USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 756 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 51 SER OG : rot -160:sc= 0 USER MOD Set 1.2: A 52 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 43 LYS NZ :NH3+ 141:sc= -0.389 (180deg=-0.246) USER MOD Set 2.2: A 44 ASN : amide:sc= -2.26! C(o=-1.6!,f=-12!) USER MOD Set 2.3: A 76 SER OG : rot -115:sc= 1.05 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 33:sc= 1.05 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0.137 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 22 LYS NZ :NH3+ 155:sc= -0.192 (180deg=-0.976) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 30:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 LYS NZ :NH3+ 163:sc= -0.458 (180deg=-0.977) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HD1:sc= -1.08 K(o=-1.1,f=0.09) USER MOD Single : A 59 LYS NZ :NH3+ -164:sc=-0.00618 (180deg=-0.167) USER MOD Single : A 61 CYS SG : rot 180:sc=-0.00287 USER MOD Single : A 62 GLN : amide:sc= -0.827 K(o=-0.83,f=-0.021) USER MOD Single : A 68 ASN : amide:sc= -0.533 K(o=-0.53,f=-2.7) USER MOD Single : A 69 ASN : amide:sc= -0.32 K(o=-0.32,f=-3.5!) USER MOD Single : A 70 CYS SG : rot 29:sc= -4.52! USER MOD Single : A 71 GLN : amide:sc= -1.15 K(o=-1.2,f=-0.59) USER MOD Single : A 72 MET CE :methyl 164:sc= -1.52 (180deg=-2.59) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.00829 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 93:sc= 0.0354 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0663 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot -170:sc= -0.937 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot -172:sc= 1.28 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 27:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.610 -8.524 -3.468 1.00 0.00 N ATOM 2 CA GLY A 1 -24.370 -7.897 -3.890 1.00 0.00 C ATOM 3 C GLY A 1 -24.603 -6.691 -4.778 1.00 0.00 C ATOM 4 O GLY A 1 -24.360 -6.743 -5.983 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.397 -9.343 -2.863 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.181 -7.839 -2.934 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.141 -8.840 -4.304 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.803 -7.592 -3.010 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.762 -8.626 -4.425 1.00 0.00 H new ATOM 8 N SER A 2 -25.078 -5.602 -4.181 1.00 0.00 N ATOM 9 CA SER A 2 -25.349 -4.379 -4.927 1.00 0.00 C ATOM 10 C SER A 2 -24.093 -3.521 -5.039 1.00 0.00 C ATOM 11 O SER A 2 -23.671 -2.889 -4.071 1.00 0.00 O ATOM 12 CB SER A 2 -26.466 -3.582 -4.251 1.00 0.00 C ATOM 13 OG SER A 2 -27.601 -4.396 -4.012 1.00 0.00 O ATOM 0 H SER A 2 -25.283 -5.542 -3.184 1.00 0.00 H new ATOM 0 HA SER A 2 -25.668 -4.658 -5.931 1.00 0.00 H new ATOM 0 HB2 SER A 2 -26.104 -3.171 -3.308 1.00 0.00 H new ATOM 0 HB3 SER A 2 -26.746 -2.737 -4.880 1.00 0.00 H new ATOM 0 HG SER A 2 -28.300 -3.864 -3.578 1.00 0.00 H new ATOM 19 N SER A 3 -23.499 -3.504 -6.229 1.00 0.00 N ATOM 20 CA SER A 3 -22.289 -2.727 -6.468 1.00 0.00 C ATOM 21 C SER A 3 -22.536 -1.645 -7.514 1.00 0.00 C ATOM 22 O SER A 3 -22.636 -1.930 -8.707 1.00 0.00 O ATOM 23 CB SER A 3 -21.151 -3.643 -6.924 1.00 0.00 C ATOM 24 OG SER A 3 -20.488 -4.223 -5.814 1.00 0.00 O ATOM 0 H SER A 3 -23.837 -4.020 -7.042 1.00 0.00 H new ATOM 0 HA SER A 3 -22.005 -2.245 -5.532 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.548 -4.429 -7.566 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.438 -3.074 -7.521 1.00 0.00 H new ATOM 0 HG SER A 3 -19.766 -4.805 -6.132 1.00 0.00 H new ATOM 30 N GLY A 4 -22.633 -0.400 -7.058 1.00 0.00 N ATOM 31 CA GLY A 4 -22.868 0.707 -7.966 1.00 0.00 C ATOM 32 C GLY A 4 -22.057 0.593 -9.241 1.00 0.00 C ATOM 33 O GLY A 4 -22.530 0.050 -10.239 1.00 0.00 O ATOM 0 H GLY A 4 -22.553 -0.138 -6.075 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.928 0.749 -8.216 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.621 1.643 -7.465 1.00 0.00 H new ATOM 37 N SER A 5 -20.832 1.108 -9.210 1.00 0.00 N ATOM 38 CA SER A 5 -19.955 1.066 -10.374 1.00 0.00 C ATOM 39 C SER A 5 -19.403 -0.340 -10.588 1.00 0.00 C ATOM 40 O SER A 5 -18.615 -0.839 -9.785 1.00 0.00 O ATOM 41 CB SER A 5 -18.803 2.058 -10.207 1.00 0.00 C ATOM 42 OG SER A 5 -19.283 3.344 -9.854 1.00 0.00 O ATOM 0 H SER A 5 -20.424 1.559 -8.391 1.00 0.00 H new ATOM 0 HA SER A 5 -20.541 1.345 -11.250 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.118 1.699 -9.439 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.236 2.121 -11.136 1.00 0.00 H new ATOM 0 HG SER A 5 -18.527 3.959 -9.752 1.00 0.00 H new ATOM 48 N SER A 6 -19.824 -0.974 -11.678 1.00 0.00 N ATOM 49 CA SER A 6 -19.376 -2.325 -11.998 1.00 0.00 C ATOM 50 C SER A 6 -18.153 -2.290 -12.910 1.00 0.00 C ATOM 51 O SER A 6 -18.258 -1.978 -14.095 1.00 0.00 O ATOM 52 CB SER A 6 -20.503 -3.114 -12.667 1.00 0.00 C ATOM 53 OG SER A 6 -20.824 -2.569 -13.935 1.00 0.00 O ATOM 0 H SER A 6 -20.474 -0.574 -12.354 1.00 0.00 H new ATOM 0 HA SER A 6 -19.099 -2.820 -11.067 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.204 -4.156 -12.781 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.387 -3.104 -12.029 1.00 0.00 H new ATOM 0 HG SER A 6 -20.014 -2.206 -14.349 1.00 0.00 H new ATOM 59 N GLY A 7 -16.993 -2.613 -12.346 1.00 0.00 N ATOM 60 CA GLY A 7 -15.766 -2.612 -13.122 1.00 0.00 C ATOM 61 C GLY A 7 -14.784 -1.556 -12.653 1.00 0.00 C ATOM 62 O GLY A 7 -14.121 -0.912 -13.465 1.00 0.00 O ATOM 0 H GLY A 7 -16.881 -2.875 -11.367 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.298 -3.594 -13.056 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -16.004 -2.442 -14.172 1.00 0.00 H new ATOM 66 N ALA A 8 -14.693 -1.377 -11.340 1.00 0.00 N ATOM 67 CA ALA A 8 -13.785 -0.392 -10.765 1.00 0.00 C ATOM 68 C ALA A 8 -13.700 -0.543 -9.250 1.00 0.00 C ATOM 69 O ALA A 8 -14.713 -0.489 -8.553 1.00 0.00 O ATOM 70 CB ALA A 8 -14.231 1.015 -11.133 1.00 0.00 C ATOM 0 H ALA A 8 -15.237 -1.901 -10.654 1.00 0.00 H new ATOM 0 HA ALA A 8 -12.791 -0.566 -11.178 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -13.544 1.740 -10.697 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -14.233 1.124 -12.218 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -15.236 1.190 -10.749 1.00 0.00 H new ATOM 76 N ALA A 9 -12.485 -0.732 -8.746 1.00 0.00 N ATOM 77 CA ALA A 9 -12.268 -0.889 -7.313 1.00 0.00 C ATOM 78 C ALA A 9 -11.235 0.109 -6.802 1.00 0.00 C ATOM 79 O ALA A 9 -11.356 0.630 -5.693 1.00 0.00 O ATOM 80 CB ALA A 9 -11.831 -2.312 -6.998 1.00 0.00 C ATOM 0 H ALA A 9 -11.636 -0.780 -9.309 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.211 -0.689 -6.804 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.673 -2.415 -5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.604 -3.010 -7.319 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.902 -2.532 -7.524 1.00 0.00 H new ATOM 86 N PHE A 10 -10.217 0.370 -7.616 1.00 0.00 N ATOM 87 CA PHE A 10 -9.161 1.305 -7.245 1.00 0.00 C ATOM 88 C PHE A 10 -9.300 2.615 -8.014 1.00 0.00 C ATOM 89 O PHE A 10 -9.229 2.637 -9.242 1.00 0.00 O ATOM 90 CB PHE A 10 -7.787 0.687 -7.512 1.00 0.00 C ATOM 91 CG PHE A 10 -7.309 -0.211 -6.407 1.00 0.00 C ATOM 92 CD1 PHE A 10 -6.847 0.321 -5.214 1.00 0.00 C ATOM 93 CD2 PHE A 10 -7.322 -1.588 -6.561 1.00 0.00 C ATOM 94 CE1 PHE A 10 -6.406 -0.503 -4.196 1.00 0.00 C ATOM 95 CE2 PHE A 10 -6.882 -2.418 -5.546 1.00 0.00 C ATOM 96 CZ PHE A 10 -6.424 -1.874 -4.362 1.00 0.00 C ATOM 0 H PHE A 10 -10.101 -0.053 -8.537 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.256 1.518 -6.180 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -7.828 0.117 -8.440 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -7.061 1.486 -7.660 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -6.831 1.392 -5.078 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -7.680 -2.018 -7.485 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -6.048 -0.075 -3.271 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -6.897 -3.490 -5.679 1.00 0.00 H new ATOM 0 HZ PHE A 10 -6.081 -2.520 -3.567 1.00 0.00 H new ATOM 106 N ALA A 11 -9.500 3.706 -7.281 1.00 0.00 N ATOM 107 CA ALA A 11 -9.648 5.021 -7.892 1.00 0.00 C ATOM 108 C ALA A 11 -8.293 5.592 -8.298 1.00 0.00 C ATOM 109 O ALA A 11 -8.205 6.427 -9.199 1.00 0.00 O ATOM 110 CB ALA A 11 -10.359 5.969 -6.939 1.00 0.00 C ATOM 0 H ALA A 11 -9.563 3.705 -6.263 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.251 4.911 -8.793 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.462 6.947 -7.409 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.347 5.574 -6.702 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.778 6.067 -6.022 1.00 0.00 H new ATOM 116 N LYS A 12 -7.240 5.139 -7.628 1.00 0.00 N ATOM 117 CA LYS A 12 -5.889 5.604 -7.918 1.00 0.00 C ATOM 118 C LYS A 12 -4.849 4.619 -7.394 1.00 0.00 C ATOM 119 O LYS A 12 -4.615 4.532 -6.189 1.00 0.00 O ATOM 120 CB LYS A 12 -5.658 6.984 -7.297 1.00 0.00 C ATOM 121 CG LYS A 12 -4.254 7.521 -7.513 1.00 0.00 C ATOM 122 CD LYS A 12 -4.035 7.943 -8.956 1.00 0.00 C ATOM 123 CE LYS A 12 -4.649 9.307 -9.237 1.00 0.00 C ATOM 124 NZ LYS A 12 -3.774 10.416 -8.768 1.00 0.00 N ATOM 0 H LYS A 12 -7.296 4.449 -6.879 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.782 5.676 -9.000 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.376 7.688 -7.719 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -5.856 6.929 -6.227 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.084 8.372 -6.854 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.525 6.757 -7.242 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -2.967 7.973 -9.169 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.473 7.201 -9.624 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.826 9.412 -10.307 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.619 9.377 -8.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.227 11.328 -8.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.625 10.331 -7.