USER MOD reduce.3.24.130724 H: found=0, std=0, add=766, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 764 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 68 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -54:sc= 0.404 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -0.33 K(o=-0.33,f=-1.2) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot -17:sc= 0.348 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 28:sc= 0.548 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 140:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 62 ASN : amide:sc= -0.517 K(o=-0.52,f=-5.8!) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0969) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.0338 USER MOD Single : A 72 TYR OH : rot 164:sc= 0.282 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl -138:sc= -2.22 (180deg=-6.39!) USER MOD Single : A 80 TYR OH : rot -11:sc= 0.461 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -150:sc= -1.74 (180deg=-2.49!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HE2:sc= -4.1! X(o=-4.1!,f=-4.5) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 70:sc= 0.496 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.776 16.765 -10.766 1.00 0.00 N ATOM 2 CA GLY A 1 22.575 17.064 -10.010 1.00 0.00 C ATOM 3 C GLY A 1 22.330 18.554 -9.875 1.00 0.00 C ATOM 4 O GLY A 1 22.412 19.295 -10.854 1.00 0.00 O ATOM 0 H1 GLY A 1 23.899 15.734 -10.830 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.692 17.163 -11.723 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.600 17.183 -10.288 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.718 16.601 -10.498 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.655 16.621 -9.017 1.00 0.00 H new ATOM 8 N SER A 2 22.027 18.995 -8.658 1.00 0.00 N ATOM 9 CA SER A 2 21.764 20.406 -8.399 1.00 0.00 C ATOM 10 C SER A 2 22.509 20.878 -7.154 1.00 0.00 C ATOM 11 O SER A 2 22.552 20.180 -6.141 1.00 0.00 O ATOM 12 CB SER A 2 20.263 20.644 -8.230 1.00 0.00 C ATOM 13 OG SER A 2 19.992 22.001 -7.928 1.00 0.00 O ATOM 0 H SER A 2 21.958 18.395 -7.836 1.00 0.00 H new ATOM 0 HA SER A 2 22.121 20.980 -9.254 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.742 20.361 -9.144 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.878 20.007 -7.433 1.00 0.00 H new ATOM 0 HG SER A 2 19.025 22.127 -7.827 1.00 0.00 H new ATOM 19 N SER A 3 23.095 22.068 -7.238 1.00 0.00 N ATOM 20 CA SER A 3 23.842 22.633 -6.121 1.00 0.00 C ATOM 21 C SER A 3 22.907 23.342 -5.146 1.00 0.00 C ATOM 22 O SER A 3 23.150 24.483 -4.754 1.00 0.00 O ATOM 23 CB SER A 3 24.902 23.611 -6.631 1.00 0.00 C ATOM 24 OG SER A 3 25.732 24.060 -5.574 1.00 0.00 O ATOM 0 H SER A 3 23.067 22.660 -8.068 1.00 0.00 H new ATOM 0 HA SER A 3 24.335 21.815 -5.595 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.510 23.127 -7.395 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.416 24.465 -7.104 1.00 0.00 H new ATOM 0 HG SER A 3 25.176 24.428 -4.856 1.00 0.00 H new ATOM 30 N GLY A 4 21.835 22.657 -4.758 1.00 0.00 N ATOM 31 CA GLY A 4 20.879 23.236 -3.833 1.00 0.00 C ATOM 32 C GLY A 4 21.068 22.736 -2.414 1.00 0.00 C ATOM 33 O GLY A 4 22.192 22.467 -1.988 1.00 0.00 O ATOM 0 H GLY A 4 21.612 21.711 -5.068 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.975 24.322 -3.848 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.868 23.001 -4.166 1.00 0.00 H new ATOM 37 N SER A 5 19.967 22.611 -1.681 1.00 0.00 N ATOM 38 CA SER A 5 20.017 22.144 -0.300 1.00 0.00 C ATOM 39 C SER A 5 19.061 20.974 -0.087 1.00 0.00 C ATOM 40 O SER A 5 18.014 20.889 -0.729 1.00 0.00 O ATOM 41 CB SER A 5 19.668 23.284 0.659 1.00 0.00 C ATOM 42 OG SER A 5 20.639 24.315 0.600 1.00 0.00 O ATOM 0 H SER A 5 19.029 22.826 -2.020 1.00 0.00 H new ATOM 0 HA SER A 5 21.032 21.803 -0.094 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.688 23.688 0.407 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.602 22.900 1.677 1.00 0.00 H new ATOM 0 HG SER A 5 20.392 25.032 1.220 1.00 0.00 H new ATOM 48 N SER A 6 19.430 20.075 0.820 1.00 0.00 N ATOM 49 CA SER A 6 18.608 