USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 992 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 78 SER OG : rot 180:sc= 0.24 USER MOD Set 1.2: A 80 CYS SG : rot 96:sc= -0.406 USER MOD Set 2.1: A 15 SER OG : rot 79:sc= 1.52 USER MOD Set 2.2: A 16 GLN : amide:sc= 1.07 K(o=4.7,f=-4.4!) USER MOD Set 2.3: A 34 SER OG : rot -67:sc= 1.24 USER MOD Set 2.4: A 40 SER OG : rot -173:sc= 0.115 USER MOD Set 2.5: A 62 SER OG : rot 120:sc= 0.741 USER MOD Set 3.1: A 8 CYS SG : rot 61:sc= -0.125 USER MOD Set 3.2: A 12 SER OG : rot 100:sc= 0.537 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.00827 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 175:sc= 1.26 (180deg=1.16) USER MOD Single : A 5 MET CE :methyl -161:sc= 0 (180deg=-1.08) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0.973 K(o=0.97,f=-5!) USER MOD Single : A 13 CYS SG : rot -36:sc= -0.145 USER MOD Single : A 17 MET CE :methyl -177:sc= -0.4 (180deg=-0.424) USER MOD Single : A 23 LYS NZ :NH3+ -165:sc= 1.24 (180deg=1.14) USER MOD Single : A 24 THR OG1 : rot 72:sc= 0.0848 USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 0.75 (180deg=0.744) USER MOD Single : A 33 THR OG1 : rot -150:sc= -0.0099 USER MOD Single : A 35 CYS SG : rot 112:sc= 0.0664 USER MOD Single : A 39 SER OG : rot -35:sc= 1.28 USER MOD Single : A 43 HIS : no HD1:sc= -0.497 K(o=-0.5,f=-6.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -166:sc= -0.0644 (180deg=-0.146) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0161 USER MOD Single : A 60 GLN : amide:sc= 1.5 K(o=1.5,f=-1.6) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.58 K(o=2.6,f=-0.001) USER MOD Single : A 69 ASN : amide:sc= 1.01 K(o=1,f=-0.1) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0184 K(o=-0.018,f=-1.2) USER MOD Single : A 92 THR OG1 : rot -24:sc= 0.118 USER MOD Single : A 93 GLN : amide:sc= -0.25! C(o=-0.25!,f=-6.7!) USER MOD Single : A 100 GLN : amide:sc= 0.0124 K(o=0.012,f=-6.1!) USER MOD Single : A 107 GLN : amide:sc= 1.15 K(o=1.1,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 67:sc= 1.24 USER MOD Single : A 118 GLN : amide:sc= 1.26 K(o=1.3,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -153:sc= 1.34 (180deg=1.19) USER MOD Single : A 125 ASN : amide:sc= 0.243 X(o=0.24,f=-0.01) USER MOD Single : A 129 LYS NZ :NH3+ 175:sc= 1.29 (180deg=1.16) USER MOD Single : A 131 SER OG : rot -103:sc= 0.195 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.333 1.866 1.980 1.00 0.00 N ATOM 2 CA MET A 1 4.349 1.720 0.487 1.00 0.00 C ATOM 3 C MET A 1 5.210 0.517 0.056 1.00 0.00 C ATOM 4 O MET A 1 6.269 0.295 0.638 1.00 0.00 O ATOM 5 CB MET A 1 4.823 3.033 -0.197 1.00 0.00 C ATOM 6 CG MET A 1 4.785 3.003 -1.735 1.00 0.00 C ATOM 7 SD MET A 1 3.171 2.595 -2.456 1.00 0.00 S ATOM 8 CE MET A 1 2.305 4.185 -2.295 1.00 0.00 C ATOM 0 H1 MET A 1 4.440 2.869 2.232 1.00 0.00 H new ATOM 0 H2 MET A 1 3.430 1.510 2.354 1.00 0.00 H new ATOM 0 H3 MET A 1 5.117 1.320 2.391 1.00 0.00 H new ATOM 0 HA MET A 1 3.328 1.527 0.157 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.199 3.855 0.153 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.842 3.247 0.124 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.097 3.978 -2.110 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.517 2.276 -2.087 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.296 4.092 -2.697 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.252 4.466 -1.243 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.847 4.952 -2.849 1.00 0.00 H new ATOM 18 N LYS A 2 4.795 -0.247 -0.974 1.00 0.00 N ATOM 19 CA LYS A 2 5.570 -1.380 -1.521 1.00 0.00 C ATOM 20 C LYS A 2 6.798 -0.908 -2.292 1.00 0.00 C ATOM 21 O LYS A 2 6.708 0.039 -3.074 1.00 0.00 O ATOM 22 CB LYS A 2 4.715 -2.282 -2.432 1.00 0.00 C ATOM 23 CG LYS A 2 3.533 -2.985 -1.748 1.00 0.00 C ATOM 24 CD LYS A 2 2.652 -3.702 -2.792 1.00 0.00 C ATOM 25 CE LYS A 2 1.635 -2.795 -3.512 1.00 0.00 C ATOM 26 NZ LYS A 2 0.434 -2.488 -2.677 1.00 0.00 N ATOM 0 H LYS A 2 3.907 -0.095 -1.453 1.00 0.00 H new ATOM 0 HA LYS A 2 5.895 -1.962 -0.659 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.329 -1.678 -3.253 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.362 -3.042 -2.871 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.904 -3.706 -1.020 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.937 -2.256 -1.200 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.299 -4.162 -3.538 1.00 0.00 H new ATOM 0 HD3 LYS A 2 2.111 -4.509 -2.298 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.124 -1.862 -3.793 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.315 -3.278 -4.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.214 -1.875 -3.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.052 -3.373 -2.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.731 -2.001 -1.807 1.00 0.00 H new ATOM 40 N LYS A 3 7.912 -1.625 -2.146 1.00 0.00 N ATOM 41 CA LYS A 3 9.146 -1.405 -2.914 1.00 0.00 C ATOM 42 C LYS A 3 9.411 -2.560 -3.882 1.00 0.00 C ATOM 43 O LYS A 3 9.444 -3.721 -3.480 1.00 0.00 O ATOM 44 CB LYS A 3 10.288 -1.159 -1.920 1.00 0.00 C ATOM 45 CG LYS A 3 11.540 -0.520 -2.546 1.00 0.00 C ATOM 46 CD LYS A 3 12.625 -0.227 -1.492 1.00 0.00 C ATOM 47 CE LYS A 3 12.139 0.744 -0.403 1.00 0.00 C ATOM 48 NZ LYS A 3 13.226 1.069 0.561 1.00 0.00 N ATOM 0 H LYS A 3 7.987 -2.392 -1.478 1.00 0.00 H new ATOM 0 HA LYS A 3 9.053 -0.525 -3.550 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.926 -0.514 -1.120 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.568 -2.108 -1.463 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.945 -1.186 -3.308 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.262 0.407 -3.048 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.938 -1.162 -1.027 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.502 0.193 -1.985 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.776 1.661 -0.867 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.297 0.302 0.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.891 1.790 1.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.496 0.210 1.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.051 1.434 0.044 1.00 0.00 H new ATOM 62 N VAL A 4 9.599 -2.216 -5.155 1.00 0.00 N ATOM 63 CA VAL A 4 9.849 -3.134 -6.274 1.00 0.00 C ATOM 64 C VAL A 4 11.351 -3.222 -6.547 1.00 0.00 C ATOM 65 O VAL A 4 11.930 -2.271 -7.073 1.00 0.00 O ATOM 66 CB VAL A 4 9.091 -2.679 -7.541 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.269 -3.688 -8.686 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.583 -2.525 -7.294 1.00 0.00 C ATOM 0 H VAL A 4 9.581 -1.241 -5.453 1.00 0.00 H new ATOM 0 HA VAL A 4 9.480 -4.123 -6.002 1.00 0.00 H new ATOM 0 HB VAL A 4 9.517 -1.712 -7.809 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.725 -3.341 -9.564 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.328 -3.780 -8.928 1.00 0.00 H new ATOM 0 HG13 VAL A 4 8.881 -4.659 -8.379 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.095 -2.204 -8.214 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.167 -3.481 -6.977 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.416 -1.781 -6.515 1.00 0.00 H new ATOM 78 N MET A 5 11.988 -4.343 -6.205 1.00 0.00 N ATOM 79 CA MET A 5 13.365 -4.620 -6.629 1.00 0.00 C ATOM 80 C MET A 5 13.363 -5.309 -7.993 1.00 0.00 C ATOM 81 O MET A 5 12.731 -6.352 -8.164 1.00 0.00 O ATOM 82 CB MET A 5 14.109 -5.493 -5.607 1.00 0.00 C ATOM 83 CG MET A 5 15.570 -5.733 -6.007 1.00 0.00 C ATOM 84 SD MET A 5 16.619 -4.257 -6.025 1.00 0.00 S ATOM 85 CE MET A 5 17.319 -4.377 -4.354 1.00 0.00 C ATOM 0 H MET A 5 11.572 -5.078 -5.633 1.00 0.00 H new ATOM 0 HA MET A 5 13.888 -3.666 -6.700 1.00 0.00 H new ATOM 0 HB2 MET A 5 14.076 -5.013 -4.629 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.598 -6.451 -5.510 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.004 -6.459 -5.319 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.589 -6.184 -6.999 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.714 -3.406 -4.055 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.541 -4.683 -3.655 1.00 0.00 H new ATOM 0 HE3 MET A 5 18.122 -5.114 -4.348 1.00 0.00 H new ATOM 95 N PHE A 6 14.126 -4.776 -8.940 1.00 0.00 N ATOM 96 CA PHE A 6 14.412 -5.408 -10.225 1.00 0.00 C ATOM 97 C PHE A 6 15.804 -6.067 -10.181 1.00 0.00 C ATOM 98 O PHE A 6 16.800 -5.355 -10.058 1.00 0.00 O ATOM 99 CB PHE A 6 14.293 -4.334 -11.316 1.00 0.00 C ATOM 100 CG PHE A 6 12.876 -3.832 -11.530 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.954 -4.659 -12.193 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.464 -2.565 -11.072 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.646 -4.212 -12.442 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.156 -2.111 -11.335 1.00 0.00 C ATOM 105 CZ PHE A 6 10.256 -2.921 -12.058 1.00 0.00 C ATOM 0 H PHE A 6 14.576 -3.867 -8.833 1.00 0.00 H new ATOM 0 HA PHE A 6 13.701 -6.203 -10.449 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.932 -3.491 -11.054 1.00 0.00 H new ATOM 0 HB3 PHE A 6 14.670 -4.740 -12.255 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.253 -5.646 -12.514 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.151 -1.941 -10.519 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.938 -4.865 -12.931 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.842 -1.140 -10.982 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.274 -2.550 -12.314 1.00 0.00 H new ATOM 115 N VAL A 7 15.893 -7.400 -10.278 1.00 0.00 N ATOM 116 CA VAL A 7 17.157 -8.168 -10.205 1.00 0.00 C ATOM 117 C VAL A 7 17.532 -8.808 -11.543 1.00 0.00 C ATOM 118 O VAL A 7 16.678 -9.379 -12.216 1.00 0.00 O ATOM 119 CB VAL A 7 17.198 -9.204 -9.056 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.868 -8.553 -7.711 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.245 -10.394 -9.216 1.00 0.00 C ATOM 0 H VAL A 7 15.074 -7.993 -10.412 1.00 0.00 H new ATOM 0 HA VAL A 7 17.918 -7.424 -9.968 1.00 0.00 H new ATOM 0 HB VAL A 7 18.220 -9.581 -9.094 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.905 -9.306 -6.924 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.595 -7.769 -7.498 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.869 -8.119 -7.752 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.349 -11.061 -8.361 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.218 -10.033 -9.271 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.489 -10.935 -10.130 1.00 0.00 H new ATOM 131 N CYS A 8 18.802 -8.738 -11.951 1.00 0.00 N ATOM 132 CA CYS A 8 19.279 -9.344 -13.207 1.00 0.00 C ATOM 133 C CYS A 8 20.649 -10.036 -13.048 1.00 0.00 C ATOM 134 O CYS A 8 21.339 -9.860 -12.038 1.00 0.00 O ATOM 135 CB CYS A 8 19.278 -8.239 -14.280 1.00 0.00 C ATOM 136 SG CYS A 8 19.462 -8.904 -15.967 1.00 0.00 S ATOM 0 H CYS A 8 19.532 -8.260 -11.423 1.00 0.00 H new ATOM 0 HA CYS A 8 18.612 -10.149 -13.513 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.348 -7.675 -14.215 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.090 -7.540 -14.078 1.00 0.00 H new ATOM 0 HG CYS A 8 18.462 -9.690 -16.235 1.00 0.00 H new ATOM 142 N LYS A 9 21.062 -10.811 -14.062 1.00 0.00 N ATOM 143 CA LYS A 9 22.425 -11.369 -14.171 1.00 0.00 C ATOM 144 C LYS A 9 23.455 -10.226 -14.230 1.00 0.00 C ATOM 145 O LYS A 9 23.167 -9.143 -14.736 1.00 0.00 O ATOM 146 CB LYS A 9 22.534 -12.319 -15.381 1.00 0.00 C ATOM 147 CG LYS A 9 21.625 -13.552 -15.225 1.00 0.00 C ATOM 148 CD LYS A 9 21.749 -14.570 -16.374 1.00 0.00 C ATOM 149 CE LYS A 9 23.118 -15.272 -16.409 1.00 0.00 C ATOM 150 NZ LYS A 9 23.176 -16.317 -17.472 1.00 0.00 N ATOM 0 H LYS A 9 20.455 -11.073 -14.839 1.00 0.00 H new ATOM 0 HA LYS A 9 22.642 -11.965 -13.285 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.264 -11.782 -16.290 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.568 -12.643 -15.497 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.863 -14.050 -14.285 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.589 -13.221 -15.157 1.00 0.00 H new ATOM 0 HD2 LYS A 9 20.964 -15.320 -16.274 1.00 0.00 H new ATOM 0 HD3 LYS A 9 21.584 -14.060 -17.323 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.901 -14.534 -16.582 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.318 -15.728 -15.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.113 -16.768 -17.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.445 -17.035 -17.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 23.010 -15.878 -18.400 1.00 0.00 H new ATOM 164 N ARG A 10 24.651 -10.466 -13.685 1.00 0.00 N ATOM 165 CA ARG A 10 25.668 -9.416 -13.452 1.00 0.00 C ATOM 166 C ARG A 10 26.229 -8.772 -14.734 1.00 0.00 C ATOM 167 O ARG A 10 26.235 -9.390 -15.797 1.00 0.00 O ATOM 168 CB ARG A 10 26.730 -9.951 -12.476 1.00 0.00 C ATOM 169 CG ARG A 10 27.853 -10.816 -13.082 1.00 0.00 C ATOM 170 CD ARG A 10 29.133 -10.027 -13.405 1.00 0.00 C ATOM 171 NE ARG A 10 29.684 -9.353 -12.203 1.00 0.00 N ATOM 172 CZ ARG A 10 30.867 -9.517 -11.633 1.00 0.00 C ATOM 173 NH1 ARG A 10 31.784 -10.303 -12.119 1.00 0.00 N ATOM 174 NH2 ARG A 10 31.134 -8.877 -10.530 1.00 0.00 N ATOM 0 H ARG A 10 24.950 -11.395 -13.389 1.00 0.00 H new ATOM 0 HA ARG A 10 25.179 -8.565 -12.979 1.00 0.00 H new ATOM 0 HB2 ARG A 10 27.190 -9.100 -11.973 1.00 0.00 H new ATOM 0 HB3 ARG A 10 26.223 -10.538 -11.710 1.00 0.00 H new ATOM 0 HG2 ARG A 10 28.097 -11.619 -12.386 1.00 0.00 H new ATOM 0 HG3 ARG A 10 27.486 -11.286 -13.995 1.00 0.00 H new ATOM 0 HD2 ARG A 10 29.882 -10.703 -13.818 1.00 0.00 H new ATOM 0 HD3 ARG A 10 28.917 -9.283 -14.172 1.00 0.00 H new ATOM 0 HE ARG A 10 29.069 -8.673 -11.757 1.00 0.00 H new ATOM 0 HH11 ARG A 10 31.605 -10.826 -12.976 1.00 0.00 H new ATOM 0 HH12 ARG A 10 32.681 -10.396 -11.642 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.435 -8.259 -10.117 1.00 0.00 H new ATOM 0 HH22 ARG A 10 32.042 -8.994 -10.080 1.00 0.00 H new ATOM 188 N ASN A 11 26.711 -7.529 -14.608 1.00 0.00 N ATOM 189 CA ASN A 11 27.188 -6.677 -15.714 1.00 0.00 C ATOM 190 C ASN A 11 26.162 -6.541 -16.874 1.00 0.00 C ATOM 191 O ASN A 11 26.510 -6.593 -18.054 1.00 0.00 O ATOM 192 CB ASN A 11 28.616 -7.113 -16.118 1.00 0.00 C ATOM 193 CG ASN A 11 29.363 -6.122 -17.001 1.00 0.00 C ATOM 194 OD1 ASN A 11 28.926 -5.015 -17.282 1.00 0.00 O ATOM 195 ND2 ASN A 11 30.538 -6.485 -17.462 1.00 0.00 N ATOM 0 H ASN A 11 26.784 -7.069 -13.701 1.00 0.00 H new ATOM 0 HA ASN A 11 27.268 -5.646 -15.370 1.00 0.00 H new ATOM 0 HB2 ASN A 11 29.199 -7.281 -15.212 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.555 -8.068 -16.640 1.00 0.00 H new ATOM 0 HD21 ASN A 11 31.076 -5.846 -18.048 1.00 0.00 H new ATOM 0 HD22 ASN A 11 30.913 -7.406 -17.234 1.00 0.00 H new ATOM 202 N SER A 12 24.882 -6.365 -16.515 1.00 0.00 N ATOM 203 CA SER A 12 23.764 -6.069 -17.430 1.00 0.00 C ATOM 204 C SER A 12 23.053 -4.773 -17.016 1.00 0.00 C ATOM 205 O SER A 12 23.287 -4.267 -15.921 1.00 0.00 O ATOM 206 CB SER A 12 22.801 -7.262 -17.460 1.00 0.00 C ATOM 207 OG SER A 12 21.886 -7.117 -18.540 1.00 0.00 O ATOM 0 H SER A 12 24.583 -6.427 -15.542 1.00 0.00 H new ATOM 0 HA SER A 12 24.149 -5.913 -18.438 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.361 -8.191 -17.569 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.258 -7.326 -16.517 1.00 0.00 H new ATOM 0 HG SER A 12 22.180 -7.670 -19.294 1.00 0.00 H new ATOM 213 N CYS A 13 22.171 -4.247 -17.875 1.00 0.00 N ATOM 214 CA CYS A 13 21.402 -3.013 -17.624 1.00 0.00 C ATOM 215 C CYS A 13 19.878 -3.232 -17.587 1.00 0.00 C ATOM 216 O CYS A 13 19.134 -2.267 -17.479 1.00 0.00 O ATOM 217 CB CYS A 13 21.840 -1.953 -18.656 1.00 0.00 C ATOM 218 SG CYS A 