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: A 13 SER OG : rot 129:sc= 1.12 USER MOD Set 1.2: B 6 THR OG1 : rot 170:sc= -3.38! USER MOD Set 2.1: A 6 THR OG1 : rot 172:sc= -2.82! USER MOD Set 2.2: B 13 SER OG : rot 153:sc= 1.14 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= -2.57 USER MOD Single : A 15 THR OG1 : rot -115:sc= 0.138 USER MOD Single : A 16 SER OG : rot 180:sc= 0.0399 USER MOD Single : A 18 GLN : amide:sc= -3.29! C(o=-3.3!,f=-3!) USER MOD Single : A 21 GLN : amide:sc= -0.939 K(o=-0.94,f=-0.051) USER MOD Single : A 22 ASN : amide:sc= -3.15! C(o=-3.2!,f=-12!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 11:sc= -8.07! USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.121 X(o=-0.12,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0927) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -175:sc= 0.452 (180deg=0.44) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -13.4! C(o=-13!,f=-11!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -4.06! C(o=-4.1!,f=-2.5!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 167:sc= -2.66! USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 TYR OH : rot 180:sc= -2.55 USER MOD Single : B 15 THR OG1 : rot -116:sc= 0.137 USER MOD Single : B 16 SER OG : rot 180:sc= 0.0487 USER MOD Single : B 18 GLN : amide:sc= -3.31! C(o=-3.3!,f=-3!) USER MOD Single : B 21 GLN : amide:sc= -0.963 K(o=-0.96,f=-0.063) USER MOD Single : B 22 ASN : amide:sc= -3.13! C(o=-3.1!,f=-11!) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 16:sc= -8.02! USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -0.187 X(o=-0.19,f=0) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0849) USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ -174:sc= 0.447 (180deg=0.436) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -12.4! C(o=-12!,f=-11!) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 GLN : amide:sc= -4.11! C(o=-4.1!,f=-2.5!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 169:sc= -2.63! USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ASP A 5 48.146 -0.119 -8.099 1.00 0.00 N ATOM 54 CA ASP A 5 49.453 -0.515 -8.693 1.00 0.00 C ATOM 55 C ASP A 5 50.079 0.676 -9.423 1.00 0.00 C ATOM 56 O ASP A 5 51.244 0.661 -9.766 1.00 0.00 O ATOM 57 CB ASP A 5 49.217 -1.651 -9.693 1.00 0.00 C ATOM 58 CG ASP A 5 50.472 -2.520 -9.787 1.00 0.00 C ATOM 59 OD1 ASP A 5 51.510 -2.084 -9.316 1.00 0.00 O ATOM 60 OD2 ASP A 5 50.375 -3.609 -10.331 1.00 0.00 O ATOM 0 HA ASP A 5 50.127 -0.842 -7.902 1.00 0.00 H new ATOM 0 HB2 ASP A 5 48.366 -2.256 -9.378 1.00 0.00 H new ATOM 0 HB3 ASP A 5 48.972 -1.241 -10.673 1.00 0.00 H new ATOM 65 N THR A 6 49.309 1.695 -9.691 1.00 0.00 N ATOM 66 CA THR A 6 49.856 2.868 -10.429 1.00 0.00 C ATOM 67 C THR A 6 50.239 4.057 -9.506 1.00 0.00 C ATOM 68 O THR A 6 51.077 4.849 -9.890 1.00 0.00 O ATOM 69 CB THR A 6 48.826 3.312 -11.477 1.00 0.00 C ATOM 70 OG1 THR A 6 49.496 3.981 -12.534 1.00 0.00 O ATOM 71 CG2 THR A 6 47.778 4.247 -10.859 1.00 0.00 C ATOM 0 H THR A 6 48.325 1.766 -9.431 1.00 0.00 H new ATOM 0 HA THR A 6 50.784 2.554 -10.906 1.00 0.00 H new ATOM 0 HB THR A 6 48.313 2.429 -11.857 1.00 0.00 H new ATOM 0 HG1 THR A 6 48.865 4.152 -13.264 1.00 0.00 H new ATOM 0 HG21 THR A 6 47.061 4.546 -11.624 1.00 0.00 H new ATOM 0 HG22 THR A 6 47.256 3.728 -10.055 1.00 0.00 H new ATOM 0 HG23 THR A 6 48.272 5.132 -10.458 1.00 0.00 H new ATOM 79 N PRO A 7 49.634 4.187 -8.336 1.00 0.00 N ATOM 80 CA PRO A 7 49.950 5.308 -7.425 1.00 0.00 C ATOM 81 C PRO A 7 51.268 5.058 -6.684 1.00 0.00 C ATOM 82 O PRO A 7 52.069 4.233 -7.078 1.00 0.00 O ATOM 83 CB PRO A 7 48.771 5.329 -6.448 1.00 0.00 C ATOM 84 CG PRO A 7 48.155 3.914 -6.484 1.00 0.00 C ATOM 85 CD PRO A 7 48.611 3.265 -7.804 1.00 0.00 C ATOM 0 HA PRO A 7 50.079 6.254 -7.952 1.00 0.00 H new ATOM 0 HB2 PRO A 7 49.104 5.583 -5.442 1.00 0.00 H new ATOM 0 HB3 PRO A 7 48.037 6.080 -6.740 1.00 0.00 H new ATOM 0 HG2 PRO A 7 48.487 3.326 -5.629 1.00 0.00 H new ATOM 0 HG3 PRO A 7 47.067 3.964 -6.433 1.00 0.00 H new ATOM 0 HD2 PRO A 7 49.023 2.270 -7.635 1.00 0.00 H new ATOM 0 HD3 PRO A 7 47.779 3.152 -8.499 1.00 0.00 H new ATOM 93 N THR A 8 51.503 5.774 -5.616 1.00 0.00 N ATOM 94 CA THR A 8 52.772 5.586 -4.851 1.00 0.00 C ATOM 95 C THR A 8 52.450 5.308 -3.378 1.00 0.00 C ATOM 96 O THR A 8 51.425 5.716 -2.867 1.00 0.00 O ATOM 97 CB THR A 8 53.619 6.861 -4.969 1.00 0.00 C ATOM 98 OG1 THR A 8 54.235 6.898 -6.249 1.00 0.00 O ATOM 99 CG2 THR A 8 54.698 6.877 -3.884 1.00 0.00 C ATOM 0 H THR A 8 50.871 6.481 -5.240 1.00 0.00 H new ATOM 0 HA THR A 8 53.327 4.740 -5.257 1.00 0.00 H new ATOM 0 HB THR A 8 52.975 7.732 -4.843 1.00 0.00 H new ATOM 0 HG1 THR A 8 54.775 7.712 -6.329 1.00 0.00 H new ATOM 0 HG21 THR A 8 55.293 7.785 -3.976 1.00 0.00 H new ATOM 0 HG22 THR A 8 54.227 6.850 -2.902 1.00 0.00 H new ATOM 0 HG23 THR A 8 55.344 6.007 -4.000 1.00 0.00 H new ATOM 107 N ALA A 9 53.321 4.614 -2.691 1.00 0.00 N ATOM 108 CA ALA A 9 53.068 4.307 -1.253 1.00 0.00 C ATOM 109 C ALA A 9 53.946 5.202 -0.374 1.00 0.00 C ATOM 110 O ALA A 9 55.140 5.306 -0.578 1.00 0.00 O ATOM 111 CB ALA A 9 53.413 2.841 -0.972 1.00 0.00 C ATOM 0 H ALA A 9 54.196 4.247 -3.065 1.00 0.00 H new ATOM 0 HA ALA A 9 52.017 4.488 -1.029 1.00 0.00 H new ATOM 0 HB1 ALA A 9 53.228 2.619 0.079 1.00 0.00 H new ATOM 0 HB2 ALA A 9 52.793 2.196 -1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 9 54.464 2.664 -1.200 1.00 0.00 H new ATOM 117 N CYS A 10 53.368 5.844 0.603 1.00 0.00 N ATOM 118 CA CYS A 10 54.176 6.725 1.496 1.00 0.00 C ATOM 119 C CYS A 10 54.185 6.143 2.909 1.00 0.00 C ATOM 120 O CYS A 10 53.400 5.277 3.241 1.00 0.00 O ATOM 121 CB CYS A 10 53.558 8.125 1.540 1.00 0.00 C ATOM 122 SG CYS A 10 53.376 8.768 -0.141 1.00 0.00 S ATOM 0 H CYS A 10 52.373 5.798 0.822 1.00 0.00 H new ATOM 0 HA CYS A 10 55.194 6.787 1.111 1.00 0.00 H new ATOM 0 HB2 CYS A 10 52.586 8.088 2.032 1.00 0.00 H new ATOM 0 HB3 CYS A 10 54.188 8.792 2.128 1.00 0.00 H new ATOM 127 N CYS A 11 55.056 6.624 3.751 1.00 0.00 N ATOM 128 CA CYS A 11 55.102 6.117 5.146 1.00 0.00 C ATOM 129 C CYS A 11 54.579 7.218 6.068 1.00 0.00 C ATOM 130 O CYS A 11 55.337 7.974 6.637 1.00 0.00 O ATOM 131 CB CYS A 11 56.547 5.769 5.517 1.00 0.00 C ATOM 132 SG CYS A 11 56.635 5.341 7.271 1.00 0.00 S ATOM 0 H CYS A 11 55.739 7.349 3.530 1.00 0.00 H new ATOM 0 HA CYS A 11 54.490 5.221 5.247 1.00 0.00 H new ATOM 0 HB2 CYS A 11 56.898 4.934 4.910 1.00 0.00 H new ATOM 0 HB3 CYS A 11 57.201 6.615 5.305 1.00 0.00 H new ATOM 137 N PHE A 12 53.287 7.329 6.200 1.00 0.00 N ATOM 138 CA PHE A 12 52.716 8.396 7.066 1.00 0.00 C ATOM 139 C PHE A 12 52.444 7.841 8.460 1.00 0.00 C ATOM 140 O PHE A 12 51.971 8.541 9.332 1.00 0.00 O ATOM 141 CB PHE A 12 51.398 8.893 6.462 1.00 0.00 C ATOM 142 CG PHE A 12 51.665 9.710 5.216 1.00 0.00 C ATOM 143 CD1 PHE A 12 52.949 9.749 4.655 1.00 0.00 C ATOM 144 CD2 PHE A 12 50.621 10.428 4.624 1.00 0.00 C ATOM 145 CE1 PHE A 12 53.184 10.507 3.501 1.00 0.00 C ATOM 146 CE2 PHE A 12 50.857 11.185 3.471 1.00 0.00 C ATOM 147 CZ PHE A 12 52.138 11.226 2.909 1.00 0.00 C ATOM 0 H PHE A 12 52.602 6.726 5.745 1.00 0.00 H new ATOM 0 HA PHE A 12 53.428 9.219 7.133 1.00 0.00 H new ATOM 0 HB2 PHE A 12 50.759 8.044 6.218 1.00 0.00 H new ATOM 0 HB3 PHE A 12 50.860 9.497 7.193 1.00 0.00 H new ATOM 0 HD1 PHE A 12 53.756 9.195 5.112 1.00 0.00 H new ATOM 0 HD2 PHE A 12 49.632 10.398 5.057 1.00 0.00 H new ATOM 0 HE1 PHE A 12 54.173 10.537 3.067 1.00 0.00 H new ATOM 0 HE2 PHE A 12 50.050 11.738 3.014 1.00 0.00 H new ATOM 0 HZ PHE A 12 52.320 11.811 2.020 1.00 0.00 H new ATOM 157 N SER A 13 52.719 6.587 8.679 1.00 0.00 N ATOM 158 CA SER A 13 52.450 6.011 10.020 1.00 0.00 C ATOM 159 C SER A 13 53.634 5.158 10.474 1.00 0.00 C ATOM 160 O SER A 13 54.165 4.377 9.718 1.00 0.00 O ATOM 161 CB SER A 13 51.200 5.138 9.941 1.00 0.00 C ATOM 162 OG SER A 13 50.049 5.972 9.893 1.00 0.00 O ATOM 0 H SER A 13 53.114 5.943 7.994 1.00 0.00 H new ATOM 0 HA SER A 13 52.301 6.819 10.737 1.00 0.00 H new ATOM 0 HB2 SER A 13 51.241 4.503 9.056 1.00 0.00 H new ATOM 0 HB3 SER A 13 51.149 4.477 10.806 1.00 0.00 H new ATOM 0 HG SER A 13 49.483 5.706 9.139 1.00 0.00 H new ATOM 168 N TYR A 14 54.034 5.290 11.712 1.00 0.00 N ATOM 169 CA TYR A 14 55.169 4.466 12.227 1.00 0.00 C ATOM 170 C TYR A 14 54.761 3.864 13.573 1.00 0.00 C ATOM 171 O TYR A 14 53.762 4.242 14.151 1.00 0.00 O ATOM 172 CB TYR A 14 56.433 5.319 12.410 1.00 0.00 C ATOM 173 CG TYR A 14 56.302 6.630 11.671 1.00 0.00 C ATOM 174 CD1 TYR A 14 56.326 6.647 10.273 1.00 0.00 C ATOM 175 CD2 TYR A 14 56.164 7.827 12.384 1.00 0.00 C ATOM 176 CE1 TYR A 14 56.212 7.861 9.585 1.00 0.00 C ATOM 177 CE2 TYR A 14 56.050 9.043 11.697 1.00 0.00 C ATOM 178 CZ TYR A 14 56.074 9.059 10.297 1.00 0.00 C ATOM 179 OH TYR A 14 55.963 10.256 9.620 1.00 0.00 O ATOM 0 H TYR A 14 53.624 5.933 12.389 1.00 0.00 H new ATOM 0 HA TYR A 14 55.393 3.680 11.506 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.600 5.508 13.470 1.00 0.00 H new ATOM 0 HB3 TYR A 14 57.302 4.774 12.043 1.00 0.00 H new ATOM 0 HD1 TYR A 14 56.433 5.723 9.724 1.00 0.00 H new ATOM 0 HD2 TYR A 14 56.145 7.813 13.464 1.00 0.00 H new ATOM 0 HE1 TYR A 14 56.230 7.874 8.505 1.00 0.00 H new ATOM 0 HE2 TYR A 14 55.944 9.967 12.247 1.00 0.00 H new ATOM 0 HH TYR A 14 55.874 10.989 10.264 1.00 0.00 H new ATOM 189 N THR A 15 55.515 2.925 14.077 1.00 0.00 N ATOM 190 CA THR A 15 55.144 2.305 15.383 1.00 0.00 C ATOM 191 C THR A 15 55.999 2.886 16.511 1.00 0.00 C ATOM 192 O THR A 15 57.157 3.202 16.324 1.00 0.00 O ATOM 193 CB THR A 15 55.363 0.793 15.315 1.00 0.00 C ATOM 194 OG1 THR A 15 55.031 0.213 16.569 1.00 0.00 O ATOM 195 CG2 THR A 15 56.828 0.502 14.988 1.00 0.00 C ATOM 0 H THR A 15 56.365 2.562 13.646 1.00 0.00 H new ATOM 0 HA THR A 15 54.094 2.519 15.584 1.00 0.00 H new ATOM 0 HB THR A 15 54.729 0.367 14.537 1.00 0.00 H new ATOM 0 HG1 THR A 15 55.836 -0.172 16.975 1.00 0.00 H new ATOM 0 HG21 THR A 15 56.983 -0.576 14.940 1.00 0.00 H new ATOM 0 HG22 THR A 15 57.082 0.948 14.027 1.00 0.00 H new ATOM 0 HG23 THR A 15 57.465 0.926 15.764 1.00 0.00 H new ATOM 203 N SER A 16 55.443 3.005 17.686 1.00 0.00 N ATOM 204 CA SER A 16 56.231 3.538 18.830 1.00 0.00 C ATOM 205 C SER A 16 57.260 2.483 19.230 1.00 0.00 C ATOM 206 O SER A 16 58.399 2.787 19.528 1.00 0.00 O ATOM 207 CB SER A 16 55.302 3.826 20.010 1.00 0.00 C ATOM 208 OG SER A 16 54.317 2.806 20.091 1.00 0.00 O ATOM 0 H SER A 16 54.478 2.756 17.902 1.00 0.00 H new ATOM 0 HA SER A 16 56.730 4.464 18.545 1.00 0.00 H new ATOM 0 HB2 SER A 16 55.875 3.869 20.936 1.00 0.00 H new ATOM 0 HB3 SER A 16 54.826 4.798 19.884 1.00 0.00 H new ATOM 0 HG SER A 16 53.721 2.986 20.847 1.00 0.00 H new ATOM 214 N ARG A 17 56.870 1.237 19.215 1.00 0.00 N ATOM 215 CA ARG A 17 57.821 0.150 19.567 1.00 0.00 C ATOM 216 C ARG A 17 58.496 -0.326 18.280 1.00 0.00 C ATOM 217 O ARG A 17 57.866 -0.896 17.413 1.00 0.00 O ATOM 218 CB ARG A 17 57.066 -1.014 20.211 1.00 0.00 C ATOM 219 CG ARG A 17 57.828 -1.492 21.448 1.00 0.00 C ATOM 220 CD ARG A 17 57.546 -2.977 21.677 1.00 0.00 C ATOM 221 NE ARG A 17 58.522 -3.522 22.664 1.00 0.00 N ATOM 222 CZ ARG A 17 59.732 -3.828 22.283 1.00 0.00 C ATOM 223 NH1 ARG A 17 59.916 -4.655 21.291 1.00 0.00 N ATOM 224 NH2 ARG A 17 60.759 -3.307 22.896 1.00 0.00 N ATOM 0 H ARG A 17 55.929 0.926 18.973 1.00 0.00 H new ATOM 0 HA ARG A 17 58.565 0.517 20.274 1.00 0.00 H new ATOM 0 HB2 ARG A 17 56.060 -0.700 20.489 1.00 0.00 H new ATOM 0 HB3 ARG A 17 56.959 -1.831 19.498 1.00 0.00 H new ATOM 0 HG2 ARG A 17 58.898 -1.330 21.315 1.00 0.00 H new ATOM 0 HG3 ARG A 17 57.525 -0.914 22.321 1.00 0.00 H new ATOM 0 HD2 ARG A 17 56.528 -3.113 22.043 1.00 0.00 H new ATOM 0 HD3 ARG A 17 57.622 -3.522 20.736 1.00 0.00 H new ATOM 0 HE ARG A 17 58.244 -3.656 23.636 1.00 0.00 H new ATOM 0 HH11 ARG A 17 59.113 -5.063 20.812 1.00 0.00 H new ATOM 0 HH12 ARG A 17 60.862 -4.893 20.994 1.00 0.00 H new ATOM 0 HH21 ARG A 17 60.616 -2.661 23.672 1.00 0.00 H new ATOM 0 HH22 ARG A 17 61.705 -3.546 22.599 1.00 0.00 H new ATOM 238 N GLN A 18 59.764 -0.074 18.138 1.00 0.00 N ATOM 239 CA GLN A 18 60.467 -0.487 16.899 1.00 0.00 C ATOM 240 C GLN A 18 60.347 -1.979 16.660 1.00 0.00 C ATOM 241 O GLN A 18 59.498 -2.663 17.197 1.00 0.00 O ATOM 242 CB GLN A 18 61.935 -0.124 16.986 1.00 0.00 C ATOM 243 CG GLN A 18 62.121 1.219 17.703 1.00 0.00 C ATOM 244 CD GLN A 18 61.048 2.213 17.248 1.00 0.00 C ATOM 245 OE1 GLN A 18 60.632 3.065 18.007 1.00 0.00 O ATOM 246 NE2 GLN A 18 60.581 2.138 16.033 1.00 0.00 N ATOM 0 H GLN A 18 60.344 0.401 18.829 1.00 0.00 H new ATOM 0 HA GLN A 18 59.997 0.040 16.068 1.00 0.00 H new ATOM 0 HB2 GLN A 18 62.477 -0.905 17.520 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.361 -0.069 15.984 1.00 0.00 H new ATOM 0 HG2 GLN A 18 62.060 1.075 18.782 1.00 0.00 H new ATOM 0 HG3 GLN A 18 63.112 1.619 17.490 1.00 0.00 H new ATOM 0 HE21 GLN A 18 60.930 1.422 15.396 1.00 0.00 H new ATOM 0 HE22 GLN A 18 59.866 2.795 15.720 1.00 0.00 H new ATOM 255 N ILE A 19 61.213 -2.464 15.835 1.00 0.00 N ATOM 