USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 976 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 92 THR OG1 : rot -38:sc= 0.0923 USER MOD Set 1.2: A 93 GLN : amide:sc= 1.05 K(o=1.1,f=-0.083) USER MOD Set 2.1: A 69 ASN : amide:sc= 0.768 K(o=1.1,f=0.19) USER MOD Set 2.2: A 73 TYR OH : rot -113:sc= 0.304 USER MOD Set 3.1: A 11 ASN : amide:sc= 0.8 K(o=1.9,f=-3.7!) USER MOD Set 3.2: A 15 SER OG : rot -63:sc= 0.576 USER MOD Set 3.3: A 34 SER OG : rot -170:sc= 0.507 USER MOD Set 4.1: A 5 MET CE :methyl 169:sc= -0.164 (180deg=-0.804) USER MOD Set 4.2: A 35 CYS SG : rot -95:sc= 0.4 USER MOD Single : A 1 MET CE :methyl -168:sc= 0 (180deg=-0.124) USER MOD Single : A 1 MET N :NH3+ 150:sc= 1.28 (180deg=0.673) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -167:sc= 0.837 (180deg=0.605) USER MOD Single : A 8 CYS SG : rot 176:sc= 0.121 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 160:sc= 0.0392 USER MOD Single : A 13 CYS SG : rot 138:sc= 0.365 USER MOD Single : A 16 GLN : amide:sc= 0.851 K(o=0.85,f=-2.3!) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 173:sc= 0.921 (180deg=0.89) USER MOD Single : A 24 THR OG1 : rot -160:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -173:sc= 0.88 (180deg=0.84) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -64:sc= 1.51 USER MOD Single : A 43 HIS : no HD1:sc= 0.238 K(o=0.24,f=-2.2) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 179:sc= -0.329 (180deg=-0.336) USER MOD Single : A 50 MET CE :methyl -143:sc= -0.0972 (180deg=-2.49) USER MOD Single : A 58 SER OG : rot -77:sc= 0.00632 USER MOD Single : A 60 GLN : amide:sc= 0.705 K(o=0.7,f=-3.7) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -81:sc= 1.07 USER MOD Single : A 67 ASN : amide:sc= 0.857 K(o=0.86,f=-0.19) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0143 X(o=-0.014,f=-0.014) USER MOD Single : A 100 GLN : amide:sc= 1.18 K(o=1.2,f=-0.38) USER MOD Single : A 107 GLN : amide:sc= 0.347 K(o=0.35,f=-0.74) USER MOD Single : A 108 SER OG : rot 29:sc= 0.529 USER MOD Single : A 114 THR OG1 : rot 78:sc= 1.12 USER MOD Single : A 118 GLN : amide:sc= 1.33 K(o=1.3,f=-0.26) USER MOD Single : A 120 LYS NZ :NH3+ -173:sc= 1.21 (180deg=1.14) USER MOD Single : A 125 ASN : amide:sc= 0.831 K(o=0.83,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 82:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.947 0.134 1.458 1.00 0.00 N ATOM 2 CA MET A 1 2.347 0.307 0.032 1.00 0.00 C ATOM 3 C MET A 1 2.404 1.791 -0.353 1.00 0.00 C ATOM 4 O MET A 1 1.406 2.495 -0.227 1.00 0.00 O ATOM 5 CB MET A 1 1.442 -0.496 -0.932 1.00 0.00 C ATOM 6 CG MET A 1 2.034 -0.573 -2.350 1.00 0.00 C ATOM 7 SD MET A 1 1.075 -1.612 -3.483 1.00 0.00 S ATOM 8 CE MET A 1 2.338 -1.949 -4.739 1.00 0.00 C ATOM 0 H1 MET A 1 1.437 -0.766 1.569 1.00 0.00 H new ATOM 0 H2 MET A 1 2.796 0.127 2.058 1.00 0.00 H new ATOM 0 H3 MET A 1 1.328 0.920 1.743 1.00 0.00 H new ATOM 0 HA MET A 1 3.352 -0.102 -0.069 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.302 -1.504 -0.542 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.457 -0.032 -0.975 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.100 0.434 -2.762 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.051 -0.960 -2.289 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.869 -2.395 -5.616 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.826 -1.017 -5.023 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.079 -2.638 -4.334 1.00 0.00 H new ATOM 18 N LYS A 2 3.557 2.249 -0.863 1.00 0.00 N ATOM 19 CA LYS A 2 3.767 3.584 -1.474 1.00 0.00 C ATOM 20 C LYS A 2 4.459 3.468 -2.840 1.00 0.00 C ATOM 21 O LYS A 2 4.987 2.409 -3.177 1.00 0.00 O ATOM 22 CB LYS A 2 4.544 4.486 -0.488 1.00 0.00 C ATOM 23 CG LYS A 2 3.615 5.083 0.583 1.00 0.00 C ATOM 24 CD LYS A 2 4.363 6.034 1.537 1.00 0.00 C ATOM 25 CE LYS A 2 3.418 6.865 2.424 1.00 0.00 C ATOM 26 NZ LYS A 2 2.670 6.035 3.418 1.00 0.00 N ATOM 0 H LYS A 2 4.406 1.683 -0.865 1.00 0.00 H new ATOM 0 HA LYS A 2 2.801 4.051 -1.665 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.331 3.906 -0.006 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.032 5.291 -1.037 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.803 5.623 0.097 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.161 4.276 1.159 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.030 5.451 2.173 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.989 6.708 0.952 1.00 0.00 H new ATOM 0 HE2 LYS A 2 3.997 7.622 2.953 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.706 7.394 1.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.051 6.648 3.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 2.094 5.329 2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.345 5.550 4.043 1.00 0.00 H new ATOM 40 N LYS A 3 4.443 4.542 -3.634 1.00 0.00 N ATOM 41 CA LYS A 3 5.055 4.611 -4.976 1.00 0.00 C ATOM 42 C LYS A 3 6.341 5.434 -4.936 1.00 0.00 C ATOM 43 O LYS A 3 6.398 6.465 -4.268 1.00 0.00 O ATOM 44 CB LYS A 3 4.063 5.137 -6.037 1.00 0.00 C ATOM 45 CG LYS A 3 2.816 4.251 -6.251 1.00 0.00 C ATOM 46 CD LYS A 3 1.652 4.435 -5.257 1.00 0.00 C ATOM 47 CE LYS A 3 1.084 5.857 -5.325 1.00 0.00 C ATOM 48 NZ LYS A 3 0.257 6.196 -4.136 1.00 0.00 N ATOM 0 H LYS A 3 3.993 5.415 -3.359 1.00 0.00 H new ATOM 0 HA LYS A 3 5.316 3.597 -5.278 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.737 6.135 -5.746 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.588 5.237 -6.987 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.437 4.436 -7.256 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.131 3.208 -6.216 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.864 3.715 -5.478 1.00 0.00 H new ATOM 0 HD3 LYS A 3 1.999 4.227 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.905 6.569 -5.408 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.479 5.961 -6.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.279 7.067 -4.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.405 5.418 -3.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.876 6.340 -3.312 1.00 0.00 H new ATOM 62 N VAL A 4 7.355 4.996 -5.678 1.00 0.00 N ATOM 63 CA VAL A 4 8.657 5.687 -5.814 1.00 0.00 C ATOM 64 C VAL A 4 8.941 5.969 -7.291 1.00 0.00 C ATOM 65 O VAL A 4 8.667 5.136 -8.152 1.00 0.00 O ATOM 66 CB VAL A 4 9.822 4.940 -5.124 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.088 5.805 -5.064 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.474 4.486 -3.700 1.00 0.00 C ATOM 0 H VAL A 4 7.304 4.132 -6.218 1.00 0.00 H new ATOM 0 HA VAL A 4 8.583 6.637 -5.284 1.00 0.00 H new ATOM 0 HB VAL A 4 10.004 4.057 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.886 5.248 -4.573 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.398 6.067 -6.076 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.881 6.715 -4.501 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.328 3.968 -3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.228 5.356 -3.091 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.618 3.812 -3.732 1.00 0.00 H new ATOM 78 N MET A 5 9.493 7.139 -7.595 1.00 0.00 N ATOM 79 CA MET A 5 9.830 7.550 -8.960 1.00 0.00 C ATOM 80 C MET A 5 11.237 8.134 -8.996 1.00 0.00 C ATOM 81 O MET A 5 11.605 8.939 -8.142 1.00 0.00 O ATOM 82 CB MET A 5 8.768 8.522 -9.493 1.00 0.00 C ATOM 83 CG MET A 5 9.161 9.234 -10.795 1.00 0.00 C ATOM 84 SD MET A 5 9.506 8.184 -12.231 1.00 0.00 S ATOM 85 CE MET A 5 8.117 8.635 -13.307 1.00 0.00 C ATOM 0 H MET A 5 9.724 7.841 -6.892 1.00 0.00 H new ATOM 0 HA MET A 5 9.828 6.683 -9.621 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.840 7.974 -9.658 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.563 9.273 -8.730 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.358 9.921 -11.062 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.045 9.839 -10.597 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.283 8.229 -14.305 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.193 8.227 -12.898 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.040 9.721 -13.366 1.00 0.00 H new ATOM 95 N PHE A 6 12.010 7.734 -9.999 1.00 0.00 N ATOM 96 CA PHE A 6 13.408 8.131 -10.169 1.00 0.00 C ATOM 97 C PHE A 6 13.576 9.111 -11.336 1.00 0.00 C ATOM 98 O PHE A 6 13.043 8.871 -12.413 1.00 0.00 O ATOM 99 CB PHE A 6 14.273 6.868 -10.330 1.00 0.00 C ATOM 100 CG PHE A 6 14.027 5.816 -9.264 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.558 5.961 -7.967 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.219 4.705 -9.560 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.231 5.044 -6.954 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.886 3.789 -8.544 1.00 0.00 C ATOM 105 CZ PHE A 6 13.375 3.969 -7.238 1.00 0.00 C ATOM 0 H PHE A 6 11.677 7.111 -10.735 1.00 0.00 H new ATOM 0 HA PHE A 6 13.744 8.667 -9.281 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.081 6.430 -11.310 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.325 7.154 -10.309 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.222 6.784 -7.750 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.854 4.554 -10.565 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.637 5.166 -5.961 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.252 2.944 -8.769 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.092 3.281 -6.455 1.00 0.00 H new ATOM 115 N VAL A 7 14.351 10.182 -11.142 1.00 0.00 N ATOM 116 CA VAL A 7 14.749 11.177 -12.152 1.00 0.00 C ATOM 117 C VAL A 7 16.263 11.125 -12.350 1.00 0.00 C ATOM 118 O VAL A 7 17.013 11.311 -11.402 1.00 0.00 O ATOM 119 CB VAL A 7 14.243 12.594 -11.763 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.109 13.744 -12.302 1.00 0.00 C ATOM 121 CG2 VAL A 7 12.842 12.824 -12.329 1.00 0.00 C ATOM 0 H VAL A 7 14.742 10.393 -10.224 1.00 0.00 H new ATOM 0 HA VAL A 7 14.281 10.938 -13.107 1.00 0.00 H new ATOM 0 HB VAL A 7 14.274 12.609 -10.674 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.686 14.697 -11.985 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.123 13.649 -11.913 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.133 13.702 -13.391 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.496 13.820 -12.051 1.00 0.00 H new ATOM 0 HG22 VAL A 7 12.870 12.740 -13.415 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.159 12.077 -11.925 1.00 0.00 H new ATOM 131 N CYS A 8 16.735 10.912 -13.578 1.00 0.00 N ATOM 132 CA CYS A 8 18.151 11.051 -13.966 1.00 0.00 C ATOM 133 C CYS A 8 18.292 12.081 -15.108 1.00 0.00 C ATOM 134 O CYS A 8 17.302 12.429 -15.743 1.00 0.00 O ATOM 135 CB CYS A 8 18.670 9.634 -14.276 1.00 0.00 C ATOM 136 SG CYS A 8 20.412 9.593 -14.803 1.00 0.00 S ATOM 0 H CYS A 8 16.135 10.631 -14.354 1.00 0.00 H new ATOM 0 HA CYS A 8 18.775 11.458 -13.171 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.553 9.011 -13.389 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.052 9.193 -15.058 1.00 0.00 H new ATOM 0 HG CYS A 8 20.787 8.359 -14.965 1.00 0.00 H new ATOM 142 N LYS A 9 19.505 12.575 -15.405 1.00 0.00 N ATOM 143 CA LYS A 9 19.704 13.720 -16.328 1.00 0.00 C ATOM 144 C LYS A 9 19.226 13.435 -17.765 1.00 0.00 C ATOM 145 O LYS A 9 18.580 14.287 -18.357 1.00 0.00 O ATOM 146 CB LYS A 9 21.174 14.198 -16.263 1.00 0.00 C ATOM 147 CG LYS A 9 21.315 15.672 -16.690 1.00 0.00 C ATOM 148 CD LYS A 9 22.773 16.146 -16.814 1.00 0.00 C ATOM 149 CE LYS A 9 23.484 15.558 -18.048 1.00 0.00 C ATOM 150 NZ LYS A 9 24.835 16.164 -18.240 1.00 0.00 N ATOM 0 H LYS A 9 20.372 12.201 -15.020 1.00 0.00 H new ATOM 0 HA LYS A 9 19.066 14.536 -15.989 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.552 14.076 -15.248 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.789 13.572 -16.909 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.814 15.812 -17.648 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.799 16.301 -15.965 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.794 17.234 -16.872 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.321 15.864 -15.915 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.581 14.478 -17.934 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.877 15.731 -18.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.287 15.747 -19.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.739 17.191 -18.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.422 15.977 -17.402 1.00 0.00 H new ATOM 164 N ARG A 10 19.478 12.218 -18.283 1.00 0.00 N ATOM 165 CA ARG A 10 18.975 11.726 -19.603 1.00 0.00 C ATOM 166 C ARG A 10 18.233 10.377 -19.586 1.00 0.00 C ATOM 167 O ARG A 10 18.019 9.773 -20.632 1.00 0.00 O ATOM 168 CB ARG A 10 20.047 11.881 -20.713 1.00 0.00 C ATOM 169 CG ARG A 10 21.238 10.898 -20.767 1.00 0.00 C ATOM 170 CD ARG A 10 22.189 10.965 -19.564 1.00 0.00 C ATOM 171 NE ARG A 10 23.509 10.343 -19.839 1.00 0.00 N ATOM 172 CZ ARG A 10 24.502 10.203 -18.973 1.00 0.00 C ATOM 173 NH1 ARG A 10 24.375 10.554 -17.727 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.651 9.712 -19.310 1.00 0.00 N ATOM 0 H ARG A 10 20.047 11.527 -17.795 1.00 0.00 H new ATOM 0 HA ARG A 10 18.158 12.396 -19.869 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.533 11.824 -21.673 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.458 12.887 -20.631 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.849 9.883 -20.847 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.810 11.093 -21.674 1.00 0.00 H new ATOM 0 HD2 ARG A 10 22.336 12.007 -19.280 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.727 10.465 -18.713 1.00 0.00 H new ATOM 0 HE ARG A 10 23.666 9.990 -20.783 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.495 10.948 -17.395 1.00 0.00 H new ATOM 0 HH12 ARG A 10 25.156 10.435 -17.082 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.817 9.417 -20.272 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.391 9.620 -18.614 1.00 0.00 H new ATOM 188 N ASN A 11 17.881 9.885 -18.391 1.00 0.00 N ATOM 189 CA ASN A 11 17.215 8.590 -18.106 1.00 0.00 C ATOM 190 C ASN A 11 17.838 7.349 -18.773 1.00 0.00 C ATOM 191 O ASN A 11 17.135 6.406 -19.133 1.00 0.00 O ATOM 192 CB ASN A 11 15.700 8.763 -18.315 1.00 0.00 C ATOM 193 CG ASN A 11 14.820 7.638 -17.782 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.870 7.242 -18.431 1.00 0.00 O ATOM 195 ND2 ASN A 11 15.043 7.126 -16.589 1.00 0.00 N ATOM 0 H ASN A 11 18.062 10.410 -17.535 1.00 0.00 H new ATOM 0 HA ASN A 11 17.395 8.343 -17.060 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.392 9.695 -17.841 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.510 8.871 -19.383 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.423 6.406 -16.219 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.836 7.450 -16.035 1.00 0.00 H new ATOM 202 N SER A 12 19.162 7.345 -18.920 1.00 0.00 N ATOM 203 CA SER A 12 19.935 6.249 -19.518 1.00 0.00 C ATOM 204 C SER A 12 20.447 5.250 -18.482 1.00 0.00 C ATOM 205 O SER A 12 20.431 4.047 -18.729 1.00 0.00 O ATOM 206 CB SER A 12 21.105 6.867 -20.285 1.00 0.00 C ATOM 207 OG SER A 12 21.785 7.728 -19.382 1.00 0.00 O ATOM 0 H SER A 12 19.746 8.125 -18.619 1.00 0.00 H new ATOM 0 HA SER A 12 19.282 5.684 -20.183 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.775 6.092 -20.657 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.747 7.422 -21.152 1.00 0.00 H new ATOM 0 HG SER A 12 22.695 7.891 -19.708 1.00 0.00 H new ATOM 213 N CYS A 13 20.878 5.742 -17.315 1.00 0.00 