13 21.323 -0.276 -18.164 1.00 0.00 S ATOM 0 H CYS A 13 21.965 -4.671 -18.780 1.00 0.00 H new ATOM 0 HA CYS A 13 21.629 -2.654 -16.620 1.00 0.00 H new ATOM 0 HB2 CYS A 13 22.924 -1.981 -18.768 1.00 0.00 H new ATOM 0 HB3 CYS A 13 21.412 -2.194 -19.629 1.00 0.00 H new ATOM 0 HG CYS A 13 20.164 -0.333 -17.579 1.00 0.00 H new ATOM 224 N ARG A 14 19.371 -4.472 -17.653 1.00 0.00 N ATOM 225 CA ARG A 14 17.920 -4.766 -17.749 1.00 0.00 C ATOM 226 C ARG A 14 17.213 -4.492 -16.424 1.00 0.00 C ATOM 227 O ARG A 14 16.145 -3.903 -16.425 1.00 0.00 O ATOM 228 CB ARG A 14 17.701 -6.209 -18.269 1.00 0.00 C ATOM 229 CG ARG A 14 18.192 -6.377 -19.723 1.00 0.00 C ATOM 230 CD ARG A 14 18.323 -7.850 -20.130 1.00 0.00 C ATOM 231 NE ARG A 14 19.522 -8.487 -19.542 1.00 0.00 N ATOM 232 CZ ARG A 14 19.895 -9.749 -19.689 1.00 0.00 C ATOM 233 NH1 ARG A 14 19.209 -10.605 -20.387 1.00 0.00 N ATOM 234 NH2 ARG A 14 21.000 -10.161 -19.139 1.00 0.00 N ATOM 0 H ARG A 14 19.954 -5.309 -17.642 1.00 0.00 H new ATOM 0 HA ARG A 14 17.465 -4.092 -18.475 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.229 -6.911 -17.624 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.641 -6.459 -18.212 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.498 -5.877 -20.398 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.158 -5.884 -19.837 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.433 -8.393 -19.813 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.371 -7.922 -21.217 1.00 0.00 H new ATOM 0 HE ARG A 14 20.121 -7.895 -18.966 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.347 -10.313 -20.847 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.533 -11.568 -20.474 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.573 -9.513 -18.598 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.293 -11.132 -19.248 1.00 0.00 H new ATOM 248 N SER A 15 17.855 -4.790 -15.296 1.00 0.00 N ATOM 249 CA SER A 15 17.393 -4.400 -13.946 1.00 0.00 C ATOM 250 C SER A 15 17.342 -2.879 -13.785 1.00 0.00 C ATOM 251 O SER A 15 16.342 -2.331 -13.331 1.00 0.00 O ATOM 252 CB SER A 15 18.327 -5.022 -12.893 1.00 0.00 C ATOM 253 OG SER A 15 19.665 -5.003 -13.372 1.00 0.00 O ATOM 0 H SER A 15 18.727 -5.318 -15.284 1.00 0.00 H new ATOM 0 HA SER A 15 16.379 -4.773 -13.805 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.257 -4.467 -11.957 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.021 -6.046 -12.680 1.00 0.00 H new ATOM 0 HG SER A 15 20.039 -4.104 -13.262 1.00 0.00 H new ATOM 259 N GLN A 16 18.398 -2.192 -14.217 1.00 0.00 N ATOM 260 CA GLN A 16 18.538 -0.731 -14.123 1.00 0.00 C ATOM 261 C GLN A 16 17.561 0.002 -15.057 1.00 0.00 C ATOM 262 O GLN A 16 16.901 0.948 -14.629 1.00 0.00 O ATOM 263 CB GLN A 16 20.018 -0.369 -14.374 1.00 0.00 C ATOM 264 CG GLN A 16 20.839 -0.203 -13.076 1.00 0.00 C ATOM 265 CD GLN A 16 21.022 -1.464 -12.237 1.00 0.00 C ATOM 266 OE1 GLN A 16 20.694 -2.575 -12.624 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.576 -1.372 -11.051 1.00 0.00 N ATOM 0 H GLN A 16 19.202 -2.642 -14.654 1.00 0.00 H new ATOM 0 HA GLN A 16 18.265 -0.393 -13.123 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.475 -1.146 -14.987 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.065 0.558 -14.946 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.825 0.181 -13.339 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.356 0.554 -12.458 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.864 -0.462 -10.692 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.719 -2.211 -10.488 1.00 0.00 H new ATOM 276 N MET A 17 17.355 -0.495 -16.282 1.00 0.00 N ATOM 277 CA MET A 17 16.315 0.003 -17.199 1.00 0.00 C ATOM 278 C MET A 17 14.903 -0.319 -16.720 1.00 0.00 C ATOM 279 O MET A 17 14.020 0.522 -16.878 1.00 0.00 O ATOM 280 CB MET A 17 16.503 -0.550 -18.625 1.00 0.00 C ATOM 281 CG MET A 17 17.603 0.163 -19.416 1.00 0.00 C ATOM 282 SD MET A 17 17.553 1.978 -19.403 1.00 0.00 S ATOM 283 CE MET A 17 15.815 2.357 -19.779 1.00 0.00 C ATOM 0 H MET A 17 17.907 -1.259 -16.671 1.00 0.00 H new ATOM 0 HA MET A 17 16.432 1.087 -17.212 1.00 0.00 H new ATOM 0 HB2 MET A 17 16.739 -1.612 -18.566 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.562 -0.462 -19.167 1.00 0.00 H new ATOM 0 HG2 MET A 17 18.569 -0.156 -19.023 1.00 0.00 H new ATOM 0 HG3 MET A 17 17.553 -0.174 -20.452 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.685 3.437 -19.848 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.539 1.897 -20.728 1.00 0.00 H new ATOM 0 HE3 MET A 17 15.177 1.965 -18.987 1.00 0.00 H new ATOM 293 N ALA A 18 14.675 -1.489 -16.114 1.00 0.00 N ATOM 294 CA ALA A 18 13.368 -1.789 -15.513 1.00 0.00 C ATOM 295 C ALA A 18 13.038 -0.816 -14.372 1.00 0.00 C ATOM 296 O ALA A 18 11.960 -0.229 -14.379 1.00 0.00 O ATOM 297 CB ALA A 18 13.328 -3.256 -15.091 1.00 0.00 C ATOM 0 H ALA A 18 15.366 -2.234 -16.026 1.00 0.00 H new ATOM 0 HA ALA A 18 12.582 -1.640 -16.253 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.359 -3.480 -14.645 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.481 -3.890 -15.964 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.116 -3.447 -14.362 1.00 0.00 H new ATOM 303 N GLU A 19 13.989 -0.523 -13.476 1.00 0.00 N ATOM 304 CA GLU A 19 13.820 0.565 -12.499 1.00 0.00 C ATOM 305 C GLU A 19 13.628 1.922 -13.200 1.00 0.00 C ATOM 306 O GLU A 19 12.774 2.692 -12.784 1.00 0.00 O ATOM 307 CB GLU A 19 15.008 0.616 -11.532 1.00 0.00 C ATOM 308 CG GLU A 19 14.814 1.637 -10.398 1.00 0.00 C ATOM 309 CD GLU A 19 16.154 2.237 -9.955 1.00 0.00 C ATOM 310 OE1 GLU A 19 16.990 1.491 -9.395 1.00 0.00 O ATOM 311 OE2 GLU A 19 16.389 3.436 -10.233 1.00 0.00 O ATOM 0 H GLU A 19 14.878 -1.019 -13.406 1.00 0.00 H new ATOM 0 HA GLU A 19 12.918 0.358 -11.923 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.162 -0.373 -11.101 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.912 0.865 -12.088 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.149 2.433 -10.732 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.331 1.154 -9.549 1.00 0.00 H new ATOM 318 N GLY A 20 14.355 2.194 -14.287 1.00 0.00 N ATOM 319 CA GLY A 20 14.224 3.403 -15.104 1.00 0.00 C ATOM 320 C GLY A 20 12.789 3.649 -15.578 1.00 0.00 C ATOM 321 O GLY A 20 12.172 4.638 -15.188 1.00 0.00 O ATOM 0 H GLY A 20 15.074 1.559 -14.633 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.563 4.264 -14.528 1.00 0.00 H new ATOM 0 HA3 GLY A 20 14.879 3.322 -15.971 1.00 0.00 H new ATOM 325 N PHE A 21 12.204 2.727 -16.352 1.00 0.00 N ATOM 326 CA PHE A 21 10.792 2.836 -16.757 1.00 0.00 C ATOM 327 C PHE A 21 9.854 2.850 -15.546 1.00 0.00 C ATOM 328 O PHE A 21 8.848 3.557 -15.554 1.00 0.00 O ATOM 329 CB PHE A 21 10.422 1.720 -17.751 1.00 0.00 C ATOM 330 CG PHE A 21 10.833 2.021 -19.173 1.00 0.00 C ATOM 331 CD1 PHE A 21 9.975 2.769 -19.999 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.070 1.575 -19.670 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.365 3.094 -21.308 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.451 1.887 -20.982 1.00 0.00 C ATOM 335 CZ PHE A 21 11.606 2.661 -21.798 1.00 0.00 C ATOM 0 H PHE A 21 12.681 1.900 -16.710 1.00 0.00 H new ATOM 0 HA PHE A 21 10.664 3.792 -17.265 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.894 0.790 -17.434 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.345 1.558 -17.719 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.015 3.094 -19.626 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.726 0.992 -19.041 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.710 3.677 -21.938 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.395 1.532 -21.368 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.912 2.921 -22.800 1.00 0.00 H new ATOM 345 N ALA A 22 10.185 2.129 -14.474 1.00 0.00 N ATOM 346 CA ALA A 22 9.360 2.084 -13.272 1.00 0.00 C ATOM 347 C ALA A 22 9.412 3.374 -12.431 1.00 0.00 C ATOM 348 O ALA A 22 8.404 3.696 -11.815 1.00 0.00 O ATOM 349 CB ALA A 22 9.731 0.823 -12.494 1.00 0.00 C ATOM 0 H ALA A 22 11.031 1.562 -14.417 1.00 0.00 H new ATOM 0 HA ALA A 22 8.310 2.031 -13.560 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.128 0.764 -11.588 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.544 -0.055 -13.113 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.787 0.859 -12.225 1.00 0.00 H new ATOM 355 N LYS A 23 10.487 4.178 -12.453 1.00 0.00 N ATOM 356 CA LYS A 23 10.483 5.521 -11.832 1.00 0.00 C ATOM 357 C LYS A 23 9.711 6.555 -12.664 1.00 0.00 C ATOM 358 O LYS A 23 9.115 7.460 -12.094 1.00 0.00 O ATOM 359 CB LYS A 23 11.897 6.009 -11.441 1.00 0.00 C ATOM 360 CG LYS A 23 12.888 6.219 -12.601 1.00 0.00 C ATOM 361 CD LYS A 23 14.000 7.231 -12.281 1.00 0.00 C ATOM 362 CE LYS A 23 14.945 6.784 -11.154 1.00 0.00 C ATOM 363 NZ LYS A 23 15.918 7.861 -10.806 1.00 0.00 N ATOM 0 H LYS A 23 11.372 3.925 -12.893 1.00 0.00 H new ATOM 0 HA LYS A 23 9.935 5.413 -10.896 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.797 6.950 -10.901 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.329 5.288 -10.748 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.342 5.262 -12.859 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.340 6.559 -13.480 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.585 7.410 -13.183 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.544 8.181 -12.004 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.363 6.518 -10.272 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.485 5.889 -11.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.692 7.460 -10.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.306 8.273 -11.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.435 8.602 -10.258 1.00 0.00 H new ATOM 377 N THR A 24 9.653 6.385 -13.991 1.00 0.00 N ATOM 378 CA THR A 24 8.855 7.246 -14.894 1.00 0.00 C ATOM 379 C THR A 24 7.353 6.928 -14.825 1.00 0.00 C ATOM 380 O THR A 24 6.534 7.838 -14.710 1.00 0.00 O ATOM 381 CB THR A 24 9.349 7.118 -16.345 1.00 0.00 C ATOM 382 OG1 THR A 24 10.751 7.258 -16.402 1.00 0.00 O ATOM 383 CG2 THR A 24 8.758 8.169 -17.281 1.00 0.00 C ATOM 0 H THR A 24 10.158 5.645 -14.478 1.00 0.00 H new ATOM 0 HA THR A 24 8.993 8.272 -14.554 1.00 0.00 H new ATOM 0 HB THR A 24 9.025 6.131 -16.673 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.175 6.457 -16.029 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.149 8.021 -18.288 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.672 8.074 -17.295 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.031 9.164 -16.929 1.00 0.00 H new ATOM 391 N LEU A 25 6.980 5.640 -14.865 1.00 0.00 N ATOM 392 CA LEU A 25 5.580 5.178 -14.984 1.00 0.00 C ATOM 393 C LEU A 25 4.954 4.789 -13.639 1.00 0.00 C ATOM 394 O LEU A 25 3.756 4.963 -13.432 1.00 0.00 O ATOM 395 CB LEU A 25 5.528 4.004 -15.985 1.00 0.00 C ATOM 396 CG LEU A 25 6.106 4.341 -17.369 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.103 3.098 -18.252 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.322 5.437 -18.093 1.00 0.00 C ATOM 0 H LEU A 25 7.651 4.873 -14.815 1.00 0.00 H new ATOM 0 HA LEU A 25 4.981 6.011 -15.351 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.077 3.159 -15.568 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.492 3.685 -16.102 1.00 0.00 H new ATOM 0 HG LEU A 25 7.119 4.703 -17.196 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.514 3.346 -19.231 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.712 2.321 -17.789 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.081 2.737 -18.369 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.779 5.630 -19.064 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.291 5.113 -18.235 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.337 6.349 -17.497 1.00 0.00 H new ATOM 410 N GLY A 26 5.783 4.309 -12.711 1.00 0.00 N ATOM 411 CA GLY A 26 5.453 4.072 -11.301 1.00 0.00 C ATOM 412 C GLY A 26 5.580 5.315 -10.424 1.00 0.00 C ATOM 413 O GLY A 26 5.411 5.197 -9.212 1.00 0.00 O ATOM 0 H GLY A 26 6.748 4.063 -12.930 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.433 3.694 -11.234 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.108 3.293 -10.910 1.00 0.00 H new ATOM 417 N ALA A 27 5.867 6.488 -11.011 1.00 0.00 N ATOM 418 CA ALA A 27 5.977 7.767 -10.292 1.00 0.00 C ATOM 419 C ALA A 27 4.806 8.005 -9.308 1.00 0.00 C ATOM 420 O ALA A 27 3.668 8.235 -9.723 1.00 0.00 O ATOM 421 CB ALA A 27 6.059 8.900 -11.328 1.00 0.00 C ATOM 0 H ALA A 27 6.032 6.575 -12.014 1.00 0.00 H new ATOM 0 HA ALA A 27 6.879 7.742 -9.681 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.141 9.858 -10.814 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.934 8.752 -11.961 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.160 8.895 -11.945 1.00 0.00 H new ATOM 427 N GLY A 28 5.086 7.936 -8.000 1.00 0.00 N ATOM 428 CA GLY A 28 4.097 8.127 -6.927 1.00 0.00 C ATOM 429 C GLY A 28 3.105 6.972 -6.719 1.00 0.00 C ATOM 430 O GLY A 28 2.047 7.193 -6.125 1.00 0.00 O ATOM 0 H GLY A 28 6.024 7.742 -7.650 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.631 8.295 -5.992 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.531 9.034 -7.138 1.00 0.00 H new ATOM 434 N LYS A 29 3.410 5.754 -7.200 1.00 0.00 N ATOM 435 CA LYS A 29 2.500 4.582 -7.173 1.00 0.00 C ATOM 436 C LYS A 29 3.073 3.430 -6.354 1.00 0.00 C ATOM 437 O LYS A 29 2.339 2.733 -5.662 1.00 0.00 O ATOM 438 CB LYS A 29 2.237 4.107 -8.612 1.00 0.00 C ATOM 439 CG LYS A 29 1.560 5.181 -9.480 1.00 0.00 C ATOM 440 CD LYS A 29 1.351 4.701 -10.921 1.00 0.00 C ATOM 441 CE LYS A 29 0.839 5.861 -11.789 1.00 0.00 C ATOM 442 NZ LYS A 29 0.884 5.529 -13.245 1.00 0.00 N ATOM 0 H LYS A 29 4.312 5.547 -7.628 1.00 0.00 H new ATOM 0 HA LYS A 29 1.570 4.894 -6.699 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.181 3.817 -9.072 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.608 3.217 -8.587 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.598 5.448 -9.043 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.171 6.084 -9.483 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.288 4.318 -11.326 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.636 3.878 -10.940 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.185 6.104 -11.503 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.442 6.749 -11.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.579 6.355 -13.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.856 5.272 -13.