256 CA ILE A 19 61.244 -3.886 15.478 1.00 0.00 C ATOM 257 C ILE A 19 62.709 -4.258 15.291 1.00 0.00 C ATOM 258 O ILE A 19 63.322 -3.884 14.312 1.00 0.00 O ATOM 259 CB ILE A 19 60.495 -4.117 14.166 1.00 0.00 C ATOM 260 CG1 ILE A 19 60.407 -2.812 13.371 1.00 0.00 C ATOM 261 CG2 ILE A 19 59.088 -4.617 14.465 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.593 -3.045 12.096 1.00 0.00 C ATOM 0 H ILE A 19 61.931 -1.904 15.376 1.00 0.00 H new ATOM 0 HA ILE A 19 60.771 -4.489 16.253 1.00 0.00 H new ATOM 0 HB ILE A 19 61.035 -4.859 13.578 1.00 0.00 H new ATOM 0 HG12 ILE A 19 59.940 -2.036 13.977 1.00 0.00 H new ATOM 0 HG13 ILE A 19 61.407 -2.460 13.118 1.00 0.00 H new ATOM 0 HG21 ILE A 19 58.554 -4.782 13.529 1.00 0.00 H new ATOM 0 HG22 ILE A 19 59.145 -5.553 15.020 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.557 -3.874 15.060 1.00 0.00 H new ATOM 0 HD11 ILE A 19 59.530 -2.116 11.530 1.00 0.00 H new ATOM 0 HD12 ILE A 19 60.079 -3.808 11.488 1.00 0.00 H new ATOM 0 HD13 ILE A 19 58.589 -3.377 12.361 1.00 0.00 H new ATOM 274 N PRO A 20 63.227 -4.970 16.239 1.00 0.00 N ATOM 275 CA PRO A 20 64.630 -5.400 16.222 1.00 0.00 C ATOM 276 C PRO A 20 64.869 -6.370 15.067 1.00 0.00 C ATOM 277 O PRO A 20 64.011 -7.156 14.719 1.00 0.00 O ATOM 278 CB PRO A 20 64.817 -6.046 17.599 1.00 0.00 C ATOM 279 CG PRO A 20 63.400 -6.400 18.096 1.00 0.00 C ATOM 280 CD PRO A 20 62.455 -5.438 17.400 1.00 0.00 C ATOM 0 HA PRO A 20 65.345 -4.594 16.060 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.441 -6.937 17.531 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.313 -5.362 18.287 1.00 0.00 H new ATOM 0 HG2 PRO A 20 63.150 -7.433 17.856 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.331 -6.299 19.179 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.533 -5.933 17.095 1.00 0.00 H new ATOM 0 HD3 PRO A 20 62.172 -4.612 18.052 1.00 0.00 H new ATOM 288 N GLN A 21 66.022 -6.283 14.455 1.00 0.00 N ATOM 289 CA GLN A 21 66.348 -7.162 13.292 1.00 0.00 C ATOM 290 C GLN A 21 65.706 -8.545 13.466 1.00 0.00 C ATOM 291 O GLN A 21 65.353 -9.195 12.502 1.00 0.00 O ATOM 292 CB GLN A 21 67.870 -7.319 13.194 1.00 0.00 C ATOM 293 CG GLN A 21 68.470 -6.137 12.425 1.00 0.00 C ATOM 294 CD GLN A 21 69.621 -6.634 11.549 1.00 0.00 C ATOM 295 OE1 GLN A 21 69.405 -7.358 10.598 1.00 0.00 O ATOM 296 NE2 GLN A 21 70.842 -6.275 11.833 1.00 0.00 N ATOM 0 H GLN A 21 66.762 -5.631 14.716 1.00 0.00 H new ATOM 0 HA GLN A 21 65.957 -6.706 12.383 1.00 0.00 H new ATOM 0 HB2 GLN A 21 68.304 -7.372 14.193 1.00 0.00 H new ATOM 0 HB3 GLN A 21 68.116 -8.254 12.690 1.00 0.00 H new ATOM 0 HG2 GLN A 21 67.706 -5.665 11.808 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.829 -5.380 13.122 1.00 0.00 H new ATOM 0 HE21 GLN A 21 71.022 -5.667 12.632 1.00 0.00 H new ATOM 0 HE22 GLN A 21 71.617 -6.602 11.256 1.00 0.00 H new ATOM 305 N ASN A 22 65.548 -9.001 14.679 1.00 0.00 N ATOM 306 CA ASN A 22 64.922 -10.340 14.895 1.00 0.00 C ATOM 307 C ASN A 22 63.396 -10.199 14.946 1.00 0.00 C ATOM 308 O ASN A 22 62.727 -10.879 15.696 1.00 0.00 O ATOM 309 CB ASN A 22 65.420 -10.940 16.213 1.00 0.00 C ATOM 310 CG ASN A 22 65.498 -9.848 17.281 1.00 0.00 C ATOM 311 OD1 ASN A 22 64.704 -8.928 17.286 1.00 0.00 O ATOM 312 ND2 ASN A 22 66.430 -9.910 18.193 1.00 0.00 N ATOM 0 H ASN A 22 65.824 -8.507 15.528 1.00 0.00 H new ATOM 0 HA ASN A 22 65.198 -10.997 14.070 1.00 0.00 H new ATOM 0 HB2 ASN A 22 64.748 -11.733 16.539 1.00 0.00 H new ATOM 0 HB3 ASN A 22 66.401 -11.392 16.070 1.00 0.00 H new ATOM 0 HD21 ASN A 22 66.492 -9.186 18.909 1.00 0.00 H new ATOM 0 HD22 ASN A 22 67.097 -10.682 18.189 1.00 0.00 H new ATOM 319 N PHE A 23 62.843 -9.324 14.151 1.00 0.00 N ATOM 320 CA PHE A 23 61.365 -9.139 14.148 1.00 0.00 C ATOM 321 C PHE A 23 60.974 -8.372 12.888 1.00 0.00 C ATOM 322 O PHE A 23 59.984 -7.669 12.858 1.00 0.00 O ATOM 323 CB PHE A 23 60.949 -8.325 15.375 1.00 0.00 C ATOM 324 CG PHE A 23 59.669 -8.879 15.946 1.00 0.00 C ATOM 325 CD1 PHE A 23 58.580 -9.135 15.104 1.00 0.00 C ATOM 326 CD2 PHE A 23 59.568 -9.132 17.318 1.00 0.00 C ATOM 327 CE1 PHE A 23 57.390 -9.644 15.635 1.00 0.00 C ATOM 328 CE2 PHE A 23 58.380 -9.640 17.850 1.00 0.00 C ATOM 329 CZ PHE A 23 57.289 -9.897 17.009 1.00 0.00 C ATOM 0 H PHE A 23 63.354 -8.727 13.501 1.00 0.00 H new ATOM 0 HA PHE A 23 60.870 -10.110 14.171 1.00 0.00 H new ATOM 0 HB2 PHE A 23 61.737 -8.356 16.128 1.00 0.00 H new ATOM 0 HB3 PHE A 23 60.812 -7.279 15.100 1.00 0.00 H new ATOM 0 HD1 PHE A 23 58.659 -8.940 14.045 1.00 0.00 H new ATOM 0 HD2 PHE A 23 60.409 -8.935 17.967 1.00 0.00 H new ATOM 0 HE1 PHE A 23 56.550 -9.842 14.986 1.00 0.00 H new ATOM 0 HE2 PHE A 23 58.303 -9.835 18.910 1.00 0.00 H new ATOM 0 HZ PHE A 23 56.371 -10.290 17.420 1.00 0.00 H new ATOM 339 N ILE A 24 61.763 -8.477 11.855 1.00 0.00 N ATOM 340 CA ILE A 24 61.457 -7.729 10.612 1.00 0.00 C ATOM 341 C ILE A 24 61.745 -8.601 9.390 1.00 0.00 C ATOM 342 O ILE A 24 62.226 -9.711 9.495 1.00 0.00 O ATOM 343 CB ILE A 24 62.340 -6.471 10.605 1.00 0.00 C ATOM 344 CG1 ILE A 24 61.460 -5.235 10.737 1.00 0.00 C ATOM 345 CG2 ILE A 24 63.176 -6.350 9.319 1.00 0.00 C ATOM 346 CD1 ILE A 24 62.363 -4.014 10.810 1.00 0.00 C ATOM 0 H ILE A 24 62.606 -9.050 11.821 1.00 0.00 H new ATOM 0 HA ILE A 24 60.404 -7.450 10.575 1.00 0.00 H new ATOM 0 HB ILE A 24 63.028 -6.552 11.446 1.00 0.00 H new ATOM 0 HG12 ILE A 24 60.784 -5.157 9.886 1.00 0.00 H new ATOM 0 HG13 ILE A 24 60.840 -5.303 11.631 1.00 0.00 H new ATOM 0 HG21 ILE A 24 63.782 -5.445 9.363 1.00 0.00 H new ATOM 0 HG22 ILE A 24 63.827 -7.219 9.225 1.00 0.00 H new ATOM 0 HG23 ILE A 24 62.512 -6.300 8.456 1.00 0.00 H new ATOM 0 HD11 ILE A 24 61.753 -3.116 10.905 1.00 0.00 H new ATOM 0 HD12 ILE A 24 63.021 -4.099 11.675 1.00 0.00 H new ATOM 0 HD13 ILE A 24 62.963 -3.951 9.902 1.00 0.00 H new ATOM 358 N ALA A 25 61.464 -8.081 8.231 1.00 0.00 N ATOM 359 CA ALA A 25 61.728 -8.841 6.985 1.00 0.00 C ATOM 360 C ALA A 25 62.141 -7.862 5.883 1.00 0.00 C ATOM 361 O ALA A 25 63.261 -7.883 5.410 1.00 0.00 O ATOM 362 CB ALA A 25 60.461 -9.587 6.558 1.00 0.00 C ATOM 0 H ALA A 25 61.060 -7.155 8.094 1.00 0.00 H new ATOM 0 HA ALA A 25 62.527 -9.563 7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 25 60.658 -10.144 5.642 1.00 0.00 H new ATOM 0 HB2 ALA A 25 60.163 -10.278 7.346 1.00 0.00 H new ATOM 0 HB3 ALA A 25 59.659 -8.870 6.381 1.00 0.00 H new ATOM 368 N ALA A 26 61.246 -7.006 5.471 1.00 0.00 N ATOM 369 CA ALA A 26 61.583 -6.024 4.397 1.00 0.00 C ATOM 370 C ALA A 26 61.798 -4.629 4.999 1.00 0.00 C ATOM 371 O ALA A 26 62.277 -4.485 6.106 1.00 0.00 O ATOM 372 CB ALA A 26 60.438 -5.977 3.384 1.00 0.00 C ATOM 0 H ALA A 26 60.294 -6.943 5.831 1.00 0.00 H new ATOM 0 HA ALA A 26 62.503 -6.335 3.902 1.00 0.00 H new ATOM 0 HB1 ALA A 26 60.678 -5.262 2.597 1.00 0.00 H new ATOM 0 HB2 ALA A 26 60.299 -6.965 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 26 59.520 -5.670 3.886 1.00 0.00 H new ATOM 378 N TYR A 27 61.427 -3.601 4.274 1.00 0.00 N ATOM 379 CA TYR A 27 61.578 -2.207 4.787 1.00 0.00 C ATOM 380 C TYR A 27 61.060 -1.222 3.728 1.00 0.00 C ATOM 381 O TYR A 27 60.235 -0.376 3.999 1.00 0.00 O ATOM 382 CB TYR A 27 63.051 -1.909 5.117 1.00 0.00 C ATOM 383 CG TYR A 27 63.815 -1.532 3.866 1.00 0.00 C ATOM 384 CD1 TYR A 27 63.859 -0.196 3.453 1.00 0.00 C ATOM 385 CD2 TYR A 27 64.480 -2.516 3.122 1.00 0.00 C ATOM 386 CE1 TYR A 27 64.568 0.158 2.297 1.00 0.00 C ATOM 387 CE2 TYR A 27 65.188 -2.163 1.965 1.00 0.00 C ATOM 388 CZ TYR A 27 65.233 -0.825 1.554 1.00 0.00 C ATOM 389 OH TYR A 27 65.931 -0.476 0.416 1.00 0.00 O ATOM 0 H TYR A 27 61.022 -3.671 3.340 1.00 0.00 H new ATOM 0 HA TYR A 27 60.997 -2.096 5.703 1.00 0.00 H new ATOM 0 HB2 TYR A 27 63.109 -1.098 5.843 1.00 0.00 H new ATOM 0 HB3 TYR A 27 63.509 -2.783 5.579 1.00 0.00 H new ATOM 0 HD1 TYR A 27 63.346 0.563 4.025 1.00 0.00 H new ATOM 0 HD2 TYR A 27 64.447 -3.547 3.441 1.00 0.00 H new ATOM 0 HE1 TYR A 27 64.601 1.190 1.979 1.00 0.00 H new ATOM 0 HE2 TYR A 27 65.698 -2.922 1.391 1.00 0.00 H new ATOM 0 HH TYR A 27 66.334 -1.277 0.021 1.00 0.00 H new ATOM 399 N PHE A 28 61.536 -1.326 2.522 1.00 0.00 N ATOM 400 CA PHE A 28 61.072 -0.400 1.455 1.00 0.00 C ATOM 401 C PHE A 28 61.425 1.034 1.845 1.00 0.00 C ATOM 402 O PHE A 28 61.622 1.340 3.003 1.00 0.00 O ATOM 403 CB PHE A 28 59.555 -0.516 1.297 1.00 0.00 C ATOM 404 CG PHE A 28 59.193 -1.920 0.882 1.00 0.00 C ATOM 405 CD1 PHE A 28 59.090 -2.929 1.847 1.00 0.00 C ATOM 406 CD2 PHE A 28 58.957 -2.212 -0.465 1.00 0.00 C ATOM 407 CE1 PHE A 28 58.752 -4.231 1.462 1.00 0.00 C ATOM 408 CE2 PHE A 28 58.619 -3.515 -0.850 1.00 0.00 C ATOM 409 CZ PHE A 28 58.516 -4.524 0.114 1.00 0.00 C ATOM 0 H PHE A 28 62.229 -2.014 2.228 1.00 0.00 H new ATOM 0 HA PHE A 28 61.557 -0.660 0.514 1.00 0.00 H new ATOM 0 HB2 PHE A 28 59.062 -0.265 2.236 1.00 0.00 H new ATOM 0 HB3 PHE A 28 59.202 0.196 0.551 1.00 0.00 H new ATOM 0 HD1 PHE A 28 59.271 -2.703 2.887 1.00 0.00 H new ATOM 0 HD2 PHE A 28 59.035 -1.432 -1.208 1.00 0.00 H new ATOM 0 HE1 PHE A 28 58.673 -5.010 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 28 58.438 -3.741 -1.890 1.00 0.00 H new ATOM 0 HZ PHE A 28 58.254 -5.529 -0.182 1.00 0.00 H new ATOM 419 N GLU A 29 61.494 1.916 0.893 1.00 0.00 N ATOM 420 CA GLU A 29 61.823 3.328 1.221 1.00 0.00 C ATOM 421 C GLU A 29 60.921 4.251 0.415 1.00 0.00 C ATOM 422 O GLU A 29 61.374 5.137 -0.284 1.00 0.00 O ATOM 423 CB GLU A 29 63.286 3.609 0.896 1.00 0.00 C ATOM 424 CG GLU A 29 63.557 3.221 -0.557 1.00 0.00 C ATOM 425 CD GLU A 29 64.959 3.683 -0.960 1.00 0.00 C ATOM 426 OE1 GLU A 29 65.428 4.656 -0.393 1.00 0.00 O ATOM 427 OE2 GLU A 29 65.540 3.054 -1.829 1.00 0.00 O ATOM 0 H GLU A 29 61.337 1.722 -0.096 1.00 0.00 H new ATOM 0 HA GLU A 29 61.663 3.504 2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 29 63.510 4.664 1.052 1.00 0.00 H new ATOM 0 HB3 GLU A 29 63.935 3.043 1.564 1.00 0.00 H new ATOM 0 HG2 GLU A 29 63.471 2.141 -0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 29 62.812 3.675 -1.210 1.00 0.00 H new ATOM 434 N THR A 30 59.642 4.055 0.537 1.00 0.00 N ATOM 435 CA THR A 30 58.662 4.914 -0.184 1.00 0.00 C ATOM 436 C THR A 30 59.181 5.277 -1.581 1.00 0.00 C ATOM 437 O THR A 30 59.321 4.422 -2.432 1.00 0.00 O ATOM 438 CB THR A 30 58.427 6.175 0.641 1.00 0.00 C ATOM 439 OG1 THR A 30 59.662 6.848 0.825 1.00 0.00 O ATOM 440 CG2 THR A 30 57.847 5.780 1.998 1.00 0.00 C ATOM 0 H THR A 30 59.225 3.325 1.115 1.00 0.00 H new ATOM 0 HA THR A 30 57.725 4.372 -0.311 1.00 0.00 H new ATOM 0 HB THR A 30 57.730 6.835 0.125 1.00 0.00 H new ATOM 0 HG1 THR A 30 60.342 6.449 0.242 1.00 0.00 H new ATOM 0 HG21 THR A 30 57.676 6.676 2.595 1.00 0.00 H new ATOM 0 HG22 THR A 30 56.903 5.255 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 30 58.548 5.127 2.517 1.00 0.00 H new ATOM 448 N SER A 31 59.444 6.534 -1.844 1.00 0.00 N ATOM 449 CA SER A 31 59.917 6.907 -3.201 1.00 0.00 C ATOM 450 C SER A 31 60.147 8.419 -3.280 1.00 0.00 C ATOM 451 O SER A 31 60.050 9.126 -2.298 1.00 0.00 O ATOM 452 CB SER A 31 58.830 6.518 -4.192 1.00 0.00 C ATOM 453 OG SER A 31 59.408 5.818 -5.286 1.00 0.00 O ATOM 0 H SER A 31 59.351 7.305 -1.183 1.00 0.00 H new ATOM 0 HA SER A 31 60.854 6.397 -3.425 1.00 0.00 H new ATOM 0 HB2 SER A 31 58.084 5.893 -3.701 1.00 0.00 H new ATOM 0 HB3 SER A 31 58.314 7.409 -4.550 1.00 0.00 H new ATOM 0 HG SER A 31 58.706 5.567 -5.922 1.00 0.00 H new ATOM 459 N SER A 32 60.436 8.919 -4.452 1.00 0.00 N ATOM 460 CA SER A 32 60.655 10.384 -4.607 1.00 0.00 C ATOM 461 C SER A 32 59.317 11.100 -4.439 1.00 0.00 C ATOM 462 O SER A 32 59.038 11.674 -3.404 1.00 0.00 O ATOM 463 CB SER A 32 61.219 10.673 -5.998 1.00 0.00 C ATOM 464 OG SER A 32 62.629 10.830 -5.909 1.00 0.00 O ATOM 0 H SER A 32 60.530 8.374 -5.309 1.00 0.00 H new ATOM 0 HA SER A 32 61.362 10.736 -3.855 1.00 0.00 H new ATOM 0 HB2 SER A 32 60.974 9.858 -6.679 1.00 0.00 H new ATOM 0 HB3 SER A 32 60.766 11.576 -6.406 1.00 0.00 H new ATOM 0 HG SER A 32 62.995 11.014 -6.800 1.00 0.00 H new ATOM 470 N GLN A 33 58.478 11.064 -5.438 1.00 0.00 N ATOM 471 CA GLN A 33 57.158 11.734 -5.308 1.00 0.00 C ATOM 472 C GLN A 33 56.551 11.337 -3.964 1.00 0.00 C ATOM 473 O GLN A 33 56.110 10.219 -3.795 1.00 0.00 O ATOM 474 CB GLN A 33 56.234 11.280 -6.440 1.00 0.00 C ATOM 475 CG GLN A 33 56.488 12.132 -7.685 1.00 0.00 C ATOM 476 CD GLN A 33 55.224 12.167 -8.545 1.00 0.00 C ATOM 477 OE1 GLN A 33 54.882 13.191 -9.102 1.00 0.00 O ATOM 478 NE2 GLN A 33 54.509 11.082 -8.678 1.00 0.00 N ATOM 0 H GLN A 33 58.650 10.603 -6.331 1.00 0.00 H new ATOM 0 HA GLN A 33 57.279 12.816 -5.365 1.00 0.00 H new ATOM 0 HB2 GLN A 33 56.409 10.228 -6.665 1.00 0.00 H new ATOM 0 HB3 GLN A 33 55.193 11.371 -6.131 1.00 0.00 H new ATOM 0 HG2 GLN A 33 56.771 13.144 -7.395 1.00 0.00 H new ATOM 0 HG3 GLN A 33 57.319 11.720 -8.257 1.00 0.00 H new ATOM 0 HE21 GLN A 33 54.796 10.222 -8.211 1.00 0.00 H new ATOM 0 HE22 GLN A 33 53.664 11.095 -9.249 1.00 0.00 H new ATOM 487 N CYS A 34 56.556 12.247 -3.015 1.00 0.00 N ATOM 488 CA CYS A 34 56.007 11.970 -1.643 1.00 