18.907 1.116 1.00 0.00 C ATOM 50 C SER A 6 17.278 19.323 1.738 1.00 0.00 C ATOM 51 O SER A 6 17.244 20.032 2.742 1.00 0.00 O ATOM 52 CB SER A 6 19.351 17.960 2.060 1.00 0.00 C ATOM 53 OG SER A 6 18.619 16.764 2.263 1.00 0.00 O ATOM 0 H SER A 6 20.292 20.133 1.362 1.00 0.00 H new ATOM 0 HA SER A 6 18.405 18.389 0.179 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.331 17.724 1.646 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.519 18.454 3.017 1.00 0.00 H new ATOM 0 HG SER A 6 19.116 16.175 2.868 1.00 0.00 H new ATOM 59 N GLY A 7 16.182 18.875 1.131 1.00 0.00 N ATOM 60 CA GLY A 7 14.864 19.210 1.638 1.00 0.00 C ATOM 61 C GLY A 7 14.494 18.403 2.867 1.00 0.00 C ATOM 62 O GLY A 7 15.014 17.312 3.100 1.00 0.00 O ATOM 0 H GLY A 7 16.184 18.287 0.298 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.830 20.272 1.881 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.123 19.038 0.857 1.00 0.00 H new ATOM 66 N PRO A 8 13.575 18.945 3.680 1.00 0.00 N ATOM 67 CA PRO A 8 13.115 18.286 4.906 1.00 0.00 C ATOM 68 C PRO A 8 12.274 17.047 4.618 1.00 0.00 C ATOM 69 O PRO A 8 11.570 16.984 3.610 1.00 0.00 O ATOM 70 CB PRO A 8 12.268 19.361 5.591 1.00 0.00 C ATOM 71 CG PRO A 8 11.805 20.242 4.482 1.00 0.00 C ATOM 72 CD PRO A 8 12.912 20.242 3.464 1.00 0.00 C ATOM 0 HA PRO A 8 13.947 17.929 5.513 1.00 0.00 H new ATOM 0 HB2 PRO A 8 11.426 18.921 6.125 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.852 19.919 6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 8 10.877 19.869 4.049 1.00 0.00 H new ATOM 0 HG3 PRO A 8 11.606 21.251 4.842 1.00 0.00 H new ATOM 0 HD2 PRO A 8 12.524 20.331 2.449 1.00 0.00 H new ATOM 0 HD3 PRO A 8 13.599 21.075 3.617 1.00 0.00 H new ATOM 80 N PHE A 9 12.351 16.065 5.510 1.00 0.00 N ATOM 81 CA PHE A 9 11.596 14.828 5.351 1.00 0.00 C ATOM 82 C PHE A 9 10.229 14.934 6.021 1.00 0.00 C ATOM 83 O PHE A 9 10.085 15.571 7.065 1.00 0.00 O ATOM 84 CB PHE A 9 12.375 13.650 5.942 1.00 0.00 C ATOM 85 CG PHE A 9 11.496 12.540 6.441 1.00 0.00 C ATOM 86 CD1 PHE A 9 10.894 12.621 7.686 1.00 0.00 C ATOM 87 CD2 PHE A 9 11.271 11.414 5.665 1.00 0.00 C ATOM 88 CE1 PHE A 9 10.085 11.600 8.148 1.00 0.00 C ATOM 89 CE2 PHE A 9 10.463 10.390 6.121 1.00 0.00 C ATOM 90 CZ PHE A 9 9.868 10.484 7.364 1.00 0.00 C ATOM 0 H PHE A 9 12.928 16.102 6.350 1.00 0.00 H new ATOM 0 HA PHE A 9 11.447 14.659 4.285 1.00 0.00 H new ATOM 0 HB2 PHE A 9 13.051 13.255 5.184 1.00 0.00 H new ATOM 0 HB3 PHE A 9 12.994 14.010 6.764 1.00 0.00 H new ATOM 0 HD1 PHE A 9 11.059 13.492 8.303 1.00 0.00 H new ATOM 0 HD2 PHE A 9 11.733 11.336 4.692 1.00 0.00 H new ATOM 0 HE1 PHE A 9 9.623 11.675 9.121 1.00 0.00 H new ATOM 0 HE2 PHE A 9 10.297 9.518 5.506 1.00 0.00 H new ATOM 0 HZ PHE A 9 9.234 9.686 7.722 1.00 0.00 H new ATOM 100 N ASP A 10 9.228 14.307 5.413 1.00 0.00 N ATOM 101 CA ASP A 10 7.872 14.331 5.949 1.00 0.00 C ATOM 102 C ASP A 10 6.989 13.309 5.240 1.00 0.00 C ATOM 103 O ASP A 10 6.775 13.371 4.029 1.00 0.00 O ATOM 104 CB ASP A 10 7.269 15.729 5.808 1.00 0.00 C ATOM 105 CG ASP A 10 7.606 16.626 6.983 1.00 0.00 C ATOM 106 OD1 ASP A 10 7.196 16.299 8.117 1.00 0.00 O ATOM 107 OD2 ASP A 10 8.280 17.655 6.769 1.00 0.00 O ATOM 0 H ASP A 10 9.330 13.776 4.548 1.00 0.00 H new ATOM 0 HA ASP A 10 7.922 14.070 7.006 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.633 16.187 4.889 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.186 15.647 5.716 1.00 0.00 H new ATOM 112 N PRO A 11 6.465 12.344 6.010 1.00 0.00 N ATOM 113 CA PRO A 11 5.597 11.289 5.477 1.00 0.00 C ATOM 114 C PRO A 11 4.235 11.822 5.046 1.00 0.00 C ATOM 115 O PRO A 11 3.641 11.331 4.086 1.00 0.00 O ATOM 116 CB PRO A 11 5.446 10.324 6.656 1.00 0.00 C ATOM 117 CG PRO A 11 5.673 11.165 7.864 1.00 0.00 C ATOM 118 CD PRO A 11 6.678 12.208 7.461 1.00 0.00 C ATOM 0 HA PRO A 11 6.017 10.828 4.583 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.456 9.869 6.671 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.170 9.511 6.598 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.744 11.627 8.198 1.00 0.00 H new ATOM 0 HG3 PRO A 11 