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.249 4.728 -13.438 1.00 0.00 H new ATOM 456 N ILE A 30 4.391 3.259 -6.455 1.00 0.00 N ATOM 457 CA ILE A 30 5.242 2.328 -5.706 1.00 0.00 C ATOM 458 C ILE A 30 6.669 2.894 -5.602 1.00 0.00 C ATOM 459 O ILE A 30 7.031 3.829 -6.318 1.00 0.00 O ATOM 460 CB ILE A 30 5.259 0.907 -6.335 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.023 0.791 -7.859 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.267 -0.014 -5.605 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.154 1.420 -8.679 1.00 0.00 C ATOM 0 H ILE A 30 4.937 3.812 -7.116 1.00 0.00 H new ATOM 0 HA ILE A 30 4.820 2.224 -4.707 1.00 0.00 H new ATOM 0 HB ILE A 30 6.296 0.599 -6.199 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.925 -0.260 -8.129 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.081 1.275 -8.115 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.291 -1.005 -6.057 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.545 -0.088 -4.554 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.261 0.398 -5.686 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.937 1.310 -9.742 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.237 2.479 -8.433 1.00 0.00 H new ATOM 0 HD13 ILE A 30 7.094 0.919 -8.447 1.00 0.00 H new ATOM 475 N ALA A 31 7.489 2.311 -4.727 1.00 0.00 N ATOM 476 CA ALA A 31 8.932 2.585 -4.664 1.00 0.00 C ATOM 477 C ALA A 31 9.688 1.601 -5.574 1.00 0.00 C ATOM 478 O ALA A 31 9.217 0.487 -5.793 1.00 0.00 O ATOM 479 CB ALA A 31 9.395 2.552 -3.199 1.00 0.00 C ATOM 0 H ALA A 31 7.172 1.631 -4.036 1.00 0.00 H new ATOM 0 HA ALA A 31 9.155 3.584 -5.040 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.465 2.755 -3.151 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.856 3.309 -2.630 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.193 1.568 -2.776 1.00 0.00 H new ATOM 485 N VAL A 32 10.845 1.980 -6.124 1.00 0.00 N ATOM 486 CA VAL A 32 11.584 1.171 -7.123 1.00 0.00 C ATOM 487 C VAL A 32 13.097 1.168 -6.878 1.00 0.00 C ATOM 488 O VAL A 32 13.677 2.194 -6.523 1.00 0.00 O ATOM 489 CB VAL A 32 11.288 1.619 -8.569 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.801 1.479 -8.901 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.680 3.070 -8.876 1.00 0.00 C ATOM 0 H VAL A 32 11.306 2.860 -5.894 1.00 0.00 H new ATOM 0 HA VAL A 32 11.221 0.151 -6.996 1.00 0.00 H new ATOM 0 HB VAL A 32 11.903 0.958 -9.179 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.625 1.803 -9.927 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.501 0.437 -8.793 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.216 2.098 -8.220 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.437 3.301 -9.913 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.131 3.742 -8.217 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.750 3.199 -8.716 1.00 0.00 H new ATOM 501 N THR A 33 13.741 0.020 -7.105 1.00 0.00 N ATOM 502 CA THR A 33 15.196 -0.177 -6.953 1.00 0.00 C ATOM 503 C THR A 33 15.703 -1.233 -7.942 1.00 0.00 C ATOM 504 O THR A 33 14.938 -2.101 -8.366 1.00 0.00 O ATOM 505 CB THR A 33 15.531 -0.615 -5.513 1.00 0.00 C ATOM 506 OG1 THR A 33 14.874 0.209 -4.570 1.00 0.00 O ATOM 507 CG2 THR A 33 17.019 -0.556 -5.163 1.00 0.00 C ATOM 0 H THR A 33 13.257 -0.825 -7.408 1.00 0.00 H new ATOM 0 HA THR A 33 15.691 0.771 -7.163 1.00 0.00 H new ATOM 0 HB THR A 33 15.198 -1.652 -5.469 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.412 0.263 -3.752 1.00 0.00 H new ATOM 0 HG21 THR A 33 17.164 -0.881 -4.133 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.576 -1.212 -5.832 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.379 0.467 -5.275 1.00 0.00 H new ATOM 515 N SER A 34 16.982 -1.192 -8.315 1.00 0.00 N ATOM 516 CA SER A 34 17.619 -2.159 -9.220 1.00 0.00 C ATOM 517 C SER A 34 18.891 -2.770 -8.627 1.00 0.00 C ATOM 518 O SER A 34 19.643 -2.117 -7.902 1.00 0.00 O ATOM 519 CB SER A 34 17.904 -1.526 -10.583 1.00 0.00 C ATOM 520 OG SER A 34 18.583 -0.289 -10.483 1.00 0.00 O ATOM 0 H SER A 34 17.623 -0.468 -7.990 1.00 0.00 H new ATOM 0 HA SER A 34 16.910 -2.976 -9.356 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.501 -2.215 -11.181 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.963 -1.377 -11.113 1.00 0.00 H new ATOM 0 HG SER A 34 17.995 0.374 -10.064 1.00 0.00 H new ATOM 526 N CYS A 35 19.137 -4.044 -8.943 1.00 0.00 N ATOM 527 CA CYS A 35 20.256 -4.831 -8.429 1.00 0.00 C ATOM 528 C CYS A 35 20.730 -5.872 -9.465 1.00 0.00 C ATOM 529 O CYS A 35 19.931 -6.408 -10.229 1.00 0.00 O ATOM 530 CB CYS A 35 19.784 -5.473 -7.105 1.00 0.00 C ATOM 531 SG CYS A 35 20.899 -6.787 -6.515 1.00 0.00 S ATOM 0 H CYS A 35 18.543 -4.571 -9.584 1.00 0.00 H new ATOM 0 HA CYS A 35 21.126 -4.203 -8.240 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.705 -4.700 -6.340 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.785 -5.887 -7.244 1.00 0.00 H new ATOM 0 HG CYS A 35 21.494 -6.395 -5.428 1.00 0.00 H new ATOM 537 N GLY A 36 22.033 -6.159 -9.490 1.00 0.00 N ATOM 538 CA GLY A 36 22.601 -7.283 -10.243 1.00 0.00 C ATOM 539 C GLY A 36 23.149 -8.303 -9.255 1.00 0.00 C ATOM 540 O GLY A 36 23.709 -7.900 -8.236 1.00 0.00 O ATOM 0 H GLY A 36 22.731 -5.614 -8.984 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.838 -7.740 -10.874 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.394 -6.933 -10.904 1.00 0.00 H new ATOM 544 N LEU A 37 23.033 -9.608 -9.521 1.00 0.00 N ATOM 545 CA LEU A 37 23.416 -10.643 -8.535 1.00 0.00 C ATOM 546 C LEU A 37 24.866 -10.475 -8.031 1.00 0.00 C ATOM 547 O LEU A 37 25.114 -10.568 -6.832 1.00 0.00 O ATOM 548 CB LEU A 37 23.169 -12.050 -9.118 1.00 0.00 C ATOM 549 CG LEU A 37 21.704 -12.346 -9.500 1.00 0.00 C ATOM 550 CD1 LEU A 37 21.595 -13.750 -10.081 1.00 0.00 C ATOM 551 CD2 LEU A 37 20.736 -12.242 -8.323 1.00 0.00 C ATOM 0 H LEU A 37 22.680 -9.979 -10.403 1.00 0.00 H new ATOM 0 HA LEU A 37 22.781 -10.516 -7.658 1.00 0.00 H new ATOM 0 HB2 LEU A 37 23.793 -12.175 -10.003 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.496 -12.792 -8.390 1.00 0.00 H new ATOM 0 HG LEU A 37 21.424 -11.587 -10.230 1.00 0.00 H new ATOM 0 HD11 LEU A 37 20.558 -13.953 -10.349 1.00 0.00 H new ATOM 0 HD12 LEU A 37 22.221 -13.825 -10.970 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.928 -14.477 -9.340 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.724 -12.462 -8.663 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.023 -12.957 -7.552 1.00 0.00 H new ATOM 0 HD23 LEU A 37 20.769 -11.233 -7.913 1.00 0.00 H new ATOM 563 N GLU A 38 25.780 -10.096 -8.933 1.00 0.00 N ATOM 564 CA GLU A 38 27.162 -9.668 -8.635 1.00 0.00 C ATOM 565 C GLU A 38 27.416 -8.246 -9.192 1.00 0.00 C ATOM 566 O GLU A 38 28.424 -7.990 -9.855 1.00 0.00 O ATOM 567 CB GLU A 38 28.182 -10.704 -9.143 1.00 0.00 C ATOM 568 CG GLU A 38 27.978 -12.136 -8.624 1.00 0.00 C ATOM 569 CD GLU A 38 28.170 -12.293 -7.099 1.00 0.00 C ATOM 570 OE1 GLU A 38 28.975 -11.545 -6.489 1.00 0.00 O ATOM 571 OE2 GLU A 38 27.567 -13.224 -6.512 1.00 0.00 O ATOM 0 H GLU A 38 25.574 -10.077 -9.932 1.00 0.00 H new ATOM 0 HA GLU A 38 27.294 -9.615 -7.554 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.146 -10.721 -10.232 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.182 -10.373 -8.863 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.973 -12.466 -8.888 1.00 0.00 H new ATOM 0 HG3 GLU A 38 28.676 -12.798 -9.136 1.00 0.00 H new ATOM 578 N SER A 39 26.457 -7.337 -8.957 1.00 0.00 N ATOM 579 CA SER A 39 26.300 -5.971 -9.508 1.00 0.00 C ATOM 580 C SER A 39 25.952 -5.862 -11.007 1.00 0.00 C ATOM 581 O SER A 39 26.400 -6.645 -11.845 1.00 0.00 O ATOM 582 CB SER A 39 27.454 -5.042 -9.089 1.00 0.00 C ATOM 583 OG SER A 39 28.624 -5.289 -9.846 1.00 0.00 O ATOM 0 H SER A 39 25.695 -7.556 -8.315 1.00 0.00 H new ATOM 0 HA SER A 39 25.387 -5.611 -9.033 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.150 -4.003 -9.217 1.00 0.00 H new ATOM 0 HB3 SER A 39 27.669 -5.183 -8.030 1.00 0.00 H new ATOM 0 HG SER A 39 28.687 -6.246 -10.047 1.00 0.00 H new ATOM 589 N SER A 40 25.122 -4.871 -11.338 1.00 0.00 N ATOM 590 CA SER A 40 24.700 -4.462 -12.694 1.00 0.00 C ATOM 591 C SER A 40 25.349 -3.127 -13.111 1.00 0.00 C ATOM 592 O SER A 40 26.011 -2.474 -12.303 1.00 0.00 O ATOM 593 CB SER A 40 23.169 -4.399 -12.749 1.00 0.00 C ATOM 594 OG SER A 40 22.667 -5.708 -12.932 1.00 0.00 O ATOM 0 H SER A 40 24.693 -4.287 -10.620 1.00 0.00 H new ATOM 0 HA SER A 40 25.044 -5.204 -13.414 1.00 0.00 H new ATOM 0 HB2 SER A 40 22.775 -3.969 -11.828 1.00 0.00 H new ATOM 0 HB3 SER A 40 22.847 -3.753 -13.566 1.00 0.00 H new ATOM 0 HG SER A 40 21.700 -5.669 -13.087 1.00 0.00 H new ATOM 600 N ARG A 41 25.199 -2.719 -14.380 1.00 0.00 N ATOM 601 CA ARG A 41 25.926 -1.585 -14.998 1.00 0.00 C ATOM 602 C ARG A 41 25.043 -0.768 -15.939 1.00 0.00 C ATOM 603 O ARG A 41 24.217 -1.320 -16.651 1.00 0.00 O ATOM 604 CB ARG A 41 27.192 -2.172 -15.669 1.00 0.00 C ATOM 605 CG ARG A 41 28.005 -1.246 -16.600 1.00 0.00 C ATOM 606 CD ARG A 41 27.619 -1.375 -18.081 1.00 0.00 C ATOM 607 NE ARG A 41 27.994 -2.696 -18.619 1.00 0.00 N ATOM 608 CZ ARG A 41 27.968 -3.091 -19.878 1.00 0.00 C ATOM 609 NH1 ARG A 41 27.585 -2.320 -20.847 1.00 0.00 N ATOM 610 NH2 ARG A 41 28.316 -4.301 -20.182 1.00 0.00 N ATOM 0 H ARG A 41 24.555 -3.175 -15.026 1.00 0.00 H new ATOM 0 HA ARG A 41 26.226 -0.858 -14.243 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.858 -2.523 -14.880 1.00 0.00 H new ATOM 0 HB3 ARG A 41 26.891 -3.047 -16.245 1.00 0.00 H new ATOM 0 HG2 ARG A 41 27.864 -0.212 -16.285 1.00 0.00 H new ATOM 0 HG3 ARG A 41 29.066 -1.472 -16.488 1.00 0.00 H new ATOM 0 HD2 ARG A 41 26.545 -1.226 -18.194 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.112 -0.592 -18.657 1.00 0.00 H new ATOM 0 HE ARG A 41 28.311 -3.386 -17.938 1.00 0.00 H new ATOM 0 HH11 ARG A 41 27.287 -1.364 -20.651 1.00 0.00 H new ATOM 0 HH12 ARG A 41 27.582 -2.669 -21.805 1.00 0.00 H new ATOM 0 HH21 ARG A 41 28.609 -4.947 -19.449 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.297 -4.608 -21.154 1.00 0.00 H new ATOM 624 N VAL A 42 25.271 0.546 -15.949 1.00 0.00 N ATOM 625 CA VAL A 42 24.677 1.524 -16.880 1.00 0.00 C ATOM 626 C VAL A 42 25.720 2.010 -17.897 1.00 0.00 C ATOM 627 O VAL A 42 26.916 2.019 -17.600 1.00 0.00 O ATOM 628 CB VAL A 42 24.032 2.706 -16.118 1.00 0.00 C ATOM 629 CG1 VAL A 42 22.833 2.241 -15.290 1.00 0.00 C ATOM 630 CG2 VAL A 42 24.985 3.476 -15.194 1.00 0.00 C ATOM 0 H VAL A 42 25.903 0.984 -15.279 1.00 0.00 H new ATOM 0 HA VAL A 42 23.881 1.024 -17.432 1.00 0.00 H new ATOM 0 HB VAL A 42 23.724 3.392 -16.907 1.00 0.00 H new ATOM 0 HG11 VAL A 42 22.400 3.093 -14.766 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.084 1.802 -15.949 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.159 1.496 -14.564 1.00 0.00 H new ATOM 0 HG21 VAL A 42 24.443 4.285 -14.704 1.00 0.00 H new ATOM 0 HG22 VAL A 42 25.386 2.799 -14.440 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.804 3.892 -15.781 1.00 0.00 H new ATOM 640 N HIS A 43 25.283 2.424 -19.091 1.00 0.00 N ATOM 641 CA HIS A 43 26.157 2.875 -20.191 1.00 0.00 C ATOM 642 C HIS A 43 25.614 4.138 -20.867 1.00 0.00 C ATOM 643 O HIS A 43 24.396 4.258 -20.975 1.00 0.00 O ATOM 644 CB HIS A 43 26.379 1.750 -21.231 1.00 0.00 C ATOM 645 CG HIS A 43 25.396 0.606 -21.258 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.410 -0.459 -20.363 1.00 0.00 N ATOM 647 CD2 HIS A 43 24.478 0.347 -22.235 1.00 0.00 C ATOM 648 CE1 HIS A 43 24.500 -1.336 -20.809 1.00 0.00 C ATOM 649 NE2 HIS A 43 23.921 -0.878 -21.928 1.00 0.00 N ATOM 0 H HIS A 43 24.292 2.457 -19.330 1.00 0.00 H new ATOM 0 HA HIS A 43 27.122 3.125 -19.750 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.387 2.207 -22.221 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.372 1.333 -21.065 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.236 0.975 -23.079 1.00 0.00 H new ATOM 0 HE1 HIS A 43 24.266 -2.278 -20.334 1.00 0.00 H new ATOM 0 HE2 HIS A 43 23.193 -1.354 -22.461 1.00 0.00 H new ATOM 657 N PRO A 44 26.465 5.030 -21.422 1.00 0.00 N ATOM 658 CA PRO A 44 26.021 6.247 -22.121 1.00 0.00 C ATOM 659 C PRO A 44 24.995 5.995 -23.234 1.00 0.00 C ATOM 660 O PRO A 44 24.032 6.746 -23.368 1.00 0.00 O ATOM 661 CB PRO A 44 27.297 6.897 -22.664 1.00 0.00 C ATOM 662 CG PRO A 44 28.357 6.455 -21.661 1.00 0.00 C ATOM 663 CD PRO A 44 27.922 5.034 -21.323 1.00 0.00 C ATOM 0 HA PRO A 44 25.487 6.896 -21.428 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.527 6.554 -23.673 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.210 7.983 -22.708 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.358 6.481 -22.091 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.372 7.095 -20.779 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.363 4.315 -22.014 1.00 0.00 H new ATOM 0 HD3 PRO A 44 28.247 4.753 -20.321 1.00 0.00 H new ATOM 671 N THR A 45 25.117 4.876 -23.962 1.00 0.00 N ATOM 672 CA THR A 45 24.117 4.451 -24.959 1.00 0.00 C ATOM 673 C THR A 45 22.765 4.146 -24.319 1.00 0.00 C ATOM 674 O THR A 45 21.738 4.555 -24.849 1.00 0.00 O ATOM 675 CB THR A 45 24.612 3.226 -25.757 1.00 0.00 C ATOM 676 OG1 THR A 45 25.922 3.451 -26.240 1.00 0.00 O ATOM 677 CG2 THR A 45 23.712 2.885 -26.948 1.00 0.00 C ATOM 0 H THR A 45 25.909 4.239 -23.879 1.00 0.00 H new ATOM 0 HA THR A 45 23.983 5.287 -25.645 1.00 0.00 H new ATOM 0 HB THR A 45 24.591 2.385 -25.063 1.00 0.00 H new ATOM 0 HG1 THR A 45 26.225 2.666 -26.743 1.00 0.00 H new ATOM 0 HG21 THR A 45 24.112 2.015 -27.469 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.706 2.664 -26.592 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.677 3.733 -27.632 1.00 0.00 H new ATOM 685 N ALA A 46 22.732 3.517 -23.138 1.00 0.00 N ATOM 686 CA ALA A 46 21.479 3.302 -22.410 1.00 0.00 C ATOM 687 C ALA A 46 20.923 4.593 -21.786 1.00 0.00 C ATOM 688 O ALA A 46 19.729 4.673 -21.530 1.00 0.00 O ATOM 689 CB ALA A 46 21.658 2.180 -21.379 1.00 0.00 C ATOM 0 H ALA A 46 23.559 3.149 -22.668 1.00 0.00 H new ATOM 0 HA ALA A 46 20.723 2.986 -23.129 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.722 2.026 -20.842 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.939 1.259 -21.889 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.440 2.457 -20.672 1.00 0.00 H new ATOM 695 N ILE A 47 21.743 5.631 -21.578 1.00 0.00 N ATOM 696 CA ILE A 47 21.221 6.956 -21.206 1.00 0.00 C ATOM 697 C ILE A 47 20.516 7.550 -22.439 1.00 0.00 C ATOM 698 O ILE A 47 19.327 7.873 -22.400 1.00 0.00 O ATOM 699 CB ILE A 47 22.318 7.909 -20.668 1.00 0.00 C ATOM 700 CG1 ILE A 47 23.165 7.242 -19.560 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.641 9.191 -20.153 1.00 0.00 C ATOM 702 CD1 ILE A 47 24.294 8.112 -18.994 1.00 0.00 C ATOM 0 H ILE A 47 22.759 5.583 -21.659 1.00 0.00 H new ATOM 0 HA ILE A 47 20.516 6.839 -20.383 1.00 0.00 H new ATOM 0 HB ILE A 47 23.007 8.154 -21.476 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.504 6.954 -18.742 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.599 6.324 -19.958 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.399 9.874 -19.770 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.100 9.670 -20.969 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.944 8.938 -19.354 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.830 7.557 -18.224 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.983 8.380 -19.795 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.872 9.019 -18.560 1.00 0.00 H new ATOM 714 N ALA A 48 21.224 7.620 -23.571 1.00 0.00 N ATOM 715 CA ALA A 48 20.772 8.345 -24.759 1.00 0.00 C ATOM 716 C ALA A 48 19.621 7.664 -25.519 1.00 0.00 C ATOM 717 O ALA A 48 18.721 8.347 -26.004 1.00 0.00 O ATOM 718 CB ALA A 48 21.984 8.583 -25.666 1.00 0.00 C ATOM 0 H ALA A 48 22.133 7.172 -23.688 1.00 0.00 H new ATOM 0 HA ALA A 48 20.347 9.292 -24.427 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.670 9.123 -26.559 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.729 9.171 -25.130 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.416 7.625 -25.955 1.00 0.00 H new ATOM 724 N MET A 49 19.589 6.326 -25.572 1.00 0.00 N ATOM 725 CA MET A 49 18.502 5.560 -26.206 1.00 0.00 C ATOM 726 C MET A 49 17.172 5.625 -25.440 1.00 0.00 C ATOM 727 O MET A 49 16.148 5.167 -25.947 1.00 0.00 O ATOM 728 CB MET A 49 18.933 4.095 -26.397 1.00 0.00 C ATOM 729 CG MET A 49 20.053 3.919 -27.427 1.00 0.00 C ATOM 730 SD MET A 49 19.573 4.304 -29.135 1.00 0.00 S ATOM 731 CE MET A 49 20.333 5.943 -29.322 1.00 0.00 C ATOM 0 H MET A 49 20.321 5.738 -25.174 1.00 0.00 H new ATOM 0 HA MET A 49 18.319 6.028 -27.173 1.00 0.00 H new ATOM 0 HB2 MET A 49 19.264 3.694 -25.439 1.00 0.00 H new ATOM 0 HB3 MET A 49 18.069 3.507 -26.707 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.891 4.557 -27.146 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.408 2.889 -27.386 1.00 0.00 H new ATOM 