N ATOM 214 CA CYS A 13 21.476 4.962 -16.221 1.00 0.00 C ATOM 215 C CYS A 13 20.967 5.461 -14.854 1.00 0.00 C ATOM 216 O CYS A 13 20.117 6.348 -14.790 1.00 0.00 O ATOM 217 CB CYS A 13 23.010 5.050 -16.413 1.00 0.00 C ATOM 218 SG CYS A 13 23.880 3.760 -15.460 1.00 0.00 S ATOM 0 H CYS A 13 20.818 6.736 -17.096 1.00 0.00 H new ATOM 0 HA CYS A 13 21.183 3.912 -16.243 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.252 4.947 -17.471 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.361 6.033 -16.100 1.00 0.00 H new ATOM 0 HG CYS A 13 24.826 3.246 -16.189 1.00 0.00 H new ATOM 224 N ARG A 14 21.462 4.896 -13.747 1.00 0.00 N ATOM 225 CA ARG A 14 21.052 5.158 -12.338 1.00 0.00 C ATOM 226 C ARG A 14 19.566 4.916 -12.065 1.00 0.00 C ATOM 227 O ARG A 14 19.206 3.855 -11.585 1.00 0.00 O ATOM 228 CB ARG A 14 21.602 6.529 -11.864 1.00 0.00 C ATOM 229 CG ARG A 14 23.135 6.557 -11.880 1.00 0.00 C ATOM 230 CD ARG A 14 23.715 7.776 -11.148 1.00 0.00 C ATOM 231 NE ARG A 14 23.363 9.049 -11.817 1.00 0.00 N ATOM 232 CZ ARG A 14 24.025 9.664 -12.781 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.184 9.268 -13.198 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.513 10.706 -13.356 1.00 0.00 N ATOM 0 H ARG A 14 22.205 4.199 -13.800 1.00 0.00 H new ATOM 0 HA ARG A 14 21.520 4.404 -11.705 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.216 7.319 -12.508 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.244 6.737 -10.856 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.515 5.646 -11.418 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.483 6.559 -12.913 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.345 7.792 -10.123 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.800 7.683 -11.094 1.00 0.00 H new ATOM 0 HE ARG A 14 22.509 9.505 -11.496 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.624 8.449 -12.779 1.00 0.00 H new ATOM 0 HH12 ARG A 14 25.658 9.775 -13.946 1.00 0.00 H new ATOM 0 HH21 ARG A 14 22.599 11.052 -13.064 1.00 0.00 H new ATOM 0 HH22 ARG A 14 24.024 11.181 -14.100 1.00 0.00 H new ATOM 248 N SER A 15 18.695 5.843 -12.460 1.00 0.00 N ATOM 249 CA SER A 15 17.211 5.751 -12.381 1.00 0.00 C ATOM 250 C SER A 15 16.658 4.404 -12.863 1.00 0.00 C ATOM 251 O SER A 15 15.858 3.758 -12.198 1.00 0.00 O ATOM 252 CB SER A 15 16.615 6.896 -13.219 1.00 0.00 C ATOM 253 OG SER A 15 17.103 6.844 -14.562 1.00 0.00 O ATOM 0 H SER A 15 19.004 6.726 -12.865 1.00 0.00 H new ATOM 0 HA SER A 15 16.925 5.834 -11.333 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.527 6.826 -13.219 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.873 7.855 -12.770 1.00 0.00 H new ATOM 0 HG SER A 15 18.074 6.978 -14.563 1.00 0.00 H new ATOM 259 N GLN A 16 17.175 3.932 -13.998 1.00 0.00 N ATOM 260 CA GLN A 16 16.803 2.663 -14.640 1.00 0.00 C ATOM 261 C GLN A 16 17.226 1.439 -13.795 1.00 0.00 C ATOM 262 O GLN A 16 16.442 0.502 -13.635 1.00 0.00 O ATOM 263 CB GLN A 16 17.434 2.684 -16.052 1.00 0.00 C ATOM 264 CG GLN A 16 16.928 3.813 -16.989 1.00 0.00 C ATOM 265 CD GLN A 16 15.489 3.658 -17.505 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.643 2.979 -16.948 1.00 0.00 O ATOM 267 NE2 GLN A 16 15.157 4.330 -18.584 1.00 0.00 N ATOM 0 H GLN A 16 17.891 4.439 -14.518 1.00 0.00 H new ATOM 0 HA GLN A 16 15.721 2.564 -14.721 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.515 2.779 -15.947 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.243 1.724 -16.531 1.00 0.00 H new ATOM 0 HG2 GLN A 16 17.003 4.762 -16.457 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.597 3.874 -17.847 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.852 4.903 -19.062 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.204 4.279 -18.944 1.00 0.00 H new ATOM 276 N MET A 17 18.406 1.490 -13.150 1.00 0.00 N ATOM 277 CA MET A 17 18.854 0.493 -12.150 1.00 0.00 C ATOM 278 C MET A 17 18.033 0.561 -10.856 1.00 0.00 C ATOM 279 O MET A 17 17.756 -0.470 -10.257 1.00 0.00 O ATOM 280 CB MET A 17 20.334 0.701 -11.771 1.00 0.00 C ATOM 281 CG MET A 17 21.362 0.440 -12.871 1.00 0.00 C ATOM 282 SD MET A 17 23.037 0.700 -12.227 1.00 0.00 S ATOM 283 CE MET A 17 24.018 0.060 -13.603 1.00 0.00 C ATOM 0 H MET A 17 19.087 2.233 -13.308 1.00 0.00 H new ATOM 0 HA MET A 17 18.715 -0.479 -12.623 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.457 1.728 -11.426 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.565 0.051 -10.927 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.260 -0.580 -13.241 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.181 1.105 -13.715 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.078 0.148 -13.366 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.769 -0.988 -13.771 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.799 0.634 -14.504 1.00 0.00 H new ATOM 293 N ALA A 18 17.624 1.758 -10.424 1.00 0.00 N ATOM 294 CA ALA A 18 16.856 1.953 -9.189 1.00 0.00 C ATOM 295 C ALA A 18 15.488 1.266 -9.275 1.00 0.00 C ATOM 296 O ALA A 18 15.097 0.558 -8.350 1.00 0.00 O ATOM 297 CB ALA A 18 16.752 3.459 -8.913 1.00 0.00 C ATOM 0 H ALA A 18 17.818 2.625 -10.925 1.00 0.00 H new ATOM 0 HA ALA A 18 17.367 1.484 -8.348 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.184 3.623 -7.997 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.752 3.878 -8.799 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.247 3.948 -9.746 1.00 0.00 H new ATOM 303 N GLU A 19 14.819 1.357 -10.430 1.00 0.00 N ATOM 304 CA GLU A 19 13.615 0.567 -10.718 1.00 0.00 C ATOM 305 C GLU A 19 13.942 -0.935 -10.737 1.00 0.00 C ATOM 306 O GLU A 19 13.193 -1.719 -10.168 1.00 0.00 O ATOM 307 CB GLU A 19 13.000 1.042 -12.044 1.00 0.00 C ATOM 308 CG GLU A 19 11.618 0.433 -12.318 1.00 0.00 C ATOM 309 CD GLU A 19 11.188 0.699 -13.772 1.00 0.00 C ATOM 310 OE1 GLU A 19 10.645 1.789 -14.062 1.00 0.00 O ATOM 311 OE2 GLU A 19 11.424 -0.190 -14.627 1.00 0.00 O ATOM 0 H GLU A 19 15.096 1.978 -11.190 1.00 0.00 H new ATOM 0 HA GLU A 19 12.879 0.718 -9.928 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.915 2.129 -12.030 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.673 0.785 -12.862 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.644 -0.641 -12.131 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.885 0.858 -11.633 1.00 0.00 H new ATOM 318 N GLY A 20 15.094 -1.329 -11.295 1.00 0.00 N ATOM 319 CA GLY A 20 15.611 -2.704 -11.276 1.00 0.00 C ATOM 320 C GLY A 20 15.760 -3.303 -9.873 1.00 0.00 C ATOM 321 O GLY A 20 15.307 -4.415 -9.631 1.00 0.00 O ATOM 0 H GLY A 20 15.710 -0.681 -11.786 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.944 -3.338 -11.860 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.582 -2.721 -11.771 1.00 0.00 H new ATOM 325 N PHE A 21 16.327 -2.573 -8.913 1.00 0.00 N ATOM 326 CA PHE A 21 16.408 -3.058 -7.525 1.00 0.00 C ATOM 327 C PHE A 21 15.064 -3.003 -6.816 1.00 0.00 C ATOM 328 O PHE A 21 14.645 -3.977 -6.195 1.00 0.00 O ATOM 329 CB PHE A 21 17.496 -2.289 -6.768 1.00 0.00 C ATOM 330 CG PHE A 21 18.868 -2.706 -7.237 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.293 -4.027 -7.012 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.679 -1.820 -7.966 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.514 -4.469 -7.530 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.913 -2.261 -8.469 1.00 0.00 C ATOM 335 CZ PHE A 21 21.324 -3.589 -8.261 1.00 0.00 C ATOM 0 H PHE A 21 16.735 -1.651 -9.063 1.00 0.00 H new ATOM 0 HA PHE A 21 16.686 -4.112 -7.546 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.364 -1.218 -6.920 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.401 -2.473 -5.698 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.675 -4.702 -6.438 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.354 -0.804 -8.139 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.833 -5.488 -7.367 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.547 -1.579 -9.016 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.265 -3.932 -8.665 1.00 0.00 H new ATOM 345 N ALA A 22 14.353 -1.887 -6.932 1.00 0.00 N ATOM 346 CA ALA A 22 13.088 -1.694 -6.228 1.00 0.00 C ATOM 347 C ALA A 22 11.977 -2.653 -6.692 1.00 0.00 C ATOM 348 O ALA A 22 11.228 -3.134 -5.847 1.00 0.00 O ATOM 349 CB ALA A 22 12.713 -0.218 -6.366 1.00 0.00 C ATOM 0 H ALA A 22 14.633 -1.096 -7.511 1.00 0.00 H new ATOM 0 HA ALA A 22 13.210 -1.947 -5.175 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.770 -0.033 -5.851 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.495 0.399 -5.924 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.606 0.033 -7.421 1.00 0.00 H new ATOM 355 N LYS A 23 11.898 -3.029 -7.978 1.00 0.00 N ATOM 356 CA LYS A 23 10.865 -3.973 -8.470 1.00 0.00 C ATOM 357 C LYS A 23 10.982 -5.375 -7.847 1.00 0.00 C ATOM 358 O LYS A 23 9.972 -6.036 -7.628 1.00 0.00 O ATOM 359 CB LYS A 23 10.859 -4.026 -10.013 1.00 0.00 C ATOM 360 CG LYS A 23 12.107 -4.696 -10.610 1.00 0.00 C ATOM 361 CD LYS A 23 12.253 -4.554 -12.132 1.00 0.00 C ATOM 362 CE LYS A 23 11.231 -5.422 -12.888 1.00 0.00 C ATOM 363 NZ LYS A 23 11.521 -5.482 -14.354 1.00 0.00 N ATOM 0 H LYS A 23 12.535 -2.697 -8.702 1.00 0.00 H new ATOM 0 HA LYS A 23 9.901 -3.585 -8.140 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.973 -4.566 -10.346 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.780 -3.011 -10.403 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.991 -4.273 -10.134 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.087 -5.757 -10.359 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.122 -3.509 -12.414 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.262 -4.840 -12.429 1.00 0.00 H new ATOM 0 HE2 LYS A 23 11.237 -6.431 -12.476 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.230 -5.021 -12.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 10.884 -6.168 -14.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 11.374 -4.543 -14.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 12.507 -5.777 -14.501 1.00 0.00 H new ATOM 377 N THR A 24 12.211 -5.799 -7.536 1.00 0.00 N ATOM 378 CA THR A 24 12.539 -7.104 -6.922 1.00 0.00 C ATOM 379 C THR A 24 12.545 -7.042 -5.389 1.00 0.00 C ATOM 380 O THR A 24 11.873 -7.840 -4.739 1.00 0.00 O ATOM 381 CB THR A 24 13.896 -7.605 -7.442 1.00 0.00 C ATOM 382 OG1 THR A 24 13.907 -7.617 -8.854 1.00 0.00 O ATOM 383 CG2 THR A 24 14.260 -9.014 -6.976 1.00 0.00 C ATOM 0 H THR A 24 13.039 -5.228 -7.708 1.00 0.00 H new ATOM 0 HA THR A 24 11.757 -7.806 -7.211 1.00 0.00 H new ATOM 0 HB THR A 24 14.628 -6.910 -7.032 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.617 -8.214 -9.171 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.231 -9.293 -7.386 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.305 -9.037 -5.887 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.504 -9.718 -7.322 1.00 0.00 H new ATOM 391 N LEU A 25 13.265 -6.080 -4.799 1.00 0.00 N ATOM 392 CA LEU A 25 13.446 -5.958 -3.335 1.00 0.00 C ATOM 393 C LEU A 25 12.218 -5.339 -2.643 1.00 0.00 C ATOM 394 O LEU A 25 11.981 -5.549 -1.454 1.00 0.00 O ATOM 395 CB LEU A 25 14.734 -5.146 -3.056 1.00 0.00 C ATOM 396 CG LEU A 25 16.003 -5.702 -3.737 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.180 -4.780 -3.443 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.361 -7.106 -3.250 1.00 0.00 C ATOM 0 H LEU A 25 13.747 -5.352 -5.326 1.00 0.00 H new ATOM 0 HA LEU A 25 13.550 -6.956 -2.910 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.580 -4.119 -3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.900 -5.112 -1.979 1.00 0.00 H new ATOM 0 HG LEU A 25 15.796 -5.754 -4.806 1.00 0.00 H new ATOM 0 HD11 LEU A 25 18.077 -5.171 -3.923 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.967 -3.783 -3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.339 -4.725 -2.366 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.261 -7.450 -3.760 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.540 -7.084 -2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.538 -7.787 -3.467 1.00 0.00 H new ATOM 410 N GLY A 26 11.428 -4.574 -3.402 1.00 0.00 N ATOM 411 CA GLY A 26 10.171 -3.942 -3.003 1.00 0.00 C ATOM 412 C GLY A 26 8.914 -4.623 -3.552 1.00 0.00 C ATOM 413 O GLY A 26 7.836 -4.050 -3.423 1.00 0.00 O ATOM 0 H GLY A 26 11.666 -4.368 -4.372 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.115 -3.929 -1.914 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.180 -2.904 -3.334 1.00 0.00 H new ATOM 417 N ALA A 27 9.012 -5.813 -4.151 1.00 0.00 N ATOM 418 CA ALA A 27 7.879 -6.527 -4.758 1.00 0.00 C ATOM 419 C ALA A 27 6.673 -6.651 -3.797 1.00 0.00 C ATOM 420 O ALA A 27 6.745 -7.345 -2.779 1.00 0.00 O ATOM 421 CB ALA A 27 8.362 -7.910 -5.217 1.00 0.00 C ATOM 0 H ALA A 27 9.895 -6.318 -4.231 1.00 0.00 H new ATOM 0 HA ALA A 27 7.524 -5.951 -5.612 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.533 -8.453 -5.670 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.161 -7.792 -5.949 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.736 -8.468 -4.359 1.00 0.00 H new ATOM 427 N GLY A 28 5.570 -5.947 -4.094 1.00 0.00 N ATOM 428 CA GLY A 28 4.340 -5.919 -3.279 1.00 0.00 C ATOM 429 C GLY A 28 4.380 -4.932 -2.101 1.00 0.00 C ATOM 430 O GLY A 28 3.331 -4.469 -1.651 1.00 0.00 O ATOM 0 H GLY A 28 5.505 -5.365 -4.929 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.498 -5.664 -3.923 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.153 -6.920 -2.892 1.00 0.00 H new ATOM 434 N LYS A 29 5.581 -4.543 -1.651 1.00 0.00 N ATOM 435 CA LYS A 29 5.809 -3.449 -0.686 1.00 0.00 C ATOM 436 C LYS A 29 5.595 -2.086 -1.345 1.00 0.00 C ATOM 437 O LYS A 29 5.032 -1.188 -0.730 1.00 0.00 O ATOM 438 CB LYS A 29 7.239 -3.548 -0.121 1.00 0.00 C ATOM 439 CG LYS A 29 7.412 -4.722 0.853 1.00 0.00 C ATOM 440 CD LYS A 29 8.804 -5.378 0.793 1.00 0.00 C ATOM 441 CE LYS A 29 9.922 -4.501 1.378 1.00 0.00 C ATOM 442 NZ LYS A 29 11.231 -5.224 1.348 1.00 0.00 N ATOM 0 H LYS A 29 6.446 -4.990 -1.954 1.00 0.00 H new ATOM 0 HA LYS A 29 5.091 -3.547 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.944 -3.658 -0.945 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.489 -2.618 0.390 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.230 -4.370 1.868 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.655 -5.476 0.637 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.775 -6.324 1.334 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.042 -5.612 -0.245 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.999 -3.574 0.809 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.676 -4.226 2.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.948 -4.665 1.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.126 -6.151 1.