0.00 C ATOM 489 C CYS A 34 57.175 11.733 -0.686 1.00 0.00 C ATOM 490 O CYS A 34 57.409 10.631 -0.234 1.00 0.00 O ATOM 491 CB CYS A 34 55.093 10.738 -1.647 1.00 0.00 C ATOM 492 SG CYS A 34 54.221 10.604 -0.068 1.00 0.00 S ATOM 0 H CYS A 34 56.925 13.190 -3.136 1.00 0.00 H new ATOM 0 HA CYS A 34 55.416 12.828 -1.323 1.00 0.00 H new ATOM 0 HB2 CYS A 34 54.374 10.812 -2.463 1.00 0.00 H new ATOM 0 HB3 CYS A 34 55.683 9.839 -1.823 1.00 0.00 H new ATOM 497 N SER A 35 57.917 12.765 -0.384 1.00 0.00 N ATOM 498 CA SER A 35 59.080 12.614 0.537 1.00 0.00 C ATOM 499 C SER A 35 58.638 11.907 1.821 1.00 0.00 C ATOM 500 O SER A 35 58.258 12.536 2.788 1.00 0.00 O ATOM 501 CB SER A 35 59.633 13.998 0.880 1.00 0.00 C ATOM 502 OG SER A 35 59.958 14.684 -0.322 1.00 0.00 O ATOM 0 H SER A 35 57.767 13.710 -0.737 1.00 0.00 H new ATOM 0 HA SER A 35 59.853 12.019 0.050 1.00 0.00 H new ATOM 0 HB2 SER A 35 58.897 14.566 1.449 1.00 0.00 H new ATOM 0 HB3 SER A 35 60.518 13.903 1.509 1.00 0.00 H new ATOM 0 HG SER A 35 60.311 15.572 -0.106 1.00 0.00 H new ATOM 508 N LYS A 36 58.683 10.602 1.836 1.00 0.00 N ATOM 509 CA LYS A 36 58.265 9.848 3.050 1.00 0.00 C ATOM 510 C LYS A 36 59.072 10.309 4.273 1.00 0.00 C ATOM 511 O LYS A 36 60.244 10.608 4.161 1.00 0.00 O ATOM 512 CB LYS A 36 58.513 8.359 2.804 1.00 0.00 C ATOM 513 CG LYS A 36 59.992 8.019 3.059 1.00 0.00 C ATOM 514 CD LYS A 36 60.869 8.751 2.039 1.00 0.00 C ATOM 515 CE LYS A 36 62.175 7.980 1.835 1.00 0.00 C ATOM 516 NZ LYS A 36 62.947 7.962 3.108 1.00 0.00 N ATOM 0 H LYS A 36 58.993 10.024 1.055 1.00 0.00 H new ATOM 0 HA LYS A 36 57.208 10.030 3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 36 57.877 7.764 3.459 1.00 0.00 H new ATOM 0 HB3 LYS A 36 58.244 8.102 1.779 1.00 0.00 H new ATOM 0 HG2 LYS A 36 60.273 8.310 4.071 1.00 0.00 H new ATOM 0 HG3 LYS A 36 60.147 6.943 2.982 1.00 0.00 H new ATOM 0 HD2 LYS A 36 60.339 8.846 1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.082 9.762 2.387 1.00 0.00 H new ATOM 0 HE2 LYS A 36 61.961 6.961 1.513 1.00 0.00 H new ATOM 0 HE3 LYS A 36 62.765 8.446 1.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 63.902 7.590 2.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 63.017 8.929 3.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 62.462 7.355 3.799 1.00 0.00 H new ATOM 530 N PRO A 37 58.420 10.330 5.410 1.00 0.00 N ATOM 531 CA PRO A 37 59.049 10.725 6.680 1.00 0.00 C ATOM 532 C PRO A 37 59.799 9.540 7.301 1.00 0.00 C ATOM 533 O PRO A 37 60.292 9.621 8.408 1.00 0.00 O ATOM 534 CB PRO A 37 57.862 11.112 7.561 1.00 0.00 C ATOM 535 CG PRO A 37 56.628 10.384 6.976 1.00 0.00 C ATOM 536 CD PRO A 37 56.991 9.980 5.533 1.00 0.00 C ATOM 0 HA PRO A 37 59.777 11.527 6.560 1.00 0.00 H new ATOM 0 HB2 PRO A 37 58.033 10.815 8.596 1.00 0.00 H new ATOM 0 HB3 PRO A 37 57.713 12.192 7.559 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.379 9.506 7.572 1.00 0.00 H new ATOM 0 HG3 PRO A 37 55.754 11.035 6.987 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.825 8.916 5.363 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.385 10.518 4.804 1.00 0.00 H new ATOM 544 N GLY A 38 59.880 8.436 6.611 1.00 0.00 N ATOM 545 CA GLY A 38 60.592 7.259 7.187 1.00 0.00 C ATOM 546 C GLY A 38 60.579 6.094 6.195 1.00 0.00 C ATOM 547 O GLY A 38 60.564 6.284 4.994 1.00 0.00 O ATOM 0 H GLY A 38 59.487 8.297 5.680 1.00 0.00 H new ATOM 0 HA2 GLY A 38 61.620 7.529 7.428 1.00 0.00 H new ATOM 0 HA3 GLY A 38 60.115 6.957 8.119 1.00 0.00 H new ATOM 551 N VAL A 39 60.596 4.886 6.693 1.00 0.00 N ATOM 552 CA VAL A 39 60.596 3.696 5.794 1.00 0.00 C ATOM 553 C VAL A 39 59.414 2.788 6.157 1.00 0.00 C ATOM 554 O VAL A 39 58.945 2.783 7.274 1.00 0.00 O ATOM 555 CB VAL A 39 61.931 2.939 5.976 1.00 0.00 C ATOM 556 CG1 VAL A 39 61.719 1.413 5.986 1.00 0.00 C ATOM 557 CG2 VAL A 39 62.879 3.307 4.833 1.00 0.00 C ATOM 0 H VAL A 39 60.610 4.672 7.690 1.00 0.00 H new ATOM 0 HA VAL A 39 60.495 4.005 4.754 1.00 0.00 H new ATOM 0 HB VAL A 39 62.358 3.230 6.936 1.00 0.00 H new ATOM 0 HG11 VAL A 39 62.679 0.913 6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 39 61.055 1.143 6.808 1.00 0.00 H new ATOM 0 HG13 VAL A 39 61.273 1.101 5.042 1.00 0.00 H new ATOM 0 HG21 VAL A 39 63.822 2.775 4.957 1.00 0.00 H new ATOM 0 HG22 VAL A 39 62.427 3.027 3.881 1.00 0.00 H new ATOM 0 HG23 VAL A 39 63.064 4.381 4.845 1.00 0.00 H new ATOM 567 N ILE A 40 58.959 1.996 5.227 1.00 0.00 N ATOM 568 CA ILE A 40 57.840 1.059 5.526 1.00 0.00 C ATOM 569 C ILE A 40 58.483 -0.236 6.041 1.00 0.00 C ATOM 570 O ILE A 40 59.685 -0.302 6.197 1.00 0.00 O ATOM 571 CB ILE A 40 57.007 0.839 4.235 1.00 0.00 C ATOM 572 CG1 ILE A 40 55.610 1.441 4.431 1.00 0.00 C ATOM 573 CG2 ILE A 40 56.856 -0.650 3.887 1.00 0.00 C ATOM 574 CD1 ILE A 40 55.301 2.421 3.293 1.00 0.00 C ATOM 0 H ILE A 40 59.314 1.957 4.272 1.00 0.00 H new ATOM 0 HA ILE A 40 57.154 1.445 6.280 1.00 0.00 H new ATOM 0 HB ILE A 40 57.535 1.325 3.415 1.00 0.00 H new ATOM 0 HG12 ILE A 40 54.862 0.648 4.453 1.00 0.00 H new ATOM 0 HG13 ILE A 40 55.557 1.956 5.390 1.00 0.00 H new ATOM 0 HG21 ILE A 40 56.266 -0.753 2.976 1.00 0.00 H new ATOM 0 HG22 ILE A 40 57.842 -1.089 3.732 1.00 0.00 H new ATOM 0 HG23 ILE A 40 56.353 -1.166 4.705 1.00 0.00 H new ATOM 0 HD11 ILE A 40 54.307 2.845 3.438 1.00 0.00 H new ATOM 0 HD12 ILE A 40 56.041 3.222 3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 40 55.335 1.894 2.340 1.00 0.00 H new ATOM 586 N PHE A 41 57.735 -1.262 6.320 1.00 0.00 N ATOM 587 CA PHE A 41 58.396 -2.496 6.814 1.00 0.00 C ATOM 588 C PHE A 41 57.452 -3.685 6.712 1.00 0.00 C ATOM 589 O PHE A 41 56.251 -3.553 6.810 1.00 0.00 O ATOM 590 CB PHE A 41 58.814 -2.301 8.269 1.00 0.00 C ATOM 591 CG PHE A 41 60.258 -1.865 8.310 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.259 -2.751 7.902 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.595 -0.577 8.744 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.600 -2.353 7.927 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.938 -0.179 8.771 1.00 0.00 C ATOM 596 CZ PHE A 41 62.940 -1.067 8.362 1.00 0.00 C ATOM 0 H PHE A 41 56.720 -1.302 6.231 1.00 0.00 H new ATOM 0 HA PHE A 41 59.275 -2.693 6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.181 -1.553 8.746 1.00 0.00 H new ATOM 0 HB3 PHE A 41 58.685 -3.229 8.826 1.00 0.00 H new ATOM 0 HD1 PHE A 41 60.997 -3.744 7.567 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.821 0.108 9.057 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.373 -3.038 7.611 1.00 0.00 H new ATOM 0 HE2 PHE A 41 62.200 0.813 9.107 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.975 -0.760 8.382 1.00 0.00 H new ATOM 606 N LEU A 42 58.000 -4.850 6.523 1.00 0.00 N ATOM 607 CA LEU A 42 57.165 -6.067 6.424 1.00 0.00 C ATOM 608 C LEU A 42 57.482 -6.961 7.617 1.00 0.00 C ATOM 609 O LEU A 42 58.195 -7.938 7.508 1.00 0.00 O ATOM 610 CB LEU A 42 57.493 -6.793 5.127 1.00 0.00 C ATOM 611 CG LEU A 42 56.728 -6.139 3.981 1.00 0.00 C ATOM 612 CD1 LEU A 42 57.188 -6.743 2.654 1.00 0.00 C ATOM 613 CD2 LEU A 42 55.227 -6.382 4.163 1.00 0.00 C ATOM 0 H LEU A 42 59.003 -5.009 6.432 1.00 0.00 H new ATOM 0 HA LEU A 42 56.106 -5.809 6.427 1.00 0.00 H new ATOM 0 HB2 LEU A 42 58.565 -6.753 4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 42 57.223 -7.846 5.207 1.00 0.00 H new ATOM 0 HG LEU A 42 56.922 -5.066 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 42 56.642 -6.277 1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 42 58.256 -6.568 2.525 1.00 0.00 H new ATOM 0 HD13 LEU A 42 56.994 -7.816 2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 42 54.681 -5.914 3.344 1.00 0.00 H new ATOM 0 HD22 LEU A 42 55.030 -7.454 4.166 1.00 0.00 H new ATOM 0 HD23 LEU A 42 54.901 -5.951 5.109 1.00 0.00 H new ATOM 625 N THR A 43 56.972 -6.610 8.760 1.00 0.00 N ATOM 626 CA THR A 43 57.244 -7.409 9.986 1.00 0.00 C ATOM 627 C THR A 43 57.001 -8.893 9.706 1.00 0.00 C ATOM 628 O THR A 43 56.690 -9.290 8.601 1.00 0.00 O ATOM 629 CB THR A 43 56.324 -6.937 11.112 1.00 0.00 C ATOM 630 OG1 THR A 43 55.026 -7.483 10.921 1.00 0.00 O ATOM 631 CG2 THR A 43 56.245 -5.408 11.100 1.00 0.00 C ATOM 0 H THR A 43 56.373 -5.797 8.901 1.00 0.00 H new ATOM 0 HA THR A 43 58.284 -7.272 10.284 1.00 0.00 H new ATOM 0 HB THR A 43 56.720 -7.271 12.071 1.00 0.00 H new ATOM 0 HG1 THR A 43 54.435 -7.183 11.643 1.00 0.00 H new ATOM 0 HG21 THR A 43 55.589 -5.071 11.903 1.00 0.00 H new ATOM 0 HG22 THR A 43 57.241 -4.991 11.247 1.00 0.00 H new ATOM 0 HG23 THR A 43 55.848 -5.072 10.142 1.00 0.00 H new ATOM 639 N LYS A 44 57.146 -9.718 10.704 1.00 0.00 N ATOM 640 CA LYS A 44 56.935 -11.179 10.501 1.00 0.00 C ATOM 641 C LYS A 44 55.463 -11.520 10.725 1.00 0.00 C ATOM 642 O LYS A 44 54.976 -12.534 10.268 1.00 0.00 O ATOM 643 CB LYS A 44 57.805 -11.959 11.488 1.00 0.00 C ATOM 644 CG LYS A 44 59.196 -11.324 11.549 1.00 0.00 C ATOM 645 CD LYS A 44 59.889 -11.471 10.193 1.00 0.00 C ATOM 646 CE LYS A 44 61.096 -12.400 10.333 1.00 0.00 C ATOM 647 NZ LYS A 44 61.783 -12.523 9.016 1.00 0.00 N ATOM 0 H LYS A 44 57.402 -9.444 11.653 1.00 0.00 H new ATOM 0 HA LYS A 44 57.213 -11.450 9.483 1.00 0.00 H new ATOM 0 HB2 LYS A 44 57.347 -11.954 12.477 1.00 0.00 H new ATOM 0 HB3 LYS A 44 57.882 -13.001 11.178 1.00 0.00 H new ATOM 0 HG2 LYS A 44 59.114 -10.270 11.814 1.00 0.00 H new ATOM 0 HG3 LYS A 44 59.791 -11.803 12.326 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.191 -11.873 9.458 1.00 0.00 H new ATOM 0 HD3 LYS A 44 60.209 -10.495 9.829 1.00 0.00 H new ATOM 0 HE2 LYS A 44 61.786 -12.007 11.080 1.00 0.00 H new ATOM 0 HE3 LYS A 44 60.775 -13.382 10.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 62.552 -13.219 9.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 61.100 -12.835 8.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 62.177 -11.600 8.742 1.00 0.00 H new ATOM 661 N ARG A 45 54.747 -10.679 11.418 1.00 0.00 N ATOM 662 CA ARG A 45 53.305 -10.959 11.656 1.00 0.00 C ATOM 663 C ARG A 45 52.501 -10.558 10.418 1.00 0.00 C ATOM 664 O ARG A 45 51.286 -10.598 10.414 1.00 0.00 O ATOM 665 CB ARG A 45 52.819 -10.155 12.863 1.00 0.00 C ATOM 666 CG ARG A 45 51.780 -10.973 13.633 1.00 0.00 C ATOM 667 CD ARG A 45 50.393 -10.357 13.435 1.00 0.00 C ATOM 668 NE ARG A 45 49.361 -11.266 14.010 1.00 0.00 N ATOM 669 CZ ARG A 45 48.922 -12.278 13.313 1.00 0.00 C ATOM 670 NH1 ARG A 45 49.540 -13.426 13.367 1.00 0.00 N ATOM 671 NH2 ARG A 45 47.864 -12.141 12.560 1.00 0.00 N ATOM 0 H ARG A 45 55.097 -9.813 11.828 1.00 0.00 H new ATOM 0 HA ARG A 45 53.168 -12.022 11.852 1.00 0.00 H new ATOM 0 HB2 ARG A 45 53.659 -9.910 13.513 1.00 0.00 H new ATOM 0 HB3 ARG A 45 52.384 -9.211 12.534 1.00 0.00 H new ATOM 0 HG2 ARG A 45 51.784 -12.006 13.284 1.00 0.00 H new ATOM 0 HG3 ARG A 45 52.032 -10.994 14.693 1.00 0.00 H new ATOM 0 HD2 ARG A 45 50.344 -9.381 13.918 1.00 0.00 H new ATOM 0 HD3 ARG A 45 50.202 -10.197 12.374 1.00 0.00 H new ATOM 0 HE ARG A 45 48.998 -11.097 14.948 1.00 0.00 H new ATOM 0 HH11 ARG A 45 50.367 -13.533 13.954 1.00 0.00 H new ATOM 0 HH12 ARG A 45 49.196 -14.216 12.822 1.00 0.00 H new ATOM 0 HH21 ARG A 45 47.381 -11.243 12.517 1.00 0.00 H new ATOM 0 HH22 ARG A 45 47.520 -12.932 12.015 1.00 0.00 H new ATOM 685 N SER A 46 53.169 -10.169 9.364 1.00 0.00 N ATOM 686 CA SER A 46 52.444 -9.763 8.130 1.00 0.00 C ATOM 687 C SER A 46 51.556 -8.560 8.444 1.00 0.00 C ATOM 688 O SER A 46 50.494 -8.393 7.877 1.00 0.00 O ATOM 689 CB SER A 46 51.578 -10.926 7.642 1.00 0.00 C ATOM 690 OG SER A 46 52.139 -11.461 6.450 1.00 0.00 O ATOM 0 H SER A 46 54.186 -10.116 9.307 1.00 0.00 H new ATOM 0 HA SER A 46 53.160 -9.496 7.353 1.00 0.00 H new ATOM 0 HB2 SER A 46 51.520 -11.698 8.409 1.00 0.00 H new ATOM 0 HB3 SER A 46 50.560 -10.584 7.457 1.00 0.00 H new ATOM 0 HG SER A 46 51.588 -12.208 6.135 1.00 0.00 H new ATOM 696 N ARG A 47 51.979 -7.722 9.352 1.00 0.00 N ATOM 697 CA ARG A 47 51.149 -6.535 9.705 1.00 0.00 C ATOM 698 C ARG A 47 51.733 -5.275 9.057 1.00 0.00 C ATOM 699 O ARG A 47 51.068 -4.265 8.935 1.00 0.00 O ATOM 700 CB ARG A 47 51.131 -6.366 11.226 1.00 0.00 C ATOM 701 CG ARG A 47 49.739 -6.704 11.761 1.00 0.00 C ATOM 702 CD ARG A 47 48.723 -5.704 11.208 1.00 0.00 C ATOM 703 NE ARG A 47 48.216 -4.849 12.318 1.00 0.00 N ATOM 704 CZ ARG A 47 47.588 -5.391 13.325 1.00 0.00 C ATOM 705 NH1 ARG A 47 46.591 -6.207 13.112 1.00 0.00 N ATOM 706 NH2 ARG A 47 47.960 -5.122 14.546 1.00 0.00 N ATOM 0 H ARG A 47 52.858 -7.807 9.862 1.00 0.00 H new ATOM 0 HA ARG A 47 50.133 -6.685 9.339 1.00 0.00 H new ATOM 0 HB2 ARG A 47 51.876 -7.017 11.684 1.00 0.00 H new ATOM 0 HB3 ARG A 47 51.396 -5.343 11.492 1.00 0.00 H new ATOM 0 HG2 ARG A 47 49.463 -7.718 11.471 1.00 0.00 H new ATOM 0 HG3 ARG A 47 49.739 -6.673 12.851 1.00 0.00 H new ATOM 0 HD2 ARG A 47 49.187 -5.085 10.440 1.00 0.00 H new ATOM 0 HD3 ARG A 47 47.896 -6.233 10.735 1.00 0.00 H new ATOM 0 HE ARG A 47 48.360 -3.840 12.291 1.00 0.00 H new ATOM 0 HH11 ARG A 47 46.302 -6.421 12.157 1.00 0.00 H new ATOM 0 HH12 ARG A 47 46.101 -6.630 13.900 1.00 0.00 H new ATOM 0 HH21 ARG A 47 48.741 -4.488 14.713 1.00 0.00 H new ATOM 0 HH22 ARG A 47 47.469 -5.545 15.334 1.00 0.00 H new ATOM 720 N GLN A 48 52.971 -5.323 8.647 1.00 0.00 N ATOM 721 CA GLN A 48 53.602 -4.125 8.016 1.00 0.00 C ATOM 722 C GLN A 48 53.559 -2.958 8.997 1.00 0.00 C ATOM 723 O GLN A 48 52.689 -2.880 9.842 1.00 0.00 O ATOM 724 CB GLN A 48 52.846 -3.737 6.743 1.00 0.00 C ATOM 725 CG GLN A 48 53.434 -2.437 6.179 1.00 0.00 C ATOM 726 CD GLN A 48 52.827 -1.236 6.911 1.00 0.00 C ATOM 727 OE1 GLN A 48 51.908 -1.387 7.691 1.00 0.00 O ATOM 728 NE2 GLN A 48 53.307 -0.039 6.692 1.00 0.00 N ATOM 0 H GLN A 48 53.575 -6.141 8.721 1.00 0.00 H new ATOM 0 HA GLN A 48 54.635 -4.362 7.760 1.00 0.00 H new ATOM 0 HB2 GLN A 48 52.922 -4.535 6.004 1.00 0.00 H new ATOM 0 HB3 GLN A 48 51.786 -3.605 6.962 1.00 0.00 H new ATOM 0 HG2 GLN A 48 54.518 -2.436 6.295 1.00 0.00 H new ATOM 0 HG3 GLN A 48 53.228 -2.366 5.111 1.00 0.00 H new ATOM 0 HE21 GLN A 48 54.079 0.089 6.037 1.00 0.00 H new ATOM 0 HE22 GLN A 48 52.910 0.766 7.176 1.00 0.00 H new ATOM 737 N VAL A 49 54.484 -2.041 8.900 1.00 0.00 N ATOM 738 CA VAL A 49 54.464 -0.892 9.843 1.00 0.00 C ATOM 739 C VAL A 49 55.195 0.319 9.244 1.00 0.00 C ATOM 740 O VAL A 49 54.650 1.029 8.420 1.00 0.00 O ATOM 741 CB VAL A 49 55.123 -1.312 11.158 1.00 0.00 C ATOM 742 CG1 VAL A 49 55.038 -0.162 12.159 1.00 0.00 C ATOM 743 CG2 VAL A 49 54.385 -2.529 11.721 1.00 0.00 C ATOM 0 H VAL A 49 55.242 -2.039 8.217 1.00 0.00 H new ATOM 0 HA VAL A 49 53.430 -0.601 10.028 1.00 0.00 H new ATOM 0 HB VAL A 49 56.169 -1.563 10.981 1.00 0.00 H new ATOM 0 HG11 VAL A 49 55.507 -0.460 13.097 1.00 0.00 H new ATOM 0 HG12 VAL A 49 55.554 0.710 11.756 1.00 0.00 H new ATOM 0 HG13 VAL A 49 53.992 0.086 12.340 1.00 0.00 H new ATOM 0 HG21 VAL A 49 54.849 -2.834 12.659 1.00 0.00 H new ATOM 0 HG22 VAL A 49 53.341 -2.271 11.900 1.00 0.00 H new ATOM 0 HG23 VAL A 49 54.438 -3.350 11.006 1.00 0.00 H new ATOM 753 N CYS A 50 56.411 0.578 9.658 1.00 0.00 N ATOM 754 CA CYS A 50 57.150 1.753 9.131 1.00 0.00 C ATOM 755 C CYS A 50 58.310 2.052 10.069 1.00 0.00 C ATOM 756 O CYS A 50 58.593 1.303 10.981 1.00 0.00 O ATOM 757 CB CYS A 50 56.214 2.956 9.080 1.00 0.00 C ATOM 758 SG CYS A 50 55.950 3.444 7.357 1.00 0.00 S ATOM 0 H CYS A 50 56.921 0.019 10.342 1.00 0.00 H new ATOM 0 HA CYS A 50 57.523 1.546 8.128 1.00 0.00 H new ATOM 0 HB2 CYS A 50 55.262 2.709 9.549 1.00 0.00 H new ATOM 0 HB3 CYS A 50 56.641 3.786 9.643 1.00 0.00 H new ATOM 763 N ALA A 51 58.984 3.137 9.854 1.00 0.00 N ATOM 764 CA ALA A 51 60.129 3.471 10.741 1.00 0.00 C ATOM 765 C ALA A 51 60.434 4.968 10.684 1.00 0.00 C ATOM 766 O ALA A 51 60.454 5.571 9.631 1.00 0.00 O ATOM 767 CB ALA A 51 61.359 2.690 10.286 1.00 0.00 C ATOM 0 H ALA A 51 58.796 3.807 9.108 1.00 0.00 H new ATOM 0 HA ALA A 51 59.871 3.204 11.766 1.00 0.00 H new ATOM 0 HB1 ALA A 51 62.203 2.931 10.933 1.00 0.00 H new ATOM 0 HB2 ALA A 51 61.152 1.621 10.342 1.00 0.00 H new ATOM 0 HB3 ALA A 51 61.601 2.960 9.258 1.00 0.00 H new ATOM 773 N ASP A 52 60.683 5.560 11.819 1.00 0.00 N ATOM 774 CA ASP A 52 61.005 7.016 11.861 1.00 0.00 C ATOM 775 C ASP A 52 61.982 7.362 10.727 1.00 0.00 C ATOM 776 O ASP A 52 62.535 6.483 10.100 1.00 0.00 O ATOM 777 CB ASP A 52 61.657 7.335 13.212 1.00 0.00 C ATOM 778 CG ASP A 52 60.797 8.350 13.970 1.00 0.00 C ATOM 779 OD1 ASP A 52 59.945 8.959 13.344 1.00 0.00 O ATOM 780 OD2 ASP A 52 61.006 8.500 15.163 1.00 0.00 O ATOM 0 H ASP A 52 60.677 5.095 12.727 1.00 0.00 H new ATOM 0 HA ASP A 52 60.094 7.601 11.737 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.764 6.423 13.800 1.00 0.00 H new ATOM 0 HB3 ASP A 52 62.659 7.735 13.058 1.00 0.00 H new ATOM 785 N PRO A 53 62.171 8.639 10.504 1.00 0.00 N ATOM 786 CA PRO A 53 63.088 9.136 9.460 1.00 0.00 C ATOM 787 C PRO A 53 64.539 9.001 9.926 1.00 0.00 C ATOM 788 O PRO A 53 65.435 8.753 9.143 1.00 0.00 O ATOM 789 CB PRO A 53 62.700 10.611 9.310 1.00 0.00 C ATOM 790 CG PRO A 53 61.995 11.011 10.628 1.00 0.00 C ATOM 791 CD PRO A 53 61.490 9.703 11.270 1.00 0.00 C ATOM 0 HA PRO A 53 63.012 8.585 8.523 1.00 0.00 H new ATOM 0 HB2 PRO A 53 63.581 11.229 9.137 1.00 0.00 H new ATOM 0 HB3 PRO A 53 62.038 10.754 8.456 1.00 0.00 H new ATOM 0 HG2 PRO A 53 62.684 11.529 11.295 1.00 0.00 H new ATOM 0 HG3 PRO A 53 61.167 11.692 10.433 1.00 0.00 H new ATOM 0 HD2 PRO A 53 61.743 9.655 12.329 1.00 0.00 H new ATOM 0 HD3 PRO A 53 60.406 9.616 11.197 1.00 0.00 H new ATOM 799 N SER A 54 64.775 9.160 11.198 1.00 0.00 N ATOM 800 CA SER A 54 66.161 9.039 11.724 1.00 0.00 C ATOM 801 C SER A 54 66.221 7.875 12.713 1.00 0.00 C ATOM 802 O SER A 54 66.688 8.017 13.824 1.00 0.00 O ATOM 803 CB SER A 54 66.554 10.333 12.438 1.00 0.00 C ATOM 804 OG SER A 54 66.567 11.403 11.502 1.00 0.00 O ATOM 0 H SER A 54 64.064 9.369 11.898 1.00 0.00 H new ATOM 0 HA SER A 54 66.851 8.859 10.899 1.00 0.00 H new ATOM 0 HB2 SER A 54 65.849 10.547 13.242 1.00 0.00 H new ATOM 0 HB3 SER A 54 67.537 10.224 12.897 1.00 0.00 H new ATOM 0 HG SER A 54 66.817 12.234 11.958 1.00 0.00 H new ATOM 810 N GLU A 55 65.749 6.724 12.318 1.00 0.00 N ATOM 811 CA GLU A 55 65.784 5.554 13.247 1.00 0.00 C ATOM 812 C GLU A 55 67.154 4.914 13.207 1.00 0.00 C ATOM 813 O GLU A 55 67.763 4.742 12.170 1.00 0.00 O ATOM 814 CB GLU A 55 64.725 4.499 12.877 1.00 0.00 C ATOM 815 CG GLU A 55 63.785 5.029 11.794 1.00 0.00 C ATOM 816 CD GLU A 55 64.366 4.717 10.410 1.00 0.00 C ATOM 817 OE1 GLU A 55 65.543 4.968 10.209 1.00 0.00 O ATOM 818 OE2 GLU A 55 63.623 4.229 9.576 1.00 0.00 O ATOM 0 H GLU A 55 65.343 6.542 11.400 1.00 0.00 H new ATOM 0 HA GLU A 55 65.564 5.921 14.250 1.00 0.00 H new ATOM 0 HB2 GLU A 55 65.216 3.592 12.526 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.150 4.228 13.763 1.00 0.00 H new ATOM 0 HG2 GLU A 55 62.801 4.572 11.898 1.00 0.00 H new ATOM 0 HG3 GLU A 55 63.651 6.105 11.909 1.00 0.00 H new ATOM 825 N GLU A 56 67.627 4.568 14.353 1.00 0.00 N ATOM 826 CA GLU A 56 68.956 3.932 14.470 1.00 0.00 C ATOM 827 C GLU A 56 68.817 2.439 14.180 1.00 0.00 C ATOM 828 O GLU A 56 69.598 1.848 13.462 1.00 0.00 O ATOM 829 CB GLU A 56 69.432 4.154 15.895 1.00 0.00 C ATOM 830 CG GLU A 56 70.920 4.513 15.896 1.00 0.00 C ATOM 831 CD GLU A 56 71.753 3.236 15.762 1.00 0.00 C ATOM 832 OE1 GLU A 56 71.855 2.514 16.741 1.00 0.00 O ATOM 833 OE2 GLU A 56 72.272 3.001 14.684 1.00 0.00 O ATOM 0 H GLU A 56 67.139 4.701 15.239 1.00 0.00 H new ATOM 0 HA GLU A 56 69.670 4.355 13.764 1.00 0.00 H new ATOM 0 HB2 GLU A 56 68.856 4.954 16.360 1.00 0.00 H new ATOM 0 HB3 GLU A 56 69.265 3.255 16.488 1.00 0.00 H new ATOM 0 HG2 GLU A 56 71.142 5.193 15.073 1.00 0.00 H new ATOM 0 HG3 GLU A 56 71.179 5.034 16.818 1.00 0.00 H new ATOM 840 N TRP A 57 67.810 1.840 14.738 1.00 0.00 N ATOM 841 CA TRP A 57 67.559 0.389 14.523 1.00 0.00 C ATOM 842 C TRP A 57 67.225 0.126 13.052 1.00 0.00 C ATOM 843 O TRP A 57 67.226 -1.001 12.602 1.00 0.00 O ATOM 844 CB TRP A 57 66.379 -0.015 15.399 1.00 0.00 C ATOM 845 CG TRP A 57 65.193 0.842 15.072 1.00 0.00 C ATOM 846 CD1 TRP A 57 64.938 2.072 15.575 1.00 0.00 C ATOM 847 CD2 TRP A 57 64.100 0.543 14.173 1.00 0.00 C ATOM 848 NE1 TRP A 57 63.747 2.531 15.053 1.00 0.00 N ATOM 849 CE2 TRP A 57 63.190 1.621 14.181 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.819 -0.556 13.369 1.00 0.00 C ATOM 851 CZ2 TRP A 57 62.031 1.601 13.410 1.00 0.00 C ATOM 852 CZ3 TRP A 57 62.656 -0.590 12.585 1.00 0.00 C ATOM 853 CH2 TRP A 57 61.759 0.488 12.608 1.00 0.00 C ATOM 0 H TRP A 57 67.135 2.302 15.347 1.00 0.00 H new ATOM 0 HA TRP A 57 68.445 -0.190 14.783 1.00 0.00 H new ATOM 0 HB2 TRP A 57 66.137 -1.065 15.238 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.640 0.094 16.452 1.00 0.00 H new ATOM 0 HD1 TRP A 57 65.565 2.607 16.272 1.00 0.00 H new ATOM 0 HE1 TRP A 57 63.330 3.433 15.284 1.00 0.00 H new ATOM 0 HE3 TRP A 57 64.503 -1.392 13.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 61.348 2.437 13.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 62.451 -1.448 11.962 1.00 0.00 H new ATOM 0 HH2 TRP A 57 60.861 0.459 12.008 1.00 0.00 H new ATOM 864 N VAL A 58 66.943 1.150 12.297 1.00 0.00 N ATOM 865 CA VAL A 58 66.616 0.945 10.858 1.00 0.00 C ATOM 866 C VAL A 58 67.887 1.064 10.034 1.00 0.00 C ATOM 867 O VAL A 58 68.224 0.188 9.268 1.00 0.00 O ATOM 868 CB VAL A 58 65.636 2.013 10.403 1.00 0.00 C ATOM 869 CG1 VAL A 58 65.464 1.916 8.888 1.00 0.00 C ATOM 870 CG2 VAL A 58 64.302 1.781 11.098 1.00 0.00 C ATOM 0 H VAL A 58 66.925 2.120 12.613 1.00 0.00 H new ATOM 0 HA VAL A 58 66.174 -0.043 10.725 1.00 0.00 H new ATOM 0 HB VAL A 58 66.008 3.006 10.657 1.00 0.00 H new ATOM 0 HG11 VAL A 58 64.762 2.679 8.552 1.00 0.00 H new ATOM 0 HG12 VAL A 58 66.427 2.070 8.402 1.00 0.00 H new ATOM 0 HG13 VAL A 58 65.080 0.930 8.628 1.00 0.00 H new ATOM 0 HG21 VAL A 58 63.589 2.542 10.780 1.00 0.00 H new ATOM 0 HG22 VAL A 58 63.921 0.794 10.835 1.00 0.00 H new ATOM 0 HG23 VAL A 58 64.439 1.841 12.178 1.00 0.00 H new ATOM 880 N GLN A 59 68.598 2.143 10.208 1.00 0.00 N ATOM 881 CA GLN A 59 69.868 2.355 9.472 1.00 0.00 C ATOM 882 C GLN A 59 70.582 1.013 9.334 1.00 0.00 C ATOM 883 O GLN A 59 71.146 0.685 8.308 1.00 0.00 O ATOM 884 CB GLN A 59 70.694 3.331 10.314 1.00 0.00 C ATOM 885 CG GLN A 59 72.125 2.840 10.485 1.00 0.00 C ATOM 886 CD GLN A 59 72.806 2.717 9.117 1.00 0.00 C ATOM 887 OE1 GLN A 59 73.830 2.076 8.992 1.00 0.00 O ATOM 888 NE2 GLN A 59 72.277 3.308 8.078 1.00 0.00 N ATOM 0 H GLN A 59 68.344 2.900 10.843 1.00 0.00 H new ATOM 0 HA GLN A 59 69.710 2.758 8.471 1.00 0.00 H new ATOM 0 HB2 GLN A 59 70.698 4.312 9.838 1.00 0.00 H new ATOM 0 HB3 GLN A 59 70.230 3.453 11.293 1.00 0.00 H new ATOM 0 HG2 GLN A 59 72.682 3.532 11.117 1.00 0.00 H new ATOM 0 HG3 GLN A 59 72.129 1.874 10.990 1.00 0.00 H new ATOM 0 HE21 GLN A 59 71.417 3.847 8.181 1.00 0.00 H new ATOM 0 HE22 GLN A 59 72.724 3.230 7.165 1.00 0.00 H new ATOM 897 N LYS A 60 70.539 0.238 10.373 1.00 0.00 N ATOM 898 CA LYS A 60 71.188 -1.096 10.336 1.00 0.00 C ATOM 899 C LYS A 60 70.417 -1.968 9.351 1.00 0.00 C ATOM 900 O LYS A 60 70.980 -2.537 8.438 1.00 0.00 O ATOM 901 CB LYS A 60 71.167 -1.712 11.746 1.00 0.00 C ATOM 902 CG LYS A 60 71.251 -3.248 11.687 1.00 0.00 C ATOM 903 CD LYS A 60 72.394 -3.708 10.770 1.00 0.00 C ATOM 904 CE LYS A 60 73.613 -2.804 10.942 1.00 0.00 C ATOM 905 NZ LYS A 60 74.847 -3.643 10.973 1.00 0.00 N ATOM 0 H LYS A 60 70.079 0.472 11.253 1.00 0.00 H new ATOM 0 HA LYS A 60 72.227 -1.016 10.015 1.00 0.00 H new ATOM 0 HB2 LYS A 60 72.002 -1.322 12.328 1.00 0.00 H new ATOM 0 HB3 LYS A 60 70.253 -1.415 12.261 1.00 0.00 H new ATOM 0 HG2 LYS A 60 71.404 -3.645 12.690 1.00 0.00 H new ATOM 0 HG3 LYS A 60 70.306 -3.653 11.325 1.00 0.00 H new ATOM 0 HD2 LYS A 60 72.662 -4.739 11.002 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.064 -3.691 9.731 1.00 0.00 H new ATOM 0 HE2 LYS A 60 73.667 -2.087 10.123 1.00 0.00 H new ATOM 0 HE3 LYS A 60 73.527 -2.229 11.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 75.680 -3.031 11.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 74.793 -4.310 11.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.929 -4.173 10.082 1.00 0.00 H new ATOM 919 N TYR A 61 69.126 -2.074 9.515 1.00 0.00 N ATOM 920 CA TYR A 61 68.351 -2.923 8.560 1.00 0.00 C ATOM 921 C TYR A 61 68.604 -2.425 7.136 1.00 0.00 C ATOM 922 O TYR A 61 69.200 -3.102 6.320 1.00 0.00 O ATOM 923 CB TYR A 61 66.846 -2.850 8.844 1.00 0.00 C ATOM 924 CG TYR A 61 66.550 -3.076 10.294 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.561 -3.386 11.202 1.00 0.00 C ATOM 926 CD2 TYR A 61 65.239 -2.944 10.729 1.00 0.00 C ATOM 927 CE1 TYR A 61 67.256 -3.559 12.544 1.00 0.00 C ATOM 928 CE2 TYR A 61 64.930 -3.126 12.066 1.00 0.00 C ATOM 929 CZ TYR A 61 65.939 -3.433 12.983 1.00 0.00 C ATOM 930 OH TYR A 61 65.634 -3.601 14.318 1.00 0.00 O ATOM 0 H TYR A 61 68.583 -1.622 10.250 1.00 0.00 H new ATOM 0 HA TYR A 61 68.678 -3.956 8.677 1.00 0.00 H new ATOM 0 HB2 TYR A 61 66.464 -1.875 8.541 1.00 0.00 H new ATOM 0 HB3 TYR A 61 66.325 -3.596 8.244 1.00 0.00 H new ATOM 0 HD1 TYR A 61 68.580 -3.491 10.861 1.00 0.00 H new ATOM 0 HD2 TYR A 61 64.459 -2.699 10.024 1.00 0.00 H new ATOM 0 HE1 TYR A 61 68.040 -3.792 13.250 1.00 0.00 H new ATOM 0 HE2 TYR A 61 63.908 -3.031 12.401 1.00 0.00 H new ATOM 0 HH TYR A 61 64.726 -3.275 14.490 1.00 0.00 H new ATOM 940 N VAL A 62 68.154 -1.236 6.838 1.00 0.00 N ATOM 941 CA VAL A 62 68.356 -0.660 5.484 1.00 0.00 C ATOM 942 C VAL A 62 69.853 -0.483 5.222 1.00 0.00 C ATOM 943 O VAL A 62 70.250 -0.160 4.120 1.00 0.00 O ATOM 944 CB VAL A 62 67.642 0.699 5.417 1.00 0.00 C ATOM 945 CG1 VAL A 62 68.278 1.593 4.347 1.00 0.00 C ATOM 946 CG2 VAL A 62 66.168 0.476 5.076 1.00 0.00 C ATOM 0 H VAL A 62 67.648 -0.633 7.487 1.00 0.00 H new ATOM 0 HA VAL A 62 67.945 -1.326 4.726 1.00 0.00 H new ATOM 0 HB VAL A 62 67.735 1.192 6.385 1.00 0.00 H new ATOM 0 HG11 VAL A 62 67.757 2.550 4.316 1.00 0.00 H new ATOM 0 HG12 VAL A 62 69.328 1.759 4.588 1.00 0.00 H new ATOM 0 HG13 VAL A 62 68.202 1.107 3.374 1.00 0.00 H new ATOM 0 HG21 VAL A 62 65.656 1.437 5.027 1.00 