0 HE1 MET A 49 19.933 6.430 -30.211 1.00 0.00 H new ATOM 0 HE2 MET A 49 20.110 6.550 -28.444 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.413 5.834 -29.423 1.00 0.00 H new ATOM 741 N MET A 50 17.178 6.174 -24.221 1.00 0.00 N ATOM 742 CA MET A 50 16.051 6.119 -23.284 1.00 0.00 C ATOM 743 C MET A 50 15.627 7.510 -22.793 1.00 0.00 C ATOM 744 O MET A 50 14.440 7.739 -22.575 1.00 0.00 O ATOM 745 CB MET A 50 16.413 5.183 -22.118 1.00 0.00 C ATOM 746 CG MET A 50 17.084 3.873 -22.554 1.00 0.00 C ATOM 747 SD MET A 50 16.084 2.755 -23.548 1.00 0.00 S ATOM 748 CE MET A 50 17.322 1.454 -23.806 1.00 0.00 C ATOM 0 H MET A 50 17.983 6.679 -23.850 1.00 0.00 H new ATOM 0 HA MET A 50 15.183 5.719 -23.808 1.00 0.00 H new ATOM 0 HB2 MET A 50 17.079 5.711 -21.435 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.507 4.947 -21.560 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.983 4.121 -23.118 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.406 3.340 -21.660 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.891 0.656 -24.410 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.187 1.872 -24.321 1.00 0.00 H new ATOM 0 HE3 MET A 50 17.633 1.052 -22.842 1.00 0.00 H new ATOM 758 N GLU A 51 16.538 8.486 -22.723 1.00 0.00 N ATOM 759 CA GLU A 51 16.166 9.887 -22.469 1.00 0.00 C ATOM 760 C GLU A 51 15.264 10.460 -23.584 1.00 0.00 C ATOM 761 O GLU A 51 14.443 11.339 -23.330 1.00 0.00 O ATOM 762 CB GLU A 51 17.399 10.772 -22.216 1.00 0.00 C ATOM 763 CG GLU A 51 18.191 11.145 -23.473 1.00 0.00 C ATOM 764 CD GLU A 51 19.391 12.048 -23.122 1.00 0.00 C ATOM 765 OE1 GLU A 51 19.184 13.256 -22.848 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.552 11.570 -23.132 1.00 0.00 O ATOM 0 H GLU A 51 17.540 8.334 -22.838 1.00 0.00 H new ATOM 0 HA GLU A 51 15.576 9.894 -21.553 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.076 11.688 -21.722 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.064 10.255 -21.525 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.545 10.240 -23.966 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.539 11.659 -24.179 1.00 0.00 H new ATOM 773 N GLU A 52 15.340 9.901 -24.803 1.00 0.00 N ATOM 774 CA GLU A 52 14.461 10.255 -25.932 1.00 0.00 C ATOM 775 C GLU A 52 12.986 9.821 -25.732 1.00 0.00 C ATOM 776 O GLU A 52 12.108 10.312 -26.446 1.00 0.00 O ATOM 777 CB GLU A 52 15.063 9.775 -27.268 1.00 0.00 C ATOM 778 CG GLU A 52 15.275 8.259 -27.363 1.00 0.00 C ATOM 779 CD GLU A 52 15.721 7.816 -28.775 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.767 8.263 -29.297 1.00 0.00 O ATOM 781 OE2 GLU A 52 15.037 6.953 -29.375 1.00 0.00 O ATOM 0 H GLU A 52 16.023 9.180 -25.036 1.00 0.00 H new ATOM 0 HA GLU A 52 14.415 11.343 -25.969 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.408 10.089 -28.081 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.021 10.273 -27.420 1.00 0.00 H new ATOM 0 HG2 GLU A 52 16.026 7.953 -26.635 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.349 7.748 -27.100 1.00 0.00 H new ATOM 788 N VAL A 53 12.701 8.953 -24.744 1.00 0.00 N ATOM 789 CA VAL A 53 11.333 8.623 -24.269 1.00 0.00 C ATOM 790 C VAL A 53 11.117 9.063 -22.804 1.00 0.00 C ATOM 791 O VAL A 53 10.150 8.663 -22.156 1.00 0.00 O ATOM 792 CB VAL A 53 10.889 7.167 -24.562 1.00 0.00 C ATOM 793 CG1 VAL A 53 11.177 6.776 -26.016 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.508 6.101 -23.652 1.00 0.00 C ATOM 0 H VAL A 53 13.428 8.447 -24.238 1.00 0.00 H new ATOM 0 HA VAL A 53 10.651 9.219 -24.875 1.00 0.00 H new ATOM 0 HB VAL A 53 9.818 7.181 -24.360 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.854 5.749 -26.188 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.636 7.444 -26.686 1.00 0.00 H new ATOM 0 HG13 VAL A 53 12.247 6.857 -26.209 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.135 5.118 -23.937 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.593 6.121 -23.754 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.237 6.305 -22.616 1.00 0.00 H new ATOM 804 N GLY A 54 12.007 9.926 -22.290 1.00 0.00 N ATOM 805 CA GLY A 54 11.914 10.583 -20.978 1.00 0.00 C ATOM 806 C GLY A 54 12.492 9.804 -19.788 1.00 0.00 C ATOM 807 O GLY A 54 12.255 10.202 -18.645 1.00 0.00 O ATOM 0 H GLY A 54 12.848 10.196 -22.800 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.425 11.544 -21.039 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.864 10.792 -20.773 1.00 0.00 H new ATOM 811 N ILE A 55 13.231 8.707 -20.015 1.00 0.00 N ATOM 812 CA ILE A 55 13.741 7.843 -18.930 1.00 0.00 C ATOM 813 C ILE A 55 15.067 8.365 -18.355 1.00 0.00 C ATOM 814 O ILE A 55 15.913 8.900 -19.074 1.00 0.00 O ATOM 815 CB ILE A 55 13.863 6.360 -19.359 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.683 5.867 -20.217 1.00 0.00 C ATOM 817 CG2 ILE A 55 14.008 5.435 -18.138 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.292 6.017 -19.584 1.00 0.00 C ATOM 0 H ILE A 55 13.493 8.392 -20.949 1.00 0.00 H new ATOM 0 HA ILE A 55 12.996 7.885 -18.135 1.00 0.00 H new ATOM 0 HB ILE A 55 14.762 6.316 -19.974 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.693 6.410 -21.162 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.843 4.815 -20.453 1.00 0.00 H new ATOM 0 HG21 ILE A 55 14.091 4.401 -18.473 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.903 5.709 -17.578 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.133 5.539 -17.497 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.536 5.639 -20.273 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.252 5.449 -18.654 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.099 7.069 -19.375 1.00 0.00 H new ATOM 830 N ASP A 56 15.259 8.149 -17.053 1.00 0.00 N ATOM 831 CA ASP A 56 16.485 8.447 -16.306 1.00 0.00 C ATOM 832 C ASP A 56 17.143 7.172 -15.747 1.00 0.00 C ATOM 833 O ASP A 56 16.491 6.378 -15.064 1.00 0.00 O ATOM 834 CB ASP A 56 16.162 9.438 -15.176 1.00 0.00 C ATOM 835 CG ASP A 56 17.310 9.532 -14.154 1.00 0.00 C ATOM 836 OD1 ASP A 56 18.422 9.965 -14.536 1.00 0.00 O ATOM 837 OD2 ASP A 56 17.106 9.134 -12.981 1.00 0.00 O ATOM 0 H ASP A 56 14.533 7.744 -16.463 1.00 0.00 H new ATOM 0 HA ASP A 56 17.205 8.896 -16.990 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.971 10.424 -15.600 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.249 9.127 -14.669 1.00 0.00 H new ATOM 842 N ILE A 57 18.446 7.013 -16.003 1.00 0.00 N ATOM 843 CA ILE A 57 19.312 5.987 -15.383 1.00 0.00 C ATOM 844 C ILE A 57 20.677 6.528 -14.917 1.00 0.00 C ATOM 845 O ILE A 57 21.417 5.818 -14.239 1.00 0.00 O ATOM 846 CB ILE A 57 19.527 4.770 -16.315 1.00 0.00 C ATOM 847 CG1 ILE A 57 20.284 5.131 -17.607 1.00 0.00 C ATOM 848 CG2 ILE A 57 18.204 4.038 -16.597 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.803 3.895 -18.349 1.00 0.00 C ATOM 0 H ILE A 57 18.947 7.607 -16.664 1.00 0.00 H new ATOM 0 HA ILE A 57 18.769 5.667 -14.494 1.00 0.00 H new ATOM 0 HB ILE A 57 20.174 4.075 -15.779 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.623 5.695 -18.265 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.123 5.783 -17.363 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.391 3.189 -17.254 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.777 3.683 -15.659 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.505 4.722 -17.078 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.328 4.207 -19.252 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.486 3.343 -17.703 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.964 3.255 -18.620 1.00 0.00 H new ATOM 861 N SER A 58 21.030 7.771 -15.261 1.00 0.00 N ATOM 862 CA SER A 58 22.375 8.345 -15.081 1.00 0.00 C ATOM 863 C SER A 58 22.849 8.387 -13.619 1.00 0.00 C ATOM 864 O SER A 58 24.046 8.273 -13.352 1.00 0.00 O ATOM 865 CB SER A 58 22.392 9.774 -15.646 1.00 0.00 C ATOM 866 OG SER A 58 21.719 9.828 -16.898 1.00 0.00 O ATOM 0 H SER A 58 20.373 8.426 -15.684 1.00 0.00 H new ATOM 0 HA SER A 58 23.062 7.688 -15.615 1.00 0.00 H new ATOM 0 HB2 SER A 58 21.914 10.455 -14.941 1.00 0.00 H new ATOM 0 HB3 SER A 58 23.422 10.111 -15.766 1.00 0.00 H new ATOM 0 HG SER A 58 21.739 10.746 -17.241 1.00 0.00 H new ATOM 872 N GLY A 59 21.912 8.531 -12.674 1.00 0.00 N ATOM 873 CA GLY A 59 22.174 8.536 -11.229 1.00 0.00 C ATOM 874 C GLY A 59 22.156 7.156 -10.552 1.00 0.00 C ATOM 875 O GLY A 59 22.304 7.094 -9.330 1.00 0.00 O ATOM 0 H GLY A 59 20.924 8.650 -12.899 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.147 8.995 -11.055 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.431 9.170 -10.744 1.00 0.00 H new ATOM 879 N GLN A 60 21.950 6.056 -11.289 1.00 0.00 N ATOM 880 CA GLN A 60 21.846 4.712 -10.696 1.00 0.00 C ATOM 881 C GLN A 60 23.217 4.124 -10.314 1.00 0.00 C ATOM 882 O GLN A 60 24.257 4.472 -10.881 1.00 0.00 O ATOM 883 CB GLN A 60 21.091 3.751 -11.625 1.00 0.00 C ATOM 884 CG GLN A 60 19.617 4.139 -11.813 1.00 0.00 C ATOM 885 CD GLN A 60 18.916 3.232 -12.821 1.00 0.00 C ATOM 886 OE1 GLN A 60 19.495 2.726 -13.763 1.00 0.00 O ATOM 887 NE2 GLN A 60 17.641 2.984 -12.671 1.00 0.00 N ATOM 0 H GLN A 60 21.851 6.070 -12.304 1.00 0.00 H new ATOM 0 HA GLN A 60 21.277 4.828 -9.774 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.583 3.731 -12.597 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.147 2.741 -11.219 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.101 4.084 -10.854 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.554 5.174 -12.150 1.00 0.00 H new ATOM 0 HE21 GLN A 60 17.130 3.395 -11.890 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.157 2.379 -13.335 1.00 0.00 H new ATOM 896 N THR A 61 23.192 3.182 -9.372 1.00 0.00 N ATOM 897 CA THR A 61 24.349 2.429 -8.851 1.00 0.00 C ATOM 898 C THR A 61 24.023 0.930 -8.790 1.00 0.00 C ATOM 899 O THR A 61 22.897 0.523 -9.096 1.00 0.00 O ATOM 900 CB THR A 61 24.760 2.949 -7.454 1.00 0.00 C ATOM 901 OG1 THR A 61 23.668 2.876 -6.558 1.00 0.00 O ATOM 902 CG2 THR A 61 25.244 4.400 -7.486 1.00 0.00 C ATOM 0 H THR A 61 22.320 2.903 -8.923 1.00 0.00 H new ATOM 0 HA THR A 61 25.189 2.578 -9.529 1.00 0.00 H new ATOM 0 HB THR A 61 25.580 2.312 -7.123 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.944 3.207 -5.678 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.520 4.714 -6.479 1.00 0.00 H new ATOM 0 HG22 THR A 61 26.111 4.480 -8.141 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.446 5.041 -7.860 1.00 0.00 H new ATOM 910 N SER A 62 24.996 0.084 -8.427 1.00 0.00 N ATOM 911 CA SER A 62 24.745 -1.334 -8.126 1.00 0.00 C ATOM 912 C SER A 62 25.797 -1.971 -7.203 1.00 0.00 C ATOM 913 O SER A 62 26.952 -1.545 -7.162 1.00 0.00 O ATOM 914 CB SER A 62 24.669 -2.141 -9.418 1.00 0.00 C ATOM 915 OG SER A 62 23.974 -3.356 -9.160 1.00 0.00 O ATOM 0 H SER A 62 25.974 0.359 -8.334 1.00 0.00 H new ATOM 0 HA SER A 62 23.795 -1.358 -7.593 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.155 -1.569 -10.190 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.671 -2.351 -9.791 1.00 0.00 H new ATOM 0 HG SER A 62 23.174 -3.401 -9.724 1.00 0.00 H new ATOM 921 N ASP A 63 25.391 -3.032 -6.503 1.00 0.00 N ATOM 922 CA ASP A 63 26.205 -3.880 -5.622 1.00 0.00 C ATOM 923 C ASP A 63 25.659 -5.328 -5.651 1.00 0.00 C ATOM 924 O ASP A 63 24.494 -5.518 -6.019 1.00 0.00 O ATOM 925 CB ASP A 63 26.174 -3.329 -4.186 1.00 0.00 C ATOM 926 CG ASP A 63 27.078 -2.098 -4.002 1.00 0.00 C ATOM 927 OD1 ASP A 63 28.322 -2.262 -4.000 1.00 0.00 O ATOM 928 OD2 ASP A 63 26.554 -0.975 -3.809 1.00 0.00 O ATOM 0 H ASP A 63 24.421 -3.345 -6.537 1.00 0.00 H new ATOM 0 HA ASP A 63 27.237 -3.880 -5.973 1.00 0.00 H new ATOM 0 HB2 ASP A 63 25.149 -3.064 -3.925 1.00 0.00 H new ATOM 0 HB3 ASP A 63 26.487 -4.111 -3.494 1.00 0.00 H new ATOM 933 N PRO A 64 26.452 -6.356 -5.279 1.00 0.00 N ATOM 934 CA PRO A 64 25.990 -7.747 -5.206 1.00 0.00 C ATOM 935 C PRO A 64 24.760 -7.927 -4.307 1.00 0.00 C ATOM 936 O PRO A 64 24.664 -7.299 -3.252 1.00 0.00 O ATOM 937 CB PRO A 64 27.181 -8.554 -4.678 1.00 0.00 C ATOM 938 CG PRO A 64 28.386 -7.720 -5.104 1.00 0.00 C ATOM 939 CD PRO A 64 27.873 -6.290 -4.958 1.00 0.00 C ATOM 0 HA PRO A 64 25.666 -8.086 -6.190 1.00 0.00 H new ATOM 0 HB2 PRO A 64 27.137 -8.674 -3.596 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.212 -9.555 -5.109 1.00 0.00 H new ATOM 0 HG2 PRO A 64 29.252 -7.906 -4.469 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.688 -7.939 -6.128 1.00 0.00 H new ATOM 0 HD2 PRO A 64 28.031 -5.917 -3.946 1.00 0.00 H new ATOM 0 HD3 PRO A 64 28.398 -5.613 -5.632 1.00 0.00 H new ATOM 947 N ILE A 65 23.833 -8.815 -4.681 1.00 0.00 N ATOM 948 CA ILE A 65 22.516 -8.918 -4.023 1.00 0.00 C ATOM 949 C ILE A 65 22.592 -9.241 -2.518 1.00 0.00 C ATOM 950 O ILE A 65 21.780 -8.743 -1.743 1.00 0.00 O ATOM 951 CB ILE A 65 21.600 -9.894 -4.796 1.00 0.00 C ATOM 952 CG1 ILE A 65 20.139 -9.736 -4.318 1.00 0.00 C ATOM 953 CG2 ILE A 65 22.078 -11.357 -4.707 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.123 -10.495 -5.170 1.00 0.00 C ATOM 0 H ILE A 65 23.968 -9.480 -5.442 1.00 0.00 H new ATOM 0 HA ILE A 65 22.067 -7.926 -4.062 1.00 0.00 H new ATOM 0 HB ILE A 65 21.652 -9.632 -5.853 1.00 0.00 H new ATOM 0 HG12 ILE A 65 20.065 -10.082 -3.287 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.880 -8.677 -4.318 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.397 -11.997 -5.268 1.00 0.00 H new ATOM 0 HG22 ILE A 65 23.081 -11.438 -5.126 1.00 0.00 H new ATOM 0 HG23 ILE A 65 22.095 -11.671 -3.663 1.00 0.00 H new ATOM 0 HD11 ILE A 65 18.121 -10.334 -4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.167 -10.133 -6.197 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.355 -11.560 -5.150 1.00 0.00 H new ATOM 966 N GLU A 66 23.608 -9.992 -2.079 1.00 0.00 N ATOM 967 CA GLU A 66 23.802 -10.349 -0.662 1.00 0.00 C ATOM 968 C GLU A 66 24.126 -9.143 0.249 1.00 0.00 C ATOM 969 O GLU A 66 24.020 -9.262 1.473 1.00 0.00 O ATOM 970 CB GLU A 66 24.891 -11.428 -0.530 1.00 0.00 C ATOM 971 CG GLU A 66 24.495 -12.754 -1.189 1.00 0.00 C ATOM 972 CD GLU A 66 25.531 -13.848 -0.870 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.553 -13.958 -1.590 1.00 0.00 O ATOM 974 OE2 GLU A 66 25.330 -14.613 0.106 1.00 0.00 O ATOM 0 H GLU A 66 24.325 -10.373 -2.697 1.00 0.00 H new ATOM 0 HA GLU A 66 22.846 -10.740 -0.314 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.814 -11.064 -0.982 1.00 0.00 H new ATOM 0 HB3 GLU A 66 25.100 -11.600 0.526 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.511 -13.063 -0.835 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.418 -12.621 -2.268 1.00 0.00 H new ATOM 981 N ASN A 67 24.476 -7.975 -0.314 1.00 0.00 N ATOM 982 CA ASN A 67 24.637 -6.735 0.461 1.00 0.00 C ATOM 983 C ASN A 67 23.282 -6.096 0.868 1.00 0.00 C ATOM 984 O ASN A 67 23.244 -5.293 1.803 1.00 0.00 O ATOM 985 CB ASN A 67 25.570 -5.754 -0.293 1.00 0.00 C ATOM 986 CG ASN A 67 24.819 -4.599 -0.942 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.793 -3.482 -0.445 1.00 0.00 O ATOM 988 ND2 ASN A 67 24.144 -4.843 -2.036 1.00 0.00 N ATOM 0 H ASN A 67 24.654 -7.864 -1.312 1.00 0.00 H new ATOM 0 HA ASN A 67 25.116 -6.989 1.407 1.00 0.00 H new ATOM 0 HB2 ASN A 67 26.308 -5.355 0.403 1.00 0.00 H new ATOM 0 HB3 ASN A 67 26.119 -6.300 -1.060 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.597 -4.102 -2.474 1.00 0.00 H new ATOM 0 HD22 ASN A 67 24.165 -5.774 -2.451 1.00 0.00 H new ATOM 995 N PHE A 68 22.184 -6.441 0.182 1.00 0.00 N ATOM 996 CA PHE A 68 20.843 -5.888 0.408 1.00 0.00 C ATOM 997 C PHE A 68 19.979 -6.781 1.324 1.00 0.00 C ATOM 998 O PHE A 68 20.275 -7.956 1.548 1.00 0.00 O ATOM 999 CB PHE A 68 20.157 -5.623 -0.950 1.00 0.00 C ATOM 1000 CG PHE A 68 20.876 -4.662 -1.887 1.00 0.00 C