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.530 -5.360 0.361 1.00 0.00 H new ATOM 456 N ILE A 30 6.036 -1.932 -2.596 1.00 0.00 N ATOM 457 CA ILE A 30 5.974 -0.678 -3.367 1.00 0.00 C ATOM 458 C ILE A 30 5.691 -0.910 -4.861 1.00 0.00 C ATOM 459 O ILE A 30 5.682 -2.041 -5.344 1.00 0.00 O ATOM 460 CB ILE A 30 7.279 0.146 -3.166 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.610 -0.531 -3.561 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.460 0.558 -1.699 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.764 -0.965 -5.019 1.00 0.00 C ATOM 0 H ILE A 30 6.460 -2.697 -3.120 1.00 0.00 H new ATOM 0 HA ILE A 30 5.130 -0.106 -2.981 1.00 0.00 H new ATOM 0 HB ILE A 30 7.111 0.980 -3.847 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.422 0.156 -3.325 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.743 -1.410 -2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.381 1.132 -1.593 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.614 1.169 -1.386 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.515 -0.334 -1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.742 -1.425 -5.160 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.985 -1.685 -5.268 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.675 -0.095 -5.669 1.00 0.00 H new ATOM 475 N ALA A 31 5.474 0.188 -5.588 1.00 0.00 N ATOM 476 CA ALA A 31 5.430 0.231 -7.056 1.00 0.00 C ATOM 477 C ALA A 31 6.386 1.335 -7.553 1.00 0.00 C ATOM 478 O ALA A 31 6.568 2.343 -6.866 1.00 0.00 O ATOM 479 CB ALA A 31 3.988 0.397 -7.548 1.00 0.00 C ATOM 0 H ALA A 31 5.319 1.101 -5.161 1.00 0.00 H new ATOM 0 HA ALA A 31 5.776 -0.712 -7.479 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.976 0.427 -8.638 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.386 -0.443 -7.201 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.574 1.326 -7.155 1.00 0.00 H new ATOM 485 N VAL A 32 7.047 1.143 -8.699 1.00 0.00 N ATOM 486 CA VAL A 32 8.140 2.004 -9.159 1.00 0.00 C ATOM 487 C VAL A 32 8.115 2.340 -10.644 1.00 0.00 C ATOM 488 O VAL A 32 7.707 1.529 -11.477 1.00 0.00 O ATOM 489 CB VAL A 32 9.503 1.388 -8.804 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.950 1.948 -7.459 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.567 -0.147 -8.807 1.00 0.00 C ATOM 0 H VAL A 32 6.836 0.378 -9.339 1.00 0.00 H new ATOM 0 HA VAL A 32 7.987 2.945 -8.631 1.00 0.00 H new ATOM 0 HB VAL A 32 10.184 1.673 -9.606 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.917 1.522 -7.190 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.038 3.032 -7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.215 1.691 -6.696 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.574 -0.470 -8.543 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.857 -0.542 -8.080 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.315 -0.520 -9.800 1.00 0.00 H new ATOM 501 N THR A 33 8.635 3.533 -10.948 1.00 0.00 N ATOM 502 CA THR A 33 8.775 4.089 -12.302 1.00 0.00 C ATOM 503 C THR A 33 10.121 4.818 -12.432 1.00 0.00 C ATOM 504 O THR A 33 10.617 5.376 -11.452 1.00 0.00 O ATOM 505 CB THR A 33 7.608 5.050 -12.610 1.00 0.00 C ATOM 506 OG1 THR A 33 6.366 4.463 -12.263 1.00 0.00 O ATOM 507 CG2 THR A 33 7.499 5.410 -14.092 1.00 0.00 C ATOM 0 H THR A 33 8.985 4.166 -10.229 1.00 0.00 H new ATOM 0 HA THR A 33 8.747 3.273 -13.024 1.00 0.00 H new ATOM 0 HB THR A 33 7.822 5.944 -12.025 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.640 5.090 -12.465 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.659 6.088 -14.241 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.419 5.895 -14.417 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.341 4.503 -14.676 1.00 0.00 H new ATOM 515 N SER A 34 10.723 4.833 -13.622 1.00 0.00 N ATOM 516 CA SER A 34 11.949 5.574 -13.942 1.00 0.00 C ATOM 517 C SER A 34 11.723 6.610 -15.055 1.00 0.00 C ATOM 518 O SER A 34 11.021 6.340 -16.032 1.00 0.00 O ATOM 519 CB SER A 34 13.019 4.568 -14.345 1.00 0.00 C ATOM 520 OG SER A 34 14.212 5.261 -14.640 1.00 0.00 O ATOM 0 H SER A 34 10.359 4.312 -14.420 1.00 0.00 H new ATOM 0 HA SER A 34 12.268 6.134 -13.063 1.00 0.00 H new ATOM 0 HB2 SER A 34 13.188 3.854 -13.539 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.691 3.997 -15.213 1.00 0.00 H new ATOM 0 HG SER A 34 14.855 4.645 -15.050 1.00 0.00 H new ATOM 526 N CYS A 35 12.320 7.799 -14.908 1.00 0.00 N ATOM 527 CA CYS A 35 12.243 8.915 -15.853 1.00 0.00 C ATOM 528 C CYS A 35 13.473 9.841 -15.780 1.00 0.00 C ATOM 529 O CYS A 35 14.430 9.606 -15.036 1.00 0.00 O ATOM 530 CB CYS A 35 10.929 9.671 -15.608 1.00 0.00 C ATOM 531 SG CYS A 35 10.986 10.711 -14.130 1.00 0.00 S ATOM 0 H CYS A 35 12.893 8.017 -14.093 1.00 0.00 H new ATOM 0 HA CYS A 35 12.249 8.520 -16.869 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.705 10.292 -16.475 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.115 8.953 -15.511 1.00 0.00 H new ATOM 0 HG CYS A 35 10.478 10.063 -13.124 1.00 0.00 H new ATOM 537 N GLY A 36 13.476 10.915 -16.564 1.00 0.00 N ATOM 538 CA GLY A 36 14.467 11.991 -16.456 1.00 0.00 C ATOM 539 C GLY A 36 13.908 13.328 -16.897 1.00 0.00 C ATOM 540 O GLY A 36 12.885 13.364 -17.569 1.00 0.00 O ATOM 0 H GLY A 36 12.786 11.068 -17.300 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.810 12.065 -15.424 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.337 11.744 -17.064 1.00 0.00 H new ATOM 544 N LEU A 37 14.569 14.442 -16.565 1.00 0.00 N ATOM 545 CA LEU A 37 14.116 15.769 -17.032 1.00 0.00 C ATOM 546 C LEU A 37 14.175 15.928 -18.567 1.00 0.00 C ATOM 547 O LEU A 37 13.550 16.818 -19.139 1.00 0.00 O ATOM 548 CB LEU A 37 14.772 16.931 -16.276 1.00 0.00 C ATOM 549 CG LEU A 37 16.310 16.935 -16.266 1.00 0.00 C ATOM 550 CD1 LEU A 37 16.849 18.362 -16.210 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.823 16.211 -15.020 1.00 0.00 C ATOM 0 H LEU A 37 15.407 14.459 -15.984 1.00 0.00 H new ATOM 0 HA LEU A 37 13.057 15.820 -16.778 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.427 17.867 -16.715 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.420 16.914 -15.245 1.00 0.00 H new ATOM 0 HG LEU A 37 16.646 16.440 -17.177 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.939 18.339 -16.204 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.503 18.916 -17.082 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.491 18.851 -15.304 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.913 16.217 -15.019 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.456 16.718 -14.128 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.466 15.181 -15.025 1.00 0.00 H new ATOM 563 N GLU A 38 14.898 15.017 -19.217 1.00 0.00 N ATOM 564 CA GLU A 38 14.945 14.781 -20.661 1.00 0.00 C ATOM 565 C GLU A 38 15.257 13.288 -20.900 1.00 0.00 C ATOM 566 O GLU A 38 15.646 12.574 -19.972 1.00 0.00 O ATOM 567 CB GLU A 38 15.918 15.736 -21.381 1.00 0.00 C ATOM 568 CG GLU A 38 17.369 15.689 -20.893 1.00 0.00 C ATOM 569 CD GLU A 38 18.257 16.605 -21.756 1.00 0.00 C ATOM 570 OE1 GLU A 38 18.380 17.814 -21.439 1.00 0.00 O ATOM 571 OE2 GLU A 38 18.836 16.131 -22.763 1.00 0.00 O ATOM 0 H GLU A 38 15.511 14.377 -18.712 1.00 0.00 H new ATOM 0 HA GLU A 38 13.974 15.007 -21.103 1.00 0.00 H new ATOM 0 HB2 GLU A 38 15.904 15.506 -22.446 1.00 0.00 H new ATOM 0 HB3 GLU A 38 15.548 16.755 -21.270 1.00 0.00 H new ATOM 0 HG2 GLU A 38 17.419 16.002 -19.850 1.00 0.00 H new ATOM 0 HG3 GLU A 38 17.741 14.665 -20.937 1.00 0.00 H new ATOM 578 N SER A 39 15.046 12.800 -22.126 1.00 0.00 N ATOM 579 CA SER A 39 15.090 11.370 -22.465 1.00 0.00 C ATOM 580 C SER A 39 16.125 11.047 -23.552 1.00 0.00 C ATOM 581 O SER A 39 16.397 11.871 -24.429 1.00 0.00 O ATOM 582 CB SER A 39 13.693 10.929 -22.912 1.00 0.00 C ATOM 583 OG SER A 39 13.667 9.523 -23.048 1.00 0.00 O ATOM 0 H SER A 39 14.836 13.396 -22.927 1.00 0.00 H new ATOM 0 HA SER A 39 15.400 10.822 -21.575 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.948 11.249 -22.184 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.436 11.402 -23.860 1.00 0.00 H new ATOM 0 HG SER A 39 12.773 9.238 -23.332 1.00 0.00 H new ATOM 589 N SER A 40 16.685 9.833 -23.507 1.00 0.00 N ATOM 590 CA SER A 40 17.592 9.282 -24.523 1.00 0.00 C ATOM 591 C SER A 40 17.267 7.805 -24.841 1.00 0.00 C ATOM 592 O SER A 40 16.343 7.530 -25.607 1.00 0.00 O ATOM 593 CB SER A 40 19.056 9.545 -24.125 1.00 0.00 C ATOM 594 OG SER A 40 19.380 8.913 -22.897 1.00 0.00 O ATOM 0 H SER A 40 16.515 9.185 -22.738 1.00 0.00 H new ATOM 0 HA SER A 40 17.436 9.802 -25.468 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.719 9.180 -24.910 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.224 10.619 -24.039 1.00 0.00 H new ATOM 0 HG SER A 40 18.839 9.300 -22.177 1.00 0.00 H new ATOM 600 N ARG A 41 18.010 6.861 -24.247 1.00 0.00 N ATOM 601 CA ARG A 41 17.832 5.396 -24.306 1.00 0.00 C ATOM 602 C ARG A 41 18.486 4.746 -23.082 1.00 0.00 C ATOM 603 O ARG A 41 19.476 5.285 -22.589 1.00 0.00 O ATOM 604 CB ARG A 41 18.402 4.828 -25.628 1.00 0.00 C ATOM 605 CG ARG A 41 19.939 4.823 -25.807 1.00 0.00 C ATOM 606 CD ARG A 41 20.606 6.207 -25.770 1.00 0.00 C ATOM 607 NE ARG A 41 22.025 6.134 -26.177 1.00 0.00 N ATOM 608 CZ ARG A 41 22.520 6.198 -27.402 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.765 6.321 -28.459 1.00 0.00 N ATOM 610 NH2 ARG A 41 23.808 6.144 -27.593 1.00 0.00 N ATOM 0 H ARG A 41 18.811 7.116 -23.669 1.00 0.00 H new ATOM 0 HA ARG A 41 16.767 5.163 -24.288 1.00 0.00 H new ATOM 0 HB2 ARG A 41 18.049 3.802 -25.731 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.971 5.398 -26.451 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.378 4.205 -25.024 1.00 0.00 H new ATOM 0 HG3 ARG A 41 20.176 4.348 -26.759 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.071 6.888 -26.432 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.536 6.620 -24.764 1.00 0.00 H new ATOM 0 HE ARG A 41 22.703 6.021 -25.424 1.00 0.00 H new ATOM 0 HH11 ARG A 41 20.751 6.372 -28.359 1.00 0.00 H new ATOM 0 HH12 ARG A 41 22.189 6.367 -29.386 1.00 0.00 H new ATOM 0 HH21 ARG A 41 24.438 6.052 -26.796 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.186 6.194 -28.539 1.00 0.00 H new ATOM 624 N VAL A 42 18.013 3.582 -22.615 1.00 0.00 N ATOM 625 CA VAL A 42 18.736 2.842 -21.549 1.00 0.00 C ATOM 626 C VAL A 42 20.147 2.512 -22.036 1.00 0.00 C ATOM 627 O VAL A 42 20.316 2.019 -23.153 1.00 0.00 O ATOM 628 CB VAL A 42 18.063 1.537 -21.074 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.729 1.034 -19.781 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.589 1.708 -20.744 1.00 0.00 C ATOM 0 H VAL A 42 17.157 3.135 -22.942 1.00 0.00 H new ATOM 0 HA VAL A 42 18.736 3.509 -20.687 1.00 0.00 H new ATOM 0 HB VAL A 42 18.175 0.838 -21.903 1.00 0.00 H new ATOM 0 HG11 VAL A 42 18.245 0.113 -19.457 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.786 0.842 -19.967 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.629 1.790 -19.002 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.176 0.754 -20.417 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.477 2.444 -19.948 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.055 2.049 -21.631 1.00 0.00 H new ATOM 640 N HIS A 43 21.160 2.763 -21.204 1.00 0.00 N ATOM 641 CA HIS A 43 22.538 2.379 -21.506 1.00 0.00 C ATOM 642 C HIS A 43 22.621 0.850 -21.519 1.00 0.00 C ATOM 643 O HIS A 43 22.233 0.228 -20.528 1.00 0.00 O ATOM 644 CB HIS A 43 23.486 3.015 -20.484 1.00 0.00 C ATOM 645 CG HIS A 43 24.890 3.109 -20.998 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.797 2.053 -21.104 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.468 4.247 -21.468 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.918 2.593 -21.620 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.741 3.904 -21.856 1.00 0.00 N ATOM 0 H HIS A 43 21.048 3.236 -20.307 1.00 0.00 H new ATOM 0 HA HIS A 43 22.844 2.743 -22.487 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.127 4.012 -20.229 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.475 2.427 -19.566 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.016 5.226 -21.525 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.830 2.049 -21.816 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.434 4.537 -22.255 1.00 0.00 H new ATOM 657 N PRO A 44 23.094 0.202 -22.593 1.00 0.00 N ATOM 658 CA PRO A 44 22.963 -1.247 -22.709 1.00 0.00 C ATOM 659 C PRO A 44 23.823 -1.986 -21.668 1.00 0.00 C ATOM 660 O PRO A 44 23.447 -3.061 -21.197 1.00 0.00 O ATOM 661 CB PRO A 44 23.361 -1.553 -24.157 1.00 0.00 C ATOM 662 CG PRO A 44 24.346 -0.438 -24.506 1.00 0.00 C ATOM 663 CD PRO A 44 23.766 0.761 -23.757 1.00 0.00 C ATOM 0 HA PRO A 44 21.952 -1.596 -22.499 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.822 -2.537 -24.246 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.496 -1.545 -24.820 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.358 -0.672 -24.176 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.394 -0.261 -25.580 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.551 1.456 -23.461 1.00 0.00 H new ATOM 0 HD3 PRO A 44 23.069 1.316 -24.384 1.00 0.00 H new ATOM 671 N THR A 45 24.920 -1.369 -21.212 1.00 0.00 N ATOM 672 CA THR A 45 25.744 -1.897 -20.113 1.00 0.00 C ATOM 673 C THR A 45 25.019 -1.837 -18.768 1.00 0.00 C ATOM 674 O THR A 45 25.217 -2.723 -17.947 1.00 0.00 O ATOM 675 CB THR A 45 27.102 -1.180 -20.051 1.00 0.00 C ATOM 676 OG1 THR A 45 27.724 -1.254 -21.320 1.00 0.00 O ATOM 677 CG2 THR A 45 28.050 -1.833 -19.045 1.00 0.00 C ATOM 0 H THR A 45 25.263 -0.488 -21.594 1.00 0.00 H new ATOM 0 HA THR A 45 25.927 -2.951 -20.324 1.00 0.00 H new ATOM 0 HB THR A 45 26.910 -0.151 -19.747 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.590 -0.797 -21.287 1.00 0.00 H new ATOM 0 HG21 THR A 45 28.997 -1.294 -19.035 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.604 -1.802 -18.051 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.226 -2.870 -19.331 1.00 0.00 H new ATOM 685 N ALA A 46 24.098 -0.891 -18.541 1.00 0.00 N ATOM 686 CA ALA A 46 23.283 -0.865 -17.318 1.00 0.00 C ATOM 687 C ALA A 46 22.437 -2.140 -17.179 1.00 0.00 C ATOM 688 O ALA A 46 22.460 -2.791 -16.138 1.00 0.00 O ATOM 689 CB ALA A 46 22.393 0.384 -17.327 1.00 0.00 C ATOM 0 H ALA A 46 23.898 -0.131 -19.191 1.00 0.00 H new ATOM 0 HA ALA A 46 23.948 -0.827 -16.455 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.787 0.406 -16.421 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.018 1.276 -17.367 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.740 0.359 -18.199 1.00 0.00 H new ATOM 695 N ILE A 47 21.770 -2.553 -18.262 1.00 0.00 N ATOM 696 CA ILE A 47 21.020 -3.820 -18.329 1.00 0.00 C ATOM 697 C ILE A 47 21.962 -5.004 -18.063 1.00 0.00 C ATOM 698 O ILE A 47 21.661 -5.836 -17.210 1.00 0.00 O ATOM 699 CB ILE A 47 20.313 -3.928 -19.698 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.233 -2.831 -19.870 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.663 -5.305 -19.907 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.306 -2.140 -21.233 1.00 0.00 C ATOM 0 H ILE A 47 21.733 -2.014 -19.127 1.00 0.00 H new ATOM 0 HA ILE A 47 20.251 -3.842 -17.556 1.00 0.00 H new ATOM 0 HB ILE A 47 21.091 -3.790 -20.449 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.246 -3.276 -19.745 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.349 -2.086 -19.083 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.178 -5.334 -20.883 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.428 -6.080 -19.859 1.00 0.00 H new ATOM 0 HG23 ILE A 47 18.921 -5.479 -19.128 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.526 -1.381 -21.298 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.282 -1.669 -21.350 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.162 -2.877 -22.023 1.00 0.00 H new ATOM 714 N ALA A 48 23.143 -5.031 -18.688 1.00 0.00 N ATOM 715 CA ALA A 48 24.121 -6.104 -18.474 1.00 0.00 C ATOM 716 C ALA A 48 24.612 -6.197 -17.017 1.00 0.00 C ATOM 717 O ALA A 48 24.820 -7.287 -16.485 1.00 0.00 O ATOM 718 CB ALA A 48 25.298 -5.897 -19.428 1.00 0.00 