USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 772 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.1 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 61:sc= 0.32 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.184 K(o=-0.18,f=-0.89) USER MOD Single : A 21 ASN : amide:sc= -1.04 K(o=-1,f=-0.31) USER MOD Single : A 23 CYS SG : rot 180:sc= -0.0422 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= -0.906 K(o=-0.91,f=-2.6!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -1.59! K(o=-1.6!,f=-0.9) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 99:sc= -1.35 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.245 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.530 14.152 39.946 1.00 0.00 N ATOM 2 CA GLY A 1 -8.892 14.404 38.665 1.00 0.00 C ATOM 3 C GLY A 1 -7.578 15.166 38.848 1.00 0.00 C ATOM 4 O GLY A 1 -7.004 15.170 39.936 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.740 13.137 40.036 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.892 14.443 40.715 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.415 14.695 40.006 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.701 13.458 38.158 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.564 14.978 38.027 1.00 0.00 H new ATOM 8 N SER A 2 -7.139 15.793 37.766 1.00 0.00 N ATOM 9 CA SER A 2 -5.903 16.556 37.793 1.00 0.00 C ATOM 10 C SER A 2 -5.887 17.568 36.645 1.00 0.00 C ATOM 11 O SER A 2 -5.787 18.772 36.876 1.00 0.00 O ATOM 12 CB SER A 2 -4.685 15.635 37.706 1.00 0.00 C ATOM 13 OG SER A 2 -3.461 16.364 37.739 1.00 0.00 O ATOM 0 H SER A 2 -7.618 15.788 36.865 1.00 0.00 H new ATOM 0 HA SER A 2 -5.852 17.091 38.741 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.707 14.926 38.533 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.736 15.053 36.786 1.00 0.00 H new ATOM 0 HG SER A 2 -2.707 15.740 37.683 1.00 0.00 H new ATOM 19 N SER A 3 -5.988 17.041 35.434 1.00 0.00 N ATOM 20 CA SER A 3 -5.987 17.883 34.249 1.00 0.00 C ATOM 21 C SER A 3 -6.093 17.018 32.992 1.00 0.00 C ATOM 22 O SER A 3 -5.980 15.795 33.065 1.00 0.00 O ATOM 23 CB SER A 3 -4.728 18.751 34.192 1.00 0.00 C ATOM 24 OG SER A 3 -5.007 20.116 34.489 1.00 0.00 O ATOM 0 H SER A 3 -6.071 16.042 35.247 1.00 0.00 H new ATOM 0 HA SER A 3 -6.851 18.546 34.299 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.992 18.369 34.900 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.283 18.680 33.200 1.00 0.00 H new ATOM 0 HG SER A 3 -5.374 20.185 35.395 1.00 0.00 H new ATOM 30 N GLY A 4 -6.310 17.686 31.869 1.00 0.00 N ATOM 31 CA GLY A 4 -6.432 16.993 30.598 1.00 0.00 C ATOM 32 C GLY A 4 -7.183 17.850 29.576 1.00 0.00 C ATOM 33 O GLY A 4 -8.244 18.396 29.878 1.00 0.00 O ATOM 0 H GLY A 4 -6.405 18.700 31.813 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.441 16.750 30.216 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.958 16.049 30.743 1.00 0.00 H new ATOM 37 N SER A 5 -6.603 17.943 28.389 1.00 0.00 N ATOM 38 CA SER A 5 -7.204 18.724 27.321 1.00 0.00 C ATOM 39 C SER A 5 -6.310 18.690 26.080 1.00 0.00 C ATOM 40 O SER A 5 -5.086 18.757 26.191 1.00 0.00 O ATOM 41 CB SER A 5 -7.444 20.169 27.764 1.00 0.00 C ATOM 42 OG SER A 5 -8.811 20.548 27.631 1.00 0.00 O ATOM 0 H SER A 5 -5.723 17.490 28.143 1.00 0.00 H new ATOM 0 HA SER A 5 -8.170 18.282 27.076 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.135 20.286 28.803 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.823 20.839 27.169 1.00 0.00 H new ATOM 0 HG SER A 5 -8.923 21.476 27.925 1.00 0.00 H new ATOM 48 N SER A 6 -6.955 18.587 24.928 1.00 0.00 N ATOM 49 CA SER A 6 -6.232 18.544 23.668 1.00 0.00 C ATOM 50 C SER A 6 -7.211 18.674 22.499 1.00 0.00 C ATOM 51 O SER A 6 -8.424 18.583 22.687 1.00 0.00 O ATOM 52 CB SER A 6 -5.423 17.252 23.541 1.00 0.00 C ATOM 53 OG SER A 6 -6.256 16.121 23.303 1.00 0.00 O ATOM 0 H SER A 6 -7.970 18.532 24.840 1.00 0.00 H new ATOM 0 HA SER A 6 -5.534 19.381 23.645 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.706 17.352 22.726 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.848 17.093 24.453 1.00 0.00 H new ATOM 0 HG SER A 6 -5.701 15.317 23.226 1.00 0.00 H new ATOM 59 N GLY A 7 -6.649 18.884 21.318 1.00 0.00 N ATOM 60 CA GLY A 7 -7.457 19.027 20.119 1.00 0.00 C ATOM 61 C GLY A 7 -6.648 19.661 18.985 1.00 0.00 C ATOM 62 O GLY A 7 -5.791 20.509 19.228 1.00 0.00 O ATOM 0 H GLY A 7 -5.643 18.959 21.166 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.825 18.050 19.806 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.330 19.642 20.336 1.00 0.00 H new ATOM 66 N MET A 8 -6.949 19.225 17.771 1.00 0.00 N ATOM 67 CA MET A 8 -6.261 19.739 16.599 1.00 0.00 C ATOM 68 C MET A 8 -6.823 19.120 15.317 1.00 0.00 C ATOM 69 O MET A 8 -7.203 17.950 15.304 1.00 0.00 O ATOM 70 CB MET A 8 -4.767 19.426 16.705 1.00 0.00 C ATOM 71 CG MET A 8 -3.927 20.687 16.496 1.00 0.00 C ATOM 72 SD MET A 8 -2.910 20.989 17.931 1.00 0.00 S ATOM 73 CE MET A 8 -1.386 21.471 17.136 1.00 0.00 C ATOM 0 H MET A 8 -7.660 18.521 17.573 1.00 0.00 H new ATOM 0 HA MET A 8 -6.413 20.817 16.556 1.00 0.00 H new ATOM 0 HB2 MET A 8 -4.550 18.998 17.684 1.00 0.00 H new ATOM 0 HB3 MET A 8 -4.495 18.676 15.962 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.299 20.573 15.613 1.00 0.00 H new ATOM 0 HG3 MET A 8 -4.579 21.542 16.316 1.00 0.00 H new ATOM 0 HE1 MET A 8 -0.636 21.697 17.894 1.00 0.00 H new ATOM 0 HE2 MET A 8 -1.031 20.656 16.505 1.00 0.00 H new ATOM 0 HE3 MET A 8 -1.559 22.355 16.523 1.00 0.00 H new ATOM 83 N SER A 9 -6.857 19.932 14.271 1.00 0.00 N ATOM 84 CA SER A 9 -7.366 19.479 12.988 1.00 0.00 C ATOM 85 C SER A 9 -7.287 20.613 11.964 1.00 0.00 C ATOM 86 O SER A 9 -7.204 21.783 12.333 1.00 0.00 O ATOM 87 CB SER A 9 -8.805 18.975 13.113 1.00 0.00 C ATOM 88 OG SER A 9 -9.084 17.922 12.194 1.00 0.00 O ATOM 0 H SER A 9 -6.540 20.901 14.286 1.00 0.00 H new ATOM 0 HA SER A 9 -6.748 18.648 12.649 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.979 18.624 14.130 1.00 0.00 H new ATOM 0 HB3 SER A 9 -9.495 19.801 12.938 1.00 0.00 H new ATOM 0 HG SER A 9 -10.012 17.627 12.307 1.00 0.00 H new ATOM 94 N GLY A 10 -7.316 20.226 10.697 1.00 0.00 N ATOM 95 CA GLY A 10 -7.250 21.195 9.617 1.00 0.00 C ATOM 96 C GLY A 10 -6.766 20.540 8.321 1.00 0.00 C ATOM 97 O GLY A 10 -5.934 19.634 8.352 1.00 0.00 O ATOM 0 H GLY A 10 -7.384 19.254 10.395 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.234 21.637 9.460 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -6.576 22.006 9.892 1.00 0.00 H new ATOM 101 N GLY A 11 -7.308 21.024 7.213 1.00 0.00 N ATOM 102 CA GLY A 11 -6.942 20.497 5.910 1.00 0.00 C ATOM 103 C GLY A 11 -8.186 20.172 5.081 1.00 0.00 C ATOM 104 O GLY A 11 -9.305 20.214 5.591 1.00 0.00 O ATOM 0 H GLY A 11 -7.998 21.775 7.191 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.327 21.224 5.380 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -6.338 19.598 6.034 1.00 0.00 H new ATOM 108 N GLY A 12 -7.949 19.854 3.816 1.00 0.00 N ATOM 109 CA GLY A 12 -9.037 19.522 2.912 1.00 0.00 C ATOM 110 C GLY A 12 -9.003 18.040 2.535 1.00 0.00 C ATOM 111 O GLY A 12 -7.942 17.497 2.229 1.00 0.00 O ATOM 0 H GLY A 12 -7.020 19.819 3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -9.991 19.759 3.383 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -8.965 20.132 2.011 1.00 0.00 H new ATOM 115 N VAL A 13 -10.177 17.426 2.569 1.00 0.00 N ATOM 116 CA VAL A 13 -10.295 16.017 2.235 1.00 0.00 C ATOM 117 C VAL A 13 -11.213 15.861 1.021 1.00 0.00 C ATOM 118 O VAL A 13 -12.412 15.628 1.171 1.00 0.00 O ATOM 119 CB VAL A 13 -10.777 15.229 3.454 1.00 0.00 C ATOM 120 CG1 VAL A 13 -10.975 13.751 3.109 1.00 0.00 C ATOM 121 CG2 VAL A 13 -9.811 15.392 4.630 1.00 0.00 C ATOM 0 H VAL A 13 -11.055 17.879 2.823 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.323 15.606 1.963 1.00 0.00 H new ATOM 0 HB VAL A 13 -11.743 15.636 3.754 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -11.318 13.214 3.993 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.718 13.659 2.317 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.030 13.327 2.770 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.177 14.822 5.484 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.825 15.025 4.345 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.742 16.446 4.901 1.00 0.00 H new ATOM 131 N ILE A 14 -10.616 15.995 -0.154 1.00 0.00 N ATOM 132 CA ILE A 14 -11.365 15.871 -1.393 1.00 0.00 C ATOM 133 C ILE A 14 -11.564 14.389 -1.718 1.00 0.00 C ATOM 134 O ILE A 14 -10.668 13.576 -1.497 1.00 0.00 O ATOM 135 CB ILE A 14 -10.683 16.660 -2.512 1.00 0.00 C ATOM 136 CG1 ILE A 14 -11.615 16.822 -3.715 1.00 0.00 C ATOM 137 CG2 ILE A 14 -9.350 16.018 -2.902 1.00 0.00 C ATOM 138 CD1 ILE A 14 -11.055 17.841 -4.709 1.00 0.00 C ATOM 0 H ILE A 14 -9.622 16.188 -0.274 1.00 0.00 H new ATOM 0 HA ILE A 14 -12.357 16.309 -1.284 1.00 0.00 H new ATOM 0 HB ILE A 14 -10.462 17.660 -2.139 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.746 15.860 -4.210 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -12.600 17.143 -3.376 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -8.886 16.599 -3.699 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -8.689 15.998 -2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -9.524 15.000 -3.249 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.736 17.937 -5.554 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -10.948 18.808 -4.217 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -10.081 17.505 -5.065 1.00 0.00 H new ATOM 150 N ARG A 15 -12.743 14.083 -2.238 1.00 0.00 N ATOM 151 CA ARG A 15 -13.071 12.714 -2.596 1.00 0.00 C ATOM 152 C ARG A 15 -11.896 12.061 -3.327 1.00 0.00 C ATOM 153 O ARG A 15 -11.726 10.844 -3.273 1.00 0.00 O ATOM 154 CB ARG A 15 -14.312 12.659 -3.489 1.00 0.00 C ATOM 155 CG ARG A 15 -14.338 13.838 -4.464 1.00 0.00 C ATOM 156 CD ARG A 15 -14.872 13.406 -5.831 1.00 0.00 C ATOM 157 NE ARG A 15 -16.005 14.272 -6.228 1.00 0.00 N ATOM 158 CZ ARG A 15 -17.255 14.134 -5.763 1.00 0.00 C ATOM 159 NH1 ARG A 15 -17.539 13.164 -4.883 1.00 0.00 N ATOM 160 NH2 ARG A 15 -18.220 14.965 -6.179 1.00 0.00 N ATOM 0 H ARG A 15 -13.484 14.760 -2.420 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.278 12.171 -1.674 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -14.323 11.722 -4.046 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -15.210 12.673 -2.871 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -14.963 14.635 -4.060 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -13.333 14.246 -4.574 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -14.079 13.466 -6.576 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -15.195 12.366 -5.792 1.00 0.00 H new ATOM 0 HE ARG A 15 -15.823 15.020 -6.897 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -16.804 12.531 -4.567 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -18.490 13.059 -4.529 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -18.004 15.703 -6.849 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -19.171 14.860 -5.825 1.00 0.00 H new ATOM 174 N GLY A 16 -11.116 12.898 -3.994 1.00 0.00 N ATOM 175 CA GLY A 16 -9.962 12.418 -4.735 1.00 0.00 C ATOM 176 C GLY A 16 -10.395 11.600 -5.954 1.00 0.00 C ATOM 177 O GLY A 16 -11.558 11.215 -6.066 1.00 0.00 O ATOM 0 H GLY A 16 -11.260 13.907 -4.037 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.355 13.264 -5.057 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.337 11.806 -4.085 1.00 0.00 H new ATOM 181 N PRO A 17 -9.411 11.352 -6.859 1.00 0.00 N ATOM 182 CA PRO A 17 -9.679 10.587 -8.065 1.00 0.00 C ATOM 183 C PRO A 17 -9.811 9.096 -7.750 1.00 0.00 C ATOM 184 O PRO A 17 -8.905 8.315 -8.034 1.00 0.00 O ATOM 185 CB PRO A 17 -8.516 10.897 -8.993 1.00 0.00 C ATOM 186 CG PRO A 17 -7.411 11.450 -8.108 1.00 0.00 C ATOM 187 CD PRO A 17 -8.023 11.793 -6.759 1.00 0.00 C ATOM 0 HA PRO A 17 -10.627 10.855 -8.532 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -8.185 10.000 -9.517 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -8.806 