ATOM 1001 CD1 PHE A 68 21.225 -3.368 -1.458 1.00 0.00 C ATOM 1002 CD2 PHE A 68 21.175 -5.057 -3.206 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.889 -2.488 -2.331 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.840 -4.177 -4.078 1.00 0.00 C ATOM 1005 CZ PHE A 68 22.197 -2.891 -3.641 1.00 0.00 C ATOM 0 H PHE A 68 22.206 -7.133 -0.567 1.00 0.00 H new ATOM 0 HA PHE A 68 20.952 -4.942 0.939 1.00 0.00 H new ATOM 0 HB2 PHE A 68 20.034 -6.576 -1.464 1.00 0.00 H new ATOM 0 HB3 PHE A 68 19.157 -5.233 -0.759 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.982 -3.050 -0.455 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.892 -6.041 -3.549 1.00 0.00 H new ATOM 0 HE1 PHE A 68 22.163 -1.499 -1.993 1.00 0.00 H new ATOM 0 HE2 PHE A 68 22.076 -4.490 -5.084 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.707 -2.214 -4.310 1.00 0.00 H new ATOM 1015 N ASN A 69 18.883 -6.209 1.840 1.00 0.00 N ATOM 1016 CA ASN A 69 17.913 -6.859 2.736 1.00 0.00 C ATOM 1017 C ASN A 69 16.544 -7.028 2.052 1.00 0.00 C ATOM 1018 O ASN A 69 15.821 -6.055 1.850 1.00 0.00 O ATOM 1019 CB ASN A 69 17.831 -6.066 4.065 1.00 0.00 C ATOM 1020 CG ASN A 69 17.880 -4.542 3.942 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.688 -3.874 4.571 1.00 0.00 O ATOM 1022 ND2 ASN A 69 17.041 -3.938 3.128 1.00 0.00 N ATOM 0 H ASN A 69 18.636 -5.240 1.637 1.00 0.00 H new ATOM 0 HA ASN A 69 18.252 -7.868 2.970 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.906 -6.340 4.572 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.652 -6.385 4.707 1.00 0.00 H new ATOM 0 HD21 ASN A 69 17.069 -2.923 3.027 1.00 0.00 H new ATOM 0 HD22 ASN A 69 16.362 -4.484 2.598 1.00 0.00 H new ATOM 1029 N ALA A 70 16.150 -8.256 1.718 1.00 0.00 N ATOM 1030 CA ALA A 70 14.980 -8.535 0.881 1.00 0.00 C ATOM 1031 C ALA A 70 13.631 -8.167 1.521 1.00 0.00 C ATOM 1032 O ALA A 70 12.647 -7.945 0.815 1.00 0.00 O ATOM 1033 CB ALA A 70 15.014 -10.018 0.555 1.00 0.00 C ATOM 0 H ALA A 70 16.639 -9.097 2.024 1.00 0.00 H new ATOM 0 HA ALA A 70 15.045 -7.907 -0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 70 14.158 -10.273 -0.069 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.935 -10.252 0.021 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.974 -10.595 1.479 1.00 0.00 H new ATOM 1039 N ASP A 71 13.585 -8.077 2.852 1.00 0.00 N ATOM 1040 CA ASP A 71 12.370 -7.782 3.631 1.00 0.00 C ATOM 1041 C ASP A 71 11.792 -6.387 3.331 1.00 0.00 C ATOM 1042 O ASP A 71 10.593 -6.142 3.484 1.00 0.00 O ATOM 1043 CB ASP A 71 12.738 -7.850 5.117 1.00 0.00 C ATOM 1044 CG ASP A 71 11.501 -7.754 6.027 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.650 -8.676 5.986 1.00 0.00 O ATOM 1046 OD2 ASP A 71 11.391 -6.778 6.809 1.00 0.00 O ATOM 0 H ASP A 71 14.410 -8.210 3.437 1.00 0.00 H new ATOM 0 HA ASP A 71 11.608 -8.513 3.359 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.263 -8.784 5.317 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.427 -7.040 5.356 1.00 0.00 H new ATOM 1051 N ASP A 72 12.662 -5.479 2.886 1.00 0.00 N ATOM 1052 CA ASP A 72 12.360 -4.090 2.561 1.00 0.00 C ATOM 1053 C ASP A 72 11.926 -3.919 1.090 1.00 0.00 C ATOM 1054 O ASP A 72 11.562 -2.818 0.678 1.00 0.00 O ATOM 1055 CB ASP A 72 13.602 -3.265 2.916 1.00 0.00 C ATOM 1056 CG ASP A 72 13.350 -1.750 2.882 1.00 0.00 C ATOM 1057 OD1 ASP A 72 12.478 -1.254 3.636 1.00 0.00 O ATOM 1058 OD2 ASP A 72 14.058 -1.037 2.133 1.00 0.00 O ATOM 0 H ASP A 72 13.645 -5.707 2.736 1.00 0.00 H new ATOM 0 HA ASP A 72 11.506 -3.738 3.140 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.946 -3.548 3.911 1.00 0.00 H new ATOM 0 HB3 ASP A 72 14.404 -3.509 2.220 1.00 0.00 H new ATOM 1063 N TYR A 73 11.944 -5.012 0.312 1.00 0.00 N ATOM 1064 CA TYR A 73 11.479 -5.113 -1.065 1.00 0.00 C ATOM 1065 C TYR A 73 10.304 -6.084 -1.107 1.00 0.00 C ATOM 1066 O TYR A 73 10.460 -7.270 -1.393 1.00 0.00 O ATOM 1067 CB TYR A 73 12.632 -5.526 -1.986 1.00 0.00 C ATOM 1068 CG TYR A 73 13.828 -4.609 -1.865 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.891 -3.418 -2.604 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.836 -4.913 -0.939 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.969 -2.536 -2.410 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.916 -4.035 -0.739 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.985 -2.832 -1.477 1.00 0.00 C ATOM 1074 OH TYR A 73 17.019 -1.962 -1.303 1.00 0.00 O ATOM 0 H TYR A 73 12.308 -5.900 0.657 1.00 0.00 H new ATOM 0 HA TYR A 73 11.131 -4.147 -1.431 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.935 -6.546 -1.748 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.284 -5.529 -3.019 1.00 0.00 H new ATOM 0 HD1 TYR A 73 13.116 -3.180 -3.318 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.782 -5.831 -0.373 1.00 0.00 H new ATOM 0 HE1 TYR A 73 15.020 -1.621 -2.982 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.689 -4.279 -0.025 1.00 0.00 H new ATOM 0 HH TYR A 73 17.632 -2.314 -0.624 1.00 0.00 H new ATOM 1084 N ASP A 74 9.118 -5.575 -0.776 1.00 0.00 N ATOM 1085 CA ASP A 74 7.847 -6.314 -0.727 1.00 0.00 C ATOM 1086 C ASP A 74 7.526 -7.051 -2.041 1.00 0.00 C ATOM 1087 O ASP A 74 6.789 -8.035 -2.044 1.00 0.00 O ATOM 1088 CB ASP A 74 6.696 -5.333 -0.446 1.00 0.00 C ATOM 1089 CG ASP A 74 7.044 -4.276 0.614 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.744 -3.306 0.239 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.614 -4.412 1.785 1.00 0.00 O ATOM 0 H ASP A 74 9.007 -4.593 -0.523 1.00 0.00 H new ATOM 0 HA ASP A 74 7.951 -7.057 0.063 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.421 -4.831 -1.374 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.822 -5.894 -0.116 1.00 0.00 H new ATOM 1096 N VAL A 75 8.065 -6.560 -3.163 1.00 0.00 N ATOM 1097 CA VAL A 75 7.830 -7.054 -4.519 1.00 0.00 C ATOM 1098 C VAL A 75 9.179 -7.199 -5.242 1.00 0.00 C ATOM 1099 O VAL A 75 9.993 -6.276 -5.233 1.00 0.00 O ATOM 1100 CB VAL A 75 6.847 -6.099 -5.230 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.653 -6.481 -6.702 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.473 -6.110 -4.547 1.00 0.00 C ATOM 0 H VAL A 75 8.708 -5.768 -3.146 1.00 0.00 H new ATOM 0 HA VAL A 75 7.370 -8.042 -4.515 1.00 0.00 H new ATOM 0 HB VAL A 75 7.286 -5.103 -5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.955 -5.786 -7.169 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.611 -6.435 -7.219 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.255 -7.494 -6.766 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.802 -5.428 -5.069 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.060 -7.119 -4.576 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.580 -5.791 -3.510 1.00 0.00 H new ATOM 1112 N VAL A 76 9.449 -8.356 -5.860 1.00 0.00 N ATOM 1113 CA VAL A 76 10.760 -8.669 -6.476 1.00 0.00 C ATOM 1114 C VAL A 76 10.573 -9.266 -7.875 1.00 0.00 C ATOM 1115 O VAL A 76 9.944 -10.309 -8.031 1.00 0.00 O ATOM 1116 CB VAL A 76 11.589 -9.606 -5.566 1.00 0.00 C ATOM 1117 CG1 VAL A 76 12.882 -10.088 -6.243 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.020 -8.919 -4.258 1.00 0.00 C ATOM 0 H VAL A 76 8.767 -9.109 -5.951 1.00 0.00 H new ATOM 0 HA VAL A 76 11.318 -7.739 -6.584 1.00 0.00 H new ATOM 0 HB VAL A 76 10.924 -10.445 -5.363 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.427 -10.742 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.634 -10.636 -7.152 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.503 -9.228 -6.495 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.599 -9.617 -3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.631 -8.047 -4.489 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.136 -8.606 -3.703 1.00 0.00 H new ATOM 1128 N ILE A 77 11.129 -8.611 -8.896 1.00 0.00 N ATOM 1129 CA ILE A 77 11.067 -9.029 -10.306 1.00 0.00 C ATOM 1130 C ILE A 77 12.474 -9.452 -10.741 1.00 0.00 C ATOM 1131 O ILE A 77 13.400 -8.644 -10.700 1.00 0.00 O ATOM 1132 CB ILE A 77 10.526 -7.869 -11.195 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.005 -7.556 -11.137 1.00 0.00 C ATOM 1134 CG2 ILE A 77 10.849 -8.094 -12.686 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.274 -7.859 -9.830 1.00 0.00 C ATOM 0 H ILE A 77 11.653 -7.746 -8.764 1.00 0.00 H new ATOM 0 HA ILE A 77 10.382 -9.869 -10.422 1.00 0.00 H new ATOM 0 HB ILE A 77 11.046 -7.020 -10.752 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.870 -6.498 -11.361 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.515 -8.115 -11.934 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.455 -7.264 -13.273 1.00 0.00 H new ATOM 0 HG22 ILE A 77 11.929 -8.153 -12.819 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.391 -9.025 -13.021 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.222 -7.592 -9.931 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.359 -8.922 -9.604 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.719 -7.279 -9.021 1.00 0.00 H new ATOM 1147 N SER A 78 12.641 -10.699 -11.172 1.00 0.00 N ATOM 1148 CA SER A 78 13.849 -11.190 -11.834 1.00 0.00 C ATOM 1149 C SER A 78 13.767 -10.905 -13.337 1.00 0.00 C ATOM 1150 O SER A 78 12.681 -10.854 -13.909 1.00 0.00 O ATOM 1151 CB SER A 78 14.029 -12.684 -11.570 1.00 0.00 C ATOM 1152 OG SER A 78 15.247 -13.114 -12.147 1.00 0.00 O ATOM 0 H SER A 78 11.922 -11.416 -11.069 1.00 0.00 H new ATOM 0 HA SER A 78 14.717 -10.670 -11.429 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.032 -12.878 -10.497 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.195 -13.244 -11.993 1.00 0.00 H new ATOM 0 HG SER A 78 15.368 -14.072 -11.979 1.00 0.00 H new ATOM 1158 N LEU A 79 14.911 -10.706 -13.988 1.00 0.00 N ATOM 1159 CA LEU A 79 15.031 -10.482 -15.433 1.00 0.00 C ATOM 1160 C LEU A 79 16.071 -11.437 -16.042 1.00 0.00 C ATOM 1161 O LEU A 79 16.947 -11.017 -16.798 1.00 0.00 O ATOM 1162 CB LEU A 79 15.310 -8.991 -15.734 1.00 0.00 C ATOM 1163 CG LEU A 79 14.257 -8.002 -15.192 1.00 0.00 C ATOM 1164 CD1 LEU A 79 14.622 -7.468 -13.805 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.168 -6.778 -16.095 1.00 0.00 C ATOM 0 H LEU A 79 15.812 -10.695 -13.511 1.00 0.00 H new ATOM 0 HA LEU A 79 14.082 -10.715 -15.916 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.281 -8.728 -15.315 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.383 -8.863 -16.814 1.00 0.00 H new ATOM 0 HG LEU A 79 13.320 -8.557 -15.151 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.851 -6.776 -13.467 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.697 -8.299 -13.103 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.579 -6.948 -13.855 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.421 -6.089 -15.701 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.138 -6.281 -16.131 1.00 0.00 H new ATOM 0 HD23 LEU A 79 13.881 -7.087 -17.100 1.00 0.00 H new ATOM 1177 N CYS A 80 16.018 -12.709 -15.638 1.00 0.00 N ATOM 1178 CA CYS A 80 17.042 -13.715 -15.937 1.00 0.00 C ATOM 1179 C CYS A 80 16.556 -14.857 -16.850 1.00 0.00 C ATOM 1180 O CYS A 80 17.380 -15.613 -17.367 1.00 0.00 O ATOM 1181 CB CYS A 80 17.585 -14.261 -14.606 1.00 0.00 C ATOM 1182 SG CYS A 80 18.164 -12.901 -13.543 1.00 0.00 S ATOM 0 H CYS A 80 15.246 -13.077 -15.082 1.00 0.00 H new ATOM 0 HA CYS A 80 17.831 -13.225 -16.507 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.805 -14.824 -14.093 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.404 -14.954 -14.798 1.00 0.00 H new ATOM 0 HG CYS A 80 17.220 -12.565 -12.715 1.00 0.00 H new ATOM 1188 N GLY A 81 15.243 -14.998 -17.062 1.00 0.00 N ATOM 1189 CA GLY A 81 14.639 -16.099 -17.822 1.00 0.00 C ATOM 1190 C GLY A 81 14.601 -17.442 -17.067 1.00 0.00 C ATOM 1191 O GLY A 81 14.387 -18.489 -17.683 1.00 0.00 O ATOM 0 H GLY A 81 14.555 -14.336 -16.702 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.622 -15.821 -18.097 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.195 -16.232 -18.750 1.00 0.00 H new ATOM 1195 N CYS A 82 14.843 -17.422 -15.755 1.00 0.00 N ATOM 1196 CA CYS A 82 14.838 -18.563 -14.837 1.00 0.00 C ATOM 1197 C CYS A 82 14.595 -18.093 -13.385 1.00 0.00 C ATOM 1198 O CYS A 82 14.636 -16.895 -13.093 1.00 0.00 O ATOM 1199 CB CYS A 82 16.174 -19.325 -14.982 1.00 0.00 C ATOM 1200 SG CYS A 82 17.594 -18.286 -14.512 1.00 0.00 S ATOM 0 H CYS A 82 15.062 -16.550 -15.273 1.00 0.00 H new ATOM 0 HA CYS A 82 14.022 -19.240 -15.088 1.00 0.00 H new ATOM 0 HB2 CYS A 82 16.154 -20.218 -14.357 1.00 0.00 H new ATOM 0 HB3 CYS A 82 16.293 -19.659 -16.013 1.00 0.00 H new ATOM 0 HG CYS A 82 18.693 -18.967 -14.647 1.00 0.00 H new ATOM 1206 N GLY A 83 14.391 -19.036 -12.455 1.00 0.00 N ATOM 1207 CA GLY A 83 14.259 -18.733 -11.019 1.00 0.00 C ATOM 1208 C GLY A 83 15.496 -18.034 -10.419 1.00 0.00 C ATOM 1209 O GLY A 83 15.349 -17.221 -9.507 1.00 0.00 O ATOM 0 H GLY A 83 14.313 -20.029 -12.674 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.385 -18.099 -10.869 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.077 -19.660 -10.476 1.00 0.00 H new ATOM 1213 N VAL A 84 16.680 -18.305 -10.996 1.00 0.00 N ATOM 1214 CA VAL A 84 18.009 -17.710 -10.744 1.00 0.00 C ATOM 1215 C VAL A 84 18.552 -17.895 -9.316 1.00 0.00 C ATOM 1216 O VAL A 84 17.825 -18.239 -8.383 1.00 0.00 O ATOM 1217 CB VAL A 84 18.109 -16.272 -11.323 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.830 -15.128 -10.336 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.487 -16.042 -11.962 1.00 0.00 C ATOM 0 H VAL A 84 16.738 -19.017 -11.724 1.00 0.00 H new ATOM 0 HA VAL A 84 18.722 -18.306 -11.313 1.00 0.00 H new ATOM 0 HB VAL A 84 17.307 -16.233 -12.061 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.928 -14.172 -10.850 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.818 -15.226 -9.942 1.00 0.00 H new ATOM 0 HG13 VAL A 84 18.545 -15.174 -9.515 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.538 -15.029 -12.362 1.00 0.00 H new ATOM 0 HG22 VAL A 84 20.264 -16.174 -11.209 1.00 0.00 H new ATOM 0 HG23 VAL A 84 19.638 -16.759 -12.769 1.00 0.00 H new ATOM 1229 N ASN A 85 19.870 -17.731 -9.139 1.00 0.00 N ATOM 1230 CA ASN A 85 20.528 -17.907 -7.845 1.00 0.00 C ATOM 1231 C ASN A 85 20.137 -16.761 -6.891 1.00 0.00 C ATOM 1232 O ASN A 85 20.557 -15.617 -7.083 1.00 0.00 O ATOM 1233 CB ASN A 85 22.050 -18.013 -8.066 1.00 0.00 C ATOM 1234 CG ASN A 85 22.831 -18.302 -6.787 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.283 -18.544 -5.720 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.144 -18.301 -6.858 1.00 0.00 N ATOM 0 H ASN A 85 20.507 -17.472 -9.892 1.00 0.00 H new ATOM 0 HA ASN A 85 20.198 -18.831 -7.369 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.250 -18.802 -8.791 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.412 -17.081 -8.501 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.700 -18.501 -6.027 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.607 -18.100 -7.745 1.00 0.00 H new ATOM 1243 N LEU A 86 19.319 -17.070 -5.880 1.00 0.00 N ATOM 1244 CA LEU A 86 18.762 -16.116 -4.917 1.00 0.00 C ATOM 1245 C LEU A 86 18.747 -16.711 -3.494 1.00 0.00 C ATOM 1246 O LEU A 86 18.289 -17.849 -3.326 1.00 0.00 O ATOM 1247 CB LEU A 86 17.311 -15.767 -5.314 1.00 0.00 C ATOM 1248 CG LEU A 86 17.120 -14.883 -6.557 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.624 -14.686 -6.816 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.733 -13.494 -6.381 1.00 0.00 C ATOM 0 H LEU A 86 19.015 -18.028 -5.704 1.00 0.00 H new ATOM 0 HA LEU A 86 19.388 -15.224 -4.926 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.771 -16.700 -5.476 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.839 -15.268 -4.468 1.00 0.00 H new ATOM 0 HG LEU A 86 17.616 -15.390 -7.385 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.487 -14.059 -7.697 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.153 -15.655 -6.983 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.166 -14.204 -5.953 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.572 -12.908 -7.286 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.262 -12.993 -5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.803 -13.589 -6.196 1.00 0.00 H new ATOM 1262 N PRO A 87 19.190 -15.960 -2.463 1.00 0.00 N ATOM 1263 CA PRO A 87 18.991 -16.353 -1.067 1.00 0.00 C ATOM 1264 C PRO A 87 17.483 -16.468 -0.754 1.00 0.00 C ATOM 1265 O PRO A 87 16.684 -15.749 -1.362 1.00 0.00 O ATOM 1266 CB PRO A 87 19.694 -15.283 -0.222 1.00 0.00 C ATOM 1267 CG PRO A 87 20.725 -14.677 -1.179 1.00 0.00 C ATOM 1268 CD PRO A 87 20.058 -14.793 -2.550 1.00 0.00 C ATOM 0 HA PRO A 87 19.412 -17.334 -0.847 1.00 0.00 H new ATOM 0 HB2 PRO A 87 18.991 -14.531 0.136 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.171 -15.717 0.657 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.944 -13.640 -0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.670 -15.220 -1.146 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.486 -13.895 -2.786 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.801 -14.914 -3.339 1.00 0.00 H new ATOM 1276 N PRO A 88 17.059 -17.309 0.210 1.00 0.00 N ATOM 1277 CA PRO A 88 15.643 -17.640 0.418 1.00 0.00 C ATOM 1278 C PRO A 88 14.747 -16.447 0.794 1.00 0.00 C ATOM 1279 O PRO A 88 13.543 -16.469 0.538 1.00 0.00 O ATOM 1280 CB PRO A 88 15.635 -18.733 1.497 1.00 0.00 C ATOM 1281 CG PRO A 88 16.960 -18.538 2.232 1.00 0.00 C ATOM 1282 CD PRO A 88 17.899 -18.078 1.118 1.00 0.00 C ATOM 0 HA PRO A 88 15.204 -17.977 -0.521 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.785 -18.622 2.171 1.00 0.00 H new ATOM 0 HB3 PRO A 88 15.566 -19.728 1.057 1.00 0.00 H new ATOM 0 HG2 PRO A 88 16.877 -17.794 3.025 1.00 0.00 H new ATOM 0 HG3 PRO A 88 17.305 -19.462 2.696 1.00 0.00 H new ATOM 0 HD2 PRO A 88 18.712 -17.470 1.514 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.355 -18.928 0.610 1.00 0.00 H new ATOM 1290 N GLU A 89 15.319 -15.362 1.327 1.00 0.00 N ATOM 1291 CA GLU A 89 14.581 -14.126 1.619 1.00 0.00 C ATOM 1292 C GLU A 89 14.145 -13.331 0.367 1.00 0.00 C ATOM 1293 O GLU A 89 13.255 -12.491 0.473 1.00 0.00 O ATOM 1294 CB GLU A 89 15.365 -13.269 2.623 1.00 0.00 C ATOM 1295 CG GLU A 89 16.751 -12.818 2.135 1.00 0.00 C ATOM 1296 CD GLU A 89 17.405 -11.846 3.142 1.00 0.00 C ATOM 1297 OE1 GLU A 89 18.048 -12.326 4.111 1.00 0.00 O ATOM 1298 OE2 GLU A 89 17.284 -10.606 2.973 1.00 0.00 O ATOM 0 H GLU A 89 16.309 -15.315 1.569 1.00 0.00 H new ATOM 0 HA GLU A 89 13.638 -14.424 2.077 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.775 -12.385 2.865 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.486 -13.835 3.547 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.392 -13.688 1.996 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.658 -12.332 1.164 1.00 0.00 H new ATOM 1305 N TRP A 90 14.702 -13.605 -0.823 1.00 0.00 N ATOM 1306 CA TRP A 90 14.350 -12.931 -2.091 1.00 0.00 C ATOM 1307 C TRP A 90 13.216 -13.601 -2.890 1.00 0.00 C ATOM 1308 O TRP A 90 12.826 -13.093 -3.941 1.00 0.00 O ATOM 1309 CB TRP A 90 15.612 -12.758 -2.948 1.00 0.00 C ATOM 1310 CG TRP A 90 16.596 -11.781 -2.395 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.672 -12.090 -1.635 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.553 -10.324 -2.450 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.302 -10.931 -1.230 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.625 -9.814 -1.661 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.669 -9.386 -3.025 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.775 -8.447 -1.399 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.822 -8.008 -2.781 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.855 -7.539 -1.950 1.00 0.00 C ATOM 0 H TRP A 90 15.425 -14.315 -0.937 1.00 0.00 H new ATOM 0 HA TRP A 90 13.945 -11.957 -1.817 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.100 -13.727 -3.056 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.318 -12.435 -3.947 1.00 0.00 H new ATOM 0 HD1 TRP A 90 17.989 -13.091 -1.384 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.161 -10.906 -0.681 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.866 -9.729 -3.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.588 -8.095 -0.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.140 -7.305 -3.236 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.941 -6.484 -1.736 1.00 0.00 H new ATOM 1329 N VAL A 91 12.699 -14.745 -2.419 1.00 0.00 N ATOM 1330 CA VAL A 91 11.696 -15.589 -3.115 1.00 0.00 C ATOM 1331 C VAL A 91 10.422 -15.850 -2.284 1.00 0.00 C ATOM 1332 O VAL A 91 9.623 -16.729 -2.608 1.00 0.00 O ATOM 1333 CB VAL A 91 12.332 -16.913 -3.594 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.416 -16.664 -4.650 1.00 0.00 C ATOM 1335 CG2 VAL A 91 12.956 -17.693 -2.430 1.00 0.00 C ATOM 0 H VAL A 91 12.972 -15.128 -1.514 1.00 0.00 H new ATOM 0 HA VAL A 91 11.369 -15.019 -3.985 1.00 0.00 H new ATOM 0 HB VAL A 91 11.525 -17.500 -4.031 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.843 -17.616 -4.965 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.976 -16.161 -5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.201 -16.038 -4.225 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.393 -18.618 -2.805 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.732 -17.088 -1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.186 -17.928 -1.695 1.00 0.00 H new ATOM 1345 N THR A 92 10.231 -15.090 -1.201 1.00 0.00 N ATOM 1346 CA THR A 92 9.186 -15.276 -0.167 1.00 0.00 C ATOM 1347 C THR A 92 8.214 -14.074 -0.074 1.00 0.00 C ATOM 1348 O THR A 92 7.244 -14.076 0.686 1.00 0.00 O ATOM 1349 CB THR A 92 9.872 -15.644 1.170 1.00 0.00 C ATOM 1350 OG1 THR A 92 8.965 -15.921 2.219 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.831 -14.557 1.641 1.00 0.00 C ATOM 0 H THR A 92 10.827 -14.286 -1.004 1.00 0.00 H new ATOM 0 HA THR A 92 8.536 -16.104 -0.450 1.00 0.00 H new ATOM 0 HB THR A 92 10.423 -16.557 0.944 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.110 -15.477 2.038 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.289 -14.859 2.583 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.608 -14.407 0.891 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.283 -13.626 1.786 1.00 0.00 H new ATOM 1359 N GLN A 93 8.458 -13.050 -0.898 1.00 0.00 N ATOM 1360 CA GLN A 93 7.672 -11.826 -1.095 1.00 0.00 C ATOM 1361 C GLN A 93 6.205 -12.083 -1.483 1.00 0.00 C ATOM 1362 O GLN A 93 5.861 -13.140 -2.018 1.00 0.00 O ATOM 1363 CB GLN A 93 8.356 -11.004 -2.206 1.00 0.00 C ATOM 1364 CG GLN A 93 9.536 -10.158 -1.700 1.00 0.00 C ATOM 1365 CD GLN A 93 10.790 -10.939 -1.301 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.952 -12.118 -1.590 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.730 -10.333 -0.614 1.00 0.00 N ATOM 0 H GLN A 93 9.283 -13.056 -1.497 1.00 0.00 H new ATOM 0 HA GLN A 93 7.643 -11.295 -0.143 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.711 -11.681 -2.983 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.619 -10.347 -2.668 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.807 -9.444 -2.478 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.201 -9.579 -0.839 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.623 -9.351 -0.359 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.568 -10.844 -0.335 1.00 0.00 H new ATOM 1376 N GLU A 94 5.339 -11.081 -1.273 1.00 0.00 N ATOM 1377 CA GLU A 94 3.916 -11.180 -1.637 1.00 0.00 C ATOM 1378 C GLU A 94 3.688 -11.296 -3.156 1.00 0.00 C ATOM 1379 O GLU A 94 2.786 -12.020 -3.583 1.00 0.00 O ATOM 1380 CB GLU A 94 3.097 -10.026 -1.034 1.00 0.00 C ATOM 1381 CG GLU A 94 3.536 -8.601 -1.401 1.00 0.00 C ATOM 1382 CD GLU A 94 2.508 -7.581 -0.875 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.639 -7.122 0.287 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.553 -7.237 -1.614 1.00 0.00 O ATOM 0 H GLU A 94 5.599 -10.189 -0.852 1.00 0.00 H new ATOM 0 HA GLU A 94 3.557 -12.112 -1.201 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.058 -10.151 -1.339 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.124 -10.121 0.052 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.518 -8.393 -0.975 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.632 -8.508 -2.483 1.00 0.00 H new ATOM 1391 N ILE A 95 4.521 -10.625 -3.965 1.00 0.00 N ATOM 1392 CA ILE A 95 4.502 -10.720 -5.436 1.00 0.00 C ATOM 1393 C ILE A 95 5.927 -10.911 -5.978 1.00 0.00 C ATOM 1394 O ILE A 95 6.839 -10.141 -5.658 1.00 0.00 O ATOM 1395 CB ILE A 95 3.775 -9.502 -6.066 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.332 -9.386 -5.515 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.763 -9.597 -7.607 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.547 -8.163 -5.991 1.00 0.00 C ATOM 0 H ILE A 95 5.238 -9.991 -3.613 1.00 0.00 H new ATOM 0 HA ILE A 95 3.929 -11.600 -5.727 1.00 0.00 H new ATOM 0 HB ILE A 95 4.324 -8.602 -5.790 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.780 -10.283 -5.796 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.377 -9.367 -4.426 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.247 -8.731 -8.021 1.00 0.00 H new ATOM 0 HG22 ILE A 95 4.788 -9.621 -7.978 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.246 -10.507 -7.911 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.551 -8.175 -5.549 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.068 -7.255 -5.687 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.462 -8.185 -7.077 1.00 0.00 H new ATOM 1410 N PHE A 96 6.102 -11.924 -6.830 1.00 0.00 N ATOM 1411 CA PHE A 96 7.357 -12.254 -7.511 1.00 0.00 C ATOM 1412 C PHE A 96 7.138 -12.451 -9.022 1.00 0.00 C ATOM 1413 O PHE A 96 6.080 -12.927 -9.442 1.00 0.00 O ATOM 1414 CB PHE A 96 7.987 -13.493 -6.857 1.00 0.00 C ATOM 1415 CG PHE A 96 9.386 -13.833 -7.343 1.00 0.00 C ATOM 1416 CD1 PHE A 96 9.575 -14.635 -8.488 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.513 -13.348 -6.651 1.00 0.00 C ATOM 1418 CE1 PHE A 96 10.872 -14.940 -8.939 1.00 0.00 C ATOM 1419 CE2 PHE A 96 11.810 -13.657 -7.101 1.00 0.00 C ATOM 1420 CZ PHE A 96 11.992 -14.452 -8.246 1.00 0.00 C ATOM 0 H PHE A 96 5.344 -12.562 -7.074 1.00 0.00 H new ATOM 0 HA PHE A 96 8.050 -11.419 -7.404 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.021 -13.339 -5.778 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.338 -14.350 -7.036 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.718 -15.018 -9.022 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.381 -12.736 -5.771 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.007 -15.550 -9.820 1.00 0.00 H new ATOM 0 HE2 PHE A 96 12.669 -13.282 -6.565 1.00 0.00 H new ATOM 0 HZ PHE A 96 12.988 -14.686 -8.591 1.00 0.00 H new ATOM 1430 N GLU A 97 8.136 -12.117 -9.841 1.00 0.00 N ATOM 1431 CA GLU A 97 8.127 -12.316 -11.301 1.00 0.00 C ATOM 1432 C GLU A 97 9.501 -12.743 -11.847 1.00 0.00 C ATOM 1433 O GLU A 97 10.532 -12.522 -11.214 1.00 0.00 O ATOM 1434 CB GLU A 97 7.757 -11.011 -12.031 1.00 0.00 C ATOM 1435 CG GLU A 97 6.362 -10.421 -11.778 1.00 0.00 C ATOM 1436 CD GLU A 97 5.203 -11.329 -12.239 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.407 -12.275 -13.038 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.047 -11.043 -11.849 1.00 0.00 O ATOM 0 H GLU A 97 8.998 -11.689 -9.504 1.00 0.00 H new ATOM 0 HA GLU A 97 7.393 -13.101 -11.482 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.495 -10.255 -11.761 1.00 0.00 H new ATOM 0 HB3 GLU A 97 7.858 -11.186 -13.102 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.251 -10.221 -10.712 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.286 -9.463 -12.292 1.00 0.00 H new ATOM 1445 N ASP A 98 9.510 -13.302 -13.058 1.00 0.00 N ATOM 1446 CA ASP A 98 10.717 -13.559 -13.855 1.00 0.00 C ATOM 1447 C ASP A 98 10.448 -13.166 -15.316 1.00 0.00 C ATOM 1448 O ASP A 98 9.483 -13.639 -15.928 1.00 0.00 O ATOM 1449 CB ASP A 98 11.197 -15.009 -13.758 1.00 0.00 C ATOM 1450 CG ASP A 98 12.263 -15.281 -14.839 1.00 0.00 C ATOM 1451 OD1 ASP A 98 13.298 -14.570 -14.861 1.00 0.00 O ATOM 1452 OD2 ASP A 98 12.018 -16.165 -15.698 1.00 0.00 O ATOM 0 H ASP A 98 8.654 -13.598 -13.528 1.00 0.00 H new ATOM 0 HA ASP A 98 11.523 -12.949 -13.448 1.00 0.00 H new ATOM 0 HB2 ASP A 98 11.613 -15.198 -12.768 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.355 -15.690 -13.885 1.00 0.00 H new ATOM 1457 N TRP A 99 11.285 -12.283 -15.862 1.00 0.00 N ATOM 1458 CA TRP A 99 11.178 -11.705 -17.201 1.00 0.00 C ATOM 1459 C TRP A 99 12.292 -12.202 -18.147 1.00 0.00 C ATOM 1460 O TRP A 99 13.346 -12.659 -17.711 1.00 0.00 O ATOM 1461 CB TRP A 99 11.100 -10.175 -17.090 1.00 0.00 C ATOM 1462 CG TRP A 99 9.959 -9.558 -16.320 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.867 -10.192 -15.825 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.772 -8.148 -15.981 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.047 -9.285 -15.183 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.549 -8.013 -15.262 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.495 -6.957 -16.231 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.074 -6.781 -14.805 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.023 -5.706 -15.784 1.00 0.00 C ATOM 1470 CH2 TRP A 99 8.813 -5.619 -15.075 1.00 0.00 C ATOM 0 H TRP A 99 12.098 -11.934 -15.355 1.00 0.00 H new ATOM 0 HA TRP A 99 10.255 -12.051 -17.666 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.029 -9.830 -16.636 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.071 -9.772 -18.102 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.668 -11.249 -15.919 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.178 -9.531 -14.710 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.427 -7.008 -16.775 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.149 -6.724 -14.250 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.593 -4.812 -15.987 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.452 -4.659 -14.738 1.00 0.00 H new ATOM 1481 N GLN A 100 12.068 -12.072 -19.464 1.00 0.00 N ATOM 1482 CA GLN A 100 12.874 -12.693 -20.537 1.00 0.00 C ATOM 1483 C GLN A 100 13.446 -11.649 -21.520 1.00 0.00 C ATOM 1484 O GLN A 100 13.254 -11.739 -22.733 1.00 0.00 O ATOM 1485 CB GLN A 100 12.017 -13.768 -21.253 1.00 0.00 C ATOM 1486 CG GLN A 100 11.480 -14.912 -20.369 1.00 0.00 C ATOM 1487 CD GLN A 100 10.346 -14.519 -19.414 1.00 0.00 C ATOM 1488 OE1 GLN A 100 9.530 -13.643 -19.678 1.00 0.00 O ATOM 1489 NE2 GLN A 100 10.284 -15.100 -18.238 1.00 0.00 N ATOM 0 H GLN A 100 11.296 -11.514 -19.828 1.00 0.00 H new ATOM 0 HA GLN A 100 13.744 -13.175 -20.091 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.168 -13.272 -21.724 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.614 -14.205 -22.053 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.127 -15.715 -21.016 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.305 -15.315 -19.782 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.952 -15.832 -17.995 1.00 0.00 H new ATOM 0 HE22 GLN A 100 9.568 -14.820 -17.568 1.00 0.00 H new ATOM 1498 N LEU A 101 14.097 -10.603 -20.996 1.00 0.00 N ATOM 1499 CA LEU A 101 14.560 -9.458 -21.795 1.00 0.00 C ATOM 1500 C LEU A 101 15.872 -9.747 -22.536 1.00 0.00 C ATOM 1501 O LEU A 101 16.833 -10.253 -21.951 1.00 0.00 O ATOM 1502 CB LEU A 101 14.739 -8.206 -20.906 1.00 0.00 C ATOM 1503 CG LEU A 101 13.492 -7.452 -20.442 1.00 0.00 C ATOM 