USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 890 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: B 54 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 59 GLN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Set 2.1: A 54 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 59 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 6 THR OG1 : rot 88:sc= -0.429! USER MOD Single : A 8 THR OG1 : rot 176:sc= 0.773 USER MOD Single : A 13 SER OG : rot 25:sc= 1.21 USER MOD Single : A 14 TYR OH : rot 180:sc= -0.38 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.0644 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -5.3! C(o=-5.3!,f=-4.7!) USER MOD Single : A 21 GLN : amide:sc= -1.43! C(o=-1.4!,f=-1.3!) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -64:sc=-0.00915 USER MOD Single : A 31 SER OG : rot 40:sc= 0.548 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0522 K(o=-0.052,f=-0.97) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.02) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0896 USER MOD Single : A 44 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.0303) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -1.25 K(o=-1.3,f=-2.6!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 30:sc= -2.56! USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 93:sc= -0.46! USER MOD Single : B 8 THR OG1 : rot 163:sc= -0.209! USER MOD Single : B 13 SER OG : rot 27:sc= 1.25 USER MOD Single : B 14 TYR OH : rot 180:sc= -0.373 USER MOD Single : B 15 THR OG1 : rot 180:sc= -0.0646 USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -5.73! C(o=-5.7!,f=-4.7!) USER MOD Single : B 21 GLN : amide:sc= -1.42! C(o=-1.4!,f=-1.3!) USER MOD Single : B 22 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -52:sc= -0.0365 USER MOD Single : B 31 SER OG : rot 42:sc= 0.555 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -0.0523 K(o=-0.052,f=-1) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0258) USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.0883 USER MOD Single : B 44 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.0325) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -1.25 K(o=-1.3,f=-2.4!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 30:sc= -2.6! USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ASP A 5 52.418 -2.293 -10.701 1.00 0.00 N ATOM 54 CA ASP A 5 51.196 -2.596 -9.906 1.00 0.00 C ATOM 55 C ASP A 5 51.374 -2.074 -8.479 1.00 0.00 C ATOM 56 O ASP A 5 52.307 -1.355 -8.184 1.00 0.00 O ATOM 57 CB ASP A 5 50.974 -4.109 -9.871 1.00 0.00 C ATOM 58 CG ASP A 5 52.234 -4.797 -9.343 1.00 0.00 C ATOM 59 OD1 ASP A 5 53.231 -4.783 -10.046 1.00 0.00 O ATOM 60 OD2 ASP A 5 52.181 -5.325 -8.244 1.00 0.00 O ATOM 0 HA ASP A 5 50.334 -2.112 -10.365 1.00 0.00 H new ATOM 0 HB2 ASP A 5 50.122 -4.348 -9.234 1.00 0.00 H new ATOM 0 HB3 ASP A 5 50.738 -4.476 -10.870 1.00 0.00 H new ATOM 65 N THR A 6 50.487 -2.431 -7.591 1.00 0.00 N ATOM 66 CA THR A 6 50.606 -1.958 -6.182 1.00 0.00 C ATOM 67 C THR A 6 50.405 -0.440 -6.133 1.00 0.00 C ATOM 68 O THR A 6 50.784 0.263 -7.049 1.00 0.00 O ATOM 69 CB THR A 6 51.996 -2.305 -5.641 1.00 0.00 C ATOM 70 OG1 THR A 6 52.657 -3.171 -6.552 1.00 0.00 O ATOM 71 CG2 THR A 6 51.857 -2.999 -4.286 1.00 0.00 C ATOM 0 H THR A 6 49.684 -3.031 -7.780 1.00 0.00 H new ATOM 0 HA THR A 6 49.846 -2.446 -5.571 1.00 0.00 H new ATOM 0 HB THR A 6 52.578 -1.391 -5.523 1.00 0.00 H new ATOM 0 HG1 THR A 6 53.134 -2.638 -7.222 1.00 0.00 H new ATOM 0 HG21 THR A 6 52.846 -3.246 -3.901 1.00 0.00 H new ATOM 0 HG22 THR A 6 51.351 -2.334 -3.587 1.00 0.00 H new ATOM 0 HG23 THR A 6 51.275 -3.913 -4.403 1.00 0.00 H new ATOM 79 N PRO A 7 49.809 0.018 -5.060 1.00 0.00 N ATOM 80 CA PRO A 7 49.536 1.452 -4.855 1.00 0.00 C ATOM 81 C PRO A 7 50.807 2.180 -4.401 1.00 0.00 C ATOM 82 O PRO A 7 51.871 1.600 -4.320 1.00 0.00 O ATOM 83 CB PRO A 7 48.479 1.459 -3.746 1.00 0.00 C ATOM 84 CG PRO A 7 48.626 0.114 -2.996 1.00 0.00 C ATOM 85 CD PRO A 7 49.351 -0.849 -3.955 1.00 0.00 C ATOM 0 HA PRO A 7 49.203 1.959 -5.760 1.00 0.00 H new ATOM 0 HB2 PRO A 7 48.631 2.300 -3.069 1.00 0.00 H new ATOM 0 HB3 PRO A 7 47.478 1.563 -4.164 1.00 0.00 H new ATOM 0 HG2 PRO A 7 49.194 0.244 -2.075 1.00 0.00 H new ATOM 0 HG3 PRO A 7 47.650 -0.281 -2.715 1.00 0.00 H new ATOM 0 HD2 PRO A 7 50.189 -1.345 -3.464 1.00 0.00 H new ATOM 0 HD3 PRO A 7 48.683 -1.632 -4.314 1.00 0.00 H new ATOM 93 N THR A 8 50.701 3.447 -4.103 1.00 0.00 N ATOM 94 CA THR A 8 51.899 4.211 -3.653 1.00 0.00 C ATOM 95 C THR A 8 52.054 4.065 -2.138 1.00 0.00 C ATOM 96 O THR A 8 51.450 4.787 -1.370 1.00 0.00 O ATOM 97 CB THR A 8 51.723 5.690 -4.011 1.00 0.00 C ATOM 98 OG1 THR A 8 51.456 5.806 -5.402 1.00 0.00 O ATOM 99 CG2 THR A 8 53.000 6.458 -3.669 1.00 0.00 C ATOM 0 H THR A 8 49.836 3.986 -4.152 1.00 0.00 H new ATOM 0 HA THR A 8 52.789 3.822 -4.148 1.00 0.00 H new ATOM 0 HB THR A 8 50.892 6.106 -3.442 1.00 0.00 H new ATOM 0 HG1 THR A 8 51.279 6.744 -5.624 1.00 0.00 H new ATOM 0 HG21 THR A 8 52.872 7.510 -3.925 1.00 0.00 H new ATOM 0 HG22 THR A 8 53.205 6.366 -2.602 1.00 0.00 H new ATOM 0 HG23 THR A 8 53.835 6.046 -4.236 1.00 0.00 H new ATOM 107 N ALA A 9 52.858 3.134 -1.703 1.00 0.00 N ATOM 108 CA ALA A 9 53.049 2.938 -0.238 1.00 0.00 C ATOM 109 C ALA A 9 53.790 4.142 0.350 1.00 0.00 C ATOM 110 O ALA A 9 54.850 4.517 -0.110 1.00 0.00 O ATOM 111 CB ALA A 9 53.866 1.668 0.005 1.00 0.00 C ATOM 0 H ALA A 9 53.391 2.500 -2.299 1.00 0.00 H new ATOM 0 HA ALA A 9 52.076 2.842 0.243 1.00 0.00 H new ATOM 0 HB1 ALA A 9 54.006 1.525 1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 9 53.337 0.810 -0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 9 54.838 1.763 -0.478 1.00 0.00 H new ATOM 117 N CYS A 10 53.239 4.749 1.365 1.00 0.00 N ATOM 118 CA CYS A 10 53.910 5.927 1.985 1.00 0.00 C ATOM 119 C CYS A 10 53.710 5.882 3.504 1.00 0.00 C ATOM 120 O CYS A 10 52.629 5.611 3.988 1.00 0.00 O ATOM 121 CB CYS A 10 53.304 7.213 1.415 1.00 0.00 C ATOM 122 SG CYS A 10 53.183 7.072 -0.387 1.00 0.00 S ATOM 0 H CYS A 10 52.353 4.480 1.792 1.00 0.00 H new ATOM 0 HA CYS A 10 54.977 5.905 1.763 1.00 0.00 H new ATOM 0 HB2 CYS A 10 52.317 7.385 1.845 1.00 0.00 H new ATOM 0 HB3 CYS A 10 53.922 8.070 1.683 1.00 0.00 H new ATOM 127 N CYS A 11 54.747 6.133 4.260 1.00 0.00 N ATOM 128 CA CYS A 11 54.618 6.091 5.745 1.00 0.00 C ATOM 129 C CYS A 11 53.953 7.374 6.248 1.00 0.00 C ATOM 130 O CYS A 11 54.574 8.415 6.328 1.00 0.00 O ATOM 131 CB CYS A 11 56.009 5.964 6.374 1.00 0.00 C ATOM 132 SG CYS A 11 56.300 4.247 6.868 1.00 0.00 S ATOM 0 H CYS A 11 55.677 6.365 3.912 1.00 0.00 H new ATOM 0 HA CYS A 11 54.006 5.234 6.026 1.00 0.00 H new ATOM 0 HB2 CYS A 11 56.771 6.282 5.662 1.00 0.00 H new ATOM 0 HB3 CYS A 11 56.088 6.620 7.241 1.00 0.00 H new ATOM 137 N PHE A 12 52.698 7.306 6.599 1.00 0.00 N ATOM 138 CA PHE A 12 52.002 8.520 7.109 1.00 0.00 C ATOM 139 C PHE A 12 51.975 8.479 8.639 1.00 0.00 C ATOM 140 O PHE A 12 51.621 9.442 9.291 1.00 0.00 O ATOM 141 CB PHE A 12 50.569 8.555 6.574 1.00 0.00 C ATOM 142 CG PHE A 12 50.528 9.347 5.289 1.00 0.00 C ATOM 143 CD1 PHE A 12 50.362 10.736 5.329 1.00 0.00 C ATOM 144 CD2 PHE A 12 50.655 8.692 4.059 1.00 0.00 C ATOM 145 CE1 PHE A 12 50.322 11.471 4.138 1.00 0.00 C ATOM 146 CE2 PHE A 12 50.617 9.426 2.868 1.00 0.00 C ATOM 147 CZ PHE A 12 50.450 10.816 2.907 1.00 0.00 C ATOM 0 H PHE A 12 52.125 6.463 6.555 1.00 0.00 H new ATOM 0 HA PHE A 12 52.532 9.412 6.774 1.00 0.00 H new ATOM 0 HB2 PHE A 12 50.210 7.541 6.400 1.00 0.00 H new ATOM 0 HB3 PHE A 12 49.905 9.005 7.312 1.00 0.00 H new ATOM 0 HD1 PHE A 12 50.265 11.241 6.279 1.00 0.00 H new ATOM 0 HD2 PHE A 12 50.782 7.620 4.029 1.00 0.00 H new ATOM 0 HE1 PHE A 12 50.192 12.543 4.169 1.00 0.00 H new ATOM 0 HE2 PHE A 12 50.716 8.921 1.919 1.00 0.00 H new ATOM 0 HZ PHE A 12 50.420 11.382 1.988 1.00 0.00 H new ATOM 157 N SER A 13 52.348 7.369 9.215 1.00 0.00 N ATOM 158 CA SER A 13 52.351 7.255 10.700 1.00 0.00 C ATOM 159 C SER A 13 53.119 5.993 11.093 1.00 0.00 C ATOM 160 O SER A 13 52.813 4.906 10.642 1.00 0.00 O ATOM 161 CB SER A 13 50.912 7.159 11.209 1.00 0.00 C ATOM 162 OG SER A 13 50.408 8.467 11.443 1.00 0.00 O ATOM 0 H SER A 13 52.652 6.532 8.718 1.00 0.00 H new ATOM 0 HA SER A 13 52.827 8.132 11.140 1.00 0.00 H new ATOM 0 HB2 SER A 13 50.289 6.642 10.478 1.00 0.00 H new ATOM 0 HB3 SER A 13 50.877 6.574 12.128 1.00 0.00 H new ATOM 0 HG SER A 13 50.897 9.110 10.888 1.00 0.00 H new ATOM 168 N TYR A 14 54.121 6.121 11.919 1.00 0.00 N ATOM 169 CA TYR A 14 54.904 4.915 12.317 1.00 0.00 C ATOM 170 C TYR A 14 54.523 4.493 13.738 1.00 0.00 C ATOM 171 O TYR A 14 53.607 5.030 14.329 1.00 0.00 O ATOM 172 CB TYR A 14 56.411 5.196 12.237 1.00 0.00 C ATOM 173 CG TYR A 14 56.655 6.533 11.573 1.00 0.00 C ATOM 174 CD1 TYR A 14 56.314 6.718 10.227 1.00 0.00 C ATOM 175 CD2 TYR A 14 57.215 7.587 12.303 1.00 0.00 C ATOM 176 CE1 TYR A 14 56.532 7.954 9.611 1.00 0.00 C ATOM 177 CE2 TYR A 14 57.433 8.825 11.688 1.00 0.00 C ATOM 178 CZ TYR A 14 57.093 9.009 10.342 1.00 0.00 C ATOM 179 OH TYR A 14 57.309 10.230 9.736 1.00 0.00 O ATOM 0 H TYR A 14 54.430 7.000 12.333 1.00 0.00 H new ATOM 0 HA TYR A 14 54.669 4.105 11.627 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.843 5.194 13.238 1.00 0.00 H new ATOM 0 HB3 TYR A 14 56.907 4.405 11.674 1.00 0.00 H new ATOM 0 HD1 TYR A 14 55.882 5.904 9.664 1.00 0.00 H new ATOM 0 HD2 TYR A 14 57.479 7.445 13.341 1.00 0.00 H new ATOM 0 HE1 TYR A 14 56.268 8.095 8.573 1.00 0.00 H new ATOM 0 HE2 TYR A 14 57.864 9.639 12.252 1.00 0.00 H new ATOM 0 HH TYR A 14 57.703 10.851 10.383 1.00 0.00 H new ATOM 189 N THR A 15 55.205 3.521 14.285 1.00 0.00 N ATOM 190 CA THR A 15 54.855 3.056 15.661 1.00 0.00 C ATOM 191 C THR A 15 55.833 3.624 16.689 1.00 0.00 C ATOM 192 O THR A 15 56.875 4.150 16.352 1.00 0.00 O ATOM 193 CB THR A 15 54.911 1.526 15.711 1.00 0.00 C ATOM 194 OG1 THR A 15 54.340 1.075 16.932 1.00 0.00 O ATOM 195 CG2 THR A 15 56.367 1.064 15.627 1.00 0.00 C ATOM 0 H THR A 15 55.983 3.032 13.843 1.00 0.00 H new ATOM 0 HA THR A 15 53.850 3.405 15.899 1.00 0.00 H new ATOM 0 HB THR A 15 54.352 1.113 14.871 1.00 0.00 H new ATOM 0 HG1 THR A 15 54.373 0.096 16.967 1.00 0.00 H new ATOM 0 HG21 THR A 15 56.406 -0.025 15.663 1.00 0.00 H new ATOM 0 HG22 THR A 15 56.806 1.412 14.692 1.00 0.00 H new ATOM 0 HG23 THR A 15 56.928 1.475 16.466 1.00 0.00 H new ATOM 203 N SER A 16 55.509 3.496 17.948 1.00 0.00 N ATOM 204 CA SER A 16 56.421 3.997 19.012 1.00 0.00 C ATOM 205 C SER A 16 57.479 2.926 19.271 1.00 0.00 C ATOM 206 O SER A 16 58.666 3.176 19.192 1.00 0.00 O ATOM 207 CB SER A 16 55.627 4.255 20.293 1.00 0.00 C ATOM 208 OG SER A 16 55.681 5.640 20.608 1.00 0.00 O ATOM 0 H SER A 16 54.648 3.064 18.285 1.00 0.00 H new ATOM 0 HA SER A 16 56.892 4.929 18.699 1.00 0.00 H new ATOM 0 HB2 SER A 16 54.592 3.940 20.162 1.00 0.00 H new ATOM 0 HB3 SER A 16 56.038 3.667 21.114 1.00 0.00 H new ATOM 0 HG SER A 16 55.171 5.809 21.428 1.00 0.00 H new ATOM 214 N ARG A 17 57.054 1.722 19.554 1.00 0.00 N ATOM 215 CA ARG A 17 58.030 0.624 19.788 1.00 0.00 C ATOM 216 C ARG A 17 58.546 0.153 18.428 1.00 0.00 C ATOM 217 O ARG A 17 57.779 -0.154 17.538 1.00 0.00 O ATOM 218 CB ARG A 17 57.344 -0.538 20.511 1.00 0.00 C ATOM 219 CG ARG A 17 57.893 -0.647 21.936 1.00 0.00 C ATOM 220 CD ARG A 17 56.756 -0.993 22.899 1.00 0.00 C ATOM 221 NE ARG A 17 56.080 -2.240 22.443 1.00 0.00 N ATOM 222 CZ ARG A 17 55.030 -2.682 23.078 1.00 0.00 C ATOM 223 NH1 ARG A 17 53.942 -1.963 23.120 1.00 0.00 N ATOM 224 NH2 ARG A 17 55.068 -3.843 23.674 1.00 0.00 N ATOM 0 H ARG A 17 56.073 1.455 19.633 1.00 0.00 H new ATOM 0 HA ARG A 17 58.855 0.978 20.406 1.00 0.00 H new ATOM 0 HB2 ARG A 17 56.266 -0.379 20.536 1.00 0.00 H new ATOM 0 HB3 ARG A 17 57.516 -1.469 19.971 1.00 0.00 H new ATOM 0 HG2 ARG A 17 58.667 -1.413 21.981 1.00 0.00 H new ATOM 0 HG3 ARG A 17 58.359 0.294 22.230 1.00 0.00 H new ATOM 0 HD2 ARG A 17 57.147 -1.127 23.907 1.00 0.00 H new ATOM 0 HD3 ARG A 17 56.039 -0.173 22.942 1.00 0.00 H new ATOM 0 HE ARG A 17 56.438 -2.748 21.634 1.00 0.00 H new ATOM 0 HH11 ARG A 17 53.912 -1.055 22.656 1.00 0.00 H new ATOM 0 HH12 ARG A 17 53.121 -2.309 23.617 1.00 0.00 H new ATOM 0 HH21 ARG A 17 55.919 -4.405 23.643 1.00 0.00 H new ATOM 0 HH22 ARG A 17 54.247 -4.188 24.171 1.00 0.00 H new ATOM 238 N GLN A 18 59.835 0.122 18.246 1.00 0.00 N ATOM 239 CA GLN A 18 60.384 -0.296 16.929 1.00 0.00 C ATOM 240 C GLN A 18 60.221 -1.787 16.692 1.00 0.00 C ATOM 241 O GLN A 18 59.584 -2.505 17.437 1.00 0.00 O ATOM 242 CB GLN A 18 61.862 0.021 16.853 1.00 0.00 C ATOM 243 CG GLN A 18 62.211 1.247 17.701 1.00 0.00 C ATOM 244 CD GLN A 18 61.137 2.329 17.545 1.00 0.00 C ATOM 245 OE1 GLN A 18 60.896 3.095 18.456 1.00 0.00 O ATOM 246 NE2 GLN A 18 60.478 2.425 16.424 1.00 0.00 N ATOM 0 H GLN A 18 60.531 0.367 18.951 1.00 0.00 H new ATOM 0 HA GLN A 18 59.826 0.253 16.170 1.00 0.00 H new ATOM 0 HB2 GLN A 18 62.439 -0.838 17.196 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.145 0.201 15.816 1.00 0.00 H new ATOM 0 HG2 GLN A 18 62.297 0.960 18.749 