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.857 10.365 -9.256 1.00 0.00 H new ATOM 138 N ILE A 13 -4.229 3.879 -8.308 1.00 0.00 N ATOM 139 CA ILE A 13 -3.213 2.902 -7.937 1.00 0.00 C ATOM 140 C ILE A 13 -1.906 3.587 -7.552 1.00 0.00 C ATOM 141 O ILE A 13 -1.729 4.785 -7.781 1.00 0.00 O ATOM 142 CB ILE A 13 -2.941 1.910 -9.083 1.00 0.00 C ATOM 143 CG1 ILE A 13 -2.384 2.647 -10.303 1.00 0.00 C ATOM 144 CG2 ILE A 13 -4.213 1.159 -9.446 1.00 0.00 C ATOM 145 CD1 ILE A 13 -1.490 1.790 -11.171 1.00 0.00 C ATOM 0 H ILE A 13 -4.413 3.938 -9.310 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.601 2.355 -7.078 1.00 0.00 H new ATOM 0 HB ILE A 13 -2.198 1.186 -8.749 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -3.215 3.016 -10.904 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.822 3.518 -9.966 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.005 0.462 -10.257 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.571 0.608 -8.576 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.976 1.869 -9.765 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.132 2.378 -12.016 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.640 1.442 -10.585 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.053 0.932 -11.538 1.00 0.00 H new ATOM 157 N LEU A 14 -0.992 2.820 -6.967 1.00 0.00 N ATOM 158 CA LEU A 14 0.301 3.352 -6.551 1.00 0.00 C ATOM 159 C LEU A 14 1.210 3.577 -7.755 1.00 0.00 C ATOM 160 O LEU A 14 0.896 3.158 -8.869 1.00 0.00 O ATOM 161 CB LEU A 14 0.972 2.399 -5.561 1.00 0.00 C ATOM 162 CG LEU A 14 0.174 2.069 -4.300 1.00 0.00 C ATOM 163 CD1 LEU A 14 -0.678 0.828 -4.516 1.00 0.00 C ATOM 164 CD2 LEU A 14 1.106 1.878 -3.113 1.00 0.00 C ATOM 0 H LEU A 14 -1.123 1.828 -6.770 1.00 0.00 H new ATOM 0 HA LEU A 14 0.132 4.312 -6.063 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.195 1.467 -6.080 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.926 2.833 -5.260 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.489 2.907 -4.084 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.239 0.609 -3.607 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.372 1.002 -5.338 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.034 -0.018 -4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.520 1.644 -2.224 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.795 1.059 -3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.672 2.794 -2.943 1.00 0.00 H new ATOM 176 N ASP A 15 2.338 4.239 -7.522 1.00 0.00 N ATOM 177 CA ASP A 15 3.295 4.516 -8.587 1.00 0.00 C ATOM 178 C ASP A 15 3.991 3.236 -9.040 1.00 0.00 C ATOM 179 O ASP A 15 4.020 2.232 -8.328 1.00 0.00 O ATOM 180 CB ASP A 15 4.333 5.536 -8.116 1.00 0.00 C ATOM 181 CG ASP A 15 3.891 6.966 -8.359 1.00 0.00 C ATOM 182 OD1 ASP A 15 4.065 7.457 -9.495 1.00 0.00 O ATOM 183 OD2 ASP A 15 3.369 7.594 -7.415 1.00 0.00 O ATOM 0 H ASP A 15 2.612 4.594 -6.606 1.00 0.00 H new ATOM 0 HA ASP A 15 2.748 4.930 -9.434 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.522 5.393 -7.052 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.275 5.357 -8.634 1.00 0.00 H new ATOM 188 N PRO A 16 4.564 3.270 -10.252 1.00 0.00 N ATOM 189 CA PRO A 16 5.270 2.121 -10.826 1.00 0.00 C ATOM 190 C PRO A 16 6.581 1.827 -10.106 1.00 0.00 C ATOM 191 O PRO A 16 7.179 0.767 -10.293 1.00 0.00 O ATOM 192 CB PRO A 16 5.538 2.555 -12.270 1.00 0.00 C ATOM 193 CG PRO A 16 5.554 4.044 -12.221 1.00 0.00 C ATOM 194 CD PRO A 16 4.568 4.434 -11.154 1.00 0.00 C ATOM 0 HA PRO A 16 4.689 1.203 -10.743 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.487 2.161 -12.632 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.763 2.189 -12.944 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.551 4.416 -11.986 1.00 0.00 H new ATOM 0 HG3 PRO A 16 5.274 4.469 -13.185 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.875 5.343 -10.636 1.00 0.00 H new ATOM 0 HD3 PRO A 16 3.579 4.623 -11.571 1.00 0.00 H new ATOM 202 N ALA A 17 7.024 2.771 -9.283 1.00 0.00 N ATOM 203 CA ALA A 17 8.263 2.612 -8.533 1.00 0.00 C ATOM 204 C ALA A 17 8.473 3.771 -7.565 1.00 0.00 C ATOM 205 O ALA A 17 8.173 4.922 -7.885 1.00 0.00 O ATOM 206 CB ALA A 17 9.445 2.497 -9.484 1.00 0.00 C ATOM 0 H ALA A 17 6.542 3.655 -9.119 1.00 0.00 H new ATOM 0 HA ALA A 17 8.189 1.694 -7.949 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.364 2.379 -8.910 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.308 1.631 -10.132 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.511 3.399 -10.093 1.00 0.00 H new ATOM 212 N TYR A 18 8.987 3.461 -6.380 1.00 0.00 N ATOM 213 CA TYR A 18 9.233 4.477 -5.364 1.00 0.00 C ATOM 214 C TYR A 18 10.724 4.592 -5.058 1.00 0.00 C ATOM 215 O TYR A 18 11.512 3.722 -5.427 1.00 0.00 O ATOM 216 CB TYR A 18 8.463 4.146 -4.084 1.00 0.00 C ATOM 217 CG TYR A 18 6.976 4.397 -4.191 1.00 0.00 C ATOM 218 CD1 TYR A 18 6.195 3.688 -5.095 1.00 0.00 C ATOM 219 CD2 TYR A 18 6.352 5.343 -3.387 1.00 0.00 C ATOM 220 CE1 TYR A 18 4.836 3.914 -5.196 1.00 0.00 C ATOM 221 CE2 TYR A 18 4.993 5.575 -3.480 1.00 0.00 C ATOM 222 CZ TYR A 18 4.240 4.859 -4.386 1.00 0.00 C ATOM 223 OH TYR A 18 2.886 5.086 -4.483 1.00 0.00 O ATOM 0 H TYR A 18 9.241 2.514 -6.099 1.00 0.00 H new ATOM 0 HA TYR A 18 8.885 5.434 -5.752 1.00 0.00 H new ATOM 0 HB2 TYR A 18 8.629 3.099 -3.830 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.865 4.740 -3.264 1.00 0.00 H new ATOM 0 HD1 TYR A 18 6.658 2.947 -5.730 1.00 0.00 H new ATOM 0 HD2 TYR A 18 6.939 5.907 -2.677 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.243 3.354 -5.905 1.00 0.00 H new ATOM 0 HE2 TYR A 18 4.523 6.313 -2.847 1.00 0.00 H new ATOM 0 HH TYR A 18 2.624 5.781 -3.843 1.00 0.00 H new ATOM 233 N GLN A 19 11.101 5.673 -4.382 1.00 0.00 N ATOM 234 CA GLN A 19 12.496 5.903 -4.026 1.00 0.00 C ATOM 235 C GLN A 19 12.605 6.622 -2.686 1.00 0.00 C ATOM 236 O GLN A 19 12.030 7.695 -2.497 1.00 0.00 O ATOM 237 CB GLN A 19 13.194 6.719 -5.115 1.00 0.00 C ATOM 238 CG GLN A 19 13.454 5.935 -6.391 1.00 0.00 C ATOM 239 CD GLN A 19 13.568 6.827 -7.612 1.00 0.00 C ATOM 240 OE1 GLN A 19 14.239 7.859 -7.580 1.00 0.00 O ATOM 241 NE2 GLN A 19 12.913 6.433 -8.697 1.00 0.00 N ATOM 0 H GLN A 19 10.460 6.403 -4.070 1.00 0.00 H new ATOM 0 HA GLN A 19 12.987 4.934 -3.938 1.00 0.00 H new ATOM 0 HB2 GLN A 19 12.583 7.590 -5.352 1.00 0.00 H new ATOM 0 HB3 GLN A 19 14.143 7.090 -4.727 1.00 0.00 H new ATOM 0 HG2 GLN A 19 14.373 5.360 -6.279 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.647 5.219 -6.543 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.369 5.570 -8.679 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.954 6.993 -9.549 1.00 0.00 H new ATOM 250 N VAL A 20 13.345 6.025 -1.758 1.00 0.00 N ATOM 251 CA VAL A 20 13.530 6.610 -0.435 1.00 0.00 C ATOM 252 C VAL A 20 14.962 6.422 0.054 1.00 0.00 C ATOM 253 O VAL A 20 15.736 5.669 -0.537 1.00 0.00 O ATOM 254 CB VAL A 20 12.563 5.990 0.592 1.00 0.00 C ATOM 255 CG1 VAL A 20 13.007 4.583 0.963 1.00 0.00 C ATOM 256 CG2 VAL A 20 12.466 6.870 1.829 1.00 0.00 C ATOM 0 H VAL A 20 13.826 5.137 -1.897 1.00 0.00 H new ATOM 0 HA VAL A 20 13.318 7.675 -0.527 1.00 0.00 H new ATOM 0 HB VAL A 20 11.573 5.925 0.140 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.312 4.162 1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 20 13.021 3.959 0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 20 14.007 4.619 1.396 1.00 0.00 H new ATOM 0 HG21 VAL A 20 11.779 6.418 2.544 1.00 0.00 H new ATOM 0 HG22 VAL A 20 13.452 6.968 2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 20 12.098 7.856 1.546 1.00 0.00 H new ATOM 266 N ASP A 21 15.307 7.111 1.136 1.00 0.00 N ATOM 267 CA ASP A 21 16.646 7.020 1.706 1.00 0.00 C ATOM 268 C ASP A 21 16.720 5.903 2.743 1.00 0.00 C ATOM 269 O ASP A 21 15.760 5.654 3.472 1.00 0.00 O ATOM 270 CB ASP A 21 17.045 8.352 2.343 1.00 0.00 C ATOM 271 CG ASP A 21 15.952 8.921 3.225 1.00 0.00 C ATOM 272 OD1 ASP A 21 14.866 9.240 2.696 1.00 0.00 O ATOM 273 OD2 ASP A 21 16.181 9.047 4.446 1.00 0.00 O ATOM 0 H ASP A 21 14.678 7.739 1.636 1.00 0.00 H new ATOM 0 HA ASP A 21 17.342 6.790 0.900 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.950 8.212 2.935 1.00 0.00 H new ATOM 0 HB3 ASP A 21 17.285 9.069 1.558 1.00 0.00 H new ATOM 278 N LYS A 22 17.866 5.233 2.803 1.00 0.00 N ATOM 279 CA LYS A 22 18.067 4.143 3.750 1.00 0.00 C ATOM 280 C LYS A 22 17.506 4.505 5.122 1.00 0.00 C ATOM 281 O LYS A 22 17.441 5.678 5.487 1.00 0.00 O ATOM 282 CB LYS A 22 19.556 3.810 3.867 1.00 0.00 C ATOM 283 CG LYS A 22 19.842 2.606 4.748 1.00 0.00 C ATOM 284 CD LYS A 22 20.024 3.009 6.202 1.00 0.00 C ATOM 285 CE LYS A 22 21.474 3.347 6.509 1.00 0.00 C ATOM 286 NZ LYS A 22 21.789 4.769 6.198 1.00 0.00 N ATOM 0 H LYS A 22 18.670 5.426 2.206 1.00 0.00 H new ATOM 0 HA LYS A 22 17.534 3.268 3.378 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.958 3.625 2.871 1.00 0.00 H new ATOM 0 HB3 LYS A 22 20.083 4.676 4.267 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.022 1.892 4.667 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.741 2.101 4.394 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.394 3.870 6.424 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.694 2.197 6.850 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.678 3.152 7.562 1.00 0.00 H new ATOM 0 HE3 LYS A 22 22.129 2.695 5.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.593 5.081 6.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.034 4.858 5.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 20.960 5.362 6.407 1.00 0.00 H new ATOM 300 N GLY A 23 17.104 3.488 5.879 1.00 0.00 N ATOM 301 CA GLY A 23 16.556 3.720 7.202 1.00 0.00 C ATOM 302 C GLY A 23 15.624 4.915 7.243 1.00 0.00 C ATOM 303 O GLY A 23 15.443 5.535 8.290 1.00 0.00 O ATOM 0 H GLY A 23 17.148 2.508 5.599 1.00 0.00 H new ATOM 0 HA2 GLY A 23 16.017 2.831 7.529 1.00 0.00 H new ATOM 0 HA3 GLY A 23 17.372 3.875 7.908 1.00 0.00 H new ATOM 307 N GLY A 24 15.031 5.240 6.098 1.00 0.00 N ATOM 308 CA GLY A 24 14.122 6.369 6.028 1.00 0.00 C ATOM 309 C GLY A 24 12.671 5.954 6.163 1.00 0.00 C ATOM 310 O GLY A 24 12.350 5.026 6.906 1.00 0.00 O ATOM 0 H GLY A 24 15.164 4.742 5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.368 7.079 6.817 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.262 6.886 5.079 1.00 0.00 H new ATOM 314 N ARG A 25 11.790 6.642 5.443 1.00 0.00 N ATOM 315 CA ARG A 25 10.365 6.341 5.488 1.00 0.00 C ATOM 316 C ARG A 25 9.725 6.532 4.115 1.00 0.00 C ATOM 317 O ARG A 25 9.890 7.575 3.482 1.00 0.00 O ATOM 318 CB ARG A 25 9.666 7.231 6.517 1.00 0.00 C ATOM 319 CG ARG A 25 8.229 6.823 6.799 1.00 0.00 C ATOM 320 CD ARG A 25 7.464 7.930 7.507 1.00 0.00 C ATOM 321 NE ARG A 25 7.786 9.249 6.967 1.00 0.00 N ATOM 322 CZ ARG A 25 7.382 9.674 5.776 1.00 0.00 C ATOM 323 NH1 ARG A 25 6.644 8.888 5.003 1.00 0.00 N ATOM 324 NH2 ARG A 25 7.716 10.887 5.354 1.00 0.00 N ATOM 0 H ARG A 25 12.039 7.412 4.822 1.00 0.00 H new ATOM 0 HA ARG A 25 10.249 5.298 5.782 1.00 0.00 H new ATOM 0 HB2 ARG A 25 10.231 7.207 7.449 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.679 8.262 6.162 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.729 6.576 5.862 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.219 5.922 7.413 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.393 7.750 7.410 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.696 7.908 8.572 1.00 0.00 H new ATOM 0 HE ARG A 25 8.352 9.878 7.536 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.386 7.955 5.323 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.335 9.217 4.088 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.284 11.494 5.945 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.405 11.212 4.439 1.00 0.00 H new ATOM 338 N VAL A 26 8.995 5.519 3.662 1.00 0.00 N ATOM 339 CA VAL A 26 8.330 5.575 2.365 1.00 0.00 C ATOM 340 C VAL A 26 6.850 5.907 2.520 1.00 0.00 C ATOM 341 O VAL A 26 6.303 5.850 3.622 1.00 0.00 O ATOM 342 CB VAL A 26 8.470 4.244 1.604 1.00 0.00 C ATOM 343 CG1 VAL A 26 9.925 3.983 1.246 1.00 0.00 C ATOM 344 CG2 VAL A 26 7.901 3.098 2.427 1.00 0.00 C ATOM 0 H VAL A 26 8.849 4.649 4.174 1.00 0.00 H new ATOM 0 HA VAL A 26 8.818 6.364 1.793 1.00 0.00 H new ATOM 0 HB VAL A 26 7.900 4.314 0.677 1.00 0.00 H new ATOM 0 HG11 VAL A 26 10.004 3.038 0.709 1.00 0.00 H new ATOM 0 HG12 VAL A 26 10.295 4.791 0.615 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.521 3.933 2.158 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.008 2.165 1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.441 3.025 3.371 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.845 3.282 2.626 1.00 0.00 H new ATOM 354 N ARG A 27 6.207 6.252 1.410 1.00 0.00 N ATOM 355 CA ARG A 27 4.790 6.593 1.422 1.00 0.00 C ATOM 356 C ARG A 27 4.016 5.737 0.424 1.00 0.00 C ATOM 357 O ARG A 27 4.391 5.634 -0.744 1.00 0.00 O ATOM 358 CB ARG A 27 4.597 8.075 1.096 1.00 0.00 C ATOM 359 CG ARG A 27 3.139 8.492 0.994 1.00 0.00 C ATOM 360 CD ARG A 27 3.004 9.954 0.599 1.00 0.00 C