USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 694 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl -170:sc= 0 (180deg=-0.0497) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 73:sc= 0.0981 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -165:sc=-0.00698 (180deg=-0.361) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc=-0.00709 X(o=-0.0071,f=-0.043) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 69:sc= 0.976 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 42:sc= 0.406 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.388 -16.089 -6.905 1.00 0.00 N ATOM 2 CA MET A 1 -3.431 -15.150 -7.280 1.00 0.00 C ATOM 3 C MET A 1 -4.791 -15.846 -7.366 1.00 0.00 C ATOM 4 O MET A 1 -5.008 -16.687 -8.237 1.00 0.00 O ATOM 5 CB MET A 1 -3.091 -14.523 -8.634 1.00 0.00 C ATOM 6 CG MET A 1 -3.597 -13.082 -8.714 1.00 0.00 C ATOM 7 SD MET A 1 -2.731 -12.201 -10.003 1.00 0.00 S ATOM 8 CE MET A 1 -1.932 -10.935 -9.030 1.00 0.00 C ATOM 0 H1 MET A 1 -1.476 -15.592 -6.854 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.610 -16.502 -5.977 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.330 -16.846 -7.616 1.00 0.00 H new ATOM 0 HA MET A 1 -3.489 -14.375 -6.515 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.012 -14.542 -8.787 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.537 -15.114 -9.434 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.668 -13.075 -8.914 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.448 -12.582 -7.757 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.344 -10.291 -9.684 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.687 -10.340 -8.517 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.276 -11.401 -8.295 1.00 0.00 H new ATOM 18 N GLY A 2 -5.671 -15.469 -6.450 1.00 0.00 N ATOM 19 CA GLY A 2 -7.004 -16.047 -6.412 1.00 0.00 C ATOM 20 C GLY A 2 -8.068 -14.960 -6.241 1.00 0.00 C ATOM 21 O GLY A 2 -7.800 -13.912 -5.657 1.00 0.00 O ATOM 0 H GLY A 2 -5.487 -14.771 -5.729 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -7.190 -16.602 -7.332 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -7.072 -16.760 -5.590 1.00 0.00 H new ATOM 25 N LYS A 3 -9.251 -15.249 -6.762 1.00 0.00 N ATOM 26 CA LYS A 3 -10.356 -14.310 -6.674 1.00 0.00 C ATOM 27 C LYS A 3 -10.012 -13.048 -7.469 1.00 0.00 C ATOM 28 O LYS A 3 -9.020 -12.381 -7.181 1.00 0.00 O ATOM 29 CB LYS A 3 -10.713 -14.037 -5.212 1.00 0.00 C ATOM 30 CG LYS A 3 -11.472 -15.218 -4.603 1.00 0.00 C ATOM 31 CD LYS A 3 -10.512 -16.186 -3.907 1.00 0.00 C ATOM 32 CE LYS A 3 -10.351 -15.829 -2.428 1.00 0.00 C ATOM 33 NZ LYS A 3 -9.397 -16.752 -1.773 1.00 0.00 N ATOM 0 H LYS A 3 -9.468 -16.120 -7.246 1.00 0.00 H new ATOM 0 HA LYS A 3 -11.254 -14.736 -7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -9.804 -13.851 -4.641 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -11.322 -13.135 -5.145 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -12.208 -14.852 -3.887 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -12.021 -15.744 -5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -10.887 -17.205 -4.000 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -9.540 -16.157 -4.400 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -9.997 -14.802 -2.332 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -11.318 -15.881 -1.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -9.299 -16.496 -0.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -9.750 -17.727 -1.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.470 -16.682 -2.240 1.00 0.00 H new ATOM 47 N GLU A 4 -10.851 -12.760 -8.452 1.00 0.00 N ATOM 48 CA GLU A 4 -10.648 -11.590 -9.290 1.00 0.00 C ATOM 49 C GLU A 4 -11.512 -10.428 -8.798 1.00 0.00 C ATOM 50 O GLU A 4 -10.993 -9.374 -8.433 1.00 0.00 O ATOM 51 CB GLU A 4 -10.943 -11.909 -10.757 1.00 0.00 C ATOM 52 CG GLU A 4 -9.709 -11.666 -11.630 1.00 0.00 C ATOM 53 CD GLU A 4 -8.853 -12.929 -11.732 1.00 0.00 C ATOM 54 OE1 GLU A 4 -8.471 -13.505 -10.702 1.00 0.00 O ATOM 55 OE2 GLU A 4 -8.586 -13.311 -12.935 1.00 0.00 O ATOM 0 H GLU A 4 -11.673 -13.316 -8.688 1.00 0.00 H new ATOM 0 HA GLU A 4 -9.601 -11.294 -9.219 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -11.260 -12.948 -10.850 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -11.769 -11.291 -11.108 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -10.020 -11.352 -12.626 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.116 -10.853 -11.210 1.00 0.00 H new ATOM 62 N SER A 5 -12.817 -10.658 -8.803 1.00 0.00 N ATOM 63 CA SER A 5 -13.758 -9.643 -8.361 1.00 0.00 C ATOM 64 C SER A 5 -13.883 -9.674 -6.836 1.00 0.00 C ATOM 65 O SER A 5 -14.014 -10.742 -6.242 1.00 0.00 O ATOM 66 CB SER A 5 -15.129 -9.844 -9.010 1.00 0.00 C ATOM 67 OG SER A 5 -15.275 -9.073 -10.200 1.00 0.00 O ATOM 0 H SER A 5 -13.245 -11.533 -9.106 1.00 0.00 H new ATOM 0 HA SER A 5 -13.380 -8.668 -8.668 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.269 -10.900 -9.243 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.910 -9.568 -8.301 1.00 0.00 H new ATOM 0 HG SER A 5 -16.162 -9.230 -10.585 1.00 0.00 H new ATOM 73 N GLY A 6 -13.838 -8.488 -6.247 1.00 0.00 N ATOM 74 CA GLY A 6 -13.944 -8.365 -4.803 1.00 0.00 C ATOM 75 C GLY A 6 -12.567 -8.162 -4.167 1.00 0.00 C ATOM 76 O GLY A 6 -12.275 -7.089 -3.641 1.00 0.00 O ATOM 0 H GLY A 6 -13.730 -7.604 -6.744 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -14.592 -7.525 -4.553 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -14.410 -9.260 -4.391 1.00 0.00 H new ATOM 80 N TRP A 7 -11.758 -9.208 -4.237 1.00 0.00 N ATOM 81 CA TRP A 7 -10.419 -9.158 -3.675 1.00 0.00 C ATOM 82 C TRP A 7 -10.527 -8.626 -2.245 1.00 0.00 C ATOM 83 O TRP A 7 -10.348 -7.432 -2.008 1.00 0.00 O ATOM 84 CB TRP A 7 -9.486 -8.324 -4.555 1.00 0.00 C ATOM 85 CG TRP A 7 -8.274 -9.095 -5.082 1.00 0.00 C ATOM 86 CD1 TRP A 7 -7.596 -10.080 -4.478 1.00 0.00 C ATOM 87 CD2 TRP A 7 -7.620 -8.903 -6.354 1.00 0.00 C ATOM 88 NE1 TRP A 7 -6.557 -10.535 -5.264 1.00 0.00 N ATOM 89 CE2 TRP A 7 -6.572 -9.796 -6.441 1.00 0.00 C ATOM 90 CE3 TRP A 7 -7.905 -8.003 -7.397 1.00 0.00 C ATOM 91 CZ2 TRP A 7 -5.724 -9.878 -7.552 1.00 0.00 C ATOM 92 CZ3 TRP A 7 -7.048 -8.098 -8.501 1.00 0.00 C ATOM 93 CH2 TRP A 7 -5.989 -8.992 -8.603 1.00 0.00 C ATOM 0 H TRP A 7 -12.004 -10.096 -4.675 1.00 0.00 H new ATOM 0 HA TRP A 7 -9.976 -10.153 -3.644 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -10.053 -7.935 -5.401 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -9.136 -7.464 -3.983 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -7.833 -10.469 -3.499 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -5.899 -11.277 -5.025 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.719 -7.295 -7.350 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -4.910 -10.586 -7.596 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -7.223 -7.430 -9.331 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -5.373 -9.003 -9.490 1.00 0.00 H new ATOM 104 N ASP A 8 -10.818 -9.538 -1.328 1.00 0.00 N ATOM 105 CA ASP A 8 -10.952 -9.175 0.072 1.00 0.00 C ATOM 106 C ASP A 8 -11.210 -10.436 0.899 1.00 0.00 C ATOM 107 O ASP A 8 -12.299 -11.006 0.846 1.00 0.00 O ATOM 108 CB ASP A 8 -12.129 -8.222 0.284 1.00 0.00 C ATOM 109 CG ASP A 8 -11.971 -7.249 1.455 1.00 0.00 C ATOM 110 OD1 ASP A 8 -10.937 -6.480 1.389 1.00 0.00 O ATOM 111 OD2 ASP A 8 -12.794 -7.226 2.382 1.00 0.00 O ATOM 0 H ASP A 8 -10.965 -10.527 -1.528 1.00 0.00 H new ATOM 0 HA ASP A 8 -10.030 -8.684 0.382 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.280 -7.646 -0.629 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.031 -8.813 0.441 1.00 0.00 H new ATOM 116 N SER A 9 -10.189 -10.836 1.644 1.00 0.00 N ATOM 117 CA SER A 9 -10.292 -12.019 2.481 1.00 0.00 C ATOM 118 C SER A 9 -11.384 -11.822 3.534 1.00 0.00 C ATOM 119 O SER A 9 -11.995 -10.757 3.608 1.00 0.00 O ATOM 120 CB SER A 9 -8.955 -12.335 3.155 1.00 0.00 C ATOM 121 OG SER A 9 -8.142 -13.188 2.354 1.00 0.00 O ATOM 0 H SER A 9 -9.287 -10.362 1.685 1.00 0.00 H new ATOM 0 HA SER A 9 -10.557 -12.865 1.846 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.420 -11.406 3.353 1.00 0.00 H new ATOM 0 HB3 SER A 9 -9.138 -12.809 4.119 1.00 0.00 H new ATOM 0 HG SER A 9 -7.297 -13.365 2.818 1.00 0.00 H new ATOM 127 N GLY A 10 -11.596 -12.866 4.323 1.00 0.00 N ATOM 128 CA GLY A 10 -12.604 -12.821 5.368 1.00 0.00 C ATOM 129 C GLY A 10 -12.070 -12.111 6.615 1.00 0.00 C ATOM 130 O GLY A 10 -11.777 -10.917 6.576 1.00 0.00 O ATOM 0 H GLY A 10 -11.087 -13.747 4.259 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -13.490 -12.303 5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.911 -13.835 5.626 1.00 0.00 H new ATOM 134 N ARG A 11 -11.959 -12.877 7.690 1.00 0.00 N ATOM 135 CA ARG A 11 -11.465 -12.337 8.945 1.00 0.00 C ATOM 136 C ARG A 11 -9.954 -12.109 8.868 1.00 0.00 C ATOM 137 O ARG A 11 -9.466 -11.035 9.216 1.00 0.00 O ATOM 138 CB ARG A 11 -11.772 -13.281 10.110 1.00 0.00 C ATOM 139 CG ARG A 11 -13.021 -12.827 10.869 1.00 0.00 C ATOM 140 CD ARG A 11 -12.972 -13.283 12.328 1.00 0.00 C ATOM 141 NE ARG A 11 -13.560 -14.635 12.456 1.00 0.00 N ATOM 142 CZ ARG A 11 -13.662 -15.309 13.621 1.00 0.00 C ATOM 143 NH1 ARG A 11 -13.216 -14.761 14.771 1.00 0.00 N ATOM 144 NH2 ARG A 11 -14.205 -16.512 13.619 1.00 0.00 N ATOM 0 H ARG A 11 -12.203 -13.867 7.718 1.00 0.00 H new ATOM 0 HA ARG A 11 -11.971 -11.387 9.118 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -11.919 -14.293 9.734 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -10.921 -13.314 10.790 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -13.102 -11.741 10.826 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -13.911 -13.232 10.387 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -11.941 -13.291 12.681 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.518 -12.579 12.956 1.00 0.00 H new ATOM 0 HE ARG A 11 -13.910 -15.086 11.611 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -12.798 -13.831 14.764 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -13.297 -15.277 15.647 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -14.540 -16.919 12.746 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.290 -17.035 14.491 1.00 0.00 H new ATOM 158 N ALA A 12 -9.256 -13.137 8.408 1.00 0.00 N ATOM 159 CA ALA A 12 -7.810 -13.063 8.280 1.00 0.00 C ATOM 160 C ALA A 12 -7.426 -11.713 7.672 1.00 0.00 C ATOM 161 O ALA A 12 -6.471 -11.077 8.117 1.00 0.00 O ATOM 162 CB ALA A 12 -7.310 -14.243 7.444 1.00 0.00 C ATOM 0 H ALA A 12 -9.665 -14.026 8.119 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.334 -13.132 9.258 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.226 -14.187 7.348 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -7.584 -15.178 7.934 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.764 -14.206 6.454 1.00 0.00 H new ATOM 168 N ALA A 13 -8.188 -11.315 6.664 1.00 0.00 N ATOM 169 CA ALA A 13 -7.939 -10.052 5.991 1.00 0.00 C ATOM 170 C ALA A 13 -7.577 -8.988 7.029 1.00 0.00 C ATOM 171 O ALA A 13 -6.540 -8.335 6.918 1.00 0.00 O ATOM 172 CB ALA A 13 -9.165 -9.664 5.162 1.00 0.00 C ATOM 0 H ALA A 13 -8.978 -11.845 6.297 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.097 -10.143 5.305 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.978 -8.716 4.657 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -9.362 -10.438 4.420 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.030 -9.561 5.818 1.00 0.00 H new ATOM 178 N VAL A 14 -8.452 -8.846 8.014 1.00 0.00 N ATOM 179 CA VAL A 14 -8.237 -7.872 9.071 1.00 0.00 C ATOM 180 C VAL A 14 -6.759 -7.873 9.466 1.00 0.00 C ATOM 181 O VAL A 14 -6.113 -6.826 9.467 1.00 0.00 O ATOM 182 CB VAL A 14 -9.171 -8.163 10.247 1.00 0.00 C ATOM 183 CG1 VAL A 14 -8.926 -7.183 11.397 1.00 0.00 C ATOM 184 CG2 VAL A 14 -10.636 -8.134 9.805 1.00 0.00 C ATOM 0 H VAL A 14 -9.311 -9.389 8.102 1.00 0.00 H new ATOM 0 HA VAL A 14 -8.479 -6.868 8.722 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.950 -9.167 10.609 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.603 -7.412 12.220 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -7.895 -7.274 11.739 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -9.106 -6.165 11.052 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -11.278 -8.344 10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.876 -7.149 9.404 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.799 -8.888 9.035 1.00 0.00 H new ATOM 194 N ALA A 15 -6.267 -9.059 9.793 1.00 0.00 N ATOM 195 CA ALA A 15 -4.878 -9.209 10.190 1.00 0.00 C ATOM 196 C ALA A 15 -3.974 -8.676 9.077 1.00 0.00 C ATOM 197 O ALA A 15 -3.036 -7.925 9.341 1.00 0.00 O ATOM 198 CB ALA A 15 -4.596 -10.677 10.516 1.00 0.00 C ATOM 0 H ALA A 15 -6.806 -9.925 9.791 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.671 -8.629 11.090 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.554 -10.790 10.814 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.243 -10.999 11.331 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.790 -11.289 9.635 1.00 0.00 H new ATOM 204 N ALA A 16 -4.287 -9.084 7.856 1.00 0.00 N ATOM 205 CA ALA A 16 -3.515 -8.657 6.702 1.00 0.00 C ATOM 206 C ALA A 16 -3.475 -7.128 6.658 1.00 0.00 C ATOM 207 O ALA A 16 -2.545 -6.543 6.106 1.00 0.00 O ATOM 208 CB ALA A 16 -4.117 -9.261 5.432 1.00 0.00 C ATOM 0 H ALA A 16 -5.066 -9.707 7.641 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.487 -9.012 6.776 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -3.537 -8.940 4.566 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -4.095 -10.349 5.501 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -5.148 -8.925 5.323 1.00 0.00 H new ATOM 214 N VAL A 17 -4.497 -6.524 7.248 1.00 0.00 N ATOM 215 CA VAL A 17 -4.591 -5.075 7.283 1.00 0.00 C ATOM 216 C VAL A 17 -3.733 -4.540 8.432 1.00 0.00 C ATOM 217 O VAL A 17 -3.148 -3.463 8.325 1.00 0.00 O ATOM 218 CB VAL A 17 -6.057 -4.648 7.383 1.00 0.00 C ATOM 219 CG1 VAL A 17 -6.200 -3.134 7.209 1.00 0.00 C ATOM 220 CG2 VAL A 17 -6.917 -5.400 6.366 1.00 0.00 C ATOM 0 H VAL A 17 -5.267 -7.012 7.705 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.203 -4.645 6.360 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.414 -4.906 8.380 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.251 -2.857 7.284 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.633 -2.623 7.988 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.817 -2.842 6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.954 -5.078 6.458 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.559 -5.187 5.359 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.851 -6.471 6.556 1.00 0.00 H new ATOM 230 N VAL A 18 -3.686 -5.317 9.504 1.00 0.00 N ATOM 231 CA VAL A 18 -2.910 -4.935 10.672 1.00 0.00 C ATOM 232 C VAL A 18 -1.443 -5.310 10.448 1.00 0.00 C ATOM 233 O VAL A 18 -0.556 -4.786 11.121 1.00 0.00 O ATOM 234 CB VAL A 18 -3.505 -5.573 11.928 1.00 0.00 C ATOM 235 CG1 VAL A 18 -5.023 -5.721 11.801 1.00 0.00 C ATOM 236 CG2 VAL A 18 -2.846 -6.922 12.223 1.00 0.00 C ATOM 0 H VAL A 18 -4.173 -6.209 9.588 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.951 -3.856 10.822 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.302 -4.910 12.769 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -5.421 -6.177 12.707 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -5.474 -4.739 11.661 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -5.257 -6.353 10.944 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.288 -7.354 13.121 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -3.004 -7.596 11.381 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.777 -6.778 12.377 1.00 0.00 H new ATOM 246 N GLY A 19 -1.234 -6.213 9.502 1.00 0.00 N ATOM 247 CA GLY A 19 0.110 -6.664 9.182 1.00 0.00 C ATOM 248 C GLY A 19 0.924 -5.543 8.534 1.00 0.00 C ATOM 249 O GLY A 19 0.786 -5.281 7.340 1.00 0.00 O ATOM 0 H GLY A 19 -1.972 -6.645 8.947 1.00 0.00 H new ATOM 0 HA2 GLY A 19 0.609 -7.003 10.090 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.060 -7.519 8.507 1.00 0.00 H new ATOM 253 N GLY A 20 1.756 -4.911 9.349 1.00 0.00 N ATOM 254 CA GLY A 20 2.593 -3.824 8.870 1.00 0.00 C ATOM 255 C GLY A 20 2.113 -2.480 9.420 1.00 0.00 C ATOM 256 O GLY A 20 2.099 -1.481 8.702 1.00 0.00 O ATOM 0 H GLY A 20 1.868 -5.131 10.339 1.00 0.00 H new ATOM 0 HA2 GLY A 20 3.626 -3.996 9.171 1.00 0.00 H new ATOM 0 HA3 GLY A 20 2.578 -3.801 7.780 1.00 0.00 H new ATOM 260 N VAL A 21 1.731 -2.497 10.688 1.00 0.00 N ATOM 261 CA VAL A 21 1.251 -1.292 11.342 1.00 0.00 C ATOM 262 C VAL A 21 2.271 -0.169 11.143 1.00 0.00 C ATOM 263 O VAL A 21 1.979 0.832 10.490 1.00 0.00 O ATOM 264 CB VAL A 21 0.958 -1.578 12.817 1.00 0.00 C ATOM 265 CG1 VAL A 21 0.598 -0.292 13.563 1.00 0.00 C ATOM 266 CG2 VAL A 21 -0.149 -2.624 12.962 1.00 0.00 C ATOM 0 H VAL A 21 1.744 -3.327 11.281 1.00 0.00 H new ATOM 0 HA VAL A 21 0.313 -0.963 10.896 1.00 0.00 H new ATOM 0 HB VAL A 21 1.864 -1.984 13.267 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.394 -0.523 14.609 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.430 0.409 13.502 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.287 0.155 13.111 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.338 -2.809 14.019 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.060 -2.257 12.489 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.162 -3.551 12.481 1.00 0.00 H new ATOM 276 N VAL A 22 3.447 -0.372 11.718 1.00 0.00 N ATOM 277 CA VAL A 22 4.512 0.611 11.612 1.00 0.00 C ATOM 278 C VAL A 22 4.691 1.006 10.145 1.00 0.00 C ATOM 279 O VAL A 22 4.806 2.189 9.826 1.00 0.00 O ATOM 280 CB VAL A 22 5.794 0.065 12.244 1.00 0.00 C ATOM 281 CG1 VAL A 22 6.986 0.975 11.940 1.00 0.00 C ATOM 282 CG2 VAL A 22 5.622 -0.128 13.752 1.00 0.00 C ATOM 0 H VAL A 22 3.686 -1.203 12.259 1.00 0.00 H new ATOM 0 HA VAL A 22 4.253 1.515 12.164 1.00 0.00 H new ATOM 0 HB VAL A 22 5.996 -0.911 11.802 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.884 0.564 12.401 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.129 1.040 10.861 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.795 1.970 12.341 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.547 -0.517 14.177 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.383 0.829 14.216 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.812 -0.834 13.939 1.00 0.00 H new ATOM 292 N ALA A 23 4.709 -0.006 9.290 1.00 0.00 N ATOM 293 CA ALA A 23 4.872 0.220 7.864 1.00 0.00 C ATOM 294 C ALA A 23 3.819 1.223 7.388 1.00 0.00 C ATOM 295 O ALA A 23 4.114 2.102 6.580 1.00 0.00 O ATOM 296 CB ALA A 23 4.785 -1.114 7.122 1.00 0.00 C ATOM 0 H ALA A 23 4.613 -0.986 9.558 1.00 0.00 H new ATOM 0 HA ALA A 23 5.853 0.646 7.652 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.907 -0.944 6.052 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.572 -1.779 7.476 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.813 -1.571 7.308 1.00 0.00 H new ATOM 302 N VAL A 24 2.612 1.057 7.909 1.00 0.00 N ATOM 303 CA VAL A 24 1.513 1.936 7.547 1.00 0.00 C ATOM 304 C VAL A 24 1.749 3.318 8.159 1.00 0.00 C ATOM 305 O VAL A 24 1.304 4.327 7.612 1.00 0.00 O ATOM 306 CB VAL A 24 0.182 1.312 7.974 1.00 0.00 C ATOM 307 CG1 VAL A 24 -0.983 2.263 7.692 1.00 0.00 C ATOM 308 CG2 VAL A 24 -0.034 -0.039 7.290 1.00 0.00 C ATOM 0 H VAL A 24 2.371 0.327 8.579 1.00 0.00 H new ATOM 0 HA VAL A 24 1.465 2.063 6.466 1.00 0.00 H new ATOM 0 HB VAL A 24 0.221 1.140 9.050 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.917 1.796 8.004 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.838 3.191 8.246 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.025 2.480 6.625 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -0.987 -0.461 7.610 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -0.043 0.098 6.209 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.774 -0.718 7.563 1.00 0.00 H new ATOM 318 N GLY A 25 2.448 3.321 9.284 1.00 0.00 N ATOM 319 CA GLY A 25 2.748 4.563 9.976 1.00 0.00 C ATOM 320 C GLY A 25 3.752 5.403 9.183 1.00 0.00 C ATOM 321 O GLY A 25 3.492 6.567 8.882 1.00 0.00 O ATOM 0 H GLY A 25 2.816 2.483 9.734 1.00 0.00 H new ATOM 0 HA2 GLY A 25 1.830 5.132 10.125 1.00 0.00 H new ATOM 0 HA3 GLY A 25 3.152 4.344 10.965 1.00 0.00 H new ATOM 325 N THR A 26 4.878 4.780 8.869 1.00 0.00 N ATOM 326 CA THR A 26 5.922 5.455 