USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 935 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 19 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 128 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.43) USER MOD Set 2.1: A 65 THR OG1 : rot -34:sc= -0.286 USER MOD Set 2.2: A 101 GLN : amide:sc= 0.261 K(o=-0.025,f=-5.7!) USER MOD Set 3.1: A 81 ASN : amide:sc= -3.47! C(o=-6.4!,f=-17!) USER MOD Set 3.2: A 124 GLN :FLIP amide:sc= -2.96! C(o=-8.8!,f=-6.4!) USER MOD Set 4.1: A 70 THR OG1 : rot -43:sc= 0.159 USER MOD Set 4.2: A 133 SER OG : rot -109:sc= -0.504! USER MOD Set 5.1: A 61 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 97:sc= 0.765! USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 27 THR OG1 : rot 144:sc= -0.348 USER MOD Single : A 28 SER OG : rot 58:sc= -0.342! USER MOD Single : A 29 THR OG1 : rot -38:sc= 0.573 USER MOD Single : A 40 SER OG : rot -125:sc= -0.0489 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 43 TYR OH : rot -140:sc= -4.22! USER MOD Single : A 50 ASN : amide:sc= -1.56 K(o=-1.6,f=-3.2!) USER MOD Single : A 58 THR OG1 : rot 102:sc= 0.195 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.00421 USER MOD Single : A 60 TYR OH : rot 180:sc= -1.49! USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 140:sc= -2.22! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN :FLIP amide:sc= -6.74! C(o=-7.6!,f=-6.7!) USER MOD Single : A 85 TYR OH : rot 171:sc= -0.299 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0805 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0.0154 USER MOD Single : A 96 THR OG1 : rot 72:sc= -0.435 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -80:sc= -0.366 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 66:sc= 0.525 USER MOD Single : A 111 THR OG1 : rot 180:sc= -1.35! USER MOD Single : A 112 TYR OH : rot 2:sc= -3.95! USER MOD Single : A 138 THR OG1 : rot -25:sc= -1.21! USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -9.393 5.692 8.297 1.00 0.00 N ATOM 25 CA PRO A 3 -8.417 5.762 7.187 1.00 0.00 C ATOM 26 C PRO A 3 -6.990 5.676 7.735 1.00 0.00 C ATOM 27 O PRO A 3 -6.757 5.158 8.809 1.00 0.00 O ATOM 28 CB PRO A 3 -8.686 7.130 6.563 1.00 0.00 C ATOM 29 CG PRO A 3 -9.290 7.950 7.658 1.00 0.00 C ATOM 30 CD PRO A 3 -9.970 7.001 8.612 1.00 0.00 C ATOM 0 HA PRO A 3 -8.516 4.948 6.468 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.765 7.582 6.195 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.363 7.048 5.713 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -8.522 8.527 8.173 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.006 8.664 7.252 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -9.783 7.278 9.649 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -11.051 7.003 8.472 1.00 0.00 H new ATOM 38 N ILE A 4 -6.034 6.178 7.007 1.00 0.00 N ATOM 39 CA ILE A 4 -4.623 6.124 7.486 1.00 0.00 C ATOM 40 C ILE A 4 -4.053 7.541 7.608 1.00 0.00 C ATOM 41 O ILE A 4 -2.936 7.736 8.044 1.00 0.00 O ATOM 42 CB ILE A 4 -3.868 5.327 6.418 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.648 6.204 5.182 1.00 0.00 C ATOM 44 CG2 ILE A 4 -4.686 4.094 6.024 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.003 5.372 4.072 1.00 0.00 C ATOM 0 H ILE A 4 -6.167 6.624 6.100 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.538 5.662 8.470 1.00 0.00 H new ATOM 0 HB ILE A 4 -2.904 5.013 6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.599 6.612 4.839 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.010 7.051 5.433 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.148 3.528 5.264 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.843 3.466 6.901 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.651 4.409 5.626 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.847 5.997 3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.044 4.986 4.417 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.658 4.540 3.814 1.00 0.00 H new ATOM 57 N GLY A 5 -4.813 8.531 7.225 1.00 0.00 N ATOM 58 CA GLY A 5 -4.317 9.933 7.317 1.00 0.00 C ATOM 59 C GLY A 5 -3.777 10.374 5.956 1.00 0.00 C ATOM 60 O GLY A 5 -3.118 9.622 5.266 1.00 0.00 O ATOM 0 H GLY A 5 -5.757 8.429 6.852 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -5.123 10.595 7.632 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -3.533 10.004 8.071 1.00 0.00 H new ATOM 64 N GLU A 6 -4.051 11.588 5.563 1.00 0.00 N ATOM 65 CA GLU A 6 -3.551 12.076 4.245 1.00 0.00 C ATOM 66 C GLU A 6 -2.100 11.637 4.037 1.00 0.00 C ATOM 67 O GLU A 6 -1.830 10.617 3.433 1.00 0.00 O ATOM 68 CB GLU A 6 -3.645 13.600 4.325 1.00 0.00 C ATOM 69 CG GLU A 6 -4.857 14.080 3.525 1.00 0.00 C ATOM 70 CD GLU A 6 -5.872 14.722 4.472 1.00 0.00 C ATOM 71 OE1 GLU A 6 -5.446 15.367 5.416 1.00 0.00 O ATOM 72 OE2 GLU A 6 -7.058 14.559 4.237 1.00 0.00 O ATOM 0 H GLU A 6 -4.599 12.263 6.097 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.127 11.677 3.410 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -3.734 13.915 5.365 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.734 14.052 3.932 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.545 14.799 2.768 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -5.314 13.242 2.999 1.00 0.00 H new ATOM 79 N GLY A 7 -1.163 12.396 4.535 1.00 0.00 N ATOM 80 CA GLY A 7 0.269 12.017 4.367 1.00 0.00 C ATOM 81 C GLY A 7 0.639 10.965 5.413 1.00 0.00 C ATOM 82 O GLY A 7 0.414 11.145 6.593 1.00 0.00 O ATOM 0 H GLY A 7 -1.326 13.261 5.050 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.438 11.625 3.364 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.905 12.895 4.477 1.00 0.00 H new ATOM 86 N THR A 8 1.201 9.864 4.993 1.00 0.00 N ATOM 87 CA THR A 8 1.576 8.805 5.974 1.00 0.00 C ATOM 88 C THR A 8 3.092 8.759 6.164 1.00 0.00 C ATOM 89 O THR A 8 3.845 9.291 5.374 1.00 0.00 O ATOM 90 CB THR A 8 1.074 7.496 5.365 1.00 0.00 C ATOM 91 OG1 THR A 8 1.935 7.108 4.304 1.00 0.00 O ATOM 92 CG2 THR A 8 -0.344 7.691 4.832 1.00 0.00 C ATOM 0 H THR A 8 1.416 9.652 4.019 1.00 0.00 H new ATOM 0 HA THR A 8 1.142 8.991 6.956 1.00 0.00 H new ATOM 0 HB THR A 8 1.067 6.718 6.128 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.582 6.450 4.632 1.00 0.00 H new ATOM 0 HG21 THR A 8 -0.701 6.757 4.398 1.00 0.00 H new ATOM 0 HG22 THR A 8 -1.002 7.987 5.649 1.00 0.00 H new ATOM 0 HG23 THR A 8 -0.342 8.469 4.068 1.00 0.00 H new ATOM 100 N PHE A 9 3.542 8.121 7.210 1.00 0.00 N ATOM 101 CA PHE A 9 5.008 8.030 7.459 1.00 0.00 C ATOM 102 C PHE A 9 5.581 9.417 7.758 1.00 0.00 C ATOM 103 O PHE A 9 6.779 9.603 7.825 1.00 0.00 O ATOM 104 CB PHE A 9 5.604 7.466 6.167 1.00 0.00 C ATOM 105 CG PHE A 9 4.729 6.346 5.652 1.00 0.00 C ATOM 106 CD1 PHE A 9 3.986 5.570 6.550 1.00 0.00 C ATOM 107 CD2 PHE A 9 4.657 6.087 4.278 1.00 0.00 C ATOM 108 CE1 PHE A 9 3.172 4.535 6.074 1.00 0.00 C ATOM 109 CE2 PHE A 9 3.844 5.051 3.802 1.00 0.00 C ATOM 110 CZ PHE A 9 3.101 4.276 4.700 1.00 0.00 C ATOM 0 H PHE A 9 2.956 7.658 7.904 1.00 0.00 H new ATOM 0 HA PHE A 9 5.240 7.400 8.318 1.00 0.00 H new ATOM 0 HB2 PHE A 9 5.683 8.253 5.417 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.613 7.098 6.351 1.00 0.00 H new ATOM 0 HD1 PHE A 9 4.041 5.770 7.610 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.229 6.686 3.585 1.00 0.00 H new ATOM 0 HE1 PHE A 9 2.599 3.937 6.767 1.00 0.00 H new ATOM 0 HE2 PHE A 9 3.790 4.850 2.742 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.473 3.478 4.333 1.00 0.00 H new ATOM 120 N ASP A 10 4.734 10.393 7.947 1.00 0.00 N ATOM 121 CA ASP A 10 5.233 11.765 8.250 1.00 0.00 C ATOM 122 C ASP A 10 5.468 11.913 9.756 1.00 0.00 C ATOM 123 O ASP A 10 5.148 12.926 10.345 1.00 0.00 O ATOM 124 CB ASP A 10 4.120 12.705 7.785 1.00 0.00 C ATOM 125 CG ASP A 10 2.935 12.611 8.748 1.00 0.00 C ATOM 126 OD1 ASP A 10 2.128 11.712 8.578 1.00 0.00 O ATOM 127 OD2 ASP A 10 2.855 13.440 9.639 1.00 0.00 O ATOM 0 H ASP A 10 3.719 10.300 7.905 1.00 0.00 H new ATOM 0 HA ASP A 10 6.179 11.982 7.754 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.489 13.730 7.745 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.804 12.440 6.776 1.00 0.00 H new ATOM 132 N ASP A 11 6.028 10.902 10.374 1.00 0.00 N ATOM 133 CA ASP A 11 6.299 10.941 11.846 1.00 0.00 C ATOM 134 C ASP A 11 6.506 9.511 12.357 1.00 0.00 C ATOM 135 O ASP A 11 7.146 9.287 13.366 1.00 0.00 O ATOM 136 CB ASP A 11 5.049 11.562 12.489 1.00 0.00 C ATOM 137 CG ASP A 11 4.983 11.185 13.972 1.00 0.00 C ATOM 138 OD1 ASP A 11 5.826 11.653 14.720 1.00 0.00 O ATOM 139 OD2 ASP A 11 4.092 10.434 14.333 1.00 0.00 O ATOM 0 H ASP A 11 6.313 10.038 9.914 1.00 0.00 H new ATOM 0 HA ASP A 11 7.192 11.518 12.086 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.075 12.646 12.381 1.00 0.00 H new ATOM 0 HB3 ASP A 11 4.153 11.212 11.976 1.00 0.00 H new ATOM 144 N GLY A 12 5.968 8.544 11.664 1.00 0.00 N ATOM 145 CA GLY A 12 6.129 7.129 12.102 1.00 0.00 C ATOM 146 C GLY A 12 5.263 6.222 11.225 1.00 0.00 C ATOM 147 O GLY A 12 4.378 6.686 10.534 1.00 0.00 O ATOM 0 H GLY A 12 5.423 8.674 10.812 1.00 0.00 H new ATOM 0 HA2 GLY A 12 7.175 6.832 12.030 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.840 7.026 13.148 1.00 0.00 H new ATOM 151 N PRO A 13 5.551 4.950 11.286 1.00 0.00 N ATOM 152 CA PRO A 13 4.793 3.953 10.491 1.00 0.00 C ATOM 153 C PRO A 13 3.380 3.783 11.054 1.00 0.00 C ATOM 154 O PRO A 13 3.112 2.866 11.804 1.00 0.00 O ATOM 155 CB PRO A 13 5.604 2.671 10.653 1.00 0.00 C ATOM 156 CG PRO A 13 6.348 2.848 11.937 1.00 0.00 C ATOM 157 CD PRO A 13 6.602 4.325 12.096 1.00 0.00 C ATOM 0 HA PRO A 13 4.670 4.242 9.447 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.956 1.795 10.689 1.00 0.00 H new ATOM 0 HB3 PRO A 13 6.288 2.527 9.816 1.00 0.00 H new ATOM 0 HG2 PRO A 13 5.768 2.464 12.776 1.00 0.00 H new ATOM 0 HG3 PRO A 13 7.287 2.295 11.919 1.00 0.00 H new ATOM 0 HD2 PRO A 13 6.538 4.632 13.140 1.00 0.00 H new ATOM 0 HD3 PRO A 13 7.596 4.600 11.743 1.00 0.00 H new ATOM 165 N GLU A 14 2.485 4.673 10.701 1.00 0.00 N ATOM 166 CA GLU A 14 1.078 4.595 11.207 1.00 0.00 C ATOM 167 C GLU A 14 0.654 3.143 11.439 1.00 0.00 C ATOM 168 O GLU A 14 0.453 2.716 12.558 1.00 0.00 O ATOM 169 CB GLU A 14 0.230 5.226 10.103 1.00 0.00 C ATOM 170 CG GLU A 14 -0.939 5.989 10.729 1.00 0.00 C ATOM 171 CD GLU A 14 -0.633 7.488 10.722 1.00 0.00 C ATOM 172 OE1 GLU A 14 0.311 7.877 10.054 1.00 0.00 O ATOM 173 OE2 GLU A 14 -1.349 8.222 11.384 1.00 0.00 O ATOM 0 H GLU A 14 2.671 5.458 10.077 1.00 0.00 H new ATOM 0 HA GLU A 14 0.964 5.105 12.164 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.840 5.902 9.503 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.144 4.454 9.431 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -1.855 5.792 10.173 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.106 5.646 11.750 1.00 0.00 H new ATOM 180 N GLY A 15 0.514 2.383 10.392 1.00 0.00 N ATOM 181 CA GLY A 15 0.100 0.960 10.560 1.00 0.00 C ATOM 182 C GLY A 15 0.635 0.113 9.402 1.00 0.00 C ATOM 183 O GLY A 15 0.213 -1.008 9.199 1.00 0.00 O ATOM 0 H GLY A 15 0.667 2.682 9.429 1.00 0.00 H new ATOM 0 HA2 GLY A 15 0.477 0.574 11.507 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.987 0.892 10.598 1.00 0.00 H new ATOM 187 N TRP A 16 1.557 0.633 8.639 1.00 0.00 N ATOM 188 CA TRP A 16 2.106 -0.155 7.499 1.00 0.00 C ATOM 189 C TRP A 16 3.110 -1.192 8.007 1.00 0.00 C ATOM 190 O TRP A 16 4.191 -0.859 8.450 1.00 0.00 O ATOM 191 CB TRP A 16 2.802 0.871 6.605 1.00 0.00 C ATOM 192 CG TRP A 16 1.802 1.477 5.676 1.00 0.00 C ATOM 193 CD1 TRP A 16 0.950 2.476 5.999 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.532 1.142 4.284 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.176 2.778 4.894 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.496 1.982 3.812 1.00 0.00 C ATOM 197 CE3 TRP A 16 2.080 0.200 3.394 1.00 0.00 C ATOM 198 CZ2 TRP A 16 0.020 1.891 2.503 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.604 0.106 2.076 1.00 0.00 C ATOM 200 CH2 TRP A 16 0.576 0.950 1.632 1.00 0.00 C ATOM 0 H TRP A 16 1.953 1.566 8.755 1.00 0.00 H new ATOM 0 HA TRP A 16 1.329 -0.701 6.964 1.00 0.00 H new ATOM 0 HB2 TRP A 16 3.265 1.647 7.215 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.600 0.393 6.037 1.00 0.00 H new ATOM 0 HD1 TRP A 16 0.885 2.959 6.963 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -0.544 3.501 4.880 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.872 -0.455 3.727 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.772 2.543 2.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 2.032 -0.620 1.401 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.214 0.873 0.617 1.00 0.00 H new ATOM 211 N VAL A 17 2.761 -2.448 7.947 1.00 0.00 N ATOM 212 CA VAL A 17 3.699 -3.503 8.427 1.00 0.00 C ATOM 213 C VAL A 17 4.409 -4.154 7.239 1.00 0.00 C ATOM 214 O VAL A 17 3.783 -4.637 6.319 1.00 0.00 O ATOM 215 CB VAL A 17 2.824 -4.526 9.161 1.00 0.00 C ATOM 216 CG1 VAL A 17 1.766 -3.798 9.995 1.00 0.00 C ATOM 217 CG2 VAL A 17 2.129 -5.443 8.146 1.00 0.00 C ATOM 0 H VAL A 17 1.869 -2.789 7.587 1.00 0.00 H new ATOM 0 HA VAL A 17 4.473 -3.098 9.079 1.00 0.00 H new ATOM 0 HB VAL A 17 3.455 -5.126 9.817 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.146 -4.529 10.515 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.257 -3.154 10.725 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.140 -3.192 9.340 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.509 -6.167 8.675 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.503 -4.845 7.484 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.880 -5.970 7.557 1.00 0.00 H new ATOM 227 N ALA A 18 5.709 -4.176 7.253 1.00 0.00 N ATOM 228 CA ALA A 18 6.449 -4.801 6.122 1.00 0.00 C ATOM 229 C ALA A 18 6.987 -6.170 6.539 1.00 0.00 C ATOM 230 O ALA A 18 7.767 -6.287 7.463 1.00 0.00 O ATOM 231 CB ALA A 18 7.594 -3.840 5.816 1.00 0.00 C ATOM 0 H ALA A 18 6.292 -3.790 7.996 1.00 0.00 H new ATOM 0 HA ALA A 18 5.815 -4.962 5.250 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.188 -4.232 4.990 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.188 -2.867 5.541 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.225 -3.734 6.698 1.00 0.00 H new ATOM 237 N TYR A 19 6.571 -7.208 5.868 1.00 0.00 N ATOM 238 CA TYR A 19 7.055 -8.569 6.231 1.00 0.00 C ATOM 239 C TYR A 19 7.941 -9.136 5.119 1.00 0.00 C ATOM 240 O TYR A 19 7.750 -8.854 3.953 1.00 0.00 O ATOM 241 CB TYR A 19 5.788 -9.411 6.400 1.00 0.00 C ATOM 242 CG TYR A 19 4.963 -9.375 5.131 1.00 0.00 C ATOM 243 CD1 TYR A 19 5.443 -9.983 3.964 1.00 0.00 C ATOM 244 CD2 TYR A 19 3.711 -8.746 5.126 1.00 0.00 C ATOM 245 CE1 TYR A 19 4.674 -9.960 2.794 1.00 0.00 C ATOM 246 CE2 TYR A 19 2.942 -8.726 3.957 1.00 0.00 C ATOM 247 CZ TYR A 19 3.423 -9.332 2.791 1.00 0.00 C ATOM 248 OH TYR A 19 2.665 -9.312 1.638 1.00 0.00 O ATOM 0 H TYR A 19 5.918 -7.173 5.085 1.00 0.00 H new ATOM 0 HA TYR A 19 7.660 -8.562 7.138 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.056 -10.440 6.639 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.200 -9.032 7.236 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.407 -10.470 3.967 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.339 -8.276 6.025 1.00 0.00 H new ATOM 0 HE1 TYR A 19 5.046 -10.427 1.894 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.976 -8.242 3.955 1.00 0.00 H new ATOM 0 HH TYR A 19 1.824 -8.838 1.807 1.00 0.00 H new ATOM 258 N GLY A 20 8.911 -9.935 5.473 1.00 0.00 N ATOM 259 CA GLY A 20 9.810 -10.525 4.441 1.00 0.00 C ATOM 260 C GLY A 20 11.087 -9.692 4.328 1.00 0.00 C ATOM 261 O GLY A 20 11.649 -9.544 3.261 1.00 0.00 O ATOM 0 H GLY A 20 9.120 -10.205 6.434 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.058 -11.553 4.706 1.00 0.00 H new ATOM 0 HA3 GLY A 20 9.300 -10.558 3.478 1.00 0.00 H new ATOM 265 N THR A 21 11.554 -9.147 5.418 1.00 0.00 N ATOM 266 CA THR A 21 12.799 -8.326 5.360 1.00 0.00 C ATOM 267 C THR A 21 13.555 -8.408 6.689 1.00 0.00 C ATOM 268 O THR A 21 13.537 -9.419 7.364 1.00 0.00 O ATOM 269 CB THR A 21 12.325 -6.894 5.101 1.00 0.00 C ATOM 270 OG1 THR A 21 11.855 -6.326 6.316 1.00 0.00 O ATOM 271 CG2 THR A 21 11.198 -6.897 4.067 1.00 0.00 C ATOM 0 H THR A 21 11.131 -9.233 6.342 1.00 0.00 H new ATOM 0 HA THR A 21 13.482 -8.675 4.585 1.00 0.00 H new ATOM 0 HB THR A 21 13.157 -6.303 4.719 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.553 -5.408 6.153 1.00 0.00 H new ATOM 0 HG21 THR A 21 10.866 -5.874 3.888 1.00 0.00 H new ATOM 0 HG22 THR A 21 11.561 -7.329 3.135 1.00 0.00 H new ATOM 0 HG23 THR A 21 10.363 -7.490 4.441 1.00 0.00 H new ATOM 279 N ASP A 22 14.223 -7.352 7.066 1.00 0.00 N ATOM 280 CA ASP A 22 14.986 -7.368 8.348 1.00 0.00 C ATOM 281 C ASP A 22 14.099 -6.890 9.501 1.00 0.00 C ATOM 282 O ASP A 22 13.684 -5.749 9.545 1.00 0.00 O ATOM 283 CB ASP A 22 16.147 -6.398 8.128 1.00 0.00 C ATOM 284 CG ASP A 22 17.103 -6.467 9.320 1.00 0.00 C ATOM 285 OD1 ASP A 22 16.856 -7.267 10.207 1.00 0.00 O ATOM 286 OD2 ASP A 22 18.067 -5.718 9.326 1.00 0.00 O ATOM 0 H ASP A 22 14.274 -6.478 6.542 1.00 0.00 H new ATOM 0 HA ASP A 22 15.332 -8.368 8.609 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.676 -6.650 7.209 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.769 -5.383 8.010 1.00 0.00 H new ATOM 291 N GLY A 23 13.809 -7.754 10.436 1.00 0.00 N ATOM 292 CA GLY A 23 12.953 -7.350 11.588 1.00 0.00 C ATOM 293 C GLY A 23 11.775 -6.515 11.085 1.00 0.00 C ATOM 294 O GLY A 23 11.378 -6.624 9.942 1.00 0.00 O ATOM 0 H GLY A 23 14.128 -8.723 10.452 1.00 0.00 H new ATOM 0 HA2 GLY A 23 12.588 -8.234 12.110 1.00 0.00 H new ATOM 0 HA3 GLY A 23 13.539 -6.775 12.305 1.00 0.00 H new ATOM 298 N PRO A 24 11.253 -5.704 11.966 1.00 0.00 N ATOM 299 CA PRO A 24 10.104 -4.834 11.616 1.00 0.00 C ATOM 300 C PRO A 24 10.558 -3.684 10.712 1.00 0.00 C ATOM 301 O PRO A 24 11.716 -3.315 10.694 1.00 0.00 O ATOM 302 CB PRO A 24 9.630 -4.308 12.968 1.00 0.00 C ATOM 303 CG PRO A 24 10.830 -4.386 13.858 1.00 0.00 C ATOM 304 CD PRO A 24 11.682 -5.524 13.357 1.00 0.00 C ATOM 0 HA PRO A 24 9.321 -5.358 11.068 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.265 -3.284 12.887 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.809 -4.909 13.359 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.387 -3.449 13.836 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.532 -4.555 14.893 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.744 -5.285 13.419 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.524 -6.429 13.944 1.00 0.00 H new ATOM 312 N LEU A 25 9.654 -3.114 9.963 1.00 0.00 N ATOM 313 CA LEU A 25 10.034 -1.988 9.061 1.00 0.00 C ATOM 314 C LEU A 25 10.750 -0.892 9.856 1.00 0.00 C ATOM 315 O LEU A 25 10.938 -1.001 11.051 1.00 0.00 O ATOM 316 CB LEU A 25 8.710 -1.467 8.501 1.00 0.00 C ATOM 317 CG LEU A 25 7.853 -0.919 9.643 1.00 0.00 C ATOM 318 CD1 LEU A 25 7.150 0.360 9.185 1.00 0.00 C ATOM 319 CD2 LEU A 25 6.805 -1.962 10.038 1.00 0.00 C ATOM 0 H LEU A 25 8.669 -3.379 9.936 1.00 0.00 H new ATOM 0 HA LEU A 25 10.716 -2.303 8.271 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.897 -0.685 7.765 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.180 -2.269 7.987 1.00 0.00 H new ATOM 0 HG LEU A 25 8.488 -0.697 10.500 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.539 0.751 9.999 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.895 1.103 8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.514 0.139 8.328 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.193 -1.573 10.852 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.170 -2.183 9.180 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.305 -2.874 10.364 1.00 0.00 H new ATOM 331 N ASP A 26 11.150 0.163 9.201 1.00 0.00 N ATOM 332 CA ASP A 26 11.853 1.265 9.918 1.00 0.00 C ATOM 333 C ASP A 26 11.625 2.595 9.196 1.00 0.00 C ATOM 334 O ASP A 26 11.588 2.655 7.983 1.00 0.00 O ATOM 335 CB ASP A 26 13.332 0.881 9.882 1.00 0.00 C ATOM 336 CG ASP A 26 13.833 0.640 11.307 1.00 0.00 C ATOM 337 OD1 ASP A 26 13.251 -0.190 11.986 1.00 0.00 O ATOM 338 OD2 ASP A 26 14.790 1.289 11.696 1.00 0.00 O ATOM 0 H ASP A 26 11.021 0.310 8.200 1.00 0.00 H new ATOM 0 HA ASP A 26 11.490 1.392 10.938 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.471 -0.017 9.280 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.913 1.674 9.410 1.00 0.00 H new ATOM 343 N THR A 27 11.468 3.660 9.932 1.00 0.00 N ATOM 344 CA THR A 27 11.239 4.983 9.291 1.00 0.00 C ATOM 345 C THR A 27 12.357 5.955 9.680 1.00 0.00 C ATOM 346 O THR A 27 13.286 6.180 8.930 1.00 0.00 O ATOM 347 CB THR A 27 9.898 5.455 9.852 1.00 0.00 C ATOM 348 OG1 THR A 27 9.809 5.093 11.223 1.00 0.00 O ATOM 349 CG2 THR A 27 8.755 4.800 9.074 1.00 0.00 C ATOM 0 H THR A 27 11.489 3.670 10.952 1.00 0.00 H new ATOM 0 HA THR A 27 11.232 4.927 8.202 1.00 0.00 H new ATOM 0 HB THR A 27 9.824 6.538 9.754 1.00 0.00 H new ATOM 0 HG1 THR A 27 9.337 5.796 11.717 1.00 0.00 H new ATOM 0 HG21 THR A 27 7.800 5.138 9.476 1.00 0.00 H new ATOM 0 HG22 THR A 27 8.825 5.078 8.022 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.825 3.716 9.168 1.00 0.00 H new ATOM 357 N SER A 28 12.275 6.526 10.851 1.00 0.00 N ATOM 358 CA SER A 28 13.331 7.481 11.299 1.00 0.00 C ATOM 359 C SER A 28 13.767 8.386 10.142 1.00 0.00 C ATOM 360 O SER A 28 14.883 8.865 10.104 1.00 0.00 O ATOM 361 CB SER A 28 14.493 6.599 11.753 1.00 0.00 C ATOM 362 OG SER A 28 14.545 5.436 10.937 1.00 0.00 O ATOM 0 H SER A 28 11.520 6.372 11.519 1.00 0.00 H new ATOM 0 HA SER A 28 12.977 8.138 12.094 1.00 0.00 H new ATOM 0 HB2 SER A 28 15.431 7.149 11.683 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.365 6.319 12.799 1.00 0.00 H new ATOM 0 HG SER A 28 14.641 5.699 9.998 1.00 0.00 H new ATOM 368 N THR A 29 12.898 8.624 9.198 1.00 0.00 N ATOM 369 CA THR A 29 13.270 9.499 8.048 1.00 0.00 C ATOM 370 C THR A 29 12.040 10.253 7.532 1.00 0.00 C ATOM 371 O THR A 29 12.054 10.820 6.458 1.00 0.00 O ATOM 372 CB THR A 29 13.799 8.542 6.978 1.00 0.00 C ATOM 373 OG1 THR A 29 14.310 9.292 5.885 1.00 0.00 O ATOM 374 CG2 THR A 29 12.665 7.638 6.493 1.00 0.00 C ATOM 0 H THR A 29 11.949 8.252 9.172 1.00 0.00 H new ATOM 0 HA THR A 29 14.008 10.251 8.325 1.00 0.00 H new ATOM 0 HB THR A 29 14.594 7.928 7.401 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.740 10.074 5.730 1.00 0.00 H new ATOM 0 HG21 THR A 29 13.043 6.957 5.731 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.274 7.063 7.332 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.868 8.249 6.070 1.00 0.00 H new ATOM 382 N GLY A 30 10.977 10.261 8.288 1.00 0.00 N ATOM 383 CA GLY A 30 9.749 10.975 7.839 1.00 0.00 C ATOM 384 C GLY A 30 9.049 10.149 6.760 1.00 0.00 C ATOM 385 O GLY A 30 8.102 10.593 6.140 1.00 0.00 O ATOM 0 H GLY A 30 10.906 9.804 9.197 1.00 0.00 H new ATOM 0 HA2 GLY A 30 9.078 11.134 8.683 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.009 11.959 7.448 1.00 0.00 H new ATOM 389 N ALA A 31 9.507 8.949 6.529 1.00 0.00 N ATOM 390 CA ALA A 31 8.871 8.093 5.490 1.00 0.00 C ATOM 391 C ALA A 31 9.019 6.616 5.862 1.00 0.00 C ATOM 392 O ALA A 31 9.961 6.227 6.523 1.00 0.00 O ATOM 393 CB ALA A 31 9.640 8.403 4.207 1.00 0.00 C ATOM 0 H ALA A 31 10.296 8.524 7.017 1.00 0.00 H new ATOM 0 HA ALA A 31 7.804 8.288 5.385 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.233 7.811 3.387 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.544 9.463 3.972 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.693 8.156 4.345 1.00 0.00 H new ATOM 399 N LEU A 32 8.102 5.788 5.442 1.00 0.00 N ATOM 400 CA LEU A 32 8.205 4.338 5.776 1.00 0.00 C ATOM 401 C LEU A 32 9.198 3.658 4.833 1.00 0.00 C ATOM 402 O LEU A 32 8.977 3.573 3.641 1.00 0.00 O ATOM 403 CB LEU A 32 6.799 3.777 5.571 1.00 0.00 C ATOM 404 CG LEU A 32 6.690 2.417 6.263 1.00 0.00 C ATOM 405 CD1 LEU A 32 5.618 2.481 7.352 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.310 1.350 5.233 1.00 0.00 C ATOM 0 H LEU A 32 7.289 6.051 4.884 1.00 0.00 H new ATOM 0 HA LEU A 32 8.560 4.171 6.793 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.058 4.465 5.978 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.588 3.674 4.507 1.00 0.00 H new ATOM 0 HG LEU A 32 7.649 2.162 6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.541 1.512 7.844 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.889 3.240 8.086 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.658 2.737 6.903 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.232 0.381 5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.352 1.606 4.781 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.075 1.303 4.458 1.00 0.00 H new ATOM 418 N CYS A 33 10.294 3.180 5.352 1.00 0.00 N ATOM 419 CA CYS A 33 11.297 2.515 4.475 1.00 0.00 C ATOM 420 C CYS A 33 11.535 1.070 4.922 1.00 0.00 C ATOM 421 O CYS A 33 11.990 0.815 6.020 1.00 0.00 O ATOM 422 CB CYS A 33 12.572 3.344 4.634 1.00 0.00 C ATOM 423 SG CYS A 33 12.371 4.929 3.783 1.00 0.00 S ATOM 0 H CYS A 33 10.538 3.221 6.342 1.00 0.00 H new ATOM 0 HA CYS A 33 10.965 2.468 3.438 1.00 0.00 H new ATOM 0 HB2 CYS A 33 12.781 3.510 5.691 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.424 2.803 4.222 1.00 0.00 H new ATOM 428 N VAL A 34 11.242 0.124 4.072 1.00 0.00 N ATOM 429 CA VAL A 34 11.463 -1.305 4.439 1.00 0.00 C ATOM 430 C VAL A 34 12.775 -1.794 3.821 1.00 0.00 C ATOM 431 O VAL A 34 13.066 -1.525 2.673 1.00 0.00 O ATOM 432 CB VAL A 34 10.270 -2.064 3.854 1.00 0.00 C ATOM 433 CG1 VAL A 34 9.007 -1.713 4.643 1.00 0.00 C ATOM 434 CG2 VAL A 34 10.078 -1.671 2.387 1.00 0.00 C ATOM 0 H VAL A 34 10.859 0.278 3.139 1.00 0.00 H new ATOM 0 HA VAL A 34 11.537 -1.454 5.516 1.00 0.00 H new ATOM 0 HB VAL A 34 10.457 -3.136 3.920 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.156 -2.253 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.140 -1.995 5.687 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.823 -0.641 4.577 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.228 -2.213 1.973 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.893 -0.599 2.319 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.977 -1.921 1.823 1.00 0.00 H new ATOM 444 N ALA A 35 13.575 -2.497 4.574 1.00 0.00 N ATOM 445 CA ALA A 35 14.876 -2.982 4.030 1.00 0.00 C ATOM 446 C ALA A 35 14.720 -4.355 3.371 1.00 0.00 C ATOM 447 O ALA A 35 14.885 -5.379 4.004 1.00 0.00 O ATOM 448 CB ALA A 35 15.798 -3.077 5.246 1.00 0.00 C ATOM 0 H ALA A 35 13.385 -2.757 5.542 1.00 0.00 H new ATOM 0 HA ALA A 35 15.267 -2.315 3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.781 -3.428 4.931 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.895 -2.094 5.707 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.377 -3.776 5.968 1.00 0.00 H new ATOM 454 N VAL A 36 14.421 -4.385 2.100 1.00 0.00 N ATOM 455 CA VAL A 36 14.275 -5.695 1.402 1.00 0.00 C ATOM 456 C VAL A 36 15.650 -6.362 1.277 1.00 0.00 C ATOM 457 O VAL A 36 16.622 -5.720 0.930 1.00 0.00 O ATOM 458 CB VAL A 36 13.706 -5.350 0.025 1.00 0.00 C ATOM 459 CG1 VAL A 36 13.737 -6.592 -0.865 1.00 0.00 C ATOM 460 CG2 VAL A 36 12.259 -4.874 0.174 1.00 0.00 C ATOM 0 H VAL A 36 14.272 -3.562 1.516 1.00 0.00 H new ATOM 0 HA VAL A 36 13.628 -6.390 1.936 1.00 0.00 H new ATOM 0 HB VAL A 36 14.307 -4.560 -0.426 1.00 0.00 H new ATOM 0 HG11 VAL A 36 13.331 -6.346 -1.847 1.00 0.00 H new ATOM 0 HG12 VAL A 36 14.765 -6.937 -0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 36 13.136 -7.380 -0.411 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.854 -4.628 -0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.660 -5.665 0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.231 -3.989 0.810 1.00 0.00 H new ATOM 470 N PRO A 37 15.686 -7.630 1.585 1.00 0.00 N ATOM 471 CA PRO A 37 16.959 -8.392 1.531 1.00 0.00 C ATOM 472 C PRO A 37 17.342 -8.736 0.087 1.00 0.00 C ATOM 473 O PRO A 37 16.498 -8.863 -0.778 1.00 0.00 O ATOM 474 CB PRO A 37 16.648 -9.657 2.326 1.00 0.00 C ATOM 475 CG PRO A 37 15.162 -9.827 2.238 1.00 0.00 C ATOM 476 CD PRO A 37 14.556 -8.466 2.005 1.00 0.00 C ATOM 0 HA PRO A 37 17.803 -7.830 1.931 1.00 0.00 H new ATOM 0 HB2 PRO A 37 17.167 -10.520 1.910 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.972 -9.559 3.362 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.902 -10.505 1.425 1.00 0.00 H new ATOM 0 HG3 PRO A 37 14.773 -10.267 3.156 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.782 -8.502 1.239 1.00 0.00 H new ATOM 0 HD3 PRO A 37 14.090 -8.078 2.911 1.00 0.00 H new ATOM 484 N ALA A 38 18.614 -8.895 -0.174 1.00 0.00 N ATOM 485 CA ALA A 38 19.059 -9.239 -1.557 1.00 0.00 C ATOM 486 C ALA A 38 18.153 -10.320 -2.140 1.00 0.00 C ATOM 487 O ALA A 38 17.886 -11.324 -1.509 1.00 0.00 O ATOM 488 CB ALA A 38 20.487 -9.761 -1.400 1.00 0.00 C ATOM 0 H ALA A 38 19.364 -8.801 0.511 1.00 0.00 H new ATOM 0 HA ALA A 38 19.015 -8.384 -2.232 1.00 0.00 H new ATOM 0 HB1 ALA A 38 20.884 -10.035 -2.378 1.00 0.00 H new ATOM 0 HB2 ALA A 38 21.112 -8.984 -0.960 1.00 0.00 H new ATOM 0 HB3 ALA A 38 20.485 -10.636 -0.751 1.00 0.00 H new ATOM 494 N GLY A 39 17.671 -10.123 -3.335 1.00 0.00 N ATOM 495 CA GLY A 39 16.775 -11.141 -3.944 1.00 0.00 C ATOM 496 C GLY A 39 15.748 -11.577 -2.901 1.00 0.00 C ATOM 497 O GLY A 39 15.871 -12.622 -2.294 1.00 0.00 O ATOM 0 H GLY A 39 17.858 -9.304 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 39 16.273 -10.727 -4.819 1.00 0.00 H new ATOM 0 HA3 GLY A 39 17.355 -11.999 -4.285 1.00 0.00 H new ATOM 501 N SER A 40 14.741 -10.778 -2.678 