11.622 -9.754 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -6.613 10.717 -7.990 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -6.966 12.335 -8.562 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -7.503 11.284 -5.947 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -7.961 12.862 -6.556 1.00 0.00 H new ATOM 195 N ALA A 18 -10.948 8.746 -7.166 1.00 0.00 N ATOM 196 CA ALA A 18 -11.211 7.362 -6.809 1.00 0.00 C ATOM 197 C ALA A 18 -12.143 6.740 -7.851 1.00 0.00 C ATOM 198 O ALA A 18 -12.687 7.442 -8.702 1.00 0.00 O ATOM 199 CB ALA A 18 -11.794 7.301 -5.396 1.00 0.00 C ATOM 0 H ALA A 18 -11.697 9.397 -6.931 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.287 6.784 -6.806 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.991 6.263 -5.128 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -11.082 7.729 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.724 7.868 -5.362 1.00 0.00 H new ATOM 205 N GLY A 19 -12.298 5.428 -7.751 1.00 0.00 N ATOM 206 CA GLY A 19 -13.155 4.702 -8.674 1.00 0.00 C ATOM 207 C GLY A 19 -14.383 4.140 -7.956 1.00 0.00 C ATOM 208 O GLY A 19 -15.163 4.891 -7.372 1.00 0.00 O ATOM 0 H GLY A 19 -11.845 4.848 -7.045 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -13.472 5.365 -9.479 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -12.594 3.888 -9.133 1.00 0.00 H new ATOM 212 N ASN A 20 -14.517 2.824 -8.023 1.00 0.00 N ATOM 213 CA ASN A 20 -15.637 2.152 -7.386 1.00 0.00 C ATOM 214 C ASN A 20 -15.127 1.331 -6.200 1.00 0.00 C ATOM 215 O ASN A 20 -15.561 1.535 -5.067 1.00 0.00 O ATOM 216 CB ASN A 20 -16.331 1.196 -8.358 1.00 0.00 C ATOM 217 CG ASN A 20 -17.816 1.536 -8.495 1.00 0.00 C ATOM 218 OD1 ASN A 20 -18.453 2.032 -7.580 1.00 0.00 O ATOM 219 ND2 ASN A 20 -18.331 1.243 -9.686 1.00 0.00 N ATOM 0 H ASN A 20 -13.868 2.205 -8.509 1.00 0.00 H new ATOM 0 HA ASN A 20 -16.346 2.914 -7.061 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -15.850 1.252 -9.334 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -16.220 0.170 -8.006 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -19.315 1.433 -9.877 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -17.742 0.829 -10.408 1.00 0.00 H new ATOM 226 N ASN A 21 -14.212 0.421 -6.501 1.00 0.00 N ATOM 227 CA ASN A 21 -13.639 -0.432 -5.473 1.00 0.00 C ATOM 228 C ASN A 21 -12.273 -0.939 -5.942 1.00 0.00 C ATOM 229 O ASN A 21 -12.114 -1.324 -7.099 1.00 0.00 O ATOM 230 CB ASN A 21 -14.528 -1.647 -5.206 1.00 0.00 C ATOM 231 CG ASN A 21 -15.360 -1.449 -3.937 1.00 0.00 C ATOM 232 OD1 ASN A 21 -15.014 -1.905 -2.859 1.00 0.00 O ATOM 233 ND2 ASN A 21 -16.473 -0.745 -4.124 1.00 0.00 N ATOM 0 H ASN A 21 -13.853 0.256 -7.441 1.00 0.00 H new ATOM 0 HA ASN A 21 -13.548 0.155 -4.559 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -15.189 -1.812 -6.057 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -13.910 -2.539 -5.105 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -17.096 -0.558 -3.338 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -16.703 -0.392 -5.053 1.00 0.00 H new ATOM 240 N ASP A 22 -11.323 -0.923 -5.018 1.00 0.00 N ATOM 241 CA ASP A 22 -9.977 -1.377 -5.322 1.00 0.00 C ATOM 242 C ASP A 22 -9.458 -2.233 -4.165 1.00 0.00 C ATOM 243 O ASP A 22 -8.788 -1.727 -3.266 1.00 0.00 O ATOM 244 CB ASP A 22 -9.023 -0.194 -5.499 1.00 0.00 C ATOM 245 CG ASP A 22 -9.032 0.441 -6.891 1.00 0.00 C ATOM 246 OD1 ASP A 22 -9.907 1.304 -7.116 1.00 0.00 O ATOM 247 OD2 ASP A 22 -8.162 0.048 -7.699 1.00 0.00 O ATOM 0 H ASP A 22 -11.459 -0.603 -4.059 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.016 -1.950 -6.248 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.277 0.571 -4.765 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -8.010 -0.527 -5.275 1.00 0.00 H new ATOM 252 N CYS A 23 -9.788 -3.515 -4.224 1.00 0.00 N ATOM 253 CA CYS A 23 -9.364 -4.446 -3.193 1.00 0.00 C ATOM 254 C CYS A 23 -7.879 -4.209 -2.913 1.00 0.00 C ATOM 255 O CYS A 23 -7.420 -4.387 -1.785 1.00 0.00 O ATOM 256 CB CYS A 23 -9.646 -5.896 -3.589 1.00 0.00 C ATOM 257 SG CYS A 23 -11.446 -6.149 -3.800 1.00 0.00 S ATOM 0 H CYS A 23 -10.345 -3.931 -4.971 1.00 0.00 H new ATOM 0 HA CYS A 23 -9.937 -4.270 -2.283 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -9.126 -6.136 -4.516 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -9.263 -6.572 -2.824 1.00 0.00 H new ATOM 0 HG CYS A 23 -11.674 -7.383 -4.139 1.00 0.00 H new ATOM 263 N ARG A 24 -7.169 -3.810 -3.958 1.00 0.00 N ATOM 264 CA ARG A 24 -5.745 -3.547 -3.839 1.00 0.00 C ATOM 265 C ARG A 24 -5.506 -2.088 -3.448 1.00 0.00 C ATOM 266 O ARG A 24 -5.913 -1.174 -4.164 1.00 0.00 O ATOM 267 CB ARG A 24 -5.018 -3.842 -5.153 1.00 0.00 C ATOM 268 CG ARG A 24 -5.638 -3.055 -6.310 1.00 0.00 C ATOM 269 CD ARG A 24 -6.198 -3.998 -7.376 1.00 0.00 C ATOM 270 NE ARG A 24 -5.900 -3.470 -8.726 1.00 0.00 N ATOM 271 CZ ARG A 24 -6.067 -4.167 -9.859 1.00 0.00 C ATOM 272 NH1 ARG A 24 -6.530 -5.423 -9.811 1.00 0.00 N ATOM 273 NH2 ARG A 24 -5.770 -3.607 -11.039 1.00 0.00 N ATOM 0 H ARG A 24 -7.553 -3.662 -4.891 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.350 -4.204 -3.064 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -3.964 -3.583 -5.056 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.066 -4.910 -5.368 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.434 -2.413 -5.933 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -4.887 -2.403 -6.755 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -5.762 -4.990 -7.260 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -7.275 -4.106 -7.248 1.00 0.00 H new ATOM 0 HE ARG A 24 -5.545 -2.516 -8.799 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -6.756 -5.849 -8.912 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.657 -5.953 -10.673 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -5.417 -2.651 -11.075 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.897 -4.137 -11.901 1.00 0.00 H new ATOM 287 N ILE A 25 -4.846 -1.913 -2.312 1.00 0.00 N ATOM 288 CA ILE A 25 -4.548 -0.580 -1.817 1.00 0.00 C ATOM 289 C ILE A 25 -3.057 -0.291 -2.007 1.00 0.00 C ATOM 290 O ILE A 25 -2.243 -1.212 -2.044 1.00 0.00 O ATOM 291 CB ILE A 25 -5.024 -0.426 -0.371 1.00 0.00 C ATOM 292 CG1 ILE A 25 -4.413 -1.504 0.526 1.00 0.00 C ATOM 293 CG2 ILE A 25 -6.553 -0.417 -0.295 1.00 0.00 C ATOM 294 CD1 ILE A 25 -4.606 -1.163 2.004 1.00 0.00 C ATOM 0 H ILE A 25 -4.509 -2.673 -1.720 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.094 0.169 -2.390 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.677 0.538 0.001 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.874 -2.467 0.308 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.350 -1.603 0.308 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.865 -0.306 0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.942 0.416 -0.881 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.943 -1.354 -0.693 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.162 -1.946 2.619 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.123 -0.211 2.224 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.671 -1.089 2.224 1.00 0.00 H new ATOM 306 N TYR A 26 -2.746 0.991 -2.123 1.00 0.00 N ATOM 307 CA TYR A 26 -1.368 1.413 -2.308 1.00 0.00 C ATOM 308 C TYR A 26 -0.874 2.220 -1.106 1.00 0.00 C ATOM 309 O TYR A 26 -1.549 3.145 -0.656 1.00 0.00 O ATOM 310 CB TYR A 26 -1.364 2.311 -3.547 1.00 0.00 C ATOM 311 CG TYR A 26 -0.054 3.071 -3.761 1.00 0.00 C ATOM 312 CD1 TYR A 26 1.026 2.435 -4.340 1.00 0.00 C ATOM 313 CD2 TYR A 26 0.049 4.392 -3.375 1.00 0.00 C ATOM 314 CE1 TYR A 26 2.260 3.150 -4.541 1.00 0.00 C ATOM 315 CE2 TYR A 26 1.283 5.107 -3.577 1.00 0.00 C ATOM 316 CZ TYR A 26 2.327 4.451 -4.150 1.00 0.00 C ATOM 317 OH TYR A 26 3.492 5.126 -4.340 1.00 0.00 O ATOM 0 H TYR A 26 -3.425 1.752 -2.092 1.00 0.00 H new ATOM 0 HA TYR A 26 -0.714 0.548 -2.417 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -1.565 1.700 -4.427 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.180 3.029 -3.465 1.00 0.00 H new ATOM 0 HD1 TYR A 26 0.946 1.401 -4.642 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -0.796 4.890 -2.922 1.00 0.00 H new ATOM 0 HE1 TYR A 26 3.113 2.664 -4.992 1.00 0.00 H new ATOM 0 HE2 TYR A 26 1.377 6.141 -3.280 1.00 0.00 H new ATOM 0 HH TYR A 26 3.394 6.045 -4.015 1.00 0.00 H new ATOM 327 N VAL A 27 0.298 1.840 -0.619 1.00 0.00 N ATOM 328 CA VAL A 27 0.889 2.518 0.522 1.00 0.00 C ATOM 329 C VAL A 27 2.115 3.308 0.062 1.00 0.00 C ATOM 330 O VAL A 27 3.017 2.753 -0.563 1.00 0.00 O ATOM 331 CB VAL A 27 1.210 1.505 1.624 1.00 0.00 C ATOM 332 CG1 VAL A 27 1.731 2.207 2.879 1.00 0.00 C ATOM 333 CG2 VAL A 27 -0.011 0.640 1.945 1.00 0.00 C ATOM 0 H VAL A 27 0.854 1.071 -0.994 1.00 0.00 H new ATOM 0 HA VAL A 27 0.184 3.231 0.949 1.00 0.00 H new ATOM 0 HB VAL A 27 1.999 0.848 1.257 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.951 1.465 3.646 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.639 2.759 2.637 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.974 2.898 3.250 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.243 -0.071 2.731 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.829 1.276 2.283 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.318 0.098 1.051 1.00 0.00 H new ATOM 343 N GLY A 28 2.109 4.592 0.389 1.00 0.00 N ATOM 344 CA GLY A 28 3.210 5.465 0.017 1.00 0.00 C ATOM 345 C GLY A 28 3.865 6.079 1.256 1.00 0.00 C ATOM 346 O GLY A 28 3.474 5.780 2.383 1.00 0.00 O ATOM 0 H GLY A 28 1.359 5.049 0.908 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.951 4.901 -0.549 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.846 6.257 -0.637 1.00 0.00 H new ATOM 350 N ASN A 29 4.852 6.927 1.005 1.00 0.00 N ATOM 351 CA ASN A 29 5.565 7.586 2.085 1.00 0.00 C ATOM 352 C ASN A 29 6.012 6.540 3.108 1.00 0.00 C ATOM 353 O ASN A 29 5.632 6.608 4.276 1.00 0.00 O ATOM 354 CB ASN A 29 4.668 8.596 2.802 1.00 0.00 C ATOM 355 CG ASN A 29 4.325 9.773 1.886 1.00 0.00 C ATOM 356 OD1 ASN A 29 3.513 9.672 0.981 1.00 0.00 O ATOM 357 ND2 ASN A 29 4.988 10.890 2.170 1.00 0.00 N ATOM 0 H ASN A 29 5.174 7.173 0.069 1.00 0.00 H new ATOM 0 HA ASN A 29 6.421 8.106 1.656 1.00 0.00 H new ATOM 0 HB2 ASN A 29 3.751 8.106 3.129 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.170 8.962 3.698 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.830 11.732 1.616 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.654 10.905 2.942 1.00 0.00 H new ATOM 364 N LEU A 30 6.811 5.597 2.633 1.00 0.00 N ATOM 365 CA LEU A 30 7.313 4.538 3.492 1.00 0.00 C ATOM 366 C LEU A 30 8.779 4.815 3.833 1.00 0.00 C ATOM 367 O LEU A 30 9.452 5.566 3.129 1.00 0.00 O ATOM 368 CB LEU A 30 7.080 3.170 2.848 1.00 0.00 C ATOM 369 CG LEU A 30 5.640 2.654 2.872 1.00 0.00 C ATOM 370 CD1 LEU A 30 5.425 1.579 1.804 1.00 0.00 C ATOM 371 CD2 LEU A 30 5.258 2.159 4.268 1.00 0.00 C ATOM 0 H LEU A 30 7.124 5.544 1.664 1.00 0.00 H new ATOM 0 HA LEU A 30 6.764 4.519 4.434 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.411 3.218 1.810 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.715 2.441 3.351 1.00 0.00 H new ATOM 0 HG LEU A 30 4.976 3.484 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.393 1.229 1.842 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.629 1.999 0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.099 0.743 1.989 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.230 1.798 4.257 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.924 1.348 4.561 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.347 2.978 4.982 1.00 0.00 H new ATOM 383 N PRO A 31 9.241 4.178 4.942 1.00 0.00 N ATOM 384 CA PRO A 31 10.615 4.349 5.385 1.00 0.00 C ATOM 385 C PRO A 31 11.580 3.568 4.490 1.00 0.00 C ATOM 386 O PRO A 31 11.159 2.711 3.715 1.00 0.00 O ATOM 387 CB PRO A 31 10.625 3.872 6.828 1.00 0.00 C ATOM 388 CG PRO A 31 9.375 3.023 6.995 1.00 0.00 C ATOM 389 CD PRO A 31 8.473 3.281 5.800 1.00 0.00 C ATOM 0 HA PRO A 31 10.953 5.383 5.319 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.523 