8.117 1.00 0.00 C ATOM 327 C THR A 26 5.394 5.900 6.752 1.00 0.00 C ATOM 328 O THR A 26 5.567 7.054 6.361 1.00 0.00 O ATOM 329 CB THR A 26 7.124 4.513 8.026 1.00 0.00 C ATOM 330 OG1 THR A 26 8.044 5.203 7.184 1.00 0.00 O ATOM 331 CG2 THR A 26 6.805 3.230 7.255 1.00 0.00 C ATOM 0 H THR A 26 5.090 3.815 9.122 1.00 0.00 H new ATOM 0 HA THR A 26 6.243 6.368 8.619 1.00 0.00 H new ATOM 0 HB THR A 26 7.462 4.259 9.031 1.00 0.00 H new ATOM 0 HG1 THR A 26 8.854 4.663 7.073 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.691 2.597 7.220 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.997 2.696 7.756 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.499 3.482 6.240 1.00 0.00 H new ATOM 339 N VAL A 27 4.760 4.962 6.064 1.00 0.00 N ATOM 340 CA VAL A 27 4.205 5.243 4.751 1.00 0.00 C ATOM 341 C VAL A 27 3.255 6.439 4.849 1.00 0.00 C ATOM 342 O VAL A 27 3.419 7.427 4.135 1.00 0.00 O ATOM 343 CB VAL A 27 3.533 3.990 4.188 1.00 0.00 C ATOM 344 CG1 VAL A 27 2.590 4.344 3.035 1.00 0.00 C ATOM 345 CG2 VAL A 27 4.575 2.960 3.747 1.00 0.00 C ATOM 0 H VAL A 27 4.618 4.006 6.391 1.00 0.00 H new ATOM 0 HA VAL A 27 4.996 5.513 4.051 1.00 0.00 H new ATOM 0 HB VAL A 27 2.937 3.544 4.984 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.125 3.435 2.653 1.00 0.00 H new ATOM 0 HG12 VAL A 27 1.817 5.024 3.393 1.00 0.00 H new ATOM 0 HG13 VAL A 27 3.156 4.825 2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 27 4.070 2.079 3.351 1.00 0.00 H new ATOM 0 HG22 VAL A 27 5.210 3.393 2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 27 5.188 2.673 4.602 1.00 0.00 H new ATOM 355 N LEU A 28 2.282 6.309 5.739 1.00 0.00 N ATOM 356 CA LEU A 28 1.306 7.366 5.939 1.00 0.00 C ATOM 357 C LEU A 28 2.035 8.693 6.161 1.00 0.00 C ATOM 358 O LEU A 28 1.827 9.652 5.418 1.00 0.00 O ATOM 359 CB LEU A 28 0.341 6.998 7.069 1.00 0.00 C ATOM 360 CG LEU A 28 -0.687 8.066 7.447 1.00 0.00 C ATOM 361 CD1 LEU A 28 -1.907 8.002 6.526 1.00 0.00 C ATOM 362 CD2 LEU A 28 -1.077 7.954 8.922 1.00 0.00 C ATOM 0 H LEU A 28 2.149 5.488 6.329 1.00 0.00 H new ATOM 0 HA LEU A 28 0.688 7.486 5.049 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.194 6.092 6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.927 6.756 7.956 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.229 9.045 7.308 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.623 8.771 6.816 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.594 8.168 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.375 7.021 6.610 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.809 8.725 9.164 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.509 6.971 9.110 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.191 8.086 9.544 1.00 0.00 H new ATOM 374 N VAL A 29 2.874 8.706 7.186 1.00 0.00 N ATOM 375 CA VAL A 29 3.636 9.899 7.515 1.00 0.00 C ATOM 376 C VAL A 29 4.292 10.446 6.246 1.00 0.00 C ATOM 377 O VAL A 29 4.445 11.657 6.094 1.00 0.00 O ATOM 378 CB VAL A 29 4.644 9.587 8.623 1.00 0.00 C ATOM 379 CG1 VAL A 29 5.649 10.729 8.786 1.00 0.00 C ATOM 380 CG2 VAL A 29 3.932 9.290 9.944 1.00 0.00 C ATOM 0 H VAL A 29 3.043 7.909 7.800 1.00 0.00 H new ATOM 0 HA VAL A 29 2.979 10.678 7.902 1.00 0.00 H new ATOM 0 HB VAL A 29 5.196 8.693 8.332 1.00 0.00 H new ATOM 0 HG11 VAL A 29 6.354 10.482 9.580 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.191 10.873 7.851 1.00 0.00 H new ATOM 0 HG13 VAL A 29 5.119 11.646 9.044 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.671 9.071 10.715 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.342 10.157 10.242 1.00 0.00 H new ATOM 0 HG23 VAL A 29 3.275 8.430 9.818 1.00 0.00 H new ATOM 390 N ALA A 30 4.663 9.527 5.367 1.00 0.00 N ATOM 391 CA ALA A 30 5.300 9.901 4.115 1.00 0.00 C ATOM 392 C ALA A 30 4.307 10.691 3.259 1.00 0.00 C ATOM 393 O ALA A 30 4.633 11.765 2.757 1.00 0.00 O ATOM 394 CB ALA A 30 5.812 8.646 3.407 1.00 0.00 C ATOM 0 H ALA A 30 4.535 8.523 5.497 1.00 0.00 H new ATOM 0 HA ALA A 30 6.161 10.544 4.299 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.289 8.927 2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.536 8.138 4.045 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.976 7.977 3.203 1.00 0.00 H new ATOM 400 N LEU A 31 3.117 10.127 3.120 1.00 0.00 N ATOM 401 CA LEU A 31 2.074 10.764 2.333 1.00 0.00 C ATOM 402 C LEU A 31 1.661 12.073 3.008 1.00 0.00 C ATOM 403 O LEU A 31 1.892 13.154 2.469 1.00 0.00 O ATOM 404 CB LEU A 31 0.911 9.797 2.101 1.00 0.00 C ATOM 405 CG LEU A 31 1.012 8.913 0.857 1.00 0.00 C ATOM 406 CD1 LEU A 31 1.920 7.709 1.112 1.00 0.00 C ATOM 407 CD2 LEU A 31 -0.376 8.491 0.370 1.00 0.00 C ATOM 0 H LEU A 31 2.851 9.236 3.539 1.00 0.00 H new ATOM 0 HA LEU A 31 2.447 11.020 1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 31 0.821 9.152 2.975 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.010 10.376 2.037 1.00 0.00 H new ATOM 0 HG LEU A 31 1.469 9.498 0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.974 7.097 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.919 8.056 1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.515 7.114 1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.276 7.863 -0.515 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.883 7.931 1.156 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.960 9.378 0.122 1.00 0.00 H new ATOM 419 N SER A 32 1.056 11.933 4.179 1.00 0.00 N ATOM 420 CA SER A 32 0.608 13.091 4.933 1.00 0.00 C ATOM 421 C SER A 32 1.663 14.197 4.869 1.00 0.00 C ATOM 422 O SER A 32 1.398 15.283 4.354 1.00 0.00 O ATOM 423 CB SER A 32 0.314 12.721 6.388 1.00 0.00 C ATOM 424 OG SER A 32 -0.580 11.616 6.488 1.00 0.00 O ATOM 0 H SER A 32 0.866 11.035 4.624 1.00 0.00 H new ATOM 0 HA SER A 32 -0.317 13.454 4.485 1.00 0.00 H new ATOM 0 HB2 SER A 32 1.247 12.479 6.896 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.115 13.582 6.901 1.00 0.00 H new ATOM 0 HG SER A 32 -0.741 11.410 7.432 1.00 0.00 H new ATOM 430 N ALA A 33 2.836 13.884 5.399 1.00 0.00 N ATOM 431 CA ALA A 33 3.932 14.838 5.409 1.00 0.00 C ATOM 432 C ALA A 33 3.968 15.580 4.071 1.00 0.00 C ATOM 433 O ALA A 33 3.822 16.801 4.031 1.00 0.00 O ATOM 434 CB ALA A 33 5.242 14.107 5.705 1.00 0.00 C ATOM 0 H ALA A 33 3.052 12.983 5.825 1.00 0.00 H new ATOM 0 HA ALA A 33 3.788 15.580 6.194 1.00 0.00 H new ATOM 0 HB1 ALA A 33 6.064 14.823 5.713 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.175 13.621 6.678 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.422 13.356 4.936 1.00 0.00 H new ATOM 440 N MET A 34 4.163 14.812 3.010 1.00 0.00 N ATOM 441 CA MET A 34 4.220 15.382 1.674 1.00 0.00 C ATOM 442 C MET A 34 5.496 16.203 1.483 1.00 0.00 C ATOM 443 O MET A 34 6.297 15.914 0.595 1.00 0.00 O ATOM 444 CB MET A 34 2.999 16.276 1.448 1.00 0.00 C ATOM 445 CG MET A 34 2.155 15.765 0.278 1.00 0.00 C ATOM 446 SD MET A 34 0.456 16.274 0.483 1.00 0.00 S ATOM 447 CE MET A 34 -0.364 14.701 0.284 1.00 0.00 C ATOM 0 H MET A 34 4.284 13.800 3.048 1.00 0.00 H new ATOM 0 HA MET A 34 4.223 14.566 0.951 1.00 0.00 H new ATOM 0 HB2 MET A 34 2.393 16.305 2.353 1.00 0.00 H new ATOM 0 HB3 MET A 34 3.323 17.297 1.248 1.00 0.00 H new ATOM 0 HG2 MET A 34 2.549 16.153 -0.662 1.00 0.00 H new ATOM 0 HG3 MET A 34 2.214 14.678 0.224 1.00 0.00 H new ATOM 0 HE1 MET A 34 -1.440 14.859 0.205 1.00 0.00 H new ATOM 0 HE2 MET A 34 -0.002 14.214 -0.621 1.00 0.00 H new ATOM 0 HE3 MET A 34 -0.152 14.069 1.146 1.00 0.00 H new ATOM 457 N GLY A 35 5.646 17.211 2.329 1.00 0.00 N ATOM 458 CA GLY A 35 6.812 18.077 2.264 1.00 0.00 C ATOM 459 C GLY A 35 7.447 18.245 3.646 1.00 0.00 C ATOM 460 O GLY A 35 8.534 17.730 3.900 1.00 0.00 O ATOM 0 H GLY A 35 4.979 17.448 3.064 1.00 0.00 H new ATOM 0 HA2 GLY A 35 7.543 17.658 1.572 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.524 19.052 1.871 1.00 0.00 H new ATOM 464 N PHE A 36 6.741 18.969 4.502 1.00 0.00 N ATOM 465 CA PHE A 36 7.222 19.213 5.851 1.00 0.00 C ATOM 466 C PHE A 36 6.183 19.975 6.675 1.00 0.00 C ATOM 467 O PHE A 36 6.525 20.899 7.411 1.00 0.00 O ATOM 468 CB PHE A 36 8.485 20.068 5.728 1.00 0.00 C ATOM 469 CG PHE A 36 8.243 21.450 5.118 1.00 0.00 C ATOM 470 CD1 PHE A 36 8.127 21.588 3.770 1.00 0.00 C ATOM 471 CD2 PHE A 36 8.144 22.541 5.924 1.00 0.00 C ATOM 472 CE1 PHE A 36 7.903 22.871 3.204 1.00 0.00 C ATOM 473 CE2 PHE A 36 7.919 23.824 5.358 1.00 0.00 C ATOM 474 CZ PHE A 36 7.803 23.962 4.010 1.00 0.00 C ATOM 0 H PHE A 36 5.839 19.395 4.287 1.00 0.00 H new ATOM 0 HA PHE A 36 7.419 18.265 6.352 1.00 0.00 H new ATOM 0 HB2 PHE A 36 8.926 20.191 6.717 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.214 19.535 5.118 1.00 0.00 H new ATOM 0 HD1 PHE A 36 8.205 20.722 3.130 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.236 22.432 6.994 1.00 0.00 H new ATOM 0 HE1 PHE A 36 7.812 22.980 2.133 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.840 24.690 5.998 1.00 0.00 H new ATOM 0 HZ PHE A 36 7.632 24.938 3.580 1.00 0.00 H new ATOM 484 N THR A 37 4.934 19.558 6.524 1.00 0.00 N ATOM 485 CA THR A 37 3.842 20.190 7.245 1.00 0.00 C ATOM 486 C THR A 37 2.733 19.175 7.530 1.00 0.00 C ATOM 487 O THR A 37 2.572 18.204 6.793 1.00 0.00 O ATOM 488 CB THR A 37 3.369 21.393 6.427 1.00 0.00 C ATOM 489 OG1 THR A 37 2.442 22.054 7.284 1.00 0.00 O ATOM 490 CG2 THR A 37 2.529 20.984 5.215 1.00 0.00 C ATOM 0 H THR A 37 4.654 18.791 5.913 1.00 0.00 H new ATOM 0 HA THR A 37 4.168 20.550 8.221 1.00 0.00 H new ATOM 0 HB THR A 37 4.234 21.966 6.093 1.00 0.00 H new ATOM 0 HG1 THR A 37 2.087 22.848 6.832 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.219 21.875 4.670 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.122 20.346 4.560 1.00 0.00 H new ATOM 0 HG23 THR A 37 1.647 20.439 5.551 1.00 0.00 H new ATOM 498 N SER A 38 1.998 19.435 8.601 1.00 0.00 N ATOM 499 CA SER A 38 0.909 18.556 8.993 1.00 0.00 C ATOM 500 C SER A 38 0.446 18.897 10.410 1.00 0.00 C ATOM 501 O SER A 38 -0.728 18.733 10.740 1.00 0.00 O ATOM 502 CB SER A 38 1.330 17.088 8.910 1.00 0.00 C ATOM 503 OG SER A 38 0.633 16.390 7.881 1.00 0.00 O ATOM 0 H SER A 38 2.135 20.242 9.210 1.00 0.00 H new ATOM 0 HA SER A 38 0.080 18.708 8.301 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.403 17.028 8.726 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.143 16.603 9.868 1.00 0.00 H new ATOM 0 HG SER A 38 0.976 16.669 7.006 1.00 0.00 H new ATOM 509 N VAL A 39 1.393 19.363 11.212 1.00 0.00 N ATOM 510 CA VAL A 39 1.096 19.728 12.587 1.00 0.00 C ATOM 511 C VAL A 39 0.043 20.838 12.600 1.00 0.00 C ATOM 512 O VAL A 39 -1.155 20.562 12.603 1.00 0.00 O ATOM 513 CB VAL A 39 2.385 20.118 13.314 1.00 0.00 C ATOM 514 CG1 VAL A 39 2.082 20.673 14.707 1.00 0.00 C ATOM 515 CG2 VAL A 39 3.349 18.933 13.393 1.00 0.00 C ATOM 0 H VAL A 39 2.366 19.496 10.936 1.00 0.00 H new ATOM 0 HA VAL A 39 0.678 18.878 13.126 1.00 0.00 H new ATOM 0 HB VAL A 39 2.870 20.906 12.738 1.00 0.00 H new ATOM 0 HG11 VAL A 39 3.015 20.942 15.202 1.00 0.00 H new ATOM 0 HG12 VAL A 39 1.451 21.557 14.617 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.564 19.916 15.296 1.00 0.00 H new ATOM 0 HG21 VAL A 39 4.257 19.237 13.914 1.00 0.00 H new ATOM 0 HG22 VAL A 39 2.876 18.115 13.935 1.00 0.00 H new ATOM 0 HG23 VAL A 39 3.602 18.602 12.386 1.00 0.00 H new ATOM 525 N GLY A 40 0.529 22.071 12.607 1.00 0.00 N ATOM 526 CA GLY A 40 -0.355 23.224 12.620 1.00 0.00 C ATOM 527 C GLY A 40 -1.554 23.006 11.694 1.00 0.00 C ATOM 528 O GLY A 40 -2.696 23.239 12.086 1.00 0.00 O ATOM 0 H GLY A 40 1.524 22.296 12.604 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.704 23.408 13.636 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.194 24.112 12.307 1.00 0.00 H new ATOM 532 N ILE A 41 -1.252 22.561 10.483 1.00 0.00 N ATOM 533 CA ILE A 41 -2.290 22.309 9.498 1.00 0.00 C ATOM 534 C ILE A 41 -3.387 21.449 10.128 1.00 0.00 C ATOM 535 O ILE A 41 -4.566 21.793 10.063 1.00 0.00 O ATOM 536 CB ILE A 41 -1.688 21.705 8.228 1.00 0.00 C ATOM 537 CG1 ILE A 41 -0.828 22.732 7.487 1.00 0.00 C ATOM 538 CG2 ILE A 41 -2.778 21.117 7.331 1.00 0.00 C ATOM 539 CD1 ILE A 41 -1.702 23.733 6.729 1.00 0.00 C ATOM 0 H ILE A 41 -0.303 22.369 10.162 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.756 23.244 9.188 1.00 0.00 H new ATOM 0 HB ILE A 41 -1.032 20.884 8.518 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.195 23.262 8.198 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.165 22.221 6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.323 20.694 6.435 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.311 20.335 7.871 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.478 21.903 7.046 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -1.067 24.452 6.211 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.317 23.202 6.002 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -2.346 24.260 7.433 1.00 0.00 H new ATOM 551 N ALA A 42 -2.959 20.345 10.724 1.00 0.00 N ATOM 552 CA ALA A 42 -3.890 19.432 11.366 1.00 0.00 C ATOM 553 C ALA A 42 -4.646 20.175 12.470 1.00 0.00 C ATOM 554 O ALA A 42 -5.808 19.874 12.741 1.00 0.00 O ATOM 555 CB ALA A 42 -3.129 18.216 11.897 1.00 0.00 C ATOM 0 H ALA A 42 -1.980 20.062 10.776 1.00 0.00 H new ATOM 0 HA ALA A 42 -4.626 19.068 10.650 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -3.827 17.531 12.378 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -2.634 17.707 11.070 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.383 18.542 12.622 1.00 0.00 H new ATOM 561 N ALA A 43 -3.957 21.129 13.076 1.00 0.00 N ATOM 562 CA ALA A 43 -4.549 21.917 14.145 1.00 0.00 C ATOM 563 C ALA A 43 -5.633 22.825 13.562 1.00 0.00 C ATOM 564 O ALA A 43 -6.596 23.166 14.247 1.00 0.00 O ATOM 565 CB ALA A 43 -3.453 22.705 14.866 1.00 0.00 C ATOM 0 H ALA A 43 -2.994 21.375 12.848 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.023 21.269 14.883 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.897 23.296 15.667 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.724 22.013 15.287 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.957 23.369 14.158 1.00 0.00 H new ATOM 571 N SER A 44 -5.440 23.192 12.304 1.00 0.00 N ATOM 572 CA SER A 44 -6.389 24.054 11.621 1.00 0.00 C ATOM 573 C SER A 44 -7.625 23.251 11.211 1.00 0.00 C ATOM 574 O SER A 44 -8.746 23.601 11.575 1.00 0.00 O ATOM 575 CB SER A 44 -5.753 24.713 10.395 1.00 0.00 C ATOM 576 OG SER A 44 -5.762 26.135 10.488 1.00 0.00 O ATOM 0 H SER A 44 -4.640 22.908 11.739 1.00 0.00 H new ATOM 0 HA SER A 44 -6.689 24.844 12.309 1.00 0.00 H new ATOM 0 HB2 SER A 44 -4.726 24.363 10.287 1.00 0.00 H new ATOM 0 HB3 SER A 44 -6.290 24.405 9.498 1.00 0.00 H new ATOM 0 HG SER A 44 -5.346 26.518 9.687 1.00 0.00 H new ATOM 582 N SER A 45 -7.378 22.189 10.458 1.00 0.00 N ATOM 583 CA SER A 45 -8.457 21.333 9.994 1.00 0.00 C ATOM 584 C SER A 45 -9.320 20.891 11.177 1.00 0.00 C ATOM 585 O SER A 45 -10.547 20.884 11.087 1.00 0.00 O ATOM 586 CB SER A 45 -7.910 20.112 9.251 1.00 0.00 C ATOM 587 OG SER A 45 -8.946 19.212 8.870 1.00 0.00 O ATOM 0 H SER A 45 -6.447 21.902 10.158 1.00 0.00 H new ATOM 0 HA SER A 45 -9.071 21.904 9.298 1.00 0.00 H new ATOM 0 HB2 SER A 45 -7.370 20.440 8.363 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.193 19.592 9.886 1.00 0.00 H new ATOM 0 HG SER A 45 -8.557 18.447 8.397 1.00 0.00 H new ATOM 593 N ILE A 46 -8.645 20.534 12.260 1.00 0.00 N ATOM 594 CA ILE A 46 -9.335 20.092 13.460 1.00 0.00 C ATOM 595 C ILE A 46 -10.130 21.261 14.046 1.00 0.00 C ATOM 596 O ILE A 46 -11.328 21.139 14.295 1.00 0.00 O ATOM 597 CB ILE A 46 -8.348 19.464 14.446 1.00 0.00 C ATOM 598 CG1 ILE A 46 -7.839 18.117 13.929 1.00 0.00 C ATOM 599 CG2 ILE A 46 -8.965 19.348 15.841 1.00 0.00 C ATOM 600 CD1 ILE A 46 -6.463 17.790 14.514 1.00 0.00 C ATOM 0 H ILE A 46 -7.628 20.542 12.331 1.00 0.00 H new ATOM 0 HA ILE A 46 -10.052 19.307 13.219 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.484 20.123 14.531 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.547 17.331 14.193 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.780 18.140 12.841 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.242 18.899 16.522 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -9.236 20.340 16.203 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.857 18.723 15.794 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -6.124 16.828 14.131 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -5.752 18.565 14.228 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.531 17.744 15.601 1.00 0.00 H new ATOM 612 N ALA A 47 -9.430 22.368 14.249 1.00 0.00 N ATOM 613 CA ALA A 47 -10.055 23.558 14.801 1.00 0.00 C ATOM 614 C ALA A 47 -11.379 23.815 14.078 1.00 0.00 C ATOM 615 O ALA A 47 -12.381 24.149 14.709 1.00 0.00 O ATOM 616 CB ALA A 47 -9.090 24.740 14.689 1.00 0.00 C ATOM 0 H ALA A 47 -8.436 22.466 14.041 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.279 23.419 15.859 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.559 25.633 15.103 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -8.178 24.519 15.243 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -8.845 24.912 13.641 1.00 0.00 H new ATOM 622 N ALA A 48 -11.340 23.651 12.763 1.00 0.00 N ATOM 623 CA ALA A 48 -12.524 23.861 11.948 1.00 0.00 C ATOM 624 C ALA A 48 -13.556 22.777 12.265 1.00 0.00 C ATOM 625 O ALA A 48 -14.695 23.083 12.615 1.00 0.00 O ATOM 626 CB ALA A 48 -12.130 23.876 10.469 1.00 0.00 C ATOM 0 H ALA A 48 -10.507 23.375 12.243 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.979 24.825 12.174 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -13.018 24.034 9.857 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.419 24.682 10.290 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -11.672 22.923 10.205 1.00 0.00 H new ATOM 632 N LYS A 49 -13.121 21.533 12.132 1.00 0.00 N ATOM 633 CA LYS A 49 -13.993 20.402 12.400 1.00 0.00 C ATOM 634 C LYS A 49 -15.047 20.303 11.295 1.00 0.00 C ATOM 635 O LYS A 49 -14.994 19.400 10.462 1.00 0.00 O ATOM 636 CB LYS A 49 -14.585 20.504 13.807 1.00 0.00 C ATOM 637 CG LYS A 49 -13.898 19.527 14.763 1.00 0.00 C ATOM 638 CD LYS A 49 -14.877 19.018 15.824 1.00 0.00 C ATOM 639 CE LYS A 49 -14.768 17.501 15.986 1.00 0.00 C ATOM 640 NZ LYS A 49 -14.602 17.143 17.413 1.00 0.00 N ATOM 0 H LYS A 49 -12.176 21.283 11.842 1.00 0.00 H new ATOM 0 HA LYS A 49 -13.426 19.471 12.384 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -14.473 21.522 14.180 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.654 20.293 13.772 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -13.495 18.685 14.200 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -13.055 20.019 15.247 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -14.672 19.505 16.777 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -15.896 19.285 15.542 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -15.661 17.021 15.586 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -13.921 17.128 15.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -14.530 16.110 17.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -13.737 17.585 17.