1504 CD1 LEU A 101 12.622 -6.970 -21.598 1.00 0.00 C ATOM 1505 CD2 LEU A 101 12.627 -8.278 -19.512 1.00 0.00 C ATOM 0 H LEU A 101 14.319 -10.525 -20.003 1.00 0.00 H new ATOM 0 HA LEU A 101 13.788 -9.273 -22.542 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.293 -8.508 -20.017 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.368 -7.501 -21.450 1.00 0.00 H new ATOM 0 HG LEU A 101 13.883 -6.587 -19.906 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.753 -6.443 -21.204 1.00 0.00 H new ATOM 0 HD12 LEU A 101 13.199 -6.296 -22.231 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.291 -7.826 -22.186 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.756 -7.696 -19.213 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.300 -9.182 -20.026 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.202 -8.551 -18.627 1.00 0.00 H new ATOM 1517 N GLU A 102 15.941 -9.317 -23.797 1.00 0.00 N ATOM 1518 CA GLU A 102 17.160 -9.290 -24.606 1.00 0.00 C ATOM 1519 C GLU A 102 18.105 -8.230 -24.029 1.00 0.00 C ATOM 1520 O GLU A 102 17.674 -7.192 -23.529 1.00 0.00 O ATOM 1521 CB GLU A 102 16.887 -8.973 -26.099 1.00 0.00 C ATOM 1522 CG GLU A 102 15.453 -9.228 -26.600 1.00 0.00 C ATOM 1523 CD GLU A 102 15.249 -8.690 -28.029 1.00 0.00 C ATOM 1524 OE1 GLU A 102 15.774 -9.300 -28.995 1.00 0.00 O ATOM 1525 OE2 GLU A 102 14.537 -7.668 -28.191 1.00 0.00 O ATOM 0 H GLU A 102 15.125 -8.967 -24.299 1.00 0.00 H new ATOM 0 HA GLU A 102 17.605 -10.284 -24.568 1.00 0.00 H new ATOM 0 HB2 GLU A 102 17.130 -7.925 -26.276 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.572 -9.566 -26.705 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.244 -10.298 -26.580 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.741 -8.752 -25.926 1.00 0.00 H new ATOM 1532 N ASP A 103 19.401 -8.477 -24.115 1.00 0.00 N ATOM 1533 CA ASP A 103 20.442 -7.530 -23.713 1.00 0.00 C ATOM 1534 C ASP A 103 20.948 -6.717 -24.923 1.00 0.00 C ATOM 1535 O ASP A 103 21.461 -7.301 -25.878 1.00 0.00 O ATOM 1536 CB ASP A 103 21.567 -8.270 -22.968 1.00 0.00 C ATOM 1537 CG ASP A 103 22.287 -9.346 -23.810 1.00 0.00 C ATOM 1538 OD1 ASP A 103 21.643 -10.345 -24.212 1.00 0.00 O ATOM 1539 OD2 ASP A 103 23.521 -9.226 -24.014 1.00 0.00 O ATOM 0 H ASP A 103 19.772 -9.357 -24.473 1.00 0.00 H new ATOM 0 HA ASP A 103 20.022 -6.803 -23.018 1.00 0.00 H new ATOM 0 HB2 ASP A 103 22.302 -7.541 -22.627 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.149 -8.741 -22.078 1.00 0.00 H new ATOM 1544 N PRO A 104 20.815 -5.374 -24.925 1.00 0.00 N ATOM 1545 CA PRO A 104 21.222 -4.553 -26.066 1.00 0.00 C ATOM 1546 C PRO A 104 22.725 -4.207 -26.068 1.00 0.00 C ATOM 1547 O PRO A 104 23.240 -3.723 -27.072 1.00 0.00 O ATOM 1548 CB PRO A 104 20.330 -3.319 -25.963 1.00 0.00 C ATOM 1549 CG PRO A 104 20.185 -3.116 -24.457 1.00 0.00 C ATOM 1550 CD PRO A 104 20.119 -4.551 -23.939 1.00 0.00 C ATOM 0 HA PRO A 104 21.097 -5.081 -27.012 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.784 -2.453 -26.444 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.364 -3.479 -26.442 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.030 -2.571 -24.037 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.286 -2.552 -24.208 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.592 -4.633 -22.960 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.085 -4.875 -23.822 1.00 0.00 H new ATOM 1558 N ASP A 105 23.443 -4.465 -24.969 1.00 0.00 N ATOM 1559 CA ASP A 105 24.883 -4.205 -24.842 1.00 0.00 C ATOM 1560 C ASP A 105 25.698 -4.909 -25.944 1.00 0.00 C ATOM 1561 O ASP A 105 25.638 -6.131 -26.100 1.00 0.00 O ATOM 1562 CB ASP A 105 25.344 -4.651 -23.448 1.00 0.00 C ATOM 1563 CG ASP A 105 26.836 -4.375 -23.210 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.283 -3.229 -23.447 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.556 -5.253 -22.684 1.00 0.00 O ATOM 0 H ASP A 105 23.032 -4.868 -24.127 1.00 0.00 H new ATOM 0 HA ASP A 105 25.058 -3.136 -24.965 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.756 -4.133 -22.691 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.151 -5.717 -23.328 1.00 0.00 H new ATOM 1570 N GLY A 106 26.454 -4.131 -26.726 1.00 0.00 N ATOM 1571 CA GLY A 106 27.220 -4.619 -27.883 1.00 0.00 C ATOM 1572 C GLY A 106 26.389 -4.940 -29.139 1.00 0.00 C ATOM 1573 O GLY A 106 26.961 -5.382 -30.139 1.00 0.00 O ATOM 0 H GLY A 106 26.554 -3.128 -26.572 1.00 0.00 H new ATOM 0 HA2 GLY A 106 27.967 -3.870 -28.144 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.760 -5.518 -27.586 1.00 0.00 H new ATOM 1577 N GLN A 107 25.066 -4.726 -29.111 1.00 0.00 N ATOM 1578 CA GLN A 107 24.159 -4.874 -30.261 1.00 0.00 C ATOM 1579 C GLN A 107 23.812 -3.511 -30.900 1.00 0.00 C ATOM 1580 O GLN A 107 24.381 -2.475 -30.543 1.00 0.00 O ATOM 1581 CB GLN A 107 22.909 -5.679 -29.853 1.00 0.00 C ATOM 1582 CG GLN A 107 23.237 -7.050 -29.240 1.00 0.00 C ATOM 1583 CD GLN A 107 22.107 -8.049 -29.475 1.00 0.00 C ATOM 1584 OE1 GLN A 107 21.955 -8.610 -30.551 1.00 0.00 O ATOM 1585 NE2 GLN A 107 21.254 -8.284 -28.504 1.00 0.00 N ATOM 0 H GLN A 107 24.581 -4.436 -28.262 1.00 0.00 H new ATOM 0 HA GLN A 107 24.674 -5.440 -31.037 1.00 0.00 H new ATOM 0 HB2 GLN A 107 22.330 -5.098 -29.135 1.00 0.00 H new ATOM 0 HB3 GLN A 107 22.277 -5.823 -30.729 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.160 -7.433 -29.675 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.411 -6.940 -28.170 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.369 -7.823 -27.601 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.477 -8.928 -28.653 1.00 0.00 H new ATOM 1594 N SER A 108 22.904 -3.507 -31.889 1.00 0.00 N ATOM 1595 CA SER A 108 22.537 -2.294 -32.638 1.00 0.00 C ATOM 1596 C SER A 108 21.658 -1.349 -31.808 1.00 0.00 C ATOM 1597 O SER A 108 20.954 -1.777 -30.891 1.00 0.00 O ATOM 1598 CB SER A 108 21.860 -2.674 -33.963 1.00 0.00 C ATOM 1599 OG SER A 108 21.615 -1.511 -34.739 1.00 0.00 O ATOM 0 H SER A 108 22.404 -4.343 -32.192 1.00 0.00 H new ATOM 0 HA SER A 108 23.453 -1.748 -32.862 1.00 0.00 H new ATOM 0 HB2 SER A 108 22.494 -3.364 -34.519 1.00 0.00 H new ATOM 0 HB3 SER A 108 20.922 -3.192 -33.765 1.00 0.00 H new ATOM 0 HG SER A 108 21.185 -1.765 -35.582 1.00 0.00 H new ATOM 1605 N LEU A 109 21.636 -0.064 -32.159 1.00 0.00 N ATOM 1606 CA LEU A 109 20.828 0.965 -31.494 1.00 0.00 C ATOM 1607 C LEU A 109 19.324 0.666 -31.607 1.00 0.00 C ATOM 1608 O LEU A 109 18.564 0.902 -30.670 1.00 0.00 O ATOM 1609 CB LEU A 109 21.193 2.354 -32.059 1.00 0.00 C ATOM 1610 CG LEU A 109 22.624 2.866 -31.769 1.00 0.00 C ATOM 1611 CD1 LEU A 109 23.027 2.703 -30.303 1.00 0.00 C ATOM 1612 CD2 LEU A 109 23.712 2.209 -32.626 1.00 0.00 C ATOM 0 H LEU A 109 22.192 0.302 -32.932 1.00 0.00 H new ATOM 0 HA LEU A 109 21.056 0.960 -30.428 1.00 0.00 H new ATOM 0 HB2 LEU A 109 21.052 2.330 -33.140 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.484 3.080 -31.661 1.00 0.00 H new ATOM 0 HG LEU A 109 22.565 3.923 -32.028 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.040 3.079 -30.160 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.339 3.265 -29.672 1.00 0.00 H new ATOM 0 HD13 LEU A 109 22.990 1.648 -30.031 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.684 2.624 -32.360 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.715 1.134 -32.448 1.00 0.00 H new ATOM 0 HD23 LEU A 109 23.511 2.402 -33.680 1.00 0.00 H new ATOM 1624 N GLU A 110 18.894 0.005 -32.681 1.00 0.00 N ATOM 1625 CA GLU A 110 17.517 -0.482 -32.798 1.00 0.00 C ATOM 1626 C GLU A 110 17.206 -1.650 -31.845 1.00 0.00 C ATOM 1627 O GLU A 110 16.051 -1.814 -31.460 1.00 0.00 O ATOM 1628 CB GLU A 110 17.199 -0.802 -34.268 1.00 0.00 C ATOM 1629 CG GLU A 110 16.676 0.431 -35.031 1.00 0.00 C ATOM 1630 CD GLU A 110 17.630 1.647 -34.985 1.00 0.00 C ATOM 1631 OE1 GLU A 110 18.623 1.672 -35.753 1.00 0.00 O ATOM 1632 OE2 GLU A 110 17.372 2.594 -34.200 1.00 0.00 O ATOM 0 H GLU A 110 19.482 -0.207 -33.487 1.00 0.00 H new ATOM 0 HA GLU A 110 16.849 0.316 -32.475 1.00 0.00 H new ATOM 0 HB2 GLU A 110 18.097 -1.177 -34.759 1.00 0.00 H new ATOM 0 HB3 GLU A 110 16.455 -1.597 -34.312 1.00 0.00 H new ATOM 0 HG2 GLU A 110 16.504 0.156 -36.072 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.712 0.722 -34.614 1.00 0.00 H new ATOM 1639 N VAL A 111 18.201 -2.399 -31.344 1.00 0.00 N ATOM 1640 CA VAL A 111 17.990 -3.392 -30.274 1.00 0.00 C ATOM 1641 C VAL A 111 17.713 -2.685 -28.949 1.00 0.00 C ATOM 1642 O VAL A 111 16.767 -3.064 -28.263 1.00 0.00 O ATOM 1643 CB VAL A 111 19.135 -4.420 -30.162 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.803 -5.502 -29.127 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.347 -5.132 -31.505 1.00 0.00 C ATOM 0 H VAL A 111 19.167 -2.336 -31.665 1.00 0.00 H new ATOM 0 HA VAL A 111 17.111 -3.979 -30.542 1.00 0.00 H new ATOM 0 HB VAL A 111 20.029 -3.872 -29.865 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.626 -6.214 -29.068 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.653 -5.039 -28.152 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.893 -6.024 -29.425 1.00 0.00 H new ATOM 0 HG21 VAL A 111 20.158 -5.854 -31.410 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.432 -5.650 -31.791 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.602 -4.398 -32.270 1.00 0.00 H new ATOM 1655 N PHE A 112 18.412 -1.586 -28.626 1.00 0.00 N ATOM 1656 CA PHE A 112 18.045 -0.730 -27.480 1.00 0.00 C ATOM 1657 C PHE A 112 16.598 -0.228 -27.614 1.00 0.00 C ATOM 1658 O PHE A 112 15.801 -0.376 -26.687 1.00 0.00 O ATOM 1659 CB PHE A 112 19.014 0.461 -27.345 1.00 0.00 C ATOM 1660 CG PHE A 112 20.407 0.143 -26.838 1.00 0.00 C ATOM 1661 CD1 PHE A 112 21.426 -0.248 -27.728 1.00 0.00 C ATOM 1662 CD2 PHE A 112 20.703 0.269 -25.468 1.00 0.00 C ATOM 1663 CE1 PHE A 112 22.718 -0.531 -27.249 1.00 0.00 C ATOM 1664 CE2 PHE A 112 21.996 -0.003 -24.993 1.00 0.00 C ATOM 1665 CZ PHE A 112 23.006 -0.409 -25.881 1.00 0.00 C ATOM 0 H PHE A 112 19.234 -1.267 -29.139 1.00 0.00 H new ATOM 0 HA PHE A 112 18.120 -1.335 -26.577 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.106 0.939 -28.320 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.565 1.192 -26.673 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.214 -0.331 -28.784 1.00 0.00 H new ATOM 0 HD2 PHE A 112 19.931 0.577 -24.778 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.491 -0.843 -27.936 1.00 0.00 H new ATOM 0 HE2 PHE A 112 22.215 0.100 -23.940 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.998 -0.626 -25.513 1.00 0.00 H new ATOM 1675 N ARG A 113 16.216 0.267 -28.801 1.00 0.00 N ATOM 1676 CA ARG A 113 14.844 0.747 -29.087 1.00 0.00 C ATOM 1677 C ARG A 113 13.777 -0.364 -29.127 1.00 0.00 C ATOM 1678 O ARG A 113 12.600 -0.071 -28.945 1.00 0.00 O ATOM 1679 CB ARG A 113 14.832 1.604 -30.371 1.00 0.00 C ATOM 1680 CG ARG A 113 15.701 2.872 -30.243 1.00 0.00 C ATOM 1681 CD ARG A 113 15.487 3.821 -31.429 1.00 0.00 C ATOM 1682 NE ARG A 113 16.164 5.115 -31.207 1.00 0.00 N ATOM 1683 CZ ARG A 113 17.190 5.623 -31.864 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.794 5.007 -32.844 1.00 0.00 N ATOM 1685 NH2 ARG A 113 17.624 6.803 -31.528 1.00 0.00 N ATOM 0 H ARG A 113 16.849 0.348 -29.597 1.00 0.00 H new ATOM 0 HA ARG A 113 14.556 1.371 -28.241 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.191 1.004 -31.208 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.806 1.892 -30.602 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.459 3.388 -29.314 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.752 2.590 -30.186 1.00 0.00 H new ATOM 0 HD2 ARG A 113 15.868 3.360 -32.340 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.420 3.987 -31.578 1.00 0.00 H new ATOM 0 HE ARG A 113 15.792 5.689 -30.450 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.477 4.083 -33.138 1.00 0.00 H new ATOM 0 HH12 ARG A 113 18.583 5.450 -33.315 1.00 0.00 H new ATOM 0 HH21 ARG A 113 17.173 7.316 -30.771 1.00 0.00 H new ATOM 0 HH22 ARG A 113 18.416 7.215 -32.022 1.00 0.00 H new ATOM 1699 N THR A 114 14.170 -1.631 -29.272 1.00 0.00 N ATOM 1700 CA THR A 114 13.284 -2.807 -29.171 1.00 0.00 C ATOM 1701 C THR A 114 13.153 -3.312 -27.731 1.00 0.00 C ATOM 1702 O THR A 114 12.055 -3.616 -27.268 1.00 0.00 O ATOM 1703 CB THR A 114 13.783 -3.952 -30.069 1.00 0.00 C ATOM 1704 OG1 THR A 114 14.004 -3.513 -31.395 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.740 -5.060 -30.219 1.00 0.00 C ATOM 0 H THR A 114 15.139 -1.881 -29.469 1.00 0.00 H new ATOM 0 HA THR A 114 12.300 -2.482 -29.509 1.00 0.00 H new ATOM 0 HB THR A 114 14.693 -4.305 -29.585 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.758 -2.887 -31.411 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.135 -5.847 -30.861 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.506 -5.475 -29.238 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.834 -4.649 -30.665 1.00 0.00 H new ATOM 1713 N VAL A 115 14.256 -3.391 -26.980 1.00 0.00 N ATOM 1714 CA VAL A 115 14.278 -3.853 -25.576 1.00 0.00 C ATOM 1715 C VAL A 115 13.544 -2.883 -24.657 1.00 0.00 C ATOM 1716 O VAL A 115 12.780 -3.326 -23.804 1.00 0.00 O ATOM 1717 CB VAL A 115 15.726 -4.134 -25.119 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.793 -4.434 -23.615 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.293 -5.333 -25.881 1.00 0.00 C ATOM 0 H VAL A 115 15.178 -3.133 -27.331 1.00 0.00 H new ATOM 0 HA VAL A 115 13.735 -4.796 -25.513 1.00 0.00 H new ATOM 0 HB VAL A 115 16.313 -3.240 -25.327 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.827 -4.627 -23.328 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.415 -3.578 -23.056 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.185 -5.310 -23.391 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.315 -5.523 -25.552 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.679 -6.212 -25.685 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.290 -5.119 -26.950 1.00 0.00 H new ATOM 1729 N ARG A 116 13.675 -1.571 -24.879 1.00 0.00 N ATOM 1730 CA ARG A 116 13.022 -0.553 -24.035 1.00 0.00 C ATOM 1731 C ARG A 116 11.498 -0.707 -23.969 1.00 0.00 C ATOM 1732 O ARG A 116 10.927 -0.632 -22.893 1.00 0.00 O ATOM 1733 CB ARG A 116 13.488 0.841 -24.495 1.00 0.00 C ATOM 1734 CG ARG A 116 12.799 1.365 -25.760 1.00 0.00 C ATOM 1735 CD ARG A 116 13.348 2.739 -26.153 1.00 0.00 C ATOM 1736 NE ARG A 116 12.664 3.229 -27.368 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.978 4.299 -28.070 1.00 0.00 C ATOM 1738 NH1 ARG A 116 13.993 5.042 -27.760 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.295 4.643 -29.120 1.00 0.00 N ATOM 0 H ARG A 116 14.231 -1.183 -25.641 1.00 0.00 H new ATOM 0 HA ARG A 116 13.333 -0.696 -23.000 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.318 1.551 -23.685 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.563 0.809 -24.671 1.00 0.00 H new ATOM 0 HG2 ARG A 116 12.949 0.661 -26.579 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.724 1.433 -25.592 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.204 3.445 -25.335 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.421 2.673 -26.332 1.00 0.00 H new ATOM 0 HE ARG A 116 11.868 2.683 -27.697 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.572 4.804 -26.955 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.213 5.865 -28.321 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.497 4.081 -29.416 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.556 5.476 -29.648 1.00 0.00 H new ATOM 1753 N GLY A 117 10.852 -1.030 -25.091 1.00 0.00 N ATOM 1754 CA GLY A 117 9.400 -1.249 -25.155 1.00 0.00 C ATOM 1755 C GLY A 117 8.963 -2.545 -24.469 1.00 0.00 C