3.292 7.041 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.619 4.716 7.518 1.00 0.00 H new ATOM 0 HG2 PRO A 31 9.636 1.967 7.055 1.00 0.00 H new ATOM 0 HG3 PRO A 31 8.862 3.277 7.922 1.00 0.00 H new ATOM 0 HD2 PRO A 31 8.226 2.354 5.283 1.00 0.00 H new ATOM 0 HD3 PRO A 31 7.531 3.736 6.106 1.00 0.00 H new ATOM 397 N PRO A 32 12.891 3.902 4.632 1.00 0.00 N ATOM 398 CA PRO A 32 13.920 3.242 3.846 1.00 0.00 C ATOM 399 C PRO A 32 14.187 1.829 4.369 1.00 0.00 C ATOM 400 O PRO A 32 14.635 0.961 3.621 1.00 0.00 O ATOM 401 CB PRO A 32 15.134 4.151 3.945 1.00 0.00 C ATOM 402 CG PRO A 32 14.891 5.042 5.152 1.00 0.00 C ATOM 403 CD PRO A 32 13.427 4.912 5.539 1.00 0.00 C ATOM 0 HA PRO A 32 13.629 3.101 2.805 1.00 0.00 H new ATOM 0 HB2 PRO A 32 16.048 3.570 4.066 1.00 0.00 H new ATOM 0 HB3 PRO A 32 15.252 4.745 3.039 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.533 4.745 5.981 1.00 0.00 H new ATOM 0 HG3 PRO A 32 15.133 6.078 4.917 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.318 4.607 6.580 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.903 5.861 5.429 1.00 0.00 H new ATOM 411 N ASP A 33 13.902 1.642 5.649 1.00 0.00 N ATOM 412 CA ASP A 33 14.106 0.350 6.281 1.00 0.00 C ATOM 413 C ASP A 33 12.747 -0.287 6.581 1.00 0.00 C ATOM 414 O ASP A 33 12.494 -0.717 7.705 1.00 0.00 O ATOM 415 CB ASP A 33 14.862 0.496 7.603 1.00 0.00 C ATOM 416 CG ASP A 33 15.723 -0.708 7.992 1.00 0.00 C ATOM 417 OD1 ASP A 33 16.724 -0.943 7.282 1.00 0.00 O ATOM 418 OD2 ASP A 33 15.360 -1.366 8.990 1.00 0.00 O ATOM 0 H ASP A 33 13.531 2.364 6.266 1.00 0.00 H new ATOM 0 HA ASP A 33 14.688 -0.270 5.599 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.501 1.377 7.543 1.00 0.00 H new ATOM 0 HB3 ASP A 33 14.140 0.680 8.399 1.00 0.00 H new ATOM 423 N ILE A 34 11.909 -0.325 5.556 1.00 0.00 N ATOM 424 CA ILE A 34 10.582 -0.902 5.696 1.00 0.00 C ATOM 425 C ILE A 34 10.605 -2.350 5.203 1.00 0.00 C ATOM 426 O ILE A 34 11.458 -2.722 4.398 1.00 0.00 O ATOM 427 CB ILE A 34 9.542 -0.029 4.992 1.00 0.00 C ATOM 428 CG1 ILE A 34 8.123 -0.422 5.409 1.00 0.00 C ATOM 429 CG2 ILE A 34 9.726 -0.073 3.474 1.00 0.00 C ATOM 430 CD1 ILE A 34 7.835 0.009 6.848 1.00 0.00 C ATOM 0 H ILE A 34 12.122 0.034 4.625 1.00 0.00 H new ATOM 0 HA ILE A 34 10.286 -0.927 6.745 1.00 0.00 H new ATOM 0 HB ILE A 34 9.695 1.004 5.305 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.401 0.040 4.736 1.00 0.00 H new ATOM 0 HG13 ILE A 34 7.999 -1.501 5.317 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.974 0.556 2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.720 0.293 3.217 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.615 -1.099 3.124 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.820 -0.282 7.119 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.543 -0.474 7.521 1.00 0.00 H new ATOM 0 HD13 ILE A 34 7.936 1.091 6.931 1.00 0.00 H new ATOM 442 N ARG A 35 9.658 -3.128 5.705 1.00 0.00 N ATOM 443 CA ARG A 35 9.559 -4.527 5.326 1.00 0.00 C ATOM 444 C ARG A 35 8.130 -4.859 4.890 1.00 0.00 C ATOM 445 O ARG A 35 7.168 -4.375 5.485 1.00 0.00 O ATOM 446 CB ARG A 35 9.957 -5.442 6.486 1.00 0.00 C ATOM 447 CG ARG A 35 11.478 -5.502 6.640 1.00 0.00 C ATOM 448 CD ARG A 35 11.878 -6.471 7.754 1.00 0.00 C ATOM 449 NE ARG A 35 13.287 -6.240 8.143 1.00 0.00 N ATOM 450 CZ ARG A 35 14.342 -6.693 7.451 1.00 0.00 C ATOM 451 NH1 ARG A 35 14.153 -7.404 6.331 1.00 0.00 N ATOM 452 NH2 ARG A 35 15.585 -6.436 7.880 1.00 0.00 N ATOM 0 H ARG A 35 8.952 -2.816 6.372 1.00 0.00 H new ATOM 0 HA ARG A 35 10.244 -4.695 4.495 1.00 0.00 H new ATOM 0 HB2 ARG A 35 9.508 -5.079 7.411 1.00 0.00 H new ATOM 0 HB3 ARG A 35 9.565 -6.445 6.314 1.00 0.00 H new ATOM 0 HG2 ARG A 35 11.930 -5.817 5.700 1.00 0.00 H new ATOM 0 HG3 ARG A 35 11.864 -4.507 6.862 1.00 0.00 H new ATOM 0 HD2 ARG A 35 11.227 -6.335 8.617 1.00 0.00 H new ATOM 0 HD3 ARG A 35 11.749 -7.499 7.417 1.00 0.00 H new ATOM 0 HE ARG A 35 13.467 -5.702 8.991 1.00 0.00 H new ATOM 0 HH11 ARG A 35 13.207 -7.600 6.005 1.00 0.00 H new ATOM 0 HH12 ARG A 35 14.956 -7.749 5.804 1.00 0.00 H new ATOM 0 HH21 ARG A 35 15.729 -5.896 8.733 1.00 0.00 H new ATOM 0 HH22 ARG A 35 16.388 -6.781 7.353 1.00 0.00 H new ATOM 466 N THR A 36 8.037 -5.682 3.856 1.00 0.00 N ATOM 467 CA THR A 36 6.742 -6.084 3.334 1.00 0.00 C ATOM 468 C THR A 36 5.913 -6.761 4.428 1.00 0.00 C ATOM 469 O THR A 36 4.684 -6.733 4.386 1.00 0.00 O ATOM 470 CB THR A 36 6.980 -6.975 2.113 1.00 0.00 C ATOM 471 OG1 THR A 36 7.566 -6.100 1.154 1.00 0.00 O ATOM 472 CG2 THR A 36 5.675 -7.428 1.456 1.00 0.00 C ATOM 0 H THR A 36 8.837 -6.081 3.366 1.00 0.00 H new ATOM 0 HA THR A 36 6.159 -5.220 3.015 1.00 0.00 H new ATOM 0 HB THR A 36 7.560 -7.849 2.409 1.00 0.00 H new ATOM 0 HG1 THR A 36 7.755 -6.597 0.331 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.900 -8.057 0.595 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.083 -7.995 2.175 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.110 -6.555 1.129 1.00 0.00 H new ATOM 480 N LYS A 37 6.619 -7.352 5.380 1.00 0.00 N ATOM 481 CA LYS A 37 5.964 -8.034 6.483 1.00 0.00 C ATOM 482 C LYS A 37 5.401 -6.997 7.457 1.00 0.00 C ATOM 483 O LYS A 37 4.211 -7.012 7.766 1.00 0.00 O ATOM 484 CB LYS A 37 6.918 -9.037 7.136 1.00 0.00 C ATOM 485 CG LYS A 37 6.143 -10.130 7.874 1.00 0.00 C ATOM 486 CD LYS A 37 6.449 -10.102 9.373 1.00 0.00 C ATOM 487 CE LYS A 37 7.564 -11.089 9.723 1.00 0.00 C ATOM 488 NZ LYS A 37 8.889 -10.501 9.425 1.00 0.00 N ATOM 0 H LYS A 37 7.638 -7.373 5.411 1.00 0.00 H new ATOM 0 HA LYS A 37 5.121 -8.621 6.120 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.554 -9.488 6.374 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.575 -8.518 7.834 1.00 0.00 H new ATOM 0 HG2 LYS A 37 5.073 -9.993 7.715 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.404 -11.106 7.464 1.00 0.00 H new ATOM 0 HD2 LYS A 37 6.743 -9.095 9.669 1.00 0.00 H new ATOM 0 HD3 LYS A 37 5.549 -10.349 9.936 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.506 -11.353 10.779 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.433 -12.011 9.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.635 -11.184 9.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.947 -10.271 8.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.018 -9.634 9.985 1.00 0.00 H new ATOM 502 N ASP A 38 6.284 -6.121 7.914 1.00 0.00 N ATOM 503 CA ASP A 38 5.891 -5.079 8.846 1.00 0.00 C ATOM 504 C ASP A 38 4.661 -4.350 8.301 1.00 0.00 C ATOM 505 O ASP A 38 3.791 -3.935 9.065 1.00 0.00 O ATOM 506 CB ASP A 38 7.009 -4.050 9.027 1.00 0.00 C ATOM 507 CG ASP A 38 8.321 -4.611 9.579 1.00 0.00 C ATOM 508 OD1 ASP A 38 8.512 -5.840 9.449 1.00 0.00 O ATOM 509 OD2 ASP A 38 9.103 -3.799 10.118 1.00 0.00 O ATOM 0 H ASP A 38 7.271 -6.112 7.656 1.00 0.00 H new ATOM 0 HA ASP A 38 5.676 -5.549 9.805 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.209 -3.580 8.064 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.656 -3.266 9.697 1.00 0.00 H new ATOM 514 N ILE A 39 4.629 -4.215 6.983 1.00 0.00 N ATOM 515 CA ILE A 39 3.521 -3.544 6.326 1.00 0.00 C ATOM 516 C ILE A 39 2.303 -4.471 6.313 1.00 0.00 C ATOM 517 O ILE A 39 1.165 -4.006 6.275 1.00 0.00 O ATOM 518 CB ILE A 39 3.937 -3.056 4.937 1.00 0.00 C ATOM 519 CG1 ILE A 39 5.165 -2.147 5.020 1.00 0.00 C ATOM 520 CG2 ILE A 39 2.768 -2.376 4.221 1.00 0.00 C ATOM 521 CD1 ILE A 39 5.783 -1.932 3.638 1.00 0.00 C ATOM 0 H ILE A 39 5.353 -4.559 6.353 1.00 0.00 H new ATOM 0 HA ILE A 39 3.235 -2.650 6.880 1.00 0.00 H new ATOM 0 HB ILE A 39 4.218 -3.924 4.341 1.00 0.00 H new ATOM 0 HG12 ILE A 39 4.882 -1.186 5.449 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.904 -2.589 5.688 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.091 -2.039 3.236 1.00 0.00 H new ATOM 0 HG22 ILE A 39 1.947 -3.085 4.111 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.432 -1.520 4.806 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.654 -1.282 3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 39 6.087 -2.892 3.222 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.049 -1.468 2.979 1.00 0.00 H new ATOM 533 N GLU A 40 2.585 -5.765 6.345 1.00 0.00 N ATOM 534 CA GLU A 40 1.528 -6.761 6.337 1.00 0.00 C ATOM 535 C GLU A 40 0.791 -6.764 7.678 1.00 0.00 C ATOM 536 O GLU A 40 -0.405 -6.480 7.734 1.00 0.00 O ATOM 537 CB GLU A 40 2.084 -8.149 6.015 1.00 0.00 C ATOM 538 CG GLU A 40 1.340 -9.234 6.796 1.00 0.00 C ATOM 539 CD GLU A 40 1.516 -10.603 6.137 1.00 0.00 C ATOM 540 OE1 GLU A 40 2.673 -10.918 5.784 1.00 0.00 O ATOM 541 OE2 GLU A 40 0.490 -11.305 6.003 1.00 0.00 O ATOM 0 H GLU A 40 3.530 -6.146 6.377 1.00 0.00 H new ATOM 0 HA GLU A 40 0.817 -6.500 5.554 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.996 -8.341 4.946 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.146 -8.184 6.258 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.711 -9.269 7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.280 -8.986 6.850 1.00 0.00 H new ATOM 548 N ASP A 41 1.535 -7.087 8.725 1.00 0.00 N ATOM 549 CA ASP A 41 0.967 -7.130 10.062 1.00 0.00 C ATOM 550 C ASP A 41 0.263 -5.804 10.355 1.00 0.00 C ATOM 551 O ASP A 41 -0.774 -5.780 11.017 1.00 0.00 O ATOM 552 CB ASP A 41 2.057 -7.331 11.117 1.00 0.00 C ATOM 553 CG ASP A 41 1.614 -7.083 12.560 1.00 0.00 C ATOM 554 OD1 ASP A 41 1.675 -5.906 12.978 1.00 0.00 O ATOM 555 OD2 ASP A 41 1.224 -8.075 13.212 1.00 0.00 O ATOM 0 H ASP A 41 2.526 -7.322 8.675 1.00 0.00 H new ATOM 0 HA ASP A 41 0.266 -7.964 10.104 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.434 -8.351 11.039 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.889 -6.665 10.889 1.00 0.00 H new ATOM 560 N VAL A 42 0.855 -4.732 9.850 1.00 0.00 N ATOM 561 CA VAL A 42 0.298 -3.405 10.049 1.00 0.00 C ATOM 562 C VAL A 42 -1.192 -3.425 9.704 1.00 0.00 C ATOM 563 O VAL A 42 -2.026 -3.021 10.513 1.00 0.00 O ATOM 564 CB VAL A 42 1.086 -2.378 9.234 1.00 0.00 C ATOM 565 CG1 VAL A 42 0.222 -1.160 8.903 1.00 0.00 C ATOM 566 CG2 VAL A 42 2.364 -1.961 9.966 1.00 0.00 C ATOM 0 H VAL A 42 1.716 -4.755 9.303 1.00 0.00 H new ATOM 0 HA VAL A 42 0.386 -3.107 11.094 1.00 0.00 H new ATOM 0 HB VAL A 42 1.376 -2.848 8.294 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.807 -0.446 8.323 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.645 -1.476 8.322 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.113 -0.689 9.827 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.906 -1.230 9.365 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.105 -1.519 10.928 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.993 -2.836 10.127 1.00 0.00 H new ATOM 576 N PHE A 43 -1.482 -3.900 8.502 1.00 0.00 N ATOM 577 CA PHE A 43 -2.858 -3.979 8.040 1.00 0.00 C ATOM 578 C PHE A 43 -3.547 -5.234 8.579 1.00 0.00 C ATOM 579 O PHE A 43 -4.709 -5.185 8.977 1.00 0.00 O ATOM 580 CB PHE A 43 -2.813 -4.052 6.512 1.00 0.00 C ATOM 581 CG PHE A 43 -2.637 -2.695 5.828 1.00 0.00 C ATOM 582 CD1 PHE A 43 -1.405 -2.125 5.756 1.00 0.00 C ATOM 583 CD2 PHE A 43 -3.714 -2.059 5.293 1.00 0.00 C ATOM 584 CE1 PHE A 43 -1.242 -0.865 5.121 1.00 0.00 C ATOM 585 CE2 PHE A 43 -3.551 -0.799 4.659 1.00 0.00 C ATOM 586 CZ PHE A 43 -2.318 -0.229 4.586 1.00 0.00 C ATOM 0 H PHE A 43 -0.788 -4.234 7.834 1.00 0.00 H new ATOM 0 HA PHE A 43 -3.418 -3.112 8.390 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -1.994 -4.706 6.214 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -3.734 -4.511 6.153 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -0.550 -2.630 6.181 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -4.693 -2.512 5.350 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -0.263 -0.412 5.063 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.406 -0.293 4.235 1.00 0.00 H new ATOM 0 HZ PHE A 43 -2.194 0.729 4.103 1.00 0.00 H new ATOM 596 N TYR A 44 -2.800 -6.328 8.575 1.00 0.00 N ATOM 597 CA TYR A 44 -3.324 -7.594 9.059 1.00 0.00 C ATOM 598 C TYR A 44 -4.212 -7.386 10.288 1.00 0.00 C ATOM 599 O TYR A 44 -5.225 -8.065 