.932 1.00 0.00 H new ATOM 1227 N SER A 81 -5.120 -4.209 -4.302 1.00 0.00 N ATOM 1228 CA SER A 81 -5.219 -5.620 -3.949 1.00 0.00 C ATOM 1229 C SER A 81 -3.837 -6.218 -3.707 1.00 0.00 C ATOM 1230 O SER A 81 -2.909 -6.002 -4.486 1.00 0.00 O ATOM 1231 CB SER A 81 -5.935 -6.395 -5.058 1.00 0.00 C ATOM 1232 OG SER A 81 -7.336 -6.413 -4.844 1.00 0.00 O ATOM 0 H SER A 81 -4.707 -4.031 -5.218 1.00 0.00 H new ATOM 0 HA SER A 81 -5.796 -5.699 -3.028 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.717 -5.939 -6.024 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.556 -7.416 -5.095 1.00 0.00 H new ATOM 0 HG SER A 81 -7.771 -6.912 -5.566 1.00 0.00 H new ATOM 1238 N SER A 82 -3.708 -6.972 -2.620 1.00 0.00 N ATOM 1239 CA SER A 82 -2.439 -7.600 -2.271 1.00 0.00 C ATOM 1240 C SER A 82 -2.665 -8.977 -1.656 1.00 0.00 C ATOM 1241 O SER A 82 -3.019 -9.096 -0.484 1.00 0.00 O ATOM 1242 CB SER A 82 -1.660 -6.715 -1.295 1.00 0.00 C ATOM 1243 OG SER A 82 -0.942 -5.706 -1.984 1.00 0.00 O ATOM 0 H SER A 82 -4.467 -7.163 -1.966 1.00 0.00 H new ATOM 0 HA SER A 82 -1.858 -7.721 -3.185 1.00 0.00 H new ATOM 0 HB2 SER A 82 -2.349 -6.256 -0.586 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.968 -7.327 -0.716 1.00 0.00 H new ATOM 0 HG SER A 82 -1.345 -5.562 -2.866 1.00 0.00 H new ATOM 1249 N GLY A 83 -2.456 -10.018 -2.457 1.00 0.00 N ATOM 1250 CA GLY A 83 -2.642 -11.374 -1.976 1.00 0.00 C ATOM 1251 C GLY A 83 -1.567 -12.319 -2.476 1.00 0.00 C ATOM 1252 O GLY A 83 -0.550 -12.520 -1.811 1.00 0.00 O ATOM 0 H GLY A 83 -2.161 -9.946 -3.431 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.642 -11.373 -0.886 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.619 -11.738 -2.294 1.00 0.00 H new TER 1256 GLY A 83