0.00 H new ATOM 0 HG22 VAL A 62 66.090 -0.026 4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 62 65.706 -0.142 5.846 1.00 0.00 H new ATOM 956 N SER A 63 70.688 -0.689 6.218 1.00 0.00 N ATOM 957 CA SER A 63 72.158 -0.535 6.005 1.00 0.00 C ATOM 958 C SER A 63 72.500 -1.096 4.625 1.00 0.00 C ATOM 959 O SER A 63 73.369 -0.609 3.929 1.00 0.00 O ATOM 960 CB SER A 63 72.919 -1.307 7.084 1.00 0.00 C ATOM 961 OG SER A 63 74.316 -1.126 6.894 1.00 0.00 O ATOM 0 H SER A 63 70.412 -0.956 7.163 1.00 0.00 H new ATOM 0 HA SER A 63 72.442 0.516 6.064 1.00 0.00 H new ATOM 0 HB2 SER A 63 72.626 -0.956 8.073 1.00 0.00 H new ATOM 0 HB3 SER A 63 72.668 -2.367 7.035 1.00 0.00 H new ATOM 0 HG SER A 63 74.807 -1.618 7.585 1.00 0.00 H new ATOM 1107 N ASP B 5 49.490 -1.105 5.806 1.00 0.00 N ATOM 1108 CA ASP B 5 48.146 -0.871 6.402 1.00 0.00 C ATOM 1109 C ASP B 5 48.164 0.404 7.251 1.00 0.00 C ATOM 1110 O ASP B 5 47.132 0.925 7.624 1.00 0.00 O ATOM 1111 CB ASP B 5 47.784 -2.063 7.292 1.00 0.00 C ATOM 1112 CG ASP B 5 46.264 -2.221 7.349 1.00 0.00 C ATOM 1113 OD1 ASP B 5 45.577 -1.296 6.947 1.00 0.00 O ATOM 1114 OD2 ASP B 5 45.813 -3.264 7.793 1.00 0.00 O ATOM 0 HA ASP B 5 47.411 -0.759 5.605 1.00 0.00 H new ATOM 0 HB2 ASP B 5 48.239 -2.973 6.901 1.00 0.00 H new ATOM 0 HB3 ASP B 5 48.182 -1.914 8.296 1.00 0.00 H new ATOM 1119 N THR B 6 49.326 0.893 7.582 1.00 0.00 N ATOM 1120 CA THR B 6 49.404 2.113 8.433 1.00 0.00 C ATOM 1121 C THR B 6 49.661 3.418 7.628 1.00 0.00 C ATOM 1122 O THR B 6 49.304 4.478 8.102 1.00 0.00 O ATOM 1123 CB THR B 6 50.502 1.908 9.485 1.00 0.00 C ATOM 1124 OG1 THR B 6 50.220 2.718 10.614 1.00 0.00 O ATOM 1125 CG2 THR B 6 51.882 2.274 8.920 1.00 0.00 C ATOM 0 H THR B 6 50.225 0.501 7.300 1.00 0.00 H new ATOM 0 HA THR B 6 48.431 2.246 8.907 1.00 0.00 H new ATOM 0 HB THR B 6 50.520 0.857 9.772 1.00 0.00 H new ATOM 0 HG1 THR B 6 50.821 2.475 11.349 1.00 0.00 H new ATOM 0 HG21 THR B 6 52.642 2.119 9.686 1.00 0.00 H new ATOM 0 HG22 THR B 6 52.102 1.643 8.059 1.00 0.00 H new ATOM 0 HG23 THR B 6 51.884 3.320 8.613 1.00 0.00 H new ATOM 1133 N PRO B 7 50.271 3.342 6.456 1.00 0.00 N ATOM 1134 CA PRO B 7 50.554 4.551 5.654 1.00 0.00 C ATOM 1135 C PRO B 7 49.291 5.038 4.932 1.00 0.00 C ATOM 1136 O PRO B 7 48.186 4.671 5.277 1.00 0.00 O ATOM 1137 CB PRO B 7 51.610 4.086 4.649 1.00 0.00 C ATOM 1138 CG PRO B 7 51.464 2.554 4.546 1.00 0.00 C ATOM 1139 CD PRO B 7 50.728 2.091 5.818 1.00 0.00 C ATOM 0 HA PRO B 7 50.892 5.389 6.263 1.00 0.00 H new ATOM 0 HB2 PRO B 7 51.457 4.557 3.678 1.00 0.00 H new ATOM 0 HB3 PRO B 7 52.611 4.360 4.982 1.00 0.00 H new ATOM 0 HG2 PRO B 7 50.903 2.278 3.653 1.00 0.00 H new ATOM 0 HG3 PRO B 7 52.441 2.077 4.469 1.00 0.00 H new ATOM 0 HD2 PRO B 7 49.889 1.439 5.576 1.00 0.00 H new ATOM 0 HD3 PRO B 7 51.389 1.528 6.477 1.00 0.00 H new ATOM 1147 N THR B 8 49.451 5.869 3.937 1.00 0.00 N ATOM 1148 CA THR B 8 48.264 6.389 3.196 1.00 0.00 C ATOM 1149 C THR B 8 48.434 6.122 1.695 1.00 0.00 C ATOM 1150 O THR B 8 49.536 6.027 1.192 1.00 0.00 O ATOM 1151 CB THR B 8 48.138 7.897 3.447 1.00 0.00 C ATOM 1152 OG1 THR B 8 47.595 8.114 4.743 1.00 0.00 O ATOM 1153 CG2 THR B 8 47.218 8.530 2.398 1.00 0.00 C ATOM 0 H THR B 8 50.353 6.211 3.605 1.00 0.00 H new ATOM 0 HA THR B 8 47.363 5.885 3.544 1.00 0.00 H new ATOM 0 HB THR B 8 49.125 8.355 3.378 1.00 0.00 H new ATOM 0 HG1 THR B 8 47.515 9.077 4.907 1.00 0.00 H new ATOM 0 HG21 THR B 8 47.135 9.601 2.585 1.00 0.00 H new ATOM 0 HG22 THR B 8 47.633 8.367 1.404 1.00 0.00 H new ATOM 0 HG23 THR B 8 46.230 8.074 2.458 1.00 0.00 H new ATOM 1161 N ALA B 9 47.347 6.000 0.976 1.00 0.00 N ATOM 1162 CA ALA B 9 47.444 5.739 -0.490 1.00 0.00 C ATOM 1163 C ALA B 9 47.125 7.022 -1.261 1.00 0.00 C ATOM 1164 O ALA B 9 46.127 7.672 -1.016 1.00 0.00 O ATOM 1165 CB ALA B 9 46.437 4.655 -0.885 1.00 0.00 C ATOM 0 H ALA B 9 46.397 6.070 1.342 1.00 0.00 H new ATOM 0 HA ALA B 9 48.454 5.408 -0.730 1.00 0.00 H new ATOM 0 HB1 ALA B 9 46.508 4.465 -1.956 1.00 0.00 H new ATOM 0 HB2 ALA B 9 46.656 3.738 -0.338 1.00 0.00 H new ATOM 0 HB3 ALA B 9 45.428 4.990 -0.642 1.00 0.00 H new ATOM 1171 N CYS B 10 47.957 7.387 -2.197 1.00 0.00 N ATOM 1172 CA CYS B 10 47.691 8.624 -2.987 1.00 0.00 C ATOM 1173 C CYS B 10 47.425 8.248 -4.444 1.00 0.00 C ATOM 1174 O CYS B 10 47.698 7.144 -4.872 1.00 0.00 O ATOM 1175 CB CYS B 10 48.911 9.548 -2.928 1.00 0.00 C ATOM 1176 SG CYS B 10 49.355 9.872 -1.205 1.00 0.00 S ATOM 0 H CYS B 10 48.808 6.884 -2.449 1.00 0.00 H new ATOM 0 HA CYS B 10 46.824 9.135 -2.570 1.00 0.00 H new ATOM 0 HB2 CYS B 10 49.751 9.089 -3.449 1.00 0.00 H new ATOM 0 HB3 CYS B 10 48.693 10.486 -3.439 1.00 0.00 H new ATOM 1181 N CYS B 11 46.910 9.163 -5.216 1.00 0.00 N ATOM 1182 CA CYS B 11 46.646 8.869 -6.648 1.00 0.00 C ATOM 1183 C CYS B 11 47.653 9.657 -7.486 1.00 0.00 C ATOM 1184 O CYS B 11 47.366 10.732 -7.967 1.00 0.00 O ATOM 1185 CB CYS B 11 45.222 9.298 -7.005 1.00 0.00 C ATOM 1186 SG CYS B 11 44.966 9.125 -8.786 1.00 0.00 S ATOM 0 H CYS B 11 46.660 10.105 -4.914 1.00 0.00 H new ATOM 0 HA CYS B 11 46.748 7.802 -6.844 1.00 0.00 H new ATOM 0 HB2 CYS B 11 44.500 8.687 -6.463 1.00 0.00 H new ATOM 0 HB3 CYS B 11 45.056 10.332 -6.702 1.00 0.00 H new ATOM 1191 N PHE B 12 48.839 9.139 -7.645 1.00 0.00 N ATOM 1192 CA PHE B 12 49.871 9.870 -8.433 1.00 0.00 C ATOM 1193 C PHE B 12 49.862 9.378 -9.876 1.00 0.00 C ATOM 1194 O PHE B 12 50.630 9.837 -10.699 1.00 0.00 O ATOM 1195 CB PHE B 12 51.253 9.611 -7.826 1.00 0.00 C ATOM 1196 CG PHE B 12 51.395 10.339 -6.508 1.00 0.00 C ATOM 1197 CD1 PHE B 12 50.283 10.945 -5.907 1.00 0.00 C ATOM 1198 CD2 PHE B 12 52.647 10.405 -5.886 1.00 0.00 C ATOM 1199 CE1 PHE B 12 50.425 11.616 -4.687 1.00 0.00 C ATOM 1200 CE2 PHE B 12 52.789 11.075 -4.666 1.00 0.00 C ATOM 1201 CZ PHE B 12 51.678 11.681 -4.067 1.00 0.00 C ATOM 0 H PHE B 12 49.138 8.242 -7.264 1.00 0.00 H new ATOM 0 HA PHE B 12 49.650 10.937 -8.410 1.00 0.00 H new ATOM 0 HB2 PHE B 12 51.396 8.541 -7.675 1.00 0.00 H new ATOM 0 HB3 PHE B 12 52.028 9.942 -8.517 1.00 0.00 H new ATOM 0 HD1 PHE B 12 49.316 10.894 -6.386 1.00 0.00 H new ATOM 0 HD2 PHE B 12 53.504 9.938 -6.348 1.00 0.00 H new ATOM 0 HE1 PHE B 12 49.568 12.083 -4.224 1.00 0.00 H new ATOM 0 HE2 PHE B 12 53.755 11.125 -4.186 1.00 0.00 H new ATOM 0 HZ PHE B 12 51.788 12.199 -3.126 1.00 0.00 H new ATOM 1211 N SER B 13 49.018 8.440 -10.195 1.00 0.00 N ATOM 1212 CA SER B 13 48.995 7.927 -11.587 1.00 0.00 C ATOM 1213 C SER B 13 47.555 7.798 -12.078 1.00 0.00 C ATOM 1214 O SER B 13 46.698 7.307 -11.377 1.00 0.00 O ATOM 1215 CB SER B 13 49.665 6.556 -11.619 1.00 0.00 C ATOM 1216 OG SER B 13 51.075 6.720 -11.535 1.00 0.00 O ATOM 0 H SER B 13 48.349 8.010 -9.557 1.00 0.00 H new ATOM 0 HA SER B 13 49.528 8.622 -12.236 1.00 0.00 H new ATOM 0 HB2 SER B 13 49.308 5.945 -10.790 1.00 0.00 H new ATOM 0 HB3 SER B 13 49.402 6.031 -12.538 1.00 0.00 H new ATOM 0 HG SER B 13 51.474 5.922 -11.129 1.00 0.00 H new ATOM 1222 N TYR B 14 47.288 8.216 -13.288 1.00 0.00 N ATOM 1223 CA TYR B 14 45.906 8.095 -13.838 1.00 0.00 C ATOM 1224 C TYR B 14 45.992 7.494 -15.243 1.00 0.00 C ATOM 1225 O TYR B 14 47.059 7.391 -15.815 1.00 0.00 O ATOM 1226 CB TYR B 14 45.216 9.466 -13.912 1.00 0.00 C ATOM 1227 CG TYR B 14 45.954 10.478 -13.067 1.00 0.00 C ATOM 1228 CD1 TYR B 14 45.919 10.380 -11.673 1.00 0.00 C ATOM 1229 CD2 TYR B 14 46.666 11.516 -13.678 1.00 0.00 C ATOM 1230 CE1 TYR B 14 46.595 11.320 -10.886 1.00 0.00 C ATOM 1231 CE2 TYR B 14 47.343 12.458 -12.893 1.00 0.00 C ATOM 1232 CZ TYR B 14 47.308 12.359 -11.496 1.00 0.00 C ATOM 1233 OH TYR B 14 47.974 13.287 -10.723 1.00 0.00 O ATOM 0 H TYR B 14 47.969 8.637 -13.920 1.00 0.00 H new ATOM 0 HA TYR B 14 45.318 7.455 -13.180 1.00 0.00 H new ATOM 0 HB2 TYR B 14 45.180 9.806 -14.947 1.00 0.00 H new ATOM 0 HB3 TYR B 14 44.185 9.380 -13.568 1.00 0.00 H new ATOM 0 HD1 TYR B 14 45.370 9.578 -11.202 1.00 0.00 H new ATOM 0 HD2 TYR B 14 46.694 11.591 -14.755 1.00 0.00 H new ATOM 0 HE1 TYR B 14 46.566 11.244 -9.809 1.00 0.00 H new ATOM 0 HE2 TYR B 14 47.892 13.260 -13.364 1.00 0.00 H new ATOM 0 HH TYR B 14 48.418 13.939 -11.305 1.00 0.00 H new ATOM 1243 N THR B 15 44.887 7.086 -15.804 1.00 0.00 N ATOM 1244 CA THR B 15 44.932 6.483 -17.169 1.00 0.00 C ATOM 1245 C THR B 15 44.484 7.502 -18.216 1.00 0.00 C ATOM 1246 O THR B 15 43.622 8.322 -17.970 1.00 0.00 O ATOM 1247 CB THR B 15 44.007 5.266 -17.224 1.00 0.00 C ATOM 1248 OG1 THR B 15 44.037 4.712 -18.532 1.00 0.00 O ATOM 1249 CG2 THR B 15 42.579 5.692 -16.881 1.00 0.00 C ATOM 0 H THR B 15 43.960 7.143 -15.381 1.00 0.00 H new ATOM 0 HA THR B 15 45.957 6.179 -17.382 1.00 0.00 H new ATOM 0 HB THR B 15 44.343 4.520 -16.504 1.00 0.00 H new ATOM 0 HG1 THR B 15 43.149 4.788 -18.940 1.00 0.00 H new ATOM 0 HG21 THR B 15 41.921 4.824 -16.921 1.00 0.00 H new ATOM 0 HG22 THR B 15 42.557 6.118 -15.878 1.00 0.00 H new ATOM 0 HG23 THR B 15 42.239 6.438 -17.600 1.00 0.00 H new ATOM 1257 N SER B 16 45.048 7.441 -19.393 1.00 0.00 N ATOM 1258 CA SER B 16 44.635 8.389 -20.464 1.00 0.00 C ATOM 1259 C SER B 16 43.230 8.004 -20.924 1.00 0.00 C ATOM 1260 O SER B 16 42.387 8.847 -21.161 1.00 0.00 O ATOM 1261 CB SER B 16 45.606 8.296 -21.642 1.00 0.00 C ATOM 1262 OG SER B 16 45.976 6.938 -21.839 1.00 0.00 O ATOM 0 H SER B 16 45.775 6.776 -19.657 1.00 0.00 H new ATOM 0 HA SER B 16 44.643 9.411 -20.085 1.00 0.00 H new ATOM 0 HB2 SER B 16 45.140 8.693 -22.544 1.00 0.00 H new ATOM 0 HB3 SER B 16 46.491 8.902 -21.447 1.00 0.00 H new ATOM 0 HG SER B 16 46.597 6.874 -22.594 1.00 0.00 H new ATOM 1268 N ARG B 17 42.969 6.729 -21.027 1.00 0.00 N ATOM 1269 CA ARG B 17 41.615 6.275 -21.443 1.00 0.00 C ATOM 1270 C ARG B 17 40.773 6.073 -20.184 1.00 0.00 C ATOM 1271 O ARG B 17 41.034 5.194 -19.387 1.00 0.00 O ATOM 1272 CB ARG B 17 41.722 4.953 -22.206 1.00 0.00 C ATOM 1273 CG ARG B 17 40.845 5.016 -23.457 1.00 0.00 C ATOM 1274 CD ARG B 17 40.374 3.606 -23.822 1.00 0.00 C ATOM 1275 NE ARG B 17 39.274 3.694 -24.822 1.00 0.00 N ATOM 1276 CZ ARG B 17 38.061 3.979 -24.435 1.00 0.00 C ATOM 1277 NH1 ARG B 17 37.483 3.259 -23.513 1.00 0.00 N ATOM 1278 NH2 ARG B 17 37.426 4.985 -24.971 1.00 0.00 N ATOM 0 H ARG B 17 43.638 5.982 -20.840 1.00 0.00 H new ATOM 0 HA ARG B 17 41.154 7.018 -22.093 1.00 0.00 H new ATOM 0 HB2 ARG B 17 42.759 4.764 -22.484 1.00 0.00 H new ATOM 0 HB3 ARG B 17 41.407 4.126 -21.569 1.00 0.00 H new ATOM 0 HG2 ARG B 17 39.986 5.663 -23.280 1.00 0.00 H new ATOM 0 HG3 ARG B 17 41.405 5.450 -24.285 1.00 0.00 H new ATOM 0 HD2 ARG B 17 41.204 3.027 -24.228 1.00 0.00 H new ATOM 0 HD3 ARG B 17 40.028 3.084 -22.930 1.00 0.00 H new ATOM 0 HE ARG B 17 39.469 3.531 -25.810 1.00 0.00 H new ATOM 0 HH11 ARG B 17 37.979 2.473 -23.094 1.00 0.00 H new ATOM 0 HH12 ARG B 17 36.535 3.483 -23.211 1.00 0.00 H new ATOM 0 HH21 ARG B 17 37.878 5.548 -25.692 1.00 0.00 H new ATOM 0 HH22 ARG B 17 36.478 5.209 -24.669 1.00 0.00 H new ATOM 1292 N GLN B 18 39.783 6.894 -19.983 1.00 0.00 N ATOM 1293 CA GLN B 18 38.948 6.763 -18.765 1.00 0.00 C ATOM 1294 C GLN B 18 38.327 5.384 -18.659 1.00 0.00 C ATOM 1295 O GLN B 18 38.747 4.426 -19.276 1.00 0.00 O ATOM 1296 CB GLN B 18 37.841 7.798 -18.778 1.00 0.00 C ATOM 1297 CG GLN B 18 38.340 9.120 -19.371 1.00 0.00 C ATOM 1298 CD GLN B 18 39.754 9.426 -18.864 1.00 0.00 C ATOM 1299 OE1 GLN B 18 40.544 10.034 -19.559 1.00 0.00 O ATOM 1300 NE2 GLN B 18 40.106 9.026 -17.673 1.00 0.00 N ATOM 0 H GLN B 18 39.517 7.651 -20.613 1.00 0.00 H new ATOM 0 HA GLN B 18 39.600 6.919 -17.906 1.00 0.00 H new ATOM 0 HB2 GLN B 18 36.998 7.428 -19.361 1.00 0.00 H new ATOM 0 HB3 GLN B 18 37.479 7.963 -17.763 1.00 0.00 H new ATOM 0 HG2 GLN B 18 38.341 9.062 -20.459 1.00 0.00 H new ATOM 0 HG3 GLN B 18 37.664 9.929 -19.095 1.00 0.00 H new ATOM 0 HE21 GLN B 18 39.443 8.516 -17.090 1.00 0.00 H new ATOM 0 HE22 GLN B 18 41.044 9.224 -17.325 1.00 0.00 H new ATOM 1309 N ILE B 19 37.320 5.309 -17.853 1.00 0.00 N ATOM 1310 CA ILE B 19 36.598 4.053 -17.618 1.00 0.00 C ATOM 1311 C ILE B 19 35.134 4.421 -17.422 1.00 0.00 C ATOM 1312 O ILE B 19 34.762 4.957 -16.398 1.00 0.00 O ATOM 1313 CB ILE B 19 37.119 3.374 -16.354 1.00 0.00 C ATOM 1314 CG1 ILE B 19 37.816 4.395 -15.453 1.00 0.00 C ATOM 1315 CG2 ILE B 19 38.113 2.284 -16.735 1.00 0.00 C ATOM 1316 CD1 ILE B 19 38.393 3.685 -14.226 1.00 0.00 C ATOM 0 H ILE B 19 36.956 6.104 -17.327 1.00 0.00 H new ATOM 0 HA ILE B 19 36.733 3.368 -18.455 1.00 0.00 H new ATOM 0 HB ILE B 19 36.277 2.938 -15.817 1.00 0.00 H new ATOM 0 HG12 ILE B 19 38.612 4.897 -16.003 1.00 0.00 H new ATOM 0 HG13 ILE B 19 37.109 5.164 -15.142 1.00 0.00 H new ATOM 0 HG21 ILE B 19 38.485 1.799 -15.832 1.00 0.00 H new ATOM 0 HG22 ILE B 19 37.619 1.545 -17.366 1.00 0.00 H new ATOM 0 HG23 ILE B 19 38.947 2.726 -17.279 1.00 0.00 H new ATOM 0 HD11 ILE B 19 38.890 4.413 -13.584 1.00 0.00 H new ATOM 0 HD12 ILE B 19 37.587 3.203 -13.672 1.00 0.00 H new ATOM 0 HD13 ILE B 19 39.114 2.933 -14.546 1.00 0.00 H new ATOM 1328 N PRO B 20 34.351 4.138 -18.413 1.00 0.00 N ATOM 1329 CA PRO B 20 32.916 4.440 -18.393 1.00 0.00 C ATOM 1330 C PRO B 20 32.218 