C ATOM 0 H ALA A 48 23.447 -4.317 -19.351 1.00 0.00 H new ATOM 0 HA ALA A 48 23.625 -7.052 -18.681 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.032 -6.689 -19.278 1.00 0.00 H new ATOM 0 HB2 ALA A 48 24.941 -5.924 -20.458 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.762 -4.931 -19.230 1.00 0.00 H new ATOM 724 N MET A 49 24.750 -5.051 -16.347 1.00 0.00 N ATOM 725 CA MET A 49 25.170 -4.952 -14.947 1.00 0.00 C ATOM 726 C MET A 49 24.046 -5.340 -13.979 1.00 0.00 C ATOM 727 O MET A 49 24.339 -5.858 -12.906 1.00 0.00 O ATOM 728 CB MET A 49 25.726 -3.550 -14.671 1.00 0.00 C ATOM 729 CG MET A 49 26.944 -3.226 -15.545 1.00 0.00 C ATOM 730 SD MET A 49 28.541 -3.631 -14.800 1.00 0.00 S ATOM 731 CE MET A 49 28.846 -5.255 -15.531 1.00 0.00 C ATOM 0 H MET A 49 24.568 -4.143 -16.774 1.00 0.00 H new ATOM 0 HA MET A 49 25.968 -5.673 -14.772 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.946 -2.810 -14.850 1.00 0.00 H new ATOM 0 HB3 MET A 49 26.004 -3.472 -13.620 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.851 -3.766 -16.487 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.930 -2.163 -15.784 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.806 -5.636 -15.184 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.054 -5.942 -15.234 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.862 -5.168 -16.617 1.00 0.00 H new ATOM 741 N MET A 50 22.774 -5.158 -14.349 1.00 0.00 N ATOM 742 CA MET A 50 21.636 -5.702 -13.589 1.00 0.00 C ATOM 743 C MET A 50 21.498 -7.220 -13.796 1.00 0.00 C ATOM 744 O MET A 50 21.184 -7.942 -12.849 1.00 0.00 O ATOM 745 CB MET A 50 20.340 -4.978 -13.982 1.00 0.00 C ATOM 746 CG MET A 50 20.328 -3.492 -13.588 1.00 0.00 C ATOM 747 SD MET A 50 20.663 -3.106 -11.846 1.00 0.00 S ATOM 748 CE MET A 50 19.426 -4.148 -11.030 1.00 0.00 C ATOM 0 H MET A 50 22.502 -4.632 -15.180 1.00 0.00 H new ATOM 0 HA MET A 50 21.824 -5.531 -12.529 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.198 -5.062 -15.059 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.495 -5.479 -13.509 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.066 -2.972 -14.199 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.353 -3.080 -13.846 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.029 -3.627 -10.159 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.615 -4.362 -11.726 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.889 -5.083 -10.714 1.00 0.00 H new ATOM 758 N GLU A 51 21.836 -7.731 -14.986 1.00 0.00 N ATOM 759 CA GLU A 51 21.831 -9.176 -15.257 1.00 0.00 C ATOM 760 C GLU A 51 22.885 -9.945 -14.436 1.00 0.00 C ATOM 761 O GLU A 51 22.681 -11.125 -14.160 1.00 0.00 O ATOM 762 CB GLU A 51 22.005 -9.455 -16.758 1.00 0.00 C ATOM 763 CG GLU A 51 20.739 -9.157 -17.568 1.00 0.00 C ATOM 764 CD GLU A 51 20.940 -9.549 -19.046 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.587 -8.786 -19.805 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.460 -10.634 -19.458 1.00 0.00 O ATOM 0 H GLU A 51 22.119 -7.161 -15.783 1.00 0.00 H new ATOM 0 HA GLU A 51 20.855 -9.545 -14.940 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.827 -8.851 -17.142 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.284 -10.499 -16.899 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.895 -9.707 -17.151 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.495 -8.097 -17.496 1.00 0.00 H new ATOM 773 N GLU A 52 23.952 -9.294 -13.938 1.00 0.00 N ATOM 774 CA GLU A 52 24.888 -9.931 -12.981 1.00 0.00 C ATOM 775 C GLU A 52 24.213 -10.290 -11.641 1.00 0.00 C ATOM 776 O GLU A 52 24.632 -11.229 -10.962 1.00 0.00 O ATOM 777 CB GLU A 52 26.085 -9.023 -12.671 1.00 0.00 C ATOM 778 CG GLU A 52 26.889 -8.575 -13.895 1.00 0.00 C ATOM 779 CD GLU A 52 28.301 -8.129 -13.490 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.435 -7.212 -12.644 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.290 -8.672 -14.034 1.00 0.00 O ATOM 0 H GLU A 52 24.191 -8.332 -14.178 1.00 0.00 H new ATOM 0 HA GLU A 52 25.222 -10.844 -13.473 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.725 -8.138 -12.147 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.753 -9.548 -11.988 1.00 0.00 H new ATOM 0 HG2 GLU A 52 26.954 -9.393 -14.612 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.373 -7.754 -14.393 1.00 0.00 H new ATOM 788 N VAL A 53 23.149 -9.560 -11.279 1.00 0.00 N ATOM 789 CA VAL A 53 22.309 -9.805 -10.091 1.00 0.00 C ATOM 790 C VAL A 53 21.180 -10.815 -10.399 1.00 0.00 C ATOM 791 O VAL A 53 20.440 -11.219 -9.503 1.00 0.00 O ATOM 792 CB VAL A 53 21.712 -8.477 -9.552 1.00 0.00 C ATOM 793 CG1 VAL A 53 21.372 -8.574 -8.060 1.00 0.00 C ATOM 794 CG2 VAL A 53 22.646 -7.260 -9.698 1.00 0.00 C ATOM 0 H VAL A 53 22.836 -8.755 -11.821 1.00 0.00 H new ATOM 0 HA VAL A 53 22.948 -10.236 -9.321 1.00 0.00 H new ATOM 0 HB VAL A 53 20.824 -8.328 -10.166 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.957 -7.626 -7.719 1.00 0.00 H new ATOM 0 HG12 VAL A 53 20.641 -9.367 -7.904 1.00 0.00 H new ATOM 0 HG13 VAL A 53 22.276 -8.798 -7.495 1.00 0.00 H new ATOM 0 HG21 VAL A 53 22.154 -6.374 -9.298 1.00 0.00 H new ATOM 0 HG22 VAL A 53 23.569 -7.442 -9.148 1.00 0.00 H new ATOM 0 HG23 VAL A 53 22.876 -7.102 -10.752 1.00 0.00 H new ATOM 804 N GLY A 54 21.014 -11.213 -11.666 1.00 0.00 N ATOM 805 CA GLY A 54 19.863 -11.986 -12.148 1.00 0.00 C ATOM 806 C GLY A 54 18.569 -11.163 -12.227 1.00 0.00 C ATOM 807 O GLY A 54 17.481 -11.737 -12.303 1.00 0.00 O ATOM 0 H GLY A 54 21.690 -11.002 -12.400 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.091 -12.387 -13.136 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.704 -12.838 -11.487 1.00 0.00 H new ATOM 811 N ILE A 55 18.674 -9.826 -12.188 1.00 0.00 N ATOM 812 CA ILE A 55 17.549 -8.881 -12.243 1.00 0.00 C ATOM 813 C ILE A 55 17.353 -8.402 -13.685 1.00 0.00 C ATOM 814 O ILE A 55 18.305 -7.996 -14.353 1.00 0.00 O ATOM 815 CB ILE A 55 17.781 -7.719 -11.247 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.689 -8.241 -9.791 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.782 -6.572 -11.456 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.886 -7.176 -8.698 1.00 0.00 C ATOM 0 H ILE A 55 19.577 -9.357 -12.115 1.00 0.00 H new ATOM 0 HA ILE A 55 16.626 -9.374 -11.938 1.00 0.00 H new ATOM 0 HB ILE A 55 18.780 -7.324 -11.433 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.714 -8.707 -9.650 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.437 -9.021 -9.654 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.982 -5.779 -10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.886 -6.178 -12.467 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.767 -6.943 -11.314 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.803 -7.642 -7.716 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.873 -6.725 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.122 -6.405 -8.799 1.00 0.00 H new ATOM 830 N ASP A 56 16.107 -8.421 -14.162 1.00 0.00 N ATOM 831 CA ASP A 56 15.764 -8.080 -15.548 1.00 0.00 C ATOM 832 C ASP A 56 15.221 -6.648 -15.706 1.00 0.00 C ATOM 833 O ASP A 56 14.200 -6.285 -15.113 1.00 0.00 O ATOM 834 CB ASP A 56 14.771 -9.115 -16.101 1.00 0.00 C ATOM 835 CG ASP A 56 14.346 -8.794 -17.547 1.00 0.00 C ATOM 836 OD1 ASP A 56 15.179 -8.261 -18.318 1.00 0.00 O ATOM 837 OD2 ASP A 56 13.175 -9.070 -17.906 1.00 0.00 O ATOM 0 H ASP A 56 15.299 -8.675 -13.594 1.00 0.00 H new ATOM 0 HA ASP A 56 16.686 -8.110 -16.129 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.224 -10.106 -16.068 1.00 0.00 H new ATOM 0 HB3 ASP A 56 13.888 -9.147 -15.463 1.00 0.00 H new ATOM 842 N ILE A 57 15.881 -5.855 -16.559 1.00 0.00 N ATOM 843 CA ILE A 57 15.415 -4.536 -17.023 1.00 0.00 C ATOM 844 C ILE A 57 15.467 -4.366 -18.558 1.00 0.00 C ATOM 845 O ILE A 57 15.358 -3.244 -19.046 1.00 0.00 O ATOM 846 CB ILE A 57 16.136 -3.378 -16.291 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.657 -3.332 -16.542 1.00 0.00 C ATOM 848 CG2 ILE A 57 15.844 -3.369 -14.779 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.215 -1.901 -16.482 1.00 0.00 C ATOM 0 H ILE A 57 16.781 -6.119 -16.959 1.00 0.00 H new ATOM 0 HA ILE A 57 14.359 -4.488 -16.757 1.00 0.00 H new ATOM 0 HB ILE A 57 15.716 -2.473 -16.731 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.164 -3.949 -15.800 1.00 0.00 H new ATOM 0 HG13 ILE A 57 17.875 -3.764 -17.519 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.373 -2.538 -14.311 1.00 0.00 H new ATOM 0 HG22 ILE A 57 14.772 -3.255 -14.616 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.180 -4.307 -14.338 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.289 -1.921 -16.665 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.729 -1.289 -17.242 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.023 -1.477 -15.497 1.00 0.00 H new ATOM 861 N SER A 58 15.635 -5.435 -19.350 1.00 0.00 N ATOM 862 CA SER A 58 15.844 -5.312 -20.811 1.00 0.00 C ATOM 863 C SER A 58 14.650 -4.703 -21.566 1.00 0.00 C ATOM 864 O SER A 58 14.832 -4.093 -22.623 1.00 0.00 O ATOM 865 CB SER A 58 16.233 -6.663 -21.426 1.00 0.00 C ATOM 866 OG SER A 58 15.113 -7.533 -21.522 1.00 0.00 O ATOM 0 H SER A 58 15.631 -6.396 -19.009 1.00 0.00 H new ATOM 0 HA SER A 58 16.668 -4.608 -20.929 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.658 -6.504 -22.417 1.00 0.00 H new ATOM 0 HB3 SER A 58 17.008 -7.131 -20.819 1.00 0.00 H new ATOM 0 HG SER A 58 14.914 -7.909 -20.639 1.00 0.00 H new ATOM 872 N GLY A 59 13.443 -4.809 -20.999 1.00 0.00 N ATOM 873 CA GLY A 59 12.213 -4.193 -21.511 1.00 0.00 C ATOM 874 C GLY A 59 12.046 -2.694 -21.204 1.00 0.00 C ATOM 875 O GLY A 59 11.025 -2.120 -21.586 1.00 0.00 O ATOM 0 H GLY A 59 13.290 -5.343 -20.144 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.181 -4.331 -22.592 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.359 -4.728 -21.096 1.00 0.00 H new ATOM 879 N GLN A 60 13.000 -2.044 -20.521 1.00 0.00 N ATOM 880 CA GLN A 60 12.957 -0.604 -20.261 1.00 0.00 C ATOM 881 C GLN A 60 13.288 0.212 -21.523 1.00 0.00 C ATOM 882 O GLN A 60 13.957 -0.246 -22.452 1.00 0.00 O ATOM 883 CB GLN A 60 13.920 -0.223 -19.125 1.00 0.00 C ATOM 884 CG GLN A 60 13.409 -0.560 -17.718 1.00 0.00 C ATOM 885 CD GLN A 60 14.444 -0.203 -16.647 1.00 0.00 C ATOM 886 OE1 GLN A 60 15.608 0.032 -16.918 1.00 0.00 O ATOM 887 NE2 GLN A 60 14.092 -0.204 -15.384 1.00 0.00 N ATOM 0 H GLN A 60 13.823 -2.506 -20.134 1.00 0.00 H new ATOM 0 HA GLN A 60 11.938 -0.363 -19.958 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.870 -0.733 -19.285 1.00 0.00 H new ATOM 0 HB3 GLN A 60 14.120 0.847 -19.179 1.00 0.00 H new ATOM 0 HG2 GLN A 60 12.483 -0.018 -17.526 1.00 0.00 H new ATOM 0 HG3 GLN A 60 13.174 -1.623 -17.659 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.125 -0.397 -15.124 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.785 -0.012 -14.661 1.00 0.00 H new ATOM 896 N THR A 61 12.851 1.466 -21.499 1.00 0.00 N ATOM 897 CA THR A 61 13.093 2.540 -22.454 1.00 0.00 C ATOM 898 C THR A 61 13.181 3.817 -21.618 1.00 0.00 C ATOM 899 O THR A 61 12.808 3.837 -20.435 1.00 0.00 O ATOM 900 CB THR A 61 11.973 2.662 -23.509 1.00 0.00 C ATOM 901 OG1 THR A 61 10.696 2.713 -22.899 1.00 0.00 O ATOM 902 CG2 THR A 61 11.973 1.491 -24.492 1.00 0.00 C ATOM 0 H THR A 61 12.259 1.787 -20.733 1.00 0.00 H new ATOM 0 HA THR A 61 14.004 2.346 -23.020 1.00 0.00 H new ATOM 0 HB THR A 61 12.175 3.588 -24.048 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.006 2.792 -23.590 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.167 1.622 -25.214 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.928 1.456 -25.016 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.824 0.559 -23.947 1.00 0.00 H new ATOM 910 N SER A 62 13.728 4.883 -22.189 1.00 0.00 N ATOM 911 CA SER A 62 13.780 6.168 -21.497 1.00 0.00 C ATOM 912 C SER A 62 12.494 6.980 -21.693 1.00 0.00 C ATOM 913 O SER A 62 11.901 6.952 -22.774 1.00 0.00 O ATOM 914 CB SER A 62 14.986 6.941 -21.980 1.00 0.00 C ATOM 915 OG SER A 62 16.174 6.206 -21.745 1.00 0.00 O ATOM 0 H SER A 62 14.139 4.886 -23.122 1.00 0.00 H new ATOM 0 HA SER A 62 13.869 5.981 -20.427 1.00 0.00 H new ATOM 0 HB2 SER A 62 14.887 7.153 -23.045 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.038 7.902 -21.468 1.00 0.00 H new ATOM 0 HG SER A 62 16.452 6.324 -20.813 1.00 0.00 H new ATOM 921 N ASP A 63 12.080 7.729 -20.665 1.00 0.00 N ATOM 922 CA ASP A 63 10.900 8.613 -20.697 1.00 0.00 C ATOM 923 C ASP A 63 11.091 9.955 -19.942 1.00 0.00 C ATOM 924 O ASP A 63 11.763 9.990 -18.906 1.00 0.00 O ATOM 925 CB ASP A 63 9.668 7.877 -20.153 1.00 0.00 C ATOM 926 CG ASP A 63 9.086 6.872 -21.158 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.524 7.311 -22.191 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.129 5.647 -20.889 1.00 0.00 O ATOM 0 H ASP A 63 12.563 7.741 -19.767 1.00 0.00 H new ATOM 0 HA ASP A 63 10.754 8.873 -21.745 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.938 7.353 -19.236 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.902 8.606 -19.889 1.00 0.00 H new ATOM 933 N PRO A 64 10.488 11.069 -20.420 1.00 0.00 N ATOM 934 CA PRO A 64 10.672 12.408 -19.854 1.00 0.00 C ATOM 935 C PRO A 64 9.714 12.731 -18.691 1.00 0.00 C ATOM 936 O PRO A 64 8.555 12.314 -18.674 1.00 0.00 O ATOM 937 CB PRO A 64 10.461 13.360 -21.036 1.00 0.00 C ATOM 938 CG PRO A 64 9.380 12.646 -21.849 1.00 0.00 C ATOM 939 CD PRO A 64 9.734 11.170 -21.668 1.00 0.00 C ATOM 0 HA PRO A 64 11.660 12.501 -19.404 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.136 14.348 -20.708 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.376 13.500 -21.612 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.380 12.870 -21.476 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.403 12.941 -22.898 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.833 10.558 -21.626 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.326 10.808 -22.508 1.00 0.00 H new ATOM 947 N ILE A 65 10.176 13.561 -17.750 1.00 0.00 N ATOM 948 CA ILE A 65 9.463 13.995 -16.535 1.00 0.00 C ATOM 949 C ILE A 65 8.129 14.690 -16.860 1.00 0.00 C ATOM 950 O ILE A 65 7.136 14.503 -16.166 1.00 0.00 O ATOM 951 CB ILE A 65 10.417 14.902 -15.711 1.00 0.00 C ATOM 952 CG1 ILE A 65 9.995 14.953 -14.239 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.566 16.332 -16.272 1.00 0.00 C ATOM 954 CD1 ILE A 65 10.952 15.763 -13.359 1.00 0.00 C ATOM 0 H ILE A 65 11.107 13.972 -17.815 1.00 0.00 H new ATOM 0 HA ILE A 65 9.191 13.123 -15.941 1.00 0.00 H new ATOM 0 HB ILE A 65 11.399 14.437 -15.794 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.997 15.385 -14.170 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.930 13.936 -13.852 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.248 16.901 -15.641 1.00 0.00 H new ATOM 0 HG22 ILE A 65 10.964 16.286 -17.286 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.592 16.821 -16.286 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.593 15.757 -12.330 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.947 15.319 -13.399 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.998 16.790 -13.721 1.00 0.00 H new ATOM 966 N GLU A 66 8.098 15.443 -17.966 1.00 0.00 N ATOM 967 CA GLU A 66 6.938 16.251 -18.388 1.00 0.00 C ATOM 968 C GLU A 66 5.683 15.421 -18.727 1.00 0.00 C ATOM 969 O GLU A 66 4.568 15.941 -18.651 1.00 0.00 O ATOM 970 CB GLU A 66 7.320 17.126 -19.593 1.00 