1.00 0.00 N ATOM 502 CA SER A 40 13.710 -11.142 -1.664 1.00 0.00 C ATOM 503 C SER A 40 12.674 -12.096 -2.271 1.00 0.00 C ATOM 504 O SER A 40 11.492 -11.990 -2.013 1.00 0.00 O ATOM 505 CB SER A 40 13.062 -9.815 -1.271 1.00 0.00 C ATOM 506 OG SER A 40 11.858 -9.641 -2.004 1.00 0.00 O ATOM 0 H SER A 40 14.587 -9.889 -3.154 1.00 0.00 H new ATOM 0 HA SER A 40 14.139 -11.657 -0.804 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.854 -9.802 -0.201 1.00 0.00 H new ATOM 0 HB3 SER A 40 13.746 -8.990 -1.473 1.00 0.00 H new ATOM 0 HG SER A 40 11.888 -8.787 -2.484 1.00 0.00 H new ATOM 512 N ALA A 41 13.114 -13.031 -3.068 1.00 0.00 N ATOM 513 CA ALA A 41 12.165 -13.999 -3.687 1.00 0.00 C ATOM 514 C ALA A 41 12.350 -15.374 -3.060 1.00 0.00 C ATOM 515 O ALA A 41 12.052 -16.392 -3.651 1.00 0.00 O ATOM 516 CB ALA A 41 12.541 -14.035 -5.161 1.00 0.00 C ATOM 0 H ALA A 41 14.094 -13.166 -3.318 1.00 0.00 H new ATOM 0 HA ALA A 41 11.124 -13.712 -3.540 1.00 0.00 H new ATOM 0 HB1 ALA A 41 11.885 -14.728 -5.687 1.00 0.00 H new ATOM 0 HB2 ALA A 41 12.433 -13.038 -5.588 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.575 -14.364 -5.265 1.00 0.00 H new ATOM 522 N GLN A 42 12.840 -15.399 -1.862 1.00 0.00 N ATOM 523 CA GLN A 42 13.056 -16.703 -1.164 1.00 0.00 C ATOM 524 C GLN A 42 11.738 -17.243 -0.619 1.00 0.00 C ATOM 525 O GLN A 42 11.687 -18.278 0.016 1.00 0.00 O ATOM 526 CB GLN A 42 14.026 -16.393 -0.024 1.00 0.00 C ATOM 527 CG GLN A 42 13.291 -15.619 1.074 1.00 0.00 C ATOM 528 CD GLN A 42 14.290 -15.175 2.143 1.00 0.00 C ATOM 529 OE1 GLN A 42 15.250 -14.491 1.848 1.00 0.00 O ATOM 530 NE2 GLN A 42 14.105 -15.537 3.383 1.00 0.00 N ATOM 0 H GLN A 42 13.104 -14.573 -1.326 1.00 0.00 H new ATOM 0 HA GLN A 42 13.451 -17.465 -1.836 1.00 0.00 H new ATOM 0 HB2 GLN A 42 14.436 -17.318 0.381 1.00 0.00 H new ATOM 0 HB3 GLN A 42 14.867 -15.807 -0.396 1.00 0.00 H new ATOM 0 HG2 GLN A 42 12.789 -14.751 0.647 1.00 0.00 H new ATOM 0 HG3 GLN A 42 12.519 -16.246 1.521 1.00 0.00 H new ATOM 0 HE21 GLN A 42 13.300 -16.111 3.632 1.00 0.00 H new ATOM 0 HE22 GLN A 42 14.766 -15.246 4.103 1.00 0.00 H new ATOM 539 N TYR A 43 10.682 -16.547 -0.884 1.00 0.00 N ATOM 540 CA TYR A 43 9.335 -16.976 -0.415 1.00 0.00 C ATOM 541 C TYR A 43 8.305 -15.916 -0.825 1.00 0.00 C ATOM 542 O TYR A 43 7.165 -16.219 -1.117 1.00 0.00 O ATOM 543 CB TYR A 43 9.451 -17.100 1.115 1.00 0.00 C ATOM 544 CG TYR A 43 9.082 -15.798 1.785 1.00 0.00 C ATOM 545 CD1 TYR A 43 10.048 -14.801 1.959 1.00 0.00 C ATOM 546 CD2 TYR A 43 7.773 -15.592 2.231 1.00 0.00 C ATOM 547 CE1 TYR A 43 9.703 -13.595 2.580 1.00 0.00 C ATOM 548 CE2 TYR A 43 7.427 -14.388 2.852 1.00 0.00 C ATOM 549 CZ TYR A 43 8.391 -13.390 3.027 1.00 0.00 C ATOM 550 OH TYR A 43 8.047 -12.203 3.639 1.00 0.00 O ATOM 0 H TYR A 43 10.688 -15.678 -1.418 1.00 0.00 H new ATOM 0 HA TYR A 43 9.011 -17.922 -0.848 1.00 0.00 H new ATOM 0 HB2 TYR A 43 8.797 -17.896 1.471 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.469 -17.379 1.386 1.00 0.00 H new ATOM 0 HD1 TYR A 43 11.059 -14.962 1.614 1.00 0.00 H new ATOM 0 HD2 TYR A 43 7.029 -16.363 2.096 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.447 -12.824 2.714 1.00 0.00 H new ATOM 0 HE2 TYR A 43 6.416 -14.229 3.196 1.00 0.00 H new ATOM 0 HH TYR A 43 7.445 -12.385 4.391 1.00 0.00 H new ATOM 560 N GLY A 44 8.712 -14.674 -0.859 1.00 0.00 N ATOM 561 CA GLY A 44 7.773 -13.590 -1.261 1.00 0.00 C ATOM 562 C GLY A 44 7.685 -12.529 -0.160 1.00 0.00 C ATOM 563 O GLY A 44 7.037 -12.723 0.850 1.00 0.00 O ATOM 0 H GLY A 44 9.656 -14.365 -0.625 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.111 -13.132 -2.191 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.785 -14.008 -1.453 1.00 0.00 H new ATOM 567 N VAL A 45 8.311 -11.395 -0.354 1.00 0.00 N ATOM 568 CA VAL A 45 8.233 -10.318 0.676 1.00 0.00 C ATOM 569 C VAL A 45 7.026 -9.434 0.363 1.00 0.00 C ATOM 570 O VAL A 45 6.352 -9.640 -0.626 1.00 0.00 O ATOM 571 CB VAL A 45 9.535 -9.524 0.530 1.00 0.00 C ATOM 572 CG1 VAL A 45 9.615 -8.463 1.629 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.735 -10.469 0.649 1.00 0.00 C ATOM 0 H VAL A 45 8.870 -11.171 -1.177 1.00 0.00 H new ATOM 0 HA VAL A 45 8.118 -10.702 1.690 1.00 0.00 H new ATOM 0 HB VAL A 45 9.551 -9.040 -0.447 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.542 -7.899 1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.766 -7.785 1.543 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.594 -8.948 2.605 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.658 -9.899 0.544 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.718 -10.957 1.623 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.683 -11.223 -0.136 1.00 0.00 H new ATOM 583 N GLY A 46 6.734 -8.452 1.174 1.00 0.00 N ATOM 584 CA GLY A 46 5.560 -7.592 0.855 1.00 0.00 C ATOM 585 C GLY A 46 5.068 -6.829 2.086 1.00 0.00 C ATOM 586 O GLY A 46 5.001 -7.354 3.179 1.00 0.00 O ATOM 0 H GLY A 46 7.244 -8.212 2.024 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.830 -6.884 0.071 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.752 -8.210 0.462 1.00 0.00 H new ATOM 590 N VAL A 47 4.695 -5.591 1.896 1.00 0.00 N ATOM 591 CA VAL A 47 4.168 -4.774 3.023 1.00 0.00 C ATOM 592 C VAL A 47 2.640 -4.743 2.934 1.00 0.00 C ATOM 593 O VAL A 47 2.070 -5.043 1.904 1.00 0.00 O ATOM 594 CB VAL A 47 4.749 -3.376 2.805 1.00 0.00 C ATOM 595 CG1 VAL A 47 4.438 -2.497 4.017 1.00 0.00 C ATOM 596 CG2 VAL A 47 6.265 -3.477 2.624 1.00 0.00 C ATOM 0 H VAL A 47 4.734 -5.108 0.998 1.00 0.00 H new ATOM 0 HA VAL A 47 4.438 -5.168 4.003 1.00 0.00 H new ATOM 0 HB VAL A 47 4.304 -2.934 1.914 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.853 -1.501 3.860 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.358 -2.424 4.146 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.881 -2.938 4.910 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.680 -2.481 2.469 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.709 -3.920 3.515 1.00 0.00 H new ATOM 0 HG23 VAL A 47 6.487 -4.102 1.759 1.00 0.00 H new ATOM 606 N VAL A 48 1.966 -4.393 3.993 1.00 0.00 N ATOM 607 CA VAL A 48 0.474 -4.362 3.935 1.00 0.00 C ATOM 608 C VAL A 48 -0.090 -3.431 5.010 1.00 0.00 C ATOM 609 O VAL A 48 0.550 -3.151 6.004 1.00 0.00 O ATOM 610 CB VAL A 48 0.040 -5.804 4.198 1.00 0.00 C ATOM 611 CG1 VAL A 48 0.410 -6.679 2.998 1.00 0.00 C ATOM 612 CG2 VAL A 48 0.751 -6.330 5.447 1.00 0.00 C ATOM 0 H VAL A 48 2.376 -4.129 4.889 1.00 0.00 H new ATOM 0 HA VAL A 48 0.111 -3.989 2.977 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.039 -5.834 4.350 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.100 -7.707 3.188 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.094 -6.306 2.107 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.489 -6.648 2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.442 -7.358 5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.830 -6.297 5.293 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.488 -5.709 6.304 1.00 0.00 H new ATOM 622 N LEU A 49 -1.290 -2.951 4.817 1.00 0.00 N ATOM 623 CA LEU A 49 -1.899 -2.040 5.829 1.00 0.00 C ATOM 624 C LEU A 49 -3.425 -2.167 5.810 1.00 0.00 C ATOM 625 O LEU A 49 -4.065 -1.922 4.807 1.00 0.00 O ATOM 626 CB LEU A 49 -1.478 -0.633 5.405 1.00 0.00 C ATOM 627 CG LEU A 49 -2.203 0.395 6.273 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.496 0.511 7.623 1.00 0.00 C ATOM 629 CD2 LEU A 49 -2.190 1.755 5.571 1.00 0.00 C ATOM 0 H LEU A 49 -1.873 -3.150 4.004 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.572 -2.277 6.841 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.399 -0.517 5.509 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.716 -0.471 4.354 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.234 0.077 6.429 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.013 1.244 8.242 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.505 -0.458 8.123 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.465 0.829 7.468 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.707 2.489 6.190 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.159 2.074 5.415 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.694 1.672 4.608 1.00 0.00 H new ATOM 641 N ASN A 50 -4.013 -2.545 6.912 1.00 0.00 N ATOM 642 CA ASN A 50 -5.497 -2.684 6.954 1.00 0.00 C ATOM 643 C ASN A 50 -6.132 -1.413 7.525 1.00 0.00 C ATOM 644 O ASN A 50 -5.494 -0.647 8.220 1.00 0.00 O ATOM 645 CB ASN A 50 -5.757 -3.875 7.878 1.00 0.00 C ATOM 646 CG ASN A 50 -5.065 -3.639 9.222 1.00 0.00 C ATOM 647 OD1 ASN A 50 -5.256 -2.614 9.845 1.00 0.00 O ATOM 648 ND2 ASN A 50 -4.263 -4.552 9.698 1.00 0.00 N ATOM 0 H ASN A 50 -3.531 -2.763 7.784 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.926 -2.835 5.963 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.829 -4.006 8.027 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -5.384 -4.792 7.421 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -3.797 -4.405 10.593 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.103 -5.413 9.175 1.00 0.00 H new ATOM 655 N GLY A 51 -7.384 -1.184 7.239 1.00 0.00 N ATOM 656 CA GLY A 51 -8.058 0.036 7.767 1.00 0.00 C ATOM 657 C GLY A 51 -8.423 0.966 6.609 1.00 0.00 C ATOM 658 O GLY A 51 -7.798 1.986 6.399 1.00 0.00 O ATOM 0 H GLY A 51 -7.969 -1.789 6.663 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.956 -0.243 8.319 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.401 0.552 8.467 1.00 0.00 H new ATOM 662 N VAL A 52 -9.434 0.625 5.855 1.00 0.00 N ATOM 663 CA VAL A 52 -9.839 1.494 4.712 1.00 0.00 C ATOM 664 C VAL A 52 -11.365 1.588 4.635 1.00 0.00 C ATOM 665 O VAL A 52 -12.075 0.901 5.343 1.00 0.00 O ATOM 666 CB VAL A 52 -9.278 0.804 3.469 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.688 1.589 2.222 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.751 0.754 3.560 1.00 0.00 C ATOM 0 H VAL A 52 -9.996 -0.217 5.981 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.464 2.512 4.814 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.673 -0.210 3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.288 1.098 1.335 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.775 1.627 2.157 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -9.293 2.603 2.284 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.350 0.262 2.674 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.357 1.768 3.622 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.458 0.196 4.449 1.00 0.00 H new ATOM 678 N ALA A 53 -11.877 2.433 3.781 1.00 0.00 N ATOM 679 CA ALA A 53 -13.358 2.568 3.664 1.00 0.00 C ATOM 680 C ALA A 53 -13.767 2.709 2.195 1.00 0.00 C ATOM 681 O ALA A 53 -13.658 3.768 1.609 1.00 0.00 O ATOM 682 CB ALA A 53 -13.702 3.839 4.441 1.00 0.00 C ATOM 0 H ALA A 53 -11.335 3.035 3.160 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.882 1.696 4.054 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.778 4.009 4.403 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.389 3.727 5.479 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.184 4.689 3.996 1.00 0.00 H new ATOM 688 N ILE A 54 -14.240 1.650 1.597 1.00 0.00 N ATOM 689 CA ILE A 54 -14.659 1.721 0.167 1.00 0.00 C ATOM 690 C ILE A 54 -16.097 1.215 0.017 1.00 0.00 C ATOM 691 O ILE A 54 -16.688 0.717 0.955 1.00 0.00 O ATOM 692 CB ILE A 54 -13.685 0.806 -0.574 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.259 1.332 -0.396 1.00 0.00 C ATOM 694 CG2 ILE A 54 -14.037 0.782 -2.062 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.179 2.776 -0.890 1.00 0.00 C ATOM 0 H ILE A 54 -14.355 0.737 2.037 1.00 0.00 H new ATOM 0 HA ILE A 54 -14.638 2.738 -0.224 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.755 -0.204 -0.169 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.970 1.280 0.654 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.559 0.708 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.342 0.129 -2.590 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -15.053 0.409 -2.190 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -13.967 1.791 -2.469 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.163 3.148 -0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.450 2.815 -1.945 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.867 3.396 -0.315 1.00 0.00 H new ATOM 707 N GLU A 55 -16.667 1.338 -1.151 1.00 0.00 N ATOM 708 CA GLU A 55 -18.067 0.861 -1.344 1.00 0.00 C ATOM 709 C GLU A 55 -18.403 0.749 -2.833 1.00 0.00 C ATOM 710 O GLU A 55 -18.214 1.676 -3.595 1.00 0.00 O ATOM 711 CB GLU A 55 -18.941 1.924 -0.677 1.00 0.00 C ATOM 712 CG GLU A 55 -19.561 1.349 0.598 1.00 0.00 C ATOM 713 CD GLU A 55 -21.077 1.558 0.568 1.00 0.00 C ATOM 714 OE1 GLU A 55 -21.611 1.717 -0.517 1.00 0.00 O ATOM 715 OE2 GLU A 55 -21.676 1.554 1.630 1.00 0.00 O ATOM 0 H GLU A 55 -16.227 1.746 -1.976 1.00 0.00 H new ATOM 0 HA GLU A 55 -18.222 -0.129 -0.916 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.344 2.804 -0.439 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.725 2.247 -1.362 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -19.331 0.287 0.680 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -19.133 1.836 1.475 1.00 0.00 H new ATOM 722 N GLU A 56 -18.908 -0.384 -3.243 1.00 0.00 N ATOM 723 CA GLU A 56 -19.275 -0.582 -4.677 1.00 0.00 C ATOM 724 C GLU A 56 -18.262 0.097 -5.601 1.00 0.00 C ATOM 725 O GLU A 56 -17.110 0.272 -5.256 1.00 0.00 O ATOM 726 CB GLU A 56 -20.654 0.060 -4.821 1.00 0.00 C ATOM 727 CG GLU A 56 -20.519 1.577 -4.730 1.00 0.00 C ATOM 728 CD GLU A 56 -21.829 2.235 -5.168 1.00 0.00 C ATOM 729 OE1 GLU A 56 -22.740 2.292 -4.359 1.00 0.00 O ATOM 730 OE2 GLU A 56 -21.899 2.671 -6.305 1.00 0.00 O ATOM 0 H GLU A 56 -19.084 -1.188 -2.641 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.281 -1.636 -4.954 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.100 -0.220 -5.776 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.320 -0.304 -4.039 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.277 1.870 -3.709 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -19.699 1.918 -5.363 1.00 0.00 H new ATOM 737 N GLY A 57 -18.684 0.477 -6.777 1.00 0.00 N ATOM 738 CA GLY A 57 -17.751 1.141 -7.729 1.00 0.00 C ATOM 739 C GLY A 57 -17.733 2.647 -7.464 1.00 0.00 C ATOM 740 O GLY A 57 -18.308 3.424 -8.200 1.00 0.00 O ATOM 0 H GLY A 57 -19.637 0.355 -7.119 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -16.748 0.730 -7.617 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -18.063 0.946 -8.755 1.00 0.00 H new ATOM 744 N THR A 58 -17.074 3.064 -6.420 1.00 0.00 N ATOM 745 CA THR A 58 -17.014 4.520 -6.106 1.00 0.00 C ATOM 746 C THR A 58 -15.660 5.092 -6.548 1.00 0.00 C ATOM 747 O THR A 58 -14.779 4.370 -6.970 