ATOM 361 NE ARG A 27 3.466 10.197 -0.765 1.00 0.00 N ATOM 362 CZ ARG A 27 4.732 10.450 -1.079 1.00 0.00 C ATOM 363 NH1 ARG A 27 5.657 10.491 -0.130 1.00 0.00 N ATOM 364 NH2 ARG A 27 5.074 10.660 -2.343 1.00 0.00 N ATOM 0 H ARG A 27 6.645 6.303 0.490 1.00 0.00 H new ATOM 0 HA ARG A 27 4.403 6.395 2.422 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.084 8.674 1.865 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.097 8.299 0.154 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.631 7.867 0.259 1.00 0.00 H new ATOM 0 HG3 ARG A 27 2.644 8.325 1.951 1.00 0.00 H new ATOM 0 HD2 ARG A 27 1.961 10.259 0.688 1.00 0.00 H new ATOM 0 HD3 ARG A 27 3.577 10.571 1.291 1.00 0.00 H new ATOM 0 HE ARG A 27 2.779 10.171 -1.518 1.00 0.00 H new ATOM 0 HH11 ARG A 27 5.397 10.328 0.843 1.00 0.00 H new ATOM 0 HH12 ARG A 27 6.628 10.685 -0.373 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.365 10.627 -3.075 1.00 0.00 H new ATOM 0 HH22 ARG A 27 6.046 10.854 -2.583 1.00 0.00 H new ATOM 378 N PHE A 28 2.933 5.124 0.893 1.00 0.00 N ATOM 379 CA PHE A 28 2.107 4.276 0.042 1.00 0.00 C ATOM 380 C PHE A 28 0.624 4.512 0.314 1.00 0.00 C ATOM 381 O PHE A 28 0.099 4.107 1.351 1.00 0.00 O ATOM 382 CB PHE A 28 2.449 2.802 0.269 1.00 0.00 C ATOM 383 CG PHE A 28 3.844 2.439 -0.154 1.00 0.00 C ATOM 384 CD1 PHE A 28 4.284 2.706 -1.440 1.00 0.00 C ATOM 385 CD2 PHE A 28 4.715 1.830 0.735 1.00 0.00 C ATOM 386 CE1 PHE A 28 5.567 2.373 -1.832 1.00 0.00 C ATOM 387 CE2 PHE A 28 5.999 1.495 0.349 1.00 0.00 C ATOM 388 CZ PHE A 28 6.425 1.766 -0.936 1.00 0.00 C ATOM 0 H PHE A 28 2.608 5.199 1.857 1.00 0.00 H new ATOM 0 HA PHE A 28 2.314 4.535 -0.996 1.00 0.00 H new ATOM 0 HB2 PHE A 28 2.326 2.567 1.326 1.00 0.00 H new ATOM 0 HB3 PHE A 28 1.739 2.184 -0.280 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.617 3.180 -2.145 1.00 0.00 H new ATOM 0 HD2 PHE A 28 4.387 1.615 1.741 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.898 2.587 -2.837 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.669 1.022 1.052 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.428 1.504 -1.240 1.00 0.00 H new ATOM 398 N VAL A 29 -0.046 5.173 -0.625 1.00 0.00 N ATOM 399 CA VAL A 29 -1.468 5.464 -0.488 1.00 0.00 C ATOM 400 C VAL A 29 -2.223 5.128 -1.769 1.00 0.00 C ATOM 401 O VAL A 29 -1.681 5.234 -2.869 1.00 0.00 O ATOM 402 CB VAL A 29 -1.706 6.945 -0.139 1.00 0.00 C ATOM 403 CG1 VAL A 29 -0.993 7.850 -1.132 1.00 0.00 C ATOM 404 CG2 VAL A 29 -3.196 7.250 -0.102 1.00 0.00 C ATOM 0 H VAL A 29 0.373 5.517 -1.489 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.842 4.842 0.325 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.294 7.137 0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -1.173 8.892 -0.869 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.078 7.648 -1.104 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.372 7.659 -2.136 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.346 8.301 0.146 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.634 7.041 -1.078 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.676 6.627 0.652 1.00 0.00 H new ATOM 414 N VAL A 30 -3.480 4.721 -1.619 1.00 0.00 N ATOM 415 CA VAL A 30 -4.312 4.370 -2.764 1.00 0.00 C ATOM 416 C VAL A 30 -5.746 4.848 -2.568 1.00 0.00 C ATOM 417 O VAL A 30 -6.222 4.966 -1.439 1.00 0.00 O ATOM 418 CB VAL A 30 -4.318 2.849 -3.008 1.00 0.00 C ATOM 419 CG1 VAL A 30 -2.958 2.383 -3.506 1.00 0.00 C ATOM 420 CG2 VAL A 30 -4.713 2.108 -1.740 1.00 0.00 C ATOM 0 H VAL A 30 -3.944 4.626 -0.716 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.882 4.868 -3.633 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.057 2.625 -3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.981 1.306 -3.673 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.720 2.890 -4.441 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.198 2.619 -2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.712 1.035 -1.930 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.000 2.337 -0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.711 2.421 -1.432 1.00 0.00 H new ATOM 430 N GLU A 31 -6.430 5.120 -3.675 1.00 0.00 N ATOM 431 CA GLU A 31 -7.811 5.585 -3.623 1.00 0.00 C ATOM 432 C GLU A 31 -8.782 4.435 -3.872 1.00 0.00 C ATOM 433 O GLU A 31 -8.423 3.424 -4.477 1.00 0.00 O ATOM 434 CB GLU A 31 -8.038 6.691 -4.656 1.00 0.00 C ATOM 435 CG GLU A 31 -9.208 7.603 -4.324 1.00 0.00 C ATOM 436 CD GLU A 31 -9.432 8.671 -5.376 1.00 0.00 C ATOM 437 OE1 GLU A 31 -8.438 9.282 -5.821 1.00 0.00 O ATOM 438 OE2 GLU A 31 -10.600 8.896 -5.755 1.00 0.00 O ATOM 0 H GLU A 31 -6.051 5.027 -4.617 1.00 0.00 H new ATOM 0 HA GLU A 31 -7.996 5.984 -2.626 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -7.132 7.291 -4.738 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.208 6.236 -5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.113 7.004 -4.221 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -9.030 8.080 -3.360 1.00 0.00 H new ATOM 445 N LEU A 32 -10.014 4.596 -3.401 1.00 0.00 N ATOM 446 CA LEU A 32 -11.038 3.572 -3.571 1.00 0.00 C ATOM 447 C LEU A 32 -12.327 4.176 -4.119 1.00 0.00 C ATOM 448 O LEU A 32 -12.898 5.090 -3.524 1.00 0.00 O ATOM 449 CB LEU A 32 -11.315 2.873 -2.239 1.00 0.00 C ATOM 450 CG LEU A 32 -10.086 2.502 -1.408 1.00 0.00 C ATOM 451 CD1 LEU A 32 -10.423 2.512 0.076 1.00 0.00 C ATOM 452 CD2 LEU A 32 -9.551 1.141 -1.826 1.00 0.00 C ATOM 0 H LEU A 32 -10.328 5.426 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.668 2.840 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.954 3.520 -1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.881 1.964 -2.440 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.310 3.246 -1.589 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.537 2.246 0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.759 3.508 0.366 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.215 1.790 0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.677 0.893 -1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.322 0.385 -1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.271 1.168 -2.879 1.00 0.00 H new ATOM 464 N ALA A 33 -12.782 3.658 -5.255 1.00 0.00 N ATOM 465 CA ALA A 33 -14.005 4.144 -5.881 1.00 0.00 C ATOM 466 C ALA A 33 -15.137 4.251 -4.864 1.00 0.00 C ATOM 467 O ALA A 33 -16.024 5.093 -4.995 1.00 0.00 O ATOM 468 CB ALA A 33 -14.410 3.230 -7.029 1.00 0.00 C ATOM 0 H ALA A 33 -12.322 2.901 -5.761 1.00 0.00 H new ATOM 0 HA ALA A 33 -13.810 5.141 -6.276 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.325 3.605 -7.487 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -13.614 3.207 -7.774 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -14.581 2.223 -6.649 1.00 0.00 H new ATOM 474 N ASP A 34 -15.099 3.392 -3.851 1.00 0.00 N ATOM 475 CA ASP A 34 -16.121 3.390 -2.811 1.00 0.00 C ATOM 476 C ASP A 34 -15.553 2.877 -1.492 1.00 0.00 C ATOM 477 O ASP A 34 -14.655 2.036 -1.459 1.00 0.00 O ATOM 478 CB ASP A 34 -17.311 2.528 -3.237 1.00 0.00 C ATOM 479 CG ASP A 34 -18.189 3.220 -4.262 1.00 0.00 C ATOM 480 OD1 ASP A 34 -17.846 3.177 -5.462 1.00 0.00 O ATOM 481 OD2 ASP A 34 -19.218 3.805 -3.864 1.00 0.00 O ATOM 0 H ASP A 34 -14.371 2.688 -3.728 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.459 4.416 -2.666 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.946 1.588 -3.651 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.908 2.279 -2.360 1.00 0.00 H new ATOM 486 N PRO A 35 -16.086 3.397 -0.376 1.00 0.00 N ATOM 487 CA PRO A 35 -15.647 3.007 0.967 1.00 0.00 C ATOM 488 C PRO A 35 -16.055 1.580 1.319 1.00 0.00 C ATOM 489 O PRO A 35 -15.457 0.950 2.192 1.00 0.00 O ATOM 490 CB PRO A 35 -16.362 4.007 1.879 1.00 0.00 C ATOM 491 CG PRO A 35 -17.565 4.429 1.108 1.00 0.00 C ATOM 492 CD PRO A 35 -17.159 4.404 -0.340 1.00 0.00 C ATOM 0 HA PRO A 35 -14.561 3.024 1.061 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -16.641 3.549 2.828 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -15.722 4.858 2.112 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -18.402 3.755 1.290 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -17.889 5.426 1.405 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -17.992 4.127 -0.986 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.806 5.379 -0.675 1.00 0.00 H new ATOM 500 N LYS A 36 -17.076 1.075 0.634 1.00 0.00 N ATOM 501 CA LYS A 36 -17.563 -0.278 0.872 1.00 0.00 C ATOM 502 C LYS A 36 -16.460 -1.304 0.632 1.00 0.00 C ATOM 503 O LYS A 36 -16.307 -2.257 1.397 1.00 0.00 O ATOM 504 CB LYS A 36 -18.759 -0.578 -0.034 1.00 0.00 C ATOM 505 CG LYS A 36 -20.096 -0.195 0.577 1.00 0.00 C ATOM 506 CD LYS A 36 -21.151 0.036 -0.492 1.00 0.00 C ATOM 507 CE LYS A 36 -21.774 -1.273 -0.953 1.00 0.00 C ATOM 508 NZ LYS A 36 -22.860 -1.722 -0.039 1.00 0.00 N ATOM 0 H LYS A 36 -17.582 1.583 -0.091 1.00 0.00 H new ATOM 0 HA LYS A 36 -17.877 -0.346 1.913 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.633 -0.044 -0.976 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -18.768 -1.642 -0.269 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -20.428 -0.983 1.253 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -19.978 0.709 1.175 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -21.929 0.692 -0.101 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -20.702 0.546 -1.344 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -22.174 -1.150 -1.960 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -21.004 -2.042 -1.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -23.259 -2.617 -0.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -22.474 -1.864 0.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -23.607 -0.999 -0.006 1.00 0.00 H new ATOM 522 N LEU A 37 -15.692 -1.101 -0.433 1.00 0.00 N ATOM 523 CA LEU A 37 -14.601 -2.008 -0.773 1.00 0.00 C ATOM 524 C LEU A 37 -13.605 -2.117 0.378 1.00 0.00 C ATOM 525 O LEU A 37 -13.479 -1.202 1.190 1.00 0.00 O ATOM 526 CB LEU A 37 -13.887 -1.527 -2.037 1.00 0.00 C ATOM 527 CG LEU A 37 -14.680 -1.639 -3.339 1.00 0.00 C ATOM 528 CD1 LEU A 37 -14.255 -0.555 -4.318 1.00 0.00 C ATOM 529 CD2 LEU A 37 -14.501 -3.018 -3.957 1.00 0.00 C ATOM 0 H LEU A 37 -15.804 -0.317 -1.076 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.025 -2.995 -0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.604 -0.484 -1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.964 -2.096 -2.147 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.737 -1.500 -3.111 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -14.830 -0.651 -5.239 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.436 0.425 -3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -13.193 -0.662 -4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -15.073 -3.079 -4.883 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -13.446 -3.187 -4.171 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -14.856 -3.778 -3.261 1.00 0.00 H new ATOM 541 N GLU A 38 -12.898 -3.241 0.437 1.00 0.00 N ATOM 542 CA GLU A 38 -11.912 -3.468 1.488 1.00 0.00 C ATOM 543 C GLU A 38 -10.497 -3.460 0.916 1.00 0.00 C ATOM 544 O GLU A 38 -10.273 -3.870 -0.223 1.00 0.00 O ATOM 545 CB GLU A 38 -12.182 -4.799 2.192 1.00 0.00 C ATOM 546 CG GLU A 38 -11.501 -4.920 3.545 1.00 0.00 C ATOM 547 CD GLU A 38 -12.350 -4.374 4.676 1.00 0.00 C ATOM 548 OE1 GLU A 38 -13.242 -5.106 5.156 1.00 0.00 O ATOM 549 OE2 GLU A 38 -12.124 -3.215 5.082 1.00 0.00 O ATOM 0 H GLU A 38 -12.989 -4.008 -0.229 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.997 -2.658 2.213 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.257 -4.919 2.324 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.846 -5.614 1.551 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.273 -5.968 3.740 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.551 -4.386 3.518 1.00 0.00 H new ATOM 556 N VAL A 39 -9.545 -2.990 1.716 1.00 0.00 N ATOM 557 CA VAL A 39 -8.152 -2.928 1.291 1.00 0.00 C ATOM 558 C VAL A 39 -7.291 -3.900 2.089 1.00 0.00 C ATOM 559 O VAL A 39 -7.568 -4.180 3.256 1.00 0.00 O ATOM 560 CB VAL A 39 -7.580 -1.506 1.447 1.00 0.00 C ATOM 561 CG1 VAL A 39 -8.377 -0.516 0.612 1.00 0.00 C ATOM 562 CG2 VAL A 39 -7.569 -1.094 2.911 1.00 0.00 C ATOM 0 H VAL A 39 -9.713 -2.647 2.662 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.130 -3.207 0.238 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.552 -1.505 1.085 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.959 0.483 0.735 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.328 -0.804 -0.438 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.416 -0.517 0.940 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.162 -0.087 3.003 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.587 -1.111 3.301 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.951 -1.788 3.480 1.00 0.00 H new ATOM 572 N LYS A 40 -6.243 -4.413 1.453 1.00 0.00 N ATOM 573 CA LYS A 40 -5.338 -5.354 2.103 1.00 0.00 C ATOM 574 C LYS A 40 -3.919 -5.205 1.564 1.00 0.00 C ATOM 575 O LYS A 40 -3.688 -5.315 0.360 1.00 0.00 O ATOM 576 CB LYS A 40 -5.826 -6.789 1.895 1.00 0.00 C ATOM 577 CG LYS A 40 -7.165 -7.078 2.550 1.00 0.00 C ATOM 578 CD LYS A 40 -7.668 -8.469 2.203 1.00 0.00 C ATOM 579 CE LYS A 40 -9.179 -8.568 2.350 1.00 0.00 C ATOM 580 NZ LYS A 40 -9.755 -9.619 1.465 1.00 0.00 N ATOM 0 H LYS A 40 -5.999 -4.193 0.487 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.328 -5.131 3.170 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.904 -6.986 0.826 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -5.081 -7.478 2.292 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.069 -6.984 3.632 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.896 -6.336 2.229 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.384 -8.715 1.180 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -7.189 -9.203 2.852 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.429 -8.790 3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.631 -7.605 2.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.786 -9.655 1.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.538 -9.394 0.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -9.343 -10.542 1.709 1.00 0.00 H new ATOM 594 N TRP A 41 -2.973 -4.956 2.462 1.00 0.00 N ATOM 595 CA TRP A 41 -1.576 -4.794 2.075 1.00 0.00 C ATOM 596 C TRP A 41 -0.809 -6.100 2.245 1.00 0.00 C ATOM 597 O TRP A 41 -0.992 -6.815 3.230 1.00 0.00 O ATOM 598 CB TRP A 41 -0.920 -3.691 2.908 1.00 0.00 C ATOM 599 CG TRP A 41 -1.525 -2.338 2.685 1.00 0.00 C ATOM 600 CD1 TRP A 41 -2.723 -1.888 3.161 1.00 0.00 C ATOM 601 CD2 TRP A 41 -0.961 -1.261 1.929 1.00 0.00 C ATOM 602 NE1 TRP A 41 -2.938 -0.596 2.746 1.00 0.00 N ATOM 603 CE2 TRP A 41 -1.872 -0.188 1.989 1.00 0.00 C ATOM 604 CE3 TRP A 41 0.225 -1.098 1.208 1.00 0.00 C ATOM 605 CZ2 TRP A 41 -1.632 1.028 1.355 1.00 0.00 C ATOM 606 CZ3 TRP A 41 0.462 0.109 0.579 1.00 0.00 C ATOM 607 CH2 TRP A 41 -0.463 1.160 0.656 1.00 0.00 C ATOM 0 H TRP A 41 -3.147 -4.862 3.463 1.00 0.00 H new ATOM 0 HA TRP A 41 -1.547 -4.512 1.023 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -1.000 -3.947 3.964 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.143 -3.649 2.670 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.402 -2.463 3.774 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -3.759 -0.032 2.966 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.944 -1.902 1.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.343 1.839 1.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.375 0.245 0.019 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -0.249 2.092 0.154 1.00 0.00 H new ATOM 618 N TYR A 42 0.050 -6.406 1.279 1.00 0.00 N ATOM 619 CA TYR A 42 0.843 -7.629 1.320 1.00 0.00 C ATOM 620 C TYR A 42 2.293 -7.351 0.935 1.00 0.00 C ATOM 621 O TYR A 42 2.577 -6.451 0.145 1.00 0.00 O ATOM 622 CB TYR A 42 0.248 -8.680 0.383 1.00 0.00 C ATOM 623 CG TYR A 42 -1.141 -9.128 0.779 1.00 0.00 C ATOM 624 CD1 TYR A 42 -1.325 -10.172 1.678 1.00 0.00 C ATOM 625 CD2 TYR A 42 -2.268 -8.509 0.255 1.00 0.00 C ATOM 626 CE1 TYR A 42 -2.592 -10.585 2.043 1.00 0.00 C ATOM 627 CE2 TYR A 42 -3.539 -8.914 0.615 1.00 0.00 C ATOM 628 CZ TYR A 42 -3.695 -9.953 1.509 1.00 0.00 C ATOM 629 OH TYR A 42 -4.959 -10.361 1.870 1.00 0.00 O ATOM 0 H TYR A 42 0.215 -5.824 0.458 1.00 0.00 H new ATOM 0 HA TYR A 42 0.823 -8.010 2.341 1.00 0.00 H new ATOM 0 HB2 TYR A 42 0.216 -8.276 -0.629 1.00 0.00 H new ATOM 0 HB3 TYR A 42 0.907 -9.548 0.359 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.463 -10.669 2.098 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -2.149 -7.696 -0.446 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -2.718 -11.398 2.743 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -4.405 -8.420 0.199 1.00 0.00 H new ATOM 0 HH TYR A 42 -4.940 -10.716 2.783 1.00 0.00 H new ATOM 639 N LYS A 43 3.208 -8.131 1.500 1.00 0.00 N ATOM 640 CA LYS A 43 4.630 -7.973 1.216 1.00 0.00 C ATOM 641 C LYS A 43 5.277 -9.320 0.911 1.00 0.00 C ATOM 642 O LYS A 43 5.581 -10.093 1.819 1.00 0.00 O ATOM 643 CB LYS A 43 5.337 -7.313 2.402 1.00 0.00 C ATOM 644 CG LYS A 43 6.824 -7.096 2.180 1.00 0.00 C ATOM 645 CD LYS A 43 7.526 -6.686 3.463 1.00 0.00 C ATOM 646 CE LYS A 43 9.038 -6.733 3.311 1.00 0.00 C ATOM 647 NZ LYS A 43 9.538 -8.129 3.167 1.00 0.00 N ATOM 0 H LYS A 43 2.990 -8.880 2.158 1.00 0.00 H new ATOM 0 HA LYS A 43 4.731 -7.334 0.339 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.865 -6.352 2.607 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.197 -7.932 3.288 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.273 -8.012 1.796 1.00 0.00 H new ATOM 0 HG3 LYS A 43 6.971 -6.327 1.422 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.218 -5.678 3.741 1.00 0.00 H new ATOM 0 HD3 LYS A 43 7.220 -7.347 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.334 -6.150 2.439 1.00 0.00 H new ATOM 0 HE3 LYS A 43 9.505 -6.268 4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.308 -8.152 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 9.893 -8.467 4.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 8.763 -8.744 2.848 1.00 0.00 H new ATOM 661 N ASN A 44 5.486 -9.594 -0.372 1.00 0.00 N ATOM 662 CA ASN A 44 6.098 -10.848 -0.797 1.00 0.00 C ATOM 663 C ASN A 44 5.136 -12.016 -0.604 1.00 0.00 C ATOM 664 O ASN A 44 5.545 -13.117 -0.239 1.00 0.00 O ATOM 665 CB ASN A 44 7.388 -11.100 -0.014 1.00 0.00 C ATOM 666 CG ASN A 44 8.222 -9.844 0.147 1.00 0.00 C ATOM 667 OD1 ASN A 44 7.813 -8.757 -0.261 1.00 0.00 O ATOM 668 ND2 ASN A 44 9.399 -9.988 0.745 1.00 0.00 N ATOM 0 H ASN A 44 5.241 -8.965 -1.136 1.00 0.00 H new ATOM 0 HA ASN A 44 6.334 -10.767 -1.858 1.00 0.00 H new ATOM 0 HB2 ASN A 44 7.140 -11.497 0.970 1.00 0.00 H new ATOM 0 HB3 ASN A 44 7.977 -11.861 -0.526 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.004 -9.178 0.882 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.698 -10.908 1.068 1.00 0.00 H new ATOM 675 N GLY A 45 3.854 -11.767 -0.852 1.00 0.00 N ATOM 676 CA GLY A 45 2.853 -12.807 -0.700 1.00 0.00 C ATOM 677 C GLY A 45 2.517 -13.081 0.752 1.00 0.00 C ATOM 678 O GLY A 45 2.249 -14.221 1.129 1.00 0.00 O ATOM 0 H GLY A 45 3.491 -10.864 -1.156 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.947 -12.515 -1.230 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.213 -13.724 -1.166 1.00 0.00 H new ATOM 682 N GLN A 46 2.532 -12.032 1.570 1.00 0.00 N ATOM 683 CA GLN A 46 2.229 -12.167 2.989 1.00 0.00 C ATOM 684 C GLN A 46 1.478 -10.943 3.504 1.00 0.00 C ATOM 685 O GLN A 46 1.841 -9.808 3.199 1.00 0.00 O ATOM 686 CB GLN A 46 3.516 -12.364 3.791 1.00 0.00 C ATOM 687 CG GLN A 46 3.307 -12.329 5.297 1.00 0.00 C ATOM 688 CD GLN A 46 4.306 -13.189 6.045 1.00 0.00 C ATOM 689 OE1 GLN A 46 5.411 -12.746 6.360 1.00 0.00 O ATOM 690 NE2 GLN A 46 3.922 -14.427 6.334 1.00 0.00 N ATOM 0 H GLN A 46 2.751 -11.081 1.274 1.00 0.00 H new ATOM 0 HA GLN A 46 1.592 -13.042 3.117 1.00 0.00 H new ATOM 0 HB2 GLN A 46 3.962 -13.320 3.517 1.00 0.00 H new ATOM 0 HB3 GLN A 46 4.229 -11.588 3.514 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.386 -11.300 5.647 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.297 -12.668 5.528 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.997 -14.753 6.054 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.552 -15.052 6.836 1.00 0.00 H new ATOM 699 N GLU A 47 0.429 -11.183 4.285 1.00 0.00 N ATOM 700 CA GLU A 47 -0.373 -10.099 4.840 1.00 0.00 C ATOM 701 C GLU A 47 0.468 -9.214 5.756 1.00 0.00 C ATOM 702 O GLU A 47 1.260 -9.709 6.558 1.00 0.00 O ATOM 703 CB GLU A 47 -1.567 -10.663 5.613 1.00 0.00 C ATOM 704 CG GLU A 47 -2.598 -9.613 5.991 1.00 0.00 C ATOM 705 CD GLU A 47 -3.880 -10.221 6.528 1.00 0.00 C ATOM 706 OE1 GLU A 47 -4.585 -10.900 5.753 1.00 0.00 O ATOM 707 OE2 GLU A 47 -4.177 -10.016 7.723 1.00 0.00 O ATOM 0 H GLU A 47 0.115 -12.117 4.547 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.739 -9.491 4.012 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -2.049 -11.433 5.010 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -1.206 -11.148 6.520 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.174 -8.947 6.742 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.828 -9.003 5.117 1.00 0.00 H new ATOM 714 N ILE A 48 0.289 -7.904 5.630 1.00 0.00 N ATOM 715 CA ILE A 48 1.029 -6.950 6.447 1.00 0.00 C ATOM 716 C ILE A 48 0.210 -6.507 7.654 1.00 0.00 C ATOM 717 O ILE A 48 -0.946 -6.106 7.519 1.00 0.00 O ATOM 718 CB ILE A 48 1.435 -5.708 5.632 1.00 0.00 C ATOM 719 CG1 ILE A 48 2.238 -6.121 4.397 1.00 0.00 C ATOM 720 CG2 ILE A 48 2.239 -4.747 6.496 1.00 0.00 C ATOM 721 CD1 ILE A 48 2.500 -4.981 3.437 1.00 0.00 C ATOM 0 H ILE A 48 -0.362 -7.479 4.970 1.00 0.00 H new ATOM 0 HA ILE A 48 1.929 -7.460 6.790 1.00 0.00 H new ATOM 0 HB ILE A 48 0.531 -5.198 5.300 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.191 -6.542 4.717 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.701 -6.911 3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.519 -3.874 5.906 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.636 -4.431 7.347 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.139 -5.246 6.854 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.074 -5.347 2.586 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.551 -4.574 3.087 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.064 -4.199 3.946 1.00 0.00 H new ATOM 733 N ARG A 49 0.818 -6.581 8.834 1.00 0.00 N ATOM 734 CA ARG A 49 0.145 -6.187 10.066 1.00 0.00 C ATOM 735 C ARG A 49 0.564 -4.783 10.489 1.00 0.00 C ATOM 736 O ARG A 49 1.717 -4.378 10.331 1.00 0.00 O ATOM 737 CB ARG A 49 0.459 -7.183 11.184 1.00 0.00 C ATOM 738 CG ARG A 49 1.883 -7.085 11.705 1.00 0.00 C ATOM 739 CD ARG A 49 2.108 -8.012 12.890 1.00 0.00 C ATOM 740 NE ARG A 49 1.739 -7.383 14.155 1.00 0.00 N ATOM 741 CZ ARG A 49 2.503 -6.499 14.787 1.00 0.00 C ATOM 742 NH1 ARG A 49 3.672 -6.141 14.274 1.00 0.00 N ATOM 743 NH2 ARG A 49 2.098 -5.971 15.935 1.00 0.00 N ATOM 