0.00 C ATOM 971 CG GLU A 66 8.426 18.140 -19.275 1.00 0.00 C ATOM 972 CD GLU A 66 8.644 19.099 -20.462 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.408 18.755 -21.397 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.061 20.212 -20.470 1.00 0.00 O ATOM 0 H GLU A 66 8.889 15.512 -18.606 1.00 0.00 H new ATOM 0 HA GLU A 66 6.674 16.869 -17.530 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.648 16.484 -20.411 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.436 17.660 -19.942 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.159 18.710 -18.385 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.354 17.615 -19.050 1.00 0.00 H new ATOM 981 N ASN A 67 5.836 14.133 -19.078 1.00 0.00 N ATOM 982 CA ASN A 67 4.703 13.232 -19.356 1.00 0.00 C ATOM 983 C ASN A 67 4.121 12.572 -18.081 1.00 0.00 C ATOM 984 O ASN A 67 3.042 11.979 -18.133 1.00 0.00 O ATOM 985 CB ASN A 67 5.105 12.212 -20.451 1.00 0.00 C ATOM 986 CG ASN A 67 5.325 10.800 -19.924 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.545 9.889 -20.159 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.368 10.575 -19.162 1.00 0.00 N ATOM 0 H ASN A 67 6.748 13.687 -19.177 1.00 0.00 H new ATOM 0 HA ASN A 67 3.878 13.830 -19.742 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.328 12.188 -21.215 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.019 12.555 -20.936 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.523 9.646 -18.771 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.024 11.329 -18.960 1.00 0.00 H new ATOM 995 N PHE A 68 4.834 12.651 -16.953 1.00 0.00 N ATOM 996 CA PHE A 68 4.548 11.918 -15.716 1.00 0.00 C ATOM 997 C PHE A 68 3.834 12.767 -14.643 1.00 0.00 C ATOM 998 O PHE A 68 3.658 13.978 -14.793 1.00 0.00 O ATOM 999 CB PHE A 68 5.863 11.290 -15.220 1.00 0.00 C ATOM 1000 CG PHE A 68 6.346 10.083 -16.004 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.496 8.979 -16.223 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.666 10.044 -16.484 1.00 0.00 C ATOM 1003 CE1 PHE A 68 5.960 7.855 -16.928 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.126 8.918 -17.194 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.275 7.824 -17.415 1.00 0.00 C ATOM 0 H PHE A 68 5.656 13.249 -16.874 1.00 0.00 H new ATOM 0 HA PHE A 68 3.827 11.129 -15.929 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.641 12.053 -15.244 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.735 10.997 -14.178 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.484 8.997 -15.847 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.329 10.879 -16.308 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.303 7.014 -17.095 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.138 8.896 -17.570 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.631 6.961 -17.958 1.00 0.00 H new ATOM 1015 N ASN A 69 3.407 12.114 -13.556 1.00 0.00 N ATOM 1016 CA ASN A 69 2.527 12.679 -12.521 1.00 0.00 C ATOM 1017 C ASN A 69 3.104 12.549 -11.097 1.00 0.00 C ATOM 1018 O ASN A 69 2.797 11.593 -10.384 1.00 0.00 O ATOM 1019 CB ASN A 69 1.116 12.058 -12.676 1.00 0.00 C ATOM 1020 CG ASN A 69 1.068 10.543 -12.885 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.659 10.055 -13.929 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.461 9.749 -11.915 1.00 0.00 N ATOM 0 H ASN A 69 3.671 11.148 -13.364 1.00 0.00 H new ATOM 0 HA ASN A 69 2.451 13.756 -12.670 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.535 12.300 -11.786 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.621 12.537 -13.521 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.423 8.737 -12.037 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.804 10.144 -11.040 1.00 0.00 H new ATOM 1029 N ALA A 70 3.892 13.534 -10.644 1.00 0.00 N ATOM 1030 CA ALA A 70 4.499 13.512 -9.306 1.00 0.00 C ATOM 1031 C ALA A 70 3.477 13.305 -8.172 1.00 0.00 C ATOM 1032 O ALA A 70 3.790 12.665 -7.170 1.00 0.00 O ATOM 1033 CB ALA A 70 5.249 14.816 -9.044 1.00 0.00 C ATOM 0 H ALA A 70 4.125 14.363 -11.190 1.00 0.00 H new ATOM 0 HA ALA A 70 5.178 12.660 -9.303 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.694 14.786 -8.049 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.035 14.940 -9.789 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.555 15.654 -9.106 1.00 0.00 H new ATOM 1039 N ASP A 71 2.251 13.808 -8.352 1.00 0.00 N ATOM 1040 CA ASP A 71 1.146 13.709 -7.390 1.00 0.00 C ATOM 1041 C ASP A 71 0.784 12.259 -6.998 1.00 0.00 C ATOM 1042 O ASP A 71 0.249 12.036 -5.909 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.079 14.394 -8.006 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.242 14.504 -7.008 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.112 15.243 -6.001 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.307 13.882 -7.245 1.00 0.00 O ATOM 0 H ASP A 71 1.991 14.312 -9.200 1.00 0.00 H new ATOM 0 HA ASP A 71 1.468 14.195 -6.469 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.198 15.390 -8.350 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.405 13.833 -8.882 1.00 0.00 H new ATOM 1051 N ASP A 72 1.096 11.272 -7.851 1.00 0.00 N ATOM 1052 CA ASP A 72 0.887 9.842 -7.572 1.00 0.00 C ATOM 1053 C ASP A 72 2.195 9.068 -7.305 1.00 0.00 C ATOM 1054 O ASP A 72 2.190 7.839 -7.247 1.00 0.00 O ATOM 1055 CB ASP A 72 0.027 9.197 -8.668 1.00 0.00 C ATOM 1056 CG ASP A 72 -0.622 7.871 -8.220 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -1.173 7.802 -7.093 1.00 0.00 O ATOM 1058 OD2 ASP A 72 -0.648 6.908 -9.026 1.00 0.00 O ATOM 0 H ASP A 72 1.507 11.447 -8.768 1.00 0.00 H new ATOM 0 HA ASP A 72 0.336 9.778 -6.634 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.755 9.895 -8.967 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.645 9.014 -9.547 1.00 0.00 H new ATOM 1063 N TYR A 73 3.319 9.764 -7.107 1.00 0.00 N ATOM 1064 CA TYR A 73 4.577 9.179 -6.637 1.00 0.00 C ATOM 1065 C TYR A 73 4.844 9.696 -5.220 1.00 0.00 C ATOM 1066 O TYR A 73 5.356 10.801 -5.038 1.00 0.00 O ATOM 1067 CB TYR A 73 5.735 9.472 -7.607 1.00 0.00 C ATOM 1068 CG TYR A 73 5.432 9.305 -9.085 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.676 8.214 -9.561 1.00 0.00 C ATOM 1070 CD2 TYR A 73 5.911 10.269 -9.991 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.339 8.132 -10.925 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.569 10.194 -11.350 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.759 9.140 -11.819 1.00 0.00 C ATOM 1074 OH TYR A 73 4.390 9.107 -13.127 1.00 0.00 O ATOM 0 H TYR A 73 3.380 10.769 -7.272 1.00 0.00 H new ATOM 0 HA TYR A 73 4.497 8.092 -6.606 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.071 10.495 -7.440 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.569 8.818 -7.352 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.355 7.441 -8.878 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.544 11.070 -9.639 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.758 7.297 -11.288 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.927 10.945 -12.038 1.00 0.00 H new ATOM 0 HH TYR A 73 5.181 8.957 -13.686 1.00 0.00 H new ATOM 1084 N ASP A 74 4.477 8.902 -4.206 1.00 0.00 N ATOM 1085 CA ASP A 74 4.627 9.287 -2.796 1.00 0.00 C ATOM 1086 C ASP A 74 6.062 9.723 -2.463 1.00 0.00 C ATOM 1087 O ASP A 74 6.268 10.646 -1.678 1.00 0.00 O ATOM 1088 CB ASP A 74 4.237 8.109 -1.893 1.00 0.00 C ATOM 1089 CG ASP A 74 2.812 7.615 -2.153 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.834 8.257 -1.713 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.691 6.566 -2.828 1.00 0.00 O ATOM 0 H ASP A 74 4.069 7.977 -4.339 1.00 0.00 H new ATOM 0 HA ASP A 74 3.968 10.137 -2.620 1.00 0.00 H new ATOM 0 HB2 ASP A 74 4.937 7.288 -2.050 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.329 8.410 -0.849 1.00 0.00 H new ATOM 1096 N VAL A 75 7.054 9.104 -3.109 1.00 0.00 N ATOM 1097 CA VAL A 75 8.459 9.507 -3.050 1.00 0.00 C ATOM 1098 C VAL A 75 8.996 9.801 -4.451 1.00 0.00 C ATOM 1099 O VAL A 75 8.782 9.023 -5.382 1.00 0.00 O ATOM 1100 CB VAL A 75 9.297 8.416 -2.368 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.756 8.853 -2.209 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.719 8.049 -0.994 1.00 0.00 C ATOM 0 H VAL A 75 6.897 8.289 -3.702 1.00 0.00 H new ATOM 0 HA VAL A 75 8.532 10.421 -2.460 1.00 0.00 H new ATOM 0 HB VAL A 75 9.262 7.537 -3.012 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.323 8.059 -1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.184 9.056 -3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.801 9.756 -1.600 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.334 7.274 -0.536 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.712 8.932 -0.355 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.700 7.680 -1.115 1.00 0.00 H new ATOM 1112 N VAL A 76 9.772 10.876 -4.588 1.00 0.00 N ATOM 1113 CA VAL A 76 10.540 11.187 -5.805 1.00 0.00 C ATOM 1114 C VAL A 76 12.027 11.271 -5.468 1.00 0.00 C ATOM 1115 O VAL A 76 12.414 11.838 -4.452 1.00 0.00 O ATOM 1116 CB VAL A 76 10.037 12.477 -6.470 1.00 0.00 C ATOM 1117 CG1 VAL A 76 10.976 13.009 -7.564 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.670 12.253 -7.124 1.00 0.00 C ATOM 0 H VAL A 76 9.890 11.569 -3.849 1.00 0.00 H new ATOM 0 HA VAL A 76 10.393 10.384 -6.527 1.00 0.00 H new ATOM 0 HB VAL A 76 9.984 13.208 -5.663 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.558 13.921 -7.990 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.953 13.225 -7.132 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.084 12.259 -8.348 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.333 13.179 -7.589 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.753 11.475 -7.883 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.950 11.945 -6.366 1.00 0.00 H new ATOM 1128 N ILE A 77 12.870 10.719 -6.334 1.00 0.00 N ATOM 1129 CA ILE A 77 14.321 10.664 -6.160 1.00 0.00 C ATOM 1130 C ILE A 77 14.997 11.283 -7.381 1.00 0.00 C ATOM 1131 O ILE A 77 14.687 10.891 -8.501 1.00 0.00 O ATOM 1132 CB ILE A 77 14.770 9.196 -6.009 1.00 0.00 C ATOM 1133 CG1 ILE A 77 13.986 8.368 -4.965 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.277 9.116 -5.730 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.102 8.855 -3.520 1.00 0.00 C ATOM 0 H ILE A 77 12.556 10.285 -7.202 1.00 0.00 H new ATOM 0 HA ILE A 77 14.603 11.219 -5.265 1.00 0.00 H new ATOM 0 HB ILE A 77 14.538 8.736 -6.969 1.00 0.00 H new ATOM 0 HG12 ILE A 77 12.933 8.364 -5.246 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.332 7.335 -5.011 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.573 8.072 -5.627 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.825 9.568 -6.557 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.505 9.651 -4.808 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.516 8.206 -2.869 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.147 8.831 -3.211 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.726 9.876 -3.449 1.00 0.00 H new ATOM 1147 N SER A 78 15.938 12.200 -7.186 1.00 0.00 N ATOM 1148 CA SER A 78 16.819 12.698 -8.245 1.00 0.00 C ATOM 1149 C SER A 78 18.169 11.981 -8.169 1.00 0.00 C ATOM 1150 O SER A 78 18.633 11.617 -7.092 1.00 0.00 O ATOM 1151 CB SER A 78 16.989 14.211 -8.173 1.00 0.00 C ATOM 1152 OG SER A 78 17.675 14.635 -9.342 1.00 0.00 O ATOM 0 H SER A 78 16.116 12.627 -6.277 1.00 0.00 H new ATOM 0 HA SER A 78 16.358 12.482 -9.209 1.00 0.00 H new ATOM 0 HB2 SER A 78 16.017 14.700 -8.104 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.550 14.489 -7.281 1.00 0.00 H new ATOM 0 HG SER A 78 17.794 15.607 -9.317 1.00 0.00 H new ATOM 1158 N LEU A 79 18.781 11.718 -9.320 1.00 0.00 N ATOM 1159 CA LEU A 79 20.059 11.018 -9.474 1.00 0.00 C ATOM 1160 C LEU A 79 20.902 11.752 -10.526 1.00 0.00 C ATOM 1161 O LEU A 79 21.436 11.140 -11.451 1.00 0.00 O ATOM 1162 CB LEU A 79 19.831 9.518 -9.803 1.00 0.00 C ATOM 1163 CG LEU A 79 18.894 8.726 -8.864 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.434 8.782 -9.316 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.249 7.238 -8.876 1.00 0.00 C ATOM 0 H LEU A 79 18.383 12.000 -10.216 1.00 0.00 H new ATOM 0 HA LEU A 79 20.615 11.030 -8.537 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.432 9.451 -10.815 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.802 9.022 -9.810 1.00 0.00 H new ATOM 0 HG LEU A 79 19.019 9.182 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.816 8.210 -8.623 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.097 9.819 -9.331 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.346 8.357 -10.316 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.577 6.698 -8.208 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.145 6.847 -9.888 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.278 7.107 -8.540 1.00 0.00 H new ATOM 1213 N VAL A 84 20.319 20.381 -11.235 1.00 0.00 N ATOM 1214 CA VAL A 84 18.914 19.912 -11.198 1.00 0.00 C ATOM 1215 C VAL A 84 18.323 20.079 -9.793 1.00 0.00 C ATOM 1216 O VAL A 84 18.894 19.588 -8.819 1.00 0.00 O ATOM 1217 CB VAL A 84 18.815 18.436 -11.651 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.369 17.918 -11.637 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.354 18.240 -13.075 1.00 0.00 C ATOM 0 HA VAL A 84 18.336 20.524 -11.891 1.00 0.00 H new ATOM 0 HB VAL A 84 19.417 17.876 -10.935 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.352 16.878 -11.963 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.967 17.988 -10.626 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.760 18.520 -12.312 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.267 17.190 -13.356 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.777 18.851 -13.770 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.401 18.540 -13.112 1.00 0.00 H new ATOM 1229 N ASN A 85 17.156 20.735 -9.694 1.00 0.00 N ATOM 1230 CA ASN A 85 16.463 20.990 -8.414 1.00 0.00 C ATOM 1231 C ASN A 85 14.949 20.671 -8.406 1.00 0.00 C ATOM 1232 O ASN A 85 14.335 20.739 -7.343 1.00 0.00 O ATOM 1233 CB ASN A 85 16.745 22.450 -8.005 1.00 0.00 C ATOM 1234 CG ASN A 85 18.216 22.706 -7.710 1.00 0.00 C ATOM 1235 OD1 ASN A 85 18.952 23.249 -8.524 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.703 22.306 -6.555 1.00 0.00 N ATOM 0 H ASN A 85 16.660 21.107 -10.504 1.00 0.00 H new ATOM 0 HA ASN A 85 16.865 20.291 -7.681 1.00 0.00 H new ATOM 0 HB2 ASN A 85 16.418 23.116 -8.804 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.154 22.696 -7.123 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.690 22.449 -6.341 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.094 21.853 -5.874 1.00 0.00 H new ATOM 1243 N LEU A 86 14.347 20.316 -9.557 1.00 0.00 N ATOM 1244 CA LEU A 86 12.917 19.962 -9.721 1.00 0.00 C ATOM 1245 C LEU A 86 11.913 20.905 -8.998 1.00 0.00 C ATOM 1246 O LEU A 86 11.119 20.439 -8.182 1.00 0.00 O ATOM 1247 CB LEU A 86 12.694 18.477 -9.345 1.00 0.00 C ATOM 1248 CG LEU A 86 13.476 17.399 -10.096 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.926 16.039 -9.660 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.281 17.553 -11.602 1.00 0.00 C ATOM 0 H LEU A 86 14.861 20.265 -10.436 1.00 0.00 H new ATOM 0 HA LEU A 86 12.691 20.109 -10.777 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.919 18.368 -8.284 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.633 18.261 -9.470 1.00 0.00 H new ATOM 0 HG