6.046 10.564 8.693 1.00 0.00 H new ATOM 0 HD2 PRO A 11 6.510 13.151 7.982 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.696 11.894 7.690 1.00 0.00 H new ATOM 126 N SER A 12 3.745 12.829 5.762 1.00 0.00 N ATOM 127 CA SER A 12 2.451 13.426 5.455 1.00 0.00 C ATOM 128 C SER A 12 2.435 13.991 4.038 1.00 0.00 C ATOM 129 O SER A 12 1.414 13.948 3.351 1.00 0.00 O ATOM 130 CB SER A 12 2.125 14.533 6.460 1.00 0.00 C ATOM 131 OG SER A 12 2.041 14.016 7.777 1.00 0.00 O ATOM 0 H SER A 12 4.225 13.248 6.559 1.00 0.00 H new ATOM 0 HA SER A 12 1.693 12.645 5.525 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.893 15.305 6.417 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.181 15.007 6.191 1.00 0.00 H new ATOM 0 HG SER A 12 1.834 14.743 8.401 1.00 0.00 H new ATOM 137 N LYS A 13 3.574 14.520 3.606 1.00 0.00 N ATOM 138 CA LYS A 13 3.695 15.093 2.270 1.00 0.00 C ATOM 139 C LYS A 13 3.470 14.029 1.200 1.00 0.00 C ATOM 140 O LYS A 13 3.010 14.331 0.098 1.00 0.00 O ATOM 141 CB LYS A 13 5.074 15.730 2.089 1.00 0.00 C ATOM 142 CG LYS A 13 5.396 16.791 3.127 1.00 0.00 C ATOM 143 CD LYS A 13 4.506 18.013 2.969 1.00 0.00 C ATOM 144 CE LYS A 13 3.243 17.895 3.807 1.00 0.00 C ATOM 145 NZ LYS A 13 3.425 18.469 5.169 1.00 0.00 N ATOM 0 H LYS A 13 4.428 14.564 4.162 1.00 0.00 H new ATOM 0 HA LYS A 13 2.930 15.861 2.160 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.834 14.950 2.132 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.131 16.176 1.096 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.270 16.374 4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.441 17.086 3.035 1.00 0.00 H new ATOM 0 HD2 LYS A 13 5.057 18.906 3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 13 4.238 18.136 1.920 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.424 18.408 3.303 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.959 16.846 3.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.542 18.369 5.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.190 17.963 5.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.671 19.476 5.091 1.00 0.00 H new ATOM 159 N VAL A 14 3.795 12.784 1.532 1.00 0.00 N ATOM 160 CA VAL A 14 3.625 11.675 0.600 1.00 0.00 C ATOM 161 C VAL A 14 2.150 11.418 0.315 1.00 0.00 C ATOM 162 O VAL A 14 1.341 11.294 1.235 1.00 0.00 O ATOM 163 CB VAL A 14 4.266 10.384 1.142 1.00 0.00 C ATOM 164 CG1 VAL A 14 4.077 9.240 0.157 1.00 0.00 C ATOM 165 CG2 VAL A 14 5.742 10.605 1.438 1.00 0.00 C ATOM 0 H VAL A 14 4.178 12.518 2.439 1.00 0.00 H new ATOM 0 HA VAL A 14 4.126 11.959 -0.326 1.00 0.00 H new ATOM 0 HB VAL A 14 3.769 10.116 2.074 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.536 8.336 0.557 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.012 9.067 0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.547 9.496 -0.793 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.179 9.682 1.820 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.257 10.898 0.523 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.850 11.393 2.183 1.00 0.00 H new ATOM 175 N VAL A 15 1.806 11.337 -0.966 1.00 0.00 N ATOM 176 CA VAL A 15 0.427 11.092 -1.373 1.00 0.00 C ATOM 177 C VAL A 15 0.291 9.740 -2.066 1.00 0.00 C ATOM 178 O VAL A 15 1.006 9.447 -3.023 1.00 0.00 O ATOM 179 CB VAL A 15 -0.084 12.195 -2.318 1.00 0.00 C ATOM 180 CG1 VAL A 15 -1.520 11.918 -2.736 1.00 0.00 C ATOM 181 CG2 VAL A 15 0.034 13.560 -1.657 1.00 0.00 C ATOM 0 H VAL A 15 2.463 11.437 -1.740 1.00 0.00 H new ATOM 0 HA VAL A 15 -0.176 11.094 -0.465 1.00 0.00 H new ATOM 0 HB VAL A 15 0.536 12.196 -3.215 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.864 12.708 -3.404 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -1.570 10.959 -3.252 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.157 11.888 -1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.332 14.327 -2.339 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.560 13.574 -0.743 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.078 13.758 -1.414 1.00 0.00 H new ATOM 191 N ALA A 16 -0.634 8.921 -1.575 1.00 0.00 N ATOM 