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -15.423 17.482 17.954 1.00 0.00 H new ATOM 654 N MET A 50 -15.979 21.244 11.324 1.00 0.00 N ATOM 655 CA MET A 50 -17.043 21.274 10.335 1.00 0.00 C ATOM 656 C MET A 50 -16.737 22.288 9.231 1.00 0.00 C ATOM 657 O MET A 50 -15.966 23.224 9.439 1.00 0.00 O ATOM 658 CB MET A 50 -18.363 21.643 11.017 1.00 0.00 C ATOM 659 CG MET A 50 -18.315 23.069 11.568 1.00 0.00 C ATOM 660 SD MET A 50 -17.930 23.038 13.311 1.00 0.00 S ATOM 661 CE MET A 50 -17.226 24.667 13.502 1.00 0.00 C ATOM 0 H MET A 50 -16.019 21.991 12.017 1.00 0.00 H new ATOM 0 HA MET A 50 -17.121 20.286 9.882 1.00 0.00 H new ATOM 0 HB2 MET A 50 -19.183 21.552 10.304 1.00 0.00 H new ATOM 0 HB3 MET A 50 -18.566 20.943 11.827 1.00 0.00 H new ATOM 0 HG2 MET A 50 -17.564 23.650 11.032 1.00 0.00 H new ATOM 0 HG3 MET A 50 -19.274 23.562 11.408 1.00 0.00 H new ATOM 0 HE1 MET A 50 -16.693 24.724 14.451 1.00 0.00 H new ATOM 0 HE2 MET A 50 -16.532 24.862 12.684 1.00 0.00 H new ATOM 0 HE3 MET A 50 -18.022 25.411 13.488 1.00 0.00 H new ATOM 671 N MET A 51 -17.359 22.069 8.082 1.00 0.00 N ATOM 672 CA MET A 51 -17.163 22.952 6.945 1.00 0.00 C ATOM 673 C MET A 51 -15.680 23.276 6.751 1.00 0.00 C ATOM 674 O MET A 51 -15.207 24.322 7.193 1.00 0.00 O ATOM 675 CB MET A 51 -17.945 24.249 7.165 1.00 0.00 C ATOM 676 CG MET A 51 -19.251 24.244 6.367 1.00 0.00 C ATOM 677 SD MET A 51 -19.373 25.730 5.387 1.00 0.00 S ATOM 678 CE MET A 51 -20.949 25.452 4.597 1.00 0.00 C ATOM 0 H MET A 51 -17.999 21.293 7.914 1.00 0.00 H new ATOM 0 HA MET A 51 -17.525 22.446 6.050 1.00 0.00 H new ATOM 0 HB2 MET A 51 -18.163 24.371 8.226 1.00 0.00 H new ATOM 0 HB3 MET A 51 -17.335 25.101 6.865 1.00 0.00 H new ATOM 0 HG2 MET A 51 -19.288 23.368 5.720 1.00 0.00 H new ATOM 0 HG3 MET A 51 -20.101 24.175 7.046 1.00 0.00 H new ATOM 0 HE1 MET A 51 -21.182 26.293 3.943 1.00 0.00 H new ATOM 0 HE2 MET A 51 -20.904 24.536 4.008 1.00 0.00 H new ATOM 0 HE3 MET A 51 -21.725 25.358 5.357 1.00 0.00 H new ATOM 688 N SER A 52 -14.988 22.360 6.091 1.00 0.00 N ATOM 689 CA SER A 52 -13.569 22.535 5.833 1.00 0.00 C ATOM 690 C SER A 52 -13.120 21.594 4.714 1.00 0.00 C ATOM 691 O SER A 52 -12.756 20.447 4.970 1.00 0.00 O ATOM 692 CB SER A 52 -12.745 22.286 7.098 1.00 0.00 C ATOM 693 OG SER A 52 -11.576 23.099 7.142 1.00 0.00 O ATOM 0 H SER A 52 -15.384 21.493 5.727 1.00 0.00 H new ATOM 0 HA SER A 52 -13.403 23.566 5.520 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.359 22.486 7.976 1.00 0.00 H new ATOM 0 HB3 SER A 52 -12.458 21.235 7.143 1.00 0.00 H new ATOM 0 HG SER A 52 -11.078 22.912 7.965 1.00 0.00 H new ATOM 699 N THR A 53 -13.161 22.113 3.495 1.00 0.00 N ATOM 700 CA THR A 53 -12.763 21.334 2.336 1.00 0.00 C ATOM 701 C THR A 53 -12.456 22.255 1.153 1.00 0.00 C ATOM 702 O THR A 53 -12.916 23.395 1.114 1.00 0.00 O ATOM 703 CB THR A 53 -13.871 20.320 2.044 1.00 0.00 C ATOM 704 OG1 THR A 53 -13.213 19.283 1.321 1.00 0.00 O ATOM 705 CG2 THR A 53 -14.912 20.857 1.060 1.00 0.00 C ATOM 0 H THR A 53 -13.464 23.064 3.286 1.00 0.00 H new ATOM 0 HA THR A 53 -11.841 20.784 2.527 1.00 0.00 H new ATOM 0 HB THR A 53 -14.362 20.042 2.977 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.859 18.582 1.093 1.00 0.00 H new ATOM 0 HG21 THR A 53 -15.675 20.098 0.888 1.00 0.00 H new ATOM 0 HG22 THR A 53 -15.377 21.752 1.474 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.427 21.104 0.116 1.00 0.00 H new ATOM 713 N ALA A 54 -11.680 21.726 0.218 1.00 0.00 N ATOM 714 CA ALA A 54 -11.307 22.487 -0.962 1.00 0.00 C ATOM 715 C ALA A 54 -11.495 21.616 -2.206 1.00 0.00 C ATOM 716 O ALA A 54 -11.635 20.398 -2.100 1.00 0.00 O ATOM 717 CB ALA A 54 -9.868 22.987 -0.813 1.00 0.00 C ATOM 0 H ALA A 54 -11.300 20.780 0.254 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.947 23.362 -1.072 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.588 23.558 -1.698 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.794 23.624 0.068 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.197 22.135 -0.703 1.00 0.00 H new ATOM 723 N ALA A 55 -11.493 22.274 -3.356 1.00 0.00 N ATOM 724 CA ALA A 55 -11.662 21.574 -4.618 1.00 0.00 C ATOM 725 C ALA A 55 -12.865 20.635 -4.519 1.00 0.00 C ATOM 726 O ALA A 55 -12.704 19.417 -4.460 1.00 0.00 O ATOM 727 CB ALA A 55 -10.370 20.832 -4.968 1.00 0.00 C ATOM 0 H ALA A 55 -11.377 23.284 -3.440 1.00 0.00 H new ATOM 0 HA ALA A 55 -11.861 22.280 -5.424 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.497 20.307 -5.915 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.552 21.547 -5.057 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -10.139 20.113 -4.182 1.00 0.00 H new ATOM 733 N ILE A 56 -14.046 21.237 -4.504 1.00 0.00 N ATOM 734 CA ILE A 56 -15.276 20.469 -4.412 1.00 0.00 C ATOM 735 C ILE A 56 -15.721 20.058 -5.817 1.00 0.00 C ATOM 736 O ILE A 56 -16.620 20.671 -6.392 1.00 0.00 O ATOM 737 CB ILE A 56 -16.338 21.249 -3.635 1.00 0.00 C ATOM 738 CG1 ILE A 56 -15.889 21.498 -2.193 1.00 0.00 C ATOM 739 CG2 ILE A 56 -17.694 20.543 -3.699 1.00 0.00 C ATOM 740 CD1 ILE A 56 -15.283 22.895 -2.041 1.00 0.00 C ATOM 0 H ILE A 56 -14.177 22.247 -4.554 1.00 0.00 H new ATOM 0 HA ILE A 56 -15.111 19.551 -3.847 1.00 0.00 H new ATOM 0 HB ILE A 56 -16.460 22.224 -4.108 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -16.740 21.391 -1.520 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -15.156 20.746 -1.902 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -18.431 21.119 -3.139 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -18.012 20.460 -4.738 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -17.606 19.547 -3.266 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -14.972 23.046 -1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -14.418 22.990 -2.698 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -16.027 23.645 -2.310 1.00 0.00 H new ATOM 752 N ALA A 57 -15.071 19.024 -6.330 1.00 0.00 N ATOM 753 CA ALA A 57 -15.389 18.524 -7.657 1.00 0.00 C ATOM 754 C ALA A 57 -15.353 16.994 -7.643 1.00 0.00 C ATOM 755 O ALA A 57 -14.311 16.392 -7.895 1.00 0.00 O ATOM 756 CB ALA A 57 -14.414 19.120 -8.674 1.00 0.00 C ATOM 0 H ALA A 57 -14.326 18.519 -5.851 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.394 18.828 -7.951 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -14.652 18.745 -9.669 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -14.499 20.207 -8.666 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.395 18.833 -8.413 1.00 0.00 H new ATOM 762 N ASN A 58 -16.505 16.410 -7.347 1.00 0.00 N ATOM 763 CA ASN A 58 -16.618 14.962 -7.297 1.00 0.00 C ATOM 764 C ASN A 58 -15.724 14.423 -6.178 1.00 0.00 C ATOM 765 O ASN A 58 -14.555 14.115 -6.407 1.00 0.00 O ATOM 766 CB ASN A 58 -16.163 14.328 -8.612 1.00 0.00 C ATOM 767 CG ASN A 58 -16.934 14.912 -9.798 1.00 0.00 C ATOM 768 OD1 ASN A 58 -16.536 15.891 -10.409 1.00 0.00 O ATOM 769 ND2 ASN A 58 -18.056 14.260 -10.088 1.00 0.00 N ATOM 0 H ASN A 58 -17.368 16.913 -7.139 1.00 0.00 H new ATOM 0 HA ASN A 58 -17.664 14.712 -7.119 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -15.095 14.495 -8.750 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -16.314 13.249 -8.571 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -18.642 14.572 -10.863 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -18.331 13.448 -9.536 1.00 0.00 H new ATOM 776 N GLY A 59 -16.308 14.325 -4.993 1.00 0.00 N ATOM 777 CA GLY A 59 -15.579 13.829 -3.838 1.00 0.00 C ATOM 778 C GLY A 59 -16.531 13.210 -2.813 1.00 0.00 C ATOM 779 O GLY A 59 -17.712 13.553 -2.771 1.00 0.00 O ATOM 0 H GLY A 59 -17.278 14.581 -4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.848 13.085 -4.157 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.023 14.645 -3.377 1.00 0.00 H new ATOM 783 N GLY A 60 -15.982 12.310 -2.010 1.00 0.00 N ATOM 784 CA GLY A 60 -16.768 11.641 -0.988 1.00 0.00 C ATOM 785 C GLY A 60 -15.958 10.532 -0.312 1.00 0.00 C ATOM 786 O GLY A 60 -16.051 9.368 -0.698 1.00 0.00 O ATOM 0 H GLY A 60 -15.002 12.029 -2.047 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -17.093 12.366 -0.241 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -17.668 11.218 -1.435 1.00 0.00 H new ATOM 790 N GLY A 61 -15.182 10.933 0.684 1.00 0.00 N ATOM 791 CA GLY A 61 -14.357 9.988 1.417 1.00 0.00 C ATOM 792 C GLY A 61 -12.902 10.459 1.473 1.00 0.00 C ATOM 793 O GLY A 61 -12.634 11.659 1.469 1.00 0.00 O ATOM 0 H GLY A 61 -15.107 11.900 1.001 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.744 9.870 2.429 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.408 9.009 0.940 1.00 0.00 H new ATOM 797 N VAL A 62 -12.001 9.489 1.525 1.00 0.00 N ATOM 798 CA VAL A 62 -10.581 9.789 1.582 1.00 0.00 C ATOM 799 C VAL A 62 -9.916 9.340 0.279 1.00 0.00 C ATOM 800 O VAL A 62 -9.036 10.024 -0.240 1.00 0.00 O ATOM 801 CB VAL A 62 -9.959 9.145 2.823 1.00 0.00 C ATOM 802 CG1 VAL A 62 -10.378 9.887 4.094 1.00 0.00 C ATOM 803 CG2 VAL A 62 -10.321 7.661 2.910 1.00 0.00 C ATOM 0 H VAL A 62 -12.227 8.494 1.529 1.00 0.00 H new ATOM 0 HA VAL A 62 -10.422 10.863 1.675 1.00 0.00 H new ATOM 0 HB VAL A 62 -8.875 9.221 2.733 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -9.922 9.409 4.961 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -10.047 10.924 4.036 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -11.463 9.857 4.192 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.867 7.227 3.801 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -11.404 7.553 2.966 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -9.951 7.144 2.025 1.00 0.00 H new ATOM 813 N ALA A 63 -10.363 8.193 -0.211 1.00 0.00 N ATOM 814 CA ALA A 63 -9.822 7.645 -1.443 1.00 0.00 C ATOM 815 C ALA A 63 -9.733 8.753 -2.494 1.00 0.00 C ATOM 816 O ALA A 63 -8.649 9.062 -2.986 1.00 0.00 O ATOM 817 CB ALA A 63 -10.690 6.473 -1.905 1.00 0.00 C ATOM 0 H ALA A 63 -11.093 7.628 0.223 1.00 0.00 H new ATOM 0 HA ALA A 63 -8.814 7.262 -1.282 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.284 6.062 -2.829 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -10.697 5.700 -1.136 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -11.708 6.821 -2.079 1.00 0.00 H new ATOM 823 N ALA A 64 -10.888 9.322 -2.807 1.00 0.00 N ATOM 824 CA ALA A 64 -10.955 10.390 -3.790 1.00 0.00 C ATOM 825 C ALA A 64 -9.895 11.445 -3.463 1.00 0.00 C ATOM 826 O ALA A 64 -9.498 11.594 -2.309 1.00 0.00 O ATOM 827 CB ALA A 64 -12.369 10.973 -3.817 1.00 0.00 C ATOM 0 H ALA A 64 -11.785 9.063 -2.397 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.742 10.007 -4.788 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -12.418 11.774 -4.555 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -13.080 10.191 -4.083 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -12.618 11.370 -2.833 1.00 0.00 H new ATOM 833 N GLY A 65 -9.468 12.150 -4.501 1.00 0.00 N ATOM 834 CA GLY A 65 -8.463 13.186 -4.338 1.00 0.00 C ATOM 835 C GLY A 65 -7.148 12.784 -5.009 1.00 0.00 C ATOM 836 O GLY A 65 -6.967 11.627 -5.386 1.00 0.00 O ATOM 0 H GLY A 65 -9.800 12.024 -5.457 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -8.825 14.120 -4.769 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.293 13.369 -3.277 1.00 0.00 H new ATOM 840 N SER A 66 -6.264 13.762 -5.138 1.00 0.00 N ATOM 841 CA SER A 66 -4.970 13.525 -5.757 1.00 0.00 C ATOM 842 C SER A 66 -4.287 12.325 -5.098 1.00 0.00 C ATOM 843 O SER A 66 -3.567 11.577 -5.758 1.00 0.00 O ATOM 844 CB SER A 66 -4.078 14.764 -5.660 1.00 0.00 C ATOM 845 OG SER A 66 -4.332 15.689 -6.713 