1.00 0.00 O ATOM 748 CB THR A 58 -17.187 4.599 -4.583 1.00 0.00 C ATOM 749 OG1 THR A 58 -18.573 4.599 -4.271 1.00 0.00 O ATOM 750 CG2 THR A 58 -16.545 5.879 -4.041 1.00 0.00 C ATOM 0 H THR A 58 -16.573 2.459 -5.769 1.00 0.00 H new ATOM 0 HA THR A 58 -17.779 5.099 -6.624 1.00 0.00 H new ATOM 0 HB THR A 58 -16.700 3.738 -4.124 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.839 3.707 -3.965 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.675 5.922 -2.960 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.481 5.881 -4.279 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.021 6.747 -4.498 1.00 0.00 H new ATOM 758 N THR A 59 -15.493 6.384 -6.461 1.00 0.00 N ATOM 759 CA THR A 59 -14.201 6.999 -6.885 1.00 0.00 C ATOM 760 C THR A 59 -13.224 7.064 -5.707 1.00 0.00 C ATOM 761 O THR A 59 -13.619 7.124 -4.560 1.00 0.00 O ATOM 762 CB THR A 59 -14.571 8.407 -7.352 1.00 0.00 C ATOM 763 OG1 THR A 59 -15.882 8.394 -7.898 1.00 0.00 O ATOM 764 CG2 THR A 59 -13.577 8.872 -8.417 1.00 0.00 C ATOM 0 H THR A 59 -16.194 7.040 -6.115 1.00 0.00 H new ATOM 0 HA THR A 59 -13.709 6.422 -7.668 1.00 0.00 H new ATOM 0 HB THR A 59 -14.537 9.091 -6.504 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.121 9.296 -8.196 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.842 9.876 -8.749 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.572 8.883 -7.996 1.00 0.00 H new ATOM 0 HG23 THR A 59 -13.608 8.189 -9.266 1.00 0.00 H new ATOM 772 N TYR A 60 -11.948 7.057 -5.986 1.00 0.00 N ATOM 773 CA TYR A 60 -10.938 7.122 -4.890 1.00 0.00 C ATOM 774 C TYR A 60 -9.593 7.594 -5.445 1.00 0.00 C ATOM 775 O TYR A 60 -9.041 6.998 -6.348 1.00 0.00 O ATOM 776 CB TYR A 60 -10.820 5.691 -4.367 1.00 0.00 C ATOM 777 CG TYR A 60 -12.053 5.338 -3.574 1.00 0.00 C ATOM 778 CD1 TYR A 60 -12.223 5.843 -2.280 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.023 4.501 -4.132 1.00 0.00 C ATOM 780 CE1 TYR A 60 -13.367 5.510 -1.546 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.165 4.167 -3.399 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.339 4.672 -2.105 1.00 0.00 C ATOM 783 OH TYR A 60 -15.467 4.343 -1.381 1.00 0.00 O ATOM 0 H TYR A 60 -11.561 7.009 -6.928 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.229 7.820 -4.105 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.700 4.998 -5.200 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.933 5.594 -3.741 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -11.472 6.489 -1.848 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -12.890 4.112 -5.131 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.500 5.900 -0.548 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -14.913 3.519 -3.831 1.00 0.00 H new ATOM 0 HH TYR A 60 -16.039 3.754 -1.916 1.00 0.00 H new ATOM 793 N THR A 61 -9.058 8.657 -4.912 1.00 0.00 N ATOM 794 CA THR A 61 -7.747 9.157 -5.413 1.00 0.00 C ATOM 795 C THR A 61 -6.602 8.508 -4.633 1.00 0.00 C ATOM 796 O THR A 61 -6.452 8.716 -3.445 1.00 0.00 O ATOM 797 CB THR A 61 -7.777 10.666 -5.167 1.00 0.00 C ATOM 798 OG1 THR A 61 -8.954 11.215 -5.742 1.00 0.00 O ATOM 799 CG2 THR A 61 -6.546 11.312 -5.804 1.00 0.00 C ATOM 0 H THR A 61 -9.470 9.200 -4.153 1.00 0.00 H new ATOM 0 HA THR A 61 -7.589 8.920 -6.465 1.00 0.00 H new ATOM 0 HB THR A 61 -7.773 10.860 -4.094 1.00 0.00 H new ATOM 0 HG1 THR A 61 -8.975 12.182 -5.583 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.568 12.388 -5.629 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.644 10.890 -5.361 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.548 11.119 -6.877 1.00 0.00 H new ATOM 807 N LEU A 62 -5.790 7.726 -5.291 1.00 0.00 N ATOM 808 CA LEU A 62 -4.655 7.070 -4.582 1.00 0.00 C ATOM 809 C LEU A 62 -3.422 7.973 -4.626 1.00 0.00 C ATOM 810 O LEU A 62 -2.993 8.404 -5.679 1.00 0.00 O ATOM 811 CB LEU A 62 -4.393 5.772 -5.348 1.00 0.00 C ATOM 812 CG LEU A 62 -3.072 5.156 -4.876 1.00 0.00 C ATOM 813 CD1 LEU A 62 -3.279 4.477 -3.521 1.00 0.00 C ATOM 814 CD2 LEU A 62 -2.597 4.119 -5.896 1.00 0.00 C ATOM 0 H LEU A 62 -5.863 7.514 -6.286 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.881 6.880 -3.533 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.212 5.071 -5.186 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.351 5.972 -6.419 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.322 5.941 -4.779 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.339 4.039 -3.186 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.616 5.214 -2.792 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.030 3.693 -3.618 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.657 3.681 -5.559 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.348 3.335 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.447 4.601 -6.862 1.00 0.00 H new ATOM 826 N ARG A 63 -2.851 8.262 -3.492 1.00 0.00 N ATOM 827 CA ARG A 63 -1.646 9.136 -3.468 1.00 0.00 C ATOM 828 C ARG A 63 -0.549 8.496 -2.615 1.00 0.00 C ATOM 829 O ARG A 63 -0.805 7.985 -1.546 1.00 0.00 O ATOM 830 CB ARG A 63 -2.119 10.447 -2.839 1.00 0.00 C ATOM 831 CG ARG A 63 -1.017 11.501 -2.965 1.00 0.00 C ATOM 832 CD ARG A 63 -1.608 12.890 -2.711 1.00 0.00 C ATOM 833 NE ARG A 63 -1.275 13.196 -1.292 1.00 0.00 N ATOM 834 CZ ARG A 63 -0.066 13.567 -0.971 1.00 0.00 C ATOM 835 NH1 ARG A 63 0.907 13.435 -1.830 1.00 0.00 N ATOM 836 NH2 ARG A 63 0.169 14.070 0.210 1.00 0.00 N ATOM 0 H ARG A 63 -3.166 7.931 -2.580 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.227 9.290 -4.462 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -3.026 10.793 -3.334 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.368 10.290 -1.790 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -0.220 11.297 -2.250 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.571 11.460 -3.959 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.179 13.631 -3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.686 12.896 -2.874 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.992 13.116 -0.571 1.00 0.00 H new ATOM 0 HH11 ARG A 63 0.723 13.042 -2.753 1.00 0.00 H new ATOM 0 HH12 ARG A 63 1.852 13.725 -1.579 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -0.592 14.173 0.881 1.00 0.00 H new ATOM 0 HH22 ARG A 63 1.114 14.360 0.462 1.00 0.00 H new ATOM 850 N TYR A 64 0.669 8.524 -3.080 1.00 0.00 N ATOM 851 CA TYR A 64 1.788 7.925 -2.297 1.00 0.00 C ATOM 852 C TYR A 64 3.108 8.128 -3.050 1.00 0.00 C ATOM 853 O TYR A 64 3.154 8.073 -4.263 1.00 0.00 O ATOM 854 CB TYR A 64 1.430 6.433 -2.151 1.00 0.00 C ATOM 855 CG TYR A 64 1.980 5.632 -3.313 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.351 5.351 -3.391 1.00 0.00 C ATOM 857 CD2 TYR A 64 1.115 5.169 -4.312 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.853 4.610 -4.467 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.618 4.427 -5.387 1.00 0.00 C ATOM 860 CZ TYR A 64 2.988 4.149 -5.465 1.00 0.00 C ATOM 861 OH TYR A 64 3.484 3.419 -6.525 1.00 0.00 O ATOM 0 H TYR A 64 0.939 8.938 -3.972 1.00 0.00 H new ATOM 0 HA TYR A 64 1.917 8.386 -1.318 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.833 6.048 -1.215 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.347 6.317 -2.104 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.020 5.706 -2.621 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.058 5.385 -4.253 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.909 4.394 -4.527 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.950 4.069 -6.156 1.00 0.00 H new ATOM 0 HH TYR A 64 2.750 3.176 -7.127 1.00 0.00 H new ATOM 871 N THR A 65 4.177 8.373 -2.345 1.00 0.00 N ATOM 872 CA THR A 65 5.484 8.590 -3.030 1.00 0.00 C ATOM 873 C THR A 65 6.499 7.536 -2.589 1.00 0.00 C ATOM 874 O THR A 65 7.183 7.694 -1.598 1.00 0.00 O ATOM 875 CB THR A 65 5.933 9.984 -2.588 1.00 0.00 C ATOM 876 OG1 THR A 65 4.798 10.742 -2.193 1.00 0.00 O ATOM 877 CG2 THR A 65 6.641 10.686 -3.748 1.00 0.00 C ATOM 0 H THR A 65 4.204 8.432 -1.327 1.00 0.00 H new ATOM 0 HA THR A 65 5.399 8.510 -4.114 1.00 0.00 H new ATOM 0 HB THR A 65 6.621 9.895 -1.747 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.029 10.492 -2.747 1.00 0.00 H new ATOM 0 HG21 THR A 65 6.960 11.679 -3.432 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.512 10.103 -4.049 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.956 10.776 -4.591 1.00 0.00 H new ATOM 885 N ALA A 66 6.605 6.462 -3.321 1.00 0.00 N ATOM 886 CA ALA A 66 7.578 5.397 -2.947 1.00 0.00 C ATOM 887 C ALA A 66 8.893 5.596 -3.704 1.00 0.00 C ATOM 888 O ALA A 66 8.925 6.171 -4.775 1.00 0.00 O ATOM 889 CB ALA A 66 6.910 4.087 -3.366 1.00 0.00 C ATOM 0 H ALA A 66 6.060 6.275 -4.163 1.00 0.00 H new ATOM 0 HA ALA A 66 7.818 5.410 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.565 3.251 -3.124 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.965 3.974 -2.834 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.722 4.101 -4.440 1.00 0.00 H new ATOM 895 N THR A 67 9.979 5.125 -3.157 1.00 0.00 N ATOM 896 CA THR A 67 11.291 5.288 -3.847 1.00 0.00 C ATOM 897 C THR A 67 12.226 4.126 -3.496 1.00 0.00 C ATOM 898 O THR A 67 12.339 3.730 -2.354 1.00 0.00 O ATOM 899 CB THR A 67 11.857 6.607 -3.319 1.00 0.00 C ATOM 900 OG1 THR A 67 11.018 7.677 -3.728 1.00 0.00 O ATOM 901 CG2 THR A 67 13.267 6.818 -3.875 1.00 0.00 C ATOM 0 H THR A 67 10.016 4.635 -2.263 1.00 0.00 H new ATOM 0 HA THR A 67 11.186 5.293 -4.932 1.00 0.00 H new ATOM 0 HB THR A 67 11.900 6.575 -2.230 1.00 0.00 H new ATOM 0 HG1 THR A 67 10.928 8.321 -2.995 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.670 7.758 -3.498 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.909 5.996 -3.560 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.228 6.850 -4.964 1.00 0.00 H new ATOM 909 N ALA A 68 12.901 3.582 -4.472 1.00 0.00 N ATOM 910 CA ALA A 68 13.833 2.451 -4.196 1.00 0.00 C ATOM 911 C ALA A 68 15.225 2.773 -4.746 1.00 0.00 C ATOM 912 O ALA A 68 15.365 3.329 -5.817 1.00 0.00 O ATOM 913 CB ALA A 68 13.232 1.249 -4.926 1.00 0.00 C ATOM 0 H ALA A 68 12.848 3.872 -5.449 1.00 0.00 H new ATOM 0 HA ALA A 68 13.947 2.260 -3.129 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.864 0.375 -4.769 1.00 0.00 H new ATOM 0 HB2 ALA A 68 12.234 1.049 -4.537 1.00 0.00 H new ATOM 0 HB3 ALA A 68 13.169 1.465 -5.993 1.00 0.00 H new ATOM 919 N SER A 69 16.255 2.427 -4.024 1.00 0.00 N ATOM 920 CA SER A 69 17.636 2.714 -4.511 1.00 0.00 C ATOM 921 C SER A 69 17.979 1.800 -5.689 1.00 0.00 C ATOM 922 O SER A 69 19.032 1.907 -6.286 1.00 0.00 O ATOM 923 CB SER A 69 18.546 2.418 -3.320 1.00 0.00 C ATOM 924 OG SER A 69 18.649 3.580 -2.508 1.00 0.00 O ATOM 0 H SER A 69 16.202 1.959 -3.119 1.00 0.00 H new ATOM 0 HA SER A 69 17.746 3.740 -4.862 1.00 0.00 H new ATOM 0 HB2 SER A 69 18.145 1.588 -2.738 1.00 0.00 H new ATOM 0 HB3 SER A 69 19.533 2.115 -3.668 1.00 0.00 H new ATOM 0 HG SER A 69 19.231 3.393 -1.742 1.00 0.00 H new ATOM 930 N THR A 70 17.096 0.900 -6.028 1.00 0.00 N ATOM 931 CA THR A 70 17.368 -0.023 -7.166 1.00 0.00 C ATOM 932 C THR A 70 16.239 0.065 -8.196 1.00 0.00 C ATOM 933 O THR A 70 16.052 -0.825 -9.001 1.00 0.00 O ATOM 934 CB THR A 70 17.402 -1.417 -6.535 1.00 0.00 C ATOM 935 OG1 THR A 70 17.994 -2.333 -7.446 1.00 0.00 O ATOM 936 CG2 THR A 70 15.974 -1.863 -6.211 1.00 0.00 C ATOM 0 H THR A 70 16.197 0.764 -5.565 1.00 0.00 H new ATOM 0 HA THR A 70 18.295 0.219 -7.686 1.00 0.00 H new ATOM 0 HB THR A 70 17.989 -1.390 -5.617 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.643 -2.171 -8.347 1.00 0.00 H new ATOM 0 HG21 THR A 70 15.996 -2.856 -5.761 1.00 0.00 H new ATOM 0 HG22 THR A 70 15.522 -1.158 -5.513 1.00 0.00 H new ATOM 0 HG23 THR A 70 15.385 -1.893 -7.128 1.00 0.00 H new ATOM 944 N ASP A 71 15.481 1.127 -8.172 1.00 0.00 N ATOM 945 CA ASP A 71 14.362 1.260 -9.143 1.00 0.00 C ATOM 946 C ASP A 71 13.616 -0.071 -9.250 1.00 0.00 C ATOM 947 O ASP A 71 13.553 -0.680 -10.299 1.00 0.00 O ATOM 948 CB ASP A 71 15.039 1.619 -10.462 1.00 0.00 C ATOM 949 CG ASP A 71 14.038 1.480 -11.610 1.00 0.00 C ATOM 950 OD1 ASP A 71 12.865 1.296 -11.330 1.00 0.00 O ATOM 951 OD2 ASP A 71 14.462 1.560 -12.752 1.00 0.00 O ATOM 0 H ASP A 71 15.589 1.906 -7.523 1.00 0.00 H new ATOM 0 HA ASP A 71 13.628 2.011 -8.851 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.420 2.639 -10.420 1.00 0.00 H new ATOM 0 HB3 ASP A 71 15.895 0.966 -10.632 1.00 0.00 H new ATOM 956 N VAL A 72 13.063 -0.531 -8.161 1.00 0.00 N ATOM 957 CA VAL A 72 12.333 -1.830 -8.183 1.00 0.00 C ATOM 958 C VAL A 72 10.871 -1.627 -8.587 1.00 0.00 C ATOM 959 O VAL A 72 10.227 -0.679 -8.184 1.00 0.00 O ATOM 960 CB VAL A 72 12.422 -2.354 -6.747 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.452 -1.578 -5.853 1.00 0.00 C ATOM 962 CG2 VAL A 72 12.054 -3.839 -6.724 1.00 0.00 C ATOM 0 H VAL A 72 13.085 -0.062 -7.255 1.00 0.00 H new ATOM 0 HA VAL A 72 12.761 -2.525 -8.906 1.00 0.00 H new ATOM 0 HB VAL A 72 13.439 -2.222 -6.378 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.518 -1.954 -4.832 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.711 -0.519 -5.868 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.434 -1.707 -6.222 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.117 -4.214 -5.702 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.037 -3.968 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.745 -4.395 -7.357 1.00 0.00 H new ATOM 972 N THR A 73 10.343 -2.525 -9.369 1.00 0.00 N ATOM 973 CA THR A 73 8.920 -2.409 -9.792 1.00 0.00 C ATOM 974 C THR A 73 8.153 -3.643 -9.313 1.00 0.00 C ATOM 975 O THR A 73 8.042 -4.628 -10.017 1.00 0.00 O ATOM 976 CB THR A 73 8.959 -2.355 -11.320 1.00 0.00 C ATOM 977 OG1 THR A 73 9.539 -1.126 -11.733 1.00 0.00 O ATOM 978 CG2 THR A 73 7.537 -2.462 -11.873 1.00 0.00 C ATOM 0 H THR A 73 10.838 -3.338 -9.735 1.00 0.00 H new ATOM 0 HA THR A 73 8.424 -1.532 -9.377 1.00 0.00 H new ATOM 0 HB THR A 73 9.556 -3.185 -11.699 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.567 -1.090 -12.712 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.566 -2.423 -12.962 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.093 -3.405 -11.555 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.937 -1.634 -11.497 1.00 0.00 H new ATOM 986 N VAL A 74 7.636 -3.605 -8.116 1.00 0.00 N ATOM 987 CA VAL A 74 6.893 -4.787 -7.593 1.00 0.00 C ATOM 988 C VAL A 74 5.410 -4.687 -7.955 1.00 0.00 C ATOM 989 O VAL A 74 5.048 -4.185 -9.000 1.00 0.00 O ATOM 990 CB VAL A 74 7.083 -4.737 -6.077 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.580 -4.716 -5.746 1.00 0.00 C ATOM 992 CG2 VAL A 74 6.418 -3.475 -5.525 1.00 0.00 C ATOM 0 H VAL A 74 7.695 -2.810 -7.479 1.00 0.00 H new ATOM 0 HA VAL A 74 7.257 -5.723 -8.018 1.00 0.00 H new ATOM 0 HB VAL A 74 6.627 -5.617 -5.624 