3.609 -17.319 1.00 0.00 C ATOM 1331 O PRO B 20 32.581 2.479 -17.065 1.00 0.00 O ATOM 1332 CB PRO B 20 32.462 4.093 -19.813 1.00 0.00 C ATOM 1333 CG PRO B 20 33.538 3.141 -20.380 1.00 0.00 C ATOM 1334 CD PRO B 20 34.819 3.461 -19.632 1.00 0.00 C ATOM 0 HA PRO B 20 32.678 5.474 -18.141 1.00 0.00 H new ATOM 0 HB2 PRO B 20 31.483 3.615 -19.804 1.00 0.00 H new ATOM 0 HB3 PRO B 20 32.373 4.991 -20.425 1.00 0.00 H new ATOM 0 HG2 PRO B 20 33.252 2.099 -20.235 1.00 0.00 H new ATOM 0 HG3 PRO B 20 33.665 3.291 -21.452 1.00 0.00 H new ATOM 0 HD2 PRO B 20 35.382 2.558 -19.397 1.00 0.00 H new ATOM 0 HD3 PRO B 20 35.476 4.103 -20.219 1.00 0.00 H new ATOM 1342 N GLN B 21 31.241 4.189 -16.668 1.00 0.00 N ATOM 1343 CA GLN B 21 30.511 3.478 -15.576 1.00 0.00 C ATOM 1344 C GLN B 21 30.405 1.979 -15.886 1.00 0.00 C ATOM 1345 O GLN B 21 30.383 1.155 -14.993 1.00 0.00 O ATOM 1346 CB GLN B 21 29.103 4.068 -15.448 1.00 0.00 C ATOM 1347 CG GLN B 21 29.138 5.320 -14.564 1.00 0.00 C ATOM 1348 CD GLN B 21 27.876 5.366 -13.701 1.00 0.00 C ATOM 1349 OE1 GLN B 21 27.696 4.547 -12.822 1.00 0.00 O ATOM 1350 NE2 GLN B 21 26.986 6.295 -13.918 1.00 0.00 N ATOM 0 H GLN B 21 30.915 5.138 -16.850 1.00 0.00 H new ATOM 0 HA GLN B 21 31.060 3.605 -14.643 1.00 0.00 H new ATOM 0 HB2 GLN B 21 28.714 4.320 -16.435 1.00 0.00 H new ATOM 0 HB3 GLN B 21 28.427 3.328 -15.019 1.00 0.00 H new ATOM 0 HG2 GLN B 21 30.025 5.307 -13.931 1.00 0.00 H new ATOM 0 HG3 GLN B 21 29.202 6.215 -15.183 1.00 0.00 H new ATOM 0 HE21 GLN B 21 27.136 6.983 -14.656 1.00 0.00 H new ATOM 0 HE22 GLN B 21 26.140 6.333 -13.350 1.00 0.00 H new ATOM 1359 N ASN B 22 30.344 1.614 -17.139 1.00 0.00 N ATOM 1360 CA ASN B 22 30.244 0.164 -17.486 1.00 0.00 C ATOM 1361 C ASN B 22 31.648 -0.447 -17.570 1.00 0.00 C ATOM 1362 O ASN B 22 31.916 -1.297 -18.395 1.00 0.00 O ATOM 1363 CB ASN B 22 29.541 0.000 -18.837 1.00 0.00 C ATOM 1364 CG ASN B 22 30.019 1.085 -19.805 1.00 0.00 C ATOM 1365 OD1 ASN B 22 31.159 1.500 -19.754 1.00 0.00 O ATOM 1366 ND2 ASN B 22 29.188 1.562 -20.691 1.00 0.00 N ATOM 0 H ASN B 22 30.359 2.252 -17.934 1.00 0.00 H new ATOM 0 HA ASN B 22 29.669 -0.346 -16.713 1.00 0.00 H new ATOM 0 HB2 ASN B 22 29.752 -0.987 -19.249 1.00 0.00 H new ATOM 0 HB3 ASN B 22 28.461 0.067 -18.706 1.00 0.00 H new ATOM 0 HD21 ASN B 22 29.496 2.284 -21.342 1.00 0.00 H new ATOM 0 HD22 ASN B 22 28.231 1.212 -20.733 1.00 0.00 H new ATOM 1373 N PHE B 23 32.544 -0.024 -16.719 1.00 0.00 N ATOM 1374 CA PHE B 23 33.926 -0.579 -16.742 1.00 0.00 C ATOM 1375 C PHE B 23 34.619 -0.213 -15.432 1.00 0.00 C ATOM 1376 O PHE B 23 35.825 -0.082 -15.370 1.00 0.00 O ATOM 1377 CB PHE B 23 34.703 0.037 -17.906 1.00 0.00 C ATOM 1378 CG PHE B 23 35.564 -1.014 -18.558 1.00 0.00 C ATOM 1379 CD1 PHE B 23 36.379 -1.838 -17.774 1.00 0.00 C ATOM 1380 CD2 PHE B 23 35.553 -1.160 -19.950 1.00 0.00 C ATOM 1381 CE1 PHE B 23 37.182 -2.810 -18.381 1.00 0.00 C ATOM 1382 CE2 PHE B 23 36.355 -2.131 -20.558 1.00 0.00 C ATOM 1383 CZ PHE B 23 37.170 -2.957 -19.774 1.00 0.00 C ATOM 0 H PHE B 23 32.376 0.686 -16.006 1.00 0.00 H new ATOM 0 HA PHE B 23 33.889 -1.662 -16.862 1.00 0.00 H new ATOM 0 HB2 PHE B 23 34.011 0.457 -18.636 1.00 0.00 H new ATOM 0 HB3 PHE B 23 35.324 0.858 -17.547 1.00 0.00 H new ATOM 0 HD1 PHE B 23 36.388 -1.724 -16.700 1.00 0.00 H new ATOM 0 HD2 PHE B 23 34.925 -0.523 -20.555 1.00 0.00 H new ATOM 0 HE1 PHE B 23 37.811 -3.446 -17.776 1.00 0.00 H new ATOM 0 HE2 PHE B 23 36.346 -2.244 -21.632 1.00 0.00 H new ATOM 0 HZ PHE B 23 37.789 -3.707 -20.243 1.00 0.00 H new ATOM 1393 N ILE B 24 33.861 -0.015 -14.391 1.00 0.00 N ATOM 1394 CA ILE B 24 34.470 0.379 -13.097 1.00 0.00 C ATOM 1395 C ILE B 24 33.776 -0.350 -11.946 1.00 0.00 C ATOM 1396 O ILE B 24 32.817 -1.074 -12.132 1.00 0.00 O ATOM 1397 CB ILE B 24 34.307 1.901 -12.957 1.00 0.00 C ATOM 1398 CG1 ILE B 24 35.678 2.562 -13.007 1.00 0.00 C ATOM 1399 CG2 ILE B 24 33.613 2.295 -11.641 1.00 0.00 C ATOM 1400 CD1 ILE B 24 35.481 4.069 -12.948 1.00 0.00 C ATOM 0 H ILE B 24 32.845 -0.110 -14.383 1.00 0.00 H new ATOM 0 HA ILE B 24 35.526 0.109 -13.066 1.00 0.00 H new ATOM 0 HB ILE B 24 33.680 2.240 -13.782 1.00 0.00 H new ATOM 0 HG12 ILE B 24 36.293 2.226 -12.172 1.00 0.00 H new ATOM 0 HG13 ILE B 24 36.202 2.283 -13.921 1.00 0.00 H new ATOM 0 HG21 ILE B 24 33.521 3.380 -11.589 1.00 0.00 H new ATOM 0 HG22 ILE B 24 32.621 1.845 -11.604 1.00 0.00 H new ATOM 0 HG23 ILE B 24 34.205 1.940 -10.797 1.00 0.00 H new ATOM 0 HD11 ILE B 24 36.451 4.564 -12.982 1.00 0.00 H new ATOM 0 HD12 ILE B 24 34.879 4.391 -13.798 1.00 0.00 H new ATOM 0 HD13 ILE B 24 34.971 4.333 -12.021 1.00 0.00 H new ATOM 1412 N ALA B 25 34.254 -0.137 -10.756 1.00 0.00 N ATOM 1413 CA ALA B 25 33.635 -0.781 -9.573 1.00 0.00 C ATOM 1414 C ALA B 25 33.728 0.173 -8.379 1.00 0.00 C ATOM 1415 O ALA B 25 32.733 0.653 -7.877 1.00 0.00 O ATOM 1416 CB ALA B 25 34.374 -2.082 -9.248 1.00 0.00 C ATOM 0 H ALA B 25 35.054 0.461 -10.552 1.00 0.00 H new ATOM 0 HA ALA B 25 32.590 -1.007 -9.784 1.00 0.00 H new ATOM 0 HB1 ALA B 25 33.916 -2.553 -8.378 1.00 0.00 H new ATOM 0 HB2 ALA B 25 34.313 -2.758 -10.101 1.00 0.00 H new ATOM 0 HB3 ALA B 25 35.420 -1.863 -9.034 1.00 0.00 H new ATOM 1422 N ALA B 26 34.921 0.447 -7.921 1.00 0.00 N ATOM 1423 CA ALA B 26 35.084 1.369 -6.757 1.00 0.00 C ATOM 1424 C ALA B 26 35.580 2.742 -7.232 1.00 0.00 C ATOM 1425 O ALA B 26 35.250 3.198 -8.307 1.00 0.00 O ATOM 1426 CB ALA B 26 36.090 0.767 -5.777 1.00 0.00 C ATOM 0 H ALA B 26 35.790 0.073 -8.302 1.00 0.00 H new ATOM 0 HA ALA B 26 34.121 1.498 -6.263 1.00 0.00 H new ATOM 0 HB1 ALA B 26 36.213 1.436 -4.925 1.00 0.00 H new ATOM 0 HB2 ALA B 26 35.726 -0.200 -5.430 1.00 0.00 H new ATOM 0 HB3 ALA B 26 37.050 0.635 -6.276 1.00 0.00 H new ATOM 1432 N TYR B 27 36.392 3.393 -6.431 1.00 0.00 N ATOM 1433 CA TYR B 27 36.944 4.725 -6.818 1.00 0.00 C ATOM 1434 C TYR B 27 37.857 5.238 -5.693 1.00 0.00 C ATOM 1435 O TYR B 27 38.994 5.598 -5.913 1.00 0.00 O ATOM 1436 CB TYR B 27 35.806 5.728 -7.080 1.00 0.00 C ATOM 1437 CG TYR B 27 35.299 6.313 -5.779 1.00 0.00 C ATOM 1438 CD1 TYR B 27 35.901 7.461 -5.251 1.00 0.00 C ATOM 1439 CD2 TYR B 27 34.229 5.712 -5.104 1.00 0.00 C ATOM 1440 CE1 TYR B 27 35.433 8.009 -4.050 1.00 0.00 C ATOM 1441 CE2 TYR B 27 33.761 6.260 -3.901 1.00 0.00 C ATOM 1442 CZ TYR B 27 34.364 7.408 -3.375 1.00 0.00 C ATOM 1443 OH TYR B 27 33.904 7.949 -2.191 1.00 0.00 O ATOM 0 H TYR B 27 36.696 3.053 -5.519 1.00 0.00 H new ATOM 0 HA TYR B 27 37.521 4.621 -7.737 1.00 0.00 H new ATOM 0 HB2 TYR B 27 36.162 6.528 -7.730 1.00 0.00 H new ATOM 0 HB3 TYR B 27 34.990 5.231 -7.604 1.00 0.00 H new ATOM 0 HD1 TYR B 27 36.727 7.925 -5.770 1.00 0.00 H new ATOM 0 HD2 TYR B 27 33.764 4.826 -5.510 1.00 0.00 H new ATOM 0 HE1 TYR B 27 35.897 8.896 -3.644 1.00 0.00 H new ATOM 0 HE2 TYR B 27 32.936 5.796 -3.381 1.00 0.00 H new ATOM 0 HH TYR B 27 33.157 7.411 -1.854 1.00 0.00 H new ATOM 1453 N PHE B 28 37.369 5.270 -4.488 1.00 0.00 N ATOM 1454 CA PHE B 28 38.208 5.757 -3.360 1.00 0.00 C ATOM 1455 C PHE B 28 38.600 7.209 -3.614 1.00 0.00 C ATOM 1456 O PHE B 28 38.595 7.676 -4.735 1.00 0.00 O ATOM 1457 CB PHE B 28 39.476 4.907 -3.256 1.00 0.00 C ATOM 1458 CG PHE B 28 39.104 3.472 -2.974 1.00 0.00 C ATOM 1459 CD1 PHE B 28 38.722 2.630 -4.024 1.00 0.00 C ATOM 1460 CD2 PHE B 28 39.146 2.984 -1.664 1.00 0.00 C ATOM 1461 CE1 PHE B 28 38.381 1.299 -3.762 1.00 0.00 C ATOM 1462 CE2 PHE B 28 38.805 1.652 -1.401 1.00 0.00 C ATOM 1463 CZ PHE B 28 38.422 0.810 -2.451 1.00 0.00 C ATOM 0 H PHE B 28 36.425 4.980 -4.234 1.00 0.00 H new ATOM 0 HA PHE B 28 37.642 5.682 -2.431 1.00 0.00 H new ATOM 0 HB2 PHE B 28 40.045 4.970 -4.184 1.00 0.00 H new ATOM 0 HB3 PHE B 28 40.118 5.289 -2.462 1.00 0.00 H new ATOM 0 HD1 PHE B 28 38.690 3.007 -5.035 1.00 0.00 H new ATOM 0 HD2 PHE B 28 39.442 3.635 -0.855 1.00 0.00 H new ATOM 0 HE1 PHE B 28 38.086 0.648 -4.572 1.00 0.00 H new ATOM 0 HE2 PHE B 28 38.837 1.275 -0.390 1.00 0.00 H new ATOM 0 HZ PHE B 28 38.158 -0.218 -2.250 1.00 0.00 H new ATOM 1473 N GLU B 29 38.950 7.928 -2.588 1.00 0.00 N ATOM 1474 CA GLU B 29 39.353 9.344 -2.784 1.00 0.00 C ATOM 1475 C GLU B 29 40.576 9.640 -1.928 1.00 0.00 C ATOM 1476 O GLU B 29 40.597 10.568 -1.144 1.00 0.00 O ATOM 1477 CB GLU B 29 38.205 10.268 -2.393 1.00 0.00 C ATOM 1478 CG GLU B 29 37.754 9.932 -0.972 1.00 0.00 C ATOM 1479 CD GLU B 29 36.745 10.976 -0.492 1.00 0.00 C ATOM 1480 OE1 GLU B 29 36.817 12.101 -0.959 1.00 0.00 O ATOM 1481 OE2 GLU B 29 35.919 10.633 0.337 1.00 0.00 O ATOM 0 H GLU B 29 38.974 7.597 -1.624 1.00 0.00 H new ATOM 0 HA GLU B 29 39.596 9.513 -3.833 1.00 0.00 H new ATOM 0 HB2 GLU B 29 38.524 11.309 -2.450 1.00 0.00 H new ATOM 0 HB3 GLU B 29 37.374 10.151 -3.089 1.00 0.00 H new ATOM 0 HG2 GLU B 29 37.304 8.939 -0.948 1.00 0.00 H new ATOM 0 HG3 GLU B 29 38.614 9.909 -0.303 1.00 0.00 H new ATOM 1488 N THR B 30 41.601 8.861 -2.103 1.00 0.00 N ATOM 1489 CA THR B 30 42.863 9.070 -1.340 1.00 0.00 C ATOM 1490 C THR B 30 42.562 9.513 0.097 1.00 0.00 C ATOM 1491 O THR B 30 42.010 8.761 0.875 1.00 0.00 O ATOM 1492 CB THR B 30 43.693 10.127 -2.059 1.00 0.00 C ATOM 1493 OG1 THR B 30 42.943 11.327 -2.149 1.00 0.00 O ATOM 1494 CG2 THR B 30 44.031 9.623 -3.462 1.00 0.00 C ATOM 0 H THR B 30 41.621 8.075 -2.752 1.00 0.00 H new ATOM 0 HA THR B 30 43.418 8.133 -1.288 1.00 0.00 H new ATOM 0 HB THR B 30 44.614 10.318 -1.508 1.00 0.00 H new ATOM 0 HG1 THR B 30 42.189 11.289 -1.524 1.00 0.00 H new ATOM 0 HG21 THR B 30 44.625 10.373 -3.985 1.00 0.00 H new ATOM 0 HG22 THR B 30 44.600 8.696 -3.388 1.00 0.00 H new ATOM 0 HG23 THR B 30 43.110 9.440 -4.015 1.00 0.00 H new ATOM 1502 N SER B 31 42.937 10.711 0.475 1.00 0.00 N ATOM 1503 CA SER B 31 42.682 11.145 1.872 1.00 0.00 C ATOM 1504 C SER B 31 43.211 12.564 2.088 1.00 0.00 C ATOM 1505 O SER B 31 43.655 13.221 1.167 1.00 0.00 O ATOM 1506 CB SER B 31 43.427 10.190 2.794 1.00 0.00 C ATOM 1507 OG SER B 31 42.564 9.764 3.839 1.00 0.00 O ATOM 0 H SER B 31 43.403 11.396 -0.120 1.00 0.00 H new ATOM 0 HA SER B 31 41.612 11.137 2.078 1.00 0.00 H new ATOM 0 HB2 SER B 31 43.784 9.328 2.230 1.00 0.00 H new ATOM 0 HB3 SER B 31 44.305 10.683 3.212 1.00 0.00 H new ATOM 0 HG SER B 31 43.045 9.148 4.430 1.00 0.00 H new ATOM 1513 N SER B 32 43.181 13.035 3.306 1.00 0.00 N ATOM 1514 CA SER B 32 43.697 14.402 3.592 1.00 0.00 C ATOM 1515 C SER B 32 45.217 14.394 3.447 1.00 0.00 C ATOM 1516 O SER B 32 45.756 14.848 2.457 1.00 0.00 O ATOM 1517 CB SER B 32 43.321 14.803 5.018 1.00 0.00 C ATOM 1518 OG SER B 32 42.166 15.631 4.984 1.00 0.00 O ATOM 0 H SER B 32 42.820 12.530 4.116 1.00 0.00 H new ATOM 0 HA SER B 32 43.261 15.117 2.894 1.00 0.00 H new ATOM 0 HB2 SER B 32 43.128 13.914 5.619 1.00 0.00 H new ATOM 0 HB3 SER B 32 44.149 15.333 5.489 1.00 0.00 H new ATOM 0 HG SER B 32 41.921 15.889 5.897 1.00 0.00 H new ATOM 1524 N GLN B 33 45.916 13.868 4.415 1.00 0.00 N ATOM 1525 CA GLN B 33 47.399 13.823 4.305 1.00 0.00 C ATOM 1526 C GLN B 33 47.759 13.303 2.916 1.00 0.00 C ATOM 1527 O GLN B 33 47.606 12.132 2.639 1.00 0.00 O ATOM 1528 CB GLN B 33 47.969 12.879 5.367 1.00 0.00 C ATOM 1529 CG GLN B 33 48.138 13.633 6.687 1.00 0.00 C ATOM 1530 CD GLN B 33 49.247 12.975 7.511 1.00 0.00 C ATOM 1531 OE1 GLN B 33 50.032 13.651 8.143 1.00 0.00 O ATOM 1532 NE2 GLN B 33 49.343 11.673 7.528 1.00 0.00 N ATOM 0 H GLN B 33 45.527 13.471 5.270 1.00 0.00 H new ATOM 0 HA GLN B 33 47.816 14.818 4.458 1.00 0.00 H new ATOM 0 HB2 GLN B 33 47.303 12.027 5.506 1.00 0.00 H new ATOM 0 HB3 GLN B 33 48.929 12.482 5.038 1.00 0.00 H new ATOM 0 HG2 GLN B 33 48.385 14.677 6.493 1.00 0.00 H new ATOM 0 HG3 GLN B 33 47.202 13.625 7.245 1.00 0.00 H new ATOM 0 HE21 GLN B 33 48.683 11.106 6.996 1.00 0.00 H new ATOM 0 HE22 GLN B 33 50.078 11.223 8.073 1.00 0.00 H new ATOM 1541 N CYS B 34 48.212 14.182 2.048 1.00 0.00 N ATOM 1542 CA CYS B 34 48.581 13.798 0.642 1.00 0.00 C ATOM 1543 C CYS B 34 47.459 14.243 -0.298 1.00 0.00 C ATOM 1544 O CYS B 34 46.729 13.436 -0.836 1.00 0.00 O ATOM 1545 CB CYS B 34 48.782 12.283 0.513 1.00 0.00 C ATOM 1546 SG CYS B 34 49.506 11.885 -1.097 1.00 0.00 S ATOM 0 H CYS B 34 48.344 15.171 2.260 1.00 0.00 H new ATOM 0 HA CYS B 34 49.519 14.287 0.380 1.00 0.00 H new ATOM 0 HB2 CYS B 34 49.433 11.926 1.311 1.00 0.00 H new ATOM 0 HB3 CYS B 34 47.827 11.771 0.627 1.00 0.00 H new ATOM 1551 N SER B 35 47.316 15.526 -0.489 1.00 0.00 N ATOM 1552 CA SER B 35 46.239 16.039 -1.385 1.00 0.00 C ATOM 1553 C SER B 35 46.304 15.325 -2.737 1.00 0.00 C ATOM 1554 O SER B 35 46.958 15.775 -3.657 1.00 0.00 O ATOM 1555 CB SER B 35 46.433 17.542 -1.591 1.00 0.00 C ATOM 1556 OG SER B 35 46.462 18.190 -0.326 1.00 0.00 O ATOM 0 H SER B 35 47.901 16.244 -0.062 1.00 0.00 H new ATOM 0 HA SER B 35 45.267 15.851 -0.929 1.00 0.00 H new ATOM 0 HB2 SER B 35 47.362 17.730 -2.130 1.00 0.00 H new ATOM 0 HB3 SER B 35 45.624 17.945 -2.200 1.00 0.00 H new ATOM 0 HG SER B 35 46.588 19.153 -0.455 1.00 0.00 H new ATOM 1562 N LYS B 36 45.633 14.212 -2.863 1.00 0.00 N ATOM 1563 CA LYS B 36 45.654 13.461 -4.149 1.00 0.00 C ATOM 1564 C LYS B 36 45.192 14.362 -5.304 1.00 0.00 C ATOM 1565 O LYS B 36 44.310 15.180 -5.134 1.00 0.00 O ATOM 1566 CB LYS B 36 44.712 12.263 -4.024 1.00 0.00 C ATOM 1567 CG LYS B 36 43.259 12.705 -4.265 1.00 0.00 C ATOM 1568 CD LYS B 36 42.829 13.675 -3.161 1.00 0.00 C ATOM 1569 CE LYS B 36 41.309 13.618 -2.986 1.00 0.00 C ATOM 1570 NZ LYS B 36 40.645 14.091 -4.233 1.00 0.00 N ATOM 0 H LYS B 36 45.069 13.789 -2.126 1.00 0.00 H new ATOM 0 HA LYS B 36 46.670 13.126 -4.360 1.00 0.00 H new ATOM 0 HB2 LYS B 36 44.991 11.495 -4.745 1.00 0.00 H new ATOM 0 HB3 LYS B 36 44.805 11.819 -3.033 1.00 0.00 H new ATOM 0 HG2 LYS B 36 43.171 13.185 -5.240 1.00 0.00 H new ATOM 0 HG3 LYS B 36 42.601 11.836 -4.277 1.00 0.00 H new ATOM 0 HD2 LYS B 36 43.322 13.416 -2.224 1.00 0.00 H new ATOM 0 HD3 LYS B 36 43.138 14.689 -3.414 1.00 0.00 H new ATOM 0 HE2 LYS B 36 40.997 12.598 -2.760 1.00 0.00 H new ATOM 0 HE3 LYS B 36 41.006 14.239 -2.143 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 39.624 14.197 -4.064 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 41.047 15.008 -4.