1.00 0.00 O ATOM 0 H SER A 66 -6.418 14.720 -4.825 1.00 0.00 H new ATOM 0 HA SER A 66 -5.130 13.308 -6.813 1.00 0.00 H new ATOM 0 HB2 SER A 66 -4.241 15.254 -4.700 1.00 0.00 H new ATOM 0 HB3 SER A 66 -3.032 14.460 -5.689 1.00 0.00 H new ATOM 0 HG SER A 66 -3.744 16.467 -6.614 1.00 0.00 H new ATOM 851 N LEU A 67 -4.536 12.180 -3.805 1.00 0.00 N ATOM 852 CA LEU A 67 -3.954 11.083 -3.050 1.00 0.00 C ATOM 853 C LEU A 67 -4.214 9.768 -3.786 1.00 0.00 C ATOM 854 O LEU A 67 -3.325 8.924 -3.889 1.00 0.00 O ATOM 855 CB LEU A 67 -4.468 11.094 -1.609 1.00 0.00 C ATOM 856 CG LEU A 67 -3.418 11.348 -0.524 1.00 0.00 C ATOM 857 CD1 LEU A 67 -3.452 12.805 -0.060 1.00 0.00 C ATOM 858 CD2 LEU A 67 -3.586 10.371 0.641 1.00 0.00 C ATOM 0 H LEU A 67 -5.133 12.803 -3.261 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.873 11.200 -2.980 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -5.240 11.859 -1.526 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.946 10.135 -1.407 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.432 11.170 -0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.697 12.959 0.711 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.246 13.461 -0.906 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.437 13.035 0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.828 10.573 1.398 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.577 10.493 1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.473 9.349 0.278 1.00 0.00 H new ATOM 870 N VAL A 68 -5.437 9.634 -4.278 1.00 0.00 N ATOM 871 CA VAL A 68 -5.825 8.435 -5.002 1.00 0.00 C ATOM 872 C VAL A 68 -4.753 8.102 -6.042 1.00 0.00 C ATOM 873 O VAL A 68 -4.382 6.941 -6.207 1.00 0.00 O ATOM 874 CB VAL A 68 -7.215 8.620 -5.614 1.00 0.00 C ATOM 875 CG1 VAL A 68 -7.120 9.227 -7.015 1.00 0.00 C ATOM 876 CG2 VAL A 68 -7.983 7.297 -5.640 1.00 0.00 C ATOM 0 H VAL A 68 -6.172 10.336 -4.190 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.894 7.585 -4.323 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.769 9.316 -4.984 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.122 9.348 -7.428 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.631 10.199 -6.958 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.540 8.566 -7.659 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.968 7.456 -6.080 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.433 6.569 -6.236 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.096 6.922 -4.623 1.00 0.00 H new ATOM 886 N ALA A 69 -4.286 9.143 -6.717 1.00 0.00 N ATOM 887 CA ALA A 69 -3.264 8.976 -7.736 1.00 0.00 C ATOM 888 C ALA A 69 -2.097 8.176 -7.156 1.00 0.00 C ATOM 889 O ALA A 69 -1.605 7.241 -7.787 1.00 0.00 O ATOM 890 CB ALA A 69 -2.830 10.348 -8.254 1.00 0.00 C ATOM 0 H ALA A 69 -4.597 10.105 -6.578 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.657 8.417 -8.585 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.063 10.222 -9.018 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.689 10.863 -8.683 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.428 10.937 -7.430 1.00 0.00 H new ATOM 896 N ILE A 70 -1.686 8.572 -5.960 1.00 0.00 N ATOM 897 CA ILE A 70 -0.586 7.903 -5.287 1.00 0.00 C ATOM 898 C ILE A 70 -1.061 6.545 -4.767 1.00 0.00 C ATOM 899 O ILE A 70 -0.269 5.611 -4.646 1.00 0.00 O ATOM 900 CB ILE A 70 0.005 8.805 -4.201 1.00 0.00 C ATOM 901 CG1 ILE A 70 1.534 8.740 -4.207 1.00 0.00 C ATOM 902 CG2 ILE A 70 -0.577 8.463 -2.828 1.00 0.00 C ATOM 903 CD1 ILE A 70 2.139 10.110 -4.519 1.00 0.00 C ATOM 0 H ILE A 70 -2.095 9.348 -5.440 1.00 0.00 H new ATOM 0 HA ILE A 70 0.227 7.710 -5.987 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.275 9.835 -4.422 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.891 8.393 -3.237 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.868 8.014 -4.948 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.140 9.118 -2.074 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.658 8.601 -2.846 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.348 7.426 -2.584 1.00 0.00 H new ATOM 0 HD11 ILE A 70 3.227 10.036 -4.517 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.799 10.443 -5.500 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.823 10.828 -3.763 1.00 0.00 H new ATOM 915 N LEU A 71 -2.351 6.477 -4.474 1.00 0.00 N ATOM 916 CA LEU A 71 -2.941 5.249 -3.971 1.00 0.00 C ATOM 917 C LEU A 71 -2.780 4.144 -5.017 1.00 0.00 C ATOM 918 O LEU A 71 -2.337 3.042 -4.698 1.00 0.00 O ATOM 919 CB LEU A 71 -4.391 5.486 -3.545 1.00 0.00 C ATOM 920 CG LEU A 71 -4.905 4.614 -2.397 1.00 0.00 C ATOM 921 CD1 LEU A 71 -6.241 5.137 -1.867 1.00 0.00 C ATOM 922 CD2 LEU A 71 -4.991 3.146 -2.820 1.00 0.00 C ATOM 0 H LEU A 71 -3.005 7.253 -4.576 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.420 4.917 -3.073 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.498 6.532 -3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.034 5.327 -4.411 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.189 4.672 -1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.584 4.499 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.114 6.156 -1.502 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.979 5.129 -2.669 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.359 2.548 -1.986 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.674 3.050 -3.664 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.002 2.793 -3.111 1.00 0.00 H new ATOM 934 N GLN A 72 -3.149 4.478 -6.245 1.00 0.00 N ATOM 935 CA GLN A 72 -3.050 3.528 -7.340 1.00 0.00 C ATOM 936 C GLN A 72 -1.583 3.257 -7.678 1.00 0.00 C ATOM 937 O GLN A 72 -1.164 2.104 -7.759 1.00 0.00 O ATOM 938 CB GLN A 72 -3.813 4.028 -8.569 1.00 0.00 C ATOM 939 CG GLN A 72 -4.421 2.861 -9.349 1.00 0.00 C ATOM 940 CD GLN A 72 -3.642 2.598 -10.639 1.00 0.00 C ATOM 941 OE1 GLN A 72 -3.546 3.438 -11.519 1.00 0.00 O ATOM 942 NE2 GLN A 72 -3.094 1.388 -10.703 1.00 0.00 N ATOM 0 H GLN A 72 -3.517 5.393 -6.506 1.00 0.00 H new ATOM 0 HA GLN A 72 -3.508 2.591 -7.025 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -4.602 4.713 -8.258 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -3.140 4.591 -9.216 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.418 1.964 -8.729 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.462 3.081 -9.587 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.213 0.733 -9.931 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -2.554 1.115 -11.525 1.00 0.00 H new ATOM 951 N SER A 73 -0.842 4.340 -7.865 1.00 0.00 N ATOM 952 CA SER A 73 0.569 4.233 -8.192 1.00 0.00 C ATOM 953 C SER A 73 1.291 3.401 -7.130 1.00 0.00 C ATOM 954 O SER A 73 1.706 2.274 -7.396 1.00 0.00 O ATOM 955 CB SER A 73 1.213 5.616 -8.311 1.00 0.00 C ATOM 956 OG SER A 73 2.076 5.708 -9.442 1.00 0.00 O ATOM 0 H SER A 73 -1.193 5.295 -7.796 1.00 0.00 H new ATOM 0 HA SER A 73 0.659 3.735 -9.158 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.433 6.374 -8.388 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.779 5.832 -7.405 1.00 0.00 H new ATOM 0 HG SER A 73 2.466 6.606 -9.484 1.00 0.00 H new ATOM 962 N VAL A 74 1.419 3.989 -5.950 1.00 0.00 N ATOM 963 CA VAL A 74 2.083 3.316 -4.846 1.00 0.00 C ATOM 964 C VAL A 74 1.387 1.981 -4.576 1.00 0.00 C ATOM 965 O VAL A 74 2.016 1.031 -4.113 1.00 0.00 O ATOM 966 CB VAL A 74 2.119 4.231 -3.621 1.00 0.00 C ATOM 967 CG1 VAL A 74 2.757 3.521 -2.425 1.00 0.00 C ATOM 968 CG2 VAL A 74 2.848 5.539 -3.934 1.00 0.00 C ATOM 0 H VAL A 74 1.074 4.924 -5.734 1.00 0.00 H new ATOM 0 HA VAL A 74 3.120 3.096 -5.100 1.00 0.00 H new ATOM 0 HB VAL A 74 1.090 4.476 -3.356 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.770 4.194 -1.567 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.178 2.631 -2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 74 3.778 3.232 -2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 74 2.859 6.171 -3.046 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.872 5.321 -4.237 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.333 6.058 -4.742 1.00 0.00 H new ATOM 978 N GLY A 75 0.097 1.951 -4.876 1.00 0.00 N ATOM 979 CA GLY A 75 -0.692 0.748 -4.671 1.00 0.00 C ATOM 980 C GLY A 75 -0.106 -0.432 -5.449 1.00 0.00 C ATOM 981 O GLY A 75 0.435 -1.364 -4.857 1.00 0.00 O ATOM 0 H GLY A 75 -0.422 2.741 -5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.725 0.507 -3.608 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.719 0.924 -4.990 1.00 0.00 H new ATOM 985 N ALA A 76 -0.233 -0.352 -6.766 1.00 0.00 N ATOM 986 CA ALA A 76 0.278 -1.401 -7.632 1.00 0.00 C ATOM 987 C ALA A 76 1.807 -1.393 -7.588 1.00 0.00 C ATOM 988 O ALA A 76 2.425 -2.384 -7.202 1.00 0.00 O ATOM 989 CB ALA A 76 -0.266 -1.203 -9.048 1.00 0.00 C ATOM 0 H ALA A 76 -0.682 0.423 -7.254 1.00 0.00 H new ATOM 0 HA ALA A 76 -0.056 -2.380 -7.288 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.117 -1.990 -9.698 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.355 -1.246 -9.029 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.052 -0.232 -9.427 1.00 0.00 H new ATOM 995 N ALA A 77 2.373 -0.265 -7.989 1.00 0.00 N ATOM 996 CA ALA A 77 3.818 -0.115 -8.001 1.00 0.00 C ATOM 997 C ALA A 77 4.396 -0.689 -6.706 1.00 0.00 C ATOM 998 O ALA A 77 5.250 -1.574 -6.741 1.00 0.00 O ATOM 999 CB ALA A 77 4.178 1.359 -8.196 1.00 0.00 C ATOM 0 H ALA A 77 1.857 0.555 -8.308 1.00 0.00 H new ATOM 0 HA ALA A 77 4.254 -0.669 -8.832 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.262 1.471 -8.205 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.769 1.711 -9.143 1.00 0.00 H new ATOM 0 HB3 ALA A 77 3.759 1.947 -7.379 1.00 0.00 H new ATOM 1005 N GLY A 78 3.907 -0.163 -5.592 1.00 0.00 N ATOM 1006 CA GLY A 78 4.365 -0.612 -4.288 1.00 0.00 C ATOM 1007 C GLY A 78 4.238 -2.131 -4.156 1.00 0.00 C ATOM 1008 O GLY A 78 5.241 -2.842 -4.138 1.00 0.00 O ATOM 0 H GLY A 78 3.198 0.570 -5.566 1.00 0.00 H new ATOM 0 HA2 GLY A 78 5.404 -0.316 -4.142 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.782 -0.125 -3.506 1.00 0.00 H new ATOM 1012 N LEU A 79 2.996 -2.584 -4.067 1.00 0.00 N ATOM 1013 CA LEU A 79 2.725 -4.005 -3.937 1.00 0.00 C ATOM 1014 C LEU A 79 3.673 -4.786 -4.849 1.00 0.00 C ATOM 1015 O LEU A 