192 CA ALA A 16 -0.866 7.601 -2.149 1.00 0.00 C ATOM 193 C ALA A 16 -2.310 7.452 -2.616 1.00 0.00 C ATOM 194 O ALA A 16 -3.237 7.926 -1.959 1.00 0.00 O ATOM 195 CB ALA A 16 -0.522 6.518 -1.138 1.00 0.00 C ATOM 0 H ALA A 16 -1.234 9.148 -0.782 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.217 7.491 -3.018 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -0.700 5.538 -1.580 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.527 6.604 -0.856 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -1.147 6.635 -0.252 1.00 0.00 H new ATOM 201 N SER A 17 -2.494 6.792 -3.755 1.00 0.00 N ATOM 202 CA SER A 17 -3.826 6.584 -4.312 1.00 0.00 C ATOM 203 C SER A 17 -3.811 5.469 -5.353 1.00 0.00 C ATOM 204 O SER A 17 -2.762 4.907 -5.662 1.00 0.00 O ATOM 205 CB SER A 17 -4.346 7.878 -4.940 1.00 0.00 C ATOM 206 OG SER A 17 -3.640 8.187 -6.130 1.00 0.00 O ATOM 0 H SER A 17 -1.738 6.392 -4.310 1.00 0.00 H new ATOM 0 HA SER A 17 -4.491 6.290 -3.500 1.00 0.00 H new ATOM 0 HB2 SER A 17 -5.409 7.778 -5.160 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.243 8.698 -4.229 1.00 0.00 H new ATOM 0 HG SER A 17 -3.992 9.017 -6.513 1.00 0.00 H new ATOM 212 N GLY A 18 -4.986 5.156 -5.892 1.00 0.00 N ATOM 213 CA GLY A 18 -5.087 4.110 -6.892 1.00 0.00 C ATOM 214 C GLY A 18 -6.214 3.138 -6.603 1.00 0.00 C ATOM 215 O GLY A 18 -6.826 3.164 -5.535 1.00 0.00 O ATOM 0 H GLY A 18 -5.869 5.608 -5.654 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.243 4.562 -7.871 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.144 3.565 -6.939 1.00 0.00 H new ATOM 219 N PRO A 19 -6.505 2.258 -7.572 1.00 0.00 N ATOM 220 CA PRO A 19 -7.569 1.257 -7.440 1.00 0.00 C ATOM 221 C PRO A 19 -7.223 0.174 -6.424 1.00 0.00 C ATOM 222 O PRO A 19 -8.100 -0.353 -5.741 1.00 0.00 O ATOM 223 CB PRO A 19 -7.670 0.660 -8.846 1.00 0.00 C ATOM 224 CG PRO A 19 -6.325 0.877 -9.448 1.00 0.00 C ATOM 225 CD PRO A 19 -5.817 2.170 -8.871 1.00 0.00 C ATOM 0 HA PRO A 19 -8.500 1.696 -7.081 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.920 -0.400 -8.809 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.449 1.151 -9.430 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -5.653 0.053 -9.210 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -6.388 0.933 -10.535 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -4.734 2.159 -8.752 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -6.058 3.018 -9.512 1.00 0.00 H new ATOM 233 N GLY A 20 -5.937 -0.154 -6.330 1.00 0.00 N ATOM 234 CA GLY A 20 -5.499 -1.173 -5.394 1.00 0.00 C ATOM 235 C GLY A 20 -5.937 -0.882 -3.973 1.00 0.00 C ATOM 236 O GLY A 20 -6.240 -1.800 -3.209 1.00 0.00 O ATOM 0 H GLY A 20 -5.192 0.267 -6.885 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.896 -2.140 -5.702 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.412 -1.250 -5.427 1.00 0.00 H new ATOM 240 N LEU A 21 -5.970 0.397 -3.615 1.00 0.00 N ATOM 241 CA LEU A 21 -6.374 0.806 -2.275 1.00 0.00 C ATOM 242 C LEU A 21 -7.892 0.772 -2.128 1.00 0.00 C ATOM 243 O LEU A 21 -8.422 0.919 -1.027 1.00 0.00 O ATOM 244 CB LEU A 21 -5.853 2.212 -1.971 1.00 0.00 C ATOM 245 CG LEU A 21 -4.438 2.294 -1.396 1.00 0.00 C ATOM 246 CD1 LEU A 21 -3.783 3.613 -1.777 1.00 0.00 C ATOM 247 CD2 LEU A 21 -4.467 2.128 0.116 1.00 0.00 C ATOM 0 H LEU A 21 -5.722 1.168 -4.234 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.943 0.102 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.884 2.796 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.537 2.687 -1.268 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.846 1.482 -1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.777 3.654 -1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.729 3.692 -2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.373 4.440 -1.382 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.452 2.189 0.508 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.075 2.918 0.557 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.895 1.158 0.367 1.00 0.00 H new ATOM 259 N GLU A 22 -8.585 0.574 -3.245 1.00 0.00 N ATOM 260 CA GLU A 