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 40.800 13.398 -4.993 1.00 0.00 H new ATOM 1584 N PRO B 37 45.791 14.166 -6.453 1.00 0.00 N ATOM 1585 CA PRO B 37 45.453 14.928 -7.666 1.00 0.00 C ATOM 1586 C PRO B 37 44.234 14.314 -8.365 1.00 0.00 C ATOM 1587 O PRO B 37 43.859 14.722 -9.446 1.00 0.00 O ATOM 1588 CB PRO B 37 46.693 14.768 -8.544 1.00 0.00 C ATOM 1589 CG PRO B 37 47.410 13.486 -8.059 1.00 0.00 C ATOM 1590 CD PRO B 37 46.874 13.181 -6.647 1.00 0.00 C ATOM 0 HA PRO B 37 45.203 15.968 -7.456 1.00 0.00 H new ATOM 0 HB2 PRO B 37 46.416 14.684 -9.595 1.00 0.00 H new ATOM 0 HB3 PRO B 37 47.347 15.636 -8.455 1.00 0.00 H new ATOM 0 HG2 PRO B 37 47.213 12.654 -8.735 1.00 0.00 H new ATOM 0 HG3 PRO B 37 48.490 13.632 -8.039 1.00 0.00 H new ATOM 0 HD2 PRO B 37 46.501 12.159 -6.574 1.00 0.00 H new ATOM 0 HD3 PRO B 37 47.653 13.291 -5.892 1.00 0.00 H new ATOM 1598 N GLY B 38 43.616 13.329 -7.769 1.00 0.00 N ATOM 1599 CA GLY B 38 42.433 12.702 -8.424 1.00 0.00 C ATOM 1600 C GLY B 38 41.862 11.593 -7.536 1.00 0.00 C ATOM 1601 O GLY B 38 41.948 11.644 -6.325 1.00 0.00 O ATOM 0 H GLY B 38 43.877 12.935 -6.865 1.00 0.00 H new ATOM 0 HA2 GLY B 38 41.669 13.457 -8.611 1.00 0.00 H new ATOM 0 HA3 GLY B 38 42.720 12.291 -9.392 1.00 0.00 H new ATOM 1605 N VAL B 39 41.271 10.595 -8.136 1.00 0.00 N ATOM 1606 CA VAL B 39 40.680 9.478 -7.343 1.00 0.00 C ATOM 1607 C VAL B 39 41.280 8.148 -7.816 1.00 0.00 C ATOM 1608 O VAL B 39 41.707 8.016 -8.942 1.00 0.00 O ATOM 1609 CB VAL B 39 39.148 9.481 -7.550 1.00 0.00 C ATOM 1610 CG1 VAL B 39 38.594 8.052 -7.698 1.00 0.00 C ATOM 1611 CG2 VAL B 39 38.478 10.159 -6.353 1.00 0.00 C ATOM 0 H VAL B 39 41.172 10.505 -9.147 1.00 0.00 H new ATOM 0 HA VAL B 39 40.902 9.605 -6.283 1.00 0.00 H new ATOM 0 HB VAL B 39 38.931 10.026 -8.469 1.00 0.00 H new ATOM 0 HG11 VAL B 39 37.514 8.093 -7.842 1.00 0.00 H new ATOM 0 HG12 VAL B 39 39.057 7.570 -8.559 1.00 0.00 H new ATOM 0 HG13 VAL B 39 38.818 7.480 -6.798 1.00 0.00 H new ATOM 0 HG21 VAL B 39 37.397 10.163 -6.495 1.00 0.00 H new ATOM 0 HG22 VAL B 39 38.722 9.613 -5.442 1.00 0.00 H new ATOM 0 HG23 VAL B 39 38.837 11.185 -6.268 1.00 0.00 H new ATOM 1621 N ILE B 40 41.278 7.154 -6.971 1.00 0.00 N ATOM 1622 CA ILE B 40 41.809 5.825 -7.381 1.00 0.00 C ATOM 1623 C ILE B 40 40.627 5.054 -7.987 1.00 0.00 C ATOM 1624 O ILE B 40 39.546 5.593 -8.114 1.00 0.00 O ATOM 1625 CB ILE B 40 42.410 5.116 -6.138 1.00 0.00 C ATOM 1626 CG1 ILE B 40 43.926 4.980 -6.323 1.00 0.00 C ATOM 1627 CG2 ILE B 40 41.814 3.715 -5.925 1.00 0.00 C ATOM 1628 CD1 ILE B 40 44.653 5.583 -5.115 1.00 0.00 C ATOM 0 H ILE B 40 40.931 7.206 -6.013 1.00 0.00 H new ATOM 0 HA ILE B 40 42.608 5.897 -8.118 1.00 0.00 H new ATOM 0 HB ILE B 40 42.171 5.722 -5.264 1.00 0.00 H new ATOM 0 HG12 ILE B 40 44.195 3.930 -6.434 1.00 0.00 H new ATOM 0 HG13 ILE B 40 44.237 5.487 -7.236 1.00 0.00 H new ATOM 0 HG21 ILE B 40 42.265 3.258 -5.044 1.00 0.00 H new ATOM 0 HG22 ILE B 40 40.737 3.796 -5.781 1.00 0.00 H new ATOM 0 HG23 ILE B 40 42.017 3.096 -6.799 1.00 0.00 H new ATOM 0 HD11 ILE B 40 45.730 5.484 -5.252 1.00 0.00 H new ATOM 0 HD12 ILE B 40 44.395 6.638 -5.024 1.00 0.00 H new ATOM 0 HD13 ILE B 40 44.352 5.057 -4.209 1.00 0.00 H new ATOM 1640 N PHE B 41 40.788 3.824 -8.374 1.00 0.00 N ATOM 1641 CA PHE B 41 39.620 3.114 -8.954 1.00 0.00 C ATOM 1642 C PHE B 41 39.868 1.614 -8.981 1.00 0.00 C ATOM 1643 O PHE B 41 40.985 1.156 -9.101 1.00 0.00 O ATOM 1644 CB PHE B 41 39.373 3.616 -10.374 1.00 0.00 C ATOM 1645 CG PHE B 41 38.322 4.697 -10.335 1.00 0.00 C ATOM 1646 CD1 PHE B 41 37.011 4.375 -9.977 1.00 0.00 C ATOM 1647 CD2 PHE B 41 38.659 6.021 -10.647 1.00 0.00 C ATOM 1648 CE1 PHE B 41 36.031 5.373 -9.929 1.00 0.00 C ATOM 1649 CE2 PHE B 41 37.677 7.019 -10.601 1.00 0.00 C ATOM 1650 CZ PHE B 41 36.364 6.694 -10.241 1.00 0.00 C ATOM 0 H PHE B 41 41.655 3.290 -8.317 1.00 0.00 H new ATOM 0 HA PHE B 41 38.745 3.313 -8.335 1.00 0.00 H new ATOM 0 HB2 PHE B 41 40.297 4.004 -10.802 1.00 0.00 H new ATOM 0 HB3 PHE B 41 39.046 2.795 -11.012 1.00 0.00 H new ATOM 0 HD1 PHE B 41 36.753 3.354 -9.737 1.00 0.00 H new ATOM 0 HD2 PHE B 41 39.673 6.271 -10.922 1.00 0.00 H new ATOM 0 HE1 PHE B 41 35.018 5.122 -9.651 1.00 0.00 H new ATOM 0 HE2 PHE B 41 37.933 8.040 -10.843 1.00 0.00 H new ATOM 0 HZ PHE B 41 35.608 7.464 -10.204 1.00 0.00 H new ATOM 1660 N LEU B 42 38.821 0.847 -8.877 1.00 0.00 N ATOM 1661 CA LEU B 42 38.961 -0.626 -8.908 1.00 0.00 C ATOM 1662 C LEU B 42 38.268 -1.144 -10.163 1.00 0.00 C ATOM 1663 O LEU B 42 37.170 -1.660 -10.117 1.00 0.00 O ATOM 1664 CB LEU B 42 38.300 -1.215 -7.668 1.00 0.00 C ATOM 1665 CG LEU B 42 39.267 -1.117 -6.493 1.00 0.00 C ATOM 1666 CD1 LEU B 42 38.551 -1.539 -5.210 1.00 0.00 C ATOM 1667 CD2 LEU B 42 40.464 -2.039 -6.739 1.00 0.00 C ATOM 0 H LEU B 42 37.865 1.186 -8.771 1.00 0.00 H new ATOM 0 HA LEU B 42 40.012 -0.914 -8.920 1.00 0.00 H new ATOM 0 HB2 LEU B 42 37.378 -0.678 -7.442 1.00 0.00 H new ATOM 0 HB3 LEU B 42 38.028 -2.255 -7.845 1.00 0.00 H new ATOM 0 HG LEU B 42 39.616 -0.089 -6.393 1.00 0.00 H new ATOM 0 HD11 LEU B 42 39.241 -1.470 -4.369 1.00 0.00 H new ATOM 0 HD12 LEU B 42 37.699 -0.882 -5.036 1.00 0.00 H new ATOM 0 HD13 LEU B 42 38.202 -2.567 -5.309 1.00 0.00 H new ATOM 0 HD21 LEU B 42 41.156 -1.969 -5.899 1.00 0.00 H new ATOM 0 HD22 LEU B 42 40.117 -3.067 -6.839 1.00 0.00 H new ATOM 0 HD23 LEU B 42 40.973 -1.738 -7.654 1.00 0.00 H new ATOM 1679 N THR B 43 38.904 -0.983 -11.287 1.00 0.00 N ATOM 1680 CA THR B 43 38.299 -1.438 -12.567 1.00 0.00 C ATOM 1681 C THR B 43 37.787 -2.872 -12.424 1.00 0.00 C ATOM 1682 O THR B 43 37.850 -3.468 -11.366 1.00 0.00 O ATOM 1683 CB THR B 43 39.352 -1.373 -13.675 1.00 0.00 C ATOM 1684 OG1 THR B 43 40.219 -2.493 -13.568 1.00 0.00 O ATOM 1685 CG2 THR B 43 40.160 -0.079 -13.534 1.00 0.00 C ATOM 0 H THR B 43 39.824 -0.552 -11.375 1.00 0.00 H new ATOM 0 HA THR B 43 37.461 -0.789 -12.821 1.00 0.00 H new ATOM 0 HB THR B 43 38.861 -1.388 -14.648 1.00 0.00 H new ATOM 0 HG1 THR B 43 40.893 -2.454 -14.278 1.00 0.00 H new ATOM 0 HG21 THR B 43 40.911 -0.031 -14.323 1.00 0.00 H new ATOM 0 HG22 THR B 43 39.492 0.778 -13.617 1.00 0.00 H new ATOM 0 HG23 THR B 43 40.653 -0.062 -12.562 1.00 0.00 H new ATOM 1693 N LYS B 44 37.277 -3.431 -13.484 1.00 0.00 N ATOM 1694 CA LYS B 44 36.751 -4.823 -13.412 1.00 0.00 C ATOM 1695 C LYS B 44 37.877 -5.813 -13.707 1.00 0.00 C ATOM 1696 O LYS B 44 37.804 -6.973 -13.353 1.00 0.00 O ATOM 1697 CB LYS B 44 35.628 -4.994 -14.438 1.00 0.00 C ATOM 1698 CG LYS B 44 34.721 -3.762 -14.404 1.00 0.00 C ATOM 1699 CD LYS B 44 34.022 -3.675 -13.046 1.00 0.00 C ATOM 1700 CE LYS B 44 32.518 -3.888 -13.231 1.00 0.00 C ATOM 1701 NZ LYS B 44 31.836 -3.780 -11.910 1.00 0.00 N ATOM 0 H LYS B 44 37.201 -2.985 -14.398 1.00 0.00 H new ATOM 0 HA LYS B 44 36.360 -5.015 -12.413 1.00 0.00 H new ATOM 0 HB2 LYS B 44 36.048 -5.124 -15.436 1.00 0.00 H new ATOM 0 HB3 LYS B 44 35.050 -5.891 -14.216 1.00 0.00 H new ATOM 0 HG2 LYS B 44 35.308 -2.861 -14.580 1.00 0.00 H new ATOM 0 HG3 LYS B 44 33.981 -3.821 -15.202 1.00 0.00 H new ATOM 0 HD2 LYS B 44 34.426 -4.427 -12.368 1.00 0.00 H new ATOM 0 HD3 LYS B 44 34.209 -2.703 -12.591 1.00 0.00 H new ATOM 0 HE2 LYS B 44 32.117 -3.146 -13.921 1.00 0.00 H new ATOM 0 HE3 LYS B 44 32.330 -4.867 -13.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 30.831 -4.024 -12.017 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 32.281 -4.434 -11.235 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 31.919 -2.806 -11.555 1.00 0.00 H new ATOM 1715 N ARG B 45 38.922 -5.366 -14.345 1.00 0.00 N ATOM 1716 CA ARG B 45 40.052 -6.286 -14.650 1.00 0.00 C ATOM 1717 C ARG B 45 40.929 -6.436 -13.404 1.00 0.00 C ATOM 1718 O ARG B 45 41.972 -7.060 -13.440 1.00 0.00 O ATOM 1719 CB ARG B 45 40.886 -5.714 -15.797 1.00 0.00 C ATOM 1720 CG ARG B 45 41.412 -6.860 -16.663 1.00 0.00 C ATOM 1721 CD ARG B 45 42.919 -7.013 -16.452 1.00 0.00 C ATOM 1722 NE ARG B 45 43.391 -8.253 -17.134 1.00 0.00 N ATOM 1723 CZ ARG B 45 43.274 -9.408 -16.538 1.00 0.00 C ATOM 1724 NH1 ARG B 45 42.178 -10.103 -16.674 1.00 0.00 N ATOM 1725 NH2 ARG B 45 44.252 -9.869 -15.807 1.00 0.00 N ATOM 0 H ARG B 45 39.042 -4.406 -14.668 1.00 0.00 H new ATOM 0 HA ARG B 45 39.661 -7.260 -14.943 1.00 0.00 H new ATOM 0 HB2 ARG B 45 40.280 -5.037 -16.399 1.00 0.00 H new ATOM 0 HB3 ARG B 45 41.718 -5.131 -15.401 1.00 0.00 H new ATOM 0 HG2 ARG B 45 40.902 -7.788 -16.404 1.00 0.00 H new ATOM 0 HG3 ARG B 45 41.200 -6.662 -17.714 1.00 0.00 H new ATOM 0 HD2 ARG B 45 43.443 -6.144 -16.850 1.00 0.00 H new ATOM 0 HD3 ARG B 45 43.145 -7.062 -15.387 1.00 0.00 H new ATOM 0 HE ARG B 45 43.805 -8.198 -18.065 1.00 0.00 H new ATOM 0 HH11 ARG B 45 41.414 -9.743 -17.246 1.00 0.00 H new ATOM 0 HH12 ARG B 45 42.086 -11.006 -16.209 1.00 0.00 H new ATOM 0 HH21 ARG B 45 45.109 -9.326 -15.701 1.00 0.00 H new ATOM 0 HH22 ARG B 45 44.159 -10.772 -15.342 1.00 0.00 H new ATOM 1739 N SER B 46 40.516 -5.868 -12.302 1.00 0.00 N ATOM 1740 CA SER B 46 41.326 -5.976 -11.059 1.00 0.00 C ATOM 1741 C SER B 46 42.690 -5.330 -11.295 1.00 0.00 C ATOM 1742 O SER B 46 43.691 -5.749 -10.745 1.00 0.00 O ATOM 1743 CB SER B 46 41.513 -7.451 -10.698 1.00 0.00 C ATOM 1744 OG SER B 46 40.742 -7.752 -9.541 1.00 0.00 O ATOM 0 H SER B 46 39.652 -5.334 -12.211 1.00 0.00 H new ATOM 0 HA SER B 46 40.816 -5.468 -10.241 1.00 0.00 H new ATOM 0 HB2 SER B 46 41.203 -8.083 -11.530 1.00 0.00 H new ATOM 0 HB3 SER B 46 42.566 -7.661 -10.512 1.00 0.00 H new ATOM 0 HG SER B 46 40.858 -8.697 -9.307 1.00 0.00 H new ATOM 1750 N ARG B 47 42.742 -4.316 -12.115 1.00 0.00 N ATOM 1751 CA ARG B 47 44.049 -3.652 -12.388 1.00 0.00 C ATOM 1752 C ARG B 47 44.138 -2.331 -11.617 1.00 0.00 C ATOM 1753 O ARG B 47 45.207 -1.785 -11.429 1.00 0.00 O ATOM 1754 CB ARG B 47 44.171 -3.378 -13.889 1.00 0.00 C ATOM 1755 CG ARG B 47 45.235 -4.299 -14.491 1.00 0.00 C ATOM 1756 CD ARG B 47 46.598 -3.969 -13.884 1.00 0.00 C ATOM 1757 NE ARG B 47 47.474 -3.372 -14.929 1.00 0.00 N ATOM 1758 CZ ARG B 47 47.777 -4.058 -15.998 1.00 0.00 C ATOM 1759 NH1 ARG B 47 48.251 -5.268 -15.885 1.00 0.00 N ATOM 1760 NH2 ARG B 47 47.603 -3.534 -17.180 1.00 0.00 N ATOM 0 H ARG B 47 41.940 -3.920 -12.606 1.00 0.00 H new ATOM 0 HA ARG B 47 44.859 -4.306 -12.065 1.00 0.00 H new ATOM 0 HB2 ARG B 47 43.212 -3.544 -14.379 1.00 0.00 H new ATOM 0 HB3 ARG B 47 44.439 -2.335 -14.059 1.00 0.00 H new ATOM 0 HG2 ARG B 47 44.981 -5.341 -14.297 1.00 0.00 H new ATOM 0 HG3 ARG B 47 45.268 -4.176 -15.573 1.00 0.00 H new ATOM 0 HD2 ARG B 47 46.479 -3.274 -13.053 1.00 0.00 H new ATOM 0 HD3 ARG B 47 47.057 -4.872 -13.481 1.00 0.00 H new ATOM 0 HE ARG B 47 47.838 -2.427 -14.810 1.00 0.00 H new ATOM 0 HH11 ARG B 47 48.385 -5.679 -14.961 1.00 0.00 H new ATOM 0 HH12 ARG B 47 48.487 -5.803 -16.721 1.00 0.00 H new ATOM 0 HH21 ARG B 47 47.230 -2.589 -17.269 1.00 0.00 H new ATOM 0 HH22 ARG B 47 47.840 -4.070 -18.015 1.00 0.00 H new ATOM 1774 N GLN B 48 43.025 -1.810 -11.178 1.00 0.00 N ATOM 1775 CA GLN B 48 43.043 -0.518 -10.428 1.00 0.00 C ATOM 1776 C GLN B 48 43.663 0.565 -11.306 1.00 0.00 C ATOM 1777 O GLN B 48 44.476 0.286 -12.165 1.00 0.00 O ATOM 1778 CB GLN B 48 43.872 -0.659 -9.149 1.00 0.00 C ATOM 1779 CG GLN B 48 43.979 0.706 -8.459 1.00 0.00 C ATOM 1780 CD GLN B 48 45.104 1.524 -9.102 1.00 0.00 C ATOM 1781 OE1 GLN B 48 45.847 1.017 -9.919 1.00 0.00 O ATOM 1782 NE2 GLN B 48 45.261 2.778 -8.766 1.00 0.00 N ATOM 0 H GLN B 48 42.101 -2.223 -11.306 1.00 0.00 H new ATOM 0 HA GLN B 48 42.021 -0.248 -10.164 1.00 0.00 H new ATOM 0 HB2 GLN B 48 43.407 -1.382 -8.479 1.00 0.00 H new ATOM 0 HB3 GLN B 48 44.866 -1.038 -9.387 1.00 0.00 H new ATOM 0 HG2 GLN B 48 43.033 1.242 -8.543 1.00 0.00 H new ATOM 0 HG3 GLN B 48 44.176 0.572 -7.395 1.00 0.00 H new ATOM 0 HE21 GLN B 48 44.638 3.204 -8.080 1.00 0.00 H new ATOM 0 HE22 GLN B 48 46.007 3.330 -9.190 1.00 0.00 H new ATOM 1791 N VAL B 49 43.296 1.802 -11.105 1.00 0.00 N ATOM 1792 CA VAL B 49 43.886 2.878 -11.946 1.00 0.00 C ATOM 1793 