1.00 0.00 H new ATOM 0 HG3 GLN A 18 63.181 1.642 17.398 1.00 0.00 H new ATOM 0 HE21 GLN A 18 60.679 1.783 15.658 1.00 0.00 H new ATOM 0 HE22 GLN A 18 59.762 3.143 16.313 1.00 0.00 H new ATOM 255 N ILE A 19 60.838 -2.234 15.643 1.00 0.00 N ATOM 256 CA ILE A 19 60.819 -3.650 15.263 1.00 0.00 C ATOM 257 C ILE A 19 62.235 -3.980 14.816 1.00 0.00 C ATOM 258 O ILE A 19 62.616 -3.697 13.698 1.00 0.00 O ATOM 259 CB ILE A 19 59.864 -3.870 14.104 1.00 0.00 C ATOM 260 CG1 ILE A 19 59.907 -2.662 13.161 1.00 0.00 C ATOM 261 CG2 ILE A 19 58.446 -4.065 14.637 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.115 -1.499 13.766 1.00 0.00 C ATOM 0 H ILE A 19 61.376 -1.642 15.011 1.00 0.00 H new ATOM 0 HA ILE A 19 60.492 -4.277 16.092 1.00 0.00 H new ATOM 0 HB ILE A 19 60.164 -4.761 13.553 1.00 0.00 H new ATOM 0 HG12 ILE A 19 60.940 -2.360 12.990 1.00 0.00 H new ATOM 0 HG13 ILE A 19 59.489 -2.932 12.191 1.00 0.00 H new ATOM 0 HG21 ILE A 19 57.762 -4.223 13.803 1.00 0.00 H new ATOM 0 HG22 ILE A 19 58.421 -4.933 15.296 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.141 -3.179 15.193 1.00 0.00 H new ATOM 0 HD11 ILE A 19 59.150 -0.644 13.090 1.00 0.00 H new ATOM 0 HD12 ILE A 19 58.079 -1.802 13.914 1.00 0.00 H new ATOM 0 HD13 ILE A 19 59.552 -1.221 14.725 1.00 0.00 H new ATOM 274 N PRO A 20 62.980 -4.538 15.714 1.00 0.00 N ATOM 275 CA PRO A 20 64.382 -4.889 15.466 1.00 0.00 C ATOM 276 C PRO A 20 64.502 -5.957 14.391 1.00 0.00 C ATOM 277 O PRO A 20 63.529 -6.378 13.799 1.00 0.00 O ATOM 278 CB PRO A 20 64.874 -5.371 16.833 1.00 0.00 C ATOM 279 CG PRO A 20 63.605 -5.753 17.623 1.00 0.00 C ATOM 280 CD PRO A 20 62.483 -4.905 17.050 1.00 0.00 C ATOM 0 HA PRO A 20 64.976 -4.057 15.087 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.543 -6.226 16.729 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.434 -4.589 17.346 1.00 0.00 H new ATOM 0 HG2 PRO A 20 63.384 -6.815 17.517 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.735 -5.560 18.688 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.548 -5.462 16.992 1.00 0.00 H new ATOM 0 HD3 PRO A 20 62.292 -4.024 17.663 1.00 0.00 H new ATOM 288 N GLN A 21 65.700 -6.378 14.123 1.00 0.00 N ATOM 289 CA GLN A 21 65.922 -7.401 13.067 1.00 0.00 C ATOM 290 C GLN A 21 65.498 -8.793 13.558 1.00 0.00 C ATOM 291 O GLN A 21 65.825 -9.794 12.952 1.00 0.00 O ATOM 292 CB GLN A 21 67.407 -7.416 12.712 1.00 0.00 C ATOM 293 CG GLN A 21 67.791 -6.073 12.081 1.00 0.00 C ATOM 294 CD GLN A 21 68.124 -6.283 10.604 1.00 0.00 C ATOM 295 OE1 GLN A 21 69.254 -6.563 10.257 1.00 0.00 O ATOM 296 NE2 GLN A 21 67.179 -6.160 9.712 1.00 0.00 N ATOM 0 H GLN A 21 66.545 -6.055 14.594 1.00 0.00 H new ATOM 0 HA GLN A 21 65.322 -7.151 12.192 1.00 0.00 H new ATOM 0 HB2 GLN A 21 68.004 -7.595 13.606 1.00 0.00 H new ATOM 0 HB3 GLN A 21 67.619 -8.230 12.019 1.00 0.00 H new ATOM 0 HG2 GLN A 21 66.970 -5.363 12.183 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.648 -5.646 12.601 1.00 0.00 H new ATOM 0 HE21 GLN A 21 66.230 -5.925 10.003 1.00 0.00 H new ATOM 0 HE22 GLN A 21 67.389 -6.299 8.724 1.00 0.00 H new ATOM 305 N ASN A 22 64.772 -8.873 14.641 1.00 0.00 N ATOM 306 CA ASN A 22 64.337 -10.201 15.146 1.00 0.00 C ATOM 307 C ASN A 22 63.019 -10.592 14.472 1.00 0.00 C ATOM 308 O ASN A 22 62.818 -11.733 14.105 1.00 0.00 O ATOM 309 CB ASN A 22 64.142 -10.134 16.661 1.00 0.00 C ATOM 310 CG ASN A 22 64.846 -11.323 17.319 1.00 0.00 C ATOM 311 OD1 ASN A 22 64.669 -12.452 16.907 1.00 0.00 O ATOM 312 ND2 ASN A 22 65.642 -11.116 18.332 1.00 0.00 N ATOM 0 H ASN A 22 64.463 -8.075 15.196 1.00 0.00 H new ATOM 0 HA ASN A 22 65.098 -10.947 14.916 1.00 0.00 H new ATOM 0 HB2 ASN A 22 64.545 -9.199 17.049 1.00 0.00 H new ATOM 0 HB3 ASN A 22 63.079 -10.148 16.903 1.00 0.00 H new ATOM 0 HD21 ASN A 22 66.115 -11.902 18.778 1.00 0.00 H new ATOM 0 HD22 ASN A 22 65.791 -10.168 18.678 1.00 0.00 H new ATOM 319 N PHE A 23 62.120 -9.657 14.288 1.00 0.00 N ATOM 320 CA PHE A 23 60.832 -10.000 13.619 1.00 0.00 C ATOM 321 C PHE A 23 60.841 -9.390 12.222 1.00 0.00 C ATOM 322 O PHE A 23 60.171 -9.853 11.321 1.00 0.00 O ATOM 323 CB PHE A 23 59.631 -9.436 14.392 1.00 0.00 C ATOM 324 CG PHE A 23 60.046 -8.923 15.749 1.00 0.00 C ATOM 325 CD1 PHE A 23 60.826 -9.714 16.597 1.00 0.00 C ATOM 326 CD2 PHE A 23 59.637 -7.650 16.159 1.00 0.00 C ATOM 327 CE1 PHE A 23 61.201 -9.230 17.855 1.00 0.00 C ATOM 328 CE2 PHE A 23 60.008 -7.165 17.416 1.00 0.00 C ATOM 329 CZ PHE A 23 60.792 -7.955 18.266 1.00 0.00 C ATOM 0 H PHE A 23 62.222 -8.682 14.569 1.00 0.00 H new ATOM 0 HA PHE A 23 60.737 -11.085 13.580 1.00 0.00 H new ATOM 0 HB2 PHE A 23 59.174 -8.629 13.820 1.00 0.00 H new ATOM 0 HB3 PHE A 23 58.874 -10.212 14.510 1.00 0.00 H new ATOM 0 HD1 PHE A 23 61.139 -10.698 16.281 1.00 0.00 H new ATOM 0 HD2 PHE A 23 59.033 -7.041 15.503 1.00 0.00 H new ATOM 0 HE1 PHE A 23 61.806 -9.840 18.509 1.00 0.00 H new ATOM 0 HE2 PHE A 23 59.690 -6.182 17.732 1.00 0.00 H new ATOM 0 HZ PHE A 23 61.081 -7.582 19.237 1.00 0.00 H new ATOM 339 N ILE A 24 61.598 -8.346 12.043 1.00 0.00 N ATOM 340 CA ILE A 24 61.660 -7.690 10.715 1.00 0.00 C ATOM 341 C ILE A 24 62.288 -8.644 9.705 1.00 0.00 C ATOM 342 O ILE A 24 62.897 -9.637 10.050 1.00 0.00 O ATOM 343 CB ILE A 24 62.491 -6.399 10.826 1.00 0.00 C ATOM 344 CG1 ILE A 24 61.562 -5.193 10.754 1.00 0.00 C ATOM 345 CG2 ILE A 24 63.519 -6.285 9.690 1.00 0.00 C ATOM 346 CD1 ILE A 24 62.406 -3.939 10.899 1.00 0.00 C ATOM 0 H ILE A 24 62.178 -7.919 12.765 1.00 0.00 H new ATOM 0 HA ILE A 24 60.655 -7.436 10.378 1.00 0.00 H new ATOM 0 HB ILE A 24 63.023 -6.429 11.777 1.00 0.00 H new ATOM 0 HG12 ILE A 24 61.024 -5.183 9.806 1.00 0.00 H new ATOM 0 HG13 ILE A 24 60.813 -5.241 11.545 1.00 0.00 H new ATOM 0 HG21 ILE A 24 64.086 -5.361 9.803 1.00 0.00 H new ATOM 0 HG22 ILE A 24 64.200 -7.135 9.729 1.00 0.00 H new ATOM 0 HG23 ILE A 24 63.002 -6.278 8.731 1.00 0.00 H new ATOM 0 HD11 ILE A 24 61.763 -3.060 10.851 1.00 0.00 H new ATOM 0 HD12 ILE A 24 62.924 -3.958 11.858 1.00 0.00 H new ATOM 0 HD13 ILE A 24 63.138 -3.898 10.092 1.00 0.00 H new ATOM 358 N ALA A 25 62.149 -8.323 8.459 1.00 0.00 N ATOM 359 CA ALA A 25 62.736 -9.164 7.392 1.00 0.00 C ATOM 360 C ALA A 25 62.849 -8.313 6.134 1.00 0.00 C ATOM 361 O ALA A 25 63.892 -8.229 5.517 1.00 0.00 O ATOM 362 CB ALA A 25 61.830 -10.368 7.126 1.00 0.00 C ATOM 0 H ALA A 25 61.645 -7.500 8.128 1.00 0.00 H new ATOM 0 HA ALA A 25 63.718 -9.529 7.692 1.00 0.00 H new ATOM 0 HB1 ALA A 25 62.266 -10.985 6.340 1.00 0.00 H new ATOM 0 HB2 ALA A 25 61.732 -10.958 8.037 1.00 0.00 H new ATOM 0 HB3 ALA A 25 60.846 -10.020 6.811 1.00 0.00 H new ATOM 368 N ALA A 26 61.782 -7.661 5.758 1.00 0.00 N ATOM 369 CA ALA A 26 61.838 -6.797 4.547 1.00 0.00 C ATOM 370 C ALA A 26 61.875 -5.325 4.969 1.00 0.00 C ATOM 371 O ALA A 26 62.155 -4.999 6.105 1.00 0.00 O ATOM 372 CB ALA A 26 60.618 -7.062 3.662 1.00 0.00 C ATOM 0 H ALA A 26 60.880 -7.689 6.234 1.00 0.00 H new ATOM 0 HA ALA A 26 62.739 -7.028 3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 26 60.665 -6.427 2.778 1.00 0.00 H new ATOM 0 HB2 ALA A 26 60.610 -8.108 3.357 1.00 0.00 H new ATOM 0 HB3 ALA A 26 59.708 -6.840 4.220 1.00 0.00 H new ATOM 378 N TYR A 27 61.570 -4.438 4.063 1.00 0.00 N ATOM 379 CA TYR A 27 61.557 -2.986 4.401 1.00 0.00 C ATOM 380 C TYR A 27 61.276 -2.179 3.135 1.00 0.00 C ATOM 381 O TYR A 27 61.200 -2.719 2.050 1.00 0.00 O ATOM 382 CB TYR A 27 62.906 -2.549 4.969 1.00 0.00 C ATOM 383 CG TYR A 27 63.975 -2.730 3.917 1.00 0.00 C ATOM 384 CD1 TYR A 27 64.592 -3.977 3.751 1.00 0.00 C ATOM 385 CD2 TYR A 27 64.347 -1.652 3.105 1.00 0.00 C ATOM 386 CE1 TYR A 27 65.580 -4.144 2.774 1.00 0.00 C ATOM 387 CE2 TYR A 27 65.335 -1.820 2.127 1.00 0.00 C ATOM 388 CZ TYR A 27 65.952 -3.066 1.962 1.00 0.00 C ATOM 389 OH TYR A 27 66.925 -3.231 0.997 1.00 0.00 O ATOM 0 H TYR A 27 61.328 -4.657 3.097 1.00 0.00 H new ATOM 0 HA TYR A 27 60.783 -2.812 5.149 1.00 0.00 H new ATOM 0 HB2 TYR A 27 62.861 -1.506 5.282 1.00 0.00 H new ATOM 0 HB3 TYR A 27 63.148 -3.137 5.854 1.00 0.00 H new ATOM 0 HD1 TYR A 27 64.305 -4.809 4.377 1.00 0.00 H new ATOM 0 HD2 TYR A 27 63.872 -0.691 3.233 1.00 0.00 H new ATOM 0 HE1 TYR A 27 66.056 -5.105 2.646 1.00 0.00 H new ATOM 0 HE2 TYR A 27 65.621 -0.988 1.500 1.00 0.00 H new ATOM 0 HH TYR A 27 67.062 -2.385 0.522 1.00 0.00 H new ATOM 399 N PHE A 28 61.132 -0.890 3.265 1.00 0.00 N ATOM 400 CA PHE A 28 60.861 -0.042 2.070 1.00 0.00 C ATOM 401 C PHE A 28 61.066 1.421 2.447 1.00 0.00 C ATOM 402 O PHE A 28 60.798 1.818 3.556 1.00 0.00 O ATOM 403 CB PHE A 28 59.411 -0.236 1.621 1.00 0.00 C ATOM 404 CG PHE A 28 59.283 -1.528 0.851 1.00 0.00 C ATOM 405 CD1 PHE A 28 59.741 -1.605 -0.469 1.00 0.00 C ATOM 406 CD2 PHE A 28 58.705 -2.649 1.459 1.00 0.00 C ATOM 407 CE1 PHE A 28 59.622 -2.804 -1.182 1.00 0.00 C ATOM 408 CE2 PHE A 28 58.587 -3.848 0.747 1.00 0.00 C ATOM 409 CZ PHE A 28 59.045 -3.926 -0.573 1.00 0.00 C ATOM 0 H PHE A 28 61.190 -0.385 4.150 1.00 0.00 H new ATOM 0 HA PHE A 28 61.536 -0.324 1.262 1.00 0.00 H new ATOM 0 HB2 PHE A 28 58.751 -0.252 2.488 1.00 0.00 H new ATOM 0 HB3 PHE A 28 59.098 0.602 0.998 1.00 0.00 H new ATOM 0 HD1 PHE A 28 60.186 -0.740 -0.938 1.00 0.00 H new ATOM 0 HD2 PHE A 28 58.350 -2.588 2.477 1.00 0.00 H new ATOM 0 HE1 PHE A 28 59.975 -2.864 -2.201 1.00 0.00 H new ATOM 0 HE2 PHE A 28 58.142 -4.713 1.216 1.00 0.00 H new ATOM 0 HZ PHE A 28 58.954 -4.851 -1.122 1.00 0.00 H new ATOM 419 N GLU A 29 61.522 2.237 1.544 1.00 0.00 N ATOM 420 CA GLU A 29 61.705 3.671 1.898 1.00 0.00 C ATOM 421 C GLU A 29 60.530 4.461 1.342 1.00 0.00 C ATOM 422 O GLU A 29 60.691 5.408 0.599 1.00 0.00 O ATOM 423 CB GLU A 29 63.021 4.220 1.334 1.00 0.00 C ATOM 424 CG GLU A 29 63.648 3.216 0.364 1.00 0.00 C ATOM 425 CD GLU A 29 62.890 3.249 -0.965 1.00 0.00 C ATOM 426 OE1 GLU A 29 62.842 4.308 -1.570 1.00 0.00 O ATOM 427 OE2 GLU A 29 62.370 2.217 -1.353 1.00 0.00 O ATOM 0 H GLU A 29 61.773 1.981 0.589 1.00 0.00 H new ATOM 0 HA GLU A 29 61.747 3.767 2.983 1.00 0.00 H new ATOM 0 HB2 GLU A 29 62.838 5.164 0.821 1.00 0.00 H new ATOM 0 HB3 GLU A 29 63.714 4.429 2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 29 64.698 3.458 0.202 1.00 0.00 H new ATOM 0 HG3 GLU A 29 63.614 2.213 0.790 1.00 0.00 H new ATOM 434 N THR A 30 59.344 4.068 1.710 1.00 0.00 N ATOM 435 CA THR A 30 58.127 4.775 1.229 1.00 0.00 C ATOM 436 C THR A 30 58.067 4.740 -0.300 1.00 0.00 C ATOM 437 O THR A 30 58.375 3.740 -0.918 1.00 0.00 O ATOM 438 CB THR A 30 58.161 6.218 1.722 1.00 0.00 C ATOM 439 OG1 THR A 30 59.017 6.988 0.885 1.00 0.00 O ATOM 440 CG2 THR A 30 58.675 6.241 3.161 1.00 0.00 C ATOM 0 H THR A 30 59.164 3.278 2.330 1.00 0.00 H new ATOM 0 HA THR A 30 57.239 4.279 1.620 1.00 0.00 H new ATOM 0 HB THR A 30 57.159 6.645 1.689 1.00 0.00 H new ATOM 0 HG1 THR A 30 59.935 6.654 0.961 1.00 0.00 H new ATOM 0 HG21 THR A 30 58.702 7.269 3.521 1.00 0.00 H new ATOM 0 HG22 THR A 30 58.011 5.652 3.794 1.00 0.00 H new ATOM 0 HG23 THR A 30 59.679 5.818 3.196 1.00 0.00 H new ATOM 448 N SER A 31 57.655 5.816 -0.917 1.00 0.00 N ATOM 449 CA SER A 31 57.558 5.826 -2.401 1.00 0.00 C ATOM 450 C SER A 31 57.480 7.269 -2.900 1.00 0.00 C ATOM 451 O SER A 31 57.334 8.195 -2.126 1.00 0.00 O ATOM 452 CB SER A 31 56.289 5.086 -2.810 1.00 0.00 C ATOM 453 OG SER A 31 56.613 3.749 -3.166 1.00 0.00 O ATOM 0 H SER A 31 57.383 6.685 -0.457 1.00 0.00 H new ATOM 0 HA SER A 31 58.434 5.342 -2.833 1.00 0.00 H new ATOM 0 HB2 SER A 31 55.572 5.091 -1.989 1.00 0.00 H new ATOM 0 HB3 SER A 31 55.815 5.593 -3.651 1.00 0.00 H new ATOM 0 HG SER A 31 57.283 3.398 -2.543 1.00 0.00 H new ATOM 459 N SER A 32 57.560 7.469 -4.188 1.00 0.00 N ATOM 460 CA SER A 32 57.472 8.853 -4.728 1.00 0.00 C ATOM 461 C SER A 32 56.008 9.299 -4.697 1.00 0.00 C ATOM 462 O SER A 32 55.169 8.650 -4.104 1.00 0.00 O ATOM 463 CB SER A 32 57.988 8.881 -6.167 1.00 0.00 C ATOM 464 OG SER A 32 59.342 8.449 -6.190 1.00 0.00 O ATOM 0 H SER A 32 57.682 6.736 -4.886 1.00 0.00 H new ATOM 0 HA SER A 32 58.079 9.526 -4.123 1.00 0.00 H new ATOM 0 HB2 SER A 32 57.377 8.234 -6.797 1.00 0.00 H new ATOM 0 HB3 SER A 32 57.909 9.889 -6.574 1.00 0.00 H new ATOM 0 HG SER A 32 59.675 8.464 -7.112 1.00 0.00 H new ATOM 470 N GLN A 33 55.690 10.399 -5.321 1.00 0.00 N ATOM 471 CA GLN A 33 54.276 10.870 -5.309 1.00 0.00 C ATOM 472 C GLN A 33 53.804 10.990 -3.858 1.00 0.00 C ATOM 473 O GLN A 33 52.624 11.015 -3.573 1.00 0.00 O ATOM 474 CB GLN A 33 53.395 9.865 -6.054 1.00 0.00 C ATOM 475 CG GLN A 33 53.430 10.171 -7.552 1.00 0.00 C ATOM 476 CD GLN A 33 54.356 9.177 -8.255 1.00 0.00 C ATOM 477 OE1 GLN A 33 55.562 9.277 -8.155 1.00 0.00 O ATOM 478 NE2 GLN A 33 53.838 8.214 -8.968 1.00 0.00 N ATOM 0 H GLN A 33 56.343 10.989 -5.836 1.00 0.00 H new ATOM 0 HA GLN A 33 54.206 11.840 -5.801 1.00 0.00 H new ATOM 0 HB2 GLN A 33 53.747 8.850 -5.871 1.00 0.00 H new ATOM 0 HB3 GLN A 33 52.371 9.919 -5.685 1.00 0.00 H new ATOM 0 HG2 GLN A 33 52.426 10.107 -7.970 1.00 0.00 H new ATOM 0 HG3 GLN A 33 53.780 11.190 -7.718 1.00 0.00 H new ATOM 0 HE21 GLN A 33 52.825 8.130 -9.052 1.00 0.00 H new ATOM 0 HE22 GLN