22 -10.042 0.518 -3.240 1.00 0.00 C ATOM 261 C GLU A 22 -10.531 -0.927 -3.279 1.00 0.00 C ATOM 262 O GLU A 22 -11.565 -1.260 -2.699 1.00 0.00 O ATOM 263 CB GLU A 22 -10.608 1.293 -4.432 1.00 0.00 C ATOM 264 CG GLU A 22 -10.069 2.708 -4.549 1.00 0.00 C ATOM 265 CD GLU A 22 -11.028 3.640 -5.266 1.00 0.00 C ATOM 266 OE1 GLU A 22 -11.037 3.636 -6.514 1.00 0.00 O ATOM 267 OE2 GLU A 22 -11.769 4.372 -4.577 1.00 0.00 O ATOM 0 H GLU A 22 -8.161 0.450 -4.164 1.00 0.00 H new ATOM 0 HA GLU A 22 -10.395 0.977 -2.317 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.380 0.750 -5.349 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.694 1.333 -4.346 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.865 3.099 -3.552 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.119 2.688 -5.084 1.00 0.00 H new ATOM 274 N HIS A 23 -9.781 -1.781 -3.968 1.00 0.00 N ATOM 275 CA HIS A 23 -10.138 -3.191 -4.084 1.00 0.00 C ATOM 276 C HIS A 23 -9.031 -3.976 -4.780 1.00 0.00 C ATOM 277 O HIS A 23 -8.192 -3.403 -5.474 1.00 0.00 O ATOM 278 CB HIS A 23 -11.450 -3.345 -4.853 1.00 0.00 C ATOM 279 CG HIS A 23 -11.411 -2.753 -6.228 1.00 0.00 C ATOM 280 ND1 HIS A 23 -10.669 -3.290 -7.258 1.00 0.00 N ATOM 281 CD2 HIS A 23 -12.031 -1.663 -6.740 1.00 0.00 C ATOM 282 CE1 HIS A 23 -10.832 -2.556 -8.345 1.00 0.00 C ATOM 283 NE2 HIS A 23 -11.654 -1.563 -8.057 1.00 0.00 N ATOM 0 H HIS A 23 -8.923 -1.522 -4.454 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.266 -3.592 -3.079 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.695 -4.404 -4.929 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.252 -2.873 -4.286 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -12.697 -0.997 -6.212 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -10.372 -2.737 -9.305 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -11.959 -0.839 -8.707 1.00 0.00 H new ATOM 292 N GLY A 24 -9.035 -5.292 -4.590 1.00 0.00 N ATOM 293 CA GLY A 24 -8.026 -6.134 -5.206 1.00 0.00 C ATOM 294 C GLY A 24 -8.554 -7.511 -5.555 1.00 0.00 C ATOM 295 O GLY A 24 -9.647 -7.890 -5.134 1.00 0.00 O ATOM 0 H GLY A 24 -9.719 -5.790 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.656 -5.650 -6.110 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -7.178 -6.234 -4.529 1.00 0.00 H new ATOM 299 N LYS A 25 -7.778 -8.262 -6.329 1.00 0.00 N ATOM 300 CA LYS A 25 -8.173 -9.605 -6.737 1.00 0.00 C ATOM 301 C LYS A 25 -7.007 -10.579 -6.600 1.00 0.00 C ATOM 302 O LYS A 25 -5.858 -10.230 -6.870 1.00 0.00 O ATOM 303 CB LYS A 25 -8.676 -9.594 -8.182 1.00 0.00 C ATOM 304 CG LYS A 25 -9.642 -10.723 -8.497 1.00 0.00 C ATOM 305 CD LYS A 25 -10.104 -10.673 -9.944 1.00 0.00 C ATOM 306 CE LYS A 25 -11.433 -11.391 -10.130 1.00 0.00 C ATOM 307 NZ LYS A 25 -12.010 -11.147 -11.481 1.00 0.00 N ATOM 0 H LYS A 25 -6.871 -7.963 -6.687 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.979 -9.935 -6.081 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.167 -8.641 -8.380 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.822 -9.659 -8.856 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.160 -11.681 -8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.506 -10.659 -7.836 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.203 -9.634 -10.260 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.349 -11.130 -10.584 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.291 -12.462 -9.984 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.137 -11.056 -9.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.915 -11.653 -11.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.169 -10.128 -11.