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.713 -4.680 -4.665 1.00 0.00 H new ATOM 0 HG12 VAL A 74 9.052 -5.616 -6.140 1.00 0.00 H new ATOM 0 HG13 VAL A 74 9.040 -3.837 -6.197 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.552 -3.436 -4.444 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.874 -2.595 -5.979 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.353 -3.493 -5.758 1.00 0.00 H new ATOM 1002 N ARG A 75 4.549 -5.169 -7.102 1.00 0.00 N ATOM 1003 CA ARG A 75 3.090 -5.107 -7.403 1.00 0.00 C ATOM 1004 C ARG A 75 2.332 -4.455 -6.243 1.00 0.00 C ATOM 1005 O ARG A 75 2.409 -4.893 -5.115 1.00 0.00 O ATOM 1006 CB ARG A 75 2.664 -6.566 -7.571 1.00 0.00 C ATOM 1007 CG ARG A 75 2.812 -6.977 -9.037 1.00 0.00 C ATOM 1008 CD ARG A 75 1.449 -7.399 -9.589 1.00 0.00 C ATOM 1009 NE ARG A 75 0.744 -6.122 -9.888 1.00 0.00 N ATOM 1010 CZ ARG A 75 -0.213 -6.097 -10.774 1.00 0.00 C ATOM 1011 NH1 ARG A 75 -1.382 -6.599 -10.486 1.00 0.00 N ATOM 1012 NH2 ARG A 75 0.000 -5.569 -11.949 1.00 0.00 N ATOM 0 H ARG A 75 4.791 -5.602 -6.211 1.00 0.00 H new ATOM 0 HA ARG A 75 2.876 -4.512 -8.291 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.276 -7.209 -6.939 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.630 -6.693 -7.250 1.00 0.00 H new ATOM 0 HG2 ARG A 75 3.211 -6.147 -9.620 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.522 -7.799 -9.125 1.00 0.00 H new ATOM 0 HD2 ARG A 75 1.558 -8.009 -10.485 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.896 -7.995 -8.863 1.00 0.00 H new ATOM 0 HE ARG A 75 1.009 -5.267 -9.400 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -1.548 -7.011 -9.568 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -2.130 -6.579 -11.179 1.00 0.00 H new ATOM 0 HH21 ARG A 75 0.914 -5.176 -12.174 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -0.748 -5.549 -12.642 1.00 0.00 H new ATOM 1026 N ALA A 76 1.596 -3.413 -6.517 1.00 0.00 N ATOM 1027 CA ALA A 76 0.827 -2.735 -5.434 1.00 0.00 C ATOM 1028 C ALA A 76 -0.643 -2.618 -5.842 1.00 0.00 C ATOM 1029 O ALA A 76 -0.975 -2.678 -7.009 1.00 0.00 O ATOM 1030 CB ALA A 76 1.462 -1.350 -5.298 1.00 0.00 C ATOM 0 H ALA A 76 1.494 -3.001 -7.445 1.00 0.00 H new ATOM 0 HA ALA A 76 0.858 -3.284 -4.493 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.948 -0.789 -4.517 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.515 -1.456 -5.035 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.376 -0.816 -6.244 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.527 -2.454 -4.895 1.00 0.00 N ATOM 1037 CA LEU A 77 -2.970 -2.340 -5.242 1.00 0.00 C ATOM 1038 C LEU A 77 -3.818 -2.207 -3.972 1.00 0.00 C ATOM 1039 O LEU A 77 -3.339 -1.800 -2.932 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.302 -3.643 -5.976 1.00 0.00 C ATOM 1041 CG LEU A 77 -2.815 -4.835 -5.151 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -3.771 -5.070 -3.980 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -2.777 -6.083 -6.035 1.00 0.00 C ATOM 0 H LEU A 77 -1.312 -2.394 -3.900 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.179 -1.461 -5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.377 -3.716 -6.140 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.829 -3.650 -6.958 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.816 -4.628 -4.768 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.424 -5.920 -3.392 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.801 -4.181 -3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.770 -5.277 -4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.430 -6.934 -5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.777 -6.289 -6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.097 -5.917 -6.870 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.076 -2.547 -4.053 1.00 0.00 N ATOM 1056 CA VAL A 78 -5.963 -2.445 -2.857 1.00 0.00 C ATOM 1057 C VAL A 78 -6.956 -3.609 -2.855 1.00 0.00 C ATOM 1058 O VAL A 78 -6.922 -4.460 -3.722 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.692 -1.110 -3.022 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.392 -0.742 -1.713 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.680 -0.020 -3.382 1.00 0.00 C ATOM 0 H VAL A 78 -5.530 -2.892 -4.899 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.413 -2.490 -1.917 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.433 -1.198 -3.816 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.911 0.209 -1.833 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.112 -1.518 -1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.652 -0.654 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.197 0.932 -3.500 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.939 0.066 -2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.182 -0.280 -4.316 1.00 0.00 H new ATOM 1071 N GLY A 79 -7.841 -3.666 -1.896 1.00 0.00 N ATOM 1072 CA GLY A 79 -8.819 -4.790 -1.872 1.00 0.00 C ATOM 1073 C GLY A 79 -9.431 -4.922 -0.479 1.00 0.00 C ATOM 1074 O GLY A 79 -9.492 -3.974 0.279 1.00 0.00 O ATOM 0 H GLY A 79 -7.929 -2.991 -1.137 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.604 -4.615 -2.608 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.323 -5.720 -2.150 1.00 0.00 H new ATOM 1078 N GLN A 80 -9.890 -6.094 -0.141 1.00 0.00 N ATOM 1079 CA GLN A 80 -10.506 -6.298 1.200 1.00 0.00 C ATOM 1080 C GLN A 80 -9.992 -7.593 1.830 1.00 0.00 C ATOM 1081 O GLN A 80 -9.524 -8.485 1.149 1.00 0.00 O ATOM 1082 CB GLN A 80 -12.016 -6.392 0.946 1.00 0.00 C ATOM 1083 CG GLN A 80 -12.284 -7.147 -0.358 1.00 0.00 C ATOM 1084 CD GLN A 80 -13.790 -7.183 -0.625 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -14.517 -8.114 -0.070 1.00 0.00 O flip ATOM 1086 NE2 GLN A 80 -14.311 -6.355 -1.345 1.00 0.00 N flip ATOM 0 H GLN A 80 -9.865 -6.922 -0.737 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.260 -5.488 1.887 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -12.501 -6.903 1.777 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.446 -5.392 0.891 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -11.768 -6.660 -1.186 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.891 -8.162 -0.291 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -13.743 -5.627 -1.779 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.316 -6.388 -1.516 1.00 0.00 H new ATOM 1095 N ASN A 81 -10.078 -7.704 3.126 1.00 0.00 N ATOM 1096 CA ASN A 81 -9.599 -8.942 3.802 1.00 0.00 C ATOM 1097 C ASN A 81 -10.792 -9.770 4.287 1.00 0.00 C ATOM 1098 O ASN A 81 -11.349 -9.518 5.337 1.00 0.00 O ATOM 1099 CB ASN A 81 -8.767 -8.452 4.988 1.00 0.00 C ATOM 1100 CG ASN A 81 -7.310 -8.284 4.556 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -7.034 -7.734 3.508 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -6.357 -8.738 5.324 1.00 0.00 N ATOM 0 H ASN A 81 -10.460 -6.990 3.747 1.00 0.00 H new ATOM 0 HA ASN A 81 -9.018 -9.579 3.136 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -9.160 -7.504 5.354 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -8.833 -9.164 5.811 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.382 -8.631 5.044 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -6.587 -9.200 6.204 1.00 0.00 H new ATOM 1109 N GLY A 82 -11.190 -10.752 3.525 1.00 0.00 N ATOM 1110 CA GLY A 82 -12.348 -11.596 3.936 1.00 0.00 C ATOM 1111 C GLY A 82 -13.232 -11.873 2.718 1.00 0.00 C ATOM 1112 O GLY A 82 -13.408 -11.029 1.864 1.00 0.00 O ATOM 0 H GLY A 82 -10.763 -11.007 2.634 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.995 -12.534 4.364 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -12.925 -11.090 4.710 1.00 0.00 H new ATOM 1116 N ALA A 83 -13.785 -13.053 2.629 1.00 0.00 N ATOM 1117 CA ALA A 83 -14.655 -13.383 1.462 1.00 0.00 C ATOM 1118 C ALA A 83 -15.924 -12.521 1.486 1.00 0.00 C ATOM 1119 O ALA A 83 -16.330 -12.053 2.531 1.00 0.00 O ATOM 1120 CB ALA A 83 -15.007 -14.860 1.637 1.00 0.00 C ATOM 0 H ALA A 83 -13.672 -13.802 3.312 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.160 -13.192 0.510 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -15.647 -15.181 0.816 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -14.093 -15.454 1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.532 -14.999 2.582 1.00 0.00 H new ATOM 1126 N PRO A 84 -16.514 -12.335 0.328 1.00 0.00 N ATOM 1127 CA PRO A 84 -15.978 -12.930 -0.925 1.00 0.00 C ATOM 1128 C PRO A 84 -14.772 -12.133 -1.437 1.00 0.00 C ATOM 1129 O PRO A 84 -14.294 -12.354 -2.532 1.00 0.00 O ATOM 1130 CB PRO A 84 -17.145 -12.819 -1.900 1.00 0.00 C ATOM 1131 CG PRO A 84 -17.973 -11.678 -1.396 1.00 0.00 C ATOM 1132 CD PRO A 84 -17.735 -11.559 0.089 1.00 0.00 C ATOM 0 HA PRO A 84 -15.628 -13.953 -0.790 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -16.793 -12.632 -2.915 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.723 -13.742 -1.928 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -17.698 -10.753 -1.903 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -19.029 -11.852 -1.601 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.609 -10.519 0.389 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -18.575 -11.956 0.659 1.00 0.00 H new ATOM 1140 N TYR A 85 -14.282 -11.206 -0.659 1.00 0.00 N ATOM 1141 CA TYR A 85 -13.109 -10.392 -1.101 1.00 0.00 C ATOM 1142 C TYR A 85 -13.514 -9.458 -2.245 1.00 0.00 C ATOM 1143 O TYR A 85 -14.677 -9.326 -2.571 1.00 0.00 O ATOM 1144 CB TYR A 85 -12.060 -11.400 -1.587 1.00 0.00 C ATOM 1145 CG TYR A 85 -12.021 -12.598 -0.666 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -11.456 -12.483 0.609 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -12.544 -13.826 -1.091 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -11.413 -13.595 1.459 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -12.502 -14.937 -0.241 1.00 0.00 C ATOM 1150 CZ TYR A 85 -11.937 -14.821 1.035 1.00 0.00 C ATOM 1151 OH TYR A 85 -11.895 -15.917 1.873 1.00 0.00 O ATOM 0 H TYR A 85 -14.643 -10.975 0.267 1.00 0.00 H new ATOM 0 HA TYR A 85 -12.725 -9.769 -0.293 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.295 -11.720 -2.602 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.079 -10.927 -1.622 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -11.053 -11.536 0.938 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.980 -13.915 -2.075 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -10.975 -13.506 2.442 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.905 -15.884 -0.569 1.00 0.00 H new ATOM 0 HH TYR A 85 -12.426 -16.645 1.487 1.00 0.00 H new ATOM 1161 N GLY A 86 -12.560 -8.810 -2.856 1.00 0.00 N ATOM 1162 CA GLY A 86 -12.884 -7.884 -3.979 1.00 0.00 C ATOM 1163 C GLY A 86 -11.803 -6.806 -4.078 1.00 0.00 C ATOM 1164 O GLY A 86 -11.724 -5.916 -3.256 1.00 0.00 O ATOM 0 H GLY A 86 -11.569 -8.882 -2.626 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.947 -8.438 -4.915 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.858 -7.423 -3.815 1.00 0.00 H new ATOM 1168 N THR A 87 -10.966 -6.880 -5.078 1.00 0.00 N ATOM 1169 CA THR A 87 -9.890 -5.857 -5.224 1.00 0.00 C ATOM 1170 C THR A 87 -10.329 -4.756 -6.191 1.00 0.00 C ATOM 1171 O THR A 87 -11.313 -4.885 -6.892 1.00 0.00 O ATOM 1172 CB THR A 87 -8.690 -6.616 -5.792 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.137 -7.531 -6.783 1.00 0.00 O ATOM 1174 CG2 THR A 87 -7.986 -7.379 -4.669 1.00 0.00 C ATOM 0 H THR A 87 -10.980 -7.602 -5.798 1.00 0.00 H new ATOM 0 HA THR A 87 -9.656 -5.373 -4.276 1.00 0.00 H new ATOM 0 HB THR A 87 -7.991 -5.909 -6.239 1.00 0.00 H new ATOM 0 HG1 THR A 87 -8.369 -8.017 -7.149 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.131 -7.919 -5.076 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.643 -6.675 -3.911 1.00 0.00 H new ATOM 0 HG23 THR A 87 -8.682 -8.087 -4.219 1.00 0.00 H new ATOM 1182 N VAL A 88 -9.602 -3.674 -6.234 1.00 0.00 N ATOM 1183 CA VAL A 88 -9.971 -2.561 -7.156 1.00 0.00 C ATOM 1184 C VAL A 88 -8.727 -2.035 -7.880 1.00 0.00 C ATOM 1185 O VAL A 88 -8.794 -1.606 -9.014 1.00 0.00 O ATOM 1186 CB VAL A 88 -10.562 -1.478 -6.254 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -11.968 -1.891 -5.814 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -9.674 -1.301 -5.020 1.00 0.00 C ATOM 0 H VAL A 88 -8.768 -3.511 -5.670 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.674 -2.881 -7.925 1.00 0.00 H new ATOM 0 HB VAL A 88 -10.614 -0.538 -6.803 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.389 -1.119 -5.171 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.602 -2.018 -6.692 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -11.916 -2.831 -5.265 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.095 -0.529 -4.376 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.622 -2.242 -4.472 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -8.672 -1.007 -5.332 1.00 0.00 H new ATOM 1198 N LEU A 89 -7.593 -2.065 -7.233 1.00 0.00 N ATOM 1199 CA LEU A 89 -6.349 -1.567 -7.887 1.00 0.00 C ATOM 1200 C LEU A 89 -5.534 -2.726 -8.460 1.00 0.00 C ATOM 1201 O LEU A 89 -5.475 -3.798 -7.892 1.00 0.00 O ATOM 1202 CB LEU A 89 -5.569 -0.873 -6.785 1.00 0.00 C ATOM 1203 CG LEU A 89 -5.947 0.600 -6.769 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.244 0.786 -5.987 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -4.825 1.391 -6.109 1.00 0.00 C ATOM 0 H LEU A 89 -7.474 -2.412 -6.281 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.573 -0.898 -8.718 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.791 -1.330 -5.821 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.498 -0.986 -6.952 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.094 0.957 -7.788 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -7.514 1.842 -5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.040 0.213 -6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.105 0.436 -4.964 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.087 2.449 -6.093 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.682 1.037 -5.088 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -3.903 1.254 -6.673 1.00 0.00 H new ATOM 1217 N ASP A 90 -4.899 -2.516 -9.577 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.079 -3.604 -10.181 1.00 0.00 C ATOM 1219 C ASP A 90 -2.923 -3.007 -10.991 1.00 0.00 C ATOM 1220 O ASP A 90 -3.031 -2.808 -12.185 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.040 -4.365 -11.095 1.00 0.00 C ATOM 1222 CG ASP A 90 -5.599 -3.414 -12.155 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -6.044 -2.340 -11.783 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -5.572 -3.775 -13.320 1.00 0.00 O ATOM 0 H ASP A 90 -4.911 -1.640 -10.099 1.00 0.00 H new ATOM 0 HA ASP A 90 -3.635 -4.254 -9.427 