A 33 54.446 7.546 -9.441 1.00 0.00 H new ATOM 487 N CYS A 34 54.729 11.066 -2.942 1.00 0.00 N ATOM 488 CA CYS A 34 54.367 11.186 -1.503 1.00 0.00 C ATOM 489 C CYS A 34 55.656 11.198 -0.681 1.00 0.00 C ATOM 490 O CYS A 34 55.824 10.425 0.240 1.00 0.00 O ATOM 491 CB CYS A 34 53.487 10.002 -1.085 1.00 0.00 C ATOM 492 SG CYS A 34 54.460 8.474 -1.090 1.00 0.00 S ATOM 0 H CYS A 34 55.731 11.050 -3.132 1.00 0.00 H new ATOM 0 HA CYS A 34 53.809 12.107 -1.333 1.00 0.00 H new ATOM 0 HB2 CYS A 34 53.075 10.177 -0.091 1.00 0.00 H new ATOM 0 HB3 CYS A 34 52.642 9.907 -1.768 1.00 0.00 H new ATOM 497 N SER A 35 56.569 12.072 -1.027 1.00 0.00 N ATOM 498 CA SER A 35 57.870 12.158 -0.298 1.00 0.00 C ATOM 499 C SER A 35 57.668 11.854 1.186 1.00 0.00 C ATOM 500 O SER A 35 57.362 12.726 1.975 1.00 0.00 O ATOM 501 CB SER A 35 58.441 13.568 -0.452 1.00 0.00 C ATOM 502 OG SER A 35 59.853 13.523 -0.292 1.00 0.00 O ATOM 0 H SER A 35 56.465 12.737 -1.793 1.00 0.00 H new ATOM 0 HA SER A 35 58.561 11.427 -0.718 1.00 0.00 H new ATOM 0 HB2 SER A 35 58.187 13.970 -1.433 1.00 0.00 H new ATOM 0 HB3 SER A 35 58.000 14.234 0.290 1.00 0.00 H new ATOM 0 HG SER A 35 60.222 14.425 -0.392 1.00 0.00 H new ATOM 508 N LYS A 36 57.840 10.620 1.573 1.00 0.00 N ATOM 509 CA LYS A 36 57.664 10.259 3.004 1.00 0.00 C ATOM 510 C LYS A 36 59.041 10.021 3.632 1.00 0.00 C ATOM 511 O LYS A 36 59.923 9.479 2.996 1.00 0.00 O ATOM 512 CB LYS A 36 56.825 8.983 3.112 1.00 0.00 C ATOM 513 CG LYS A 36 55.333 9.323 3.040 1.00 0.00 C ATOM 514 CD LYS A 36 55.000 10.442 4.028 1.00 0.00 C ATOM 515 CE LYS A 36 54.764 11.744 3.259 1.00 0.00 C ATOM 516 NZ LYS A 36 54.912 12.902 4.185 1.00 0.00 N ATOM 0 H LYS A 36 58.095 9.847 0.958 1.00 0.00 H new ATOM 0 HA LYS A 36 57.155 11.068 3.527 1.00 0.00 H new ATOM 0 HB2 LYS A 36 57.088 8.297 2.307 1.00 0.00 H new ATOM 0 HB3 LYS A 36 57.044 8.473 4.050 1.00 0.00 H new ATOM 0 HG2 LYS A 36 55.071 9.631 2.028 1.00 0.00 H new ATOM 0 HG3 LYS A 36 54.739 8.438 3.268 1.00 0.00 H new ATOM 0 HD2 LYS A 36 54.113 10.181 4.605 1.00 0.00 H new ATOM 0 HD3 LYS A 36 55.816 10.569 4.739 1.00 0.00 H new ATOM 0 HE2 LYS A 36 55.476 11.828 2.438 1.00 0.00 H new ATOM 0 HE3 LYS A 36 53.767 11.743 2.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 54.573 13.766 3.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 54.353 12.732 5.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 55.914 13.017 4.440 1.00 0.00 H new ATOM 530 N PRO A 37 59.186 10.442 4.863 1.00 0.00 N ATOM 531 CA PRO A 37 60.449 10.300 5.608 1.00 0.00 C ATOM 532 C PRO A 37 60.595 8.882 6.167 1.00 0.00 C ATOM 533 O PRO A 37 61.472 8.136 5.781 1.00 0.00 O ATOM 534 CB PRO A 37 60.304 11.311 6.749 1.00 0.00 C ATOM 535 CG PRO A 37 58.785 11.548 6.933 1.00 0.00 C ATOM 536 CD PRO A 37 58.107 11.101 5.625 1.00 0.00 C ATOM 0 HA PRO A 37 61.328 10.474 4.988 1.00 0.00 H new ATOM 0 HB2 PRO A 37 60.751 10.928 7.666 1.00 0.00 H new ATOM 0 HB3 PRO A 37 60.816 12.243 6.510 1.00 0.00 H new ATOM 0 HG2 PRO A 37 58.404 10.978 7.781 1.00 0.00 H new ATOM 0 HG3 PRO A 37 58.579 12.599 7.136 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.281 10.416 5.819 1.00 0.00 H new ATOM 0 HD3 PRO A 37 57.696 11.950 5.079 1.00 0.00 H new ATOM 544 N GLY A 38 59.747 8.517 7.087 1.00 0.00 N ATOM 545 CA GLY A 38 59.836 7.160 7.696 1.00 0.00 C ATOM 546 C GLY A 38 59.916 6.081 6.613 1.00 0.00 C ATOM 547 O GLY A 38 59.838 6.358 5.434 1.00 0.00 O ATOM 0 H GLY A 38 58.993 9.103 7.445 1.00 0.00 H new ATOM 0 HA2 GLY A 38 60.714 7.102 8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 38 58.966 6.983 8.328 1.00 0.00 H new ATOM 551 N VAL A 39 60.072 4.847 7.018 1.00 0.00 N ATOM 552 CA VAL A 39 60.156 3.726 6.036 1.00 0.00 C ATOM 553 C VAL A 39 59.147 2.644 6.430 1.00 0.00 C ATOM 554 O VAL A 39 58.761 2.538 7.575 1.00 0.00 O ATOM 555 CB VAL A 39 61.566 3.132 6.060 1.00 0.00 C ATOM 556 CG1 VAL A 39 62.591 4.211 5.701 1.00 0.00 C ATOM 557 CG2 VAL A 39 61.853 2.586 7.457 1.00 0.00 C ATOM 0 H VAL A 39 60.145 4.566 7.996 1.00 0.00 H new ATOM 0 HA VAL A 39 59.934 4.096 5.035 1.00 0.00 H new ATOM 0 HB VAL A 39 61.636 2.325 5.331 1.00 0.00 H new ATOM 0 HG11 VAL A 39 63.593 3.782 5.720 1.00 0.00 H new ATOM 0 HG12 VAL A 39 62.380 4.596 4.703 1.00 0.00 H new ATOM 0 HG13 VAL A 39 62.531 5.025 6.424 1.00 0.00 H new ATOM 0 HG21 VAL A 39 62.856 2.161 7.482 1.00 0.00 H new ATOM 0 HG22 VAL A 39 61.783 3.394 8.185 1.00 0.00 H new ATOM 0 HG23 VAL A 39 61.125 1.813 7.702 1.00 0.00 H new ATOM 567 N ILE A 40 58.726 1.835 5.496 1.00 0.00 N ATOM 568 CA ILE A 40 57.750 0.756 5.818 1.00 0.00 C ATOM 569 C ILE A 40 58.528 -0.537 6.066 1.00 0.00 C ATOM 570 O ILE A 40 59.557 -0.769 5.464 1.00 0.00 O ATOM 571 CB ILE A 40 56.790 0.581 4.632 1.00 0.00 C ATOM 572 CG1 ILE A 40 55.690 1.642 4.710 1.00 0.00 C ATOM 573 CG2 ILE A 40 56.150 -0.810 4.667 1.00 0.00 C ATOM 574 CD1 ILE A 40 55.901 2.682 3.607 1.00 0.00 C ATOM 0 H ILE A 40 59.018 1.876 4.519 1.00 0.00 H new ATOM 0 HA ILE A 40 57.171 1.009 6.706 1.00 0.00 H new ATOM 0 HB ILE A 40 57.351 0.692 3.704 1.00 0.00 H new ATOM 0 HG12 ILE A 40 54.711 1.175 4.601 1.00 0.00 H new ATOM 0 HG13 ILE A 40 55.705 2.125 5.687 1.00 0.00 H new ATOM 0 HG21 ILE A 40 55.472 -0.920 3.821 1.00 0.00 H new ATOM 0 HG22 ILE A 40 56.929 -1.570 4.609 1.00 0.00 H new ATOM 0 HG23 ILE A 40 55.593 -0.931 5.596 1.00 0.00 H new ATOM 0 HD11 ILE A 40 55.117 3.437 3.664 1.00 0.00 H new ATOM 0 HD12 ILE A 40 56.873 3.158 3.737 1.00 0.00 H new ATOM 0 HD13 ILE A 40 55.864 2.193 2.634 1.00 0.00 H new ATOM 586 N PHE A 41 58.067 -1.378 6.951 1.00 0.00 N ATOM 587 CA PHE A 41 58.820 -2.627 7.215 1.00 0.00 C ATOM 588 C PHE A 41 57.979 -3.849 6.891 1.00 0.00 C ATOM 589 O PHE A 41 56.876 -3.758 6.390 1.00 0.00 O ATOM 590 CB PHE A 41 59.241 -2.670 8.676 1.00 0.00 C ATOM 591 CG PHE A 41 60.557 -1.950 8.808 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.726 -2.544 8.320 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.607 -0.684 9.396 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.949 -1.872 8.425 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.827 -0.010 9.499 1.00 0.00 C ATOM 596 CZ PHE A 41 63.000 -0.604 9.014 1.00 0.00 C ATOM 0 H PHE A 41 57.213 -1.254 7.494 1.00 0.00 H new ATOM 0 HA PHE A 41 59.703 -2.638 6.575 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.485 -2.198 9.303 1.00 0.00 H new ATOM 0 HB3 PHE A 41 59.337 -3.702 9.014 1.00 0.00 H new ATOM 0 HD1 PHE A 41 61.685 -3.521 7.862 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.703 -0.226 9.771 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.852 -2.332 8.052 1.00 0.00 H new ATOM 0 HE2 PHE A 41 61.866 0.969 9.953 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.943 -0.083 9.095 1.00 0.00 H new ATOM 606 N LEU A 42 58.521 -4.995 7.166 1.00 0.00 N ATOM 607 CA LEU A 42 57.805 -6.257 6.875 1.00 0.00 C ATOM 608 C LEU A 42 58.131 -7.283 7.953 1.00 0.00 C ATOM 609 O LEU A 42 58.838 -8.244 7.720 1.00 0.00 O ATOM 610 CB LEU A 42 58.270 -6.774 5.525 1.00 0.00 C ATOM 611 CG LEU A 42 57.172 -6.538 4.497 1.00 0.00 C ATOM 612 CD1 LEU A 42 57.764 -5.840 3.273 1.00 0.00 C ATOM 613 CD2 LEU A 42 56.572 -7.881 4.082 1.00 0.00 C ATOM 0 H LEU A 42 59.443 -5.112 7.586 1.00 0.00 H new ATOM 0 HA LEU A 42 56.729 -6.084 6.859 1.00 0.00 H new ATOM 0 HB2 LEU A 42 59.185 -6.265 5.222 1.00 0.00 H new ATOM 0 HB3 LEU A 42 58.503 -7.837 5.589 1.00 0.00 H new ATOM 0 HG LEU A 42 56.393 -5.910 4.929 1.00 0.00 H new ATOM 0 HD11 LEU A 42 56.979 -5.670 2.536 1.00 0.00 H new ATOM 0 HD12 LEU A 42 58.194 -4.884 3.572 1.00 0.00 H new ATOM 0 HD13 LEU A 42 58.542 -6.467 2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 42 55.785 -7.716 3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 42 57.350 -8.508 3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 42 56.152 -8.378 4.957 1.00 0.00 H new ATOM 625 N THR A 43 57.626 -7.078 9.132 1.00 0.00 N ATOM 626 CA THR A 43 57.899 -8.030 10.239 1.00 0.00 C ATOM 627 C THR A 43 57.498 -9.444 9.809 1.00 0.00 C ATOM 628 O THR A 43 57.318 -9.721 8.640 1.00 0.00 O ATOM 629 CB THR A 43 57.102 -7.607 11.477 1.00 0.00 C ATOM 630 OG1 THR A 43 55.735 -7.950 11.298 1.00 0.00 O ATOM 631 CG2 THR A 43 57.232 -6.093 11.677 1.00 0.00 C ATOM 0 H THR A 43 57.032 -6.287 9.379 1.00 0.00 H new ATOM 0 HA THR A 43 58.962 -8.023 10.479 1.00 0.00 H new ATOM 0 HB THR A 43 57.492 -8.121 12.355 1.00 0.00 H new ATOM 0 HG1 THR A 43 55.224 -7.682 12.090 1.00 0.00 H new ATOM 0 HG21 THR A 43 56.665 -5.792 12.558 1.00 0.00 H new ATOM 0 HG22 THR A 43 58.282 -5.833 11.815 1.00 0.00 H new ATOM 0 HG23 THR A 43 56.842 -5.575 10.800 1.00 0.00 H new ATOM 639 N LYS A 44 57.364 -10.344 10.742 1.00 0.00 N ATOM 640 CA LYS A 44 56.988 -11.739 10.379 1.00 0.00 C ATOM 641 C LYS A 44 55.469 -11.852 10.256 1.00 0.00 C ATOM 642 O LYS A 44 54.952 -12.783 9.672 1.00 0.00 O ATOM 643 CB LYS A 44 57.492 -12.695 11.460 1.00 0.00 C ATOM 644 CG LYS A 44 58.951 -12.365 11.787 1.00 0.00 C ATOM 645 CD LYS A 44 59.757 -12.245 10.489 1.00 0.00 C ATOM 646 CE LYS A 44 59.913 -13.631 9.861 1.00 0.00 C ATOM 647 NZ LYS A 44 60.192 -13.489 8.404 1.00 0.00 N ATOM 0 H LYS A 44 57.498 -10.175 11.739 1.00 0.00 H new ATOM 0 HA LYS A 44 57.441 -12.000 9.422 1.00 0.00 H new ATOM 0 HB2 LYS A 44 56.877 -12.606 12.356 1.00 0.00 H new ATOM 0 HB3 LYS A 44 57.408 -13.726 11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 44 59.006 -11.432 12.348 1.00 0.00 H new ATOM 0 HG3 LYS A 44 59.377 -13.143 12.420 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.252 -11.573 9.795 1.00 0.00 H new ATOM 0 HD3 LYS A 44 60.737 -11.814 10.694 1.00 0.00 H new ATOM 0 HE2 LYS A 44 60.725 -14.172 10.346 1.00 0.00 H new ATOM 0 HE3 LYS A 44 59.005 -14.215 10.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 59.581 -14.139 7.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 60.001 -12.511 8.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 61.189 -13.719 8.217 1.00 0.00 H new ATOM 661 N ARG A 45 54.750 -10.908 10.794 1.00 0.00 N ATOM 662 CA ARG A 45 53.266 -10.962 10.697 1.00 0.00 C ATOM 663 C ARG A 45 52.816 -10.181 9.463 1.00 0.00 C ATOM 664 O ARG A 45 51.709 -9.684 9.401 1.00 0.00 O ATOM 665 CB ARG A 45 52.649 -10.341 11.950 1.00 0.00 C ATOM 666 CG ARG A 45 52.832 -11.292 13.134 1.00 0.00 C ATOM 667 CD ARG A 45 51.656 -12.269 13.188 1.00 0.00 C ATOM 668 NE ARG A 45 51.985 -13.390 14.112 1.00 0.00 N ATOM 669 CZ ARG A 45 51.436 -13.443 15.295 1.00 0.00 C ATOM 670 NH1 ARG A 45 51.070 -12.343 15.896 1.00 0.00 N ATOM 671 NH2 ARG A 45 51.254 -14.596 15.877 1.00 0.00 N ATOM 0 H ARG A 45 55.125 -10.103 11.296 1.00 0.00 H new ATOM 0 HA ARG A 45 52.941 -11.999 10.613 1.00 0.00 H new ATOM 0 HB2 ARG A 45 53.121 -9.382 12.164 1.00 0.00 H new ATOM 0 HB3 ARG A 45 51.589 -10.145 11.788 1.00 0.00 H new ATOM 0 HG2 ARG A 45 53.769 -11.839 13.033 1.00 0.00 H new ATOM 0 HG3 ARG A 45 52.892 -10.726 14.063 1.00 0.00 H new ATOM 0 HD2 ARG A 45 50.757 -11.755 13.528 1.00 0.00 H new ATOM 0 HD3 ARG A 45 51.444 -12.655 12.191 1.00 0.00 H new ATOM 0 HE ARG A 45 52.639 -14.116 13.820 1.00 0.00 H new ATOM 0 HH11 ARG A 45 51.213 -11.441 15.441 1.00 0.00 H new ATOM 0 HH12 ARG A 45 50.641 -12.385 16.820 1.00 0.00 H new ATOM 0 HH21 ARG A 45 51.541 -15.455 15.408 1.00 0.00 H new ATOM 0 HH22 ARG A 45 50.825 -14.639 16.801 1.00 0.00 H new ATOM 685 N SER A 46 53.670 -10.064 8.480 1.00 0.00 N ATOM 686 CA SER A 46 53.293 -9.311 7.252 1.00 0.00 C ATOM 687 C SER A 46 52.585 -8.018 7.655 1.00 0.00 C ATOM 688 O SER A 46 51.724 -7.525 6.953 1.00 0.00 O ATOM 689 CB SER A 46 52.352 -10.162 6.398 1.00 0.00 C ATOM 690 OG SER A 46 53.113 -11.113 5.664 1.00 0.00 O ATOM 0 H SER A 46 54.611 -10.458 8.476 1.00 0.00 H new ATOM 0 HA SER A 46 54.189 -9.077 6.677 1.00 0.00 H new ATOM 0 HB2 SER A 46 51.627 -10.671 7.033 1.00 0.00 H new ATOM 0 HB3 SER A 46 51.787 -9.527 5.716 1.00 0.00 H new ATOM 0 HG SER A 46 52.512 -11.661 5.117 1.00 0.00 H new ATOM 696 N ARG A 47 52.937 -7.468 8.784 1.00 0.00 N ATOM 697 CA ARG A 47 52.277 -6.210 9.232 1.00 0.00 C ATOM 698 C ARG A 47 53.287 -5.062 9.214 1.00 0.00 C ATOM 699 O ARG A 47 54.039 -4.872 10.148 1.00 0.00 O ATOM 700 CB ARG A 47 51.745 -6.394 10.655 1.00 0.00 C ATOM 701 CG ARG A 47 50.216 -6.343 10.638 1.00 0.00 C ATOM 702 CD ARG A 47 49.725 -5.397 11.736 1.00 0.00 C ATOM 703 NE ARG A 47 49.933 -6.031 13.068 1.00 0.00 N ATOM 704 CZ ARG A 47 48.954 -6.671 13.646 1.00 0.00 C ATOM 705 NH1 ARG A 47 47.922 -7.054 12.944 1.00 0.00 N ATOM 706 NH2 ARG A 47 49.005 -6.928 14.924 1.00 0.00 N ATOM 0 H ARG A 47 53.651 -7.834 9.414 1.00 0.00 H new ATOM 0 HA ARG A 47 51.452 -5.977 8.559 1.00 0.00 H new ATOM 0 HB2 ARG A 47 52.083 -7.347 11.061 1.00 0.00 H new ATOM 0 HB3 ARG A 47 52.138 -5.613 11.306 1.00 0.00 H new ATOM 0 HG2 ARG A 47 49.864 -6.002 9.665 1.00 0.00 H new ATOM 0 HG3 ARG A 47 49.806 -7.341 10.793 1.00 0.00 H new ATOM 0 HD2 ARG A 47 50.264 -4.451 11.684 1.00 0.00 H new ATOM 0 HD3 ARG A 47 48.669 -5.171 11.590 1.00 0.00 H new ATOM 0 HE ARG A 47 50.841 -5.965 13.528 1.00 0.00 H new ATOM 0 HH11 ARG A 47 47.882 -6.853 11.945 1.00 0.00 H new ATOM 0 HH12 ARG A 47 47.156 -7.554 13.395 1.00 0.00 H new ATOM 0 HH21 ARG A 47 49.811 -6.628 15.473 1.00 0.00 H new ATOM 0 HH22 ARG A 47 48.239 -7.428 15.375 1.00 0.00 H new ATOM 720 N GLN A 48 53.305 -4.289 8.163 1.00 0.00 N ATOM 721 CA GLN A 48 54.263 -3.151 8.101 1.00 0.00 C ATOM 722 C GLN A 48 54.087 -2.289 9.352 1.00 0.00 C ATOM 723 O GLN A 48 53.007 -2.194 9.900 1.00 0.00 O ATOM 724 CB GLN A 48 53.978 -2.312 6.852 1.00 0.00 C ATOM 725 CG GLN A 48 52.688 -1.513 7.053 1.00 0.00 C ATOM 726 CD GLN A 48 53.024 -0.026 7.180 1.00 0.00 C ATOM 727 OE1 GLN A 48 53.274 0.638 6.193 1.00 0.00 O ATOM 728 NE2 GLN A 48 53.040 0.530 8.360 1.00 0.00 N ATOM 0 H GLN A 48 52.701 -4.396 7.348 1.00 0.00 H new ATOM 0 HA GLN A 48 55.285 -3.527 8.053 1.00 0.00 H new ATOM 0 HB2 GLN A 48 54.810 -1.635 6.659 1.00 0.00 H new ATOM 0 HB3 GLN A 48 53.884 -2.960 5.980 1.00 0.00 H new ATOM 0 HG2 GLN A 48 52.013 -1.674 6.212 1.00 0.00 H new ATOM 0 HG3 GLN A 48 52.170 -1.857 7.948 1.00 0.00 H new ATOM 0 HE21 GLN A 48 52.830 -0.026 9.189 1.00 0.00 H new ATOM 0 HE22 GLN A 48 53.262 1.521 8.454 1.00 0.00 H new ATOM 737 N VAL A 49 55.134 -1.666 9.822 1.00 0.00 N ATOM 738 CA VAL A 49 54.993 -0.829 11.049 1.00 0.00 C ATOM 739 C VAL A 49 55.551 0.578 10.812 1.00 0.00 C ATOM 740 O VAL A 49 55.587 1.394 11.711 1.00 0.00 O ATOM 741 CB VAL A 49 55.754 -1.485 12.198 1.00 0.00 C ATOM 742 CG1 VAL A 49 55.452 -0.740 13.499 1.00 0.00 C ATOM 743 CG2 VAL A 49 55.314 -2.944 12.335 1.00 0.00 C ATOM 0 H VAL A 49 56.069 -1.699 9.416 1.00 0.00 H new ATOM 0 HA VAL A 49 53.935 -0.749 11.297 1.00 0.00 H new ATOM 0 HB VAL A 49 56.824 -1.445 11.994 1.00 0.00 H new ATOM 0 HG11 VAL A 49 55.995 -1.208 14.320 1.00 0.00 H new ATOM 0 HG12 VAL A 49 55.764 0.300 13.403 1.00 0.00 H new ATOM 0 HG13 VAL A 49 54.382 -0.781 13.702 1.00 0.00 H new ATOM 0 HG21 VAL A 49 55.858 -3.412 13.156 1.00 0.00 H new ATOM 0 HG22 VAL A 49 54.244 -2.984 12.539 1.00 0.00 H new ATOM 0 HG23 VAL A 49 55.527 -3.477 11.408 1.00 0.00 H new ATOM 753 N CYS A 50 55.990 0.877 9.621 1.00 0.00 N ATOM 754 CA CYS A 50 56.540 2.233 9.361 1.00 0.00 C ATOM 755 C CYS A 50 57.717 2.475 10.305 1.00 0.00 C ATOM 756 O CYS A 50 57.998 1.671 11.172 1.00 0.00 O ATOM 757 CB CYS A 50 55.454 3.276 9.613 1.00 0.00 C ATOM 758 SG CYS A 50 54.719 3.789 8.039 1.00 0.00 S ATOM 0 H CYS A 50 55.991 0.244 8.821 1.00 0.00 H new ATOM 0 HA CYS A 50 56.876 2.309 8.327 1.00 0.00 H new ATOM 0 HB2 CYS A 50 54.685 2.863 10.266 1.00 0.00 H new ATOM 0 HB3 CYS A 50 55.878 4.140 10.125 1.00 0.00 H new ATOM 763 N ALA A 51 58.416 3.565 10.149 1.00 0.00 N ATOM 764 CA ALA A 51 59.575 3.822 11.052 1.00 0.00 C ATOM 765 C ALA A 51 60.053 5.266 10.921 1.00 0.00 C ATOM 766 O ALA A 51 60.108 5.818 9.844 1.00 0.00 O ATOM 767 CB ALA A 51 60.721 2.893 10.666 1.00 0.00 C ATOM 0 H ALA A 51 58.239 4.281 9.445 1.00 0.00 H new ATOM 0 HA ALA A 51 59.262 3.643 12.081 1.00 0.00 H new ATOM 0 HB1 ALA A 51 61.573 3.074 11.321 1.00 0.00 H new ATOM 0 HB2 ALA A 51 60.399 1.857 10.767 1.00 0.00 H new ATOM 0 HB3 ALA A 51 61.011 3.083 9.633 1.00 0.00 H new ATOM 773 N ASP A 52 60.418 5.874 12.015 1.00 0.00 N ATOM 774 CA ASP A 52 60.917 7.278 11.960 1.00 0.00 C ATOM 775 C ASP A 52 61.965 7.400 10.845 1.00 0.00 C ATOM 776 O ASP A 52 62.386 6.408 10.283 1.00 0.00 O ATOM 777 CB ASP A 52 61.560 7.641 13.301 1.00 0.00 C ATOM 778 CG ASP A 52 60.787 8.791 13.950 1.00 0.00 C ATOM 779 OD1 ASP A 52 59.703 9.092 13.479 1.00 0.00 O ATOM 780 OD2 ASP A 52 61.293 9.351 14.909 1.00 0.00 O ATOM 0 H ASP A 52 60.393 5.459 12.947 1.00 0.00 H new ATOM 0 HA ASP A 52 60.086 7.954 11.758 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.562 6.773 13.961 1.00 0.00 H new ATOM 0 HB3 ASP A 52 62.600 7.929 13.150 1.00 0.00 H new ATOM 785 N PRO A 53 62.354 8.617 10.560 1.00 0.00 N ATOM 786 CA PRO A 53 63.355 8.909 9.516 1.00 0.00 C ATOM 787 C PRO A 53 64.772 8.628 10.031 1.00 0.00 C ATOM 788 O PRO A 53 65.265 9.296 10.918 1.00 0.00 O ATOM 789 CB PRO A 53 63.164 10.405 9.246 1.00 0.00 C ATOM 790 CG PRO A 53 62.495 10.994 10.511 1.00 0.00 C ATOM 791 CD PRO A 53 61.832 9.815 11.250 1.00 0.00 C ATOM 0 HA PRO A 53 63.231 8.296 8.623 1.00 0.00 H new ATOM 0 HB2 PRO A 53 64.121 10.890 9.051 1.00 0.00 H new ATOM 0 HB3 PRO A 53 62.540 10.565 8.366 1.00 0.00 H new ATOM 0 HG2 PRO A 53 63.233 11.484 11.147 1.00 0.00 H new ATOM 0 HG3 PRO A 53 61.755 11.748 10.242 1.00 0.00 H new ATOM 0 HD2 PRO A 53 62.093 9.811 12.308 1.00 0.00 H new ATOM 0 HD3 PRO A 53 60.745 9.868 11.190 1.00 0.00 H new ATOM 799 N SER A 54 65.432 7.647 9.477 1.00 0.00 N ATOM 800 CA SER A 54 66.817 7.326 9.928 1.00 0.00 C ATOM 801 C SER A 54 66.781 6.739 11.342 1.00 0.00 C ATOM 802 O SER A 54 67.621 7.036 12.169 1.00 0.00 O ATOM 803 CB SER A 54 67.662 8.601 9.927 1.00 0.00 C ATOM 804 OG SER A 54 68.697 8.477 8.961 1.00 0.00 O ATOM 0 H SER A 54 65.071 7.053 8.730 1.00 0.00 H new ATOM 0 HA SER A 54 67.255 6.596 9.248 1.00 0.00 H new ATOM 0 HB2 SER A 54 67.038 9.465 9.699 1.00 0.00 H new ATOM 0 HB3 SER A 54 68.089 8.769 10.916 1.00 0.00 H new ATOM 0 HG SER A 54 69.240 9.293 8.956 1.00 0.00 H new ATOM 810 N GLU A 55 65.820 5.904 11.624 1.00 0.00 N ATOM 811 CA GLU A 55 65.733 5.293 12.982 1.00 0.00 C ATOM 812 C GLU A 55 66.963 4.457 13.256 1.00 0.00 C ATOM 813 O GLU A 55 67.387 3.651 12.461 1.00 0.00 O ATOM 814 CB GLU A 55 64.496 4.406 13.076 1.00 0.00 C ATOM 815 CG GLU A 55 63.280 5.266 13.418 1.00 0.00 C ATOM 816 CD GLU A 55 63.242 5.512 14.927 1.00 0.00 C ATOM 817 OE1 GLU A 55 64.293 5.767 15.493 1.00 0.00 O ATOM 818 OE2 GLU A 55 62.163 5.439 15.492 1.00 0.00 O ATOM 0 H GLU A 55 65.090 5.617 10.972 1.00 0.00 H new ATOM 0 HA GLU A 55 65.666 6.093 13.719 1.00 0.00 H new ATOM 0 HB2 GLU A 55 64.334 3.887 12.131 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.640 3.641 13.839 1.00 0.00 H new ATOM 0 HG2 GLU A 55 63.330 6.215 12.885 1.00 0.00 H new ATOM 0 HG3 GLU A 55 62.366 4.767 13.096 1.00 0.00 H new ATOM 825 N GLU A 56 67.517 4.649 14.403 1.00 0.00 N ATOM 826 CA GLU A 56 68.715 3.885 14.814 1.00 0.00 C ATOM 827 C GLU A 56 68.592 2.431 14.342 1.00 0.00 C ATOM 828 O GLU A 56 69.462 1.898 13.682 1.00 0.00 O ATOM 829 CB GLU A 56 68.761 3.943 16.329 1.00 0.00 C ATOM 830 CG GLU A 56 70.135 4.433 16.790 1.00 0.00 C ATOM 831 CD GLU A 56 70.344 4.062 18.259 1.00 0.00 C ATOM 832 OE1 GLU A 56 69.356 3.890 18.953 1.00 0.00 O ATOM 833 OE2 GLU A 56 71.490 3.956 18.665 1.00 0.00 O ATOM 0 H GLU A 56 67.184 5.321 15.095 1.00 0.00 H new ATOM 0 HA GLU A 56 69.623 4.300 14.378 1.00 0.00 H new ATOM 0 HB2 GLU A 56 67.984 4.611 16.700 1.00 0.00 H new ATOM 0 HB3 GLU A 56 68.559 2.956 16.746 1.00 0.00 H new ATOM 0 HG2 GLU A 56 70.917 3.986 16.176 1.00 0.00 H new ATOM 0 HG3 GLU A 56 70.209 5.513 16.663 1.00 0.00 H new ATOM 840 N TRP A 57 67.514 1.796 14.690 1.00 0.00 N ATOM 841 CA TRP A 57 67.292 0.379 14.293 1.00 0.00 C ATOM 842 C TRP A 57 67.085 0.251 12.779 1.00 0.00 C ATOM 843 O TRP A 57 67.486 -0.727 12.181 1.00 0.00 O ATOM 844 CB TRP A 57 66.066 -0.152 15.038 1.00 0.00 C ATOM 845 CG TRP A 57 64.893 0.781 14.909 1.00 0.00 C ATOM 846 CD1 TRP A 57 64.698 1.907 15.634 1.00 0.00 C ATOM 847 CD2 TRP A 57 63.731 0.658 14.046 1.00 0.00 C ATOM 848 NE1 TRP A 57 63.496 2.477 15.268 1.00 0.00 N ATOM 849 CE2 TRP A 57 62.860 1.743 14.294 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.358 -0.281 13.085 1.00 0.00 C ATOM 851 CZ2 TRP A 57 61.655 1.881 13.610 1.00 0.00 C ATOM 852 CZ3 TRP A 57 62.146 -0.151 12.392 1.00 0.00 C ATOM 853 CH2 TRP A 57 61.293 0.926 12.657 1.00 0.00 C ATOM 0 H TRP A 57 66.761 2.205 15.244 1.00 0.00 H new ATOM 0 HA TRP A 57 68.174 -0.205 14.555 1.00 0.00 H new ATOM 0 HB2 TRP A 57 65.797 -1.132 14.645 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.310 -0.287 16.092 1.00 0.00 H new ATOM 0 HD1 TRP A 57 65.375 2.297 16.380 1.00 0.00 H new ATOM 0 HE1 TRP A 57 63.124 3.337 15.670 1.00 0.00 H new ATOM 0 HE3 TRP A 57 64.009 -1.116 12.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 61.006 2.719 13.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 61.870 -0.886 11.650 1.00 0.00 H new ATOM 0 HH2 TRP A 57 60.357 1.019 12.126 1.00 0.00 H new ATOM 864 N VAL A 58 66.466 1.209 12.145 1.00 0.00 N ATOM 865 CA VAL A 58 66.257 1.085 10.672 1.00 0.00 C ATOM 866 C VAL A 58 67.592 1.221 9.936 1.00 0.00 C ATOM 867 O VAL A 58 68.015 0.314 9.262 1.00 0.00 O ATOM 868 CB VAL A 58 65.292 2.157 10.182 1.00 0.00 C ATOM 869 CG1 VAL A 58 65.139 2.027 8.663 1.00 0.00 C ATOM 870 CG2 VAL A 58 63.936 1.948 10.855 1.00 0.00 C ATOM 0 H VAL A 58 66.101 2.060 12.573 1.00 0.00 H new ATOM 0 HA VAL A 58 65.832 0.103 10.465 1.00 0.00 H new ATOM 0 HB VAL A 58 65.671 3.149 10.428 1.00 0.00 H new ATOM 0 HG11 VAL A 58 64.450 2.790 8.300 1.00 0.00 H new ATOM 0 HG12 VAL A 58 66.110 2.159 8.187 1.00 0.00 H new ATOM 0 HG13 VAL A 58 64.748 1.039 8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 58 63.238 2.711 10.511 1.00 0.00 H new ATOM 0 HG22 VAL A 58 63.551 0.961 10.599 1.00 0.00 H new ATOM 0 HG23 VAL A 58 64.051 2.023 11.936 1.00 0.00 H new ATOM 880 N GLN A 59 68.251 2.346 10.057 1.00 0.00 N ATOM 881 CA GLN A 59 69.566 2.542 9.366 1.00 0.00 C ATOM 882 C GLN A 59 70.311 1.208 9.283 1.00 0.00 C ATOM 883 O GLN A 59 70.966 0.908 8.305 1.00 0.00 O ATOM 884 CB GLN A 59 70.406 3.526 10.172 1.00 0.00 C ATOM 885 CG GLN A 59 69.853 4.941 9.995 1.00 0.00 C ATOM 886 CD GLN A 59 70.800 5.753 9.110 1.00 0.00 C ATOM 887 OE1 GLN A 59 71.919 6.030 9.492 1.00 0.00 O ATOM 888 NE2 GLN A 59 70.396 6.149 7.934 1.00 0.00 N ATOM 0 H GLN A 59 67.934 3.143 10.608 1.00 0.00 H new ATOM 0 HA GLN A 59 69.394 2.926 8.360 1.00 0.00 H new ATOM 0 HB2 GLN A 59 70.395 3.250 11.226 1.00 0.00 H new ATOM 0 HB3 GLN A 59 71.444 3.487 9.843 1.00 0.00 H new ATOM 0 HG2 GLN A 59 68.861 4.901 9.544 1.00 0.00 H new ATOM 0 HG3 GLN A 59 69.743 5.424 10.966 1.00 0.00 H new ATOM 0 HE21 GLN A 59 69.456 5.917 7.613 1.00 0.00 H new ATOM 0 HE22 GLN A 59 71.020 6.691 7.336 1.00 0.00 H new ATOM 897 N LYS A 60 70.191 0.401 10.300 1.00 0.00 N ATOM 898 CA LYS A 60 70.863 -0.927 10.291 1.00 0.00 C ATOM 899 C LYS A 60 70.104 -1.844 9.335 1.00 0.00 C ATOM 900 O LYS A 60 70.678 -2.473 8.468 1.00 0.00 O ATOM 901 CB LYS A 60 70.826 -1.525 11.709 1.00 0.00 C ATOM 902 CG LYS A 60 71.098 -3.042 11.674 1.00 0.00 C ATOM 903 CD LYS A 60 72.565 -3.306 12.026 1.00 0.00 C ATOM 904 CE LYS A 60 73.262 -3.974 10.838 1.00 0.00 C ATOM 905 NZ LYS A 60 74.686 -4.250 11.186 1.00 0.00 N ATOM 0 H LYS A 60 69.653 0.606 11.142 1.00 0.00 H new ATOM 0 HA LYS A 60 71.900 -0.824 9.970 1.00 0.00 H new ATOM 0 HB2 LYS A 60 71.570 -1.033 12.335 1.00 0.00 H new ATOM 0 HB3 LYS A 60 69.853 -1.336 12.162 1.00 0.00 H new ATOM 0 HG2 LYS A 60 70.445 -3.556 12.380 1.00 0.00 H new ATOM 0 HG3 LYS A 60 70.873 -3.440 10.684 1.00 0.00 H new ATOM 0 HD2 LYS A 60 73.065 -2.370 12.275 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.630 -3.946 12.906 1.00 0.00 H new ATOM 0 HE2 LYS A 60 72.753 -4.903 10.580 1.00 0.00 H new ATOM 0 HE3 LYS A 60 73.210 -3.328 9.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 75.159 -4.704 10.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 75.168 -3.356 11.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.726 -4.883 12.011 1.00 0.00 H new ATOM 919 N TYR A 61 68.819 -1.950 9.516 1.00 0.00 N ATOM 920 CA TYR A 61 68.017 -2.860 8.647 1.00 0.00 C ATOM 921 C TYR A 61 67.960 -2.295 7.220 1.00 0.00 C ATOM 922 O TYR A 61 68.440 -2.906 6.286 1.00 0.00 O ATOM 923 CB TYR A 61 66.605 -3.026 9.234 1.00 0.00 C ATOM 924 CG TYR A 61 66.665 -3.080 10.740 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.864 -3.363 11.406 1.00 0.00 C ATOM 926 CD2 TYR A 61 65.511 -2.820 11.472 1.00 0.00 C ATOM 927 CE1 TYR A 61 67.904 -3.378 12.795 1.00 0.00 C ATOM 928 CE2 TYR A 61 65.549 -2.846 12.863 1.00 0.00 C ATOM 929 CZ TYR A 61 66.746 -3.123 13.530 1.00 0.00 C ATOM 930 OH TYR A 61 66.787 -3.132 14.910 1.00 0.00 O ATOM 0 H TYR A 61 68.287 -1.447 10.227 1.00 0.00 H new ATOM 0 HA TYR A 61 68.488 -3.842 8.608 1.00 0.00 H new ATOM 0 HB2 TYR A 61 65.973 -2.196 8.918 1.00 0.00 H new ATOM 0 HB3 TYR A 61 66.149 -3.938 8.849 1.00 0.00 H new ATOM 0 HD1 TYR A 61 68.760 -3.570 10.839 1.00 0.00 H new ATOM 0 HD2 TYR A 61 64.586 -2.598 10.961 1.00 0.00 H new ATOM 0 HE1 TYR A 61 68.832 -3.587 13.306 1.00 0.00 H new ATOM 0 HE2 TYR A 61 64.650 -2.651 13.429 1.00 0.00 H new ATOM 0 HH TYR A 61 67.677 -2.856 15.213 1.00 0.00 H new ATOM 940 N VAL A 62 67.404 -1.127 7.046 1.00 0.00 N ATOM 941 CA VAL A 62 67.346 -0.513 5.689 1.00 0.00 C ATOM 942 C VAL A 62 68.775 -0.330 5.161 1.00 0.00 C ATOM 943 O VAL A 62 68.983 -0.060 3.995 1.00 0.00 O ATOM 944 CB VAL A 62 66.648 0.852 5.798 1.00 0.00 C ATOM 945 CG1 VAL A 62 67.045 1.751 4.623 1.00 0.00 C ATOM 946 CG2 VAL A 62 65.132 0.646 5.788 1.00 0.00 C ATOM 0 H VAL A 62 66.985 -0.569 7.790 1.00 0.00 H new ATOM 0 HA VAL A 62 66.791 -1.153 5.004 1.00 0.00 H new ATOM 0 HB VAL A 62 66.954 1.332 6.728 1.00 0.00 H new ATOM 0 HG11 VAL A 62 66.542 2.714 4.715 1.00 0.00 H new ATOM 0 HG12 VAL A 62 68.124 1.903 4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 62 66.751 1.277 3.687 1.00 0.00 H new ATOM 