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.350 -11.490 -12.208 1.00 0.00 H new ATOM 321 N VAL A 26 -7.312 -11.804 -6.180 1.00 0.00 N ATOM 322 CA VAL A 26 -6.290 -12.830 -6.011 1.00 0.00 C ATOM 323 C VAL A 26 -5.474 -13.008 -7.286 1.00 0.00 C ATOM 324 O VAL A 26 -5.993 -13.446 -8.312 1.00 0.00 O ATOM 325 CB VAL A 26 -6.913 -14.183 -5.619 1.00 0.00 C ATOM 326 CG1 VAL A 26 -5.834 -15.245 -5.473 1.00 0.00 C ATOM 327 CG2 VAL A 26 -7.716 -14.047 -4.334 1.00 0.00 C ATOM 0 H VAL A 26 -8.258 -12.109 -5.951 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.634 -12.495 -5.208 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.591 -14.495 -6.413 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.293 -16.194 -5.196 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.306 -15.360 -6.420 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.129 -14.943 -4.699 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.149 -15.012 -4.072 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.061 -13.712 -3.529 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.514 -13.319 -4.479 1.00 0.00 H new ATOM 337 N GLY A 27 -4.191 -12.667 -7.214 1.00 0.00 N ATOM 338 CA GLY A 27 -3.322 -12.797 -8.369 1.00 0.00 C ATOM 339 C GLY A 27 -3.165 -11.493 -9.126 1.00 0.00 C ATOM 340 O GLY A 27 -2.129 -11.249 -9.745 1.00 0.00 O ATOM 0 H GLY A 27 -3.738 -12.303 -6.376 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.341 -13.146 -8.045 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.725 -13.556 -9.039 1.00 0.00 H new ATOM 344 N GLU A 28 -4.196 -10.655 -9.079 1.00 0.00 N ATOM 345 CA GLU A 28 -4.167 -9.370 -9.768 1.00 0.00 C ATOM 346 C GLU A 28 -3.045 -8.488 -9.228 1.00 0.00 C ATOM 347 O GLU A 28 -2.291 -8.895 -8.345 1.00 0.00 O ATOM 348 CB GLU A 28 -5.511 -8.655 -9.617 1.00 0.00 C ATOM 349 CG GLU A 28 -6.502 -8.982 -10.722 1.00 0.00 C ATOM 350 CD GLU A 28 -6.030 -8.517 -12.085 1.00 0.00 C ATOM 351 OE1 GLU A 28 -5.779 -7.303 -12.244 1.00 0.00 O ATOM 352 OE2 GLU A 28 -5.911 -9.365 -12.994 1.00 0.00 O ATOM 0 H GLU A 28 -5.061 -10.843 -8.572 1.00 0.00 H new ATOM 0 HA GLU A 28 -3.981 -9.558 -10.825 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.950 -8.923 -8.656 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -5.340 -7.579 -9.600 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.670 -10.059 -10.748 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.461 -8.515 -10.495 1.00 0.00 H new ATOM 359 N ALA A 29 -2.942 -7.277 -9.766 1.00 0.00 N ATOM 360 CA ALA A 29 -1.914 -6.336 -9.339 1.00 0.00 C ATOM 361 C ALA A 29 -2.529 -5.009 -8.908 1.00 0.00 C ATOM 362 O ALA A 29 -3.107 -4.289 -9.722 1.00 0.00 O ATOM 363 CB ALA A 29 -0.903 -6.115 -10.454 1.00 0.00 C ATOM 0 H ALA A 29 -3.558 -6.925 -10.499 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.400 -6.764 -8.479 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -0.142 -5.410 -10.120 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.432 -7.064 -10.711 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.410 -5.713 -11.331 1.00 0.00 H new ATOM 369 N GLY A 30 -2.402 -4.692 -7.623 1.00 0.00 N ATOM 370 CA GLY A 30 -2.952 -3.452 -7.108 1.00 0.00 C ATOM 371 C GLY A 30 -2.164 -2.237 -7.556 1.00 0.00 C ATOM 372 O GLY A 30 -1.077 -1.969 -7.041 1.00 0.00 O ATOM 0 H GLY A 30 -1.928 -5.272 -6.930 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -3.986 -3.352 -7.438 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -2.967 -3.490 -6.019 1.00 0.00 H new ATOM 376 N LEU A 31 -2.709 -1.502 -8.518 1.00 0.00 N ATOM 377 CA LEU A 31 -2.049 -0.309 -9.037 1.00 0.00 C ATOM 378 C LEU A 31 -2.025 0.800 -7.990 1.00 0.00 C ATOM 379 O LEU A 31 -3.072 1.304 -7.581 1.00 0.00 O ATOM 380 CB LEU A 31 -2.758 0.182 -10.300 1.00 0.00 C ATOM 381 CG LEU A 31 -2.816 -0.807 -11.465 1.00 0.00 C ATOM 382 CD1 LEU A 31 -3.696 -0.267 -12.582 1.00 0.00 C ATOM 383 CD2 LEU A 31 -1.416 -1.104 -11.983 1.00 0.00 C ATOM 0 H LEU A 31 -3.607 -1.711 -8.955 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.021 -0.572 -9.284 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.778 0.460 -10.035 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -2.259 1.088 -10.643 1.00 0.00 H new ATOM 0 HG LEU A 31 -3.254 -1.738 -11.104 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.725 -0.985 -13.402 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.706 -0.107 -12.204 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.289 0.678 -12.941 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.477 -1.809 -12.812 