10.448 1.00 0.00 O ATOM 600 CB TYR A 44 -2.106 -8.429 9.459 1.00 0.00 C ATOM 601 CG TYR A 44 -2.367 -9.937 9.485 1.00 0.00 C ATOM 602 CD1 TYR A 44 -2.924 -10.521 10.605 1.00 0.00 C ATOM 603 CD2 TYR A 44 -2.045 -10.711 8.389 1.00 0.00 C ATOM 604 CE1 TYR A 44 -3.169 -11.940 10.629 1.00 0.00 C ATOM 605 CE2 TYR A 44 -2.291 -12.130 8.414 1.00 0.00 C ATOM 606 CZ TYR A 44 -2.841 -12.674 9.532 1.00 0.00 C ATOM 607 OH TYR A 44 -3.072 -14.014 9.555 1.00 0.00 O ATOM 0 H TYR A 44 -1.836 -6.364 8.244 1.00 0.00 H new ATOM 0 HA TYR A 44 -3.929 -8.078 8.292 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.293 -8.223 8.763 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -1.769 -8.112 10.446 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -3.176 -9.914 11.462 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -1.609 -10.253 7.513 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -3.603 -12.411 11.499 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -2.044 -12.748 7.564 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.790 -14.409 8.704 1.00 0.00 H new ATOM 617 N LYS A 45 -3.799 -6.444 11.124 1.00 0.00 N ATOM 618 CA LYS A 45 -4.543 -6.139 12.333 1.00 0.00 C ATOM 619 C LYS A 45 -6.039 -6.113 12.013 1.00 0.00 C ATOM 620 O LYS A 45 -6.866 -6.433 12.866 1.00 0.00 O ATOM 621 CB LYS A 45 -4.028 -4.845 12.967 1.00 0.00 C ATOM 622 CG LYS A 45 -2.502 -4.860 13.080 1.00 0.00 C ATOM 623 CD LYS A 45 -2.056 -4.600 14.520 1.00 0.00 C ATOM 624 CE LYS A 45 -1.928 -5.910 15.300 1.00 0.00 C ATOM 625 NZ LYS A 45 -1.747 -5.639 16.743 1.00 0.00 N ATOM 0 H LYS A 45 -2.959 -5.882 10.987 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.389 -6.917 13.081 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.344 -3.991 12.367 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.468 -4.720 13.956 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.119 -5.824 12.745 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.078 -4.102 12.422 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -1.099 -4.078 14.519 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -2.775 -3.947 15.015 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -2.819 -6.519 15.147 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -1.081 -6.483 14.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -1.662 -6.539 17.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -0.884 -5.076 16.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -2.568 -5.111 17.103 1.00 0.00 H new ATOM 639 N TYR A 46 -6.342 -5.729 10.781 1.00 0.00 N ATOM 640 CA TYR A 46 -7.724 -5.657 10.338 1.00 0.00 C ATOM 641 C TYR A 46 -8.223 -7.028 9.877 1.00 0.00 C ATOM 642 O TYR A 46 -9.241 -7.517 10.364 1.00 0.00 O ATOM 643 CB TYR A 46 -7.735 -4.696 9.147 1.00 0.00 C ATOM 644 CG TYR A 46 -7.807 -3.219 9.540 1.00 0.00 C ATOM 645 CD1 TYR A 46 -8.992 -2.684 10.000 1.00 0.00 C ATOM 646 CD2 TYR A 46 -6.685 -2.422 9.434 1.00 0.00 C ATOM 647 CE1 TYR A 46 -9.059 -1.294 10.370 1.00 0.00 C ATOM 648 CE2 TYR A 46 -6.752 -1.032 9.804 1.00 0.00 C ATOM 649 CZ TYR A 46 -7.936 -0.537 10.253 1.00 0.00 C ATOM 650 OH TYR A 46 -7.999 0.776 10.603 1.00 0.00 O ATOM 0 H TYR A 46 -5.654 -5.465 10.076 1.00 0.00 H new ATOM 0 HA TYR A 46 -8.371 -5.324 11.149 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -6.836 -4.860 8.553 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.586 -4.934 8.509 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.870 -3.308 10.083 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.757 -2.841 9.074 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.981 -0.863 10.732 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -5.882 -0.397 9.727 1.00 0.00 H new ATOM 0 HH TYR A 46 -7.122 1.193 10.469 1.00 0.00 H new ATOM 660 N GLY A 47 -7.484 -7.608 8.943 1.00 0.00 N ATOM 661 CA GLY A 47 -7.839 -8.913 8.411 1.00 0.00 C ATOM 662 C GLY A 47 -6.596 -9.671 7.944 1.00 0.00 C ATOM 663 O GLY A 47 -5.610 -9.765 8.674 1.00 0.00 O ATOM 0 H GLY A 47 -6.641 -7.198 8.541 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.357 -9.493 9.175 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.531 -8.794 7.577 1.00 0.00 H new ATOM 667 N ALA A 48 -6.682 -10.194 6.729 1.00 0.00 N ATOM 668 CA ALA A 48 -5.576 -10.942 6.156 1.00 0.00 C ATOM 669 C ALA A 48 -5.179 -10.312 4.819 1.00 0.00 C ATOM 670 O ALA A 48 -5.930 -9.518 4.256 1.00 0.00 O ATOM 671 CB ALA A 48 -5.974 -12.412 6.012 1.00 0.00 C ATOM 0 H ALA A 48 -7.501 -10.114 6.126 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.706 -10.903 6.811 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.144 -12.973 5.582 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -6.219 -12.820 6.992 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.843 -12.491 5.359 1.00 0.00 H new ATOM 677 N ILE A 49 -3.999 -10.691 4.350 1.00 0.00 N ATOM 678 CA ILE A 49 -3.493 -10.173 3.091 1.00 0.00 C ATOM 679 C ILE A 49 -3.399 -11.314 2.076 1.00 0.00 C ATOM 680 O ILE A 49 -3.297 -12.480 2.456 1.00 0.00 O ATOM 681 CB ILE A 49 -2.172 -9.432 3.307 1.00 0.00 C ATOM 682 CG1 ILE A 49 -2.394 -8.129 4.079 1.00 0.00 C ATOM 683 CG2 ILE A 49 -1.451 -9.196 1.979 1.00 0.00 C ATOM 684 CD1 ILE A 49 -1.121 -7.703 4.812 1.00 0.00 C ATOM 0 H ILE A 49 -3.379 -11.351 4.820 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.181 -9.435 2.679 1.00 0.00 H new ATOM 0 HB ILE A 49 -1.524 -10.061 3.917 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.702 -7.342 3.391 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.204 -8.260 4.796 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -0.515 -8.668 2.162 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.240 -10.154 1.504 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.083 -8.598 1.323 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.306 -6.775 5.353 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.829 -8.481 5.517 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.319 -7.549 4.090 1.00 0.00 H new ATOM 696 N ARG A 50 -3.436 -10.939 0.806 1.00 0.00 N ATOM 697 CA ARG A 50 -3.356 -11.917 -0.266 1.00 0.00 C ATOM 698 C ARG A 50 -1.974 -11.874 -0.922 1.00 0.00 C ATOM 699 O ARG A 50 -1.514 -12.871 -1.475 1.00 0.00 O ATOM 700 CB ARG A 50 -4.426 -11.658 -1.329 1.00 0.00 C ATOM 701 CG ARG A 50 -4.139 -12.458 -2.601 1.00 0.00 C ATOM 702 CD ARG A 50 -5.405 -12.617 -3.445 1.00 0.00 C ATOM 703 NE ARG A 50 -5.700 -14.053 -3.648 1.00 0.00 N ATOM 704 CZ ARG A 50 -6.588 -14.519 -4.537 1.00 0.00 C ATOM 705 NH1 ARG A 50 -7.273 -13.666 -5.310 1.00 0.00 N ATOM 706 NH2 ARG A 50 -6.791 -15.839 -4.653 1.00 0.00 N ATOM 0 H ARG A 50 -3.520 -9.971 0.495 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.524 -12.902 0.170 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.406 -11.930 -0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.460 -10.594 -1.564 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.369 -11.955 -3.185 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -3.748 -13.440 -2.337 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.246 -12.131 -2.950 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.274 -12.124 -4.408 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.196 -14.730 -3.076 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -7.119 -12.662 -5.222 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.949 -14.021 -5.987 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -6.270 -16.489 -4.065 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.467 -16.194 -5.330 1.00 0.00 H new ATOM 720 N ASP A 51 -1.351 -10.707 -0.839 1.00 0.00 N ATOM 721 CA ASP A 51 -0.031 -10.521 -1.417 1.00 0.00 C ATOM 722 C ASP A 51 0.378 -9.053 -1.280 1.00 0.00 C ATOM 723 O ASP A 51 -0.475 -8.174 -1.170 1.00 0.00 O ATOM 724 CB ASP A 51 -0.028 -10.875 -2.906 1.00 0.00 C ATOM 725 CG ASP A 51 1.167 -11.711 -3.368 1.00 0.00 C ATOM 726 OD1 ASP A 51 1.933 -12.146 -2.481 1.00 0.00 O ATOM 727 OD2 ASP A 51 1.288 -11.896 -4.599 1.00 0.00 O ATOM 0 H ASP A 51 -1.736 -9.881 -0.380 1.00 0.00 H new ATOM 0 HA ASP A 51 0.664 -11.174 -0.889 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -0.944 -11.419 -3.137 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.051 -9.951 -3.484 1.00 0.00 H new ATOM 732 N ILE A 52 1.685 -8.833 -1.289 1.00 0.00 N ATOM 733 CA ILE A 52 2.218 -7.487 -1.167 1.00 0.00 C ATOM 734 C ILE A 52 3.258 -7.253 -2.264 1.00 0.00 C ATOM 735 O ILE A 52 4.245 -7.983 -2.355 1.00 0.00 O ATOM 736 CB ILE A 52 2.752 -7.249 0.247 1.00 0.00 C ATOM 737 CG1 ILE A 52 1.672 -7.526 1.295 1.00 0.00 C ATOM 738 CG2 ILE A 52 3.335 -5.841 0.383 1.00 0.00 C ATOM 739 CD1 ILE A 52 2.285 -8.081 2.582 1.00 0.00 C ATOM 0 H ILE A 52 2.390 -9.564 -1.379 1.00 0.00 H new ATOM 0 HA ILE A 52 1.428 -6.750 -1.314 1.00 0.00 H new ATOM 0 HB ILE A 52 3.564 -7.953 0.428 1.00 0.00 H new ATOM 0 HG12 ILE A 52 1.129 -6.607 1.514 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.948 -8.237 0.897 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.707 -5.698 1.397 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.154 -5.716 -0.325 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.559 -5.104 0.174 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.495 -8.269 3.310 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.807 -9.013 2.364 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.990 -7.357 2.991 1.00 0.00 H new ATOM 751 N ASP A 53 3.002 -6.234 -3.070 1.00 0.00 N ATOM 752 CA ASP A 53 3.904 -5.895 -4.158 1.00 0.00 C ATOM 753 C ASP A 53 4.699 -4.642 -3.784 1.00 0.00 C ATOM 754 O ASP A 53 4.144 -3.545 -3.726 1.00 0.00 O ATOM 755 CB ASP A 53 3.130 -5.598 -5.444 1.00 0.00 C ATOM 756 CG ASP A 53 3.365 -6.591 -6.584 1.00 0.00 C ATOM 757 OD1 ASP A 53 4.472 -6.537 -7.163 1.00 0.00 O ATOM 758 OD2 ASP A 53 2.434 -7.380 -6.850 1.00 0.00 O ATOM 0 H ASP A 53 2.183 -5.631 -2.992 1.00 0.00 H new ATOM 0 HA ASP A 53 4.566 -6.745 -4.324 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.065 -5.579 -5.213 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.399 -4.600 -5.790 1.00 0.00 H new ATOM 763 N LEU A 54 5.985 -4.846 -3.541 1.00 0.00 N ATOM 764 CA LEU A 54 6.861 -3.746 -3.175 1.00 0.00 C ATOM 765 C LEU A 54 7.887 -3.525 -4.288 1.00 0.00 C ATOM 766 O LEU A 54 8.576 -4.458 -4.697 1.00 0.00 O ATOM 767 CB LEU A 54 7.487 -3.994 -1.802 1.00 0.00 C ATOM 768 CG LEU A 54 8.729 -3.163 -1.470 1.00 0.00 C ATOM 769 CD1 LEU A 54 8.346 -1.872 -0.743 1.00 0.00 C ATOM 770 CD2 LEU A 54 9.745 -3.988 -0.678 1.00 0.00 C ATOM 0 H LEU A 54 6.442 -5.757 -3.590 1.00 0.00 H new ATOM 0 HA LEU A 54 6.292 -2.822 -3.078 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.731 -3.802 -1.040 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.751 -5.049 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 54 9.208 -2.875 -2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 54 9.246 -1.300 -0.519 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.688 -1.279 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 54 7.831 -2.117 0.186 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.618 -3.374 -0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.292 -4.326 0.254 1.00 0.00 H new ATOM 0 HD23 LEU A 54 10.051 -4.852 -1.268 1.00 0.00 H new ATOM 782 N LYS A 55 7.957 -2.283 -4.747 1.00 0.00 N ATOM 783 CA LYS A 55 8.888 -1.928 -5.804 1.00 0.00 C ATOM 784 C LYS A 55 10.197 -1.438 -5.182 1.00 0.00 C ATOM 785 O LYS A 55 11.196 -2.156 -5.183 1.00 0.00 O ATOM 786 CB LYS A 55 8.249 -0.922 -6.764 1.00 0.00 C ATOM 787 CG LYS A 55 7.197 -1.598 -7.647 1.00 0.00 C ATOM 788 CD LYS A 55 7.469 -1.327 -9.128 1.00 0.00 C ATOM 789 CE LYS A 55 6.164 -1.081 -9.888 1.00 0.00 C ATOM 790 NZ LYS A 55 6.353 -1.327 -11.335 1.00 0.00 N ATOM 0 H LYS A 55 7.384 -1.511 -4.406 1.00 0.00 H new ATOM 0 HA LYS A 55 9.130 -2.802 -6.408 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.787 -0.114 -6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.019 -0.472 -7.390 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.199 -2.672 -7.464 1.00 0.00 H new ATOM 0 HG3 LYS A 55 6.205 -1.232 -7.383 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.122 -0.460 -9.229 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.995 -2.175 -9.566 1.00 0.00 H new ATOM 0 HE2 LYS A 55 5.382 -1.734 -9.501 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.831 -0.056 -9.