0 HG21 VAL A 62 64.633 1.612 5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 62 64.837 0.159 4.859 1.00 0.00 H new ATOM 0 HG23 VAL A 62 64.844 0.020 6.633 1.00 0.00 H new ATOM 956 N SER A 63 69.755 -0.461 6.020 1.00 0.00 N ATOM 957 CA SER A 63 71.174 -0.285 5.592 1.00 0.00 C ATOM 958 C SER A 63 71.387 -0.841 4.181 1.00 0.00 C ATOM 959 O SER A 63 72.014 -0.214 3.349 1.00 0.00 O ATOM 960 CB SER A 63 72.096 -1.022 6.564 1.00 0.00 C ATOM 961 OG SER A 63 73.408 -0.483 6.470 1.00 0.00 O ATOM 0 H SER A 63 69.630 -0.684 7.007 1.00 0.00 H new ATOM 0 HA SER A 63 71.405 0.780 5.591 1.00 0.00 H new ATOM 0 HB2 SER A 63 71.722 -0.923 7.583 1.00 0.00 H new ATOM 0 HB3 SER A 63 72.111 -2.087 6.332 1.00 0.00 H new ATOM 0 HG SER A 63 74.000 -0.953 7.094 1.00 0.00 H new ATOM 1107 N ASP B 5 47.608 -0.052 10.833 1.00 0.00 N ATOM 1108 CA ASP B 5 48.807 -0.553 10.106 1.00 0.00 C ATOM 1109 C ASP B 5 48.633 -0.305 8.606 1.00 0.00 C ATOM 1110 O ASP B 5 47.727 0.384 8.182 1.00 0.00 O ATOM 1111 CB ASP B 5 48.966 -2.053 10.359 1.00 0.00 C ATOM 1112 CG ASP B 5 47.672 -2.775 9.977 1.00 0.00 C ATOM 1113 OD1 ASP B 5 46.685 -2.585 10.668 1.00 0.00 O ATOM 1114 OD2 ASP B 5 47.691 -3.504 8.999 1.00 0.00 O ATOM 0 HA ASP B 5 49.694 -0.028 10.461 1.00 0.00 H new ATOM 0 HB2 ASP B 5 49.799 -2.445 9.776 1.00 0.00 H new ATOM 0 HB3 ASP B 5 49.199 -2.233 11.408 1.00 0.00 H new ATOM 1119 N THR B 6 49.494 -0.863 7.799 1.00 0.00 N ATOM 1120 CA THR B 6 49.377 -0.662 6.327 1.00 0.00 C ATOM 1121 C THR B 6 49.641 0.809 5.988 1.00 0.00 C ATOM 1122 O THR B 6 49.302 1.689 6.754 1.00 0.00 O ATOM 1123 CB THR B 6 47.968 -1.046 5.866 1.00 0.00 C ATOM 1124 OG1 THR B 6 47.283 -1.693 6.929 1.00 0.00 O ATOM 1125 CG2 THR B 6 48.062 -1.991 4.668 1.00 0.00 C ATOM 0 H THR B 6 50.274 -1.450 8.096 1.00 0.00 H new ATOM 0 HA THR B 6 50.109 -1.290 5.818 1.00 0.00 H new ATOM 0 HB THR B 6 47.423 -0.148 5.576 1.00 0.00 H new ATOM 0 HG1 THR B 6 46.772 -1.031 7.440 1.00 0.00 H new ATOM 0 HG21 THR B 6 47.059 -2.264 4.340 1.00 0.00 H new ATOM 0 HG22 THR B 6 48.587 -1.494 3.853 1.00 0.00 H new ATOM 0 HG23 THR B 6 48.607 -2.890 4.956 1.00 0.00 H new ATOM 1133 N PRO B 7 50.242 1.029 4.845 1.00 0.00 N ATOM 1134 CA PRO B 7 50.571 2.384 4.368 1.00 0.00 C ATOM 1135 C PRO B 7 49.326 3.066 3.789 1.00 0.00 C ATOM 1136 O PRO B 7 48.238 2.527 3.824 1.00 0.00 O ATOM 1137 CB PRO B 7 51.614 2.135 3.275 1.00 0.00 C ATOM 1138 CG PRO B 7 51.403 0.679 2.795 1.00 0.00 C ATOM 1139 CD PRO B 7 50.651 -0.052 3.923 1.00 0.00 C ATOM 0 HA PRO B 7 50.936 3.040 5.158 1.00 0.00 H new ATOM 0 HB2 PRO B 7 51.489 2.838 2.451 1.00 0.00 H new ATOM 0 HB3 PRO B 7 52.623 2.274 3.662 1.00 0.00 H new ATOM 0 HG2 PRO B 7 50.829 0.656 1.869 1.00 0.00 H new ATOM 0 HG3 PRO B 7 52.359 0.196 2.590 1.00 0.00 H new ATOM 0 HD2 PRO B 7 49.788 -0.596 3.539 1.00 0.00 H new ATOM 0 HD3 PRO B 7 51.291 -0.780 4.422 1.00 0.00 H new ATOM 1147 N THR B 8 49.480 4.247 3.254 1.00 0.00 N ATOM 1148 CA THR B 8 48.309 4.962 2.671 1.00 0.00 C ATOM 1149 C THR B 8 48.130 4.537 1.213 1.00 0.00 C ATOM 1150 O THR B 8 48.754 5.073 0.318 1.00 0.00 O ATOM 1151 CB THR B 8 48.550 6.473 2.740 1.00 0.00 C ATOM 1152 OG1 THR B 8 48.837 6.841 4.081 1.00 0.00 O ATOM 1153 CG2 THR B 8 47.301 7.215 2.263 1.00 0.00 C ATOM 0 H THR B 8 50.367 4.748 3.196 1.00 0.00 H new ATOM 0 HA THR B 8 47.410 4.713 3.234 1.00 0.00 H new ATOM 0 HB THR B 8 49.392 6.737 2.100 1.00 0.00 H new ATOM 0 HG1 THR B 8 49.248 7.731 4.095 1.00 0.00 H new ATOM 0 HG21 THR B 8 47.475 8.290 2.313 1.00 0.00 H new ATOM 0 HG22 THR B 8 47.080 6.931 1.234 1.00 0.00 H new ATOM 0 HG23 THR B 8 46.457 6.954 2.901 1.00 0.00 H new ATOM 1161 N ALA B 9 47.284 3.575 0.966 1.00 0.00 N ATOM 1162 CA ALA B 9 47.068 3.112 -0.434 1.00 0.00 C ATOM 1163 C ALA B 9 46.370 4.212 -1.237 1.00 0.00 C ATOM 1164 O ALA B 9 45.332 4.712 -0.853 1.00 0.00 O ATOM 1165 CB ALA B 9 46.196 1.855 -0.426 1.00 0.00 C ATOM 0 H ALA B 9 46.733 3.089 1.673 1.00 0.00 H new ATOM 0 HA ALA B 9 48.030 2.885 -0.893 1.00 0.00 H new ATOM 0 HB1 ALA B 9 46.037 1.516 -1.450 1.00 0.00 H new ATOM 0 HB2 ALA B 9 46.694 1.070 0.143 1.00 0.00 H new ATOM 0 HB3 ALA B 9 45.234 2.082 0.034 1.00 0.00 H new ATOM 1171 N CYS B 10 46.933 4.591 -2.352 1.00 0.00 N ATOM 1172 CA CYS B 10 46.303 5.657 -3.182 1.00 0.00 C ATOM 1173 C CYS B 10 46.483 5.314 -4.665 1.00 0.00 C ATOM 1174 O CYS B 10 47.546 4.910 -5.093 1.00 0.00 O ATOM 1175 CB CYS B 10 46.968 7.001 -2.871 1.00 0.00 C ATOM 1176 SG CYS B 10 47.105 7.201 -1.075 1.00 0.00 S ATOM 0 H CYS B 10 47.802 4.208 -2.724 1.00 0.00 H new ATOM 0 HA CYS B 10 45.239 5.724 -2.955 1.00 0.00 H new ATOM 0 HB2 CYS B 10 47.956 7.046 -3.330 1.00 0.00 H new ATOM 0 HB3 CYS B 10 46.382 7.816 -3.296 1.00 0.00 H new ATOM 1181 N CYS B 11 45.448 5.461 -5.452 1.00 0.00 N ATOM 1182 CA CYS B 11 45.558 5.131 -6.902 1.00 0.00 C ATOM 1183 C CYS B 11 46.269 6.265 -7.643 1.00 0.00 C ATOM 1184 O CYS B 11 45.691 7.297 -7.918 1.00 0.00 O ATOM 1185 CB CYS B 11 44.156 4.946 -7.490 1.00 0.00 C ATOM 1186 SG CYS B 11 43.788 3.181 -7.647 1.00 0.00 S ATOM 0 H CYS B 11 44.532 5.795 -5.152 1.00 0.00 H new ATOM 0 HA CYS B 11 46.131 4.211 -7.016 1.00 0.00 H new ATOM 0 HB2 CYS B 11 43.416 5.426 -6.849 1.00 0.00 H new ATOM 0 HB3 CYS B 11 44.094 5.428 -8.465 1.00 0.00 H new ATOM 1191 N PHE B 12 47.516 6.078 -7.979 1.00 0.00 N ATOM 1192 CA PHE B 12 48.255 7.142 -8.714 1.00 0.00 C ATOM 1193 C PHE B 12 48.263 6.810 -10.209 1.00 0.00 C ATOM 1194 O PHE B 12 48.647 7.615 -11.033 1.00 0.00 O ATOM 1195 CB PHE B 12 49.695 7.218 -8.202 1.00 0.00 C ATOM 1196 CG PHE B 12 49.783 8.237 -7.092 1.00 0.00 C ATOM 1197 CD1 PHE B 12 50.006 9.585 -7.396 1.00 0.00 C ATOM 1198 CD2 PHE B 12 49.644 7.834 -5.758 1.00 0.00 C ATOM 1199 CE1 PHE B 12 50.089 10.531 -6.368 1.00 0.00 C ATOM 1200 CE2 PHE B 12 49.728 8.780 -4.729 1.00 0.00 C ATOM 1201 CZ PHE B 12 49.950 10.128 -5.034 1.00 0.00 C ATOM 0 H PHE B 12 48.054 5.235 -7.776 1.00 0.00 H new ATOM 0 HA PHE B 12 47.765 8.102 -8.553 1.00 0.00 H new ATOM 0 HB2 PHE B 12 50.015 6.241 -7.839 1.00 0.00 H new ATOM 0 HB3 PHE B 12 50.367 7.492 -9.015 1.00 0.00 H new ATOM 0 HD1 PHE B 12 50.114 9.895 -8.425 1.00 0.00 H new ATOM 0 HD2 PHE B 12 49.472 6.794 -5.523 1.00 0.00 H new ATOM 0 HE1 PHE B 12 50.260 11.571 -6.603 1.00 0.00 H new ATOM 0 HE2 PHE B 12 49.622 8.470 -3.700 1.00 0.00 H new ATOM 0 HZ PHE B 12 50.014 10.858 -4.240 1.00 0.00 H new ATOM 1211 N SER B 13 47.837 5.628 -10.561 1.00 0.00 N ATOM 1212 CA SER B 13 47.812 5.232 -11.996 1.00 0.00 C ATOM 1213 C SER B 13 46.988 3.952 -12.139 1.00 0.00 C ATOM 1214 O SER B 13 47.253 2.960 -11.490 1.00 0.00 O ATOM 1215 CB SER B 13 49.239 4.980 -12.483 1.00 0.00 C ATOM 1216 OG SER B 13 49.793 6.197 -12.965 1.00 0.00 O ATOM 0 H SER B 13 47.503 4.916 -9.912 1.00 0.00 H new ATOM 0 HA SER B 13 47.367 6.028 -12.593 1.00 0.00 H new ATOM 0 HB2 SER B 13 49.849 4.586 -11.670 1.00 0.00 H new ATOM 0 HB3 SER B 13 49.239 4.229 -13.273 1.00 0.00 H new ATOM 0 HG SER B 13 49.360 6.954 -12.517 1.00 0.00 H new ATOM 1222 N TYR B 14 45.982 3.963 -12.971 1.00 0.00 N ATOM 1223 CA TYR B 14 45.146 2.738 -13.128 1.00 0.00 C ATOM 1224 C TYR B 14 45.491 2.038 -14.443 1.00 0.00 C ATOM 1225 O TYR B 14 46.422 2.412 -15.129 1.00 0.00 O ATOM 1226 CB TYR B 14 43.653 3.093 -13.097 1.00 0.00 C ATOM 1227 CG TYR B 14 43.471 4.542 -12.698 1.00 0.00 C ATOM 1228 CD1 TYR B 14 43.836 4.965 -11.414 1.00 0.00 C ATOM 1229 CD2 TYR B 14 42.947 5.460 -13.615 1.00 0.00 C ATOM 1230 CE1 TYR B 14 43.675 6.304 -11.045 1.00 0.00 C ATOM 1231 CE2 TYR B 14 42.786 6.801 -13.247 1.00 0.00 C ATOM 1232 CZ TYR B 14 43.150 7.223 -11.962 1.00 0.00 C ATOM 1233 OH TYR B 14 42.992 8.545 -11.599 1.00 0.00 O ATOM 0 H TYR B 14 45.704 4.760 -13.544 1.00 0.00 H new ATOM 0 HA TYR B 14 45.357 2.065 -12.297 1.00 0.00 H new ATOM 0 HB2 TYR B 14 43.209 2.919 -14.077 1.00 0.00 H new ATOM 0 HB3 TYR B 14 43.132 2.445 -12.392 1.00 0.00 H new ATOM 0 HD1 TYR B 14 44.242 4.256 -10.708 1.00 0.00 H new ATOM 0 HD2 TYR B 14 42.667 5.134 -14.606 1.00 0.00 H new ATOM 0 HE1 TYR B 14 43.955 6.629 -10.054 1.00 0.00 H new ATOM 0 HE2 TYR B 14 42.381 7.510 -13.954 1.00 0.00 H new ATOM 0 HH TYR B 14 42.617 9.048 -12.352 1.00 0.00 H new ATOM 1243 N THR B 15 44.764 1.009 -14.792 1.00 0.00 N ATOM 1244 CA THR B 15 45.078 0.276 -16.055 1.00 0.00 C ATOM 1245 C THR B 15 44.112 0.679 -17.169 1.00 0.00 C ATOM 1246 O THR B 15 43.097 1.303 -16.934 1.00 0.00 O ATOM 1247 CB THR B 15 44.959 -1.231 -15.813 1.00 0.00 C ATOM 1248 OG1 THR B 15 45.497 -1.931 -16.927 1.00 0.00 O ATOM 1249 CG2 THR B 15 43.486 -1.606 -15.637 1.00 0.00 C ATOM 0 H THR B 15 43.972 0.646 -14.262 1.00 0.00 H new ATOM 0 HA THR B 15 46.094 0.530 -16.358 1.00 0.00 H new ATOM 0 HB THR B 15 45.511 -1.500 -14.912 1.00 0.00 H new ATOM 0 HG1 THR B 15 45.423 -2.896 -16.773 1.00 0.00 H new ATOM 0 HG21 THR B 15 43.402 -2.679 -15.465 1.00 0.00 H new ATOM 0 HG22 THR B 15 43.073 -1.068 -14.784 1.00 0.00 H new ATOM 0 HG23 THR B 15 42.932 -1.338 -16.537 1.00 0.00 H new ATOM 1257 N SER B 16 44.416 0.299 -18.382 1.00 0.00 N ATOM 1258 CA SER B 16 43.512 0.627 -19.518 1.00 0.00 C ATOM 1259 C SER B 16 42.408 -0.428 -19.564 1.00 0.00 C ATOM 1260 O SER B 16 41.234 -0.117 -19.530 1.00 0.00 O ATOM 1261 CB SER B 16 44.301 0.603 -20.828 1.00 0.00 C ATOM 1262 OG SER B 16 44.301 1.904 -21.402 1.00 0.00 O ATOM 0 H SER B 16 45.254 -0.226 -18.633 1.00 0.00 H new ATOM 0 HA SER B 16 43.083 1.620 -19.386 1.00 0.00 H new ATOM 0 HB2 SER B 16 45.324 0.275 -20.644 1.00 0.00 H new ATOM 0 HB3 SER B 16 43.857 -0.112 -21.520 1.00 0.00 H new ATOM 0 HG SER B 16 44.808 1.891 -22.241 1.00 0.00 H new ATOM 1268 N ARG B 17 42.780 -1.680 -19.614 1.00 0.00 N ATOM 1269 CA ARG B 17 41.756 -2.760 -19.630 1.00 0.00 C ATOM 1270 C ARG B 17 41.238 -2.941 -18.204 1.00 0.00 C ATOM 1271 O ARG B 17 42.002 -3.105 -17.274 1.00 0.00 O ATOM 1272 CB ARG B 17 42.386 -4.067 -20.121 1.00 0.00 C ATOM 1273 CG ARG B 17 41.816 -4.422 -21.497 1.00 0.00 C ATOM 1274 CD ARG B 17 42.926 -4.992 -22.380 1.00 0.00 C ATOM 1275 NE ARG B 17 43.555 -6.158 -21.698 1.00 0.00 N ATOM 1276 CZ ARG B 17 44.579 -6.758 -22.241 1.00 0.00 C ATOM 1277 NH1 ARG B 17 45.695 -6.107 -22.422 1.00 0.00 N ATOM 1278 NH2 ARG B 17 44.486 -8.007 -22.604 1.00 0.00 N ATOM 0 H ARG B 17 43.748 -1.999 -19.644 1.00 0.00 H new ATOM 0 HA ARG B 17 40.938 -2.495 -20.301 1.00 0.00 H new ATOM 0 HB2 ARG B 17 43.469 -3.961 -20.180 1.00 0.00 H new ATOM 0 HB3 ARG B 17 42.182 -4.870 -19.413 1.00 0.00 H new ATOM 0 HG2 ARG B 17 41.011 -5.150 -21.392 1.00 0.00 H new ATOM 0 HG3 ARG B 17 41.385 -3.536 -21.963 1.00 0.00 H new ATOM 0 HD2 ARG B 17 42.518 -5.298 -23.343 1.00 0.00 H new ATOM 0 HD3 ARG B 17 43.676 -4.226 -22.580 1.00 0.00 H new ATOM 0 HE ARG B 17 43.185 -6.487 -20.806 1.00 0.00 H new ATOM 0 HH11 ARG B 17 45.767 -5.130 -22.139 1.00 0.00 H new ATOM 0 HH12 ARG B 17 46.496 -6.575 -22.846 1.00 0.00 H new ATOM 0 HH21 ARG B 17 43.613 -8.515 -22.464 1.00 0.00 H new ATOM 0 HH22 ARG B 17 45.286 -8.476 -23.028 1.00 0.00 H new ATOM 1292 N GLN B 18 39.951 -2.882 -18.013 1.00 0.00 N ATOM 1293 CA GLN B 18 39.401 -3.017 -16.639 1.00 0.00 C ATOM 1294 C GLN B 18 39.506 -4.441 -16.123 1.00 0.00 C ATOM 1295 O GLN B 18 40.105 -5.314 -16.720 1.00 0.00 O ATOM 1296 CB GLN B 18 37.939 -2.629 -16.619 1.00 0.00 C ATOM 1297 CG GLN B 18 37.630 -1.573 -17.684 1.00 0.00 C ATOM 1298 CD GLN B 18 38.750 -0.528 -17.742 1.00 0.00 C ATOM 1299 OE1 GLN B 18 39.011 0.039 -18.783 1.00 0.00 O ATOM 1300 NE2 GLN B 18 39.425 -0.248 -16.663 1.00 0.00 N ATOM 0 H GLN B 18 39.257 -2.746 -18.749 1.00 0.00 H new ATOM 0 HA GLN B 18 39.990 -2.358 -16.001 1.00 0.00 H new ATOM 0 HB2 GLN B 18 37.324 -3.512 -16.790 1.00 0.00 H new ATOM 0 HB3 GLN B 18 37.676 -2.243 -15.634 1.00 0.00 H new ATOM 0 HG2 GLN B 18 37.519 -2.051 -18.657 1.00 0.00 H new ATOM 0 HG3 GLN B 18 36.681 -1.086 -17.458 1.00 0.00 H new ATOM 0 HE21 GLN B 18 39.207 -0.723 -15.787 1.00 0.00 H new ATOM 0 HE22 GLN B 18 40.171 0.447 -16.694 1.00 0.00 H new ATOM 1309 N ILE B 19 38.884 -4.655 -15.005 1.00 0.00 N ATOM 1310 CA ILE B 19 38.849 -5.971 -14.362 1.00 0.00 C ATOM 1311 C ILE B 19 37.426 -6.150 -13.855 1.00 0.00 C ATOM 1312 O ILE B 19 37.071 -5.642 -12.810 1.00 0.00 O ATOM 1313 CB ILE B 19 39.808 -6.007 -13.186 1.00 0.00 C ATOM 1314 CG1 ILE B 19 39.826 -4.640 -12.491 1.00 0.00 C ATOM 1315 CG2 ILE B 19 41.210 -6.360 -13.677 1.00 0.00 C ATOM 1316 CD1 ILE B 19 40.657 -3.649 -13.310 1.00 0.00 C ATOM 0 H ILE B 19 38.378 -3.931 -14.495 1.00 0.00 H new ATOM 0 HA ILE B 19 39.140 -6.758 -15.058 1.00 0.00 H new ATOM 0 HB ILE B 19 39.478 -6.764 -12.474 1.00 0.00 H new ATOM 0 HG12 ILE B 19 38.808 -4.267 -12.377 1.00 0.00 H new ATOM 0 HG13 ILE B 19 40.244 -4.737 -11.489 1.00 0.00 H new ATOM 0 HG21 ILE B 19 41.896 -6.385 -12.831 1.00 0.00 H new ATOM 0 HG22 ILE B 19 41.191 -7.338 -14.158 1.00 0.00 H new ATOM 0 HG23 ILE B 19 41.544 -5.609 -14.393 1.00 0.00 H new ATOM 0 HD11 ILE B 19 40.665 -2.680 -12.810 1.00 0.00 H new ATOM 0 HD12 ILE B 19 41.678 -4.019 -13.401 1.00 0.00 H new ATOM 0 HD13 ILE B 19 40.220 -3.541 -14.303 1.00 0.00 H new ATOM 1328 N PRO B 20 36.648 -6.836 -14.627 1.00 0.00 N ATOM 1329 