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.951 -0.180 -12.327 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.816 -1.536 -11.182 1.00 0.00 H new ATOM 395 N LEU A 32 -0.825 1.176 -7.562 1.00 0.00 N ATOM 396 CA LEU A 32 -0.664 2.227 -6.564 1.00 0.00 C ATOM 397 C LEU A 32 0.360 3.261 -7.022 1.00 0.00 C ATOM 398 O LEU A 32 1.448 2.911 -7.477 1.00 0.00 O ATOM 399 CB LEU A 32 -0.234 1.626 -5.225 1.00 0.00 C ATOM 400 CG LEU A 32 -1.107 0.490 -4.688 1.00 0.00 C ATOM 401 CD1 LEU A 32 -0.542 -0.046 -3.382 1.00 0.00 C ATOM 402 CD2 LEU A 32 -2.540 0.965 -4.495 1.00 0.00 C ATOM 0 H LEU A 32 0.051 0.769 -7.891 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.626 2.725 -6.439 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.786 1.257 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.212 2.423 -4.482 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.108 -0.319 -5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.176 -0.853 -3.015 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.466 -0.424 -3.550 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.511 0.755 -2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.147 0.144 -4.113 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.557 1.791 -3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.944 1.300 -5.450 1.00 0.00 H new ATOM 414 N SER A 33 0.004 4.535 -6.896 1.00 0.00 N ATOM 415 CA SER A 33 0.891 5.620 -7.298 1.00 0.00 C ATOM 416 C SER A 33 1.193 6.541 -6.120 1.00 0.00 C ATOM 417 O SER A 33 0.284 7.032 -5.451 1.00 0.00 O ATOM 418 CB SER A 33 0.264 6.424 -8.439 1.00 0.00 C ATOM 419 OG SER A 33 1.260 6.996 -9.268 1.00 0.00 O ATOM 0 H SER A 33 -0.893 4.841 -6.519 1.00 0.00 H new ATOM 0 HA SER A 33 1.827 5.181 -7.643 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.380 5.776 -9.033 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.368 7.212 -8.028 1.00 0.00 H new ATOM 0 HG SER A 33 0.833 7.503 -9.990 1.00 0.00 H new ATOM 425 N VAL A 34 2.479 6.769 -5.870 1.00 0.00 N ATOM 426 CA VAL A 34 2.903 7.630 -4.773 1.00 0.00 C ATOM 427 C VAL A 34 3.517 8.924 -5.296 1.00 0.00 C ATOM 428 O VAL A 34 4.580 8.912 -5.918 1.00 0.00 O ATOM 429 CB VAL A 34 3.925 6.921 -3.865 1.00 0.00 C ATOM 430 CG1 VAL A 34 4.382 7.847 -2.748 1.00 0.00 C ATOM 431 CG2 VAL A 34 3.333 5.640 -3.297 1.00 0.00 C ATOM 0 H VAL A 34 3.245 6.369 -6.413 1.00 0.00 H new ATOM 0 HA VAL A 34 2.011 7.863 -4.191 1.00 0.00 H new ATOM 0 HB VAL A 34 4.796 6.658 -4.465 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.104 7.328 -2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.848 8.734 -3.178 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.522 8.144 -2.147 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.068 5.152 -2.658 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.445 5.878 -2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 34 3.061 4.971 -4.114 1.00 0.00 H new ATOM 441 N ASP A 35 2.842 10.039 -5.039 1.00 0.00 N ATOM 442 CA ASP A 35 3.322 11.343 -5.483 1.00 0.00 C ATOM 443 C ASP A 35 3.996 12.092 -4.337 1.00 0.00 C ATOM 444 O ASP A 35 3.331 12.565 -3.415 1.00 0.00 O ATOM 445 CB ASP A 35 2.165 12.173 -6.041 1.00 0.00 C ATOM 446 CG ASP A 35 2.606 13.553 -6.488 1.00 0.00 C ATOM 447 OD1 ASP A 35 3.593 14.072 -5.926 1.00 0.00 O ATOM 448 OD2 ASP A 35 1.965 14.113 -7.402 1.00 0.00 O ATOM 0 H ASP A 35 1.961 10.066 -4.526 1.00 0.00 H new ATOM 0 HA ASP A 35 4.057 11.184 -6.272 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.718 11.647 -6.884 1.00 0.00 H new ATOM 0 HB3 ASP A 35 1.391 12.271 -5.279 1.00 0.00 H new ATOM 453 N CYS A 36 5.319 12.196 -4.403 1.00 0.00 N ATOM 454 CA CYS A 36 6.083 12.886 -3.370 1.00 0.00 C ATOM 455 C CYS A 36 6.514 14.270 -3.846 1.00 0.00 C ATOM 456 O CYS A 36 7.068 14.418 -4.935 1.00 0.00 O ATOM 457 CB CYS A 36 7.311 12.063 -2.979 1.00 0.00 C ATOM 458 SG CYS A 36 8.474 11.782 -4.335 1.00 0.00 S ATOM 0 H CYS A 36 5.884 11.812 -5.160 1.00 0.00 H new ATOM 0 HA CYS A 36 5.442 13.005 -2.497 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.832 12.571 -2.167 1.00 0.00 H new ATOM 0 HB3 CYS A 36 6.981 11.099 -2.592 