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.458 -1.156 -11.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.084 -0.686 -11.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.650 -2.313 -11.484 1.00 0.00 H new ATOM 804 N ASN A 56 10.150 -0.219 -4.666 1.00 0.00 N ATOM 805 CA ASN A 56 11.320 0.375 -4.042 1.00 0.00 C ATOM 806 C ASN A 56 12.279 0.865 -5.130 1.00 0.00 C ATOM 807 O ASN A 56 12.518 2.064 -5.257 1.00 0.00 O ATOM 808 CB ASN A 56 12.064 -0.647 -3.181 1.00 0.00 C ATOM 809 CG ASN A 56 12.830 0.042 -2.050 1.00 0.00 C ATOM 810 OD1 ASN A 56 13.794 0.759 -2.265 1.00 0.00 O ATOM 811 ND2 ASN A 56 12.350 -0.214 -0.837 1.00 0.00 N ATOM 0 H ASN A 56 9.320 0.374 -4.667 1.00 0.00 H new ATOM 0 HA ASN A 56 10.985 1.200 -3.413 1.00 0.00 H new ATOM 0 HB2 ASN A 56 11.354 -1.360 -2.762 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.758 -1.214 -3.802 1.00 0.00 H new ATOM 0 HD21 ASN A 56 12.792 0.199 -0.016 1.00 0.00 H new ATOM 0 HD22 ASN A 56 11.539 -0.823 -0.727 1.00 0.00 H new ATOM 818 N ARG A 57 12.803 -0.090 -5.885 1.00 0.00 N ATOM 819 CA ARG A 57 13.731 0.229 -6.957 1.00 0.00 C ATOM 820 C ARG A 57 13.096 1.226 -7.929 1.00 0.00 C ATOM 821 O ARG A 57 12.403 0.831 -8.865 1.00 0.00 O ATOM 822 CB ARG A 57 14.141 -1.030 -7.724 1.00 0.00 C ATOM 823 CG ARG A 57 15.266 -0.726 -8.715 1.00 0.00 C ATOM 824 CD ARG A 57 15.876 -2.017 -9.264 1.00 0.00 C ATOM 825 NE ARG A 57 17.093 -1.709 -10.047 1.00 0.00 N ATOM 826 CZ ARG A 57 18.258 -1.329 -9.506 1.00 0.00 C ATOM 827 NH1 ARG A 57 18.371 -1.209 -8.176 1.00 0.00 N ATOM 828 NH2 ARG A 57 19.311 -1.070 -10.294 1.00 0.00 N ATOM 0 H ARG A 57 12.603 -1.084 -5.776 1.00 0.00 H new ATOM 0 HA ARG A 57 14.619 0.671 -6.506 1.00 0.00 H new ATOM 0 HB2 ARG A 57 14.467 -1.798 -7.022 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.280 -1.432 -8.258 1.00 0.00 H new ATOM 0 HG2 ARG A 57 14.879 -0.124 -9.537 1.00 0.00 H new ATOM 0 HG3 ARG A 57 16.039 -0.135 -8.224 1.00 0.00 H new ATOM 0 HD2 ARG A 57 16.123 -2.690 -8.443 1.00 0.00 H new ATOM 0 HD3 ARG A 57 15.150 -2.533 -9.892 1.00 0.00 H new ATOM 0 HE ARG A 57 17.042 -1.791 -11.062 1.00 0.00 H new ATOM 0 HH11 ARG A 57 17.570 -1.407 -7.576 1.00 0.00 H new ATOM 0 HH12 ARG A 57 19.258 -0.920 -7.764 1.00 0.00 H new ATOM 0 HH21 ARG A 57 19.225 -1.162 -11.306 1.00 0.00 H new ATOM 0 HH22 ARG A 57 20.198 -0.781 -9.881 1.00 0.00 H new ATOM 842 N ARG A 58 13.356 2.500 -7.674 1.00 0.00 N ATOM 843 CA ARG A 58 12.819 3.556 -8.515 1.00 0.00 C ATOM 844 C ARG A 58 13.095 4.925 -7.888 1.00 0.00 C ATOM 845 O ARG A 58 13.799 5.022 -6.884 1.00 0.00 O ATOM 846 CB ARG A 58 11.312 3.389 -8.714 1.00 0.00 C ATOM 847 CG ARG A 58 10.958 3.341 -10.202 1.00 0.00 C ATOM 848 CD ARG A 58 9.605 4.006 -10.466 1.00 0.00 C ATOM 849 NE ARG A 58 8.756 3.117 -11.289 1.00 0.00 N ATOM 850 CZ ARG A 58 8.833 3.029 -12.624 1.00 0.00 C ATOM 851 NH1 ARG A 58 9.721 3.777 -13.294 1.00 0.00 N ATOM 852 NH2 ARG A 58 8.022 2.195 -13.289 1.00 0.00 N ATOM 0 H ARG A 58 13.931 2.825 -6.897 1.00 0.00 H new ATOM 0 HA ARG A 58 13.311 3.490 -9.485 1.00 0.00 H new ATOM 0 HB2 ARG A 58 10.976 2.473 -8.227 1.00 0.00 H new ATOM 0 HB3 ARG A 58 10.785 4.215 -8.237 1.00 0.00 H new ATOM 0 HG2 ARG A 58 11.733 3.844 -10.780 1.00 0.00 H new ATOM 0 HG3 ARG A 58 10.930 2.305 -10.540 1.00 0.00 H new ATOM 0 HD2 ARG A 58 9.108 4.225 -9.521 1.00 0.00 H new ATOM 0 HD3 ARG A 58 9.752 4.958 -10.977 1.00 0.00 H new ATOM 0 HE ARG A 58 8.069 2.535 -10.810 1.00 0.00 H new ATOM 0 HH11 ARG A 58 10.338 4.413 -12.788 1.00 0.00 H new ATOM 0 HH12 ARG A 58 9.780 3.711 -14.310 1.00 0.00 H new ATOM 0 HH21 ARG A 58 7.346 1.627 -12.779 1.00 0.00 H new ATOM 0 HH22 ARG A 58 8.081 2.128 -14.305 1.00 0.00 H new ATOM 866 N GLY A 59 12.525 5.949 -8.507 1.00 0.00 N ATOM 867 CA GLY A 59 12.700 7.308 -8.022 1.00 0.00 C ATOM 868 C GLY A 59 11.700 7.626 -6.910 1.00 0.00 C ATOM 869 O GLY A 59 10.553 7.185 -6.956 1.00 0.00 O ATOM 0 H GLY A 59 11.942 5.865 -9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 59 13.716 7.437 -7.650 1.00 0.00 H new ATOM 0 HA3 GLY A 59 12.570 8.011 -8.845 1.00 0.00 H new ATOM 873 N GLY A 60 12.171 8.390 -5.935 1.00 0.00 N ATOM 874 CA GLY A 60 11.332 8.773 -4.812 1.00 0.00 C ATOM 875 C GLY A 60 11.429 7.748 -3.681 1.00 0.00 C ATOM 876 O GLY A 60 12.348 6.931 -3.656 1.00 0.00 O ATOM 0 H GLY A 60 13.123 8.754 -5.900 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.634 9.754 -4.445 1.00 0.00 H new ATOM 0 HA3 GLY A 60 10.296 8.861 -5.140 1.00 0.00 H new ATOM 880 N PRO A 61 10.442 7.827 -2.748 1.00 0.00 N ATOM 881 CA PRO A 61 10.408 6.916 -1.617 1.00 0.00 C ATOM 882 C PRO A 61 9.937 5.525 -2.047 1.00 0.00 C ATOM 883 O PRO A 61 9.441 5.350 -3.159 1.00 0.00 O ATOM 884 CB PRO A 61 9.477 7.573 -0.611 1.00 0.00 C ATOM 885 CG PRO A 61 8.664 8.589 -1.397 1.00 0.00 C ATOM 886 CD PRO A 61 9.338 8.782 -2.745 1.00 0.00 C ATOM 0 HA PRO A 61 11.393 6.751 -1.180 1.00 0.00 H new ATOM 0 HB2 PRO A 61 8.829 6.835 -0.139 1.00 0.00 H new ATOM 0 HB3 PRO A 61 10.042 8.057 0.186 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.640 8.239 -1.529 1.00 0.00 H new ATOM 0 HG3 PRO A 61 8.611 9.535 -0.858 1.00 0.00 H new ATOM 0 HD2 PRO A 61 8.646 8.590 -3.565 1.00 0.00 H new ATOM 0 HD3 PRO A 61 9.698 9.804 -2.865 1.00 0.00 H new ATOM 894 N PRO A 62 10.114 4.546 -1.120 1.00 0.00 N ATOM 895 CA PRO A 62 9.713 3.176 -1.392 1.00 0.00 C ATOM 896 C PRO A 62 8.193 3.024 -1.313 1.00 0.00 C ATOM 897 O PRO A 62 7.566 3.495 -0.366 1.00 0.00 O ATOM 898 CB PRO A 62 10.448 2.338 -0.358 1.00 0.00 C ATOM 899 CG PRO A 62 10.864 3.303 0.741 1.00 0.00 C ATOM 900 CD PRO A 62 10.698 4.717 0.208 1.00 0.00 C ATOM 0 HA PRO A 62 9.970 2.855 -2.401 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.805 1.551 0.036 1.00 0.00 H new ATOM 0 HB3 PRO A 62 11.317 1.849 -0.798 1.00 0.00 H new ATOM 0 HG2 PRO A 62 10.251 3.156 1.630 1.00 0.00 H new ATOM 0 HG3 PRO A 62 11.899 3.125 1.034 1.00 0.00 H new ATOM 0 HD2 PRO A 62 10.049 5.310 0.853 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.655 5.236 0.156 1.00 0.00 H new ATOM 908 N PHE A 63 7.643 2.363 -2.322 1.00 0.00 N ATOM 909 CA PHE A 63 6.208 2.143 -2.379 1.00 0.00 C ATOM 910 C PHE A 63 5.890 0.666 -2.624 1.00 0.00 C ATOM 911 O PHE A 63 6.701 -0.061 -3.194 1.00 0.00 O ATOM 912 CB PHE A 63 5.675 2.968 -3.551 1.00 0.00 C ATOM 913 CG PHE A 63 6.390 2.700 -4.877 1.00 0.00 C ATOM 914 CD1 PHE A 63 7.601 3.267 -5.124 1.00 0.00 C ATOM 915 CD2 PHE A 63 5.813 1.895 -5.810 1.00 0.00 C ATOM 916 CE1 PHE A 63 8.265 3.018 -6.355 1.00 0.00 C ATOM 917 CE2 PHE A 63 6.477 1.645 -7.040 1.00 0.00 C ATOM 918 CZ PHE A 63 7.688 2.212 -7.287 1.00 0.00 C ATOM 0 H PHE A 63 8.166 1.973 -3.106 1.00 0.00 H new ATOM 0 HA PHE A 63 5.749 2.435 -1.434 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.612 2.760 -3.675 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.767 4.027 -3.308 1.00 0.00 H new ATOM 0 HD1 PHE A 63 8.058 3.907 -4.384 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.850 1.446 -5.615 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.227 3.468 -6.551 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.020 1.004 -7.780 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.192 2.023 -8.223 1.00 0.00 H new ATOM 928 N ALA A 64 4.706 0.268 -2.180 1.00 0.00 N ATOM 929 CA ALA A 64 4.270 -1.108 -2.344 1.00 0.00 C ATOM 930 C ALA A 64 2.743 -1.167 -2.269 1.00 0.00 C ATOM 931 O ALA A 64 2.109 -0.263 -1.727 1.00 0.00 O ATOM 932 CB ALA A 64 4.940 -1.986 -1.285 1.00 0.00 C ATOM 0 H ALA A 64 4.036 0.874 -1.707 1.00 0.00 H new ATOM 0 HA ALA A 64 4.567 -1.491 -3.320 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.613 -3.018 -1.408 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.023 -1.932 -1.400 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.663 -1.634 -0.292 1.00 0.00 H new ATOM 938 N PHE A 65 2.197 -2.241 -2.821 1.00 0.00 N ATOM 939 CA PHE A 65 0.756 -2.430 -2.824 1.00 0.00 C ATOM 940 C PHE A 65 0.360 -3.634 -1.968 1.00 0.00 C ATOM 941 O PHE A 65 1.009 -4.678 -2.020 1.00 0.00 O ATOM 942 CB PHE A 65 0.342 -2.690 -4.273 1.00 0.00 C ATOM 943 CG PHE A 65 0.532 -1.488 -5.201 1.00 0.00 C ATOM 944 CD1 PHE A 65 1.778 -1.151 -5.629 1.00 0.00 C ATOM 945 CD2 PHE A 65 -0.544 -0.757 -5.596 1.00 0.00 C ATOM 946 CE1 PHE A 65 1.955 -0.035 -6.490 1.00 0.00 C ATOM 947 CE2 PHE A 65 -0.367 0.359 -6.457 1.00 0.00 C ATOM 948 CZ PHE A 65 0.879 0.696 -6.886 1.00 0.00 C ATOM 0 H PHE A 65 2.726 -2.989 -3.269 1.00 0.00 H new ATOM 0 HA PHE A 65 0.264 -1.549 -2.413 1.00 0.00 H new ATOM 0 HB2 PHE A 65 0.920 -3.529 -4.660 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -0.706 -2.989 -4.292 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.633 -1.732 -5.314 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -1.533 -1.025 -5.255 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.944 0.233 -6.830 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -1.222 0.940 -6.771 1.00 0.00 H new ATOM 0 HZ PHE A 65 1.014 1.544 -7.541 1.00 0.00 H new ATOM 958 N VAL A 66 -0.705 -3.450 -1.201 1.00 0.00 N ATOM 959 CA VAL A 66 -1.195 -4.509 -0.335 1.00 0.00 C ATOM 960 C VAL A 66 -2.567 -4.972 -0.830 1.00 0.00 C ATOM 961 O VAL A 66 -3.494 -4.171 -0.942 1.00 0.00 O ATOM 962 CB VAL A 66 -1.215 -4.030 1.118 1.00 0.00 C ATOM 963 CG1 VAL A 66 -1.706 -5.137 2.053 1.00 0.00 C ATOM 964 CG2 VAL A 66 0.163 -3.521 1.546 1.00 0.00 C ATOM 0 H VAL A 66 -1.242 -2.584 -1.161 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.528 -5.370 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.916 -3.198 1.187 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.711 -4.771 3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.716 -5.432 1.768 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.042 -5.998 1.978 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.121 -3.186 2.583 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.893 -4.325 1.453 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.458 -2.688 0.908 1.00 0.00 H new ATOM 974 N GLU A 67 -2.653 -6.264 -1.114 1.00 0.00 N ATOM 975 CA GLU A 67 -3.896 -6.843 -1.595 1.00 0.00 C ATOM 976 C GLU A 67 -4.693 -7.432 -0.429 1.00 0.00 C ATOM 977 O GLU A 67 -4.126 -8.075 0.453 1.00 0.00 O ATOM 978 CB GLU A 67 -3.629 -7.902 -2.666 1.00 0.00 C ATOM 979 CG GLU A 67 -4.842 -8.073 -3.583 1.00 0.00 C ATOM 980 CD GLU A 67 -4.418 -8.107 -5.053 1.00 0.00 C ATOM 981 OE1 GLU A 67 -3.610 -7.232 -5.430 1.00 0.00 O ATOM 982 OE2 GLU A 67 -4.913 -9.007 -5.765 1.00 0.00 O ATOM 0 H GLU A 67 -1.882 -6.926 -1.020 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.490 -6.052 -2.053 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -2.759 -7.615 -3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.391 -8.853 -2.190 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.366 -8.995 -3.331 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.543 -7.254 -3.422 1.00 0.00 H new ATOM 989 N PHE A 68 -5.995 -7.190 -0.462 1.00 0.00 N ATOM 990 CA PHE A 68 -6.876 -7.688 0.580 1.00 0.00 C ATOM 991 C PHE A 68 -7.823 -8.758 0.034 1.00 0.00 C ATOM 992 O PHE A 68 -8.212 -8.710 -1.132 1.00 0.00 O ATOM 993 CB PHE A 68 -7.701 -6.498 1.075 1.00 0.00 C ATOM 994 CG PHE A 68 -7.153 -5.846 2.346 1.00 0.00 C ATOM 995 CD1 PHE A 68 -7.318 -6.458 3.550 1.00 0.00 C ATOM 996 CD2 PHE A 68 -6.500 -4.655 2.273 1.00 0.00 C ATOM 997 CE1 PHE A 68 -6.809 -5.853 4.729 1.00 0.00 C ATOM 998 CE2 PHE A 68 -5.991 -4.050 3.452 1.00 0.00 C ATOM 999 CZ PHE A 68 -6.157 -4.662 4.656 1.00 0.00 C ATOM 0 H PHE A 68 -6.461 -6.655 -1.195 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.288 -8.137 1.380 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -7.748 -5.748 0.285 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.723 -6.829 1.261 