0 H ARG A 49 1.775 -6.910 8.963 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.929 -6.186 9.880 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -0.233 -7.019 12.010 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.284 -8.195 10.818 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.582 -7.337 10.907 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.094 -6.057 12.001 1.00 0.00 H new ATOM 0 HD2 ARG A 49 1.524 -8.922 12.754 1.00 0.00 H new ATOM 0 HD3 ARG A 49 3.156 -8.308 12.925 1.00 0.00 H new ATOM 0 HE ARG A 49 0.845 -7.636 14.577 1.00 0.00 H new ATOM 0 HH11 ARG A 49 3.987 -6.545 13.392 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.256 -5.462 14.762 1.00 0.00 H new ATOM 0 HH21 ARG A 49 1.199 -6.244 16.333 1.00 0.00 H new ATOM 0 HH22 ARG A 49 2.685 -5.292 16.420 1.00 0.00 H new ATOM 757 N PRO A 50 -0.392 -4.019 11.038 1.00 0.00 N ATOM 758 CA PRO A 50 -0.147 -2.648 11.494 1.00 0.00 C ATOM 759 C PRO A 50 0.740 -2.600 12.734 1.00 0.00 C ATOM 760 O PRO A 50 0.447 -3.241 13.743 1.00 0.00 O ATOM 761 CB PRO A 50 -1.548 -2.126 11.819 1.00 0.00 C ATOM 762 CG PRO A 50 -2.345 -3.346 12.128 1.00 0.00 C ATOM 763 CD PRO A 50 -1.788 -4.437 11.255 1.00 0.00 C ATOM 0 HA PRO A 50 0.379 -2.057 10.744 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.528 -1.441 12.667 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.972 -1.579 10.977 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -2.262 -3.609 13.182 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.403 -3.183 11.922 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.845 -5.410 11.742 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.334 -4.518 10.315 1.00 0.00 H new ATOM 771 N SER A 51 1.825 -1.837 12.651 1.00 0.00 N ATOM 772 CA SER A 51 2.756 -1.708 13.766 1.00 0.00 C ATOM 773 C SER A 51 3.619 -0.460 13.611 1.00 0.00 C ATOM 774 O SER A 51 3.594 0.203 12.573 1.00 0.00 O ATOM 775 CB SER A 51 3.646 -2.949 13.860 1.00 0.00 C ATOM 776 OG SER A 51 4.227 -3.063 15.147 1.00 0.00 O ATOM 0 H SER A 51 2.081 -1.299 11.823 1.00 0.00 H new ATOM 0 HA SER A 51 2.175 -1.615 14.684 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.057 -3.840 13.643 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.432 -2.895 13.106 1.00 0.00 H new ATOM 0 HG SER A 51 5.012 -3.648 15.101 1.00 0.00 H new ATOM 782 N THR A 52 4.384 -0.144 14.652 1.00 0.00 N ATOM 783 CA THR A 52 5.255 1.025 14.634 1.00 0.00 C ATOM 784 C THR A 52 5.923 1.191 13.274 1.00 0.00 C ATOM 785 O THR A 52 6.228 2.307 12.852 1.00 0.00 O ATOM 786 CB THR A 52 6.342 0.932 15.720 1.00 0.00 C ATOM 787 OG1 THR A 52 6.978 -0.350 15.668 1.00 0.00 O ATOM 788 CG2 THR A 52 5.747 1.153 17.102 1.00 0.00 C ATOM 0 H THR A 52 4.418 -0.682 15.518 1.00 0.00 H new ATOM 0 HA THR A 52 4.626 1.892 14.835 1.00 0.00 H new ATOM 0 HB THR A 52 7.080 1.711 15.531 1.00 0.00 H new ATOM 0 HG1 THR A 52 7.669 -0.401 16.361 1.00 0.00 H new ATOM 0 HG21 THR A 52 6.534 1.083 17.853 1.00 0.00 H new ATOM 0 HG22 THR A 52 5.290 2.141 17.147 1.00 0.00 H new ATOM 0 HG23 THR A 52 4.990 0.394 17.298 1.00 0.00 H new ATOM 796 N LYS A 53 6.149 0.075 12.590 1.00 0.00 N ATOM 797 CA LYS A 53 6.781 0.096 11.276 1.00 0.00 C ATOM 798 C LYS A 53 5.773 0.473 10.195 1.00 0.00 C ATOM 799 O LYS A 53 6.047 1.324 9.347 1.00 0.00 O ATOM 800 CB LYS A 53 7.396 -1.270 10.961 1.00 0.00 C ATOM 801 CG LYS A 53 8.380 -1.241 9.804 1.00 0.00 C ATOM 802 CD LYS A 53 8.404 -2.566 9.060 1.00 0.00 C ATOM 803 CE LYS A 53 9.680 -2.725 8.247 1.00 0.00 C ATOM 804 NZ LYS A 53 10.897 -2.600 9.096 1.00 0.00 N ATOM 0 H LYS A 53 5.904 -0.857 12.924 1.00 0.00 H new ATOM 0 HA LYS A 53 7.570 0.848 11.291 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.904 -1.644 11.850 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.597 -1.974 10.730 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.110 -0.441 9.115 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.378 -1.015 10.179 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.321 -3.386 9.773 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.540 -2.629 8.399 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.679 -3.698 7.755 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.706 -1.970 7.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.716 -2.990 8.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.069 -1.597 9.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.757 -3.125 9.983 1.00 0.00 H new ATOM 818 N TYR A 54 4.608 -0.163 10.231 1.00 0.00 N ATOM 819 CA TYR A 54 3.560 0.106 9.253 1.00 0.00 C ATOM 820 C TYR A 54 2.483 1.011 9.843 1.00 0.00 C ATOM 821 O TYR A 54 1.819 0.651 10.816 1.00 0.00 O ATOM 822 CB TYR A 54 2.934 -1.204 8.772 1.00 0.00 C ATOM 823 CG TYR A 54 3.901 -2.104 8.037 1.00 0.00 C ATOM 824 CD1 TYR A 54 4.247 -1.852 6.715 1.00 0.00 C ATOM 825 CD2 TYR A 54 4.468 -3.207 8.664 1.00 0.00 C ATOM 826 CE1 TYR A 54 5.130 -2.671 6.039 1.00 0.00 C ATOM 827 CE2 TYR A 54 5.353 -4.031 7.996 1.00 0.00 C ATOM 828 CZ TYR A 54 5.681 -3.759 6.684 1.00 0.00 C ATOM 829 OH TYR A 54 6.561 -4.579 6.015 1.00 0.00 O ATOM 0 H TYR A 54 4.365 -0.868 10.927 1.00 0.00 H new ATOM 0 HA TYR A 54 4.013 0.618 8.404 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.532 -1.741 9.631 1.00 0.00 H new ATOM 0 HB3 TYR A 54 2.093 -0.976 8.117 1.00 0.00 H new ATOM 0 HD1 TYR A 54 3.818 -1.001 6.207 1.00 0.00 H new ATOM 0 HD2 TYR A 54 4.212 -3.424 9.691 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.388 -2.461 5.011 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.786 -4.884 8.498 1.00 0.00 H new ATOM 0 HH TYR A 54 6.857 -5.297 6.612 1.00 0.00 H new ATOM 839 N ILE A 55 2.316 2.187 9.248 1.00 0.00 N ATOM 840 CA ILE A 55 1.319 3.144 9.712 1.00 0.00 C ATOM 841 C ILE A 55 0.117 3.184 8.775 1.00 0.00 C ATOM 842 O ILE A 55 0.237 3.565 7.610 1.00 0.00 O ATOM 843 CB ILE A 55 1.911 4.561 9.831 1.00 0.00 C ATOM 844 CG1 ILE A 55 3.307 4.503 10.455 1.00 0.00 C ATOM 845 CG2 ILE A 55 0.993 5.451 10.654 1.00 0.00 C ATOM 846 CD1 ILE A 55 3.304 4.061 11.902 1.00 0.00 C ATOM 0 H ILE A 55 2.859 2.500 8.443 1.00 0.00 H new ATOM 0 HA ILE A 55 0.996 2.810 10.698 1.00 0.00 H new ATOM 0 HB ILE A 55 1.998 4.988 8.832 1.00 0.00 H new ATOM 0 HG12 ILE A 55 3.927 3.819 9.876 1.00 0.00 H new ATOM 0 HG13 ILE A 55 3.769 5.488 10.385 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.425 6.449 10.729 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.018 5.513 10.171 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.877 5.030 11.653 1.00 0.00 H new ATOM 0 HD11 ILE A 55 4.327 4.043 12.279 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.711 4.758 12.494 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.872 3.063 11.977 1.00 0.00 H new ATOM 858 N PHE A 56 -1.042 2.790 9.291 1.00 0.00 N ATOM 859 CA PHE A 56 -2.268 2.781 8.501 1.00 0.00 C ATOM 860 C PHE A 56 -3.126 4.003 8.815 1.00 0.00 C ATOM 861 O PHE A 56 -3.477 4.248 9.969 1.00 0.00 O ATOM 862 CB PHE A 56 -3.064 1.503 8.770 1.00 0.00 C ATOM 863 CG PHE A 56 -2.428 0.269 8.195 1.00 0.00 C ATOM 864 CD1 PHE A 56 -1.262 -0.244 8.741 1.00 0.00 C ATOM 865 CD2 PHE A 56 -2.996 -0.378 7.110 1.00 0.00 C ATOM 866 CE1 PHE A 56 -0.674 -1.379 8.215 1.00 0.00 C ATOM 867 CE2 PHE A 56 -2.413 -1.514 6.580 1.00 0.00 C ATOM 868 CZ PHE A 56 -1.250 -2.014 7.133 1.00 0.00 C ATOM 0 H PHE A 56 -1.158 2.472 10.253 1.00 0.00 H new ATOM 0 HA PHE A 56 -1.992 2.814 7.447 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.178 1.375 9.846 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.065 1.614 8.354 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.807 0.249 9.588 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.905 0.009 6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.235 -1.768 8.650 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -2.866 -2.010 5.735 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.792 -2.900 6.719 1.00 0.00 H new ATOM 878 N GLU A 57 -3.458 4.767 7.779 1.00 0.00 N ATOM 879 CA GLU A 57 -4.274 5.965 7.945 1.00 0.00 C ATOM 880 C GLU A 57 -5.391 6.010 6.907 1.00 0.00 C ATOM 881 O GLU A 57 -5.172 5.724 5.729 1.00 0.00 O ATOM 882 CB GLU A 57 -3.406 7.220 7.831 1.00 0.00 C ATOM 883 CG GLU A 57 -2.452 7.408 8.998 1.00 0.00 C ATOM 884 CD GLU A 57 -1.722 8.736 8.946 1.00 0.00 C ATOM 885 OE1 GLU A 57 -1.600 9.303 7.840 1.00 0.00 O ATOM 886 OE2 GLU A 57 -1.273 9.209 10.011 1.00 0.00 O ATOM 0 H GLU A 57 -3.175 4.578 6.817 1.00 0.00 H new ATOM 0 HA GLU A 57 -4.724 5.932 8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.831 7.171 6.907 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.053 8.094 7.757 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -3.009 7.340 9.932 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.724 6.597 9.001 1.00 0.00 H new ATOM 893 N HIS A 58 -6.591 6.370 7.352 1.00 0.00 N ATOM 894 CA HIS A 58 -7.744 6.453 6.463 1.00 0.00 C ATOM 895 C HIS A 58 -8.202 7.899 6.300 1.00 0.00 C ATOM 896 O HIS A 58 -8.549 8.565 7.276 1.00 0.00 O ATOM 897 CB HIS A 58 -8.892 5.599 7.001 1.00 0.00 C ATOM 898 CG HIS A 58 -9.896 5.218 5.957 1.00 0.00 C ATOM 899 ND1 HIS A 58 -11.242 5.078 6.223 1.00 0.00 N ATOM 900 CD2 HIS A 58 -9.744 4.949 4.639 1.00 0.00 C ATOM 901 CE1 HIS A 58 -11.874 4.738 5.114 1.00 0.00 C ATOM 902 NE2 HIS A 58 -10.988 4.653 4.138 1.00 0.00 N ATOM 0 H HIS A 58 -6.790 6.609 8.323 1.00 0.00 H new ATOM 0 HA HIS A 58 -7.446 6.073 5.486 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -8.482 4.693 7.447 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -9.398 6.145 7.797 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -8.817 4.964 4.085 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -12.935 4.560 5.021 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.194 4.407 3.170 1.00 0.00 H new ATOM 911 N LYS A 59 -8.199 8.380 5.061 1.00 0.00 N ATOM 912 CA LYS A 59 -8.615 9.746 4.770 1.00 0.00 C ATOM 913 C LYS A 59 -9.657 9.772 3.656 1.00 0.00 C ATOM 914 O LYS A 59 -9.316 9.807 2.474 1.00 0.00 O ATOM 915 CB LYS A 59 -7.405 10.595 4.371 1.00 0.00 C ATOM 916 CG LYS A 59 -6.302 10.610 5.415 1.00 0.00 C ATOM 917 CD LYS A 59 -6.500 11.733 6.419 1.00 0.00 C ATOM 918 CE LYS A 59 -6.042 13.070 5.858 1.00 0.00 C ATOM 919 NZ LYS A 59 -4.559 13.149 5.753 1.00 0.00 N ATOM 0 H LYS A 59 -7.913 7.843 4.242 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.063 10.163 5.672 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -7.000 10.217 3.432 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.734 11.618 4.187 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -6.281 9.653 5.937 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.336 10.726 4.923 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -7.553 11.794 6.695 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.944 11.510 7.330 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -6.484 13.221 4.873 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.404 13.875 6.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.272 14.141 5.