CA PRO B 20 35.236 -7.073 -14.312 1.00 0.00 C ATOM 1330 C PRO B 20 35.085 -7.911 -13.052 1.00 0.00 C ATOM 1331 O PRO B 20 36.047 -8.252 -12.394 1.00 0.00 O ATOM 1332 CB PRO B 20 34.709 -7.786 -15.559 1.00 0.00 C ATOM 1333 CG PRO B 20 35.951 -8.365 -16.267 1.00 0.00 C ATOM 1334 CD PRO B 20 37.113 -7.472 -15.870 1.00 0.00 C ATOM 0 HA PRO B 20 34.681 -6.160 -14.097 1.00 0.00 H new ATOM 0 HB2 PRO B 20 34.008 -8.576 -15.291 1.00 0.00 H new ATOM 0 HB3 PRO B 20 34.175 -7.093 -16.210 1.00 0.00 H new ATOM 0 HG2 PRO B 20 36.129 -9.396 -15.961 1.00 0.00 H new ATOM 0 HG3 PRO B 20 35.816 -8.372 -17.349 1.00 0.00 H new ATOM 0 HD2 PRO B 20 38.025 -8.047 -15.710 1.00 0.00 H new ATOM 0 HD3 PRO B 20 37.333 -6.733 -16.641 1.00 0.00 H new ATOM 1342 N GLN B 21 33.874 -8.221 -12.704 1.00 0.00 N ATOM 1343 CA GLN B 21 33.623 -9.015 -11.471 1.00 0.00 C ATOM 1344 C GLN B 21 33.983 -10.491 -11.689 1.00 0.00 C ATOM 1345 O GLN B 21 33.622 -11.344 -10.901 1.00 0.00 O ATOM 1346 CB GLN B 21 32.142 -8.898 -11.114 1.00 0.00 C ATOM 1347 CG GLN B 21 31.822 -7.444 -10.750 1.00 0.00 C ATOM 1348 CD GLN B 21 31.498 -7.355 -9.258 1.00 0.00 C ATOM 1349 OE1 GLN B 21 30.362 -7.515 -8.859 1.00 0.00 O ATOM 1350 NE2 GLN B 21 32.458 -7.105 -8.409 1.00 0.00 N ATOM 0 H GLN B 21 33.037 -7.957 -13.224 1.00 0.00 H new ATOM 0 HA GLN B 21 34.244 -8.629 -10.662 1.00 0.00 H new ATOM 0 HB2 GLN B 21 31.527 -9.218 -11.955 1.00 0.00 H new ATOM 0 HB3 GLN B 21 31.905 -9.555 -10.277 1.00 0.00 H new ATOM 0 HG2 GLN B 21 32.670 -6.802 -10.988 1.00 0.00 H new ATOM 0 HG3 GLN B 21 30.977 -7.087 -11.339 1.00 0.00 H new ATOM 0 HE21 GLN B 21 33.412 -6.971 -8.743 1.00 0.00 H new ATOM 0 HE22 GLN B 21 32.254 -7.044 -7.412 1.00 0.00 H new ATOM 1359 N ASN B 22 34.692 -10.806 -12.739 1.00 0.00 N ATOM 1360 CA ASN B 22 35.067 -12.224 -12.983 1.00 0.00 C ATOM 1361 C ASN B 22 36.376 -12.535 -12.253 1.00 0.00 C ATOM 1362 O ASN B 22 36.533 -13.592 -11.676 1.00 0.00 O ATOM 1363 CB ASN B 22 35.246 -12.456 -14.484 1.00 0.00 C ATOM 1364 CG ASN B 22 34.486 -13.716 -14.901 1.00 0.00 C ATOM 1365 OD1 ASN B 22 34.622 -14.753 -14.281 1.00 0.00 O ATOM 1366 ND2 ASN B 22 33.687 -13.672 -15.931 1.00 0.00 N ATOM 0 H ASN B 22 35.027 -10.142 -13.437 1.00 0.00 H new ATOM 0 HA ASN B 22 34.279 -12.879 -12.611 1.00 0.00 H new ATOM 0 HB2 ASN B 22 34.878 -11.595 -15.042 1.00 0.00 H new ATOM 0 HB3 ASN B 22 36.304 -12.561 -14.723 1.00 0.00 H new ATOM 0 HD21 ASN B 22 33.176 -14.508 -16.216 1.00 0.00 H new ATOM 0 HD22 ASN B 22 33.573 -12.802 -16.451 1.00 0.00 H new ATOM 1373 N PHE B 23 37.314 -11.621 -12.254 1.00 0.00 N ATOM 1374 CA PHE B 23 38.594 -11.885 -11.536 1.00 0.00 C ATOM 1375 C PHE B 23 38.627 -11.020 -10.282 1.00 0.00 C ATOM 1376 O PHE B 23 39.289 -11.330 -9.312 1.00 0.00 O ATOM 1377 CB PHE B 23 39.808 -11.531 -12.408 1.00 0.00 C ATOM 1378 CG PHE B 23 39.399 -11.268 -13.836 1.00 0.00 C ATOM 1379 CD1 PHE B 23 38.577 -12.173 -14.515 1.00 0.00 C ATOM 1380 CD2 PHE B 23 39.855 -10.115 -14.483 1.00 0.00 C ATOM 1381 CE1 PHE B 23 38.207 -11.922 -15.841 1.00 0.00 C ATOM 1382 CE2 PHE B 23 39.489 -9.863 -15.808 1.00 0.00 C ATOM 1383 CZ PHE B 23 38.663 -10.766 -16.488 1.00 0.00 C ATOM 0 H PHE B 23 37.249 -10.714 -12.716 1.00 0.00 H new ATOM 0 HA PHE B 23 38.644 -12.946 -11.290 1.00 0.00 H new ATOM 0 HB2 PHE B 23 40.306 -10.650 -12.002 1.00 0.00 H new ATOM 0 HB3 PHE B 23 40.530 -12.347 -12.379 1.00 0.00 H new ATOM 0 HD1 PHE B 23 38.228 -13.065 -14.016 1.00 0.00 H new ATOM 0 HD2 PHE B 23 40.491 -9.418 -13.958 1.00 0.00 H new ATOM 0 HE1 PHE B 23 37.570 -12.619 -16.365 1.00 0.00 H new ATOM 0 HE2 PHE B 23 39.843 -8.973 -16.307 1.00 0.00 H new ATOM 0 HZ PHE B 23 38.377 -10.571 -17.511 1.00 0.00 H new ATOM 1393 N ILE B 24 37.916 -9.931 -10.303 1.00 0.00 N ATOM 1394 CA ILE B 24 37.897 -9.031 -9.123 1.00 0.00 C ATOM 1395 C ILE B 24 37.243 -9.748 -7.947 1.00 0.00 C ATOM 1396 O ILE B 24 36.589 -10.762 -8.094 1.00 0.00 O ATOM 1397 CB ILE B 24 37.119 -7.751 -9.476 1.00 0.00 C ATOM 1398 CG1 ILE B 24 38.097 -6.594 -9.638 1.00 0.00 C ATOM 1399 CG2 ILE B 24 36.110 -7.378 -8.378 1.00 0.00 C ATOM 1400 CD1 ILE B 24 37.303 -5.356 -10.017 1.00 0.00 C ATOM 0 H ILE B 24 37.345 -9.625 -11.091 1.00 0.00 H new ATOM 0 HA ILE B 24 38.915 -8.760 -8.843 1.00 0.00 H new ATOM 0 HB ILE B 24 36.576 -7.939 -10.402 1.00 0.00 H new ATOM 0 HG12 ILE B 24 38.645 -6.426 -8.711 1.00 0.00 H new ATOM 0 HG13 ILE B 24 38.835 -6.824 -10.407 1.00 0.00 H new ATOM 0 HG21 ILE B 24 35.581 -6.469 -8.664 1.00 0.00 H new ATOM 0 HG22 ILE B 24 35.394 -8.190 -8.251 1.00 0.00 H new ATOM 0 HG23 ILE B 24 36.639 -7.210 -7.440 1.00 0.00 H new ATOM 0 HD11 ILE B 24 37.982 -4.512 -10.139 1.00 0.00 H new ATOM 0 HD12 ILE B 24 36.775 -5.535 -10.953 1.00 0.00 H new ATOM 0 HD13 ILE B 24 36.582 -5.131 -9.231 1.00 0.00 H new ATOM 1412 N ALA B 25 37.409 -9.201 -6.786 1.00 0.00 N ATOM 1413 CA ALA B 25 36.801 -9.798 -5.576 1.00 0.00 C ATOM 1414 C ALA B 25 36.738 -8.718 -4.504 1.00 0.00 C ATOM 1415 O ALA B 25 35.707 -8.474 -3.910 1.00 0.00 O ATOM 1416 CB ALA B 25 37.660 -10.967 -5.089 1.00 0.00 C ATOM 0 H ALA B 25 37.949 -8.352 -6.620 1.00 0.00 H new ATOM 0 HA ALA B 25 35.801 -10.172 -5.796 1.00 0.00 H new ATOM 0 HB1 ALA B 25 37.209 -11.404 -4.198 1.00 0.00 H new ATOM 0 HB2 ALA B 25 37.723 -11.723 -5.872 1.00 0.00 H new ATOM 0 HB3 ALA B 25 38.661 -10.608 -4.850 1.00 0.00 H new ATOM 1422 N ALA B 26 37.835 -8.054 -4.263 1.00 0.00 N ATOM 1423 CA ALA B 26 37.829 -6.973 -3.239 1.00 0.00 C ATOM 1424 C ALA B 26 37.849 -5.608 -3.934 1.00 0.00 C ATOM 1425 O ALA B 26 37.568 -5.493 -5.110 1.00 0.00 O ATOM 1426 CB ALA B 26 39.048 -7.116 -2.324 1.00 0.00 C ATOM 0 H ALA B 26 38.729 -8.212 -4.728 1.00 0.00 H new ATOM 0 HA ALA B 26 36.925 -7.053 -2.635 1.00 0.00 H new ATOM 0 HB1 ALA B 26 39.038 -6.322 -1.577 1.00 0.00 H new ATOM 0 HB2 ALA B 26 39.016 -8.084 -1.825 1.00 0.00 H new ATOM 0 HB3 ALA B 26 39.959 -7.044 -2.918 1.00 0.00 H new ATOM 1432 N TYR B 27 38.200 -4.579 -3.215 1.00 0.00 N ATOM 1433 CA TYR B 27 38.268 -3.219 -3.823 1.00 0.00 C ATOM 1434 C TYR B 27 38.597 -2.199 -2.735 1.00 0.00 C ATOM 1435 O TYR B 27 38.664 -2.525 -1.568 1.00 0.00 O ATOM 1436 CB TYR B 27 36.932 -2.842 -4.459 1.00 0.00 C ATOM 1437 CG TYR B 27 35.869 -2.774 -3.388 1.00 0.00 C ATOM 1438 CD1 TYR B 27 35.204 -3.938 -2.985 1.00 0.00 C ATOM 1439 CD2 TYR B 27 35.552 -1.545 -2.795 1.00 0.00 C ATOM 1440 CE1 TYR B 27 34.221 -3.874 -1.990 1.00 0.00 C ATOM 1441 CE2 TYR B 27 34.569 -1.482 -1.800 1.00 0.00 C ATOM 1442 CZ TYR B 27 33.904 -2.646 -1.397 1.00 0.00 C ATOM 1443 OH TYR B 27 32.936 -2.583 -0.414 1.00 0.00 O ATOM 0 H TYR B 27 38.445 -4.621 -2.226 1.00 0.00 H new ATOM 0 HA TYR B 27 39.040 -3.222 -4.593 1.00 0.00 H new ATOM 0 HB2 TYR B 27 37.016 -1.880 -4.965 1.00 0.00 H new ATOM 0 HB3 TYR B 27 36.656 -3.577 -5.215 1.00 0.00 H new ATOM 0 HD1 TYR B 27 35.449 -4.886 -3.442 1.00 0.00 H new ATOM 0 HD2 TYR B 27 36.065 -0.647 -3.105 1.00 0.00 H new ATOM 0 HE1 TYR B 27 33.707 -4.772 -1.680 1.00 0.00 H new ATOM 0 HE2 TYR B 27 34.324 -0.535 -1.343 1.00 0.00 H new ATOM 0 HH TYR B 27 32.840 -1.657 -0.108 1.00 0.00 H new ATOM 1453 N PHE B 28 38.793 -0.965 -3.110 1.00 0.00 N ATOM 1454 CA PHE B 28 39.113 0.083 -2.099 1.00 0.00 C ATOM 1455 C PHE B 28 38.963 1.454 -2.749 1.00 0.00 C ATOM 1456 O PHE B 28 39.234 1.621 -3.914 1.00 0.00 O ATOM 1457 CB PHE B 28 40.559 -0.085 -1.628 1.00 0.00 C ATOM 1458 CG PHE B 28 40.643 -1.210 -0.626 1.00 0.00 C ATOM 1459 CD1 PHE B 28 40.197 -1.015 0.687 1.00 0.00 C ATOM 1460 CD2 PHE B 28 41.166 -2.451 -1.011 1.00 0.00 C ATOM 1461 CE1 PHE B 28 40.275 -2.061 1.614 1.00 0.00 C ATOM 1462 CE2 PHE B 28 41.244 -3.496 -0.084 1.00 0.00 C ATOM 1463 CZ PHE B 28 40.799 -3.301 1.229 1.00 0.00 C ATOM 0 H PHE B 28 38.745 -0.636 -4.074 1.00 0.00 H new ATOM 0 HA PHE B 28 38.438 -0.009 -1.248 1.00 0.00 H new ATOM 0 HB2 PHE B 28 41.206 -0.295 -2.479 1.00 0.00 H new ATOM 0 HB3 PHE B 28 40.915 0.842 -1.178 1.00 0.00 H new ATOM 0 HD1 PHE B 28 39.793 -0.058 0.984 1.00 0.00 H new ATOM 0 HD2 PHE B 28 41.509 -2.601 -2.024 1.00 0.00 H new ATOM 0 HE1 PHE B 28 39.931 -1.911 2.627 1.00 0.00 H new ATOM 0 HE2 PHE B 28 41.647 -4.453 -0.381 1.00 0.00 H new ATOM 0 HZ PHE B 28 40.860 -4.107 1.945 1.00 0.00 H new ATOM 1473 N GLU B 29 38.552 2.446 -2.016 1.00 0.00 N ATOM 1474 CA GLU B 29 38.424 3.792 -2.636 1.00 0.00 C ATOM 1475 C GLU B 29 39.638 4.623 -2.245 1.00 0.00 C ATOM 1476 O GLU B 29 39.525 5.701 -1.697 1.00 0.00 O ATOM 1477 CB GLU B 29 37.138 4.495 -2.183 1.00 0.00 C ATOM 1478 CG GLU B 29 36.482 3.721 -1.036 1.00 0.00 C ATOM 1479 CD GLU B 29 37.257 3.975 0.258 1.00 0.00 C ATOM 1480 OE1 GLU B 29 37.355 5.126 0.650 1.00 0.00 O ATOM 1481 OE2 GLU B 29 37.738 3.014 0.835 1.00 0.00 O ATOM 0 H GLU B 29 38.302 2.387 -1.029 1.00 0.00 H new ATOM 0 HA GLU B 29 38.373 3.681 -3.719 1.00 0.00 H new ATOM 0 HB2 GLU B 29 37.366 5.511 -1.861 1.00 0.00 H new ATOM 0 HB3 GLU B 29 36.445 4.574 -3.020 1.00 0.00 H new ATOM 0 HG2 GLU B 29 35.444 4.034 -0.919 1.00 0.00 H new ATOM 0 HG3 GLU B 29 36.470 2.655 -1.262 1.00 0.00 H new ATOM 1488 N THR B 30 40.801 4.117 -2.536 1.00 0.00 N ATOM 1489 CA THR B 30 42.052 4.850 -2.204 1.00 0.00 C ATOM 1490 C THR B 30 42.129 5.105 -0.697 1.00 0.00 C ATOM 1491 O THR B 30 41.788 4.255 0.101 1.00 0.00 O ATOM 1492 CB THR B 30 42.072 6.173 -2.963 1.00 0.00 C ATOM 1493 OG1 THR B 30 41.258 7.124 -2.285 1.00 0.00 O ATOM 1494 CG2 THR B 30 41.541 5.944 -4.378 1.00 0.00 C ATOM 0 H THR B 30 40.940 3.217 -2.995 1.00 0.00 H new ATOM 0 HA THR B 30 42.914 4.250 -2.497 1.00 0.00 H new ATOM 0 HB THR B 30 43.092 6.555 -3.016 1.00 0.00 H new ATOM 0 HG1 THR B 30 40.371 6.739 -2.123 1.00 0.00 H new ATOM 0 HG21 THR B 30 41.552 6.885 -4.928 1.00 0.00 H new ATOM 0 HG22 THR B 30 42.172 5.217 -4.890 1.00 0.00 H new ATOM 0 HG23 THR B 30 40.520 5.566 -4.327 1.00 0.00 H new ATOM 1502 N SER B 31 42.592 6.260 -0.298 1.00 0.00 N ATOM 1503 CA SER B 31 42.706 6.549 1.156 1.00 0.00 C ATOM 1504 C SER B 31 42.850 8.056 1.370 1.00 0.00 C ATOM 1505 O SER B 31 43.025 8.810 0.434 1.00 0.00 O ATOM 1506 CB SER B 31 43.950 5.847 1.694 1.00 0.00 C ATOM 1507 OG SER B 31 43.575 4.616 2.300 1.00 0.00 O ATOM 0 H SER B 31 42.895 7.012 -0.917 1.00 0.00 H new ATOM 0 HA SER B 31 41.816 6.195 1.675 1.00 0.00 H new ATOM 0 HB2 SER B 31 44.657 5.666 0.884 1.00 0.00 H new ATOM 0 HB3 SER B 31 44.454 6.484 2.421 1.00 0.00 H new ATOM 0 HG SER B 31 42.907 4.166 1.741 1.00 0.00 H new ATOM 1513 N SER B 32 42.794 8.500 2.596 1.00 0.00 N ATOM 1514 CA SER B 32 42.945 9.957 2.863 1.00 0.00 C ATOM 1515 C SER B 32 44.425 10.326 2.741 1.00 0.00 C ATOM 1516 O SER B 32 45.230 9.541 2.280 1.00 0.00 O ATOM 1517 CB SER B 32 42.448 10.280 4.272 1.00 0.00 C ATOM 1518 OG SER B 32 41.077 9.918 4.382 1.00 0.00 O ATOM 0 H SER B 32 42.651 7.918 3.421 1.00 0.00 H new ATOM 0 HA SER B 32 42.358 10.528 2.144 1.00 0.00 H new ATOM 0 HB2 SER B 32 43.039 9.739 5.011 1.00 0.00 H new ATOM 0 HB3 SER B 32 42.573 11.343 4.479 1.00 0.00 H new ATOM 0 HG SER B 32 40.756 10.122 5.285 1.00 0.00 H new ATOM 1524 N GLN B 33 44.796 11.510 3.143 1.00 0.00 N ATOM 1525 CA GLN B 33 46.228 11.910 3.035 1.00 0.00 C ATOM 1526 C GLN B 33 46.686 11.731 1.587 1.00 0.00 C ATOM 1527 O GLN B 33 47.864 11.650 1.298 1.00 0.00 O ATOM 1528 CB GLN B 33 47.076 11.028 3.955 1.00 0.00 C ATOM 1529 CG GLN B 33 47.071 11.615 5.367 1.00 0.00 C ATOM 1530 CD GLN B 33 46.114 10.813 6.251 1.00 0.00 C ATOM 1531 OE1 GLN B 33 44.911 10.945 6.139 1.00 0.00 O ATOM 1532 NE2 GLN B 33 46.600 9.983 7.133 1.00 0.00 N ATOM 0 H GLN B 33 44.174 12.215 3.539 1.00 0.00 H new ATOM 0 HA GLN B 33 46.344 12.952 3.331 1.00 0.00 H new ATOM 0 HB2 GLN B 33 46.680 10.013 3.970 1.00 0.00 H new ATOM 0 HB3 GLN B 33 48.097 10.966 3.578 1.00 0.00 H new ATOM 0 HG2 GLN B 33 48.077 11.590 5.786 1.00 0.00 H new ATOM 0 HG3 GLN B 33 46.764 12.661 5.336 1.00 0.00 H new ATOM 0 HE21 GLN B 33 47.610 9.872 7.227 1.00 0.00 H new ATOM 0 HE22 GLN B 33 45.970 9.445 7.728 1.00 0.00 H new ATOM 1541 N CYS B 34 45.755 11.671 0.677 1.00 0.00 N ATOM 1542 CA CYS B 34 46.104 11.499 -0.760 1.00 0.00 C ATOM 1543 C CYS B 34 44.807 11.409 -1.565 1.00 0.00 C ATOM 1544 O CYS B 34 44.596 10.482 -2.320 1.00 0.00 O ATOM 1545 CB CYS B 34 46.930 10.220 -0.948 1.00 0.00 C ATOM 1546 SG CYS B 34 45.895 8.764 -0.647 1.00 0.00 S ATOM 0 H CYS B 34 44.755 11.735 0.870 1.00 0.00 H new ATOM 0 HA CYS B 34 46.697 12.346 -1.105 1.00 0.00 H new ATOM 0 HB2 CYS B 34 47.336 10.185 -1.959 1.00 0.00 H new ATOM 0 HB3 CYS B 34 47.778 10.221 -0.263 1.00 0.00 H new ATOM 1551 N SER B 35 43.935 12.370 -1.388 1.00 0.00 N ATOM 1552 CA SER B 35 42.630 12.371 -2.115 1.00 0.00 C ATOM 1553 C SER B 35 42.802 11.782 -3.515 1.00 0.00 C ATOM 1554 O SER B 35 43.133 12.475 -4.456 1.00 0.00 O ATOM 1555 CB SER B 35 42.120 13.807 -2.231 1.00 0.00 C ATOM 1556 OG SER B 35 40.705 13.793 -2.374 1.00 0.00 O ATOM 0 H SER B 35 44.075 13.164 -0.763 1.00 0.00 H new ATOM 0 HA SER B 35 41.914 11.764 -1.561 1.00 0.00 H new ATOM 0 HB2 SER B 35 42.402 14.378 -1.346 1.00 0.00 H new ATOM 0 HB3 SER B 35 42.579 14.300 -3.088 1.00 0.00 H new ATOM 0 HG SER B 35 40.374 14.713 -2.447 1.00 0.00 H new ATOM 1562 