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.836 -7.404 3.609 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.369 -4.169 1.317 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.940 -6.339 5.685 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.472 -3.105 3.393 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.771 -4.202 5.554 1.00 0.00 H new ATOM 1009 N GLU A 69 -8.167 -9.698 0.901 1.00 0.00 N ATOM 1010 CA GLU A 69 -9.061 -10.778 0.520 1.00 0.00 C ATOM 1011 C GLU A 69 -10.456 -10.229 0.213 1.00 0.00 C ATOM 1012 O GLU A 69 -11.121 -10.696 -0.709 1.00 0.00 O ATOM 1013 CB GLU A 69 -9.121 -11.850 1.609 1.00 0.00 C ATOM 1014 CG GLU A 69 -7.856 -12.711 1.602 1.00 0.00 C ATOM 1015 CD GLU A 69 -7.844 -13.659 0.402 1.00 0.00 C ATOM 1016 OE1 GLU A 69 -7.498 -13.177 -0.699 1.00 0.00 O ATOM 1017 OE2 GLU A 69 -8.182 -14.844 0.612 1.00 0.00 O ATOM 0 H GLU A 69 -7.842 -9.734 1.867 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.669 -11.246 -0.383 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.238 -11.377 2.584 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.996 -12.482 1.455 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.975 -12.069 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.799 -13.287 2.526 1.00 0.00 H new ATOM 1024 N ASP A 70 -10.857 -9.245 1.005 1.00 0.00 N ATOM 1025 CA ASP A 70 -12.160 -8.627 0.830 1.00 0.00 C ATOM 1026 C ASP A 70 -11.983 -7.122 0.622 1.00 0.00 C ATOM 1027 O ASP A 70 -10.974 -6.550 1.032 1.00 0.00 O ATOM 1028 CB ASP A 70 -13.038 -8.834 2.066 1.00 0.00 C ATOM 1029 CG ASP A 70 -14.317 -9.638 1.824 1.00 0.00 C ATOM 1030 OD1 ASP A 70 -14.181 -10.815 1.425 1.00 0.00 O ATOM 1031 OD2 ASP A 70 -15.402 -9.057 2.043 1.00 0.00 O ATOM 0 H ASP A 70 -10.302 -8.861 1.770 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.639 -9.088 -0.034 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -12.449 -9.339 2.831 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.311 -7.858 2.467 1.00 0.00 H new ATOM 1036 N PRO A 71 -13.005 -6.508 -0.032 1.00 0.00 N ATOM 1037 CA PRO A 71 -12.972 -5.080 -0.299 1.00 0.00 C ATOM 1038 C PRO A 71 -13.257 -4.277 0.972 1.00 0.00 C ATOM 1039 O PRO A 71 -12.520 -3.350 1.303 1.00 0.00 O ATOM 1040 CB PRO A 71 -14.010 -4.859 -1.386 1.00 0.00 C ATOM 1041 CG PRO A 71 -14.909 -6.084 -1.359 1.00 0.00 C ATOM 1042 CD PRO A 71 -14.215 -7.154 -0.532 1.00 0.00 C ATOM 0 HA PRO A 71 -11.991 -4.736 -0.628 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -14.583 -3.950 -1.200 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.536 -4.744 -2.361 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.878 -5.836 -0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -15.094 -6.444 -2.371 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -14.849 -7.495 0.286 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.976 -8.029 -1.136 1.00 0.00 H new ATOM 1050 N ARG A 72 -14.327 -4.664 1.650 1.00 0.00 N ATOM 1051 CA ARG A 72 -14.719 -3.992 2.877 1.00 0.00 C ATOM 1052 C ARG A 72 -13.484 -3.657 3.716 1.00 0.00 C ATOM 1053 O ARG A 72 -13.207 -2.488 3.980 1.00 0.00 O ATOM 1054 CB ARG A 72 -15.667 -4.863 3.704 1.00 0.00 C ATOM 1055 CG ARG A 72 -16.996 -5.070 2.975 1.00 0.00 C ATOM 1056 CD ARG A 72 -18.100 -5.478 3.953 1.00 0.00 C ATOM 1057 NE ARG A 72 -19.284 -5.959 3.208 1.00 0.00 N ATOM 1058 CZ ARG A 72 -20.467 -6.237 3.774 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -20.629 -6.082 5.095 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -21.486 -6.668 3.020 1.00 0.00 N ATOM 0 H ARG A 72 -14.935 -5.435 1.373 1.00 0.00 H new ATOM 0 HA ARG A 72 -15.236 -3.073 2.601 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.201 -5.829 3.900 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.848 -4.394 4.671 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.281 -4.151 2.462 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.880 -5.839 2.211 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -17.736 -6.261 4.619 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -18.374 -4.629 4.579 1.00 0.00 H new ATOM 0 HE ARG A 72 -19.195 -6.087 2.200 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -19.853 -5.753 5.669 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -21.529 -6.293 5.527 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -21.362 -6.785 2.014 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -22.386 -6.879 3.451 1.00 0.00 H new ATOM 1074 N ASP A 73 -12.775 -4.704 4.112 1.00 0.00 N ATOM 1075 CA ASP A 73 -11.576 -4.535 4.915 1.00 0.00 C ATOM 1076 C ASP A 73 -10.590 -3.634 4.169 1.00 0.00 C ATOM 1077 O ASP A 73 -10.031 -2.705 4.750 1.00 0.00 O ATOM 1078 CB ASP A 73 -10.889 -5.879 5.169 1.00 0.00 C ATOM 1079 CG ASP A 73 -11.176 -6.503 6.536 1.00 0.00 C ATOM 1080 OD1 ASP A 73 -11.275 -5.723 7.507 1.00 0.00 O ATOM 1081 OD2 ASP A 73 -11.290 -7.747 6.579 1.00 0.00 O ATOM 0 H ASP A 73 -13.008 -5.672 3.892 1.00 0.00 H new ATOM 0 HA ASP A 73 -11.868 -4.093 5.868 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.198 -6.580 4.394 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.812 -5.745 5.066 1.00 0.00 H new ATOM 1086 N ALA A 74 -10.406 -3.941 2.893 1.00 0.00 N ATOM 1087 CA ALA A 74 -9.497 -3.170 2.062 1.00 0.00 C ATOM 1088 C ALA A 74 -9.814 -1.681 2.211 1.00 0.00 C ATOM 1089 O ALA A 74 -8.932 -0.837 2.060 1.00 0.00 O ATOM 1090 CB ALA A 74 -9.603 -3.647 0.612 1.00 0.00 C ATOM 0 H ALA A 74 -10.871 -4.713 2.415 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.465 -3.320 2.380 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -8.921 -3.069 -0.012 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.339 -4.703 0.556 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.624 -3.509 0.257 1.00 0.00 H new ATOM 1096 N GLU A 75 -11.076 -1.404 2.506 1.00 0.00 N ATOM 1097 CA GLU A 75 -11.520 -0.032 2.678 1.00 0.00 C ATOM 1098 C GLU A 75 -11.344 0.405 4.134 1.00 0.00 C ATOM 1099 O GLU A 75 -10.770 1.459 4.404 1.00 0.00 O ATOM 1100 CB GLU A 75 -12.973 0.134 2.227 1.00 0.00 C ATOM 1101 CG GLU A 75 -13.168 -0.388 0.803 1.00 0.00 C ATOM 1102 CD GLU A 75 -14.181 0.467 0.039 1.00 0.00 C ATOM 1103 OE1 GLU A 75 -15.388 0.172 0.172 1.00 0.00 O ATOM 1104 OE2 GLU A 75 -13.725 1.397 -0.661 1.00 0.00 O ATOM 0 H GLU A 75 -11.805 -2.107 2.630 1.00 0.00 H new ATOM 0 HA GLU A 75 -10.903 0.611 2.050 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -13.633 -0.403 2.909 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -13.254 1.186 2.274 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -12.213 -0.384 0.277 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -13.510 -1.422 0.835 1.00 0.00 H new ATOM 1111 N ASP A 76 -11.849 -0.426 5.033 1.00 0.00 N ATOM 1112 CA ASP A 76 -11.755 -0.139 6.454 1.00 0.00 C ATOM 1113 C ASP A 76 -10.298 0.161 6.814 1.00 0.00 C ATOM 1114 O ASP A 76 -10.028 0.933 7.732 1.00 0.00 O ATOM 1115 CB ASP A 76 -12.211 -1.337 7.290 1.00 0.00 C ATOM 1116 CG ASP A 76 -13.724 -1.561 7.325 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -14.448 -0.606 6.970 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -14.122 -2.683 7.706 1.00 0.00 O ATOM 0 H ASP A 76 -12.325 -1.299 4.805 1.00 0.00 H new ATOM 0 HA ASP A 76 -12.397 0.715 6.668 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -11.734 -2.236 6.900 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.854 -1.205 8.312 1.00 0.00 H new ATOM 1123 N ALA A 77 -9.398 -0.466 6.071 1.00 0.00 N ATOM 1124 CA ALA A 77 -7.975 -0.276 6.300 1.00 0.00 C ATOM 1125 C ALA A 77 -7.548 1.079 5.732 1.00 0.00 C ATOM 1126 O ALA A 77 -7.139 1.968 6.477 1.00 0.00 O ATOM 1127 CB ALA A 77 -7.198 -1.439 5.681 1.00 0.00 C ATOM 0 H ALA A 77 -9.626 -1.106 5.310 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.756 -0.270 7.368 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.131 -1.296 5.853 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.517 -2.375 6.139 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.391 -1.476 4.609 1.00 0.00 H new ATOM 1133 N VAL A 78 -7.658 1.194 4.416 1.00 0.00 N ATOM 1134 CA VAL A 78 -7.288 2.425 3.740 1.00 0.00 C ATOM 1135 C VAL A 78 -7.993 3.604 4.414 1.00 0.00 C ATOM 1136 O VAL A 78 -7.455 4.710 4.459 1.00 0.00 O ATOM 1137 CB VAL A 78 -7.602 2.316 2.246 1.00 0.00 C ATOM 1138 CG1 VAL A 78 -9.024 2.796 1.948 1.00 0.00 C ATOM 1139 CG2 VAL A 78 -6.577 3.088 1.413 1.00 0.00 C ATOM 0 H VAL A 78 -7.998 0.455 3.801 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.215 2.598 3.822 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.538 1.265 1.966 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -9.221 2.708 0.880 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.738 2.185 2.500 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.127 3.838 2.251 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.823 2.994 0.355 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.595 4.140 1.698 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.582 2.680 1.592 1.00 0.00 H new ATOM 1149 N TYR A 79 -9.185 3.329 4.921 1.00 0.00 N ATOM 1150 CA TYR A 79 -9.969 4.353 5.591 1.00 0.00 C ATOM 1151 C TYR A 79 -9.277 4.822 6.872 1.00 0.00 C ATOM 1152 O TYR A 79 -9.582 5.896 7.389 1.00 0.00 O ATOM 1153 CB TYR A 79 -11.300 3.693 5.956 1.00 0.00 C ATOM 1154 CG TYR A 79 -12.346 3.743 4.841 1.00 0.00 C ATOM 1155 CD1 TYR A 79 -11.966 4.051 3.551 1.00 0.00 C ATOM 1156 CD2 TYR A 79 -13.671 3.480 5.126 1.00 0.00 C ATOM 1157 CE1 TYR A 79 -12.951 4.098 2.502 1.00 0.00 C ATOM 1158 CE2 TYR A 79 -14.656 3.526 4.076 1.00 0.00 C ATOM 1159 CZ TYR A 79 -14.247 3.833 2.816 1.00 0.00 C ATOM 1160 OH TYR A 79 -15.177 3.878 1.825 1.00 0.00 O ATOM 0 H TYR A 79 -9.628 2.411 4.881 1.00 0.00 H new ATOM 0 HA TYR A 79 -10.097 5.223 4.946 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -11.117 2.652 6.222 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.705 4.182 6.842 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.930 4.257 3.328 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -13.969 3.240 6.136 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.667 4.338 1.488 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -15.696 3.321 4.285 1.00 0.00 H new ATOM 0 HH TYR A 79 -16.060 3.666 2.195 1.00 0.00 H new ATOM 1170 N GLY A 80 -8.358 3.994 7.347 1.00 0.00 N ATOM 1171 CA GLY A 80 -7.620 4.311 8.558 1.00 0.00 C ATOM 1172 C GLY A 80 -6.122 4.429 8.273 1.00 0.00 C ATOM 1173 O GLY A 80 -5.544 5.507 8.401 1.00 0.00 O ATOM 0 H GLY A 80 -8.108 3.104 6.915 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.989 5.247 8.978 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.792 3.537 9.306 1.00 0.00 H new ATOM 1177 N ARG A 81 -5.535 3.305 7.890 1.00 0.00 N ATOM 1178 CA ARG A 81 -4.115 3.268 7.585 1.00 0.00 C ATOM 1179 C ARG A 81 -3.698 4.540 6.844 1.00 0.00 C ATOM 1180 O ARG A 81 -2.584 5.030 7.023 1.00 0.00 O ATOM 1181 CB ARG A 81 -3.767 2.050 6.727 1.00 0.00 C ATOM 1182 CG ARG A 81 -3.832 0.762 7.550 1.00 0.00 C ATOM 1183 CD ARG A 81 -2.657 0.676 8.527 1.00 0.00 C ATOM 1184 NE ARG A 81 -2.865 -0.444 9.472 1.00 0.00 N ATOM 1185 CZ ARG A 81 -3.626 -0.367 10.571 1.00 0.00 C ATOM 1186 NH1 ARG A 81 -4.257 0.777 10.872 1.00 0.00 N ATOM 1187 NH2 ARG A 81 -3.758 -1.434 11.371 1.00 0.00 N ATOM 0 H ARG A 81 -6.017 2.412 7.784 1.00 0.00 H new ATOM 0 HA ARG A 81 -3.575 3.199 8.529 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.458 1.984 5.886 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -2.767 2.169 6.309 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -4.772 0.725 8.101 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -3.820 -0.101 6.884 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -1.727 0.531 7.978 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -2.561 1.613 9.076 1.00 0.00 H new ATOM 0 HE ARG A 81 -2.400 -1.330 9.274 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -4.158 1.590 10.264 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -4.837 0.835 11.709 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -3.279 -2.305 11.143 