LEU A 86 14.539 17.487 -9.872 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.464 15.246 -10.179 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.056 15.922 -8.584 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.866 15.979 -9.906 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.844 16.778 -12.123 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.222 17.457 -11.844 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.637 18.534 -11.917 1.00 0.00 H new ATOM 1262 N PRO A 87 11.884 22.217 -9.311 1.00 0.00 N ATOM 1263 CA PRO A 87 11.001 23.181 -8.638 1.00 0.00 C ATOM 1264 C PRO A 87 9.461 22.944 -8.664 1.00 0.00 C ATOM 1265 O PRO A 87 8.804 23.568 -7.823 1.00 0.00 O ATOM 1266 CB PRO A 87 11.376 24.550 -9.225 1.00 0.00 C ATOM 1267 CG PRO A 87 12.020 24.230 -10.570 1.00 0.00 C ATOM 1268 CD PRO A 87 12.709 22.894 -10.303 1.00 0.00 C ATOM 0 HA PRO A 87 11.180 23.077 -7.568 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.497 25.183 -9.347 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.066 25.085 -8.573 1.00 0.00 H new ATOM 0 HG2 PRO A 87 11.279 24.151 -11.365 1.00 0.00 H new ATOM 0 HG3 PRO A 87 12.731 24.999 -10.872 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.787 22.304 -11.216 1.00 0.00 H new ATOM 0 HD3 PRO A 87 13.723 23.043 -9.933 1.00 0.00 H new ATOM 1276 N PRO A 88 8.836 22.110 -9.540 1.00 0.00 N ATOM 1277 CA PRO A 88 7.382 21.869 -9.491 1.00 0.00 C ATOM 1278 C PRO A 88 6.936 20.911 -8.357 1.00 0.00 C ATOM 1279 O PRO A 88 7.661 20.650 -7.400 1.00 0.00 O ATOM 1280 CB PRO A 88 7.005 21.333 -10.887 1.00 0.00 C ATOM 1281 CG PRO A 88 8.229 21.543 -11.767 1.00 0.00 C ATOM 1282 CD PRO A 88 9.367 21.519 -10.761 1.00 0.00 C ATOM 0 HA PRO A 88 6.858 22.795 -9.252 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.736 20.278 -10.839 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.142 21.864 -11.288 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.331 20.756 -12.514 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.184 22.490 -12.306 1.00 0.00 H new ATOM 0 HD2 PRO A 88 9.710 20.500 -10.584 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.224 22.084 -11.128 1.00 0.00 H new ATOM 1290 N GLU A 89 5.746 20.308 -8.504 1.00 0.00 N ATOM 1291 CA GLU A 89 5.200 19.237 -7.641 1.00 0.00 C ATOM 1292 C GLU A 89 6.129 18.020 -7.428 1.00 0.00 C ATOM 1293 O GLU A 89 5.931 17.226 -6.512 1.00 0.00 O ATOM 1294 CB GLU A 89 3.832 18.783 -8.193 1.00 0.00 C ATOM 1295 CG GLU A 89 3.849 18.379 -9.678 1.00 0.00 C ATOM 1296 CD GLU A 89 2.489 17.787 -10.108 1.00 0.00 C ATOM 1297 OE1 GLU A 89 1.511 18.563 -10.253 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.391 16.554 -10.325 1.00 0.00 O ATOM 0 H GLU A 89 5.107 20.561 -9.258 1.00 0.00 H new ATOM 0 HA GLU A 89 5.097 19.679 -6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.478 17.938 -7.603 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.113 19.590 -8.057 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.081 19.249 -10.292 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.638 17.647 -9.850 1.00 0.00 H new ATOM 1305 N TRP A 90 7.194 17.890 -8.220 1.00 0.00 N ATOM 1306 CA TRP A 90 8.233 16.860 -8.100 1.00 0.00 C ATOM 1307 C TRP A 90 9.025 16.890 -6.782 1.00 0.00 C ATOM 1308 O TRP A 90 9.666 15.896 -6.445 1.00 0.00 O ATOM 1309 CB TRP A 90 9.130 16.947 -9.331 1.00 0.00 C ATOM 1310 CG TRP A 90 8.426 16.453 -10.557 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.633 17.177 -11.382 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.386 15.092 -11.072 1.00 0.00 C ATOM 1313 NE1 TRP A 90 6.998 16.327 -12.271 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.423 15.027 -12.121 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.096 13.911 -10.773 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.133 13.832 -12.796 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 8.876 12.732 -11.503 1.00 0.00 C ATOM 1318 CH2 TRP A 90 7.894 12.686 -12.504 1.00 0.00 C ATOM 0 H TRP A 90 7.366 18.527 -8.998 1.00 0.00 H new ATOM 0 HA TRP A 90 7.740 15.889 -8.061 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.444 17.980 -9.482 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.033 16.360 -9.167 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.514 18.250 -11.351 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.301 16.627 -12.953 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.819 13.913 -9.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.339 13.793 -13.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.468 11.853 -11.292 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.722 11.770 -13.050 1.00 0.00 H new ATOM 1329 N VAL A 91 8.939 17.976 -6.002 1.00 0.00 N ATOM 1330 CA VAL A 91 9.553 18.087 -4.659 1.00 0.00 C ATOM 1331 C VAL A 91 8.547 18.364 -3.529 1.00 0.00 C ATOM 1332 O VAL A 91 8.950 18.525 -2.378 1.00 0.00 O ATOM 1333 CB VAL A 91 10.723 19.095 -4.645 1.00 0.00 C ATOM 1334 CG1 VAL A 91 11.835 18.662 -5.600 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.277 20.533 -4.956 1.00 0.00 C ATOM 0 H VAL A 91 8.436 18.817 -6.284 1.00 0.00 H new ATOM 0 HA VAL A 91 9.959 17.098 -4.446 1.00 0.00 H new ATOM 0 HB VAL A 91 11.113 19.096 -3.627 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.645 19.390 -5.569 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.214 17.685 -5.299 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.440 18.601 -6.614 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.142 21.196 -4.932 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.822 20.567 -5.946 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.550 20.858 -4.211 1.00 0.00 H new ATOM 1345 N THR A 92 7.237 18.380 -3.821 1.00 0.00 N ATOM 1346 CA THR A 92 6.163 18.599 -2.821 1.00 0.00 C ATOM 1347 C THR A 92 5.573 17.289 -2.262 1.00 0.00 C ATOM 1348 O THR A 92 4.619 17.318 -1.479 1.00 0.00 O ATOM 1349 CB THR A 92 5.041 19.489 -3.379 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.375 18.828 -4.433 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.559 20.819 -3.928 1.00 0.00 C ATOM 0 H THR A 92 6.883 18.240 -4.767 1.00 0.00 H new ATOM 0 HA THR A 92 6.643 19.115 -1.989 1.00 0.00 H new ATOM 0 HB THR A 92 4.370 19.689 -2.544 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.026 18.331 -4.971 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.723 21.406 -4.308 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.058 21.372 -3.132 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.266 20.629 -4.736 1.00 0.00 H new ATOM 1359 N GLN A 93 6.135 16.135 -2.653 1.00 0.00 N ATOM 1360 CA GLN A 93 5.683 14.800 -2.242 1.00 0.00 C ATOM 1361 C GLN A 93 6.161 14.430 -0.819 1.00 0.00 C ATOM 1362 O GLN A 93 6.770 15.244 -0.121 1.00 0.00 O ATOM 1363 CB GLN A 93 6.081 13.773 -3.326 1.00 0.00 C ATOM 1364 CG GLN A 93 5.615 14.171 -4.742 1.00 0.00 C ATOM 1365 CD GLN A 93 4.136 14.583 -4.789 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.245 13.928 -4.257 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.825 15.725 -5.368 1.00 0.00 N ATOM 0 H GLN A 93 6.938 16.106 -3.281 1.00 0.00 H new ATOM 0 HA GLN A 93 4.596 14.793 -2.166 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.165 13.657 -3.327 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.657 12.802 -3.071 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.229 14.996 -5.103 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.776 13.334 -5.421 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.551 16.284 -5.816 1.00 0.00 H new ATOM 0 HE22 GLN A 93 2.858 16.050 -5.368 1.00 0.00 H new ATOM 1376 N GLU A 94 5.861 13.212 -0.355 1.00 0.00 N ATOM 1377 CA GLU A 94 6.071 12.809 1.049 1.00 0.00 C ATOM 1378 C GLU A 94 7.563 12.796 1.433 1.00 0.00 C ATOM 1379 O GLU A 94 7.934 13.272 2.510 1.00 0.00 O ATOM 1380 CB GLU A 94 5.431 11.428 1.294 1.00 0.00 C ATOM 1381 CG GLU A 94 5.350 11.012 2.767 1.00 0.00 C ATOM 1382 CD GLU A 94 4.318 11.850 3.548 1.00 0.00 C ATOM 1383 OE1 GLU A 94 3.117 11.485 3.551 1.00 0.00 O ATOM 1384 OE2 GLU A 94 4.695 12.873 4.169 1.00 0.00 O ATOM 0 H GLU A 94 5.466 12.474 -0.938 1.00 0.00 H new ATOM 0 HA GLU A 94 5.589 13.550 1.687 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.425 11.430 0.875 1.00 0.00 H new ATOM 0 HB3 GLU A 94 6.002 10.676 0.749 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.084 9.957 2.832 1.00 0.00 H new ATOM 0 HG3 GLU A 94 6.331 11.122 3.229 1.00 0.00 H new ATOM 1391 N ILE A 95 8.420 12.305 0.527 1.00 0.00 N ATOM 1392 CA ILE A 95 9.888 12.355 0.646 1.00 0.00 C ATOM 1393 C ILE A 95 10.510 12.720 -0.711 1.00 0.00 C ATOM 1394 O ILE A 95 10.072 12.232 -1.756 1.00 0.00 O ATOM 1395 CB ILE A 95 10.466 11.015 1.192 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.811 10.593 2.529 1.00 0.00 C ATOM 1397 CG2 ILE A 95 12.001 11.093 1.346 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.361 9.297 3.143 1.00 0.00 C ATOM 0 H ILE A 95 8.106 11.851 -0.331 1.00 0.00 H new ATOM 0 HA ILE A 95 10.148 13.128 1.369 1.00 0.00 H new ATOM 0 HB ILE A 95 10.226 10.249 0.455 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.939 11.401 3.249 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.739 10.475 2.369 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.377 10.144 1.729 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.454 11.298 0.376 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.257 11.892 2.042 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.839 9.086 4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 95 10.208 8.472 2.448 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.427 9.412 3.341 1.00 0.00 H new ATOM 1410 N PHE A 96 11.552 13.555 -0.688 1.00 0.00 N ATOM 1411 CA PHE A 96 12.414 13.831 -1.839 1.00 0.00 C ATOM 1412 C PHE A 96 13.891 13.647 -1.440 1.00 0.00 C ATOM 1413 O PHE A 96 14.304 14.089 -0.365 1.00 0.00 O ATOM 1414 CB PHE A 96 12.127 15.206 -2.467 1.00 0.00 C ATOM 1415 CG PHE A 96 13.112 15.574 -3.567 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.921 15.145 -4.899 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.275 16.300 -3.235 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.911 15.392 -5.865 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.250 16.572 -4.211 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.073 16.112 -5.527 1.00 0.00 C ATOM 0 H PHE A 96 11.825 14.069 0.150 1.00 0.00 H new ATOM 0 HA PHE A 96 12.188 13.109 -2.624 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.117 15.209 -2.876 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.158 15.969 -1.689 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.014 14.627 -5.175 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.418 16.650 -2.223 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.780 15.027 -6.873 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.134 17.134 -3.949 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.825 16.310 -6.276 1.00 0.00 H new ATOM 1430 N GLU A 97 14.685 13.005 -2.302 1.00 0.00 N ATOM 1431 CA GLU A 97 16.133 12.799 -2.120 1.00 0.00 C ATOM 1432 C GLU A 97 16.911 13.071 -3.418 1.00 0.00 C ATOM 1433 O GLU A 97 16.368 12.926 -4.511 1.00 0.00 O ATOM 1434 CB GLU A 97 16.443 11.367 -1.645 1.00 0.00 C ATOM 1435 CG GLU A 97 15.811 10.986 -0.296 1.00 0.00 C ATOM 1436 CD GLU A 97 16.270 9.597 0.195 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.463 9.242 0.016 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.447 8.859 0.788 1.00 0.00 O ATOM 0 H GLU A 97 14.333 12.602 -3.170 1.00 0.00 H new ATOM 0 HA GLU A 97 16.452 13.509 -1.357 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.098 10.665 -2.404 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.524 11.250 -1.570 1.00 0.00 H new ATOM 0 HG2 GLU A 97 16.072 11.737 0.450 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.725 10.995 -0.391 1.00 0.00 H new ATOM 1445 N ASP A 98 18.201 13.408 -3.308 1.00 0.00 N ATOM 1446 CA ASP A 98 19.107 13.599 -4.449 1.00 0.00 C ATOM 1447 C ASP A 98 20.397 12.778 -4.269 1.00 0.00 C ATOM 1448 O ASP A 98 21.282 13.145 -3.488 1.00 0.00 O ATOM 1449 CB ASP A 98 19.376 15.098 -4.641 1.00 0.00 C ATOM 1450 CG ASP A 98 20.398 15.394 -5.758 1.00 0.00 C ATOM 1451 OD1 ASP A 98 20.485 14.627 -6.747 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.110 16.421 -5.639 1.00 0.00 O ATOM 0 H ASP A 98 18.654 13.559 -2.407 1.00 0.00 H new ATOM 0 HA ASP A 98 18.637 13.228 -5.360 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.438 15.602 -4.873 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.740 15.518 -3.704 1.00 0.00 H new ATOM 1457 N TRP A 99 20.488 11.644 -4.970 1.00 0.00 N ATOM 1458 CA TRP A 99 21.597 10.687 -4.906 1.00 0.00 C ATOM 1459 C TRP A 99 22.678 11.052 -5.933 1.00 0.00 C ATOM 1460 O TRP A 99 22.656 10.608 -7.083 1.00 0.00 O ATOM 1461 CB TRP A 99 21.066 9.253 -5.091 1.00 0.00 C ATOM 1462 CG TRP A 99 19.956 8.799 -4.181 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.573 9.378 -3.018 1.00 0.00 C ATOM 1464 CD2 TRP A 99 19.062 7.655 -4.356 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.488 8.703 -2.498 1.00 0.00 N ATOM 1466 CE2 TRP A 99 18.111 7.651 -3.295 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.958 6.615 -5.304 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.102 6.686 -3.183 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.947 5.638 -5.210 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.017 5.673 -4.153 1.00 0.00 C ATOM 0 H TRP A 99 19.761 11.356 -5.625 1.00 0.00 H new ATOM 0 HA TRP A 99 22.066 10.735 -3.923 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.720 9.153 -6.120 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.903 8.566 -4.968 1.00 0.00 H new ATOM 0 HD1 TRP A 99 20.045 10.238 -2.566 1.00 0.00 H new ATOM 0 HE1 TRP A 99 18.022 8.955 -1.626 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.667 6.567 -6.