N LYS B 36 42.575 10.505 -3.658 1.00 0.00 N ATOM 1563 CA LYS B 36 42.719 9.871 -4.995 1.00 0.00 C ATOM 1564 C LYS B 36 41.325 9.577 -5.561 1.00 0.00 C ATOM 1565 O LYS B 36 40.429 9.204 -4.829 1.00 0.00 O ATOM 1566 CB LYS B 36 43.503 8.563 -4.861 1.00 0.00 C ATOM 1567 CG LYS B 36 45.008 8.847 -4.860 1.00 0.00 C ATOM 1568 CD LYS B 36 45.375 9.742 -6.045 1.00 0.00 C ATOM 1569 CE LYS B 36 45.673 11.155 -5.540 1.00 0.00 C ATOM 1570 NZ LYS B 36 45.562 12.121 -6.669 1.00 0.00 N ATOM 0 H LYS B 36 42.296 9.875 -2.906 1.00 0.00 H new ATOM 0 HA LYS B 36 43.255 10.543 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS B 36 43.221 8.054 -3.939 1.00 0.00 H new ATOM 0 HB3 LYS B 36 43.252 7.894 -5.684 1.00 0.00 H new ATOM 0 HG2 LYS B 36 45.294 9.331 -3.926 1.00 0.00 H new ATOM 0 HG3 LYS B 36 45.563 7.910 -4.916 1.00 0.00 H new ATOM 0 HD2 LYS B 36 46.244 9.339 -6.564 1.00 0.00 H new ATOM 0 HD3 LYS B 36 44.556 9.766 -6.764 1.00 0.00 H new ATOM 0 HE2 LYS B 36 44.975 11.424 -4.747 1.00 0.00 H new ATOM 0 HE3 LYS B 36 46.674 11.195 -5.110 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 45.926 13.048 -6.370 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 46.117 11.775 -7.478 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 44.565 12.215 -6.949 1.00 0.00 H new ATOM 1584 N PRO B 37 41.183 9.762 -6.848 1.00 0.00 N ATOM 1585 CA PRO B 37 39.907 9.534 -7.548 1.00 0.00 C ATOM 1586 C PRO B 37 39.697 8.043 -7.825 1.00 0.00 C ATOM 1587 O PRO B 37 38.794 7.422 -7.301 1.00 0.00 O ATOM 1588 CB PRO B 37 40.080 10.302 -8.862 1.00 0.00 C ATOM 1589 CG PRO B 37 41.605 10.434 -9.093 1.00 0.00 C ATOM 1590 CD PRO B 37 42.280 10.216 -7.726 1.00 0.00 C ATOM 0 HA PRO B 37 39.043 9.860 -6.969 1.00 0.00 H new ATOM 0 HB2 PRO B 37 39.607 9.771 -9.688 1.00 0.00 H new ATOM 0 HB3 PRO B 37 39.610 11.284 -8.803 1.00 0.00 H new ATOM 0 HG2 PRO B 37 41.952 9.697 -9.818 1.00 0.00 H new ATOM 0 HG3 PRO B 37 41.852 11.417 -9.494 1.00 0.00 H new ATOM 0 HD2 PRO B 37 43.074 9.472 -7.788 1.00 0.00 H new ATOM 0 HD3 PRO B 37 42.733 11.135 -7.354 1.00 0.00 H new ATOM 1598 N GLY B 38 40.517 7.473 -8.662 1.00 0.00 N ATOM 1599 CA GLY B 38 40.365 6.030 -9.001 1.00 0.00 C ATOM 1600 C GLY B 38 40.254 5.182 -7.731 1.00 0.00 C ATOM 1601 O GLY B 38 40.358 5.675 -6.628 1.00 0.00 O ATOM 0 H GLY B 38 41.290 7.947 -9.129 1.00 0.00 H new ATOM 0 HA2 GLY B 38 39.477 5.888 -9.617 1.00 0.00 H new ATOM 0 HA3 GLY B 38 41.219 5.699 -9.592 1.00 0.00 H new ATOM 1605 N VAL B 39 40.043 3.901 -7.893 1.00 0.00 N ATOM 1606 CA VAL B 39 39.924 2.993 -6.714 1.00 0.00 C ATOM 1607 C VAL B 39 40.884 1.813 -6.899 1.00 0.00 C ATOM 1608 O VAL B 39 41.251 1.475 -8.004 1.00 0.00 O ATOM 1609 CB VAL B 39 38.490 2.465 -6.619 1.00 0.00 C ATOM 1610 CG1 VAL B 39 37.515 3.636 -6.469 1.00 0.00 C ATOM 1611 CG2 VAL B 39 38.165 1.676 -7.885 1.00 0.00 C ATOM 0 H VAL B 39 39.947 3.442 -8.799 1.00 0.00 H new ATOM 0 HA VAL B 39 40.172 3.537 -5.803 1.00 0.00 H new ATOM 0 HB VAL B 39 38.395 1.815 -5.749 1.00 0.00 H new ATOM 0 HG11 VAL B 39 36.496 3.255 -6.402 1.00 0.00 H new ATOM 0 HG12 VAL B 39 37.754 4.195 -5.564 1.00 0.00 H new ATOM 0 HG13 VAL B 39 37.600 4.293 -7.334 1.00 0.00 H new ATOM 0 HG21 VAL B 39 37.145 1.296 -7.825 1.00 0.00 H new ATOM 0 HG22 VAL B 39 38.260 2.327 -8.754 1.00 0.00 H new ATOM 0 HG23 VAL B 39 38.858 0.840 -7.981 1.00 0.00 H new ATOM 1621 N ILE B 40 41.281 1.179 -5.830 1.00 0.00 N ATOM 1622 CA ILE B 40 42.208 0.018 -5.943 1.00 0.00 C ATOM 1623 C ILE B 40 41.375 -1.264 -5.937 1.00 0.00 C ATOM 1624 O ILE B 40 40.345 -1.333 -5.297 1.00 0.00 O ATOM 1625 CB ILE B 40 43.175 0.032 -4.749 1.00 0.00 C ATOM 1626 CG1 ILE B 40 44.317 1.011 -5.033 1.00 0.00 C ATOM 1627 CG2 ILE B 40 43.757 -1.366 -4.521 1.00 0.00 C ATOM 1628 CD1 ILE B 40 44.162 2.250 -4.148 1.00 0.00 C ATOM 0 H ILE B 40 41.002 1.417 -4.878 1.00 0.00 H new ATOM 0 HA ILE B 40 42.787 0.072 -6.865 1.00 0.00 H new ATOM 0 HB ILE B 40 42.630 0.342 -3.857 1.00 0.00 H new ATOM 0 HG12 ILE B 40 45.277 0.532 -4.840 1.00 0.00 H new ATOM 0 HG13 ILE B 40 44.310 1.299 -6.084 1.00 0.00 H new ATOM 0 HG21 ILE B 40 44.440 -1.342 -3.672 1.00 0.00 H new ATOM 0 HG22 ILE B 40 42.949 -2.068 -4.316 1.00 0.00 H new ATOM 0 HG23 ILE B 40 44.297 -1.685 -5.412 1.00 0.00 H new ATOM 0 HD11 ILE B 40 44.976 2.946 -4.351 1.00 0.00 H new ATOM 0 HD12 ILE B 40 43.209 2.733 -4.362 1.00 0.00 H new ATOM 0 HD13 ILE B 40 44.191 1.954 -3.099 1.00 0.00 H new ATOM 1640 N PHE B 41 41.791 -2.277 -6.647 1.00 0.00 N ATOM 1641 CA PHE B 41 40.984 -3.520 -6.665 1.00 0.00 C ATOM 1642 C PHE B 41 41.778 -4.693 -6.117 1.00 0.00 C ATOM 1643 O PHE B 41 42.890 -4.556 -5.647 1.00 0.00 O ATOM 1644 CB PHE B 41 40.545 -3.822 -8.089 1.00 0.00 C ATOM 1645 CG PHE B 41 39.258 -3.086 -8.351 1.00 0.00 C ATOM 1646 CD1 PHE B 41 38.071 -3.526 -7.754 1.00 0.00 C ATOM 1647 CD2 PHE B 41 39.253 -1.953 -9.170 1.00 0.00 C ATOM 1648 CE1 PHE B 41 36.876 -2.835 -7.981 1.00 0.00 C ATOM 1649 CE2 PHE B 41 38.060 -1.260 -9.395 1.00 0.00 C ATOM 1650 CZ PHE B 41 36.870 -1.701 -8.801 1.00 0.00 C ATOM 0 H PHE B 41 42.643 -2.295 -7.207 1.00 0.00 H new ATOM 0 HA PHE B 41 40.109 -3.371 -6.032 1.00 0.00 H new ATOM 0 HB2 PHE B 41 41.312 -3.510 -8.798 1.00 0.00 H new ATOM 0 HB3 PHE B 41 40.404 -4.894 -8.224 1.00 0.00 H new ATOM 0 HD1 PHE B 41 38.078 -4.399 -7.118 1.00 0.00 H new ATOM 0 HD2 PHE B 41 40.170 -1.613 -9.628 1.00 0.00 H new ATOM 0 HE1 PHE B 41 35.959 -3.176 -7.524 1.00 0.00 H new ATOM 0 HE2 PHE B 41 38.056 -0.384 -10.027 1.00 0.00 H new ATOM 0 HZ PHE B 41 35.948 -1.166 -8.976 1.00 0.00 H new ATOM 1660 N LEU B 42 41.187 -5.846 -6.166 1.00 0.00 N ATOM 1661 CA LEU B 42 41.854 -7.059 -5.643 1.00 0.00 C ATOM 1662 C LEU B 42 41.472 -8.256 -6.504 1.00 0.00 C ATOM 1663 O LEU B 42 40.729 -9.124 -6.089 1.00 0.00 O ATOM 1664 CB LEU B 42 41.384 -7.289 -4.217 1.00 0.00 C ATOM 1665 CG LEU B 42 42.503 -6.908 -3.257 1.00 0.00 C ATOM 1666 CD1 LEU B 42 41.955 -5.965 -2.186 1.00 0.00 C ATOM 1667 CD2 LEU B 42 43.051 -8.172 -2.596 1.00 0.00 C ATOM 0 H LEU B 42 40.256 -6.001 -6.552 1.00 0.00 H new ATOM 0 HA LEU B 42 42.936 -6.933 -5.665 1.00 0.00 H new ATOM 0 HB2 LEU B 42 40.494 -6.693 -4.013 1.00 0.00 H new ATOM 0 HB3 LEU B 42 41.107 -8.334 -4.076 1.00 0.00 H new ATOM 0 HG LEU B 42 43.302 -6.407 -3.804 1.00 0.00 H new ATOM 0 HD11 LEU B 42 42.755 -5.692 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU B 42 41.561 -5.066 -2.660 1.00 0.00 H new ATOM 0 HD13 LEU B 42 41.158 -6.464 -1.635 1.00 0.00 H new ATOM 0 HD21 LEU B 42 43.853 -7.904 -1.908 1.00 0.00 H new ATOM 0 HD22 LEU B 42 42.252 -8.671 -2.047 1.00 0.00 H new ATOM 0 HD23 LEU B 42 43.439 -8.844 -3.361 1.00 0.00 H new ATOM 1679 N THR B 43 41.971 -8.302 -7.702 1.00 0.00 N ATOM 1680 CA THR B 43 41.646 -9.434 -8.606 1.00 0.00 C ATOM 1681 C THR B 43 41.994 -10.756 -7.916 1.00 0.00 C ATOM 1682 O THR B 43 42.176 -10.813 -6.716 1.00 0.00 O ATOM 1683 CB THR B 43 42.445 -9.290 -9.905 1.00 0.00 C ATOM 1684 OG1 THR B 43 43.799 -9.649 -9.669 1.00 0.00 O ATOM 1685 CG2 THR B 43 42.375 -7.837 -10.390 1.00 0.00 C ATOM 0 H THR B 43 42.595 -7.599 -8.098 1.00 0.00 H new ATOM 0 HA THR B 43 40.581 -9.426 -8.839 1.00 0.00 H new ATOM 0 HB THR B 43 42.024 -9.946 -10.667 1.00 0.00 H new ATOM 0 HG1 THR B 43 44.311 -9.559 -10.500 1.00 0.00 H new ATOM 0 HG21 THR B 43 42.943 -7.734 -11.314 1.00 0.00 H new ATOM 0 HG22 THR B 43 41.336 -7.564 -10.571 1.00 0.00 H new ATOM 0 HG23 THR B 43 42.796 -7.179 -9.630 1.00 0.00 H new ATOM 1693 N LYS B 44 42.080 -11.822 -8.660 1.00 0.00 N ATOM 1694 CA LYS B 44 42.402 -13.138 -8.039 1.00 0.00 C ATOM 1695 C LYS B 44 43.917 -13.289 -7.903 1.00 0.00 C ATOM 1696 O LYS B 44 44.402 -14.113 -7.154 1.00 0.00 O ATOM 1697 CB LYS B 44 41.847 -14.259 -8.917 1.00 0.00 C ATOM 1698 CG LYS B 44 40.399 -13.936 -9.295 1.00 0.00 C ATOM 1699 CD LYS B 44 39.614 -13.537 -8.040 1.00 0.00 C ATOM 1700 CE LYS B 44 39.408 -14.770 -7.158 1.00 0.00 C ATOM 1701 NZ LYS B 44 39.152 -14.341 -5.754 1.00 0.00 N ATOM 0 H LYS B 44 41.942 -11.840 -9.670 1.00 0.00 H new ATOM 0 HA LYS B 44 41.950 -13.194 -7.049 1.00 0.00 H new ATOM 0 HB2 LYS B 44 42.454 -14.367 -9.816 1.00 0.00 H new ATOM 0 HB3 LYS B 44 41.893 -15.209 -8.385 1.00 0.00 H new ATOM 0 HG2 LYS B 44 40.375 -13.126 -10.023 1.00 0.00 H new ATOM 0 HG3 LYS B 44 39.934 -14.802 -9.766 1.00 0.00 H new ATOM 0 HD2 LYS B 44 40.154 -12.768 -7.489 1.00 0.00 H new ATOM 0 HD3 LYS B 44 38.651 -13.111 -8.320 1.00 0.00 H new ATOM 0 HE2 LYS B 44 38.569 -15.359 -7.528 1.00 0.00 H new ATOM 0 HE3 LYS B 44 40.289 -15.410 -7.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 39.677 -14.958 -5.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 39.466 -13.357 -5.629 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 38.134 -14.408 -5.551 1.00 0.00 H new ATOM 1715 N ARG B 45 44.668 -12.497 -8.614 1.00 0.00 N ATOM 1716 CA ARG B 45 46.149 -12.595 -8.514 1.00 0.00 C ATOM 1717 C ARG B 45 46.645 -11.612 -7.454 1.00 0.00 C ATOM 1718 O ARG B 45 47.773 -11.161 -7.491 1.00 0.00 O ATOM 1719 CB ARG B 45 46.776 -12.250 -9.866 1.00 0.00 C ATOM 1720 CG ARG B 45 46.540 -13.401 -10.845 1.00 0.00 C ATOM 1721 CD ARG B 45 47.674 -14.419 -10.716 1.00 0.00 C ATOM 1722 NE ARG B 45 47.289 -15.681 -11.408 1.00 0.00 N ATOM 1723 CZ ARG B 45 47.821 -15.981 -12.561 1.00 0.00 C ATOM 1724 NH1 ARG B 45 48.224 -15.033 -13.363 1.00 0.00 N ATOM 1725 NH2 ARG B 45 47.948 -17.231 -12.914 1.00 0.00 N ATOM 0 H ARG B 45 44.321 -11.787 -9.259 1.00 0.00 H new ATOM 0 HA ARG B 45 46.433 -13.610 -8.234 1.00 0.00 H new ATOM 0 HB2 ARG B 45 46.340 -11.331 -10.257 1.00 0.00 H new ATOM 0 HB3 ARG B 45 47.845 -12.072 -9.748 1.00 0.00 H new ATOM 0 HG2 ARG B 45 45.582 -13.879 -10.638 1.00 0.00 H new ATOM 0 HG3 ARG B 45 46.492 -13.021 -11.865 1.00 0.00 H new ATOM 0 HD2 ARG B 45 48.589 -14.017 -11.151 1.00 0.00 H new ATOM 0 HD3 ARG B 45 47.882 -14.617 -9.664 1.00 0.00 H new ATOM 0 HE ARG B 45 46.610 -16.310 -10.980 1.00 0.00 H new ATOM 0 HH11 ARG B 45 48.123 -14.056 -13.089 1.00 0.00 H new ATOM 0 HH12 ARG B 45 48.640 -15.270 -14.264 1.00 0.00 H new ATOM 0 HH21 ARG B 45 47.632 -17.972 -12.289 1.00 0.00 H new ATOM 0 HH22 ARG B 45 48.364 -17.467 -13.815 1.00 0.00 H new ATOM 1739 N SER B 46 45.809 -11.275 -6.508 1.00 0.00 N ATOM 1740 CA SER B 46 46.231 -10.318 -5.447 1.00 0.00 C ATOM 1741 C SER B 46 46.987 -9.157 -6.092 1.00 0.00 C ATOM 1742 O SER B 46 47.876 -8.577 -5.501 1.00 0.00 O ATOM 1743 CB SER B 46 47.146 -11.030 -4.450 1.00 0.00 C ATOM 1744 OG SER B 46 46.356 -11.790 -3.546 1.00 0.00 O ATOM 0 H SER B 46 44.853 -11.621 -6.425 1.00 0.00 H new ATOM 0 HA SER B 46 45.353 -9.940 -4.924 1.00 0.00 H new ATOM 0 HB2 SER B 46 47.842 -11.681 -4.979 1.00 0.00 H new ATOM 0 HB3 SER B 46 47.744 -10.301 -3.904 1.00 0.00 H new ATOM 0 HG SER B 46 46.940 -12.249 -2.907 1.00 0.00 H new ATOM 1750 N ARG B 47 46.644 -8.817 -7.304 1.00 0.00 N ATOM 1751 CA ARG B 47 47.350 -7.698 -7.987 1.00 0.00 C ATOM 1752 C ARG B 47 46.389 -6.525 -8.184 1.00 0.00 C ATOM 1753 O ARG B 47 45.634 -6.485 -9.134 1.00 0.00 O ATOM 1754 CB ARG B 47 47.858 -8.171 -9.350 1.00 0.00 C ATOM 1755 CG ARG B 47 49.387 -8.183 -9.350 1.00 0.00 C ATOM 1756 CD ARG B 47 49.903 -7.486 -10.610 1.00 0.00 C ATOM 1757 NE ARG B 47 49.653 -8.353 -11.795 1.00 0.00 N ATOM 1758 CZ ARG B 47 50.599 -9.132 -12.244 1.00 0.00 C ATOM 1759 NH1 ARG B 47 51.622 -9.417 -11.486 1.00 0.00 N ATOM 1760 NH2 ARG B 47 50.521 -9.625 -13.450 1.00 0.00 N ATOM 0 H ARG B 47 45.907 -9.265 -7.849 1.00 0.00 H new ATOM 0 HA ARG B 47 48.192 -7.377 -7.374 1.00 0.00 H new ATOM 0 HB2 ARG B 47 47.476 -9.169 -9.566 1.00 0.00 H new ATOM 0 HB3 ARG B 47 47.489 -7.512 -10.136 1.00 0.00 H new ATOM 0 HG2 ARG B 47 49.765 -7.678 -8.461 1.00 0.00 H new ATOM 0 HG3 ARG B 47 49.753 -9.209 -9.313 1.00 0.00 H new ATOM 0 HD2 ARG B 47 49.404 -6.525 -10.737 1.00 0.00 H new ATOM 0 HD3 ARG B 47 50.969 -7.281 -10.514 1.00 0.00 H new ATOM 0 HE ARG B 47 48.743 -8.338 -12.255 1.00 0.00 H new ATOM 0 HH11 ARG B 47 51.682 -9.031 -10.544 1.00 0.00 H new ATOM 0 HH12 ARG B 47 52.362 -10.026 -11.836 1.00 0.00 H new ATOM 0 HH21 ARG B 47 49.721 -9.401 -14.042 1.00 0.00 H new ATOM 0 HH22 ARG B 47 51.260 -10.234 -13.801 1.00 0.00 H new ATOM 1774 N GLN B 48 46.415 -5.566 -7.300 1.00 0.00 N ATOM 1775 CA GLN B 48 45.505 -4.396 -7.452 1.00 0.00 C ATOM 1776 C GLN B 48 45.701 -3.797 -8.846 1.00 0.00 C ATOM 1777 O GLN B 48 46.778 -3.854 -9.406 1.00 0.00 O ATOM 1778 CB GLN B 48 45.839 -3.348 -6.388 1.00 0.00 C ATOM 1779 CG GLN B 48 47.158 -2.658 -6.742 1.00 0.00 C ATOM 1780 CD GLN B 48 46.882 -1.209 -7.149 1.00 0.00 C ATOM 1781 OE1 GLN B 48 46.671 -0.359 -6.307 1.00 0.00 O ATOM 1782 NE2 GLN B 48 46.875 -0.888 -8.414 1.00 0.00 N ATOM 0 H GLN B 48 47.024 -5.542 -6.482 1.00 0.00 H new ATOM 0 HA GLN B 48 44.469 -4.711 -7.329 1.00 0.00 H new ATOM 0 HB2 GLN B 48 45.038 -2.612 -6.324 1.00 0.00 H new ATOM 0 HB3 GLN B 48 45.916 -3.821 -5.409 1.00 0.00 H new ATOM 0 HG2 GLN B 48 47.835 -2.685 -5.888 1.00 0.00 H new ATOM 0 HG3 GLN B 48 47.651 -3.188 -7.557 1.00 0.00 H new ATOM 0 HE21 GLN B 48 47.052 -1.601 -9.122 1.00 0.00 H new ATOM 0 HE22 GLN B 48 46.693 0.076 -8.695 1.00 0.00 H new ATOM 