79 4.087 -5.896 -4.516 1.00 0.00 O ATOM 1016 CB LEU A 79 1.245 -4.294 -4.196 1.00 0.00 C ATOM 1017 CG LEU A 79 0.809 -5.753 -4.040 1.00 0.00 C ATOM 1018 CD1 LEU A 79 0.345 -6.037 -2.610 1.00 0.00 C ATOM 1019 CD2 LEU A 79 -0.259 -6.119 -5.072 1.00 0.00 C ATOM 0 H LEU A 79 2.166 -1.991 -4.082 1.00 0.00 H new ATOM 0 HA LEU A 79 2.917 -4.338 -2.917 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.652 -3.683 -3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.004 -3.970 -5.208 1.00 0.00 H new ATOM 0 HG LEU A 79 1.673 -6.390 -4.231 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.041 -7.080 -2.527 1.00 0.00 H new ATOM 0 HD12 LEU A 79 1.163 -5.841 -1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.500 -5.392 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.551 -7.161 -4.939 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.130 -5.478 -4.937 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.142 -5.980 -6.076 1.00 0.00 H new ATOM 1031 N SER A 80 3.989 -4.176 -5.982 1.00 0.00 N ATOM 1032 CA SER A 80 4.881 -4.801 -6.944 1.00 0.00 C ATOM 1033 C SER A 80 6.275 -4.964 -6.337 1.00 0.00 C ATOM 1034 O SER A 80 6.644 -6.055 -5.904 1.00 0.00 O ATOM 1035 CB SER A 80 4.957 -3.983 -8.235 1.00 0.00 C ATOM 1036 OG SER A 80 4.450 -4.705 -9.355 1.00 0.00 O ATOM 0 H SER A 80 3.644 -3.256 -6.255 1.00 0.00 H new ATOM 0 HA SER A 80 4.483 -5.785 -7.191 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.391 -3.059 -8.113 1.00 0.00 H new ATOM 0 HB3 SER A 80 5.992 -3.700 -8.425 1.00 0.00 H new ATOM 0 HG SER A 80 4.514 -4.149 -10.159 1.00 0.00 H new ATOM 1042 N VAL A 81 7.013 -3.864 -6.324 1.00 0.00 N ATOM 1043 CA VAL A 81 8.359 -3.871 -5.776 1.00 0.00 C ATOM 1044 C VAL A 81 8.366 -4.655 -4.462 1.00 0.00 C ATOM 1045 O VAL A 81 9.387 -5.223 -4.079 1.00 0.00 O ATOM 1046 CB VAL A 81 8.869 -2.437 -5.620 1.00 0.00 C ATOM 1047 CG1 VAL A 81 8.208 -1.748 -4.424 1.00 0.00 C ATOM 1048 CG2 VAL A 81 10.393 -2.408 -5.497 1.00 0.00 C ATOM 0 H VAL A 81 6.704 -2.961 -6.684 1.00 0.00 H new ATOM 0 HA VAL A 81 9.046 -4.373 -6.458 1.00 0.00 H new ATOM 0 HB VAL A 81 8.596 -1.884 -6.518 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.588 -0.730 -4.335 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.128 -1.721 -4.571 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.437 -2.301 -3.513 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.730 -1.377 -5.387 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.699 -2.984 -4.624 1.00 0.00 H new ATOM 0 HG23 VAL A 81 10.839 -2.842 -6.392 1.00 0.00 H new ATOM 1058 N THR A 82 7.214 -4.659 -3.807 1.00 0.00 N ATOM 1059 CA THR A 82 7.074 -5.363 -2.543 1.00 0.00 C ATOM 1060 C THR A 82 7.235 -6.870 -2.752 1.00 0.00 C ATOM 1061 O THR A 82 8.319 -7.416 -2.552 1.00 0.00 O ATOM 1062 CB THR A 82 5.727 -4.975 -1.932 1.00 0.00 C ATOM 1063 OG1 THR A 82 5.822 -3.565 -1.749 1.00 0.00 O ATOM 1064 CG2 THR A 82 5.546 -5.523 -0.515 1.00 0.00 C ATOM 0 H THR A 82 6.369 -4.186 -4.128 1.00 0.00 H new ATOM 0 HA THR A 82 7.859 -5.078 -1.842 1.00 0.00 H new ATOM 0 HB THR A 82 4.922 -5.342 -2.568 1.00 0.00 H new ATOM 0 HG1 THR A 82 5.832 -3.122 -2.623 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.573 -5.218 -0.129 1.00 0.00 H new ATOM 0 HG22 THR A 82 5.603 -6.611 -0.536 1.00 0.00 H new ATOM 0 HG23 THR A 82 6.332 -5.130 0.130 1.00 0.00 H new ATOM 1072 N SER A 83 6.140 -7.500 -3.151 1.00 0.00 N ATOM 1073 CA SER A 83 6.145 -8.933 -3.389 1.00 0.00 C ATOM 1074 C SER A 83 7.380 -9.324 -4.205 1.00 0.00 C ATOM 1075 O SER A 83 8.027 -10.329 -3.915 1.00 0.00 O ATOM 1076 CB SER A 83 4.871 -9.377 -4.110 1.00 0.00 C ATOM 1077 OG SER A 83 4.086 -10.259 -3.313 1.00 0.00 O ATOM 0 H SER A 83 5.243 -7.044 -3.316 1.00 0.00 H new ATOM 0 HA SER A 83 6.179 -9.439 -2.424 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.278 -8.500 -4.371 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.137 -9.872 -5.044 1.00 0.00 H new ATOM 0 HG SER A 83 3.281 -10.518 -3.808 1.00 0.00 H new ATOM 1083 N LYS A 84 7.669 -8.508 -5.208 1.00 0.00 N ATOM 1084 CA LYS A 84 8.814 -8.756 -6.067 1.00 0.00 C ATOM 1085 C LYS A 84 10.053 -8.996 -5.202 1.00 0.00 C ATOM 1086 O LYS A 84 10.698 -10.037 -5.312 1.00 0.00 O ATOM 1087 CB LYS A 84 8.981 -7.619 -7.078 1.00 0.00 C ATOM 1088 CG LYS A 84 10.186 -7.867 -7.987 1.00 0.00 C ATOM 1089 CD LYS A 84 10.495 -6.632 -8.837 1.00 0.00 C ATOM 1090 CE LYS A 84 10.206 -6.897 -10.315 1.00 0.00 C ATOM 1091 NZ LYS A 84 10.909 -5.911 -11.166 1.00 0.00 N ATOM 0 H LYS A 84 7.130 -7.675 -5.445 1.00 0.00 H new ATOM 0 HA LYS A 84 8.658 -9.658 -6.659 1.00 0.00 H new ATOM 0 HB2 LYS A 84 8.078 -7.529 -7.682 1.00 0.00 H new ATOM 0 HB3 LYS A 84 9.107 -6.674 -6.550 1.00 0.00 H new ATOM 0 HG2 LYS A 84 11.056 -8.123 -7.382 1.00 0.00 H new ATOM 0 HG3 LYS A 84 9.987 -8.719 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 84 9.896 -5.789 -8.491 1.00 0.00 H new ATOM 0 HD3 LYS A 84 11.541 -6.353 -8.712 1.00 0.00 H new ATOM 0 HE2 LYS A 84 10.524 -7.906 -10.579 1.00 0.00 H new ATOM 0 HE3 LYS A 84 9.133 -6.843 -10.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 10.702 -6.106 -12.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 10.586 -4.952 -10.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 11.934 -5.982 -11.005 1.00 0.00 H new ATOM 1105 N VAL A 85 10.347 -8.015 -4.362 1.00 0.00 N ATOM 1106 CA VAL A 85 11.497 -8.107 -3.478 1.00 0.00 C ATOM 1107 C VAL A 85 11.321 -9.303 -2.541 1.00 0.00 C ATOM 1108 O VAL A 85 12.301 -9.864 -2.053 1.00 0.00 O ATOM 1109 CB VAL A 85 11.690 -6.785 -2.731 1.00 0.00 C ATOM 1110 CG1 VAL A 85 10.616 -6.602 -1.657 1.00 0.00 C ATOM 1111 CG2 VAL A 85 13.092 -6.697 -2.125 1.00 0.00 C ATOM 0 H VAL A 85 9.809 -7.153 -4.275 1.00 0.00 H new ATOM 0 HA VAL A 85 12.408 -8.276 -4.053 1.00 0.00 H new ATOM 0 HB VAL A 85 11.586 -5.974 -3.452 1.00 0.00 H new ATOM 0 HG11 VAL A 85 10.775 -5.655 -1.141 1.00 0.00 H new ATOM 0 HG12 VAL A 85 9.631 -6.599 -2.124 1.00 0.00 H new ATOM 0 HG13 VAL A 85 10.675 -7.421 -0.940 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.203 -5.748 -1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 85 13.238 -7.519 -1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 85 13.836 -6.761 -2.919 1.00 0.00 H new ATOM 1121 N ILE A 86 10.064 -9.659 -2.318 1.00 0.00 N ATOM 1122 CA ILE A 86 9.747 -10.779 -1.448 1.00 0.00 C ATOM 1123 C ILE A 86 10.020 -12.089 -2.190 1.00 0.00 C ATOM 1124 O ILE A 86 11.022 -12.755 -1.933 1.00 0.00 O ATOM 1125 CB ILE A 86 8.316 -10.659 -0.920 1.00 0.00 C ATOM 1126 CG1 ILE A 86 8.143 -9.384 -0.092 1.00 0.00 C ATOM 1127 CG2 ILE A 86 7.914 -11.910 -0.137 1.00 0.00 C ATOM 1128 CD1 ILE A 86 8.917 -9.476 1.225 1.00 0.00 C ATOM 0 H ILE A 86 9.254 -9.192 -2.725 1.00 0.00 H new ATOM 0 HA ILE A 86 10.389 -10.771 -0.567 1.00 0.00 H new ATOM 0 HB ILE A 86 7.642 -10.583 -1.773 1.00 0.00 H new ATOM 0 HG12 ILE A 86 8.492 -8.524 -0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.085 -9.221 0.114 1.00 0.00 H new ATOM 0 HG21 ILE A 86 6.893 -11.799 0.227 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.974 -12.782 -0.788 1.00 0.00 H new ATOM 0 HG23 ILE A 86 8.588 -12.042 0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.777 -8.557 1.794 1.00 0.00 H new ATOM 0 HD12 ILE A 86 8.549 -10.322 1.805 1.00 0.00 H new ATOM 0 HD13 ILE A 86 9.978 -9.615 1.015 1.00 0.00 H new ATOM 1140 N GLY A 87 9.112 -12.420 -3.096 1.00 0.00 N ATOM 1141 CA GLY A 87 9.242 -13.638 -3.876 1.00 0.00 C ATOM 1142 C GLY A 87 7.872 -14.156 -4.319 1.00 0.00 C ATOM 1143 O GLY A 87 7.456 -15.241 -3.917 1.00 0.00 O ATOM 0 H GLY A 87 8.283 -11.865 -3.307 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.863 -13.449 -4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.749 -14.400 -3.284 1.00 0.00 H new ATOM 1147 N GLY A 88 7.209 -13.354 -5.139 1.00 0.00 N ATOM 1148 CA GLY A 88 5.895 -13.718 -5.640 1.00 0.00 C ATOM 1149 C GLY A 88 5.075 -14.430 -4.562 1.00 0.00 C ATOM 1150 O GLY A 88 4.604 -13.800 -3.617 1.00 0.00 O ATOM 0 H GLY A 88 7.557 -12.454 -5.469 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.368 -12.824 -5.972 1.00 0.00 H new ATOM 0 HA3 GLY A 88 6.000 -14.367 -6.510 1.00 0.00 H new ATOM 1154 N PHE A 89 4.929 -15.735 -4.741 1.00 0.00 N ATOM 1155 CA PHE A 89 4.174 -16.540 -3.796 1.00 0.00 C ATOM 1156 C PHE A 89 4.620 -18.003 -3.843 1.00 0.00 C ATOM 1157 O PHE A 89 4.063 -18.801 -4.594 1.00 0.00 O ATOM 1158 CB PHE A 89 2.704 -16.454 -4.209 1.00 0.00 C ATOM 1159 CG PHE A 89 1.722 -16.538 -3.038 1.00 0.00 C ATOM 1160 CD1 PHE A 89 1.711 -17.638 -2.239 1.00 0.00 C ATOM 1161 CD2 PHE A 89 0.862 -15.513 -2.797 1.00 0.00 C ATOM 1162 CE1 PHE A 89 0.800 -17.716 -1.152 1.00 0.00 C ATOM 1163 CE2 PHE A 89 -0.049 -15.591 -1.710 1.00 0.00 C ATOM 1164 CZ PHE A 89 -0.061 -16.691 -0.911 1.00 0.00 C ATOM 0 H PHE A 89 5.321 -16.255 -5.526 1.00 0.00 H new ATOM 0 HA PHE A 89 4.334 -16.172 -2.783 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.541 -15.516 -4.740 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.487 -17.259 -4.910 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.394 -18.452 -2.431 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.871 -14.639 -3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.791 -18.589 -0.517 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.732 -14.777 -1.518 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.754 -16.751 -0.085 1.00 0.00 H new ATOM 1174 N ALA A 90 5.621 -18.310 -3.030 1.00 0.00 N ATOM 1175 CA ALA A 90 6.148 -19.662 -2.970 1.00 0.00 C ATOM 1176 C ALA A 90 6.046 -20.181 -1.534 1.00 0.00 C ATOM 1177 O ALA A 90 5.627 -19.453 -0.635 1.00 0.00 O ATOM 1178 CB ALA A 90 7.585 -19.674 -3.493 1.00 0.00 C ATOM 0 H ALA A 90 6.080 -17.645 -2.408 1.00 0.00 H new ATOM 0 HA ALA A 90 5.565 -20.329 -3.604 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.980 -20.689 -3.448 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.599 -19.325 -4.525 1.00 0.00 H new ATOM 0 HB3 ALA A 90 8.201 -19.017 -2.879 1.00 0.00 H new ATOM 1184 N GLY A 91 6.436 -21.435 -1.363 1.00 0.00 N ATOM 1185 CA GLY A 91 6.394 -22.060 -0.051 1.00 0.00 C ATOM 1186 C GLY A 91 7.050 -21.166 1.003 1.00 0.00 C ATOM 1187 O GLY A 91 6.369 -20.406 1.689 1.00 0.00 O ATOM 0 H