ATOM 1756 O GLY A 117 7.930 -2.572 -23.804 1.00 0.00 O ATOM 0 H GLY A 117 11.322 -1.149 -25.988 1.00 0.00 H new ATOM 0 HA2 GLY A 117 8.890 -0.407 -24.688 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.087 -1.273 -26.199 1.00 0.00 H new ATOM 1760 N GLN A 118 9.803 -3.589 -24.518 1.00 0.00 N ATOM 1761 CA GLN A 118 9.559 -4.849 -23.800 1.00 0.00 C ATOM 1762 C GLN A 118 9.679 -4.650 -22.289 1.00 0.00 C ATOM 1763 O GLN A 118 8.820 -5.090 -21.531 1.00 0.00 O ATOM 1764 CB GLN A 118 10.515 -5.942 -24.302 1.00 0.00 C ATOM 1765 CG GLN A 118 10.216 -6.372 -25.747 1.00 0.00 C ATOM 1766 CD GLN A 118 11.382 -7.165 -26.321 1.00 0.00 C ATOM 1767 OE1 GLN A 118 11.455 -8.385 -26.256 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.345 -6.468 -26.878 1.00 0.00 N ATOM 0 H GLN A 118 10.670 -3.584 -25.056 1.00 0.00 H new ATOM 0 HA GLN A 118 8.539 -5.173 -24.004 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.541 -5.579 -24.240 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.444 -6.810 -23.647 1.00 0.00 H new ATOM 0 HG2 GLN A 118 9.310 -6.977 -25.772 1.00 0.00 H new ATOM 0 HG3 GLN A 118 10.029 -5.492 -26.363 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.276 -5.452 -26.928 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.162 -6.943 -27.261 1.00 0.00 H new ATOM 1777 N VAL A 119 10.704 -3.915 -21.841 1.00 0.00 N ATOM 1778 CA VAL A 119 10.815 -3.463 -20.437 1.00 0.00 C ATOM 1779 C VAL A 119 9.601 -2.613 -20.052 1.00 0.00 C ATOM 1780 O VAL A 119 8.983 -2.882 -19.027 1.00 0.00 O ATOM 1781 CB VAL A 119 12.127 -2.688 -20.215 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.220 -2.094 -18.807 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.360 -3.579 -20.391 1.00 0.00 C ATOM 0 H VAL A 119 11.479 -3.615 -22.433 1.00 0.00 H new ATOM 0 HA VAL A 119 10.834 -4.341 -19.791 1.00 0.00 H new ATOM 0 HB VAL A 119 12.111 -1.897 -20.965 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.163 -1.557 -18.700 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.390 -1.405 -18.647 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.173 -2.896 -18.070 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.262 -2.989 -20.225 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.324 -4.397 -19.671 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.374 -3.986 -21.402 1.00 0.00 H new ATOM 1793 N LYS A 120 9.209 -1.638 -20.882 1.00 0.00 N ATOM 1794 CA LYS A 120 8.070 -0.736 -20.637 1.00 0.00 C ATOM 1795 C LYS A 120 6.765 -1.492 -20.428 1.00 0.00 C ATOM 1796 O LYS A 120 6.117 -1.262 -19.420 1.00 0.00 O ATOM 1797 CB LYS A 120 7.982 0.299 -21.777 1.00 0.00 C ATOM 1798 CG LYS A 120 6.946 1.411 -21.528 1.00 0.00 C ATOM 1799 CD LYS A 120 5.582 1.170 -22.200 1.00 0.00 C ATOM 1800 CE LYS A 120 4.716 2.431 -22.058 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.371 2.256 -22.673 1.00 0.00 N ATOM 0 H LYS A 120 9.684 -1.448 -21.764 1.00 0.00 H new ATOM 0 HA LYS A 120 8.242 -0.203 -19.702 1.00 0.00 H new ATOM 0 HB2 LYS A 120 8.962 0.754 -21.919 1.00 0.00 H new ATOM 0 HB3 LYS A 120 7.732 -0.216 -22.705 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.795 1.516 -20.454 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.352 2.357 -21.887 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.721 0.927 -23.253 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.082 0.318 -21.739 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.603 2.676 -21.002 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.223 3.274 -22.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.003 3.182 -22.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.446 1.630 -23.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.724 1.834 -21.977 1.00 0.00 H new ATOM 1815 N GLU A 121 6.388 -2.421 -21.306 1.00 0.00 N ATOM 1816 CA GLU A 121 5.117 -3.162 -21.161 1.00 0.00 C ATOM 1817 C GLU A 121 5.134 -4.149 -19.982 1.00 0.00 C ATOM 1818 O GLU A 121 4.110 -4.374 -19.331 1.00 0.00 O ATOM 1819 CB GLU A 121 4.723 -3.836 -22.488 1.00 0.00 C ATOM 1820 CG GLU A 121 5.561 -5.060 -22.868 1.00 0.00 C ATOM 1821 CD GLU A 121 5.126 -5.630 -24.232 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.061 -6.294 -24.302 1.00 0.00 O ATOM 1823 OE2 GLU A 121 5.841 -5.430 -25.245 1.00 0.00 O ATOM 0 H GLU A 121 6.936 -2.684 -22.125 1.00 0.00 H new ATOM 0 HA GLU A 121 4.343 -2.434 -20.918 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.677 -4.135 -22.429 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.799 -3.100 -23.288 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.615 -4.785 -22.905 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.458 -5.827 -22.101 1.00 0.00 H new ATOM 1830 N ARG A 122 6.313 -4.685 -19.646 1.00 0.00 N ATOM 1831 CA ARG A 122 6.509 -5.537 -18.464 1.00 0.00 C ATOM 1832 C ARG A 122 6.354 -4.726 -17.173 1.00 0.00 C ATOM 1833 O ARG A 122 5.513 -5.071 -16.349 1.00 0.00 O ATOM 1834 CB ARG A 122 7.830 -6.310 -18.605 1.00 0.00 C ATOM 1835 CG ARG A 122 7.686 -7.412 -19.672 1.00 0.00 C ATOM 1836 CD ARG A 122 9.032 -8.066 -19.988 1.00 0.00 C ATOM 1837 NE ARG A 122 8.880 -9.213 -20.913 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.719 -10.493 -20.620 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.523 -10.922 -19.408 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.797 -11.402 -21.541 1.00 0.00 N ATOM 0 H ARG A 122 7.164 -4.540 -20.189 1.00 0.00 H new ATOM 0 HA ARG A 122 5.728 -6.294 -18.397 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.633 -5.627 -18.883 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.105 -6.753 -17.648 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.985 -8.170 -19.321 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.265 -6.986 -20.582 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.700 -7.328 -20.431 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.499 -8.404 -19.063 1.00 0.00 H new ATOM 0 HE ARG A 122 8.902 -8.986 -21.907 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.488 -10.261 -18.632 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.404 -11.920 -19.233 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.985 -11.134 -22.507 1.00 0.00 H new ATOM 0 HH22 ARG A 122 8.671 -12.385 -21.299 1.00 0.00 H new ATOM 1854 N VAL A 123 7.044 -3.588 -17.048 1.00 0.00 N ATOM 1855 CA VAL A 123 6.839 -2.595 -15.973 1.00 0.00 C ATOM 1856 C VAL A 123 5.384 -2.115 -15.898 1.00 0.00 C ATOM 1857 O VAL A 123 4.816 -2.115 -14.813 1.00 0.00 O ATOM 1858 CB VAL A 123 7.793 -1.410 -16.194 1.00 0.00 C ATOM 1859 CG1 VAL A 123 7.522 -0.206 -15.302 1.00 0.00 C ATOM 1860 CG2 VAL A 123 9.254 -1.823 -15.945 1.00 0.00 C ATOM 0 H VAL A 123 7.779 -3.320 -17.703 1.00 0.00 H new ATOM 0 HA VAL A 123 7.059 -3.073 -15.018 1.00 0.00 H new ATOM 0 HB VAL A 123 7.617 -1.121 -17.230 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.241 0.582 -15.526 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.512 0.162 -15.484 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.618 -0.499 -14.256 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.907 -0.966 -16.108 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.363 -2.172 -14.918 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.528 -2.624 -16.632 1.00 0.00 H new ATOM 1870 N GLU A 124 4.752 -1.731 -17.012 1.00 0.00 N ATOM 1871 CA GLU A 124 3.396 -1.200 -17.033 1.00 0.00 C ATOM 1872 C GLU A 124 2.363 -2.214 -16.537 1.00 0.00 C ATOM 1873 O GLU A 124 1.603 -1.895 -15.625 1.00 0.00 O ATOM 1874 CB GLU A 124 3.062 -0.741 -18.461 1.00 0.00 C ATOM 1875 CG GLU A 124 2.012 0.356 -18.440 1.00 0.00 C ATOM 1876 CD GLU A 124 1.300 0.484 -19.800 1.00 0.00 C ATOM 1877 OE1 GLU A 124 1.971 0.804 -20.810 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.066 0.266 -19.869 1.00 0.00 O ATOM 0 H GLU A 124 5.180 -1.784 -17.936 1.00 0.00 H new ATOM 0 HA GLU A 124 3.351 -0.354 -16.347 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.965 -0.378 -18.952 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.700 -1.587 -19.045 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.278 0.143 -17.663 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.482 1.306 -18.184 1.00 0.00 H new ATOM 1885 N ASN A 125 2.361 -3.444 -17.067 1.00 0.00 N ATOM 1886 CA ASN A 125 1.373 -4.444 -16.646 1.00 0.00 C ATOM 1887 C ASN A 125 1.625 -4.930 -15.205 1.00 0.00 C ATOM 1888 O ASN A 125 0.670 -5.226 -14.488 1.00 0.00 O ATOM 1889 CB ASN A 125 1.241 -5.572 -17.690 1.00 0.00 C ATOM 1890 CG ASN A 125 2.081 -6.795 -17.365 1.00 0.00 C ATOM 1891 OD1 ASN A 125 1.648 -7.727 -16.701 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.321 -6.806 -17.782 1.00 0.00 N ATOM 0 H ASN A 125 3.020 -3.766 -17.776 1.00 0.00 H new ATOM 0 HA ASN A 125 0.393 -3.968 -16.608 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.195 -5.868 -17.764 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.534 -5.189 -18.667 1.00 0.00 H new ATOM 0 HD21 ASN A 125 3.929 -7.593 -17.554 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.680 -6.028 -18.335 1.00 0.00 H new ATOM 1899 N LEU A 126 2.890 -4.940 -14.757 1.00 0.00 N ATOM 1900 CA LEU A 126 3.255 -5.172 -13.356 1.00 0.00 C ATOM 1901 C LEU A 126 2.699 -4.060 -12.463 1.00 0.00 C ATOM 1902 O LEU A 126 2.027 -4.354 -11.479 1.00 0.00 O ATOM 1903 CB LEU A 126 4.787 -5.334 -13.252 1.00 0.00 C ATOM 1904 CG LEU A 126 5.422 -5.578 -11.865 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.610 -4.311 -11.030 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.658 -6.612 -11.034 1.00 0.00 C ATOM 0 H LEU A 126 3.694 -4.785 -15.365 1.00 0.00 H new ATOM 0 HA LEU A 126 2.804 -6.096 -12.995 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.074 -6.165 -13.896 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.242 -4.435 -13.669 1.00 0.00 H new ATOM 0 HG LEU A 126 6.411 -5.969 -12.105 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.061 -4.570 -10.072 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.262 -3.618 -11.562 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.642 -3.840 -10.860 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.151 -6.741 -10.071 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.636 -6.268 -10.875 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.642 -7.564 -11.564 1.00 0.00 H new ATOM 1918 N ILE A 127 2.925 -2.785 -12.792 1.00 0.00 N ATOM 1919 CA ILE A 127 2.479 -1.708 -11.894 1.00 0.00 C ATOM 1920 C ILE A 127 0.947 -1.579 -11.900 1.00 0.00 C ATOM 1921 O ILE A 127 0.341 -1.469 -10.835 1.00 0.00 O ATOM 1922 CB ILE A 127 3.223 -0.399 -12.209 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.721 -0.601 -11.882 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.666 0.797 -11.408 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.635 0.473 -12.471 1.00 0.00 C ATOM 0 H ILE A 127 3.397 -2.476 -13.642 1.00 0.00 H new ATOM 0 HA ILE A 127 2.742 -1.962 -10.867 1.00 0.00 H new ATOM 0 HB ILE A 127 3.083 -0.166 -13.264 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.847 -0.618 -10.799 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.036 -1.576 -12.255 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.223 1.698 -11.665 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.613 0.940 -11.652 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.768 0.599 -10.341 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.669 0.261 -12.198 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.540 0.476 -13.557 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.349 1.449 -12.079 1.00 0.00 H new ATOM 1937 N ALA A 128 0.310 -1.711 -13.067 1.00 0.00 N ATOM 1938 CA ALA A 128 -1.146 -1.628 -13.220 1.00 0.00 C ATOM 1939 C ALA A 128 -1.931 -2.693 -12.420 1.00 0.00 C ATOM 1940 O ALA A 128 -3.115 -2.480 -12.138 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.477 -1.710 -14.714 1.00 0.00 C ATOM 0 H ALA A 128 0.799 -1.881 -13.946 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.467 -0.675 -12.799 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.557 -1.650 -14.851 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.998 -0.883 -15.239 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.112 -2.655 -15.116 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.291 -3.809 -12.025 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.901 -4.843 -11.161 1.00 0.00 C ATOM 1949 C LYS A 129 -1.550 -4.736 -9.666 1.00 0.00 C ATOM 1950 O LYS A 129 -2.198 -5.422 -8.873 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.658 -6.253 -11.738 1.00 0.00 C ATOM 1952 CG LYS A 129 -0.229 -6.778 -11.546 1.00 0.00 C ATOM 1953 CD LYS A 129 -0.081 -8.189 -12.119 1.00 0.00 C ATOM 1954 CE LYS A 129 1.355 -8.681 -11.893 1.00 0.00 C ATOM 1955 NZ LYS A 129 1.512 -10.097 -12.338 1.00 0.00 N ATOM 0 H LYS A 129 -0.331 -4.022 -12.296 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.973 -4.648 -11.179 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.354 -6.949 -11.270 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.888 -6.241 -12.803 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.477 -6.107 -12.035 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.020 -6.785 -10.485 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.789 -8.865 -11.639 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.314 -8.188 -13.184 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.051 -8.045 -12.440 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.610 -8.598 -10.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.510 -10.379 -12.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.926 -10.715 -11.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.210 -10.185 -13.329 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.580 -3.900 -9.263 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.170 -3.755 -7.842 1.00 0.00 C ATOM 1971 C ILE A 130 -0.481 -2.378 -7.226 1.00 0.00 C ATOM 1972 O ILE A 130 -0.512 -2.266 -5.996 1.00 0.00 O ATOM 1973 CB ILE A 130 1.298 -4.179 -7.602 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.322 -3.148 -8.110 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.560 -5.569 -8.206 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.777 -3.486 -7.754 1.00 0.00 C ATOM 0 H ILE A 130 -0.055 -3.305 -9.904 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.804 -4.458 -7.302 1.00 0.00 H new ATOM 0 HB ILE A 130 1.438 -4.228 -6.522 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.233 -3.066 -9.193 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.075 -2.171 -7.695 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.597 -5.853 -8.029 1.00 0.00 H new ATOM 0 HG22 ILE A 130 0.899 -6.299 -7.739 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.370 -5.541 -9.279 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.437 -2.712 -8.147 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.884 -3.538 -6.671 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.045 -4.448 -8.192 1.00 0.00 H new ATOM 1988 N SER A 131 -0.731 -1.363 -8.059 1.00 0.00 N ATOM 1989 CA SER A 131 -1.046 0.023 -7.672 1.00 0.00 C ATOM 1990 C SER A 131 -2.479 0.426 -8.046 1.00 0.00 C ATOM 1991 O SER A 131 -2.822 0.433 -9.252 1.00 0.00 O ATOM 1992 CB SER A 131 -0.036 0.976 -8.308 1.00 0.00 C ATOM 1993 OG SER A 131 1.260 0.709 -7.793 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.264 0.738 -7.121 1.00 0.00 O ATOM 0 H SER A 131 -0.720 -1.488 -9.071 1.00 0.00 H new ATOM 0 HA SER A 131 -0.977 0.087 -6.586 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.040 0.856 -9.391 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.315 2.009 -8.101 1.00 0.00 H new ATOM 0 HG SER A 131 1.494 1.389 -7.128 1.00 0.00 H new TER 2000 SER A 131