1791 N VAL B 49 44.675 -3.231 -9.422 1.00 0.00 N ATOM 1792 CA VAL B 49 44.836 -2.650 -10.786 1.00 0.00 C ATOM 1793 C VAL B 49 44.339 -1.201 -10.820 1.00 0.00 C ATOM 1794 O VAL B 49 44.326 -0.570 -11.858 1.00 0.00 O ATOM 1795 CB VAL B 49 44.035 -3.480 -11.786 1.00 0.00 C ATOM 1796 CG1 VAL B 49 44.352 -3.010 -13.206 1.00 0.00 C ATOM 1797 CG2 VAL B 49 44.413 -4.956 -11.644 1.00 0.00 C ATOM 0 H VAL B 49 43.744 -3.146 -9.014 1.00 0.00 H new ATOM 0 HA VAL B 49 45.894 -2.664 -11.048 1.00 0.00 H new ATOM 0 HB VAL B 49 42.970 -3.357 -11.589 1.00 0.00 H new ATOM 0 HG11 VAL B 49 43.781 -3.602 -13.921 1.00 0.00 H new ATOM 0 HG12 VAL B 49 44.084 -1.958 -13.309 1.00 0.00 H new ATOM 0 HG13 VAL B 49 45.417 -3.134 -13.401 1.00 0.00 H new ATOM 0 HG21 VAL B 49 43.841 -5.548 -12.358 1.00 0.00 H new ATOM 0 HG22 VAL B 49 45.478 -5.079 -11.841 1.00 0.00 H new ATOM 0 HG23 VAL B 49 44.190 -5.293 -10.632 1.00 0.00 H new ATOM 1807 N CYS B 50 43.927 -0.663 -9.706 1.00 0.00 N ATOM 1808 CA CYS B 50 43.436 0.741 -9.707 1.00 0.00 C ATOM 1809 C CYS B 50 42.259 0.848 -10.676 1.00 0.00 C ATOM 1810 O CYS B 50 41.935 -0.093 -11.373 1.00 0.00 O ATOM 1811 CB CYS B 50 44.561 1.670 -10.158 1.00 0.00 C ATOM 1812 SG CYS B 50 45.336 2.441 -8.714 1.00 0.00 S ATOM 0 H CYS B 50 43.909 -1.132 -8.801 1.00 0.00 H new ATOM 0 HA CYS B 50 43.116 1.028 -8.705 1.00 0.00 H new ATOM 0 HB2 CYS B 50 45.304 1.108 -10.724 1.00 0.00 H new ATOM 0 HB3 CYS B 50 44.166 2.438 -10.824 1.00 0.00 H new ATOM 1817 N ALA B 51 41.608 1.977 -10.728 1.00 0.00 N ATOM 1818 CA ALA B 51 40.449 2.106 -11.659 1.00 0.00 C ATOM 1819 C ALA B 51 40.032 3.568 -11.804 1.00 0.00 C ATOM 1820 O ALA B 51 40.012 4.316 -10.852 1.00 0.00 O ATOM 1821 CB ALA B 51 39.271 1.317 -11.098 1.00 0.00 C ATOM 0 H ALA B 51 41.823 2.806 -10.175 1.00 0.00 H new ATOM 0 HA ALA B 51 40.742 1.721 -12.636 1.00 0.00 H new ATOM 0 HB1 ALA B 51 38.419 1.406 -11.772 1.00 0.00 H new ATOM 0 HB2 ALA B 51 39.549 0.268 -11.001 1.00 0.00 H new ATOM 0 HB3 ALA B 51 39.001 1.713 -10.119 1.00 0.00 H new ATOM 1827 N ASP B 52 39.679 3.971 -12.993 1.00 0.00 N ATOM 1828 CA ASP B 52 39.239 5.381 -13.205 1.00 0.00 C ATOM 1829 C ASP B 52 38.211 5.757 -12.129 1.00 0.00 C ATOM 1830 O ASP B 52 37.756 4.909 -11.387 1.00 0.00 O ATOM 1831 CB ASP B 52 38.595 5.508 -14.588 1.00 0.00 C ATOM 1832 CG ASP B 52 39.407 6.480 -15.448 1.00 0.00 C ATOM 1833 OD1 ASP B 52 40.508 6.818 -15.047 1.00 0.00 O ATOM 1834 OD2 ASP B 52 38.913 6.868 -16.493 1.00 0.00 O ATOM 0 H ASP B 52 39.676 3.386 -13.828 1.00 0.00 H new ATOM 0 HA ASP B 52 40.099 6.048 -13.140 1.00 0.00 H new ATOM 0 HB2 ASP B 52 38.550 4.531 -15.070 1.00 0.00 H new ATOM 0 HB3 ASP B 52 37.569 5.863 -14.491 1.00 0.00 H new ATOM 1839 N PRO B 53 37.875 7.022 -12.081 1.00 0.00 N ATOM 1840 CA PRO B 53 36.899 7.550 -11.108 1.00 0.00 C ATOM 1841 C PRO B 53 35.466 7.235 -11.554 1.00 0.00 C ATOM 1842 O PRO B 53 34.991 7.743 -12.550 1.00 0.00 O ATOM 1843 CB PRO B 53 37.155 9.059 -11.129 1.00 0.00 C ATOM 1844 CG PRO B 53 37.833 9.368 -12.486 1.00 0.00 C ATOM 1845 CD PRO B 53 38.437 8.043 -12.988 1.00 0.00 C ATOM 0 HA PRO B 53 37.008 7.114 -10.115 1.00 0.00 H new ATOM 0 HB2 PRO B 53 36.222 9.613 -11.026 1.00 0.00 H new ATOM 0 HB3 PRO B 53 37.795 9.356 -10.298 1.00 0.00 H new ATOM 0 HG2 PRO B 53 37.109 9.759 -13.201 1.00 0.00 H new ATOM 0 HG3 PRO B 53 38.607 10.127 -12.369 1.00 0.00 H new ATOM 0 HD2 PRO B 53 38.164 7.848 -14.025 1.00 0.00 H new ATOM 0 HD3 PRO B 53 39.526 8.059 -12.943 1.00 0.00 H new ATOM 1853 N SER B 54 34.773 6.407 -10.820 1.00 0.00 N ATOM 1854 CA SER B 54 33.370 6.066 -11.196 1.00 0.00 C ATOM 1855 C SER B 54 33.365 5.219 -12.472 1.00 0.00 C ATOM 1856 O SER B 54 32.529 5.389 -13.337 1.00 0.00 O ATOM 1857 CB SER B 54 32.579 7.352 -11.436 1.00 0.00 C ATOM 1858 OG SER B 54 31.551 7.458 -10.460 1.00 0.00 O ATOM 0 H SER B 54 35.118 5.951 -9.975 1.00 0.00 H new ATOM 0 HA SER B 54 32.910 5.499 -10.387 1.00 0.00 H new ATOM 0 HB2 SER B 54 33.241 8.216 -11.379 1.00 0.00 H new ATOM 0 HB3 SER B 54 32.147 7.346 -12.437 1.00 0.00 H new ATOM 0 HG SER B 54 31.042 8.282 -10.609 1.00 0.00 H new ATOM 1864 N GLU B 55 34.289 4.305 -12.594 1.00 0.00 N ATOM 1865 CA GLU B 55 34.334 3.444 -13.810 1.00 0.00 C ATOM 1866 C GLU B 55 33.067 2.624 -13.916 1.00 0.00 C ATOM 1867 O GLU B 55 32.620 2.003 -12.979 1.00 0.00 O ATOM 1868 CB GLU B 55 35.532 2.504 -13.738 1.00 0.00 C ATOM 1869 CG GLU B 55 36.778 3.229 -14.243 1.00 0.00 C ATOM 1870 CD GLU B 55 36.808 3.182 -15.771 1.00 0.00 C ATOM 1871 OE1 GLU B 55 35.762 3.369 -16.371 1.00 0.00 O ATOM 1872 OE2 GLU B 55 37.876 2.957 -16.317 1.00 0.00 O ATOM 0 H GLU B 55 35.016 4.117 -11.903 1.00 0.00 H new ATOM 0 HA GLU B 55 34.424 4.086 -14.686 1.00 0.00 H new ATOM 0 HB2 GLU B 55 35.684 2.169 -12.712 1.00 0.00 H new ATOM 0 HB3 GLU B 55 35.347 1.614 -14.340 1.00 0.00 H new ATOM 0 HG2 GLU B 55 36.774 4.264 -13.900 1.00 0.00 H new ATOM 0 HG3 GLU B 55 37.674 2.761 -13.836 1.00 0.00 H new ATOM 1879 N GLU B 56 32.508 2.617 -15.075 1.00 0.00 N ATOM 1880 CA GLU B 56 31.275 1.841 -15.328 1.00 0.00 C ATOM 1881 C GLU B 56 31.343 0.500 -14.588 1.00 0.00 C ATOM 1882 O GLU B 56 30.461 0.140 -13.835 1.00 0.00 O ATOM 1883 CB GLU B 56 31.214 1.611 -16.826 1.00 0.00 C ATOM 1884 CG GLU B 56 29.856 2.062 -17.367 1.00 0.00 C ATOM 1885 CD GLU B 56 29.613 1.427 -18.738 1.00 0.00 C ATOM 1886 OE1 GLU B 56 30.585 1.085 -19.390 1.00 0.00 O ATOM 1887 OE2 GLU B 56 28.459 1.295 -19.111 1.00 0.00 O ATOM 0 H GLU B 56 32.860 3.130 -15.883 1.00 0.00 H new ATOM 0 HA GLU B 56 30.390 2.371 -14.975 1.00 0.00 H new ATOM 0 HB2 GLU B 56 32.014 2.163 -17.320 1.00 0.00 H new ATOM 0 HB3 GLU B 56 31.371 0.555 -17.047 1.00 0.00 H new ATOM 0 HG2 GLU B 56 29.064 1.774 -16.676 1.00 0.00 H new ATOM 0 HG3 GLU B 56 29.828 3.149 -17.448 1.00 0.00 H new ATOM 1894 N TRP B 57 32.390 -0.236 -14.813 1.00 0.00 N ATOM 1895 CA TRP B 57 32.559 -1.560 -14.154 1.00 0.00 C ATOM 1896 C TRP B 57 32.778 -1.405 -12.644 1.00 0.00 C ATOM 1897 O TRP B 57 32.345 -2.233 -11.869 1.00 0.00 O ATOM 1898 CB TRP B 57 33.753 -2.274 -14.788 1.00 0.00 C ATOM 1899 CG TRP B 57 34.965 -1.384 -14.844 1.00 0.00 C ATOM 1900 CD1 TRP B 57 35.197 -0.427 -15.772 1.00 0.00 C ATOM 1901 CD2 TRP B 57 36.131 -1.390 -13.978 1.00 0.00 C ATOM 1902 NE1 TRP B 57 36.426 0.151 -15.526 1.00 0.00 N ATOM 1903 CE2 TRP B 57 37.042 -0.410 -14.432 1.00 0.00 C ATOM 1904 CE3 TRP B 57 36.477 -2.144 -12.857 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 38.261 -0.196 -13.791 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 37.701 -1.936 -12.206 1.00 0.00 C ATOM 1907 CH2 TRP B 57 38.594 -0.966 -12.675 1.00 0.00 C ATOM 0 H TRP B 57 33.152 0.028 -15.438 1.00 0.00 H new ATOM 0 HA TRP B 57 31.651 -2.146 -14.296 1.00 0.00 H new ATOM 0 HB2 TRP B 57 33.986 -3.172 -14.216 1.00 0.00 H new ATOM 0 HB3 TRP B 57 33.491 -2.597 -15.796 1.00 0.00 H new ATOM 0 HD1 TRP B 57 34.528 -0.159 -16.576 1.00 0.00 H new ATOM 0 HE1 TRP B 57 36.828 0.902 -16.087 1.00 0.00 H new ATOM 0 HE3 TRP B 57 35.795 -2.895 -12.487 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 38.942 0.559 -14.155 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 37.956 -2.527 -11.339 1.00 0.00 H new ATOM 0 HH2 TRP B 57 39.539 -0.813 -12.175 1.00 0.00 H new ATOM 1918 N VAL B 58 33.443 -0.371 -12.207 1.00 0.00 N ATOM 1919 CA VAL B 58 33.665 -0.222 -10.738 1.00 0.00 C ATOM 1920 C VAL B 58 32.346 0.109 -10.037 1.00 0.00 C ATOM 1921 O VAL B 58 31.894 -0.634 -9.200 1.00 0.00 O ATOM 1922 CB VAL B 58 34.679 0.882 -10.465 1.00 0.00 C ATOM 1923 CG1 VAL B 58 34.845 1.039 -8.950 1.00 0.00 C ATOM 1924 CG2 VAL B 58 36.017 0.492 -11.091 1.00 0.00 C ATOM 0 H VAL B 58 33.837 0.367 -12.791 1.00 0.00 H new ATOM 0 HA VAL B 58 34.052 -1.164 -10.350 1.00 0.00 H new ATOM 0 HB VAL B 58 34.337 1.824 -10.894 1.00 0.00 H new ATOM 0 HG11 VAL B 58 35.569 1.827 -8.743 1.00 0.00 H new ATOM 0 HG12 VAL B 58 33.886 1.301 -8.504 1.00 0.00 H new ATOM 0 HG13 VAL B 58 35.199 0.100 -8.524 1.00 0.00 H new ATOM 0 HG21 VAL B 58 36.750 1.276 -10.901 1.00 0.00 H new ATOM 0 HG22 VAL B 58 36.365 -0.444 -10.653 1.00 0.00 H new ATOM 0 HG23 VAL B 58 35.892 0.365 -12.166 1.00 0.00 H new ATOM 1934 N GLN B 59 31.731 1.218 -10.368 1.00 0.00 N ATOM 1935 CA GLN B 59 30.435 1.597 -9.721 1.00 0.00 C ATOM 1936 C GLN B 59 29.636 0.337 -9.382 1.00 0.00 C ATOM 1937 O GLN B 59 28.981 0.256 -8.362 1.00 0.00 O ATOM 1938 CB GLN B 59 29.626 2.445 -10.697 1.00 0.00 C ATOM 1939 CG GLN B 59 30.239 3.843 -10.795 1.00 0.00 C ATOM 1940 CD GLN B 59 29.336 4.848 -10.077 1.00 0.00 C ATOM 1941 OE1 GLN B 59 28.224 5.096 -10.502 1.00 0.00 O ATOM 1942 NE2 GLN B 59 29.770 5.443 -9.000 1.00 0.00 N ATOM 0 H GLN B 59 32.073 1.882 -11.063 1.00 0.00 H new ATOM 0 HA GLN B 59 30.636 2.156 -8.807 1.00 0.00 H new ATOM 0 HB2 GLN B 59 29.613 1.973 -11.680 1.00 0.00 H new ATOM 0 HB3 GLN B 59 28.591 2.514 -10.363 1.00 0.00 H new ATOM 0 HG2 GLN B 59 31.233 3.848 -10.348 1.00 0.00 H new ATOM 0 HG3 GLN B 59 30.358 4.127 -11.841 1.00 0.00 H new ATOM 0 HE21 GLN B 59 30.703 5.235 -8.643 1.00 0.00 H new ATOM 0 HE22 GLN B 59 29.177 6.116 -8.515 1.00 0.00 H new ATOM 1951 N LYS B 60 29.711 -0.653 -10.228 1.00 0.00 N ATOM 1952 CA LYS B 60 28.986 -1.925 -9.962 1.00 0.00 C ATOM 1953 C LYS B 60 29.717 -2.675 -8.852 1.00 0.00 C ATOM 1954 O LYS B 60 29.129 -3.102 -7.879 1.00 0.00 O ATOM 1955 CB LYS B 60 28.981 -2.785 -11.240 1.00 0.00 C ATOM 1956 CG LYS B 60 28.647 -4.254 -10.915 1.00 0.00 C ATOM 1957 CD LYS B 60 27.167 -4.517 -11.204 1.00 0.00 C ATOM 1958 CE LYS B 60 26.457 -4.916 -9.909 1.00 0.00 C ATOM 1959 NZ LYS B 60 25.019 -5.192 -10.192 1.00 0.00 N ATOM 0 H LYS B 60 30.246 -0.634 -11.096 1.00 0.00 H new ATOM 0 HA LYS B 60 27.959 -1.717 -9.662 1.00 0.00 H new ATOM 0 HB2 LYS B 60 28.251 -2.390 -11.946 1.00 0.00 H new ATOM 0 HB3 LYS B 60 29.956 -2.728 -11.725 1.00 0.00 H new ATOM 0 HG2 LYS B 60 29.269 -4.920 -11.513 1.00 0.00 H new ATOM 0 HG3 LYS B 60 28.867 -4.465 -9.869 1.00 0.00 H new ATOM 0 HD2 LYS B 60 26.704 -3.625 -11.625 1.00 0.00 H new ATOM 0 HD3 LYS B 60 27.066 -5.309 -11.946 1.00 0.00 H new ATOM 0 HE2 LYS B 60 26.930 -5.800 -9.480 1.00 0.00 H new ATOM 0 HE3 LYS B 60 26.546 -4.118 -9.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 24.538 -5.463 -9.311 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 24.572 -4.338 -10.582 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 24.943 -5.968 -10.881 1.00 0.00 H new ATOM 1973 N TYR B 61 30.994 -2.868 -9.014 1.00 0.00 N ATOM 1974 CA TYR B 61 31.769 -3.630 -7.990 1.00 0.00 C ATOM 1975 C TYR B 61 31.866 -2.806 -6.698 1.00 0.00 C ATOM 1976 O TYR B 61 31.372 -3.207 -5.663 1.00 0.00 O ATOM 1977 CB TYR B 61 33.165 -3.964 -8.540 1.00 0.00 C ATOM 1978 CG TYR B 61 33.086 -4.302 -10.008 1.00 0.00 C ATOM 1979 CD1 TYR B 61 31.868 -4.656 -10.603 1.00 0.00 C ATOM 1980 CD2 TYR B 61 34.241 -4.235 -10.781 1.00 0.00 C ATOM 1981 CE1 TYR B 61 31.811 -4.932 -11.963 1.00 0.00 C ATOM 1982 CE2 TYR B 61 34.185 -4.524 -12.141 1.00 0.00 C ATOM 1983 CZ TYR B 61 32.969 -4.871 -12.739 1.00 0.00 C ATOM 1984 OH TYR B 61 32.911 -5.141 -14.091 1.00 0.00 O ATOM 0 H TYR B 61 31.537 -2.533 -9.809 1.00 0.00 H new ATOM 0 HA TYR B 61 31.259 -4.566 -7.762 1.00 0.00 H new ATOM 0 HB2 TYR B 61 33.834 -3.116 -8.391 1.00 0.00 H new ATOM 0 HB3 TYR B 61 33.588 -4.804 -7.989 1.00 0.00 H new ATOM 0 HD1 TYR B 61 30.972 -4.714 -10.003 1.00 0.00 H new ATOM 0 HD2 TYR B 61 35.181 -3.959 -10.326 1.00 0.00 H new ATOM 0 HE1 TYR B 61 30.869 -5.194 -12.421 1.00 0.00 H new ATOM 0 HE2 TYR B 61 35.084 -4.480 -12.737 1.00 0.00 H new ATOM 0 HH TYR B 61 32.029 -4.891 -14.437 1.00 0.00 H new ATOM 1994 N VAL B 62 32.471 -1.651 -6.752 1.00 0.00 N ATOM 1995 CA VAL B 62 32.571 -0.793 -5.538 1.00 0.00 C ATOM 1996 C VAL B 62 31.157 -0.452 -5.049 1.00 0.00 C ATOM 1997 O VAL B 62 30.974 0.044 -3.955 1.00 0.00 O ATOM 1998 CB VAL B 62 33.323 0.495 -5.907 1.00 0.00 C ATOM 1999 CG1 VAL B 62 32.977 1.618 -4.924 1.00 0.00 C ATOM 2000 CG2 VAL B 62 34.829 0.230 -5.865 1.00 0.00 C ATOM 0 H VAL B 62 32.903 -1.263 -7.591 1.00 0.00 H new ATOM 0 HA VAL B 62 33.108 -1.315 -4.746 1.00 0.00 H new ATOM 0 HB VAL B 62 33.026 0.802 -6.910 1.00 0.00 H new ATOM 0 HG11 VAL B 62 33.518 2.523 -5.200 1.00 0.00 H new ATOM 0 HG12 VAL B 62 31.905 1.812 -4.956 1.00 0.00 H new ATOM 0 HG13 VAL B 62 33.261 1.319 -3.915 1.00 0.00 H new ATOM 0 HG21 VAL B 62 35.366 1.142 -6.126 1.00 0.00 H new ATOM 0 HG22 VAL B 62 35.115 -0.085 -4.861 1.00 0.00 H new ATOM 0 HG23 VAL B 62 35.080 -0.556 -6.577 1.00 0.00 H new ATOM 2010 N SER B 63 30.162 -0.703 -5.862 1.00 0.00 N ATOM 2011 CA SER B 63 28.757 -0.387 -5.471 1.00 0.00 C ATOM 2012 C SER B 63 28.538 -0.655 -3.978 1.00 0.00 C ATOM 2013 O SER B 63 27.948 0.145 -3.279 1.00 0.00 O ATOM 2014 CB SER B 63 27.795 -1.257 -6.281 1.00 0.00 C ATOM 2015 OG SER B 63 26.507 -0.654 -6.286 1.00 0.00 O ATOM 0 H SER B 63 30.266 -1.117 -6.788 1.00 0.00 H new ATOM 0 HA SER B 63 28.570 0.668 -5.672 1.00 0.00 H new ATOM 0 HB2 SER B 63 28.160 -1.370 -7.302 1.00 0.00 H new ATOM 0 HB3 SER B 63 27.740 -2.257 -5.850 1.00 0.00 H new ATOM 0 HG SER B 63 25.888 -1.208 -6.806 1.00 0.00 H new