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.400 6.720 -2.363 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.885 4.857 -5.953 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.241 4.924 -4.088 1.00 0.00 H new ATOM 1481 N GLN A 100 23.633 11.886 -5.518 1.00 0.00 N ATOM 1482 CA GLN A 100 24.705 12.394 -6.382 1.00 0.00 C ATOM 1483 C GLN A 100 25.824 11.337 -6.523 1.00 0.00 C ATOM 1484 O GLN A 100 26.744 11.276 -5.704 1.00 0.00 O ATOM 1485 CB GLN A 100 25.222 13.742 -5.833 1.00 0.00 C ATOM 1486 CG GLN A 100 24.114 14.797 -5.654 1.00 0.00 C ATOM 1487 CD GLN A 100 24.641 16.218 -5.430 1.00 0.00 C ATOM 1488 OE1 GLN A 100 25.825 16.474 -5.247 1.00 0.00 O ATOM 1489 NE2 GLN A 100 23.776 17.206 -5.451 1.00 0.00 N ATOM 0 H GLN A 100 23.686 12.233 -4.560 1.00 0.00 H new ATOM 0 HA GLN A 100 24.319 12.579 -7.385 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.709 13.572 -4.873 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.981 14.134 -6.510 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.475 14.792 -6.537 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.489 14.514 -4.807 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.786 17.014 -5.602 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.094 18.166 -5.316 1.00 0.00 H new ATOM 1498 N LEU A 101 25.718 10.478 -7.544 1.00 0.00 N ATOM 1499 CA LEU A 101 26.649 9.372 -7.832 1.00 0.00 C ATOM 1500 C LEU A 101 27.491 9.644 -9.089 1.00 0.00 C ATOM 1501 O LEU A 101 27.272 10.611 -9.822 1.00 0.00 O ATOM 1502 CB LEU A 101 25.859 8.050 -7.965 1.00 0.00 C ATOM 1503 CG LEU A 101 24.978 7.632 -6.773 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.376 6.258 -7.062 1.00 0.00 C ATOM 1505 CD2 LEU A 101 25.749 7.554 -5.461 1.00 0.00 C ATOM 0 H LEU A 101 24.955 10.533 -8.219 1.00 0.00 H new ATOM 0 HA LEU A 101 27.348 9.287 -7.000 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.222 8.125 -8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.572 7.248 -8.155 1.00 0.00 H new ATOM 0 HG LEU A 101 24.209 8.396 -6.658 1.00 0.00 H new ATOM 0 HD11 LEU A 101 23.750 5.952 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.771 6.309 -7.967 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.177 5.532 -7.201 1.00 0.00 H new ATOM 0 HD21 LEU A 101 25.074 7.255 -4.659 1.00 0.00 H new ATOM 0 HD22 LEU A 101 26.550 6.821 -5.553 1.00 0.00 H new ATOM 0 HD23 LEU A 101 26.175 8.530 -5.231 1.00 0.00 H new ATOM 1517 N GLU A 102 28.452 8.758 -9.344 1.00 0.00 N ATOM 1518 CA GLU A 102 29.295 8.735 -10.534 1.00 0.00 C ATOM 1519 C GLU A 102 28.465 8.486 -11.809 1.00 0.00 C ATOM 1520 O GLU A 102 27.305 8.067 -11.772 1.00 0.00 O ATOM 1521 CB GLU A 102 30.361 7.635 -10.364 1.00 0.00 C ATOM 1522 CG GLU A 102 31.356 7.788 -9.201 1.00 0.00 C ATOM 1523 CD GLU A 102 30.732 7.644 -7.790 1.00 0.00 C ATOM 1524 OE1 GLU A 102 29.801 6.821 -7.597 1.00 0.00 O ATOM 1525 OE2 GLU A 102 31.183 8.362 -6.863 1.00 0.00 O ATOM 0 H GLU A 102 28.673 8.002 -8.695 1.00 0.00 H new ATOM 0 HA GLU A 102 29.775 9.707 -10.646 1.00 0.00 H new ATOM 0 HB2 GLU A 102 29.846 6.682 -10.243 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.932 7.573 -11.290 1.00 0.00 H new ATOM 0 HG2 GLU A 102 32.142 7.042 -9.313 1.00 0.00 H new ATOM 0 HG3 GLU A 102 31.832 8.766 -9.275 1.00 0.00 H new ATOM 1532 N ASP A 103 29.082 8.721 -12.964 1.00 0.00 N ATOM 1533 CA ASP A 103 28.468 8.574 -14.291 1.00 0.00 C ATOM 1534 C ASP A 103 29.200 7.502 -15.128 1.00 0.00 C ATOM 1535 O ASP A 103 30.248 7.806 -15.699 1.00 0.00 O ATOM 1536 CB ASP A 103 28.398 9.955 -14.965 1.00 0.00 C ATOM 1537 CG ASP A 103 27.284 9.989 -16.019 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.117 10.206 -15.615 1.00 0.00 O ATOM 1539 OD2 ASP A 103 27.522 9.751 -17.223 1.00 0.00 O ATOM 0 H ASP A 103 30.053 9.029 -13.009 1.00 0.00 H new ATOM 0 HA ASP A 103 27.446 8.207 -14.198 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.217 10.723 -14.213 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.355 10.186 -15.433 1.00 0.00 H new ATOM 1544 N PRO A 104 28.694 6.245 -15.182 1.00 0.00 N ATOM 1545 CA PRO A 104 29.402 5.103 -15.784 1.00 0.00 C ATOM 1546 C PRO A 104 29.500 5.093 -17.315 1.00 0.00 C ATOM 1547 O PRO A 104 30.298 4.343 -17.868 1.00 0.00 O ATOM 1548 CB PRO A 104 28.648 3.861 -15.311 1.00 0.00 C ATOM 1549 CG PRO A 104 27.956 4.306 -14.038 1.00 0.00 C ATOM 1550 CD PRO A 104 27.570 5.735 -14.399 1.00 0.00 C ATOM 0 HA PRO A 104 30.443 5.153 -15.464 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.929 3.524 -16.058 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.328 3.030 -15.125 1.00 0.00 H new ATOM 0 HG2 PRO A 104 27.087 3.691 -13.805 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.618 4.264 -13.173 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.645 5.760 -14.974 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.406 6.337 -13.505 1.00 0.00 H new ATOM 1558 N ASP A 105 28.698 5.903 -18.003 1.00 0.00 N ATOM 1559 CA ASP A 105 28.628 5.978 -19.467 1.00 0.00 C ATOM 1560 C ASP A 105 30.009 6.287 -20.091 1.00 0.00 C ATOM 1561 O ASP A 105 30.513 7.412 -20.008 1.00 0.00 O ATOM 1562 CB ASP A 105 27.575 7.042 -19.804 1.00 0.00 C ATOM 1563 CG ASP A 105 27.364 7.324 -21.301 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.873 6.569 -22.165 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.645 8.314 -21.593 1.00 0.00 O ATOM 0 H ASP A 105 28.056 6.549 -17.544 1.00 0.00 H new ATOM 0 HA ASP A 105 28.338 5.018 -19.894 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.622 6.732 -19.374 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.858 7.974 -19.314 1.00 0.00 H new ATOM 1570 N GLY A 106 30.631 5.269 -20.706 1.00 0.00 N ATOM 1571 CA GLY A 106 31.964 5.361 -21.318 1.00 0.00 C ATOM 1572 C GLY A 106 33.143 5.201 -20.343 1.00 0.00 C ATOM 1573 O GLY A 106 34.275 5.528 -20.707 1.00 0.00 O ATOM 0 H GLY A 106 30.213 4.343 -20.793 1.00 0.00 H new ATOM 0 HA2 GLY A 106 32.045 4.596 -22.091 1.00 0.00 H new ATOM 0 HA3 GLY A 106 32.052 6.327 -21.815 1.00 0.00 H new ATOM 1577 N GLN A 107 32.893 4.724 -19.115 1.00 0.00 N ATOM 1578 CA GLN A 107 33.917 4.496 -18.084 1.00 0.00 C ATOM 1579 C GLN A 107 34.483 3.063 -18.165 1.00 0.00 C ATOM 1580 O GLN A 107 35.290 2.757 -19.045 1.00 0.00 O ATOM 1581 CB GLN A 107 33.376 4.847 -16.679 1.00 0.00 C ATOM 1582 CG GLN A 107 32.740 6.230 -16.507 1.00 0.00 C ATOM 1583 CD GLN A 107 33.674 7.436 -16.501 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.869 7.374 -16.765 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.132 8.588 -16.168 1.00 0.00 N ATOM 0 H GLN A 107 31.953 4.481 -18.804 1.00 0.00 H new ATOM 0 HA GLN A 107 34.753 5.169 -18.275 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.635 4.096 -16.403 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.197 4.760 -15.968 1.00 0.00 H new ATOM 0 HG2 GLN A 107 32.015 6.369 -17.309 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.183 6.231 -15.570 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.137 8.639 -15.948 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.707 9.430 -16.130 1.00 0.00 H new ATOM 1594 N SER A 108 34.070 2.178 -17.248 1.00 0.00 N ATOM 1595 CA SER A 108 34.428 0.749 -17.164 1.00 0.00 C ATOM 1596 C SER A 108 33.397 0.005 -16.316 1.00 0.00 C ATOM 1597 O SER A 108 32.672 0.620 -15.533 1.00 0.00 O ATOM 1598 CB SER A 108 35.826 0.580 -16.536 1.00 0.00 C ATOM 1599 OG SER A 108 36.852 0.836 -17.482 1.00 0.00 O ATOM 0 H SER A 108 33.438 2.454 -16.497 1.00 0.00 H new ATOM 0 HA SER A 108 34.440 0.335 -18.172 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.931 1.259 -15.690 1.00 0.00 H new ATOM 0 HB3 SER A 108 35.932 -0.433 -16.147 1.00 0.00 H new ATOM 0 HG SER A 108 36.528 1.475 -18.151 1.00 0.00 H new ATOM 1605 N LEU A 109 33.330 -1.326 -16.411 1.00 0.00 N ATOM 1606 CA LEU A 109 32.283 -2.112 -15.733 1.00 0.00 C ATOM 1607 C LEU A 109 32.438 -2.087 -14.209 1.00 0.00 C ATOM 1608 O LEU A 109 31.444 -2.045 -13.498 1.00 0.00 O ATOM 1609 CB LEU A 109 32.225 -3.537 -16.320 1.00 0.00 C ATOM 1610 CG LEU A 109 31.404 -3.656 -17.624 1.00 0.00 C ATOM 1611 CD1 LEU A 109 31.866 -2.732 -18.753 1.00 0.00 C ATOM 1612 CD2 LEU A 109 31.464 -5.096 -18.134 1.00 0.00 C ATOM 0 H LEU A 109 33.988 -1.887 -16.951 1.00 0.00 H new ATOM 0 HA LEU A 109 31.317 -1.645 -15.926 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.242 -3.880 -16.512 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.799 -4.207 -15.574 1.00 0.00 H new ATOM 0 HG LEU A 109 30.391 -3.353 -17.360 1.00 0.00 H new ATOM 0 HD11 LEU A 109 31.234 -2.883 -19.628 1.00 0.00 H new ATOM 0 HD12 LEU A 109 31.793 -1.694 -18.427 1.00 0.00 H new ATOM 0 HD13 LEU A 109 32.901 -2.960 -19.009 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.885 -5.181 -19.054 1.00 0.00 H new ATOM 0 HD22 LEU A 109 32.501 -5.369 -18.331 1.00 0.00 H new ATOM 0 HD23 LEU A 109 31.049 -5.766 -17.381 1.00 0.00 H new ATOM 1624 N GLU A 110 33.655 -1.955 -13.685 1.00 0.00 N ATOM 1625 CA GLU A 110 33.887 -1.710 -12.247 1.00 0.00 C ATOM 1626 C GLU A 110 33.275 -0.383 -11.757 1.00 0.00 C ATOM 1627 O GLU A 110 32.802 -0.293 -10.623 1.00 0.00 O ATOM 1628 CB GLU A 110 35.388 -1.820 -11.927 1.00 0.00 C ATOM 1629 CG GLU A 110 36.263 -0.736 -12.576 1.00 0.00 C ATOM 1630 CD GLU A 110 37.754 -0.990 -12.271 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.261 -0.483 -11.240 1.00 0.00 O ATOM 1632 OE2 GLU A 110 38.431 -1.691 -13.062 1.00 0.00 O ATOM 0 H GLU A 110 34.511 -2.013 -14.236 1.00 0.00 H new ATOM 0 HA GLU A 110 33.363 -2.486 -11.690 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.520 -1.775 -10.846 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.744 -2.798 -12.251 1.00 0.00 H new ATOM 0 HG2 GLU A 110 36.103 -0.728 -13.654 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.972 0.246 -12.203 1.00 0.00 H new ATOM 1639 N VAL A 111 33.183 0.624 -12.632 1.00 0.00 N ATOM 1640 CA VAL A 111 32.512 1.904 -12.342 1.00 0.00 C ATOM 1641 C VAL A 111 30.993 1.754 -12.425 1.00 0.00 C ATOM 1642 O VAL A 111 30.294 2.265 -11.552 1.00 0.00 O ATOM 1643 CB VAL A 111 33.049 3.021 -13.260 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.356 4.366 -13.024 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.550 3.228 -13.035 1.00 0.00 C ATOM 0 H VAL A 111 33.575 0.577 -13.572 1.00 0.00 H new ATOM 0 HA VAL A 111 32.742 2.197 -11.318 1.00 0.00 H new ATOM 0 HB VAL A 111 32.845 2.692 -14.279 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.774 5.114 -13.698 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.288 4.263 -13.214 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.512 4.680 -11.992 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.911 4.020 -13.692 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.727 3.509 -11.997 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.082 2.303 -13.256 1.00 0.00 H new ATOM 1655 N PHE A 112 30.464 0.972 -13.377 1.00 0.00 N ATOM 1656 CA PHE A 112 29.037 0.610 -13.374 1.00 0.00 C ATOM 1657 C PHE A 112 28.656 -0.148 -12.096 1.00 0.00 C ATOM 1658 O PHE A 112 27.668 0.200 -11.463 1.00 0.00 O ATOM 1659 CB PHE A 112 28.683 -0.239 -14.600 1.00 0.00 C ATOM 1660 CG PHE A 112 28.315 0.526 -15.850 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.977 0.907 -16.058 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.289 0.841 -16.816 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.610 1.598 -17.226 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.924 1.546 -17.976 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.589 1.937 -18.173 1.00 0.00 C ATOM 0 H PHE A 112 30.997 0.580 -14.154 1.00 0.00 H new ATOM 0 HA PHE A 112 28.469 1.540 -13.410 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.532 -0.883 -14.829 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.850 -0.891 -14.338 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.228 0.668 -15.317 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.316 0.541 -16.666 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.578 1.867 -17.394 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.671 1.788 -18.717 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.316 2.499 -19.054 1.00 0.00 H new ATOM 1675 N ARG A 113 29.461 -1.125 -11.665 1.00 0.00 N ATOM 1676 CA ARG A 113 29.250 -1.894 -10.418 1.00 0.00 C ATOM 1677 C ARG A 113 29.332 -0.999 -9.173 1.00 0.00 C ATOM 1678 O ARG A 113 28.494 -1.118 -8.281 1.00 0.00 O ATOM 1679 CB ARG A 113 30.271 -3.046 -10.350 1.00 0.00 C ATOM 1680 CG ARG A 113 30.033 -4.109 -11.438 1.00 0.00 C ATOM 1681 CD ARG A 113 31.189 -5.108 -11.483 1.00 0.00 C ATOM 1682 NE ARG A 113 31.045 -6.088 -12.579 1.00 0.00 N ATOM 1683 CZ ARG A 113 31.999 -6.544 -13.373 1.00 0.00 C ATOM 1684 NH1 ARG A 113 33.230 -6.115 -13.333 1.00 0.00 N ATOM 1685 NH2 ARG A 113 31.729 -7.469 -14.238 1.00 0.00 N ATOM 0 H ARG A 113 30.294 -1.414 -12.177 1.00 0.00 H new ATOM 0 HA ARG A 113 28.243 -2.310 -10.433 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.278 -2.642 -10.455 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.218 -3.517 -9.368 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.099 -4.635 -11.240 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.927 -3.625 -12.409 1.00 0.00 H new ATOM 0 HD2 ARG A 113 32.128 -4.568 -11.604 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.246 -5.637 -10.532 1.00 0.00 H new ATOM 0 HE ARG A 113 30.106 -6.453 -12.741 1.00 0.00 H new ATOM 0 HH11 ARG A 113 33.497 -5.392 -12.665 1.00 0.00 H new ATOM 0 HH12 ARG A 113 33.926 -6.503 -13.970 1.00 0.00 H new ATOM 0 HH21 ARG A 113 30.783 -7.844 -14.305 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.463 -7.823 -14.852 1.00 0.00 H new ATOM 1699 N THR A 114 30.263 -0.042 -9.161 1.00 0.00 N ATOM 1700 CA THR A 114 30.400 0.969 -8.086 1.00 0.00 C ATOM 1701 C THR A 114 29.148 1.841 -7.966 1.00 0.00 C ATOM 1702 O THR A 114 28.660 2.084 -6.863 1.00 0.00 O ATOM 1703 CB THR A 114 31.651 1.836 -8.324 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.814 1.046 -8.192 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.784 2.993 -7.333 1.00 0.00 C ATOM 0 H THR A 114 30.956 0.062 -9.902 1.00 0.00 H new ATOM 0 HA THR A 114 30.516 0.438 -7.141 1.00 0.00 H new ATOM 0 HB THR A 114 31.541 2.246 -9.328 1.00 0.00 H new ATOM 0 HG1 THR A 114 32.944 0.517 -9.007 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.686 3.563 -7.558 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.914 3.644 -7.415 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.847 2.598 -6.319 1.00 0.00 H new ATOM 1713 N VAL A 115 28.572 2.282 -9.089 1.00 0.00 N ATOM 1714 CA VAL A 115 27.283 3.003 -9.094 1.00 0.00 C ATOM 1715 C VAL A 115 26.115 2.092 -8.713 1.00 0.00 C ATOM 1716 O VAL A 115 25.339 2.450 -7.833 1.00 0.00 O ATOM 1717 CB VAL A 115 27.076 3.698 -10.449 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.670 4.260 -10.660 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.045 4.877 -10.516 1.00 0.00 C ATOM 0 H VAL A 115 28.978 2.154 -10.016 1.00 0.00 H new ATOM 0 HA VAL A 115 27.314 3.775 -8.325 1.00 0.00 H new ATOM 0 HB VAL A 115 27.241 2.943 -11.218 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.611 4.733 -11.640 1.00 0.00 H new ATOM 0 HG12 VAL A 115 24.942 3.451 -10.603 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.453 4.998 -9.887 1.00 0.00 H new ATOM 0 HG21 VAL A 115 27.924 5.394 -11.468 1.00 0.00 H new ATOM 0 HG22 VAL A 115 27.835 5.567 -9.699 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.068 4.512 -10.429 1.00 0.00 H new ATOM 1729 N ARG A 116 26.018 0.898 -9.309 1.00 0.00 N ATOM 1730 CA ARG A 116 24.959 -0.103 -9.070 1.00 0.00 C ATOM 1731 C ARG A 116 24.779 -0.408 -7.581 1.00 0.00 C ATOM 1732 O ARG A 116 23.661 -0.346 -7.086 1.00 0.00 O ATOM 1733 CB ARG A 116 25.306 -1.366 -9.897 1.00 0.00 C ATOM 1734 CG ARG A 116 24.211 -2.441 -9.856 1.00 0.00 C ATOM 1735 CD ARG A 116 24.661 -3.766 -10.474 1.00 0.00 C ATOM 1736 NE ARG A 116 25.671 -4.447 -9.623 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.569 -5.333 -10.016 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.570 -5.802 -11.224 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.499 -5.751 -9.211 1.00 0.00 N ATOM 0 H ARG A 116 26.700 0.585 -10.000 1.00 0.00 H new ATOM 0 HA ARG A 116 23.996 0.291 -9.394 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.482 -1.076 -10.933 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.237 -1.792 -9.523 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.912 -2.610 -8.821 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.331 -2.078 -10.387 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.798 -4.418 -10.609 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.080 -3.584 -11.463 1.00 0.00 H new ATOM 0 HE ARG A 116 25.671 -4.205 -8.632 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.868 -5.488 -11.894 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.273 -6.485 -11.505 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.545 -5.395 -8.256 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.183 -6.435 -9.534 1.00 0.00 H new ATOM 1753 N GLY A 117 25.873 -0.665 -6.864 1.00 0.00 N ATOM 1754 CA GLY A 117 25.854 -0.944 -5.418 1.00 0.00 C ATOM 1755 C GLY A 117 25.302 0.219 -4.585 1.00 0.00 C ATOM 1756 O GLY A 117 24.519 0.000 -3.664 1.00 0.00 O ATOM 0 H GLY A 117 26.809 -0.687 -7.269 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.250 -1.833 -5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.867 -1.172 -5.085 1.00 0.00 H new ATOM 1760 N GLN A 118 25.624 1.463 -4.954 1.00 0.00 N ATOM 1761 CA GLN A 118 25.105 2.656 -4.268 1.00 0.00 C ATOM 1762 C GLN A 118 23.619 2.895 -4.588 1.00 0.00 C ATOM 1763 O GLN A 118 22.822 3.080 -3.674 1.00 0.00 O ATOM 1764 CB GLN A 118 25.971 3.881 -4.614 1.00 0.00 C ATOM 1765 CG GLN A 118 27.419 3.784 -4.097 1.00 0.00 C ATOM 1766 CD GLN A 118 28.282 4.922 -4.647 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.515 5.934 -3.998 1.00 0.00 O ATOM 1768 NE2 GLN A 118 28.756 4.802 -5.868 1.00 0.00 N ATOM 0 H GLN A 118 26.249 1.673 -5.733 1.00 0.00 H new ATOM 0 HA GLN A 118 25.165 2.489 -3.193 1.00 0.00 H new ATOM 0 HB2 GLN A 118 25.989 4.008 -5.696 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.505 4.774 -4.197 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.422 3.816 -3.007 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.848 2.825 -4.388 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.563 3.960 -6.410 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.317 5.551 -6.273 1.00 0.00 H new ATOM 1777 N VAL A 119 23.201 2.804 -5.860 1.00 0.00 N ATOM 1778 CA VAL A 119 21.773 2.873 -6.249 1.00 0.00 C ATOM 1779 C VAL A 119 20.944 1.800 -5.524 1.00 0.00 C ATOM 1780 O VAL A 119 19.889 2.108 -4.969 1.00 0.00 O ATOM 1781 CB VAL A 119 21.594 2.759 -7.780 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.121 2.851 -8.179 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.303 3.891 -8.526 1.00 0.00 C ATOM 0 H VAL A 119 23.836 2.681 -6.649 1.00 0.00 H new ATOM 0 HA VAL A 119 21.404 3.852 -5.942 1.00 0.00 H new ATOM 0 HB VAL A 119 22.019 1.792 -8.048 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.032 2.767 -9.262 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.565 2.042 -7.705 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.715 3.809 -7.854 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.151 3.771 -9.599 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.894 4.850 -8.206 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.370 3.860 -8.305 1.00 0.00 H new ATOM 1793 N LYS A 120 21.450 0.558 -5.462 1.00 0.00 N ATOM 1794 CA LYS A 120 20.838 -0.547 -4.709 1.00 0.00 C ATOM 1795 C LYS A 120 20.682 -0.192 -3.229 1.00 0.00 C ATOM 1796 O LYS A 120 19.575 -0.274 -2.706 1.00 0.00 O ATOM 1797 CB LYS A 120 21.693 -1.816 -4.882 1.00 0.00 C ATOM 1798 CG LYS A 120 21.087 -2.992 -4.105 1.00 0.00 C ATOM 1799 CD LYS A 120 21.897 -4.282 -4.277 1.00 0.00 C ATOM 1800 CE LYS A 120 21.165 -5.431 -3.565 1.00 0.00 C ATOM 1801 NZ LYS A 120 21.632 -5.621 -2.161 1.00 0.00 N ATOM 0 H LYS A 120 22.309 0.290 -5.941 1.00 0.00 H new ATOM 0 HA LYS A 120 19.838 -0.730 -5.103 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.764 -2.071 -5.939 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.708 -1.627 -4.531 1.00 0.00 H new ATOM 0 HG2 LYS A 120 21.035 -2.737 -3.047 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.065 -3.160 -4.443 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.019 -4.512 -5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.897 -4.157 -3.861 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.094 -5.230 -3.564 1.00 0.00 H new ATOM 0 HE3 LYS A 120 21.316 -6.355 -4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.197 -6.478 -1.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.667 -5.721 -2.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 21.358 -4.796 -1.589 1.00 0.00 H new ATOM 1815 N GLU A 121 21.758 0.224 -2.558 1.00 0.00 N ATOM 1816 CA GLU A 121 21.713 0.488 -1.112 1.00 0.00 C ATOM 1817 C GLU A 121 20.798 1.657 -0.767 1.00 0.00 C ATOM 1818 O GLU A 121 20.047 1.553 0.200 1.00 0.00 O ATOM 1819 CB GLU A 121 23.123 0.587 -0.490 1.00 0.00 C ATOM 1820 CG GLU A 121 23.747 1.988 -0.449 1.00 0.00 C ATOM 1821 CD GLU A 121 25.159 1.942 0.164 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.277 1.877 1.413 1.00 0.00 O ATOM 1823 OE2 GLU A 121 26.162 1.988 -0.587 1.00 0.00 O ATOM 0 H GLU A 121 22.669 0.386 -2.987 1.00 0.00 H new ATOM 0 HA GLU A 121 21.255 -0.381 -0.640 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.076 0.203 0.529 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.791 -0.070 -1.048 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.797 2.398 -1.458 1.00 0.00 H new ATOM 0 HG3 GLU A 121 23.114 2.656 0.135 1.00 0.00 H new ATOM 1830 N ARG A 122 20.743 2.715 -1.587 1.00 0.00 N ATOM 1831 CA ARG A 122 19.786 3.804 -1.356 1.00 0.00 C ATOM 1832 C ARG A 122 18.345 3.309 -1.500 1.00 0.00 C ATOM 1833 O ARG A 122 17.548 3.587 -0.607 1.00 0.00 O ATOM 1834 CB ARG A 122 20.078 5.008 -2.261 1.00 0.00 C ATOM 1835 CG ARG A 122 21.426 5.715 -2.039 1.00 0.00 C ATOM 1836 CD ARG A 122 21.695 6.191 -0.608 1.00 0.00 C ATOM 1837 NE ARG A 122 20.652 7.112 -0.090 1.00 0.00 N ATOM 1838 CZ ARG A 122 20.569 7.576 1.149 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.454 7.276 2.058 1.00 0.00 N ATOM 1840 NH2 ARG A 122 19.583 8.339 1.519 1.00 0.00 N ATOM 0 H ARG A 122 21.340 2.839 -2.404 1.00 0.00 H new ATOM 0 HA ARG A 122 19.907 4.147 -0.328 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.032 4.676 -3.298 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.281 5.739 -2.125 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.226 5.035 -2.333 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.479 6.576 -2.705 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.763 5.324 0.049 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.662 6.693 -0.575 1.00 0.00 H new ATOM 0 HE ARG A 122 19.934 7.415 -0.748 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.239 6.668 1.825 1.00 0.00 H new ATOM 0 HH12 ARG A 122 21.362 7.650 3.003 1.00 0.00 H new ATOM 0 HH21 ARG A 122 18.855 8.591 0.851 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.538 8.685 2.477 1.00 0.00 H new ATOM 1854 N VAL A 123 18.023 2.498 -2.510 1.00 0.00 N ATOM 1855 CA VAL A 123 16.706 1.844 -2.616 1.00 0.00 C ATOM 1856 C VAL A 123 16.386 0.937 -1.427 1.00 0.00 C ATOM 1857 O VAL A 123 15.322 1.108 -0.842 1.00 0.00 O ATOM 1858 CB VAL A 123 16.561 1.101 -3.958 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.425 0.073 -3.961 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.320 2.100 -5.087 1.00 0.00 C ATOM 0 H VAL A 123 18.659 2.274 -3.275 1.00 0.00 H new ATOM 0 HA VAL A 123 15.962 2.640 -2.589 1.00 0.00 H new ATOM 0 HB VAL A 123 17.496 0.561 -4.108 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.378 -0.414 -4.935 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.609 -0.675 -3.190 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.479 0.576 -3.760 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.219 1.565 -6.031 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.407 2.660 -4.888 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.162 2.789 -5.149 1.00 0.00 H new ATOM 1870 N GLU A 124 17.258 0.010 -1.025 1.00 0.00 N ATOM 1871 CA GLU A 124 16.978 -0.854 0.136 1.00 0.00 C ATOM 1872 C GLU A 124 16.763 -0.061 1.424 1.00 0.00 C ATOM 1873 O GLU A 124 15.891 -0.406 2.224 1.00 0.00 O ATOM 1874 CB GLU A 124 18.095 -1.877 0.352 1.00 0.00 C ATOM 1875 CG GLU A 124 18.198 -2.877 -0.787 1.00 0.00 C ATOM 1876 CD GLU A 124 19.269 -3.932 -0.457 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.479 -3.646 -0.620 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.918 -5.066 -0.052 1.00 0.00 O ATOM 0 H GLU A 124 18.156 -0.165 -1.477 1.00 0.00 H new ATOM 0 HA GLU A 124 16.049 -1.374 -0.098 1.00 0.00 H new ATOM 0 HB2 GLU A 124 19.046 -1.355 0.459 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.918 -2.412 1.285 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.234 -3.361 -0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.454 -2.363 -1.713 1.00 0.00 H new ATOM 1885 N ASN A 125 17.497 1.041 1.595 1.00 0.00 N ATOM 1886 CA ASN A 125 17.331 1.890 2.767 1.00 0.00 C ATOM 1887 C ASN A 125 16.038 2.719 2.713 1.00 0.00 C ATOM 1888 O ASN A 125 15.462 3.021 3.753 1.00 0.00 O ATOM 1889 CB ASN A 125 18.612 2.714 3.005 1.00 0.00 C ATOM 1890 CG ASN A 125 18.417 4.222 3.004 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.395 4.879 4.034 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.267 4.810 1.838 1.00 0.00 N ATOM 0 H ASN A 125 18.208 1.362 0.937 1.00 0.00 H new ATOM 0 HA ASN A 125 17.198 1.260 3.646 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.043 2.419 3.962 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.340 2.457 2.235 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.131 5.820 1.790 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.286 4.256 0.981 1.00 0.00 H new ATOM 1899 N LEU A 126 15.567 3.060 1.510 1.00 0.00 N ATOM 1900 CA LEU A 126 14.323 3.790 1.301 1.00 0.00 C ATOM 1901 C LEU A 126 13.109 2.891 1.498 1.00 0.00 C ATOM 1902 O LEU A 126 12.222 3.248 2.267 1.00 0.00 O ATOM 1903 CB LEU A 126 14.366 4.433 -0.099 1.00 0.00 C ATOM 1904 CG LEU A 126 13.035 5.059 -0.558 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.577 6.200 0.348 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.219 5.583 -1.977 1.00 0.00 C ATOM 0 H LEU A 126 16.051 2.830 0.642 1.00 0.00 H new ATOM 0 HA LEU A 126 14.224 4.580 2.046 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.137 5.204 -0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.665 3.675 -0.823 1.00 0.00 H new ATOM 0 HG LEU A 126 12.265 4.289 -0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.635 6.603 -0.023 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.437 5.826 1.362 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.332 6.987 0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.288 6.031 -2.323 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.009 6.334 -1.988 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.492 4.759 -2.636 1.00 0.00 H new ATOM 1918 N ILE A 127 13.043 1.720 0.852 1.00 0.00 N ATOM 1919 CA ILE A 127 11.827 0.889 0.926 1.00 0.00 C ATOM 1920 C ILE A 127 11.523 0.452 2.355 1.00 0.00 C ATOM 1921 O ILE A 127 10.359 0.447 2.739 1.00 0.00 O ATOM 1922 CB ILE A 127 11.839 -0.298 -0.063 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.993 -1.302 0.173 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.806 0.260 -1.500 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.228 -2.293 -0.973 1.00 0.00 C ATOM 0 H ILE A 127 13.796 1.330 0.284 1.00 0.00 H new ATOM 0 HA ILE A 127 11.004 1.528 0.605 1.00 0.00 H new ATOM 0 HB ILE A 127 10.946 -0.898 0.111 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.913 -0.743 0.345 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.786 -1.864 1.084 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.814 -0.566 -2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.901 0.851 -1.640 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.680 0.890 -1.666 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.055 -2.955 -0.717 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.326 -2.884 -1.134 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.470 -1.745 -1.884 1.00 0.00 H new ATOM 1937 N ALA A 128 12.536 0.212 3.186 1.00 0.00 N ATOM 1938 CA ALA A 128 12.324 -0.122 4.593 1.00 0.00 C ATOM 1939 C ALA A 128 11.684 1.026 5.417 1.00 0.00 C ATOM 1940 O ALA A 128 11.072 0.765 6.456 1.00 0.00 O ATOM 1941 CB ALA A 128 13.672 -0.559 5.179 1.00 0.00 C ATOM 0 H ALA A 128 13.517 0.243 2.907 1.00 0.00 H new ATOM 0 HA ALA A 128 11.598 -0.933 4.652 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.546 -0.815 6.231 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.040 -1.429 4.635 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.390 0.256 5.088 1.00 0.00 H new ATOM 1947 N LYS A 129 11.780 2.284 4.948 1.00 0.00 N ATOM 1948 CA LYS A 129 11.141 3.471 5.554 1.00 0.00 C ATOM 1949 C LYS A 129 9.695 3.690 5.086 1.00 0.00 C ATOM 1950 O LYS A 129 8.860 4.088 5.895 1.00 0.00 O ATOM 1951 CB LYS A 129 11.971 4.734 5.253 1.00 0.00 C ATOM 1952 CG LYS A 129 13.383 4.694 5.857 1.00 0.00 C ATOM 1953 CD LYS A 129 14.229 5.876 5.347 1.00 0.00 C ATOM 1954 CE LYS A 129 15.680 5.843 5.857 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.789 6.096 7.324 1.00 0.00 N ATOM 0 H LYS A 129 12.320 2.511 4.113 1.00 0.00 H new ATOM 0 HA LYS A 129 11.106 3.283 6.627 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.049 4.860 4.173 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.444 5.607 5.638 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.319 4.729 6.945 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.869 3.754 5.596 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.233 5.869 4.257 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.762 6.810 5.658 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.118 4.871 5.628 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.265 6.590 5.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.789 6.061 7.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.398 7.034 7.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.256 5.369 7.842 1.00 0.00 H new ATOM 1969 N ILE A 130 9.406 3.438 3.800 1.00 0.00 N ATOM 1970 CA ILE A 130 8.122 3.810 3.156 1.00 0.00 C ATOM 1971 C ILE A 130 7.193 2.644 2.757 1.00 0.00 C ATOM 1972 O ILE A 130 6.098 2.904 2.253 1.00 0.00 O ATOM 1973 CB ILE A 130 8.329 4.842 2.020 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.256 4.409 0.868 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.886 6.148 2.610 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.718 3.289 -0.018 1.00 0.00 C ATOM 0 H ILE A 130 10.055 2.968 3.169 1.00 0.00 H new ATOM 0 HA ILE A 130 7.556 4.294 3.952 1.00 0.00 H new ATOM 0 HB ILE A 130 7.339 4.959 1.579 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.461 5.278 0.242 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.208 4.089 1.291 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.032 6.875 1.811 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.181 6.547 3.340 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.840 5.949 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.445 3.060 -0.797 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.541 2.400 0.587 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.782 3.607 -0.478 1.00 0.00 H new ATOM 1988 N SER A 131 7.587 1.383 2.987 1.00 0.00 N ATOM 1989 CA SER A 131 6.736 0.192 2.761 1.00 0.00 C ATOM 1990 C SER A 131 5.404 0.265 3.524 1.00 0.00 C ATOM 1991 O SER A 131 4.340 0.141 2.873 1.00 0.00 O ATOM 1992 CB SER A 131 7.468 -1.086 3.166 1.00 0.00 C ATOM 1993 OG SER A 131 8.519 -1.338 2.258 1.00 0.00 O ATOM 1994 OXT SER A 131 5.421 0.425 4.768 1.00 0.00 O ATOM 0 H SER A 131 8.516 1.152 3.340 1.00 0.00 H new ATOM 0 HA SER A 131 6.518 0.175 1.693 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.863 -0.986 4.177 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.774 -1.927 3.177 1.00 0.00 H new ATOM 0 HG SER A 131 9.299 -0.796 2.502 1.00 0.00 H new