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -4.338 -1.375 12.208 1.00 0.00 H new ATOM 1201 N ASP A 82 -4.615 5.040 6.029 1.00 0.00 N ATOM 1202 CA ASP A 82 -4.357 6.246 5.261 1.00 0.00 C ATOM 1203 C ASP A 82 -4.034 7.395 6.218 1.00 0.00 C ATOM 1204 O ASP A 82 -4.938 8.017 6.774 1.00 0.00 O ATOM 1205 CB ASP A 82 -5.582 6.647 4.437 1.00 0.00 C ATOM 1206 CG ASP A 82 -5.525 8.053 3.836 1.00 0.00 C ATOM 1207 OD1 ASP A 82 -5.326 9.000 4.626 1.00 0.00 O ATOM 1208 OD2 ASP A 82 -5.680 8.148 2.599 1.00 0.00 O ATOM 0 H ASP A 82 -5.538 4.632 5.884 1.00 0.00 H new ATOM 0 HA ASP A 82 -3.521 6.047 4.590 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -5.709 5.927 3.628 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.467 6.574 5.070 1.00 0.00 H new ATOM 1213 N GLY A 83 -2.742 7.642 6.380 1.00 0.00 N ATOM 1214 CA GLY A 83 -2.289 8.706 7.260 1.00 0.00 C ATOM 1215 C GLY A 83 -1.844 8.146 8.613 1.00 0.00 C ATOM 1216 O GLY A 83 -2.039 8.783 9.647 1.00 0.00 O ATOM 0 H GLY A 83 -1.995 7.124 5.917 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -1.462 9.241 6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.092 9.428 7.407 1.00 0.00 H new ATOM 1220 N TYR A 84 -1.253 6.961 8.561 1.00 0.00 N ATOM 1221 CA TYR A 84 -0.779 6.309 9.770 1.00 0.00 C ATOM 1222 C TYR A 84 0.618 6.805 10.148 1.00 0.00 C ATOM 1223 O TYR A 84 1.295 7.441 9.341 1.00 0.00 O ATOM 1224 CB TYR A 84 -0.705 4.816 9.442 1.00 0.00 C ATOM 1225 CG TYR A 84 -0.123 3.959 10.567 1.00 0.00 C ATOM 1226 CD1 TYR A 84 -0.818 3.809 11.750 1.00 0.00 C ATOM 1227 CD2 TYR A 84 1.098 3.337 10.400 1.00 0.00 C ATOM 1228 CE1 TYR A 84 -0.269 3.002 12.810 1.00 0.00 C ATOM 1229 CE2 TYR A 84 1.646 2.531 11.460 1.00 0.00 C ATOM 1230 CZ TYR A 84 0.935 2.403 12.612 1.00 0.00 C ATOM 1231 OH TYR A 84 1.453 1.642 13.613 1.00 0.00 O ATOM 0 H TYR A 84 -1.092 6.436 7.701 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.444 6.521 10.607 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.707 4.456 9.207 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.099 4.681 8.546 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.773 4.296 11.881 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.642 3.455 9.475 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.802 2.876 13.741 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.600 2.039 11.343 1.00 0.00 H new ATOM 0 HH TYR A 84 2.317 1.275 13.331 1.00 0.00 H new ATOM 1241 N ASP A 85 1.009 6.495 11.376 1.00 0.00 N ATOM 1242 CA ASP A 85 2.313 6.901 11.871 1.00 0.00 C ATOM 1243 C ASP A 85 3.148 5.656 12.177 1.00 0.00 C ATOM 1244 O ASP A 85 3.046 5.087 13.263 1.00 0.00 O ATOM 1245 CB ASP A 85 2.184 7.713 13.161 1.00 0.00 C ATOM 1246 CG ASP A 85 3.511 8.120 13.805 1.00 0.00 C ATOM 1247 OD1 ASP A 85 4.108 9.097 13.303 1.00 0.00 O ATOM 1248 OD2 ASP A 85 3.898 7.446 14.784 1.00 0.00 O ATOM 0 H ASP A 85 0.445 5.967 12.042 1.00 0.00 H new ATOM 0 HA ASP A 85 2.788 7.514 11.105 1.00 0.00 H new ATOM 0 HB2 ASP A 85 1.609 8.614 12.949 1.00 0.00 H new ATOM 0 HB3 ASP A 85 1.611 7.131 13.883 1.00 0.00 H new ATOM 1253 N TYR A 86 3.956 5.270 11.200 1.00 0.00 N ATOM 1254 CA TYR A 86 4.808 4.103 11.352 1.00 0.00 C ATOM 1255 C TYR A 86 6.171 4.490 11.929 1.00 0.00 C ATOM 1256 O TYR A 86 7.071 4.890 11.191 1.00 0.00 O ATOM 1257 CB TYR A 86 5.005 3.539 9.943 1.00 0.00 C ATOM 1258 CG TYR A 86 5.762 2.210 9.905 1.00 0.00 C ATOM 1259 CD1 TYR A 86 7.142 2.200 9.941 1.00 0.00 C ATOM 1260 CD2 TYR A 86 5.065 1.021 9.834 1.00 0.00 C ATOM 1261 CE1 TYR A 86 7.854 0.949 9.905 1.00 0.00 C ATOM 1262 CE2 TYR A 86 5.777 -0.230 9.799 1.00 0.00 C ATOM 1263 CZ TYR A 86 7.137 -0.204 9.836 1.00 0.00 C ATOM 1264 OH TYR A 86 7.809 -1.386 9.802 1.00 0.00 O ATOM 0 H TYR A 86 4.038 5.745 10.301 1.00 0.00 H new ATOM 0 HA TYR A 86 4.354 3.382 12.032 1.00 0.00 H new ATOM 0 HB2 TYR A 86 4.029 3.403 9.478 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.545 4.271 9.342 1.00 0.00 H new ATOM 0 HD1 TYR A 86 7.688 3.130 9.996 1.00 0.00 H new ATOM 0 HD2 TYR A 86 3.985 1.029 9.805 1.00 0.00 H new ATOM 0 HE1 TYR A 86 8.933 0.927 9.932 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.244 -1.168 9.745 1.00 0.00 H new ATOM 0 HH TYR A 86 7.816 -1.784 10.697 1.00 0.00 H new ATOM 1274 N ASP A 87 6.281 4.358 13.242 1.00 0.00 N ATOM 1275 CA ASP A 87 7.519 4.690 13.927 1.00 0.00 C ATOM 1276 C ASP A 87 7.898 6.139 13.614 1.00 0.00 C ATOM 1277 O ASP A 87 9.079 6.481 13.576 1.00 0.00 O ATOM 1278 CB ASP A 87 8.665 3.790 13.459 1.00 0.00 C ATOM 1279 CG ASP A 87 9.735 3.504 14.514 1.00 0.00 C ATOM 1280 OD1 ASP A 87 9.406 2.771 15.472 1.00 0.00 O ATOM 1281 OD2 ASP A 87 10.858 4.024 14.339 1.00 0.00 O ATOM 0 H ASP A 87 5.533 4.026 13.851 1.00 0.00 H new ATOM 0 HA ASP A 87 7.361 4.548 14.996 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.247 2.842 13.121 1.00 0.00 H new ATOM 0 HB3 ASP A 87 9.142 4.254 12.596 1.00 0.00 H new ATOM 1286 N GLY A 88 6.873 6.951 13.399 1.00 0.00 N ATOM 1287 CA GLY A 88 7.084 8.355 13.090 1.00 0.00 C ATOM 1288 C GLY A 88 6.897 8.623 11.596 1.00 0.00 C ATOM 1289 O GLY A 88 6.404 9.681 11.207 1.00 0.00 O ATOM 0 H GLY A 88 5.895 6.664 13.433 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.386 8.966 13.663 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.089 8.650 13.393 1.00 0.00 H new ATOM 1293 N TYR A 89 7.300 7.645 10.797 1.00 0.00 N ATOM 1294 CA TYR A 89 7.183 7.762 9.354 1.00 0.00 C ATOM 1295 C TYR A 89 5.717 7.726 8.918 1.00 0.00 C ATOM 1296 O TYR A 89 5.042 6.710 9.081 1.00 0.00 O ATOM 1297 CB TYR A 89 7.906 6.545 8.773 1.00 0.00 C ATOM 1298 CG TYR A 89 9.407 6.514 9.065 1.00 0.00 C ATOM 1299 CD1 TYR A 89 10.279 7.231 8.270 1.00 0.00 C ATOM 1300 CD2 TYR A 89 9.889 5.770 10.122 1.00 0.00 C ATOM 1301 CE1 TYR A 89 11.693 7.202 8.545 1.00 0.00 C ATOM 1302 CE2 TYR A 89 11.303 5.742 10.397 1.00 0.00 C ATOM 1303 CZ TYR A 89 12.134 6.459 9.595 1.00 0.00 C ATOM 1304 OH TYR A 89 13.469 6.432 9.855 1.00 0.00 O ATOM 0 H TYR A 89 7.708 6.768 11.122 1.00 0.00 H new ATOM 0 HA TYR A 89 7.608 8.705 9.009 1.00 0.00 H new ATOM 0 HB2 TYR A 89 7.450 5.639 9.173 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.756 6.527 7.694 1.00 0.00 H new ATOM 0 HD1 TYR A 89 9.901 7.813 7.442 1.00 0.00 H new ATOM 0 HD2 TYR A 89 9.207 5.209 10.743 1.00 0.00 H new ATOM 0 HE1 TYR A 89 12.387 7.758 7.931 1.00 0.00 H new ATOM 0 HE2 TYR A 89 11.694 5.164 11.222 1.00 0.00 H new ATOM 0 HH TYR A 89 13.639 5.862 10.634 1.00 0.00 H new ATOM 1314 N ARG A 90 5.268 8.846 8.371 1.00 0.00 N ATOM 1315 CA ARG A 90 3.894 8.955 7.911 1.00 0.00 C ATOM 1316 C ARG A 90 3.705 8.167 6.613 1.00 0.00 C ATOM 1317 O ARG A 90 4.503 8.292 5.685 1.00 0.00 O ATOM 1318 CB ARG A 90 3.508 10.417 7.673 1.00 0.00 C ATOM 1319 CG ARG A 90 2.085 10.524 7.121 1.00 0.00 C ATOM 1320 CD ARG A 90 1.102 10.947 8.215 1.00 0.00 C ATOM 1321 NE ARG A 90 -0.077 11.605 7.609 1.00 0.00 N ATOM 1322 CZ ARG A 90 -1.013 12.262 8.309 1.00 0.00 C ATOM 1323 NH1 ARG A 90 -0.912 12.353 9.641 1.00 0.00 N ATOM 1324 NH2 ARG A 90 -2.049 12.827 7.675 1.00 0.00 N ATOM 0 H ARG A 90 5.831 9.686 8.236 1.00 0.00 H new ATOM 0 HA ARG A 90 3.250 8.542 8.688 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.583 10.974 8.607 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.209 10.873 6.974 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.061 11.247 6.306 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.780 9.564 6.704 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.787 10.076 8.789 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.591 11.628 8.911 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.184 11.556 6.596 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.123 11.923 10.123 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -1.624 12.853 10.173 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -2.125 12.757 6.660 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -2.761 13.327 8.207 1.00 0.00 H new ATOM 1338 N LEU A 91 2.645 7.373 6.589 1.00 0.00 N ATOM 1339 CA LEU A 91 2.341 6.565 5.420 1.00 0.00 C ATOM 1340 C LEU A 91 1.132 7.160 4.695 1.00 0.00 C ATOM 1341 O LEU A 91 0.249 7.739 5.325 1.00 0.00 O ATOM 1342 CB LEU A 91 2.161 5.098 5.815 1.00 0.00 C ATOM 1343 CG LEU A 91 3.286 4.487 6.654 1.00 0.00 C ATOM 1344 CD1 LEU A 91 2.971 3.034 7.016 1.00 0.00 C ATOM 1345 CD2 LEU A 91 4.634 4.621 5.943 1.00 0.00 C ATOM 0 H LEU A 91 1.986 7.272 7.361 1.00 0.00 H new ATOM 0 HA LEU A 91 3.174 6.582 4.718 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.228 5.004 6.370 1.00 0.00 H new ATOM 0 HB3 LEU A 91 2.051 4.508 4.905 1.00 0.00 H new ATOM 0 HG LEU A 91 3.358 5.044 7.588 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.786 2.623 7.612 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.045 2.995 7.590 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.857 2.448 6.104 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.416 4.179 6.560 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.593 4.104 4.984 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.855 5.675 5.777 1.00 0.00 H new ATOM 1357 N ARG A 92 1.131 6.995 3.380 1.00 0.00 N ATOM 1358 CA ARG A 92 0.045 7.508 2.562 1.00 0.00 C ATOM 1359 C ARG A 92 -0.666 6.360 1.844 1.00 0.00 C ATOM 1360 O ARG A 92 -0.210 5.900 0.798 1.00 0.00 O ATOM 1361 CB ARG A 92 0.561 8.508 1.526 1.00 0.00 C ATOM 1362 CG ARG A 92 -0.262 9.797 1.550 1.00 0.00 C ATOM 1363 CD ARG A 92 0.438 10.880 2.373 1.00 0.00 C ATOM 1364 NE ARG A 92 -0.098 12.213 2.017 1.00 0.00 N ATOM 1365 CZ ARG A 92 0.235 13.349 2.644 1.00 0.00 C ATOM 1366 NH1 ARG A 92 1.105 13.321 3.663 1.00 0.00 N ATOM 1367 NH2 ARG A 92 -0.302 14.513 2.253 1.00 0.00 N ATOM 0 H ARG A 92 1.865 6.513 2.861 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.656 8.017 3.223 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.608 8.737 1.726 1.00 0.00 H new ATOM 0 HB3 ARG A 92 0.517 8.063 0.532 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -0.417 10.153 0.531 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -1.247 9.596 1.971 1.00 0.00 H new ATOM 0 HD2 ARG A 92 0.291 10.692 3.437 1.00 0.00 H new ATOM 0 HD3 ARG A 92 1.512 10.850 2.190 1.00 0.00 H new ATOM 0 HE ARG A 92 -0.763 12.270 1.246 1.00 0.00 H new ATOM 0 HH11 ARG A 92 1.513 12.435 3.961 1.00 0.00 H new ATOM 0 HH12 ARG A 92 1.359 14.186 4.141 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.965 14.534 1.478 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -0.048 15.378 2.731 1.00 0.00 H new ATOM 1381 N VAL A 93 -1.772 5.930 2.433 1.00 0.00 N ATOM 1382 CA VAL A 93 -2.550 4.844 1.862 1.00 0.00 C ATOM 1383 C VAL A 93 -3.712 5.425 1.054 1.00 0.00 C ATOM 1384 O VAL A 93 -4.495 6.222 1.571 1.00 0.00 O ATOM 1385 CB VAL A 93 -3.009 3.891 2.968 1.00 0.00 C ATOM 1386 CG1 VAL A 93 -3.307 2.500 2.404 1.00 0.00 C ATOM 1387 CG2 VAL A 93 -1.973 3.817 4.092 1.00 0.00 C ATOM 0 H VAL A 93 -2.148 6.314 3.300 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.939 4.256 1.177 1.00 0.00 H new ATOM 0 HB VAL A 93 -3.933 4.286 3.390 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.631 1.842 3.210 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.096 2.572 1.655 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.406 2.093 1.944 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.323 3.133 4.865 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.026 3.456 3.691 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -1.831 4.809 4.522 1.00 0.00 H new ATOM 1397 N GLU A 94 -3.788 5.005 -0.200 1.00 0.00 N ATOM 1398 CA GLU A 94 -4.841 5.474 -1.084 1.00 0.00 C ATOM 1399 C GLU A 94 -5.012 4.512 -2.262 1.00 0.00 C ATOM 1400 O GLU A 94 -4.056 3.864 -2.683 1.00 0.00 O ATOM 1401 CB GLU A 94 -4.554 6.895 -1.573 1.00 0.00 C ATOM 1402 CG GLU A 94 -3.353 6.916 -2.520 1.00 0.00 C ATOM 1403 CD GLU A 94 -2.419 8.084 -2.195 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -2.170 8.293 -0.988 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -1.975 8.742 -3.161 1.00 0.00 O ATOM 0 H GLU A 94 -3.137 4.345 -0.625 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.775 