GLY A 91 6.783 -22.036 -2.111 1.00 0.00 H new ATOM 0 HA2 GLY A 91 5.359 -22.259 0.228 1.00 0.00 H new ATOM 0 HA3 GLY A 91 6.905 -23.022 -0.086 1.00 0.00 H new ATOM 1191 N THR A 92 8.366 -21.288 1.099 1.00 0.00 N ATOM 1192 CA THR A 92 9.122 -20.501 2.058 1.00 0.00 C ATOM 1193 C THR A 92 8.592 -19.067 2.108 1.00 0.00 C ATOM 1194 O THR A 92 8.322 -18.465 1.070 1.00 0.00 O ATOM 1195 CB THR A 92 10.602 -20.589 1.680 1.00 0.00 C ATOM 1196 OG1 THR A 92 10.663 -20.008 0.380 1.00 0.00 O ATOM 1197 CG2 THR A 92 11.068 -22.030 1.467 1.00 0.00 C ATOM 0 H THR A 92 8.928 -21.920 0.528 1.00 0.00 H new ATOM 0 HA THR A 92 9.006 -20.892 3.069 1.00 0.00 H new ATOM 0 HB THR A 92 11.204 -20.126 2.461 1.00 0.00 H new ATOM 0 HG1 THR A 92 11.589 -20.022 0.058 1.00 0.00 H new ATOM 0 HG21 THR A 92 12.125 -22.035 1.201 1.00 0.00 H new ATOM 0 HG22 THR A 92 10.922 -22.599 2.385 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.489 -22.484 0.663 1.00 0.00 H new ATOM 1205 N ALA A 93 8.457 -18.561 3.325 1.00 0.00 N ATOM 1206 CA ALA A 93 7.963 -17.209 3.523 1.00 0.00 C ATOM 1207 C ALA A 93 8.017 -16.865 5.013 1.00 0.00 C ATOM 1208 O ALA A 93 7.833 -17.735 5.862 1.00 0.00 O ATOM 1209 CB ALA A 93 6.550 -17.092 2.949 1.00 0.00 C ATOM 0 H ALA A 93 8.681 -19.063 4.184 1.00 0.00 H new ATOM 0 HA ALA A 93 8.590 -16.490 2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.180 -16.078 3.098 1.00 0.00 H new ATOM 0 HB2 ALA A 93 6.570 -17.318 1.883 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.891 -17.797 3.457 1.00 0.00 H new ATOM 1215 N LEU A 94 8.270 -15.593 5.285 1.00 0.00 N ATOM 1216 CA LEU A 94 8.351 -15.123 6.657 1.00 0.00 C ATOM 1217 C LEU A 94 9.252 -16.061 7.462 1.00 0.00 C ATOM 1218 O LEU A 94 8.791 -16.732 8.384 1.00 0.00 O ATOM 1219 CB LEU A 94 6.950 -14.958 7.250 1.00 0.00 C ATOM 1220 CG LEU A 94 6.728 -13.713 8.112 1.00 0.00 C ATOM 1221 CD1 LEU A 94 5.483 -12.948 7.659 1.00 0.00 C ATOM 1222 CD2 LEU A 94 6.669 -14.077 9.596 1.00 0.00 C ATOM 0 H LEU A 94 8.422 -14.873 4.578 1.00 0.00 H new ATOM 0 HA LEU A 94 8.807 -14.134 6.694 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.230 -14.942 6.431 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.727 -15.838 7.853 1.00 0.00 H new ATOM 0 HG LEU A 94 7.581 -13.048 7.978 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.348 -12.068 8.288 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.604 -12.637 6.621 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.608 -13.593 7.745 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.511 -13.174 10.186 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.847 -14.772 9.768 1.00 0.00 H new ATOM 0 HD23 LEU A 94 7.607 -14.545 9.893 1.00 0.00 H new ATOM 1234 N GLY A 95 10.522 -16.079 7.083 1.00 0.00 N ATOM 1235 CA GLY A 95 11.492 -16.924 7.757 1.00 0.00 C ATOM 1236 C GLY A 95 12.576 -17.398 6.786 1.00 0.00 C ATOM 1237 O GLY A 95 12.429 -18.437 6.145 1.00 0.00 O ATOM 0 H GLY A 95 10.901 -15.522 6.318 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.950 -16.373 8.579 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.987 -17.786 8.193 1.00 0.00 H new ATOM 1241 N ALA A 96 13.640 -16.612 6.708 1.00 0.00 N ATOM 1242 CA ALA A 96 14.748 -16.937 5.826 1.00 0.00 C ATOM 1243 C ALA A 96 15.713 -15.751 5.768 1.00 0.00 C ATOM 1244 O ALA A 96 15.475 -14.722 6.397 1.00 0.00 O ATOM 1245 CB ALA A 96 14.207 -17.317 4.446 1.00 0.00 C ATOM 0 H ALA A 96 13.758 -15.751 7.241 1.00 0.00 H new ATOM 0 HA ALA A 96 15.303 -17.795 6.206 1.00 0.00 H new ATOM 0 HB1 ALA A 96 15.038 -17.561 3.784 1.00 0.00 H new ATOM 0 HB2 ALA A 96 13.550 -18.182 4.538 1.00 0.00 H new ATOM 0 HB3 ALA A 96 13.647 -16.479 4.031 1.00 0.00 H new ATOM 1251 N TRP A 97 16.782 -15.936 5.008 1.00 0.00 N ATOM 1252 CA TRP A 97 17.784 -14.895 4.859 1.00 0.00 C ATOM 1253 C TRP A 97 17.852 -14.511 3.380 1.00 0.00 C ATOM 1254 O TRP A 97 18.888 -14.678 2.738 1.00 0.00 O ATOM 1255 CB TRP A 97 19.133 -15.348 5.422 1.00 0.00 C ATOM 1256 CG TRP A 97 19.750 -16.535 4.680 1.00 0.00 C ATOM 1257 CD1 TRP A 97 19.337 -17.810 4.675 1.00 0.00 C ATOM 1258 CD2 TRP A 97 20.914 -16.506 3.828 1.00 0.00 C ATOM 1259 NE1 TRP A 97 20.147 -18.601 3.886 1.00 0.00 N ATOM 1260 CE2 TRP A 97 21.137 -17.783 3.355 1.00 0.00 C ATOM 1261 CE3 TRP A 97 21.752 -15.435 3.469 1.00 0.00 C ATOM 1262 CZ2 TRP A 97 22.194 -18.109 2.497 1.00 0.00 C ATOM 1263 CZ3 TRP A 97 22.804 -15.778 2.611 1.00 0.00 C ATOM 1264 CH2 TRP A 97 23.042 -17.059 2.126 1.00 0.00 C ATOM 0 H TRP A 97 16.976 -16.792 4.488 1.00 0.00 H new ATOM 0 HA TRP A 97 17.510 -14.011 5.435 1.00 0.00 H new ATOM 0 HB2 TRP A 97 19.829 -14.510 5.388 1.00 0.00 H new ATOM 0 HB3 TRP A 97 19.006 -15.615 6.471 1.00 0.00 H new ATOM 0 HD1 TRP A 97 18.478 -18.173 5.220 1.00 0.00 H new ATOM 0 HE1 TRP A 97 20.039 -19.602 3.723 1.00 0.00 H new ATOM 0 HE3 TRP A 97 21.596 -14.428 3.827 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 22.347 -19.117 2.140 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 23.478 -14.992 2.304 1.00 0.00 H new ATOM 0 HH2 TRP A 97 23.877 -17.243 1.466 1.00 0.00 H new ATOM 1275 N LEU A 98 16.734 -14.004 2.881 1.00 0.00 N ATOM 1276 CA LEU A 98 16.654 -13.596 1.489 1.00 0.00 C ATOM 1277 C LEU A 98 16.897 -14.810 0.590 1.00 0.00 C ATOM 1278 O LEU A 98 17.529 -15.779 1.008 1.00 0.00 O ATOM 1279 CB LEU A 98 17.605 -12.429 1.217 1.00 0.00 C ATOM 1280 CG LEU A 98 16.947 -11.069 0.977 1.00 0.00 C ATOM 1281 CD1 LEU A 98 17.069 -10.174 2.212 1.00 0.00 C ATOM 1282 CD2 LEU A 98 17.515 -10.398 -0.275 1.00 0.00 C ATOM 0 H LEU A 98 15.876 -13.867 3.416 1.00 0.00 H new ATOM 0 HA LEU A 98 15.656 -13.224 1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 98 18.286 -12.337 2.063 1.00 0.00 H new ATOM 0 HB3 LEU A 98 18.211 -12.676 0.345 1.00 0.00 H new ATOM 0 HG LEU A 98 15.884 -11.231 0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 98 16.593 -9.214 2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 98 16.579 -10.654 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 98 18.122 -10.016 2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 98 17.030 -9.433 -0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 98 18.588 -10.250 -0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 98 17.332 -11.032 -1.142 1.00 0.00 H new ATOM 1294 N GLY A 99 16.383 -14.718 -0.627 1.00 0.00 N ATOM 1295 CA GLY A 99 16.537 -15.797 -1.588 1.00 0.00 C ATOM 1296 C GLY A 99 16.684 -15.248 -3.009 1.00 0.00 C ATOM 1297 O GLY A 99 15.791 -14.567 -3.511 1.00 0.00 O ATOM 0 H GLY A 99 15.859 -13.913 -0.970 1.00 0.00 H new ATOM 0 HA2 GLY A 99 17.412 -16.394 -1.333 1.00 0.00 H new ATOM 0 HA3 GLY A 99 15.673 -16.460 -1.538 1.00 0.00 H new ATOM 1301 N SER A 100 17.818 -15.566 -3.618 1.00 0.00 N ATOM 1302 CA SER A 100 18.093 -15.114 -4.971 1.00 0.00 C ATOM 1303 C SER A 100 17.651 -13.659 -5.136 1.00 0.00 C ATOM 1304 O SER A 100 16.603 -13.387 -5.720 1.00 0.00 O ATOM 1305 CB SER A 100 17.393 -16.002 -6.001 1.00 0.00 C ATOM 1306 OG SER A 100 15.993 -16.105 -5.754 1.00 0.00 O ATOM 0 H SER A 100 18.556 -16.131 -3.199 1.00 0.00 H new ATOM 0 HA SER A 100 19.167 -15.182 -5.143 1.00 0.00 H new ATOM 0 HB2 SER A 100 17.556 -15.597 -7.000 1.00 0.00 H new ATOM 0 HB3 SER A 100 17.838 -16.997 -5.984 1.00 0.00 H new ATOM 0 HG SER A 100 15.638 -15.224 -5.511 1.00 0.00 H new ATOM 1312 N PRO A 101 18.494 -12.737 -4.598 1.00 0.00 N ATOM 1313 CA PRO A 101 18.202 -11.316 -4.681 1.00 0.00 C ATOM 1314 C PRO A 101 18.463 -10.783 -6.091 1.00 0.00 C ATOM 1315 O PRO A 101 19.246 -11.363 -6.842 1.00 0.00 O ATOM 1316 CB PRO A 101 19.087 -10.670 -3.628 1.00 0.00 C ATOM 1317 CG PRO A 101 20.175 -11.686 -3.318 1.00 0.00 C ATOM 1318 CD PRO A 101 19.744 -13.022 -3.900 1.00 0.00 C ATOM 0 HA PRO A 101 17.152 -11.091 -4.492 1.00 0.00 H new ATOM 0 HB2 PRO A 101 19.516 -9.738 -3.997 1.00 0.00 H new ATOM 0 HB3 PRO A 101 18.515 -10.425 -2.733 1.00 0.00 H new ATOM 0 HG2 PRO A 101 21.126 -11.371 -3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 101 20.324 -11.769 -2.241 1.00 0.00 H new ATOM 0 HD2 PRO A 101 20.497 -13.418 -4.582 1.00 0.00 H new ATOM 0 HD3 PRO A 101 19.599 -13.767 -3.117 1.00 0.00 H new ATOM 1326 N PRO A 102 17.775 -9.657 -6.416 1.00 0.00 N ATOM 1327 CA PRO A 102 17.925 -9.039 -7.723 1.00 0.00 C ATOM 1328 C PRO A 102 19.258 -8.296 -7.828 1.00 0.00 C ATOM 1329 O PRO A 102 19.495 -7.332 -7.102 1.00 0.00 O ATOM 1330 CB PRO A 102 16.721 -8.122 -7.865 1.00 0.00 C ATOM 1331 CG PRO A 102 16.193 -7.906 -6.456 1.00 0.00 C ATOM 1332 CD PRO A 102 16.838 -8.943 -5.552 1.00 0.00 C ATOM 0 HA PRO A 102 17.951 -9.768 -8.533 1.00 0.00 H new ATOM 0 HB2 PRO A 102 17.003 -7.175 -8.326 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.960 -8.572 -8.502 1.00 0.00 H new ATOM 0 HG2 PRO A 102 16.428 -6.899 -6.110 1.00 0.00 H new ATOM 0 HG3 PRO A 102 15.108 -8.004 -6.436 1.00 0.00 H new ATOM 0 HD2 PRO A 102 17.352 -8.473 -4.714 1.00 0.00 H new ATOM 0 HD3 PRO A 102 16.094 -9.619 -5.131 1.00 0.00 H new ATOM 1340 N SER A 103 20.094 -8.774 -8.739 1.00 0.00 N ATOM 1341 CA SER A 103 21.398 -8.167 -8.949 1.00 0.00 C ATOM 1342 C SER A 103 22.098 -7.953 -7.605 1.00 0.00 C ATOM 1343 O SER A 103 22.007 -6.876 -7.018 1.00 0.00 O ATOM 1344 CB SER A 103 21.273 -6.840 -9.699 1.00 0.00 C ATOM 1345 OG SER A 103 22.522 -6.159 -9.791 1.00 0.00 O ATOM 0 H SER A 103 19.894 -9.574 -9.339 1.00 0.00 H new ATOM 0 HA SER A 103 21.996 -8.844 -9.559 1.00 0.00 H new ATOM 0 HB2 SER A 103 20.886 -7.025 -10.701 1.00 0.00 H new ATOM 0 HB3 SER A 103 20.549 -6.203 -9.191 1.00 0.00 H new ATOM 0 HG SER A 103 22.401 -5.317 -10.278 1.00 0.00 H new ATOM 1351 N SER A 104 22.781 -8.996 -7.157 1.00 0.00 N ATOM 1352 CA SER A 104 23.496 -8.936 -5.894 1.00 0.00 C ATOM 1353 C SER A 104 24.811 -8.173 -6.073 1.00 0.00 C ATOM 1354 O SER A 104 25.014 -7.127 -5.458 1.00 0.00 O ATOM 1355 CB SER A 104 23.767 -10.339 -5.347 1.00 0.00 C ATOM 1356 OG SER A 104 24.720 -10.324 -4.288 1.00 0.00 O ATOM 0 H SER A 104 22.854 -9.888 -7.647 1.00 0.00 H new ATOM 0 HA SER A 104 22.872 -8.408 -5.173 1.00 0.00 H new ATOM 0 HB2 SER A 104 22.834 -10.775 -4.989 1.00 0.00 H new ATOM 0 HB3 SER A 104 24.130 -10.978 -6.152 1.00 0.00 H new ATOM 0 HG SER A 104 24.864 -11.238 -3.965 1.00 0.00 H new TER 1362 SER A 104