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -4.522 -5.196 -11.574 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.854 -4.792 -10.509 1.00 0.00 H new ATOM 1229 N THR A 91 -1.819 -2.715 -10.357 1.00 0.00 N ATOM 1230 CA THR A 91 -0.668 -2.128 -11.106 1.00 0.00 C ATOM 1231 C THR A 91 0.644 -2.377 -10.356 1.00 0.00 C ATOM 1232 O THR A 91 0.677 -3.055 -9.349 1.00 0.00 O ATOM 1233 CB THR A 91 -0.968 -0.630 -11.178 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.538 -0.204 -9.949 1.00 0.00 O ATOM 1235 CG2 THR A 91 -1.949 -0.359 -12.320 1.00 0.00 C ATOM 0 H THR A 91 -1.664 -2.856 -9.359 1.00 0.00 H new ATOM 0 HA THR A 91 -0.553 -2.572 -12.095 1.00 0.00 H new ATOM 0 HB THR A 91 -0.044 -0.082 -11.359 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.729 0.756 -9.993 1.00 0.00 H new ATOM 0 HG21 THR A 91 -2.162 0.709 -12.371 1.00 0.00 H new ATOM 0 HG22 THR A 91 -1.510 -0.686 -13.262 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.875 -0.906 -12.142 1.00 0.00 H new ATOM 1243 N SER A 92 1.727 -1.832 -10.844 1.00 0.00 N ATOM 1244 CA SER A 92 3.040 -2.034 -10.163 1.00 0.00 C ATOM 1245 C SER A 92 3.643 -0.682 -9.766 1.00 0.00 C ATOM 1246 O SER A 92 3.717 0.224 -10.572 1.00 0.00 O ATOM 1247 CB SER A 92 3.920 -2.730 -11.200 1.00 0.00 C ATOM 1248 OG SER A 92 3.419 -2.455 -12.501 1.00 0.00 O ATOM 0 H SER A 92 1.759 -1.256 -11.685 1.00 0.00 H new ATOM 0 HA SER A 92 2.946 -2.620 -9.249 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.949 -2.382 -11.113 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.931 -3.805 -11.022 1.00 0.00 H new ATOM 0 HG SER A 92 3.982 -2.899 -13.169 1.00 0.00 H new ATOM 1254 N PRO A 93 4.052 -0.593 -8.528 1.00 0.00 N ATOM 1255 CA PRO A 93 4.651 0.661 -8.012 1.00 0.00 C ATOM 1256 C PRO A 93 6.082 0.834 -8.527 1.00 0.00 C ATOM 1257 O PRO A 93 7.037 0.554 -7.831 1.00 0.00 O ATOM 1258 CB PRO A 93 4.653 0.460 -6.500 1.00 0.00 C ATOM 1259 CG PRO A 93 4.665 -1.022 -6.304 1.00 0.00 C ATOM 1260 CD PRO A 93 3.992 -1.639 -7.503 1.00 0.00 C ATOM 0 HA PRO A 93 4.104 1.550 -8.327 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.526 0.925 -6.042 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.773 0.911 -6.041 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.687 -1.388 -6.206 1.00 0.00 H new ATOM 0 HG3 PRO A 93 4.141 -1.293 -5.388 1.00 0.00 H new ATOM 0 HD2 PRO A 93 4.507 -2.544 -7.827 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.963 -1.920 -7.281 1.00 0.00 H new ATOM 1268 N ALA A 94 6.243 1.302 -9.734 1.00 0.00 N ATOM 1269 CA ALA A 94 7.620 1.497 -10.270 1.00 0.00 C ATOM 1270 C ALA A 94 8.407 2.417 -9.333 1.00 0.00 C ATOM 1271 O ALA A 94 7.904 3.422 -8.873 1.00 0.00 O ATOM 1272 CB ALA A 94 7.426 2.157 -11.636 1.00 0.00 C ATOM 0 H ALA A 94 5.486 1.556 -10.369 1.00 0.00 H new ATOM 0 HA ALA A 94 8.176 0.563 -10.351 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.398 2.334 -12.096 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.835 1.502 -12.276 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.906 3.107 -11.511 1.00 0.00 H new ATOM 1278 N LEU A 95 9.632 2.081 -9.035 1.00 0.00 N ATOM 1279 CA LEU A 95 10.432 2.944 -8.117 1.00 0.00 C ATOM 1280 C LEU A 95 11.753 3.354 -8.774 1.00 0.00 C ATOM 1281 O LEU A 95 12.074 2.932 -9.866 1.00 0.00 O ATOM 1282 CB LEU A 95 10.693 2.075 -6.886 1.00 0.00 C ATOM 1283 CG LEU A 95 9.381 1.849 -6.134 1.00 0.00 C ATOM 1284 CD1 LEU A 95 9.605 0.842 -5.005 1.00 0.00 C ATOM 1285 CD2 LEU A 95 8.900 3.176 -5.544 1.00 0.00 C ATOM 0 H LEU A 95 10.112 1.252 -9.384 1.00 0.00 H new ATOM 0 HA LEU A 95 9.910 3.867 -7.866 1.00 0.00 H new ATOM 0 HB2 LEU A 95 11.121 1.119 -7.187 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.420 2.559 -6.234 1.00 0.00 H new ATOM 0 HG LEU A 95 8.630 1.461 -6.822 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.669 0.682 -4.470 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.950 -0.103 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.356 1.229 -4.316 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.965 3.018 -5.007 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.652 3.562 -4.856 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.740 3.895 -6.348 1.00 0.00 H new ATOM 1297 N THR A 96 12.520 4.175 -8.109 1.00 0.00 N ATOM 1298 CA THR A 96 13.824 4.619 -8.683 1.00 0.00 C ATOM 1299 C THR A 96 14.658 5.320 -7.609 1.00 0.00 C ATOM 1300 O THR A 96 14.252 5.434 -6.469 1.00 0.00 O ATOM 1301 CB THR A 96 13.464 5.597 -9.805 1.00 0.00 C ATOM 1302 OG1 THR A 96 14.602 6.384 -10.128 1.00 0.00 O ATOM 1303 CG2 THR A 96 12.324 6.513 -9.353 1.00 0.00 C ATOM 0 H THR A 96 12.299 4.559 -7.190 1.00 0.00 H new ATOM 0 HA THR A 96 14.415 3.781 -9.054 1.00 0.00 H new ATOM 0 HB THR A 96 13.145 5.034 -10.682 1.00 0.00 H new ATOM 0 HG1 THR A 96 15.259 5.831 -10.600 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.074 7.206 -10.156 1.00 0.00 H new ATOM 0 HG22 THR A 96 11.449 5.911 -9.107 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.636 7.075 -8.473 1.00 0.00 H new ATOM 1311 N SER A 97 15.823 5.788 -7.961 1.00 0.00 N ATOM 1312 CA SER A 97 16.683 6.480 -6.958 1.00 0.00 C ATOM 1313 C SER A 97 16.030 7.792 -6.514 1.00 0.00 C ATOM 1314 O SER A 97 16.212 8.241 -5.399 1.00 0.00 O ATOM 1315 CB SER A 97 17.999 6.754 -7.684 1.00 0.00 C ATOM 1316 OG SER A 97 19.062 6.123 -6.983 1.00 0.00 O ATOM 0 H SER A 97 16.218 5.722 -8.899 1.00 0.00 H new ATOM 0 HA SER A 97 16.831 5.881 -6.060 1.00 0.00 H new ATOM 0 HB2 SER A 97 17.949 6.379 -8.706 1.00 0.00 H new ATOM 0 HB3 SER A 97 18.176 7.828 -7.747 1.00 0.00 H new ATOM 0 HG SER A 97 19.908 6.295 -7.447 1.00 0.00 H new ATOM 1322 N GLU A 98 15.269 8.410 -7.375 1.00 0.00 N ATOM 1323 CA GLU A 98 14.606 9.691 -6.999 1.00 0.00 C ATOM 1324 C GLU A 98 13.229 9.413 -6.390 1.00 0.00 C ATOM 1325 O GLU A 98 12.796 8.279 -6.325 1.00 0.00 O ATOM 1326 CB GLU A 98 14.466 10.465 -8.310 1.00 0.00 C ATOM 1327 CG GLU A 98 15.442 11.643 -8.315 1.00 0.00 C ATOM 1328 CD GLU A 98 15.644 12.135 -9.749 1.00 0.00 C ATOM 1329 OE1 GLU A 98 14.679 12.131 -10.497 1.00 0.00 O ATOM 1330 OE2 GLU A 98 16.759 12.506 -10.076 1.00 0.00 O ATOM 0 H GLU A 98 15.078 8.084 -8.322 1.00 0.00 H new ATOM 0 HA GLU A 98 15.176 10.249 -6.256 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.668 9.808 -9.156 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.444 10.826 -8.424 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.056 12.451 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 98 16.397 11.339 -7.886 1.00 0.00 H new ATOM 1337 N PRO A 99 12.586 10.464 -5.962 1.00 0.00 N ATOM 1338 CA PRO A 99 11.241 10.338 -5.350 1.00 0.00 C ATOM 1339 C PRO A 99 10.198 10.008 -6.421 1.00 0.00 C ATOM 1340 O PRO A 99 10.173 10.604 -7.480 1.00 0.00 O ATOM 1341 CB PRO A 99 10.989 11.719 -4.751 1.00 0.00 C ATOM 1342 CG PRO A 99 11.847 12.648 -5.549 1.00 0.00 C ATOM 1343 CD PRO A 99 13.044 11.857 -6.008 1.00 0.00 C ATOM 0 HA PRO A 99 11.179 9.541 -4.609 1.00 0.00 H new ATOM 0 HB2 PRO A 99 9.937 11.994 -4.822 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.255 11.746 -3.694 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.296 13.044 -6.402 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.157 13.501 -4.945 1.00 0.00 H new ATOM 0 HD2 PRO A 99 13.350 12.144 -7.014 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.902 12.017 -5.356 1.00 0.00 H new ATOM 1351 N ARG A 100 9.338 9.063 -6.157 1.00 0.00 N ATOM 1352 CA ARG A 100 8.303 8.699 -7.165 1.00 0.00 C ATOM 1353 C ARG A 100 6.901 8.913 -6.590 1.00 0.00 C ATOM 1354 O ARG A 100 6.339 8.043 -5.954 1.00 0.00 O ATOM 1355 CB ARG A 100 8.541 7.219 -7.461 1.00 0.00 C ATOM 1356 CG ARG A 100 8.814 7.036 -8.954 1.00 0.00 C ATOM 1357 CD ARG A 100 7.936 5.908 -9.499 1.00 0.00 C ATOM 1358 NE ARG A 100 7.101 6.547 -10.554 1.00 0.00 N ATOM 1359 CZ ARG A 100 7.467 6.481 -11.805 1.00 0.00 C ATOM 1360 NH1 ARG A 100 7.548 5.324 -12.401 1.00 0.00 N ATOM 1361 NH2 ARG A 100 7.752 7.574 -12.460 1.00 0.00 N ATOM 0 H ARG A 100 9.307 8.528 -5.289 1.00 0.00 H new ATOM 0 HA ARG A 100 8.372 9.311 -8.064 1.00 0.00 H new ATOM 0 HB2 ARG A 100 9.386 6.852 -6.878 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.671 6.633 -7.165 1.00 0.00 H new ATOM 0 HG2 ARG A 100 8.607 7.963 -9.489 1.00 0.00 H new ATOM 0 HG3 ARG A 100 9.866 6.803 -9.116 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.541 5.100 -9.910 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.317 5.475 -8.714 1.00 0.00 H new ATOM 0 HE ARG A 100 6.243 7.036 -10.299 1.00 0.00 H new ATOM 0 HH11 ARG A 100 7.325 4.470 -11.889 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.834 5.273 -13.379 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.689 8.479 -11.994 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.038 7.523 -13.438 1.00 0.00 H new ATOM 1375 N GLN A 101 6.331 10.066 -6.812 1.00 0.00 N ATOM 1376 CA GLN A 101 4.964 10.337 -6.282 1.00 0.00 C ATOM 1377 C GLN A 101 3.916 9.627 -7.143 1.00 0.00 C ATOM 1378 O GLN A 101 4.139 9.350 -8.305 1.00 0.00 O ATOM 1379 CB GLN A 101 4.797 11.854 -6.376 1.00 0.00 C ATOM 1380 CG GLN A 101 3.399 12.245 -5.891 1.00 0.00 C ATOM 1381 CD GLN A 101 3.297 12.010 -4.383 1.00 0.00 C ATOM 1382 OE1 GLN A 101 2.814 10.983 -3.948 1.00 0.00 O ATOM 1383 NE2 GLN A 101 3.735 12.924 -3.562 1.00 0.00 N ATOM 0 H GLN A 101 6.753 10.832 -7.337 1.00 0.00 H new ATOM 0 HA GLN A 101 4.836 9.976 -5.262 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.555 12.352 -5.772 1.00 0.00 H new ATOM 0 HB3 GLN A 101 4.942 12.183 -7.405 1.00 0.00 H new ATOM 0 HG2 GLN A 101 3.203 13.292 -6.121 1.00 0.00 H new ATOM 0 HG3 GLN A 101 2.644 11.657 -6.413 1.00 0.00 H new ATOM 0 HE21 GLN A 101 4.140 13.786 -3.927 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.672 12.777 -2.555 1.00 0.00 H new ATOM 1392 N VAL A 102 2.775 9.331 -6.584 1.00 0.00 N ATOM 1393 CA VAL A 102 1.717 8.640 -7.374 1.00 0.00 C ATOM 1394 C VAL A 102 0.373 9.350 -7.192 1.00 0.00 C ATOM 1395 O VAL A 102 -0.015 9.693 -6.093 1.00 0.00 O ATOM 1396 CB VAL A 102 1.657 7.224 -6.803 1.00 0.00 C ATOM 1397 CG1 VAL A 102 0.702 6.375 -7.643 1.00 0.00 C ATOM 1398 CG2 VAL A 102 3.055 6.603 -6.837 1.00 0.00 C ATOM 0 H VAL A 102 2.530 9.537 -5.616 1.00 0.00 H new ATOM 0 HA VAL A 102 1.934 8.639 -8.442 1.00 0.00 H new ATOM 0 HB VAL A 102 1.299 7.261 -5.774 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.659 5.365 -7.236 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.294 6.818 -7.621 1.00 0.00 H new ATOM 0 HG13 VAL A 102 1.059 6.336 -8.672 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.014 5.593 -6.430 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.412 6.565 -7.866 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.736 7.208 -6.239 1.00 0.00 H new ATOM 1408 N THR A 103 -0.339 9.574 -8.262 1.00 0.00 N ATOM 1409 CA THR A 103 -1.658 10.263 -8.151 1.00 0.00 C ATOM 1410 C THR A 103 -2.595 9.790 -9.265 1.00 0.00 C ATOM 1411 O THR A 103 -2.344 10.010 -10.434 1.00 0.00 O ATOM 1412 CB THR A 103 -1.343 11.751 -8.309 1.00 0.00 C ATOM 1413 OG1 THR A 103 0.044 11.967 -8.088 1.00 0.00 O ATOM 1414 CG2 THR A 103 -2.154 12.558 -7.295 1.00 0.00 C ATOM 0 H THR A 103 -0.066 9.310 -9.209 1.00 0.00 H new ATOM 0 HA THR A 103 -2.157 10.052 -7.205 1.00 0.00 H new ATOM 0 HB THR A 103 -1.605 12.072 -9.317 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.222 11.990 -7.125 1.00 0.00 H new ATOM 0 HG21 THR A 103 -1.928 13.618 -7.409 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.218 12.393 -7.466 1.00 0.00 H new ATOM 0 HG23 THR A 103 -1.895 12.239 -6.285 1.00 0.00 H new ATOM 1422 N GLU A 104 -3.672 9.140 -8.915 1.00 0.00 N ATOM 1423 CA GLU A 104 -4.619 8.655 -9.961 1.00 0.00 C ATOM 1424 C GLU A 104 -5.996 8.386 -9.348 1.00 0.00 C ATOM 1425 O GLU A 104 -6.118 7.727 -8.335 1.00 0.00 O ATOM 1426 CB GLU A 104 -4.001 7.357 -10.481 1.00 0.00 C ATOM 1427 CG GLU A 104 -3.037 7.672 -11.626 1.00 0.00 C ATOM 1428 CD GLU A 104 -3.168 6.603 -12.712 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -2.660 5.512 -12.508 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -3.775 6.892 -13.731 1.00 0.00 O ATOM 0 H GLU A 104 -3.937 8.924 -7.954 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.765 9.386 -10.756 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.472 6.846 -9.677 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.784 6.682 -10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.257 8.656 -12.041 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -2.013 7.705 -11.255 1.00 0.00 H new ATOM 1437 N THR A 105 -7.035 8.888 -9.959 1.00 0.00 N ATOM 1438 CA THR A 105 -8.404 8.659 -9.414 1.00 0.00 C ATOM 1439 C THR A 105 -9.000 7.381 -10.011 1.00 0.00 C ATOM 1440 O THR A 105 -9.404 7.350 -11.157 1.00 0.00 O ATOM 1441 CB THR A 105 -9.214 9.882 -9.845 1.00 0.00 C ATOM 1442 OG1 THR A 105 -8.737 11.030 -9.156 1.00 0.00 O ATOM 1443 CG2 THR A 105 -10.691 9.662 -9.515 1.00 0.00 C ATOM 0 H THR A 105 -6.995 9.447 -10.812 1.00 0.00 H new ATOM 0 HA THR A 105 -8.403 8.535 -8.331 1.00 0.00 H new ATOM 0 HB THR A 105 -9.104 10.031 -10.919 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.254 11.816 -9.432 1.00 0.00 H new ATOM 0 HG21 THR A 105 -11.267 10.535 -9.823 1.00 0.00 H new ATOM 0 HG22 THR A 105 -11.055 8.782 -10.045 1.00 0.00 H new ATOM 0 HG23 THR A 105 -10.806 9.512 -8.441 1.00 0.00 H new ATOM 1451 N PHE A 106 -9.055 6.327 -9.245 1.00 0.00 N ATOM 1452 CA PHE A 106 -9.621 5.051 -9.771 1.00 0.00 C ATOM 1453 C PHE A 106 -11.002 4.788 -9.164 1.00 0.00 C ATOM 1454 O PHE A 106 -11.312 5.241 -8.080 1.00 0.00 O ATOM 1455 CB PHE A 106 -8.631 3.971 -9.329 1.00 0.00 C ATOM 1456 CG PHE A 106 -8.765 3.744 -7.841 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -9.687 2.808 -7.355 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -7.969 4.470 -6.947 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -9.812 2.599 -5.976 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -8.095 4.261 -5.568 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.016 3.325 -5.083 1.00 0.00 C ATOM 0 H PHE A 106 -8.733 6.293 -8.278 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.751 5.074 -10.853 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -8.824 3.043 -9.868 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.613 4.275 -9.571 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -10.301 2.248 -8.044 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.258 5.191 -7.321 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -10.523 1.877 -5.602 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -7.482 4.822 -4.879 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.112 3.163 -4.020 1.00 0.00 H new ATOM 1471 N THR A 107 -11.830 4.050 -9.852 1.00 0.00 N ATOM 1472 CA THR A 107 -13.186 