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.129 12.768 6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.239 12.593 4.935 1.00 0.00 H new ATOM 933 N GLY A 60 -10.929 9.757 4.041 1.00 0.00 N ATOM 934 CA GLY A 60 -12.001 9.780 3.063 1.00 0.00 C ATOM 935 C GLY A 60 -11.673 8.971 1.824 1.00 0.00 C ATOM 936 O GLY A 60 -11.100 9.493 0.867 1.00 0.00 O ATOM 0 H GLY A 60 -11.237 9.729 5.013 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.912 9.390 3.517 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.205 10.812 2.776 1.00 0.00 H new ATOM 940 N CYS A 61 -12.034 7.693 1.841 1.00 0.00 N ATOM 941 CA CYS A 61 -11.773 6.809 0.711 1.00 0.00 C ATOM 942 C CYS A 61 -10.306 6.873 0.299 1.00 0.00 C ATOM 943 O CYS A 61 -9.988 6.980 -0.885 1.00 0.00 O ATOM 944 CB CYS A 61 -12.664 7.184 -0.474 1.00 0.00 C ATOM 945 SG CYS A 61 -14.436 7.059 -0.133 1.00 0.00 S ATOM 0 H CYS A 61 -12.509 7.246 2.625 1.00 0.00 H new ATOM 0 HA CYS A 61 -12.002 5.789 1.019 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -12.435 8.205 -0.779 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -12.420 6.537 -1.317 1.00 0.00 H new ATOM 0 HG CYS A 61 -15.107 7.398 -1.194 1.00 0.00 H new ATOM 951 N GLN A 62 -9.416 6.809 1.284 1.00 0.00 N ATOM 952 CA GLN A 62 -7.983 6.862 1.024 1.00 0.00 C ATOM 953 C GLN A 62 -7.207 6.085 2.083 1.00 0.00 C ATOM 954 O GLN A 62 -7.171 6.475 3.250 1.00 0.00 O ATOM 955 CB GLN A 62 -7.503 8.314 0.987 1.00 0.00 C ATOM 956 CG GLN A 62 -6.215 8.510 0.203 1.00 0.00 C ATOM 957 CD GLN A 62 -5.700 9.934 0.275 1.00 0.00 C ATOM 958 OE1 GLN A 62 -5.570 10.611 -0.745 1.00 0.00 O ATOM 959 NE2 GLN A 62 -5.402 10.396 1.484 1.00 0.00 N ATOM 0 H GLN A 62 -9.663 6.720 2.270 1.00 0.00 H new ATOM 0 HA GLN A 62 -7.799 6.401 0.054 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -8.284 8.935 0.548 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -7.354 8.665 2.008 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -5.453 7.832 0.588 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -6.384 8.241 -0.840 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.525 9.800 2.302 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.050 11.347 1.594 1.00 0.00 H new ATOM 968 N ARG A 63 -6.589 4.984 1.667 1.00 0.00 N ATOM 969 CA ARG A 63 -5.816 4.152 2.581 1.00 0.00 C ATOM 970 C ARG A 63 -4.321 4.413 2.421 1.00 0.00 C ATOM 971 O ARG A 63 -3.713 4.010 1.429 1.00 0.00 O ATOM 972 CB ARG A 63 -6.115 2.672 2.333 1.00 0.00 C ATOM 973 CG ARG A 63 -7.451 2.218 2.899 1.00 0.00 C ATOM 974 CD ARG A 63 -7.357 1.935 4.390 1.00 0.00 C ATOM 975 NE ARG A 63 -8.653 2.056 5.052 1.00 0.00 N ATOM 976 CZ ARG A 63 -8.943 1.475 6.211 1.00 0.00 C ATOM 977 NH1 ARG A 63 -8.033 0.738 6.833 1.00 0.00 N ATOM 978 NH2 ARG A 63 -10.145 1.632 6.751 1.00 0.00 N ATOM 0 H ARG A 63 -6.609 4.648 0.704 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.106 4.409 3.600 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.101 2.482 1.260 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.320 2.070 2.774 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.203 2.986 2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.782 1.320 2.377 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.963 0.930 4.544 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.650 2.628 4.847 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.375 2.617 4.600 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -7.108 0.616 6.422 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.258 0.293 7.723 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.847 2.199 6.276 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.367 1.185 7.641 1.00 0.00 H new ATOM 992 N ILE A 64 -3.736 5.090 3.404 1.00 0.00 N ATOM 993 CA ILE A 64 -2.313 5.404 3.372 1.00 0.00 C ATOM 994 C ILE A 64 -1.504 4.366 4.142 1.00 0.00 C ATOM 995 O ILE A 64 -2.017 3.711 5.051 1.00 0.00 O ATOM 996 CB ILE A 64 -2.031 6.799 3.962 1.00 0.00 C ATOM 997 CG1 ILE A 64 -2.719 7.879 3.125 1.00 0.00 C ATOM 998 CG2 ILE A 64 -0.533 7.051 4.033 1.00 0.00 C ATOM 999 CD1 ILE A 64 -3.136 9.091 3.927 1.00 0.00 C ATOM 0 H ILE A 64 -4.225 5.431 4.231 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.011 5.393 2.325 1.00 0.00 H new ATOM 0 HB ILE A 64 -2.435 6.838 4.974 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.045 8.195 2.329 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.599 7.450 2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.350 8.041 4.452 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.067 6.297 4.667 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.107 6.997 3.031 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.617 9.815 3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.835 8.789 4.706 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -2.257 9.545 4.385 1.00 0.00 H new ATOM 1011 N LEU A 65 -0.235 4.222 3.775 1.00 0.00 N ATOM 1012 CA LEU A 65 0.648 3.264 4.433 1.00 0.00 C ATOM 1013 C LEU A 65 2.087 3.769 4.443 1.00 0.00 C ATOM 1014 O LEU A 65 2.643 4.112 3.399 1.00 0.00 O ATOM 1015 CB LEU A 65 0.575 1.908 3.729 1.00 0.00 C ATOM 1016 CG LEU A 65 1.341 0.764 4.396 1.00 0.00 C ATOM 1017 CD1 LEU A 65 2.813 1.119 4.538 1.00 0.00 C ATOM 1018 CD2 LEU A 65 0.735 0.438 5.754 1.00 0.00 C ATOM 0 H LEU A 65 0.206 4.756 3.026 1.00 0.00 H new ATOM 0 HA LEU A 65 0.316 3.149 5.465 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.473 1.619 3.648 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.952 2.028 2.713 1.00 0.00 H new ATOM 0 HG LEU A 65 1.261 -0.120 3.763 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.342 0.294 5.014 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.240 1.303 3.552 1.00 0.00 H new ATOM 0 HD13 LEU A 65 2.914 2.016 5.150 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.292 -0.378 6.215 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.784 1.318 6.395 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.306 0.140 5.626 1.00 0.00 H new ATOM 1030 N PHE A 66 2.686 3.808 5.628 1.00 0.00 N ATOM 1031 CA PHE A 66 4.062 4.270 5.775 1.00 0.00 C ATOM 1032 C PHE A 66 4.947 3.166 6.346 1.00 0.00 C ATOM 1033 O PHE A 66 4.593 2.519 7.332 1.00 0.00 O ATOM 1034 CB PHE A 66 4.116 5.502 6.680 1.00 0.00 C ATOM 1035 CG PHE A 66 3.346 6.675 6.142 1.00 0.00 C ATOM 1036 CD1 PHE A 66 3.802 7.368 5.032 1.00 0.00 C ATOM 1037 CD2 PHE A 66 2.168 7.083 6.746 1.00 0.00 C ATOM 1038 CE1 PHE A 66 3.096 8.448 4.536 1.00 0.00 C ATOM 1039 CE2 PHE A 66 1.458 8.162 6.254 1.00 0.00 C ATOM 1040 CZ PHE A 66 1.922 8.845 5.147 1.00 0.00 C ATOM 0 H PHE A 66 2.241 3.525 6.501 1.00 0.00 H new ATOM 0 HA PHE A 66 4.436 4.538 4.787 1.00 0.00 H new ATOM 0 HB2 PHE A 66 3.723 5.239 7.662 1.00 0.00 H new ATOM 0 HB3 PHE A 66 5.157 5.794 6.821 1.00 0.00 H new ATOM 0 HD1 PHE A 66 4.718 7.061 4.550 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.800 6.552 7.611 1.00 0.00 H new ATOM 0 HE1 PHE A 66 3.462 8.981 3.671 1.00 0.00 H new ATOM 0 HE2 PHE A 66 0.541 8.471 6.735 1.00 0.00 H new ATOM 0 HZ PHE A 66 1.368 9.688 4.760 1.00 0.00 H new ATOM 1050 N ILE A 67 6.100 2.957 5.719 1.00 0.00 N ATOM 1051 CA ILE A 67 7.037 1.933 6.164 1.00 0.00 C ATOM 1052 C ILE A 67 8.371 2.548 6.572 1.00 0.00 C ATOM 1053 O ILE A 67 9.140 3.003 5.727 1.00 0.00 O ATOM 1054 CB ILE A 67 7.283 0.880 5.068 1.00 0.00 C ATOM 1055 CG1 ILE A 67 5.956 0.275 4.603 1.00 0.00 C ATOM 1056 CG2 ILE A 67 8.217 -0.207 5.578 1.00 0.00 C ATOM 1057 CD1 ILE A 67 6.108 -0.717 3.471 1.00 0.00 C ATOM 0 H ILE A 67 6.408 3.483 4.901 1.00 0.00 H new ATOM 0 HA ILE A 67 6.585 1.446 7.028 1.00 0.00 H new ATOM 0 HB ILE A 67 7.756 1.368 4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.476 -0.220 5.447 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.291 1.078 4.285 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.381 -0.944 4.792 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.170 0.237 5.864 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.770 -0.694 6.444 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.128 -1.105 3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.559 -0.222 2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.747 -1.540 3.792 1.00 0.00 H new ATOM 1069 N ASN A 68 8.640 2.556 7.874 1.00 0.00 N ATOM 1070 CA ASN A 68 9.883 3.114 8.394 1.00 0.00 C ATOM 1071 C ASN A 68 10.996 2.071 8.376 1.00 0.00 C ATOM 1072 O ASN A 68 10.744 0.883 8.186 1.00 0.00 O ATOM 1073 CB ASN A 68 9.676 3.632 9.819 1.00 0.00 C ATOM 1074 CG ASN A 68 8.699 4.790 9.877 1.00 0.00 C ATOM 1075 OD1 ASN A 68 9.058 5.935 9.601 1.00 0.00 O ATOM 1076 ND2 ASN A 68 7.455 4.497 10.238 1.00 0.00 N ATOM 0 H ASN A 68 8.014 2.183 8.588 1.00 0.00 H new ATOM 0 HA ASN A 68 10.177 3.944 7.752 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.311 2.820 10.448 1.00 0.00 H new ATOM 0 HB3 ASN A 68 10.635 3.948 10.231 1.00 0.00 H new ATOM 0 HD21 ASN A 68 6.753 5.235 10.295 1.00 0.00 H new ATOM 0 HD22 ASN A 68 7.201 3.534 10.458 1.00 0.00 H new ATOM 1083 N ASN A 69 12.229 2.527 8.577 1.00 0.00 N ATOM 1084 CA ASN A 69 13.382 1.634 8.584 1.00 0.00 C ATOM 1085 C ASN A 69 13.567 0.974 7.221 1.00 0.00 C ATOM 1086 O ASN A 69 13.807 -0.231 7.131 1.00 0.00 O ATOM 1087 CB ASN A 69 13.217 0.563 9.664 1.00 0.00 C ATOM 1088 CG ASN A 69 13.109 1.156 11.055 1.00 0.00 C ATOM 1089 OD1 ASN A 69 12.785 2.332 11.217 1.00 0.00 O ATOM 1090 ND2 ASN A 69 13.381 0.341 12.068 1.00 0.00 N ATOM 0 H ASN A 69 12.455 3.509 8.737 1.00 0.00 H new ATOM 0 HA ASN A 69 14.269 2.228 8.803 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.325 -0.027 9.453 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.066 -0.119 9.628 1.00 0.00 H new ATOM 0 HD21 ASN A 69 13.325 0.683 13.027 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.646 -0.627 11.887 1.00 0.00 H new ATOM 1097 N CYS A 70 13.455 1.771 6.164 1.00 0.00 N ATOM 1098 CA CYS A 70 13.610 1.264 4.805 1.00 0.00 C ATOM 1099 C CYS A 70 15.050 0.833 4.546 1.00 0.00 C ATOM 1100 O CYS A 70 15.917 1.663 4.274 1.00 0.00 O ATOM 1101 CB CYS A 70 13.195 2.330 3.791 1.00 0.00 C ATOM 1102 SG CYS A 70 11.463 2.835 3.918 1.00 0.00 S ATOM 0 H CYS A 70 13.258 2.770 6.222 1.00 0.00 H new ATOM 0 HA CYS A 70 12.963 0.394 4.693 1.00 0.00 H new ATOM 0 HB2 CYS A 70 13.829 3.207 3.922 1.00 0.00 H new ATOM 0 HB3 CYS A 70 13.379 1.951 2.786 1.00 0.00 H new ATOM 0 HG CYS A 70 11.059 2.695 5.146 1.00 0.00 H new ATOM 1108 N GLN A 71 15.297 -0.470 4.635 1.00 0.00 N ATOM 1109 CA GLN A 71 16.633 -1.010 4.413 1.00 0.00 C ATOM 1110 C GLN A 71 16.784 -1.518 2.983 1.00 0.00 C ATOM 1111 O GLN A 71 15.819 -1.972 2.370 1.00 0.00 O ATOM 1112 CB GLN A 71 16.919 -2.142 5.401 1.00 0.00 C ATOM 1113 CG GLN A 71 18.391 -2.285 5.754 1.00 0.00 C ATOM 1114 CD GLN A 71 19.033 -0.963 6.126 1.00 0.00 C ATOM 1115 OE1 GLN A 71 20.043 -0.565 5.545 1.00 0.00 O ATOM 1116 NE2 GLN A 71 18.448 -0.273 7.098 1.00 0.00 N ATOM 0 H GLN A 71 14.590 -1.170 4.859 1.00 0.00 H new ATOM 0 HA GLN A 71 17.353 -0.207 4.572 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.350 -1.968 6.314 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.563 -3.081 4.978 1.00 0.00 H new ATOM 0 HG2 GLN A 71 18.495 -2.982 6.586 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.923 -2.718 4.907 1.00 0.00 H new ATOM 0 HE21 GLN A 71 17.612 -0.641 7.552 1.00 0.00 H new ATOM 0 HE22 GLN A 71 18.835 0.625 7.390 1.00 0.00 H new ATOM 1125 N MET A 72 18.002 -1.437 2.457 1.00 0.00 N ATOM 1126 CA MET A 72 18.279 -1.890 1.098 1.00 0.00 C ATOM 1127 C MET A 72 17.840 -3.338 0.907 1.00 0.00 C ATOM 1128 O MET A 72 17.527 -3.762 -0.206 1.00 0.00 O ATOM 1129 CB MET A 72 19.771 -1.751 0.786 1.00 0.00 C ATOM 1130 CG MET A 72 20.180 -2.405 -0.524 1.00 0.00 C ATOM 1131 SD MET A 72 19.657 -1.458 -1.966 1.00 0.00 S ATOM 1132 CE MET A 72 20.640 0.027 -1.771 1.00 0.00 C ATOM 0 H MET A 72 18.812 -1.062 2.950 1.00 0.00 H new ATOM 0 HA MET A 72 17.711 -1.264 0.410 1.00 0.00 H new ATOM 0 HB2 MET A 72 20.030 -0.693 0.751 1.00 0.00 H new ATOM 0 HB3 MET A 72 20.347 -2.193 1.599 1.00 0.00 H new ATOM 0 HG2 MET A 72 21.264 -2.522 -0.544 1.00 0.00 H new ATOM 0 HG3 MET A 72 19.750 -3.405 -0.576 1.00 0.00 H new ATOM 0 HE1 MET A 72 20.651 0.582 -2.709 1.00 0.00 H new ATOM 0 HE2 MET A 72 20.208 0.649 -0.987 1.00 0.00 H new ATOM 0 HE3 MET A 72 21.660 -0.245 -1.498 1.00 0.00 H new ATOM 1142 N THR A 73 17.820 -4.095 2.001 1.00 0.00 N ATOM 1143 CA THR A 73 17.421 -5.496 1.953 1.00 0.00 C ATOM 1144 C THR A 73 15.907 -5.640 2.047 1.00 0.00 C ATOM 1145 O THR A 73 15.331 -6.595 1.527 1.00 0.00 O ATOM 1146 CB THR A 73 18.074 -6.305 3.089 1.00 0.00 C ATOM 1147 OG1 THR A 73 17.892 -5.629 4.339 1.00 0.00 O ATOM 1148 CG2 THR A 73 19.559 -6.505 2.827 1.00 0.00 C ATOM 0 H THR A 73 18.075 -3.761 2.930 1.00 0.00 H new ATOM 0 HA THR A 73 17.761 -5.889 0.995 1.00 0.00 H new ATOM 0 HB THR A 73 17.594 -7.283 3.131 1.00 0.00 H new ATOM 0 HG1 THR A 73 18.308 -6.151 5.057 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.998 -7.079 3.643 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.694 -7.045 1.890 1.00 0.00 H new ATOM 0 HG23 THR A 73 20.051 -5.534 2.760 1.00 0.00 H new ATOM 1156 N ASP A 74 15.267 -4.685 2.714 1.00 0.00 N ATOM 1157 CA ASP A 74 13.818 -4.705 2.875 1.00 0.00 C ATOM 1158 C ASP A 74 13.120 -4.378 1.559 1.00 0.00 C ATOM 1159 O ASP A 74 12.045 -4.901 1.268 1.00 0.00 O ATOM 1160 CB ASP A 74 13.390 -3.709 3.955 1.00 0.00 C ATOM 1161 CG ASP A 74 13.425 -4.313 5.345 1.00 0.00 C ATOM 1162 OD1 ASP A 74 12.867 -5.415 5.528 1.00 0.00 O ATOM 1163 OD2 ASP A 74 14.010 -3.682 6.251 1.00 0.00 O ATOM 0 H ASP A 74 15.729 -3.888 3.152 1.00 0.00 H new ATOM 0 HA ASP A 74 13.525 -5.709 3.181 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.046 -2.839 3.923 1.00 0.00 H new ATOM 0 HB3 ASP A 74 12.381 -3.356 3.741 1.00 0.00 H new ATOM 1168 N ASP A 75 13.739 -3.508 0.767 1.00 0.00 N ATOM 1169 CA ASP A 75 13.177 -3.111 -0.518 1.00 0.00 C ATOM 1170 C ASP A 75 12.505 -4.294 -1.207 1.00 0.00 C ATOM 1171 O ASP A 75 13.175 -5.165 -1.762 1.00 0.00 O ATOM 1172 CB ASP A 75 14.270 -2.534 -1.420 1.00 0.00 C ATOM 1173 CG ASP A 75 15.153 -3.611 -2.020 1.00 0.00 C ATOM 1174 OD1 ASP A 75 15.533 -4.546 -1.284 1.00 0.00 O ATOM 1175 OD2 ASP A 75 15.464 -3.519 -3.226 1.00 0.00 O ATOM 0 H ASP A 75 14.630 -3.065 0.993 1.00 0.00 H new ATOM 0 HA ASP A 75 12.424 -2.344 -0.336 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.809 -1.958 -2.222 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.885 -1.843 -0.844 1.00 0.00 H new ATOM 1180 N SER A 76 11.176 -4.320 -1.165 1.00 0.00 N ATOM 1181 CA SER A 76 10.413 -5.399 -1.781 1.00 0.00 C ATOM 1182 C SER A 76 9.210 -4.849 -2.541 1.00 0.00 C ATOM 1183 O SER A 76 8.885 -3.667 -2.436 1.00 0.00 O ATOM 1184 CB SER A 76 9.947 -6.394 -0.716 1.00 0.00 C ATOM 1185 OG SER A 76 9.829 -7.699 -1.255 1.00 0.00 O ATOM 0 H SER A 76 10.606 -3.606 -0.711 1.00 0.00 H new ATOM 0 HA SER A 76 11.063 -5.913 -2.489 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.655 -6.402 0.113 1.00 0.00 H new ATOM 0 HB3 SER A 76 8.986 -6.076 -0.312 1.00 0.00 H new ATOM 0 HG SER A 76 8.890 -7.979 -1.230 1.00 0.00 H new ATOM 1191 N GLU A 77 8.554 -5.716 -3.306 1.00 0.00 N ATOM 1192 CA GLU A 77 7.387 -5.316 -4.084 1.00 0.00 C ATOM 1193 C GLU A 77 6.111 -5.448 -3.257 1.00 0.00 C ATOM 1194 O GLU A 77 5.817 -6.514 -2.715 1.00 0.00 O ATOM 1195 CB GLU A 77 7.277 -6.166 -5.351 1.00 0.00 C ATOM 1196 CG GLU A 77 5.978 -5.958 -6.112 1.00 0.00 C ATOM 1197 CD GLU A 77 4.878 -6.898 -5.657 1.00 0.00 C ATOM 1198 OE1 GLU A 77 4.906 -8.081 -6.057 1.00 0.00 O ATOM 1199 OE2 GLU A 77 3.991 -6.452 -4.901 1.00 0.00 O ATOM 0 H GLU A 77 8.810 -6.698 -3.404 1.00 0.00 H new ATOM 0 HA GLU A 77 7.510 -4.270 -4.366 1.00 0.00 H new ATOM 0 HB2 GLU A 77 8.115 -5.933 -6.008 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.366 -7.218 -5.081 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.647 -4.928 -5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.158 -6.104 -7.177 1.00 0.00 H new ATOM 1206 N TYR A 78 5.358 -4.358 -3.166 1.00 0.00 N ATOM 1207 CA TYR A 78 4.115 -4.349 -2.404 1.00 0.00 C ATOM 1208 C TYR A 78 2.906 -4.303 -3.333 1.00 0.00 C ATOM 1209 O TYR A 78 2.926 -3.630 -4.364 1.00 0.00 O ATOM 1210 CB TYR A 78 4.085 -3.154 -1.450 1.00 0.00 C ATOM 1211 CG TYR A 78 5.286 -3.079 -0.535 1.00 0.00 C ATOM 1212 CD1 TYR A 78 6.520 -2.653 -1.011 1.00 0.00 C ATOM 1213 CD2 TYR A 78 5.187 -3.434 0.804 1.00 0.00 C ATOM 1214 CE1 TYR A 78 7.621 -2.583 -0.179 1.00 0.00 C ATOM 1215 CE2 TYR A 78 6.282 -3.366 1.644 1.00 0.00 C ATOM 1216 CZ TYR A 78 7.497 -2.941 1.148 1.00 0.00 C ATOM 1217 OH TYR A 78 8.590 -2.873 1.980 1.00 0.00 O ATOM 0 H TYR A 78 5.587 -3.469 -3.611 1.00 0.00 H new ATOM 0 HA TYR A 78 4.069 -5.270 -1.823 1.00 0.00 H new ATOM 0 HB2 TYR A 78 4.026 -2.235 -2.034 1.00 0.00 H new ATOM 0 HB3 TYR A 78 3.180 -3.206 -0.844 1.00 0.00 H new ATOM 0 HD1 TYR A 78 6.620 -2.372 -2.049 1.00 0.00 H new ATOM 0 HD2 TYR A 78 4.238 -3.769 1.195 1.00 0.00 H new ATOM 0 HE1 TYR A 78 8.573 -2.250 -0.565 1.00 0.00 H new ATOM 0 HE2 TYR A 78 6.187 -3.644 2.683 1.00 0.00 H new ATOM 0 HH TYR A 78 8.333 -3.158 2.882 1.00 0.00 H new ATOM 1227 N TYR A 79 1.854 -5.024 -2.961 1.00 0.00 N ATOM 1228 CA TYR A 79 0.636 -5.068 -3.761 1.00 0.00 C ATOM 1229 C TYR A 79 -0.602 -5.077 -2.869 1.00 0.00 C ATOM 1230 O TYR A 79 -0.664 -5.809 -1.880 1.00 0.00 O ATOM 1231 CB TYR A 79 0.637 -6.303 -4.663 1.00 0.00 C ATOM 1232 CG TYR A 79 0.442 -7.601 -3.913 1.00 0.00 C ATOM 1233 CD1 TYR A 79 1.479 -8.167 -3.182 1.00 0.00 C ATOM 1234 CD2 TYR A 79 -0.780 -8.261 -3.934 1.00 0.00 C ATOM 1235 CE1 TYR A 79 1.305 -9.353 -2.496 1.00 0.00 C ATOM 1236 CE2 TYR A 79 -0.964 -9.447 -3.250 1.00 0.00 C ATOM 1237 CZ TYR A 79 0.082 -9.989 -2.533 1.00 0.00 C ATOM 1238 OH TYR A 79 -0.095 -11.170 -1.849 1.00 0.00 O ATOM 0 H TYR A 79 1.820 -5.586 -2.110 1.00 0.00 H new ATOM 0 HA TYR A 79 0.608 -4.173 -4.382 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.154 -6.200 -5.406 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.581 -6.345 -5.206 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.438 -7.671 -3.150 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.601 -7.839 -4.495 1.00 0.00 H new ATOM 0 HE1 TYR A 79 2.122 -9.780 -1.934 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.921 -9.947 -3.277 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.455 -10.981 -0.957 1.00 0.00 H new ATOM 1248 N VAL A 80 -1.587 -4.260 -3.226 1.00 0.00 N ATOM 1249 CA VAL A 80 -2.825 -4.174 -2.460 1.00 0.00 C ATOM 1250 C VAL A 80 -4.004 -4.720 -3.258 1.00 0.00 C ATOM 1251 O VAL A 80 -4.040 -4.616 -4.485 1.00 0.00 O ATOM 1252 CB VAL A 80 -3.129 -2.722 -2.045 1.00 0.00 C ATOM 1253 CG1 VAL A 80 -3.227 -1.826 -3.269 1.00 0.00 C ATOM 1254 CG2 VAL A 80 -4.408 -2.660 -1.224 1.00 0.00 C ATOM 0 H VAL A 80 -1.552 -3.648 -4.041 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.685 -4.778 -1.564 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.309 -2.360 -1.425 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.442 -0.804 -2.956 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.282 -1.848 -3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.027 -2.183 -3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.608 -1.627 -0.939 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.240 -3.040 -1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -4.294 -3.268 -0.327 1.00 0.00 H new ATOM 1264 N THR A 81 -4.969 -5.303 -2.554 1.00 0.00 N ATOM 1265 CA THR A 81 -6.150 -5.866 -3.196 1.00 0.00 C ATOM 1266 C THR A 81 -7.422 -5.186 -2.701 1.00 0.00 C ATOM 1267 O THR A 81 -7.557 -4.889 -1.515 1.00 0.00 O ATOM 1268 CB THR A 81 -6.259 -7.381 -2.941 1.00 0.00 C ATOM 1269 OG1 THR A 81 -6.329 -7.638 -1.534 1.00 0.00 O ATOM 1270 CG2 THR A 81 -5.068 -8.117 -3.537 1.00 0.00 C ATOM 0 H THR A 81 -4.956 -5.398 -1.538 1.00 0.00 H new ATOM 0 HA THR A 81 -6.041 -5.692 -4.266 1.00 0.00 H new ATOM 0 HB THR A 81 -7.168 -7.743 -3.421 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.400 -8.603 -1.381 1.00 0.00 H new ATOM 0 HG21 THR A 81 -5.167 -9.185 -3.344 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.034 -7.944 -4.613 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.148 -7.750 -3.081 1.00 0.00 H new ATOM 1278 N ALA A 82 -8.352 -4.944 -3.618 1.00 0.00 N ATOM 1279 CA ALA A 82 -9.615 -4.302 -3.274 1.00 0.00 C ATOM 1280 C ALA A 82 -10.733 -4.753 -4.208 1.00 0.00 C ATOM 1281 O ALA A 82 -10.746 -4.408 -5.388 1.00 0.00 O ATOM 1282 CB ALA A 82 -9.466 -2.788 -3.318 1.00 0.00 C ATOM 0 H ALA A 82 -8.255 -5.183 -4.605 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.882 -4.601 -2.260 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.416 -2.321 -3.059 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.703 -2.477 -2.605 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.172 -2.480 -4.322 1.00 0.00 H new ATOM 1288 N GLY A 83 -11.670 -5.528 -3.670 1.00 0.00 N ATOM 1289 CA GLY A 83 -12.779 -6.015 -4.470 1.00 0.00 C ATOM 1290 C GLY A 83 -12.335 -6.984 -5.547 1.00 0.00 C ATOM 1291 O GLY A 83 -11.930 -8.109 -5.252 1.00 0.00 O ATOM 0 H GLY A 83 -11.681 -5.827 -2.695 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.504 -6.506 -3.820 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.288 -5.170 -4.933 1.00 0.00 H new ATOM 1295 N ASP A 84 -12.412 -6.549 -6.800 1.00 0.00 N ATOM 1296 CA ASP A 84 -12.015 -7.387 -7.926 1.00 0.00 C ATOM 1297 C ASP A 84 -10.809 -6.793 -8.647 1.00 0.00 C ATOM 1298 O ASP A 84 -10.483 -7.193 -9.764 1.00 0.00 O ATOM 1299 CB ASP A 84 -13.180 -7.549 -8.904 1.00 0.00 C ATOM 1300 CG ASP A 84 -14.473 -7.923 -8.207 1.00 0.00 C ATOM 1301 OD1 ASP A 84 -14.406 -8.465 -7.083 1.00 0.00 O ATOM 1302 OD2 ASP A 84 -15.553 -7.675 -8.784 1.00 0.00 O ATOM 0 H ASP A 84 -12.746 -5.621 -7.062 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.737 -8.367 -7.538 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -13.322 -6.618 -9.452 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -12.931 -8.316 -9.637 1.00 0.00 H new ATOM 1307 N GLU A 85 -10.152 -5.835 -8.000 1.00 0.00 N ATOM 1308 CA GLU A 85 -8.983 -5.185 -8.581 1.00 0.00 C ATOM 1309 C GLU A 85 -7.782 -5.289 -7.646 1.00 0.00 C ATOM 1310 O GLU A 85 -7.934 -5.472 -6.438 1.00 0.00 O ATOM 1311 CB GLU A 85 -9.285 -3.715 -8.879 1.00 0.00 C ATOM 1312 CG GLU A 85 -10.264 -3.515 -10.024 1.00 0.00 C ATOM 1313 CD GLU A 85 -9.710 -3.984 -11.355 1.00 0.00 C ATOM 1314 OE1 GLU A 85 -9.693 -5.209 -11.593 1.00 0.00 O ATOM 1315 OE2 GLU A 85 -9.293 -3.124 -12.159 1.00 0.00 O ATOM 0 H GLU A 85 -10.409 -5.492 -7.074 1.00 0.00 H new ATOM 0 HA GLU A 85 -8.741 -5.695 -9.513 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.688 -3.246 -7.981 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -8.353 -3.202 -9.115 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.185 -4.056 -9.808 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.523 -2.459 -10.095 1.00 0.00 H new ATOM 1322 N LYS A 86 -6.586 -5.172 -8.214 1.00 0.00 N ATOM 1323 CA LYS A 86 -5.357 -5.252 -7.433 1.00 0.00 C ATOM 1324 C LYS A 86 -4.187 -4.637 -8.195 1.00 0.00 C ATOM 1325 O LYS A 86 -4.076 -4.794 -9.412 1.00 0.00 O ATOM 1326 CB LYS A 86 -5.043 -6.709 -7.085 1.00 0.00 C ATOM 1327 CG LYS A 86 -4.257 -7.436 -8.163 1.00 0.00 C ATOM 1328 CD LYS A 86 -3.779 -8.795 -7.682 1.00 0.00 C ATOM 1329 CE LYS A 86 -2.523 -8.676 -6.832 1.00 0.00 C ATOM 1330 NZ LYS A 86 -1.290 -8.633 -7.667 1.00 0.00 N ATOM 0 H LYS A 86 -6.442 -5.021 -9.212 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.504 -4.688 -6.512 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.478 -6.738 -6.153 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.978 -7.241 -6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.881 -7.561 -9.048 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.400 -6.832 -8.460 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.568 -9.275 -7.102 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.579 -9.436 -8.540 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.581 -7.774 -6.223 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.468 -9.521 -6.