5.500 -0.523 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.431 7.292 -2.084 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -4.360 7.545 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.807 5.976 -2.441 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.699 6.998 -3.550 1.00 0.00 H new ATOM 1412 N PHE A 95 -6.238 4.452 -2.762 1.00 0.00 N ATOM 1413 CA PHE A 95 -6.547 3.580 -3.883 1.00 0.00 C ATOM 1414 C PHE A 95 -5.915 4.104 -5.174 1.00 0.00 C ATOM 1415 O PHE A 95 -5.810 5.313 -5.373 1.00 0.00 O ATOM 1416 CB PHE A 95 -8.069 3.576 -4.040 1.00 0.00 C ATOM 1417 CG PHE A 95 -8.804 2.788 -2.953 1.00 0.00 C ATOM 1418 CD1 PHE A 95 -8.496 1.482 -2.734 1.00 0.00 C ATOM 1419 CD2 PHE A 95 -9.765 3.395 -2.206 1.00 0.00 C ATOM 1420 CE1 PHE A 95 -9.178 0.751 -1.726 1.00 0.00 C ATOM 1421 CE2 PHE A 95 -10.448 2.664 -1.198 1.00 0.00 C ATOM 1422 CZ PHE A 95 -10.140 1.358 -0.979 1.00 0.00 C ATOM 0 H PHE A 95 -7.029 4.993 -2.412 1.00 0.00 H new ATOM 0 HA PHE A 95 -6.154 2.580 -3.697 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -8.428 4.605 -4.034 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -8.323 3.156 -5.013 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.732 1.001 -3.327 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.009 4.433 -2.379 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -8.933 -0.286 -1.552 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -11.212 3.145 -0.606 1.00 0.00 H new ATOM 0 HZ PHE A 95 -10.659 0.802 -0.212 1.00 0.00 H new ATOM 1432 N PRO A 96 -5.498 3.142 -6.041 1.00 0.00 N ATOM 1433 CA PRO A 96 -4.879 3.494 -7.308 1.00 0.00 C ATOM 1434 C PRO A 96 -5.923 3.993 -8.308 1.00 0.00 C ATOM 1435 O PRO A 96 -7.042 3.483 -8.350 1.00 0.00 O ATOM 1436 CB PRO A 96 -4.174 2.227 -7.766 1.00 0.00 C ATOM 1437 CG PRO A 96 -4.807 1.091 -6.980 1.00 0.00 C ATOM 1438 CD PRO A 96 -5.605 1.700 -5.839 1.00 0.00 C ATOM 0 HA PRO A 96 -4.170 4.317 -7.216 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.298 2.077 -8.838 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.103 2.285 -7.574 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.455 0.496 -7.624 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.039 0.420 -6.593 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.644 1.373 -5.864 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.201 1.405 -4.871 1.00 0.00 H new ATOM 1446 N ARG A 97 -5.520 4.984 -9.090 1.00 0.00 N ATOM 1447 CA ARG A 97 -6.407 5.557 -10.088 1.00 0.00 C ATOM 1448 C ARG A 97 -7.190 4.452 -10.801 1.00 0.00 C ATOM 1449 O ARG A 97 -6.716 3.322 -10.909 1.00 0.00 O ATOM 1450 CB ARG A 97 -5.622 6.365 -11.123 1.00 0.00 C ATOM 1451 CG ARG A 97 -4.641 5.473 -11.886 1.00 0.00 C ATOM 1452 CD ARG A 97 -3.252 6.111 -11.945 1.00 0.00 C ATOM 1453 NE ARG A 97 -2.321 5.232 -12.688 1.00 0.00 N ATOM 1454 CZ ARG A 97 -1.071 5.574 -13.025 1.00 0.00 C ATOM 1455 NH1 ARG A 97 -0.593 6.780 -12.688 1.00 0.00 N ATOM 1456 NH2 ARG A 97 -0.298 4.712 -13.699 1.00 0.00 N ATOM 0 H ARG A 97 -4.591 5.404 -9.053 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.099 6.223 -9.573 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.313 6.834 -11.824 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -5.078 7.168 -10.626 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -4.577 4.499 -11.401 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.010 5.302 -12.897 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -3.311 7.085 -12.431 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -2.878 6.280 -10.935 1.00 0.00 H new ATOM 0 HE ARG A 97 -2.653 4.307 -12.961 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -1.181 7.437 -12.175 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.359 7.041 -12.944 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -0.662 3.794 -13.956 1.00 0.00 H new ATOM 0 HH22 ARG A 97 0.654 4.973 -13.955 1.00 0.00 H new ATOM 1470 N SER A 98 -8.374 4.817 -11.268 1.00 0.00 N ATOM 1471 CA SER A 98 -9.227 3.871 -11.967 1.00 0.00 C ATOM 1472 C SER A 98 -10.078 4.603 -13.008 1.00 0.00 C ATOM 1473 O SER A 98 -10.797 5.543 -12.676 1.00 0.00 O ATOM 1474 CB SER A 98 -10.124 3.110 -10.989 1.00 0.00 C ATOM 1475 OG SER A 98 -10.454 1.810 -11.468 1.00 0.00 O ATOM 0 H SER A 98 -8.763 5.755 -11.176 1.00 0.00 H new ATOM 0 HA SER A 98 -8.590 3.146 -12.473 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.620 3.024 -10.026 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.039 3.677 -10.820 1.00 0.00 H new ATOM 0 HG SER A 98 -11.026 1.356 -10.815 1.00 0.00 H new ATOM 1481 N GLY A 99 -9.967 4.143 -14.245 1.00 0.00 N ATOM 1482 CA GLY A 99 -10.717 4.742 -15.336 1.00 0.00 C ATOM 1483 C GLY A 99 -12.148 5.067 -14.904 1.00 0.00 C ATOM 1484 O GLY A 99 -12.893 4.179 -14.491 1.00 0.00 O ATOM 0 H GLY A 99 -9.369 3.362 -14.516 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -10.218 5.652 -15.668 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -10.736 4.060 -16.186 1.00 0.00 H new ATOM 1488 N ARG A 100 -12.489 6.343 -15.014 1.00 0.00 N ATOM 1489 CA ARG A 100 -13.818 6.796 -14.639 1.00 0.00 C ATOM 1490 C ARG A 100 -14.594 7.248 -15.878 1.00 0.00 C ATOM 1491 O ARG A 100 -14.232 8.235 -16.516 1.00 0.00 O ATOM 1492 CB ARG A 100 -13.744 7.955 -13.643 1.00 0.00 C ATOM 1493 CG ARG A 100 -15.144 8.403 -13.217 1.00 0.00 C ATOM 1494 CD ARG A 100 -15.258 9.928 -13.228 1.00 0.00 C ATOM 1495 NE ARG A 100 -14.637 10.491 -12.008 1.00 0.00 N ATOM 1496 CZ ARG A 100 -14.438 11.800 -11.801 1.00 0.00 C ATOM 1497 NH1 ARG A 100 -14.810 12.689 -12.732 1.00 0.00 N ATOM 1498 NH2 ARG A 100 -13.866 12.220 -10.665 1.00 0.00 N ATOM 0 H ARG A 100 -11.869 7.077 -15.357 1.00 0.00 H new ATOM 0 HA ARG A 100 -14.333 5.959 -14.168 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -13.174 7.649 -12.766 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -13.212 8.793 -14.093 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -15.887 7.974 -13.889 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -15.362 8.026 -12.218 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -14.768 10.331 -14.114 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -16.306 10.222 -13.281 1.00 0.00 H new ATOM 0 HE ARG A 100 -14.342 9.842 -11.279 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -15.244 12.369 -13.598 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -14.659 13.685 -12.575 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -13.582 11.543 -9.957 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -13.715 13.216 -10.508 1.00 0.00 H new ATOM 1512 N GLY A 101 -15.646 6.502 -16.182 1.00 0.00 N ATOM 1513 CA GLY A 101 -16.476 6.813 -17.334 1.00 0.00 C ATOM 1514 C GLY A 101 -17.319 8.065 -17.080 1.00 0.00 C ATOM 1515 O GLY A 101 -16.960 9.158 -17.516 1.00 0.00 O ATOM 0 H GLY A 101 -15.943 5.683 -15.651 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -15.846 6.966 -18.210 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -17.129 5.969 -17.555 1.00 0.00 H new ATOM 1519 N THR A 102 -18.423 7.863 -16.377 1.00 0.00 N ATOM 1520 CA THR A 102 -19.320 8.962 -16.061 1.00 0.00 C ATOM 1521 C THR A 102 -19.535 9.846 -17.291 1.00 0.00 C ATOM 1522 O THR A 102 -19.168 9.469 -18.403 1.00 0.00 O ATOM 1523 CB THR A 102 -18.739 9.717 -14.864 1.00 0.00 C ATOM 1524 OG1 THR A 102 -19.794 10.581 -14.452 1.00 0.00 O ATOM 1525 CG2 THR A 102 -17.611 10.671 -15.265 1.00 0.00 C ATOM 0 H THR A 102 -18.717 6.955 -16.017 1.00 0.00 H new ATOM 0 HA THR A 102 -20.310 8.598 -15.785 1.00 0.00 H new ATOM 0 HB THR A 102 -18.367 9.002 -14.131 1.00 0.00 H new ATOM 0 HG1 THR A 102 -19.503 11.107 -13.678 1.00 0.00 H new ATOM 0 HG21 THR A 102 -17.234 11.182 -14.379 1.00 0.00 H new ATOM 0 HG22 THR A 102 -16.803 10.105 -15.729 1.00 0.00 H new ATOM 0 HG23 THR A 102 -17.991 11.407 -15.973 1.00 0.00 H new ATOM 1533 N GLY A 103 -20.129 11.006 -17.050 1.00 0.00 N ATOM 1534 CA GLY A 103 -20.397 11.947 -18.124 1.00 0.00 C ATOM 1535 C GLY A 103 -21.894 12.242 -18.234 1.00 0.00 C ATOM 1536 O GLY A 103 -22.534 11.866 -19.215 1.00 0.00 O ATOM 0 H GLY A 103 -20.432 11.315 -16.126 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -19.852 12.874 -17.944 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -20.033 11.541 -19.068 1.00 0.00 H new ATOM 1540 N SER A 104 -22.409 12.912 -17.213 1.00 0.00 N ATOM 1541 CA SER A 104 -23.819 13.261 -17.182 1.00 0.00 C ATOM 1542 C SER A 104 -24.006 14.719 -17.609 1.00 0.00 C ATOM 1543 O SER A 104 -23.090 15.529 -17.481 1.00 0.00 O ATOM 1544 CB SER A 104 -24.412 13.036 -15.790 1.00 0.00 C ATOM 1545 OG SER A 104 -23.807 13.874 -14.810 1.00 0.00 O ATOM 0 H SER A 104 -21.875 13.222 -16.401 1.00 0.00 H new ATOM 0 HA SER A 104 -24.347 12.613 -17.881 1.00 0.00 H new ATOM 0 HB2 SER A 104 -25.485 13.227 -15.818 1.00 0.00 H new ATOM 0 HB3 SER A 104 -24.281 11.992 -15.505 1.00 0.00 H new ATOM 0 HG SER A 104 -24.214 13.701 -13.936 1.00 0.00 H new ATOM 1551 N GLY A 105 -25.199 15.007 -18.108 1.00 0.00 N ATOM 1552 CA GLY A 105 -25.518 16.353 -18.554 1.00 0.00 C ATOM 1553 C GLY A 105 -26.452 17.052 -17.564 1.00 0.00 C ATOM 1554 O GLY A 105 -27.254 16.401 -16.896 1.00 0.00 O ATOM 0 H GLY A 105 -25.956 14.332 -18.213 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -24.600 16.931 -18.663 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -25.988 16.312 -19.537 1.00 0.00 H new ATOM 1558 N PRO A 106 -26.314 18.403 -17.499 1.00 0.00 N ATOM 1559 CA PRO A 106 -27.135 19.198 -16.602 1.00 0.00 C ATOM 1560 C PRO A 106 -28.560 19.335 -17.141 1.00 0.00 C ATOM 1561 O PRO A 106 -28.787 19.217 -18.344 1.00 0.00 O ATOM 1562 CB PRO A 106 -26.414 20.531 -16.484 1.00 0.00 C ATOM 1563 CG PRO A 106 -25.471 20.601 -17.674 1.00 0.00 C ATOM 1564 CD PRO A 106 -25.374 19.208 -18.275 1.00 0.00 C ATOM 0 HA PRO A 106 -27.254 18.737 -15.621 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -27.121 21.360 -16.497 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -25.864 20.596 -15.545 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -25.842 21.311 -18.414 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -24.487 20.951 -17.361 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -25.637 19.214 -19.333 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -24.360 18.814 -18.201 1.00 0.00 H new ATOM 1572 N SER A 107 -29.484 19.583 -16.224 1.00 0.00 N ATOM 1573 CA SER A 107 -30.881 19.738 -16.592 1.00 0.00 C ATOM 1574 C SER A 107 -31.679 20.280 -15.404 1.00 0.00 C ATOM 1575 O SER A 107 -31.520 19.808 -14.279 1.00 0.00 O ATOM 1576 CB SER A 107 -31.475 18.411 -17.070 1.00 0.00 C ATOM 1577 OG SER A 107 -32.363 18.589 -18.171 1.00 0.00 O ATOM 0 H SER A 107 -29.292 19.680 -15.227 1.00 0.00 H new ATOM 0 HA SER A 107 -30.941 20.449 -17.416 1.00 0.00 H new ATOM 0 HB2 SER A 107 -30.669 17.737 -17.360 1.00 0.00 H new ATOM 0 HB3 SER A 107 -32.009 17.935 -16.247 1.00 0.00 H new ATOM 0 HG SER A 107 -32.720 17.719 -18.448 1.00 0.00 H new ATOM 1583 N SER A 108 -32.519 21.262 -15.695 1.00 0.00 N ATOM 1584 CA SER A 108 -33.342 21.872 -14.664 1.00 0.00 C ATOM 1585 C SER A 108 -34.823 21.670 -14.989 1.00 0.00 C ATOM 1586 O SER A 108 -35.182 21.425 -16.140 1.00 0.00 O ATOM 1587 CB SER A 108 -33.028 23.363 -14.521 1.00 0.00 C ATOM 1588 OG SER A 108 -31.926 23.596 -13.649 1.00 0.00 O ATOM 0 H SER A 108 -32.648 21.650 -16.629 1.00 0.00 H new ATOM 0 HA SER A 108 -33.116 21.388 -13.714 1.00 0.00 H new ATOM 0 HB2 SER A 108 -32.808 23.783 -15.503 1.00 0.00 H new ATOM 0 HB3 SER A 108 -33.907 23.884 -14.141 1.00 0.00 H new ATOM 0 HG SER A 108 -31.757 24.559 -13.586 1.00 0.00 H new ATOM 1594 N GLY A 109 -35.643 21.780 -13.954 1.00 0.00 N ATOM 1595 CA GLY A 109 -37.077 21.612 -14.115 1.00 0.00 C ATOM 1596 C GLY A 109 -37.423 20.166 -14.475 1.00 0.00 C ATOM 1597 O GLY A 109 -37.978 19.434 -13.657 1.00 0.00 O ATOM 0 H GLY A 109 -35.342 21.983 -13.001 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -37.585 21.892 -13.192 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -37.440 22.281 -14.895 1.00 0.00 H new TER 1601 GLY A 109