3.749 -9.310 1.00 0.00 C ATOM 1473 C THR A 107 -13.143 2.447 -8.507 1.00 0.00 C ATOM 1474 O THR A 107 -13.345 1.373 -9.038 1.00 0.00 O ATOM 1475 CB THR A 107 -14.082 3.595 -10.540 1.00 0.00 C ATOM 1476 OG1 THR A 107 -14.211 4.852 -11.190 1.00 0.00 O ATOM 1477 CG2 THR A 107 -15.462 3.097 -10.109 1.00 0.00 C ATOM 0 H THR A 107 -11.627 3.643 -10.765 1.00 0.00 H new ATOM 0 HA THR A 107 -13.552 4.528 -8.641 1.00 0.00 H new ATOM 0 HB THR A 107 -13.637 2.875 -11.226 1.00 0.00 H new ATOM 0 HG1 THR A 107 -14.783 4.755 -11.979 1.00 0.00 H new ATOM 0 HG21 THR A 107 -16.100 2.988 -10.986 1.00 0.00 H new ATOM 0 HG22 THR A 107 -15.362 2.133 -9.611 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.910 3.815 -9.422 1.00 0.00 H new ATOM 1485 N ALA A 108 -12.872 2.534 -7.233 1.00 0.00 N ATOM 1486 CA ALA A 108 -12.806 1.301 -6.398 1.00 0.00 C ATOM 1487 C ALA A 108 -13.946 0.347 -6.762 1.00 0.00 C ATOM 1488 O ALA A 108 -15.075 0.532 -6.357 1.00 0.00 O ATOM 1489 CB ALA A 108 -12.957 1.789 -4.958 1.00 0.00 C ATOM 0 H ALA A 108 -12.693 3.406 -6.734 1.00 0.00 H new ATOM 0 HA ALA A 108 -11.876 0.753 -6.549 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -12.919 0.937 -4.279 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.147 2.479 -4.721 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -13.913 2.300 -4.845 1.00 0.00 H new ATOM 1495 N SER A 109 -13.657 -0.674 -7.521 1.00 0.00 N ATOM 1496 CA SER A 109 -14.723 -1.641 -7.908 1.00 0.00 C ATOM 1497 C SER A 109 -14.879 -2.712 -6.825 1.00 0.00 C ATOM 1498 O SER A 109 -14.782 -3.894 -7.088 1.00 0.00 O ATOM 1499 CB SER A 109 -14.237 -2.267 -9.214 1.00 0.00 C ATOM 1500 OG SER A 109 -13.086 -3.060 -8.955 1.00 0.00 O ATOM 0 H SER A 109 -12.729 -0.881 -7.890 1.00 0.00 H new ATOM 0 HA SER A 109 -15.695 -1.161 -8.025 1.00 0.00 H new ATOM 0 HB2 SER A 109 -15.024 -2.881 -9.652 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.000 -1.488 -9.938 1.00 0.00 H new ATOM 0 HG SER A 109 -13.334 -3.823 -8.392 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.117 -2.306 -5.608 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.277 -3.300 -4.508 1.00 0.00 C ATOM 1508 C ALA A 110 -16.027 -2.669 -3.333 1.00 0.00 C ATOM 1509 O ALA A 110 -16.783 -1.731 -3.498 1.00 0.00 O ATOM 1510 CB ALA A 110 -13.852 -3.670 -4.098 1.00 0.00 C ATOM 0 H ALA A 110 -15.208 -1.330 -5.327 1.00 0.00 H new ATOM 0 HA ALA A 110 -15.850 -4.173 -4.819 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -13.884 -4.400 -3.290 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -13.327 -4.097 -4.952 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.327 -2.777 -3.759 1.00 0.00 H new ATOM 1516 N THR A 111 -15.830 -3.176 -2.146 1.00 0.00 N ATOM 1517 CA THR A 111 -16.539 -2.600 -0.971 1.00 0.00 C ATOM 1518 C THR A 111 -15.824 -2.979 0.328 1.00 0.00 C ATOM 1519 O THR A 111 -15.833 -4.122 0.741 1.00 0.00 O ATOM 1520 CB THR A 111 -17.929 -3.228 -1.009 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.473 -3.096 -2.314 1.00 0.00 O ATOM 1522 CG2 THR A 111 -18.833 -2.522 0.002 1.00 0.00 C ATOM 0 H THR A 111 -15.211 -3.961 -1.941 1.00 0.00 H new ATOM 0 HA THR A 111 -16.573 -1.511 -1.007 1.00 0.00 H new ATOM 0 HB THR A 111 -17.860 -4.286 -0.754 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.365 -3.500 -2.339 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.827 -2.969 -0.024 1.00 0.00 H new ATOM 0 HG22 THR A 111 -18.413 -2.628 1.002 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.905 -1.464 -0.251 1.00 0.00 H new ATOM 1530 N TYR A 112 -15.219 -2.028 0.985 1.00 0.00 N ATOM 1531 CA TYR A 112 -14.522 -2.339 2.266 1.00 0.00 C ATOM 1532 C TYR A 112 -15.247 -1.658 3.431 1.00 0.00 C ATOM 1533 O TYR A 112 -15.162 -0.457 3.593 1.00 0.00 O ATOM 1534 CB TYR A 112 -13.109 -1.764 2.133 1.00 0.00 C ATOM 1535 CG TYR A 112 -12.508 -2.112 0.789 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.930 -3.251 0.092 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -11.517 -1.286 0.241 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -12.362 -3.560 -1.153 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.955 -1.592 -1.003 1.00 0.00 C ATOM 1540 CZ TYR A 112 -11.377 -2.728 -1.699 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.831 -3.022 -2.930 1.00 0.00 O ATOM 0 H TYR A 112 -15.177 -1.052 0.692 1.00 0.00 H new ATOM 0 HA TYR A 112 -14.503 -3.412 2.459 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -13.140 -0.681 2.252 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -12.477 -2.154 2.930 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -13.692 -3.891 0.512 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -11.186 -0.411 0.781 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.684 -4.440 -1.690 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.195 -0.951 -1.425 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.260 -3.824 -3.295 1.00 0.00 H new ATOM 1551 N PRO A 113 -15.936 -2.448 4.208 1.00 0.00 N ATOM 1552 CA PRO A 113 -16.678 -1.906 5.373 1.00 0.00 C ATOM 1553 C PRO A 113 -15.699 -1.505 6.480 1.00 0.00 C ATOM 1554 O PRO A 113 -14.530 -1.282 6.235 1.00 0.00 O ATOM 1555 CB PRO A 113 -17.555 -3.074 5.813 1.00 0.00 C ATOM 1556 CG PRO A 113 -16.846 -4.296 5.324 1.00 0.00 C ATOM 1557 CD PRO A 113 -16.088 -3.901 4.081 1.00 0.00 C ATOM 0 HA PRO A 113 -17.258 -1.013 5.141 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -17.673 -3.093 6.896 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -18.555 -3.000 5.385 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.165 -4.677 6.085 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -17.557 -5.092 5.105 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -15.121 -4.401 4.027 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -16.636 -4.168 3.177 1.00 0.00 H new ATOM 1565 N ALA A 114 -16.163 -1.410 7.696 1.00 0.00 N ATOM 1566 CA ALA A 114 -15.251 -1.022 8.811 1.00 0.00 C ATOM 1567 C ALA A 114 -15.297 -2.071 9.925 1.00 0.00 C ATOM 1568 O ALA A 114 -15.055 -1.777 11.078 1.00 0.00 O ATOM 1569 CB ALA A 114 -15.787 0.319 9.314 1.00 0.00 C ATOM 0 H ALA A 114 -17.131 -1.584 7.966 1.00 0.00 H new ATOM 0 HA ALA A 114 -14.213 -0.950 8.487 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -15.167 0.673 10.138 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -15.763 1.047 8.504 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -16.813 0.194 9.659 1.00 0.00 H new ATOM 1661 N GLU A 122 -12.623 -6.400 5.325 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.326 -4.950 5.531 1.00 0.00 C ATOM 1663 C GLU A 122 -11.645 -4.365 4.289 1.00 0.00 C ATOM 1664 O GLU A 122 -11.769 -4.887 3.200 1.00 0.00 O ATOM 1665 CB GLU A 122 -11.384 -4.904 6.735 1.00 0.00 C ATOM 1666 CG GLU A 122 -9.990 -5.376 6.316 1.00 0.00 C ATOM 1667 CD GLU A 122 -9.452 -6.363 7.353 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -10.107 -7.367 7.583 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -8.394 -6.099 7.900 1.00 0.00 O ATOM 0 HA GLU A 122 -13.230 -4.364 5.700 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -11.332 -3.889 7.130 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -11.768 -5.538 7.534 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.035 -5.851 5.336 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.317 -4.523 6.227 1.00 0.00 H new ATOM 1676 N GLY A 123 -10.929 -3.283 4.446 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.241 -2.664 3.274 1.00 0.00 C ATOM 1678 C GLY A 123 -8.776 -2.404 3.620 1.00 0.00 C ATOM 1679 O GLY A 123 -8.462 -1.857 4.659 1.00 0.00 O ATOM 0 H GLY A 123 -10.791 -2.801 5.334 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.310 -3.324 2.409 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.733 -1.730 3.002 1.00 0.00 H new ATOM 1683 N GLN A 124 -7.873 -2.792 2.762 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.430 -2.562 3.053 1.00 0.00 C ATOM 1685 C GLN A 124 -5.635 -2.386 1.755 1.00 0.00 C ATOM 1686 O GLN A 124 -6.189 -2.349 0.670 1.00 0.00 O ATOM 1687 CB GLN A 124 -5.974 -3.822 3.792 1.00 0.00 C ATOM 1688 CG GLN A 124 -6.058 -5.027 2.852 1.00 0.00 C ATOM 1689 CD GLN A 124 -5.060 -6.095 3.302 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -4.945 -6.370 4.572 1.00 0.00 O flip ATOM 1691 NE2 GLN A 124 -4.377 -6.686 2.489 1.00 0.00 N flip ATOM 0 H GLN A 124 -8.071 -3.256 1.876 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.271 -1.657 3.640 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -4.952 -3.697 4.149 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.599 -3.988 4.669 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -7.069 -5.434 2.855 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.841 -4.720 1.829 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -4.466 -6.472 1.496 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.714 -7.396 2.800 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.337 -2.293 1.867 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.480 -2.132 0.659 1.00 0.00 C ATOM 1702 C ILE A 125 -2.529 -3.325 0.561 1.00 0.00 C ATOM 1703 O ILE A 125 -2.064 -3.842 1.560 1.00 0.00 O ATOM 1704 CB ILE A 125 -2.701 -0.831 0.889 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.573 0.359 0.481 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.418 -0.832 0.049 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -3.119 1.609 1.237 1.00 0.00 C ATOM 0 H ILE A 125 -3.830 -2.322 2.752 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.053 -2.091 -0.267 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.437 -0.753 1.944 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.500 0.525 -0.594 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.620 0.148 0.701 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -0.871 0.096 0.219 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -0.795 -1.678 0.338 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.675 -0.914 -1.007 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.740 2.456 0.946 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -3.215 1.440 2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.078 1.823 0.995 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.246 -3.776 -0.629 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.339 -4.946 -0.776 1.00 0.00 C ATOM 1721 C ALA A 126 -0.044 -4.558 -1.493 1.00 0.00 C ATOM 1722 O ALA A 126 -0.052 -4.138 -2.634 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.130 -5.952 -1.612 1.00 0.00 C ATOM 0 H ALA A 126 -2.602 -3.387 -1.502 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.042 -5.349 0.192 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.529 -6.848 -1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.049 -6.217 -1.089 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.377 -5.509 -2.577 1.00 0.00 H new ATOM 1729 N PHE A 127 1.069 -4.732 -0.835 1.00 0.00 N ATOM 1730 CA PHE A 127 2.386 -4.415 -1.461 1.00 0.00 C ATOM 1731 C PHE A 127 3.193 -5.711 -1.550 1.00 0.00 C ATOM 1732 O PHE A 127 3.842 -6.117 -0.608 1.00 0.00 O ATOM 1733 CB PHE A 127 3.073 -3.423 -0.511 1.00 0.00 C ATOM 1734 CG PHE A 127 2.763 -1.994 -0.910 1.00 0.00 C ATOM 1735 CD1 PHE A 127 1.584 -1.688 -1.601 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.666 -0.969 -0.588 1.00 0.00 C ATOM 1737 CE1 PHE A 127 1.307 -0.366 -1.968 1.00 0.00 C ATOM 1738 CE2 PHE A 127 3.388 0.352 -0.956 1.00 0.00 C ATOM 1739 CZ PHE A 127 2.209 0.654 -1.646 1.00 0.00 C ATOM 0 H PHE A 127 1.124 -5.084 0.121 1.00 0.00 H new ATOM 0 HA PHE A 127 2.292 -3.992 -2.461 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.739 -3.601 0.511 1.00 0.00 H new ATOM 0 HB3 PHE A 127 4.151 -3.584 -0.527 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.887 -2.474 -1.851 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.577 -1.200 -0.055 1.00 0.00 H new ATOM 0 HE1 PHE A 127 0.396 -0.133 -2.500 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.084 1.139 -0.707 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.995 1.674 -1.930 1.00 0.00 H new ATOM 1749 N GLN A 128 3.127 -6.386 -2.662 1.00 0.00 N ATOM 1750 CA GLN A 128 3.860 -7.676 -2.790 1.00 0.00 C ATOM 1751 C GLN A 128 5.282 -7.464 -3.311 1.00 0.00 C ATOM 1752 O GLN A 128 5.500 -7.232 -4.484 1.00 0.00 O ATOM 1753 CB GLN A 128 3.042 -8.491 -3.792 1.00 0.00 C ATOM 1754 CG GLN A 128 1.576 -8.518 -3.354 1.00 0.00 C ATOM 1755 CD GLN A 128 1.490 -8.931 -1.883 1.00 0.00 C ATOM 1756 OE1 GLN A 128 1.210 -8.116 -1.027 1.00 0.00 O ATOM 1757 NE2 GLN A 128 1.720 -10.172 -1.552 1.00 0.00 N ATOM 0 H GLN A 128 2.598 -6.102 -3.487 1.00 0.00 H new ATOM 0 HA GLN A 128 3.963 -8.175 -1.827 1.00 0.00 H new ATOM 0 HB2 GLN A 128 3.127 -8.054 -4.787 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.432 -9.507 -3.855 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.126 -7.535 -3.494 1.00 0.00 H new ATOM 0 HG3 GLN A 128 1.013 -9.217 -3.973 1.00 0.00 H new ATOM 0 HE21 GLN A 128 1.955 -10.856 -2.271 1.00 0.00 H new ATOM 0 HE22 GLN A 128 1.665 -10.458 -0.574 1.00 0.00 H new ATOM 1766 N LEU A 129 6.253 -7.574 -2.446 1.00 0.00 N ATOM 1767 CA LEU A 129 7.668 -7.418 -2.880 1.00 0.00 C ATOM 1768 C LEU A 129 8.286 -8.810 -3.045 1.00 0.00 C ATOM 1769 O LEU A 129 9.340 -9.106 -2.519 1.00 0.00 O ATOM 1770 CB LEU A 129 8.363 -6.647 -1.752 1.00 0.00 C ATOM 1771 CG LEU A 129 7.587 -5.363 -1.439 1.00 0.00 C ATOM 1772 CD1 LEU A 129 8.459 -4.434 -0.594 1.00 0.00 C ATOM 1773 CD2 LEU A 129 7.210 -4.656 -2.742 1.00 0.00 C ATOM 0 H LEU A 129 6.125 -7.766 -1.452 1.00 0.00 H new ATOM 0 HA LEU A 129 7.765 -6.891 -3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.426 -7.270 -0.860 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.385 -6.402 -2.043 1.00 0.00 H new ATOM 0 HG LEU A 129 6.680 -5.616 -0.889 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.908 -3.521 -0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.726 -4.933 0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.366 -4.185 -1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.658 -3.744 -2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.115 -4.405 -3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 129 6.587 -5.315 -3.347 1.00 0.00 H new ATOM 1785 N GLY A 130 7.617 -9.674 -3.760 1.00 0.00 N ATOM 1786 CA GLY A 130 8.140 -11.057 -3.955 1.00 0.00 C ATOM 1787 C GLY A 130 9.383 -11.026 -4.846 1.00 0.00 C ATOM 1788 O GLY A 130 9.306 -11.237 -6.040 1.00 0.00 O ATOM 0 H GLY A 130 6.727 -9.481 -4.219 1.00 0.00 H new ATOM 0 HA2 GLY A 130 8.385 -11.501 -2.990 1.00 0.00 H new ATOM 0 HA3 GLY A 130 7.373 -11.684 -4.409 1.00 0.00 H new ATOM 1792 N GLY A 131 10.526 -10.775 -4.267 1.00 0.00 N ATOM 1793 CA GLY A 131 11.788 -10.736 -5.063 1.00 0.00 C ATOM 1794 C GLY A 131 11.536 -10.070 -6.417 1.00 0.00 C ATOM 1795 O GLY A 131 11.514 -10.720 -7.443 1.00 0.00 O ATOM 0 H GLY A 131 10.641 -10.594 -3.270 1.00 0.00 H new ATOM 0 HA2 GLY A 131 12.555 -10.187 -4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 131 12.165 -11.748 -5.211 1.00 0.00 H new ATOM 1799 N PHE A 132 11.347 -8.779 -6.432 1.00 0.00 N ATOM 1800 CA PHE A 132 11.100 -8.080 -7.726 1.00 0.00 C ATOM 1801 C PHE A 132 12.399 -7.458 -8.245 1.00 0.00 C ATOM 1802 O PHE A 132 12.684 -7.488 -9.426 1.00 0.00 O ATOM 1803 CB PHE A 132 10.070 -6.997 -7.404 1.00 0.00 C ATOM 1804 CG PHE A 132 8.680 -7.556 -7.596 1.00 0.00 C ATOM 1805 CD1 PHE A 132 8.149 -7.683 -8.885 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.922 -7.946 -6.485 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.860 -8.201 -9.063 1.00 0.00 C ATOM 1808 CE2 PHE A 132 6.633 -8.464 -6.664 1.00 0.00 C ATOM 1809 CZ PHE A 132 6.102 -8.591 -7.953 1.00 0.00 C ATOM 0 H PHE A 132 11.353 -8.179 -5.607 1.00 0.00 H new ATOM 0 HA PHE A 132 10.743 -8.758 -8.502 1.00 0.00 H new ATOM 0 HB2 PHE A 132 10.197 -6.652 -6.378 1.00 0.00 H new ATOM 0 HB3 PHE A 132 10.219 -6.133 -8.052 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.733 -7.382 -9.742 1.00 0.00 H new ATOM 0 HD2 PHE A 132 8.331 -7.847 -5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.451 -8.300 -10.058 1.00 0.00 H new ATOM 0 HE2 PHE A 132 6.049 -8.766 -5.807 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.108 -8.990 -8.091 1.00 0.00 H new ATOM 1819 N SER A 133 13.193 -6.902 -7.371 1.00 0.00 N ATOM 1820 CA SER A 133 14.477 -6.288 -7.817 1.00 0.00 C ATOM 1821 C SER A 133 15.595 -7.336 -7.787 1.00 0.00 C ATOM 1822 O SER A 133 15.360 -8.497 -7.515 1.00 0.00 O ATOM 1823 CB SER A 133 14.747 -5.168 -6.814 1.00 0.00 C ATOM 1824 OG SER A 133 16.150 -4.993 -6.667 1.00 0.00 O ATOM 0 H SER A 133 13.009 -6.846 -6.369 1.00 0.00 H new ATOM 0 HA SER A 133 14.430 -5.909 -8.838 1.00 0.00 H new ATOM 0 HB2 SER A 133 14.288 -4.240 -7.156 1.00 0.00 H new ATOM 0 HB3 SER A 133 14.297 -5.411 -5.851 1.00 0.00 H new ATOM 0 HG SER A 133 16.428 -5.309 -5.782 1.00 0.00 H new ATOM 1830 N ALA A 134 16.807 -6.944 -8.075 1.00 0.00 N ATOM 1831 CA ALA A 134 17.927 -7.931 -8.074 1.00 0.00 C ATOM 1832 C ALA A 134 18.642 -7.950 -6.715 1.00 0.00 C ATOM 1833 O ALA A 134 18.191 -8.577 -5.778 1.00 0.00 O ATOM 1834 CB ALA A 134 18.869 -7.457 -9.181 1.00 0.00 C ATOM 0 H ALA A 134 17.070 -5.987 -8.310 1.00 0.00 H new ATOM 0 HA ALA A 134 17.575 -8.949 -8.244 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.723 -8.132 -9.246 1.00 0.00 H new ATOM 0 HB2 ALA A 134 18.338 -7.451 -10.133 1.00 0.00 H new ATOM 0 HB3 ALA A 134 19.219 -6.450 -8.954 1.00 0.00 H new ATOM 1840 N ASP A 135 19.761 -7.281 -6.602 1.00 0.00 N ATOM 1841 CA ASP A 135 20.505 -7.278 -5.307 1.00 0.00 C ATOM 1842 C ASP A 135 19.652 -6.672 -4.190 1.00 0.00 C ATOM 1843 O ASP A 135 18.543 -6.227 -4.410 1.00 0.00 O ATOM 1844 CB ASP A 135 21.740 -6.415 -5.565 1.00 0.00 C ATOM 1845 CG ASP A 135 22.755 -7.208 -6.391 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.361 -8.198 -6.985 1.00 0.00 O ATOM 1847 OD2 ASP A 135 23.908 -6.812 -6.416 1.00 0.00 O ATOM 0 H ASP A 135 20.191 -6.737 -7.350 1.00 0.00 H new ATOM 0 HA ASP A 135 20.765 -8.286 -4.985 1.00 0.00 H new ATOM 0 HB2 ASP A 135 21.457 -5.505 -6.094 1.00 0.00 H new ATOM 0 HB3 ASP A 135 22.186 -6.108 -4.619 1.00 0.00 H new ATOM 1852 N ALA A 136 20.168 -6.655 -2.990 1.00 0.00 N ATOM 1853 CA ALA A 136 19.398 -6.081 -1.849 1.00 0.00 C ATOM 1854 C ALA A 136 18.936 -4.663 -2.180 1.00 0.00 C ATOM 1855 O ALA A 136 19.680 -3.864 -2.712 1.00 0.00 O ATOM 1856 CB ALA A 136 20.381 -6.065 -0.678 1.00 0.00 C ATOM 0 H ALA A 136 21.092 -7.015 -2.751 1.00 0.00 H new ATOM 0 HA ALA A 136 18.502 -6.660 -1.623 1.00 0.00 H new ATOM 0 HB1 ALA A 136 19.889 -5.655 0.204 1.00 0.00 H new ATOM 0 HB2 ALA A 136 20.714 -7.082 -0.468 1.00 0.00 H new ATOM 0 HB3 ALA A 136 21.242 -5.447 -0.934 1.00 0.00 H new ATOM 1862 N TRP A 137 17.713 -4.345 -1.865 1.00 0.00 N ATOM 1863 CA TRP A 137 17.204 -2.978 -2.157 1.00 0.00 C ATOM 1864 C TRP A 137 16.231 -2.536 -1.069 1.00 0.00 C ATOM 1865 O TRP A 137 16.114 -3.166 -0.036 1.00 0.00 O ATOM 1866 CB TRP A 137 16.514 -3.085 -3.519 1.00 0.00 C ATOM 1867 CG TRP A 137 15.144 -3.672 -3.371 1.00 0.00 C ATOM 1868 CD1 TRP A 137 14.042 -2.977 -3.007 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.706 -5.047 -3.590 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.959 -3.837 -2.988 1.00 0.00 N ATOM 1871 CE2 TRP A 137 13.315 -5.119 -3.340 1.00 0.00 C ATOM 1872 CE3 TRP A 137 15.369 -6.229 -3.975 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 12.606 -6.312 -3.469 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.655 -7.434 -4.106 1.00 0.00 C ATOM 1875 CH2 TRP A 137 13.276 -7.473 -3.853 1.00 0.00 C ATOM 0 H TRP A 137 17.044 -4.972 -1.418 1.00 0.00 H new ATOM 0 HA TRP A 137 18.000 -2.233 -2.178 1.00 0.00 H new ATOM 0 HB2 TRP A 137 16.445 -2.098 -3.976 1.00 0.00 H new ATOM 0 HB3 TRP A 137 17.111 -3.705 -4.188 1.00 0.00 H new ATOM 0 HD1 TRP A 137 14.013 -1.924 -2.770 1.00 0.00 H new ATOM 0 HE1 TRP A 137 12.010 -3.555 -2.742 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.431 -6.210 -4.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 11.544 -6.337 -3.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 15.172 -8.335 -4.403 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.734 -8.401 -3.956 1.00 0.00 H new ATOM 1886 N THR A 138 15.549 -1.448 -1.276 1.00 0.00 N ATOM 1887 CA THR A 138 14.612 -0.970 -0.230 1.00 0.00 C ATOM 1888 C THR A 138 13.579 -0.003 -0.824 1.00 0.00 C ATOM 1889 O THR A 138 13.784 0.578 -1.871 1.00 0.00 O ATOM 1890 CB THR A 138 15.537 -0.278 0.786 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.097 -0.570 2.103 1.00 0.00 O ATOM 1892 CG2 THR A 138 15.544 1.242 0.578 1.00 0.00 C ATOM 0 H THR A 138 15.599 -0.874 -2.117 1.00 0.00 H new ATOM 0 HA THR A 138 14.023 -1.767 0.224 1.00 0.00 H new ATOM 0 HB THR A 138 16.550 -0.652 0.638 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.141 -0.787 2.088 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.206 1.706 1.309 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.897 1.470 -0.428 1.00 0.00 H new ATOM 0 HG23 THR A 138 14.534 1.631 0.704 1.00 0.00 H new ATOM 1900 N LEU A 139 12.478 0.180 -0.149 1.00 0.00 N ATOM 1901 CA LEU A 139 11.435 1.118 -0.652 1.00 0.00 C ATOM 1902 C LEU A 139 11.223 2.232 0.370 1.00 0.00 C ATOM 1903 O LEU A 139 11.572 2.094 1.524 1.00 0.00 O ATOM 1904 CB LEU A 139 10.165 0.278 -0.794 1.00 0.00 C ATOM 1905 CG LEU A 139 10.091 -0.312 -2.203 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.776 -1.679 -2.223 1.00 0.00 C ATOM 1907 CD2 LEU A 139 8.623 -0.468 -2.608 1.00 0.00 C ATOM 0 H LEU A 139 12.255 -0.282 0.733 1.00 0.00 H new ATOM 0 HA LEU A 139 11.714 1.583 -1.598 1.00 0.00 H new ATOM 0 HB2 LEU A 139 10.162 -0.522 -0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 139 9.287 0.894 -0.601 1.00 0.00 H new ATOM 0 HG LEU A 139 10.595 0.353 -2.904 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.722 -2.098 -3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.820 -1.567 -1.932 1.00 0.00 H new ATOM 0 HD13 LEU A 139 10.274 -2.348 -1.524 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.565 -0.888 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU A 139 8.121 -1.134 -1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 139 8.136 0.507 -2.594 1.00 0.00 H new ATOM 1919 N CYS A 140 10.661 3.334 -0.036 1.00 0.00 N ATOM 1920 CA CYS A 140 10.440 4.445 0.931 1.00 0.00 C ATOM 1921 C CYS A 140 9.213 5.268 0.534 1.00 0.00 C ATOM 1922 O CYS A 140 9.276 6.112 -0.338 1.00 0.00 O ATOM 1923 CB CYS A 140 11.707 5.297 0.852 1.00 0.00 C ATOM 1924 SG CYS A 140 12.992 4.563 1.895 1.00 0.00 S ATOM 0 H CYS A 140 10.346 3.514 -0.989 1.00 0.00 H new ATOM 0 HA CYS A 140 10.256 4.078 1.941 1.00 0.00 H new ATOM 0 HB2 CYS A 140 12.053 5.360 -0.180 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.495 6.315 1.179 1.00 0.00 H new ATOM 1929 N LEU A 141 8.100 5.038 1.176 1.00 0.00 N ATOM 1930 CA LEU A 141 6.875 5.820 0.843 1.00 0.00 C ATOM 1931 C LEU A 141 6.735 6.990 1.822 1.00 0.00 C ATOM 1932 O LEU A 141 7.579 7.203 2.668 1.00 0.00 O ATOM 1933 CB LEU A 141 5.710 4.841 1.003 1.00 0.00 C ATOM 1934 CG LEU A 141 5.979 3.577 0.181 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.918 2.358 1.100 1.00 0.00 C ATOM 1936 CD2 LEU A 141 4.919 3.435 -0.918 1.00 0.00 C ATOM 0 H LEU A 141 7.986 4.344 1.915 1.00 0.00 H new ATOM 0 HA LEU A 141 6.907 6.237 -0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.582 4.582 2.054 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.782 5.309 0.675 1.00 0.00 H new ATOM 0 HG LEU A 141 6.965 3.648 -0.278 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.109 1.455 0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.672 2.453 1.881 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.930 2.295 1.555 1.00 0.00 H new ATOM 0 HD21 LEU A 141 5.116 2.534 -1.499 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.931 3.365 -0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.956 4.305 -1.574 1.00 0.00 H new ATOM 1948 N ASP A 142 5.676 7.745 1.715 1.00 0.00 N ATOM 1949 CA ASP A 142 5.479 8.905 2.643 1.00 0.00 C ATOM 1950 C ASP A 142 4.365 9.812 2.119 1.00 0.00 C ATOM 1951 O ASP A 142 4.587 10.969 1.820 1.00 0.00 O ATOM 1952 CB ASP A 142 6.813 9.661 2.657 1.00 0.00 C ATOM 1953 CG ASP A 142 7.414 9.684 1.249 1.00 0.00 C ATOM 1954 OD1 ASP A 142 6.671 9.467 0.306 1.00 0.00 O ATOM 1955 OD2 ASP A 142 8.606 9.918 1.139 1.00 0.00 O ATOM 0 H ASP A 142 4.936 7.612 1.026 1.00 0.00 H new ATOM 0 HA ASP A 142 5.193 8.578 3.642 1.00 0.00 H new ATOM 0 HB2 ASP A 142 6.660 10.680 3.013 1.00 0.00 H new ATOM 0 HB3 ASP A 142 7.505 9.182 3.349 1.00 0.00 H new ATOM 1960 N ASP A 143 3.170 9.289 2.008 1.00 0.00 N ATOM 1961 CA ASP A 143 2.016 10.096 1.501 1.00 0.00 C ATOM 1962 C ASP A 143 0.920 9.152 1.009 1.00 0.00 C ATOM 1963 O ASP A 143 0.378 9.321 -0.064 1.00 0.00 O ATOM 1964 CB ASP A 143 2.555 10.920 0.327 1.00 0.00 C ATOM 1965 CG ASP A 143 2.678 12.387 0.745 1.00 0.00 C ATOM 1966 OD1 ASP A 143 2.047 12.759 1.720 1.00 0.00 O ATOM 1967 OD2 ASP A 143 3.402 13.112 0.083 1.00 0.00 O ATOM 0 H ASP A 143 2.941 8.325 2.250 1.00 0.00 H new ATOM 0 HA ASP A 143 1.596 10.737 2.277 1.00 0.00 H new ATOM 0 HB2 ASP A 143 3.527 10.537 0.016 1.00 0.00 H new ATOM 0 HB3 ASP A 143 1.888 10.830 -0.530 1.00 0.00 H new ATOM 1972 N VAL A 144 0.600 8.150 1.780 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.450 7.185 1.348 1.00 0.00 C ATOM 1974 C VAL A 144 -1.830 7.650 1.818 1.00 0.00 C ATOM 1975 O VAL A 144 -2.126 7.665 2.996 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.070 5.859 2.007 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -0.817 4.720 1.315 1.00 0.00 C ATOM 1978 CG2 VAL A 144 1.438 5.627 1.868 1.00 0.00 C ATOM 0 H VAL A 144 1.020 7.958 2.690 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.504 7.096 0.263 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.337 5.891 3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.549 3.772 1.782 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.891 4.880 1.409 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.545 4.694 0.260 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.706 4.681 2.339 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.705 5.595 0.812 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.978 6.440 2.354 1.00 0.00 H new ATOM 1988 N ALA A 145 -2.678 8.030 0.903 1.00 0.00 N ATOM 1989 CA ALA A 145 -4.039 8.496 1.294 1.00 0.00 C ATOM 1990 C ALA A 145 -5.095 7.873 0.376 1.00 0.00 C ATOM 1991 O ALA A 145 -4.828 7.554 -0.766 1.00 0.00 O ATOM 1992 CB ALA A 145 -4.004 10.014 1.118 1.00 0.00 C ATOM 0 H ALA A 145 -2.488 8.038 -0.099 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.296 8.210 2.314 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -4.973 10.434 1.387 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -3.234 10.437 1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -3.780 10.255 0.079 1.00 0.00 H new ATOM 1998 N LEU A 146 -6.291 7.699 0.867 1.00 0.00 N ATOM 1999 CA LEU A 146 -7.364 7.097 0.024 1.00 0.00 C ATOM 2000 C LEU A 146 -8.737 7.607 0.472 1.00 0.00 C ATOM 2001 O LEU A 146 -9.106 7.491 1.624 1.00 0.00 O ATOM 2002 CB LEU A 146 -7.249 5.590 0.256 1.00 0.00 C ATOM 2003 CG LEU A 146 -8.303 4.863 -0.580 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -8.015 5.079 -2.066 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -8.257 3.366 -0.265 1.00 0.00 C ATOM 0 H LEU A 146 -6.572 7.947 1.815 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.258 7.357 -1.029 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.252 5.245 -0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.387 5.362 1.313 1.00 0.00 H new ATOM 0 HG LEU A 146 -9.291 5.256 -0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.767 4.561 -2.661 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -8.046 6.145 -2.291 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -7.027 4.686 -2.306 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -9.008 2.846 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.269 2.974 -0.505 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -8.462 3.211 0.794 1.00 0.00 H new ATOM 2017 N ASP A 147 -9.494 8.171 -0.428 1.00 0.00 N ATOM 2018 CA ASP A 147 -10.841 8.688 -0.050 1.00 0.00 C ATOM 2019 C ASP A 147 -11.712 8.865 -1.297 1.00 0.00 C ATOM 2020 O ASP A 147 -11.217 9.017 -2.396 1.00 0.00 O ATOM 2021 CB ASP A 147 -10.574 10.040 0.613 1.00 0.00 C ATOM 2022 CG ASP A 147 -11.552 10.243 1.771 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -12.008 9.251 2.316 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -11.829 11.386 2.094 1.00 0.00 O ATOM 0 H ASP A 147 -9.239 8.297 -1.408 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.373 8.006 0.613 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -9.548 10.081 0.978 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -10.685 10.843 -0.116 1.00 0.00 H new ATOM 2029 N SER A 148 -13.007 8.847 -1.134 1.00 0.00 N ATOM 2030 CA SER A 148 -13.911 9.014 -2.309 1.00 0.00 C ATOM 2031 C SER A 148 -14.414 10.458 -2.387 1.00 0.00 C ATOM 2032 O SER A 148 -13.979 11.318 -1.646 1.00 0.00 O ATOM 2033 CB SER A 148 -15.071 8.052 -2.055 1.00 0.00 C ATOM 2034 OG SER A 148 -16.300 8.715 -2.323 1.00 0.00 O ATOM 0 H SER A 148 -13.479 8.724 -0.238 1.00 0.00 H new ATOM 0 HA SER A 148 -13.408 8.803 -3.253 1.00 0.00 H new ATOM 0 HB2 SER A 148 -14.974 7.172 -2.690 1.00 0.00 H new ATOM 0 HB3 SER A 148 -15.050 7.704 -1.022 1.00 0.00 H new ATOM 0 HG SER A 148 -17.046 8.100 -2.162 1.00 0.00 H new