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -0.456 -8.552 -7.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.221 -9.505 -8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -1.331 -7.812 -8.304 1.00 0.00 H new ATOM 1344 N CYS A 87 -3.318 -3.939 -7.473 1.00 0.00 N ATOM 1345 CA CYS A 87 -2.156 -3.301 -8.082 1.00 0.00 C ATOM 1346 C CYS A 87 -0.882 -3.653 -7.322 1.00 0.00 C ATOM 1347 O CYS A 87 -0.932 -4.273 -6.259 1.00 0.00 O ATOM 1348 CB CYS A 87 -2.341 -1.783 -8.116 1.00 0.00 C ATOM 1349 SG CYS A 87 -2.738 -1.052 -6.511 1.00 0.00 S ATOM 0 H CYS A 87 -3.396 -3.800 -6.465 1.00 0.00 H new ATOM 0 HA CYS A 87 -2.062 -3.671 -9.103 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -1.428 -1.325 -8.496 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -3.136 -1.540 -8.821 1.00 0.00 H new ATOM 0 HG CYS A 87 -3.080 0.192 -6.673 1.00 0.00 H new ATOM 1355 N SER A 88 0.260 -3.255 -7.874 1.00 0.00 N ATOM 1356 CA SER A 88 1.548 -3.534 -7.251 1.00 0.00 C ATOM 1357 C SER A 88 2.549 -2.423 -7.552 1.00 0.00 C ATOM 1358 O SER A 88 2.432 -1.720 -8.557 1.00 0.00 O ATOM 1359 CB SER A 88 2.096 -4.876 -7.741 1.00 0.00 C ATOM 1360 OG SER A 88 2.222 -4.890 -9.153 1.00 0.00 O ATOM 0 H SER A 88 0.319 -2.738 -8.751 1.00 0.00 H new ATOM 0 HA SER A 88 1.399 -3.583 -6.172 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.067 -5.064 -7.284 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.433 -5.681 -7.424 1.00 0.00 H new ATOM 0 HG SER A 88 2.576 -5.757 -9.441 1.00 0.00 H new ATOM 1366 N THR A 89 3.535 -2.269 -6.674 1.00 0.00 N ATOM 1367 CA THR A 89 4.556 -1.243 -6.843 1.00 0.00 C ATOM 1368 C THR A 89 5.935 -1.772 -6.465 1.00 0.00 C ATOM 1369 O THR A 89 6.053 -2.786 -5.778 1.00 0.00 O ATOM 1370 CB THR A 89 4.246 0.004 -5.994 1.00 0.00 C ATOM 1371 OG1 THR A 89 5.215 1.026 -6.252 1.00 0.00 O ATOM 1372 CG2 THR A 89 4.245 -0.338 -4.511 1.00 0.00 C ATOM 0 H THR A 89 3.648 -2.842 -5.838 1.00 0.00 H new ATOM 0 HA THR A 89 4.553 -0.965 -7.897 1.00 0.00 H new ATOM 0 HB THR A 89 3.255 0.366 -6.268 1.00 0.00 H new ATOM 0 HG1 THR A 89 5.083 1.767 -5.625 1.00 0.00 H new ATOM 0 HG21 THR A 89 4.024 0.558 -3.931 1.00 0.00 H new ATOM 0 HG22 THR A 89 3.486 -1.095 -4.313 1.00 0.00 H new ATOM 0 HG23 THR A 89 5.224 -0.722 -4.226 1.00 0.00 H new ATOM 1380 N GLU A 90 6.975 -1.078 -6.917 1.00 0.00 N ATOM 1381 CA GLU A 90 8.346 -1.480 -6.625 1.00 0.00 C ATOM 1382 C GLU A 90 9.030 -0.460 -5.719 1.00 0.00 C ATOM 1383 O GLU A 90 9.049 0.736 -6.014 1.00 0.00 O ATOM 1384 CB GLU A 90 9.141 -1.640 -7.922 1.00 0.00 C ATOM 1385 CG GLU A 90 9.019 -3.021 -8.544 1.00 0.00 C ATOM 1386 CD GLU A 90 7.686 -3.233 -9.236 1.00 0.00 C ATOM 1387 OE1 GLU A 90 7.522 -2.740 -10.371 1.00 0.00 O ATOM 1388 OE2 GLU A 90 6.808 -3.894 -8.642 1.00 0.00 O ATOM 0 H GLU A 90 6.894 -0.235 -7.486 1.00 0.00 H new ATOM 0 HA GLU A 90 8.314 -2.438 -6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.800 -0.895 -8.641 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.192 -1.432 -7.722 1.00 0.00 H new ATOM 0 HG2 GLU A 90 9.825 -3.164 -9.264 1.00 0.00 H new ATOM 0 HG3 GLU A 90 9.146 -3.777 -7.769 1.00 0.00 H new ATOM 1395 N LEU A 91 9.591 -0.941 -4.615 1.00 0.00 N ATOM 1396 CA LEU A 91 10.276 -0.072 -3.664 1.00 0.00 C ATOM 1397 C LEU A 91 11.781 -0.073 -3.914 1.00 0.00 C ATOM 1398 O LEU A 91 12.397 -1.129 -4.057 1.00 0.00 O ATOM 1399 CB LEU A 91 9.985 -0.522 -2.231 1.00 0.00 C ATOM 1400 CG LEU A 91 10.543 0.370 -1.122 1.00 0.00 C ATOM 1401 CD1 LEU A 91 12.037 0.143 -0.954 1.00 0.00 C ATOM 1402 CD2 LEU A 91 10.255 1.835 -1.420 1.00 0.00 C ATOM 0 H LEU A 91 9.585 -1.928 -4.356 1.00 0.00 H new ATOM 0 HA LEU A 91 9.903 0.943 -3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.904 -0.591 -2.105 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.386 -1.527 -2.098 1.00 0.00 H new ATOM 0 HG LEU A 91 10.049 0.105 -0.187 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.416 0.787 -0.160 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.220 -0.900 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.548 0.379 -1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 91 10.659 2.455 -0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 91 10.721 2.112 -2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 91 9.178 1.988 -1.488 1.00 0.00 H new ATOM 1414 N PHE A 92 12.368 1.119 -3.962 1.00 0.00 N ATOM 1415 CA PHE A 92 13.801 1.256 -4.193 1.00 0.00 C ATOM 1416 C PHE A 92 14.440 2.146 -3.130 1.00 0.00 C ATOM 1417 O PHE A 92 14.459 3.370 -3.258 1.00 0.00 O ATOM 1418 CB PHE A 92 14.062 1.837 -5.584 1.00 0.00 C ATOM 1419 CG PHE A 92 13.659 0.919 -6.702 1.00 0.00 C ATOM 1420 CD1 PHE A 92 14.238 -0.333 -6.831 1.00 0.00 C ATOM 1421 CD2 PHE A 92 12.701 1.307 -7.625 1.00 0.00 C ATOM 1422 CE1 PHE A 92 13.870 -1.180 -7.859 1.00 0.00 C ATOM 1423 CE2 PHE A 92 12.328 0.465 -8.655 1.00 0.00 C ATOM 1424 CZ PHE A 92 12.913 -0.781 -8.772 1.00 0.00 C ATOM 0 H PHE A 92 11.873 2.003 -3.844 1.00 0.00 H new ATOM 0 HA PHE A 92 14.250 0.265 -4.131 1.00 0.00 H new ATOM 0 HB2 PHE A 92 13.520 2.778 -5.684 1.00 0.00 H new ATOM 0 HB3 PHE A 92 15.123 2.069 -5.679 1.00 0.00 H new ATOM 0 HD1 PHE A 92 14.986 -0.651 -6.120 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.240 2.280 -7.538 1.00 0.00 H new ATOM 0 HE1 PHE A 92 14.330 -2.153 -7.949 1.00 0.00 H new ATOM 0 HE2 PHE A 92 11.580 0.780 -9.368 1.00 0.00 H new ATOM 0 HZ PHE A 92 12.623 -1.442 -9.575 1.00 0.00 H new ATOM 1434 N VAL A 93 14.963 1.520 -2.080 1.00 0.00 N ATOM 1435 CA VAL A 93 15.603 2.253 -0.995 1.00 0.00 C ATOM 1436 C VAL A 93 17.119 2.272 -1.163 1.00 0.00 C ATOM 1437 O VAL A 93 17.778 1.239 -1.051 1.00 0.00 O ATOM 1438 CB VAL A 93 15.258 1.642 0.376 1.00 0.00 C ATOM 1439 CG1 VAL A 93 15.558 0.151 0.387 1.00 0.00 C ATOM 1440 CG2 VAL A 93 16.018 2.355 1.484 1.00 0.00 C ATOM 0 H VAL A 93 14.956 0.507 -1.958 1.00 0.00 H new ATOM 0 HA VAL A 93 15.223 3.274 -1.036 1.00 0.00 H new ATOM 0 HB VAL A 93 14.191 1.775 0.555 1.00 0.00 H new ATOM 0 HG11 VAL A 93 15.308 -0.263 1.364 1.00 0.00 H new ATOM 0 HG12 VAL A 93 14.964 -0.345 -0.381 1.00 0.00 H new ATOM 0 HG13 VAL A 93 16.617 -0.008 0.186 1.00 0.00 H new ATOM 0 HG21 VAL A 93 15.762 1.910 2.446 1.00 0.00 H new ATOM 0 HG22 VAL A 93 17.090 2.256 1.312 1.00 0.00 H new ATOM 0 HG23 VAL A 93 15.748 3.411 1.489 1.00 0.00 H new ATOM 1450 N ARG A 94 17.664 3.453 -1.433 1.00 0.00 N ATOM 1451 CA ARG A 94 19.102 3.607 -1.617 1.00 0.00 C ATOM 1452 C ARG A 94 19.839 3.463 -0.289 1.00 0.00 C ATOM 1453 O ARG A 94 19.365 3.926 0.749 1.00 0.00 O ATOM 1454 CB ARG A 94 19.415 4.967 -2.242 1.00 0.00 C ATOM 1455 CG ARG A 94 18.618 5.256 -3.504 1.00 0.00 C ATOM 1456 CD ARG A 94 18.730 6.717 -3.911 1.00 0.00 C ATOM 1457 NE ARG A 94 20.120 7.134 -4.077 1.00 0.00 N ATOM 1458 CZ ARG A 94 20.479 8.308 -4.585 1.00 0.00 C ATOM 1459 NH1 ARG A 94 19.556 9.176 -4.974 1.00 0.00 N ATOM 1460 NH2 ARG A 94 21.764 8.615 -4.704 1.00 0.00 N ATOM 0 H ARG A 94 17.132 4.318 -1.529 1.00 0.00 H new ATOM 0 HA ARG A 94 19.443 2.819 -2.289 1.00 0.00 H new ATOM 0 HB2 ARG A 94 19.215 5.749 -1.509 1.00 0.00 H new ATOM 0 HB3 ARG A 94 20.479 5.014 -2.476 1.00 0.00 H new ATOM 0 HG2 ARG A 94 18.977 4.623 -4.315 1.00 0.00 H new ATOM 0 HG3 ARG A 94 17.571 5.002 -3.340 1.00 0.00 H new ATOM 0 HD2 ARG A 94 18.190 6.876 -4.844 1.00 0.00 H new ATOM 0 HD3 ARG A 94 18.252 7.341 -3.156 1.00 0.00 H new ATOM 0 HE ARG A 94 20.855 6.489 -3.787 1.00 0.00 H new ATOM 0 HH11 ARG A 94 18.567 8.943 -4.884 1.00 0.00 H new ATOM 0 HH12 ARG A 94 19.835 10.077 -5.364 1.00 0.00 H new ATOM 0 HH21 ARG A 94 22.477 7.950 -4.405 1.00 0.00 H new ATOM 0 HH22 ARG A 94 22.039 9.516 -5.094 1.00 0.00 H new ATOM 1474 N SER A 95 21.001 2.819 -0.329 1.00 0.00 N ATOM 1475 CA SER A 95 21.802 2.611 0.872 1.00 0.00 C ATOM 1476 C SER A 95 23.280 2.855 0.588 1.00 0.00 C ATOM 1477 O SER A 95 23.936 2.056 -0.079 1.00 0.00 O ATOM 1478 CB SER A 95 21.601 1.190 1.404 1.00 0.00 C ATOM 1479 OG SER A 95 22.321 0.991 2.608 1.00 0.00 O ATOM 0 H SER A 95 21.409 2.432 -1.180 1.00 0.00 H new ATOM 0 HA SER A 95 21.473 3.325 1.627 1.00 0.00 H new ATOM 0 HB2 SER A 95 20.540 1.009 1.577 1.00 0.00 H new ATOM 0 HB3 SER A 95 21.930 0.468 0.656 1.00 0.00 H new ATOM 0 HG SER A 95 22.175 0.077 2.929 1.00 0.00 H new ATOM 1485 N GLY A 96 23.799 3.967 1.100 1.00 0.00 N ATOM 1486 CA GLY A 96 25.197 4.298 0.892 1.00 0.00 C ATOM 1487 C GLY A 96 25.918 4.612 2.187 1.00 0.00 C ATOM 1488 O GLY A 96 25.336 5.143 3.134 1.00 0.00 O ATOM 0 H GLY A 96 23.276 4.645 1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 96 25.694 3.465 0.396 1.00 0.00 H new ATOM 0 HA3 GLY A 96 25.268 5.156 0.223 1.00 0.00 H new ATOM 1492 N PRO A 97 27.216 4.278 2.242 1.00 0.00 N ATOM 1493 CA PRO A 97 28.045 4.517 3.427 1.00 0.00 C ATOM 1494 C PRO A 97 28.316 6.000 3.656 1.00 0.00 C ATOM 1495 O PRO A 97 28.566 6.748 2.710 1.00 0.00 O ATOM 1496 CB PRO A 97 29.347 3.780 3.104 1.00 0.00 C ATOM 1497 CG PRO A 97 29.401 3.741 1.616 1.00 0.00 C ATOM 1498 CD PRO A 97 27.974 3.642 1.152 1.00 0.00 C ATOM 0 HA PRO A 97 27.559 4.173 4.340 1.00 0.00 H new ATOM 0 HB2 PRO A 97 30.210 4.301 3.518 1.00 0.00 H new ATOM 0 HB3 PRO A 97 29.349 2.775 3.527 1.00 0.00 H new ATOM 0 HG2 PRO A 97 29.879 4.637 1.219 1.00 0.00 H new ATOM 0 HG3 PRO A 97 29.984 2.888 1.269 1.00 0.00 H new ATOM 0 HD2 PRO A 97 27.823 4.158 0.204 1.00 0.00 H new ATOM 0 HD3 PRO A 97 27.671 2.606 1.003 1.00 0.00 H new ATOM 1506 N SER A 98 28.265 6.419 4.916 1.00 0.00 N ATOM 1507 CA SER A 98 28.502 7.814 5.268 1.00 0.00 C ATOM 1508 C SER A 98 29.181 7.923 6.630 1.00 0.00 C ATOM 1509 O SER A 98 29.322 6.933 7.346 1.00 0.00 O ATOM 1510 CB SER A 98 27.183 8.590 5.280 1.00 0.00 C ATOM 1511 OG SER A 98 26.310 8.097 6.282 1.00 0.00 O ATOM 0 H SER A 98 28.062 5.812 5.710 1.00 0.00 H new ATOM 0 HA SER A 98 29.163 8.245 4.516 1.00 0.00 H new ATOM 0 HB2 SER A 98 27.381 9.648 5.454 1.00 0.00 H new ATOM 0 HB3 SER A 98 26.703 8.512 4.305 1.00 0.00 H new ATOM 0 HG SER A 98 25.475 8.610 6.270 1.00 0.00 H new ATOM 1517 N SER A 99 29.600 9.135 6.979 1.00 0.00 N ATOM 1518 CA SER A 99 30.269 9.375 8.253 1.00 0.00 C ATOM 1519 C SER A 99 30.291 10.864 8.583 1.00 0.00 C ATOM 1520 O SER A 99 30.490 11.703 7.705 1.00 0.00 O ATOM 1521 CB SER A 99 31.697 8.828 8.214 1.00 0.00 C ATOM 1522 OG SER A 99 31.716 7.433 8.460 1.00 0.00 O ATOM 0 H SER A 99 29.488 9.966 6.398 1.00 0.00 H new ATOM 0 HA SER A 99 29.710 8.857 9.032 1.00 0.00 H new ATOM 0 HB2 SER A 99 32.142 9.035 7.241 1.00 0.00 H new ATOM 0 HB3 SER A 99 32.306 9.340 8.959 1.00 0.00 H new ATOM 0 HG SER A 99 30.859 7.042 8.190 1.00 0.00 H new ATOM 1528 N GLY A 100 30.086 11.185 9.857 1.00 0.00 N ATOM 1529 CA GLY A 100 30.086 12.573 10.282 1.00 0.00 C ATOM 1530 C GLY A 100 28.948 13.366 9.670 1.00 0.00 C ATOM 1531 O GLY A 100 29.127 14.038 8.655 1.00 0.00 O ATOM 0 H GLY A 100 29.920 10.509 10.602 1.00 0.00 H new ATOM 0 HA2 GLY A 100 30.013 12.617 11.369 1.00 0.00 H new ATOM 0 HA3 GLY A 100 31.035 13.034 10.008 1.00 0.00 H new TER 1535 GLY A 100