C VAL B 49 43.823 4.232 -11.224 1.00 0.00 C ATOM 1794 O VAL B 49 44.629 4.513 -10.359 1.00 0.00 O ATOM 1795 CB VAL B 49 43.129 2.947 -13.272 1.00 0.00 C ATOM 1796 CG1 VAL B 49 43.777 3.997 -14.173 1.00 0.00 C ATOM 1797 CG2 VAL B 49 43.194 1.581 -13.958 1.00 0.00 C ATOM 0 H VAL B 49 42.622 2.110 -10.404 1.00 0.00 H new ATOM 0 HA VAL B 49 44.935 2.649 -12.135 1.00 0.00 H new ATOM 0 HB VAL B 49 42.089 3.218 -13.088 1.00 0.00 H new ATOM 0 HG11 VAL B 49 43.238 4.047 -15.119 1.00 0.00 H new ATOM 0 HG12 VAL B 49 43.741 4.970 -13.683 1.00 0.00 H new ATOM 0 HG13 VAL B 49 44.815 3.724 -14.361 1.00 0.00 H new ATOM 0 HG21 VAL B 49 42.656 1.623 -14.905 1.00 0.00 H new ATOM 0 HG22 VAL B 49 44.235 1.316 -14.144 1.00 0.00 H new ATOM 0 HG23 VAL B 49 42.738 0.829 -13.315 1.00 0.00 H new ATOM 1807 N CYS B 50 42.892 5.083 -11.580 1.00 0.00 N ATOM 1808 CA CYS B 50 42.806 6.416 -10.932 1.00 0.00 C ATOM 1809 C CYS B 50 41.954 7.321 -11.807 1.00 0.00 C ATOM 1810 O CYS B 50 41.357 6.888 -12.772 1.00 0.00 O ATOM 1811 CB CYS B 50 44.208 7.006 -10.804 1.00 0.00 C ATOM 1812 SG CYS B 50 44.648 7.150 -9.056 1.00 0.00 S ATOM 0 H CYS B 50 42.187 4.905 -12.296 1.00 0.00 H new ATOM 0 HA CYS B 50 42.362 6.326 -9.941 1.00 0.00 H new ATOM 0 HB2 CYS B 50 44.929 6.372 -11.320 1.00 0.00 H new ATOM 0 HB3 CYS B 50 44.246 7.985 -11.281 1.00 0.00 H new ATOM 1817 N ALA B 51 41.885 8.573 -11.481 1.00 0.00 N ATOM 1818 CA ALA B 51 41.060 9.496 -12.302 1.00 0.00 C ATOM 1819 C ALA B 51 41.518 10.942 -12.108 1.00 0.00 C ATOM 1820 O ALA B 51 41.776 11.383 -11.007 1.00 0.00 O ATOM 1821 CB ALA B 51 39.600 9.372 -11.880 1.00 0.00 C ATOM 0 H ALA B 51 42.361 8.999 -10.686 1.00 0.00 H new ATOM 0 HA ALA B 51 41.173 9.229 -13.353 1.00 0.00 H new ATOM 0 HB1 ALA B 51 38.989 10.047 -12.479 1.00 0.00 H new ATOM 0 HB2 ALA B 51 39.263 8.347 -12.032 1.00 0.00 H new ATOM 0 HB3 ALA B 51 39.502 9.633 -10.826 1.00 0.00 H new ATOM 1827 N ASP B 52 41.606 11.680 -13.179 1.00 0.00 N ATOM 1828 CA ASP B 52 42.030 13.106 -13.088 1.00 0.00 C ATOM 1829 C ASP B 52 41.324 13.780 -11.900 1.00 0.00 C ATOM 1830 O ASP B 52 40.404 13.226 -11.335 1.00 0.00 O ATOM 1831 CB ASP B 52 41.637 13.819 -14.387 1.00 0.00 C ATOM 1832 CG ASP B 52 42.893 14.354 -15.079 1.00 0.00 C ATOM 1833 OD1 ASP B 52 43.922 14.417 -14.428 1.00 0.00 O ATOM 1834 OD2 ASP B 52 42.804 14.693 -16.248 1.00 0.00 O ATOM 0 H ASP B 52 41.400 11.353 -14.123 1.00 0.00 H new ATOM 0 HA ASP B 52 43.109 13.163 -12.942 1.00 0.00 H new ATOM 0 HB2 ASP B 52 41.111 13.129 -15.048 1.00 0.00 H new ATOM 0 HB3 ASP B 52 40.952 14.638 -14.171 1.00 0.00 H new ATOM 1839 N PRO B 53 41.775 14.963 -11.564 1.00 0.00 N ATOM 1840 CA PRO B 53 41.196 15.747 -10.454 1.00 0.00 C ATOM 1841 C PRO B 53 39.869 16.373 -10.887 1.00 0.00 C ATOM 1842 O PRO B 53 38.952 16.520 -10.103 1.00 0.00 O ATOM 1843 CB PRO B 53 42.247 16.829 -10.190 1.00 0.00 C ATOM 1844 CG PRO B 53 43.081 16.954 -11.488 1.00 0.00 C ATOM 1845 CD PRO B 53 42.898 15.629 -12.255 1.00 0.00 C ATOM 0 HA PRO B 53 40.980 15.147 -9.570 1.00 0.00 H new ATOM 0 HB2 PRO B 53 41.773 17.778 -9.940 1.00 0.00 H new ATOM 0 HB3 PRO B 53 42.881 16.557 -9.346 1.00 0.00 H new ATOM 0 HG2 PRO B 53 42.742 17.799 -12.087 1.00 0.00 H new ATOM 0 HG3 PRO B 53 44.132 17.127 -11.258 1.00 0.00 H new ATOM 0 HD2 PRO B 53 42.670 15.805 -13.306 1.00 0.00 H new ATOM 0 HD3 PRO B 53 43.802 15.022 -12.222 1.00 0.00 H new ATOM 1853 N SER B 54 39.763 16.739 -12.133 1.00 0.00 N ATOM 1854 CA SER B 54 38.499 17.351 -12.628 1.00 0.00 C ATOM 1855 C SER B 54 37.900 16.455 -13.712 1.00 0.00 C ATOM 1856 O SER B 54 37.578 16.904 -14.793 1.00 0.00 O ATOM 1857 CB SER B 54 38.794 18.730 -13.218 1.00 0.00 C ATOM 1858 OG SER B 54 39.286 19.585 -12.194 1.00 0.00 O ATOM 0 H SER B 54 40.499 16.641 -12.832 1.00 0.00 H new ATOM 0 HA SER B 54 37.795 17.454 -11.802 1.00 0.00 H new ATOM 0 HB2 SER B 54 39.527 18.646 -14.020 1.00 0.00 H new ATOM 0 HB3 SER B 54 37.889 19.152 -13.656 1.00 0.00 H new ATOM 0 HG SER B 54 39.478 20.469 -12.570 1.00 0.00 H new ATOM 1864 N GLU B 55 37.747 15.190 -13.431 1.00 0.00 N ATOM 1865 CA GLU B 55 37.166 14.270 -14.455 1.00 0.00 C ATOM 1866 C GLU B 55 35.657 14.373 -14.432 1.00 0.00 C ATOM 1867 O GLU B 55 35.023 14.423 -13.396 1.00 0.00 O ATOM 1868 CB GLU B 55 37.574 12.807 -14.209 1.00 0.00 C ATOM 1869 CG GLU B 55 38.634 12.716 -13.111 1.00 0.00 C ATOM 1870 CD GLU B 55 37.954 12.603 -11.743 1.00 0.00 C ATOM 1871 OE1 GLU B 55 37.042 13.373 -11.487 1.00 0.00 O ATOM 1872 OE2 GLU B 55 38.353 11.744 -10.976 1.00 0.00 O ATOM 0 H GLU B 55 37.997 14.754 -12.543 1.00 0.00 H new ATOM 0 HA GLU B 55 37.554 14.572 -15.428 1.00 0.00 H new ATOM 0 HB2 GLU B 55 36.698 12.224 -13.925 1.00 0.00 H new ATOM 0 HB3 GLU B 55 37.961 12.373 -15.131 1.00 0.00 H new ATOM 0 HG2 GLU B 55 39.275 11.851 -13.282 1.00 0.00 H new ATOM 0 HG3 GLU B 55 39.275 13.597 -13.137 1.00 0.00 H new ATOM 1879 N GLU B 56 35.094 14.402 -15.588 1.00 0.00 N ATOM 1880 CA GLU B 56 33.626 14.502 -15.721 1.00 0.00 C ATOM 1881 C GLU B 56 33.019 13.109 -15.566 1.00 0.00 C ATOM 1882 O GLU B 56 32.037 12.910 -14.878 1.00 0.00 O ATOM 1883 CB GLU B 56 33.339 15.053 -17.108 1.00 0.00 C ATOM 1884 CG GLU B 56 32.211 16.085 -17.035 1.00 0.00 C ATOM 1885 CD GLU B 56 30.863 15.365 -16.987 1.00 0.00 C ATOM 1886 OE1 GLU B 56 30.439 14.874 -18.021 1.00 0.00 O ATOM 1887 OE2 GLU B 56 30.277 15.316 -15.918 1.00 0.00 O ATOM 0 H GLU B 56 35.599 14.360 -16.473 1.00 0.00 H new ATOM 0 HA GLU B 56 33.196 15.153 -14.960 1.00 0.00 H new ATOM 0 HB2 GLU B 56 34.238 15.512 -17.520 1.00 0.00 H new ATOM 0 HB3 GLU B 56 33.059 14.242 -17.780 1.00 0.00 H new ATOM 0 HG2 GLU B 56 32.333 16.711 -16.151 1.00 0.00 H new ATOM 0 HG3 GLU B 56 32.252 16.746 -17.901 1.00 0.00 H new ATOM 1894 N TRP B 57 33.618 12.150 -16.200 1.00 0.00 N ATOM 1895 CA TRP B 57 33.131 10.748 -16.119 1.00 0.00 C ATOM 1896 C TRP B 57 33.272 10.224 -14.685 1.00 0.00 C ATOM 1897 O TRP B 57 32.717 9.204 -14.334 1.00 0.00 O ATOM 1898 CB TRP B 57 33.981 9.902 -17.060 1.00 0.00 C ATOM 1899 CG TRP B 57 35.428 10.044 -16.695 1.00 0.00 C ATOM 1900 CD1 TRP B 57 36.256 11.037 -17.097 1.00 0.00 C ATOM 1901 CD2 TRP B 57 36.224 9.175 -15.857 1.00 0.00 C ATOM 1902 NE1 TRP B 57 37.512 10.812 -16.572 1.00 0.00 N ATOM 1903 CE2 TRP B 57 37.543 9.674 -15.798 1.00 0.00 C ATOM 1904 CE3 TRP B 57 35.925 8.010 -15.159 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 38.535 9.027 -15.066 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 36.913 7.349 -14.415 1.00 0.00 C ATOM 1907 CH2 TRP B 57 38.220 7.856 -14.370 1.00 0.00 C ATOM 0 H TRP B 57 34.444 12.279 -16.785 1.00 0.00 H new ATOM 0 HA TRP B 57 32.080 10.698 -16.402 1.00 0.00 H new ATOM 0 HB2 TRP B 57 33.680 8.856 -16.997 1.00 0.00 H new ATOM 0 HB3 TRP B 57 33.823 10.217 -18.091 1.00 0.00 H new ATOM 0 HD1 TRP B 57 35.978 11.870 -17.726 1.00 0.00 H new ATOM 0 HE1 TRP B 57 38.318 11.415 -16.737 1.00 0.00 H new ATOM 0 HE3 TRP B 57 34.922 7.610 -15.190 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 39.538 9.426 -15.036 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 36.667 6.447 -13.875 1.00 0.00 H new ATOM 0 HH2 TRP B 57 38.981 7.344 -13.800 1.00 0.00 H new ATOM 1918 N VAL B 58 34.002 10.913 -13.853 1.00 0.00 N ATOM 1919 CA VAL B 58 34.165 10.448 -12.447 1.00 0.00 C ATOM 1920 C VAL B 58 33.097 11.093 -11.581 1.00 0.00 C ATOM 1921 O VAL B 58 32.365 10.426 -10.883 1.00 0.00 O ATOM 1922 CB VAL B 58 35.532 10.863 -11.931 1.00 0.00 C ATOM 1923 CG1 VAL B 58 35.610 10.560 -10.436 1.00 0.00 C ATOM 1924 CG2 VAL B 58 36.598 10.077 -12.682 1.00 0.00 C ATOM 0 H VAL B 58 34.492 11.777 -14.085 1.00 0.00 H new ATOM 0 HA VAL B 58 34.071 9.363 -12.411 1.00 0.00 H new ATOM 0 HB VAL B 58 35.693 11.930 -12.088 1.00 0.00 H new ATOM 0 HG11 VAL B 58 36.588 10.854 -10.056 1.00 0.00 H new ATOM 0 HG12 VAL B 58 34.834 11.117 -9.911 1.00 0.00 H new ATOM 0 HG13 VAL B 58 35.464 9.492 -10.273 1.00 0.00 H new ATOM 0 HG21 VAL B 58 37.585 10.366 -12.321 1.00 0.00 H new ATOM 0 HG22 VAL B 58 36.448 9.010 -12.515 1.00 0.00 H new ATOM 0 HG23 VAL B 58 36.525 10.292 -13.748 1.00 0.00 H new ATOM 1934 N GLN B 59 33.001 12.392 -11.641 1.00 0.00 N ATOM 1935 CA GLN B 59 31.981 13.126 -10.854 1.00 0.00 C ATOM 1936 C GLN B 59 30.705 12.291 -10.810 1.00 0.00 C ATOM 1937 O GLN B 59 30.037 12.188 -9.800 1.00 0.00 O ATOM 1938 CB GLN B 59 31.746 14.449 -11.584 1.00 0.00 C ATOM 1939 CG GLN B 59 30.258 14.731 -11.755 1.00 0.00 C ATOM 1940 CD GLN B 59 29.582 14.831 -10.384 1.00 0.00 C ATOM 1941 OE1 GLN B 59 28.372 14.759 -10.286 1.00 0.00 O ATOM 1942 NE2 GLN B 59 30.313 14.997 -9.315 1.00 0.00 N ATOM 0 H GLN B 59 33.601 12.984 -12.215 1.00 0.00 H new ATOM 0 HA GLN B 59 32.298 13.312 -9.828 1.00 0.00 H new ATOM 0 HB2 GLN B 59 32.211 15.262 -11.026 1.00 0.00 H new ATOM 0 HB3 GLN B 59 32.227 14.418 -12.562 1.00 0.00 H new ATOM 0 HG2 GLN B 59 30.117 15.660 -12.308 1.00 0.00 H new ATOM 0 HG3 GLN B 59 29.794 13.938 -12.341 1.00 0.00 H new ATOM 0 HE21 GLN B 59 31.328 15.058 -9.396 1.00 0.00 H new ATOM 0 HE22 GLN B 59 29.869 15.066 -8.399 1.00 0.00 H new ATOM 1951 N LYS B 60 30.383 11.687 -11.913 1.00 0.00 N ATOM 1952 CA LYS B 60 29.168 10.838 -11.972 1.00 0.00 C ATOM 1953 C LYS B 60 29.405 9.618 -11.088 1.00 0.00 C ATOM 1954 O LYS B 60 28.621 9.313 -10.211 1.00 0.00 O ATOM 1955 CB LYS B 60 28.912 10.416 -13.429 1.00 0.00 C ATOM 1956 CG LYS B 60 28.093 9.114 -13.501 1.00 0.00 C ATOM 1957 CD LYS B 60 26.856 9.185 -12.594 1.00 0.00 C ATOM 1958 CE LYS B 60 26.230 10.578 -12.651 1.00 0.00 C ATOM 1959 NZ LYS B 60 24.746 10.449 -12.720 1.00 0.00 N ATOM 0 H LYS B 60 30.913 11.745 -12.783 1.00 0.00 H new ATOM 0 HA LYS B 60 28.293 11.382 -11.617 1.00 0.00 H new ATOM 0 HB2 LYS B 60 28.381 11.211 -13.952 1.00 0.00 H new ATOM 0 HB3 LYS B 60 29.864 10.278 -13.942 1.00 0.00 H new ATOM 0 HG2 LYS B 60 27.783 8.933 -14.530 1.00 0.00 H new ATOM 0 HG3 LYS B 60 28.717 8.272 -13.203 1.00 0.00 H new ATOM 0 HD2 LYS B 60 26.126 8.439 -12.906 1.00 0.00 H new ATOM 0 HD3 LYS B 60 27.136 8.947 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS B 60 26.516 11.154 -11.771 1.00 0.00 H new ATOM 0 HE3 LYS B 60 26.600 11.120 -13.521 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 24.317 11.395 -12.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 24.483 9.914 -13.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 24.402 9.947 -11.877 1.00 0.00 H new ATOM 1973 N TYR B 61 30.484 8.915 -11.298 1.00 0.00 N ATOM 1974 CA TYR B 61 30.735 7.715 -10.442 1.00 0.00 C ATOM 1975 C TYR B 61 30.732 8.145 -8.973 1.00 0.00 C ATOM 1976 O TYR B 61 29.869 7.773 -8.203 1.00 0.00 O ATOM 1977 CB TYR B 61 32.092 7.076 -10.762 1.00 0.00 C ATOM 1978 CG TYR B 61 32.265 6.865 -12.234 1.00 0.00 C ATOM 1979 CD1 TYR B 61 31.245 7.166 -13.137 1.00 0.00 C ATOM 1980 CD2 TYR B 61 33.483 6.385 -12.694 1.00 0.00 C ATOM 1981 CE1 TYR B 61 31.449 6.987 -14.496 1.00 0.00 C ATOM 1982 CE2 TYR B 61 33.685 6.195 -14.050 1.00 0.00 C ATOM 1983 CZ TYR B 61 32.671 6.498 -14.961 1.00 0.00 C ATOM 1984 OH TYR B 61 32.878 6.323 -16.312 1.00 0.00 O ATOM 0 H TYR B 61 31.190 9.111 -12.008 1.00 0.00 H new ATOM 0 HA TYR B 61 29.951 6.984 -10.638 1.00 0.00 H new ATOM 0 HB2 TYR B 61 32.893 7.714 -10.388 1.00 0.00 H new ATOM 0 HB3 TYR B 61 32.177 6.121 -10.244 1.00 0.00 H new ATOM 0 HD1 TYR B 61 30.297 7.538 -12.777 1.00 0.00 H new ATOM 0 HD2 TYR B 61 34.274 6.160 -11.994 1.00 0.00 H new ATOM 0 HE1 TYR B 61 30.662 7.226 -15.196 1.00 0.00 H new ATOM 0 HE2 TYR B 61 34.630 5.811 -14.405 1.00 0.00 H new ATOM 0 HH TYR B 61 33.828 6.151 -16.478 1.00 0.00 H new ATOM 1994 N VAL B 62 31.697 8.936 -8.588 1.00 0.00 N ATOM 1995 CA VAL B 62 31.777 9.414 -7.183 1.00 0.00 C ATOM 1996 C VAL B 62 30.549 10.271 -6.864 1.00 0.00 C ATOM 1997 O VAL B 62 30.340 10.645 -5.728 1.00 0.00 O ATOM 1998 CB VAL B 62 33.059 10.246 -7.021 1.00 0.00 C ATOM 1999 CG1 VAL B 62 32.917 11.238 -5.860 1.00 0.00 C ATOM 2000 CG2 VAL B 62 34.234 9.307 -6.744 1.00 0.00 C ATOM 0 H VAL B 62 32.442 9.274 -9.198 1.00 0.00 H new ATOM 0 HA VAL B 62 31.801 8.567 -6.497 1.00 0.00 H new ATOM 0 HB VAL B 62 33.234 10.807 -7.939 1.00 0.00 H new ATOM 0 HG11 VAL B 62 33.835 11.817 -5.762 1.00 0.00 H new ATOM 0 HG12 VAL B 62 32.083 11.911 -6.057 1.00 0.00 H new ATOM 0 HG13 VAL B 62 32.732 10.692 -4.935 1.00 0.00 H new ATOM 0 HG21 VAL B 62 35.147 9.891 -6.628 1.00 0.00 H new ATOM 0 HG22 VAL B 62 34.043 8.746 -5.829 1.00 0.00 H new ATOM 0 HG23 VAL B 62 34.350 8.614 -7.577 1.00 0.00 H new ATOM 2010 N SER B 63 29.734 10.583 -7.851 1.00 0.00 N ATOM 2011 CA SER B 63 28.520 11.410 -7.583 1.00 0.00 C ATOM 2012 C SER B 63 27.928 10.964 -6.246 1.00 0.00 C ATOM 2013 O SER B 63 27.393 11.746 -5.486 1.00 0.00 O ATOM 2014 CB SER B 63 27.499 11.202 -8.702 1.00 0.00 C ATOM 2015 OG SER B 63 26.361 12.018 -8.456 1.00 0.00 O ATOM 0 H SER B 63 29.861 10.300 -8.823 1.00 0.00 H new ATOM 0 HA SER B 63 28.781 12.468 -7.543 1.00 0.00 H new ATOM 0 HB2 SER B 63 27.941 11.455 -9.665 1.00 0.00 H new ATOM 0 HB3 SER B 63 27.205 10.154 -8.752 1.00 0.00 H new ATOM 0 HG SER B 63 25.705 11.889 -9.172 1.00 0.00 H new