1.00 0.00 H new ATOM 0 HG CYS A 36 7.887 12.030 -5.468 1.00 0.00 H new ATOM 464 N SER A 37 6.253 15.281 -3.023 1.00 0.00 N ATOM 465 CA SER A 37 6.609 16.654 -3.362 1.00 0.00 C ATOM 466 C SER A 37 7.600 17.223 -2.352 1.00 0.00 C ATOM 467 O SER A 37 8.700 17.641 -2.714 1.00 0.00 O ATOM 468 CB SER A 37 5.356 17.530 -3.413 1.00 0.00 C ATOM 469 OG SER A 37 4.650 17.340 -4.627 1.00 0.00 O ATOM 0 H SER A 37 5.796 15.175 -2.117 1.00 0.00 H new ATOM 0 HA SER A 37 7.081 16.649 -4.345 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.707 17.292 -2.570 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.637 18.578 -3.312 1.00 0.00 H new ATOM 0 HG SER A 37 3.853 17.910 -4.634 1.00 0.00 H new ATOM 475 N GLU A 38 7.202 17.236 -1.084 1.00 0.00 N ATOM 476 CA GLU A 38 8.055 17.755 -0.021 1.00 0.00 C ATOM 477 C GLU A 38 8.309 16.690 1.042 1.00 0.00 C ATOM 478 O GLU A 38 8.619 17.006 2.190 1.00 0.00 O ATOM 479 CB GLU A 38 7.417 18.989 0.619 1.00 0.00 C ATOM 480 CG GLU A 38 7.677 20.276 -0.146 1.00 0.00 C ATOM 481 CD GLU A 38 6.781 21.413 0.305 1.00 0.00 C ATOM 482 OE1 GLU A 38 6.512 21.512 1.520 1.00 0.00 O ATOM 483 OE2 GLU A 38 6.350 22.206 -0.559 1.00 0.00 O ATOM 0 H GLU A 38 6.295 16.893 -0.768 1.00 0.00 H new ATOM 0 HA GLU A 38 9.011 18.037 -0.463 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.341 18.833 0.695 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.796 19.098 1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.720 20.567 -0.017 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.525 20.099 -1.211 1.00 0.00 H new ATOM 490 N ALA A 39 8.174 15.427 0.650 1.00 0.00 N ATOM 491 CA ALA A 39 8.389 14.316 1.568 1.00 0.00 C ATOM 492 C ALA A 39 9.864 14.185 1.935 1.00 0.00 C ATOM 493 O ALA A 39 10.218 13.484 2.882 1.00 0.00 O ATOM 494 CB ALA A 39 7.879 13.020 0.956 1.00 0.00 C ATOM 0 H ALA A 39 7.917 15.148 -0.297 1.00 0.00 H new ATOM 0 HA ALA A 39 7.830 14.518 2.482 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.046 12.198 1.652 1.00 0.00 H new ATOM 0 HB2 ALA A 39 6.812 13.110 0.750 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.413 12.822 0.026 1.00 0.00 H new ATOM 500 N GLY A 40 10.720 14.864 1.178 1.00 0.00 N ATOM 501 CA GLY A 40 12.147 14.808 1.439 1.00 0.00 C ATOM 502 C GLY A 40 12.727 13.429 1.198 1.00 0.00 C ATOM 503 O GLY A 40 12.181 12.626 0.441 1.00 0.00 O ATOM 0 H GLY A 40 10.451 15.452 0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.658 15.530 0.802 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.336 15.103 2.471 1.00 0.00 H new ATOM 507 N PRO A 41 13.863 13.139 1.850 1.00 0.00 N ATOM 508 CA PRO A 41 14.543 11.847 1.717 1.00 0.00 C ATOM 509 C PRO A 41 13.763 10.711 2.369 1.00 0.00 C ATOM 510 O PRO A 41 12.575 10.847 2.659 1.00 0.00 O ATOM 511 CB PRO A 41 15.871 12.070 2.446 1.00 0.00 C ATOM 512 CG PRO A 41 15.590 13.159 3.422 1.00 0.00 C ATOM 513 CD PRO A 41 14.569 14.048 2.768 1.00 0.00 C ATOM 0 HA PRO A 41 14.657 11.552 0.674 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.203 11.162 2.950 1.00 0.00 H new ATOM 0 HB3 PRO A 41 16.661 12.355 1.751 1.00 0.00 H new ATOM 0 HG2 PRO A 41 15.211 12.754 4.360 1.00 0.00 H new ATOM 0 HG3 PRO A 41 16.497 13.715 3.658 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.891 14.487 3.500 1.00 0.00 H new ATOM 0 HD3 PRO A 41 15.039 14.874 2.234 1.00 0.00 H new ATOM 521 N GLY A 42 14.439 9.589 2.596 1.00 0.00 N ATOM 522 CA GLY A 42 13.792 8.445 3.212 1.00 0.00 C ATOM 523 C GLY A 42 13.406 7.383 2.202 1.00 0.00 C ATOM 524 O GLY A 42 13.034 7.698 1.072 1.00 0.00 O ATOM 0 H GLY A 42 15.423 9.452 2.364 1.00 0.00 H new ATOM 0 HA2 GLY A 42 14.461 8.010 3.954 1.00 0.00 H new ATOM 0 HA3 GLY A 42 12.900 8.778 3.743 1.00 0.00 H new ATOM 528 N ALA A 43 13.497 6.121 2.608 1.00 0.00 N ATOM 529 CA ALA A 43 13.155 5.009 1.730 1.00 0.00 C ATOM 530 C ALA A 43 11.710 4.568 1.940 1.00 0.00 C ATOM 531 O ALA A 43 11.234 4.485 3.073 1.00 0.00 O ATOM 532 CB ALA A 43 14.103 3.842 1.961 1.00 0.00 C ATOM 0 H ALA A 43 13.805 5.843 3.540 1.00 0.00 H new ATOM 0 HA ALA A 43 13.258 5.348 0.699 1.00 0.00 H new ATOM 0 HB1 ALA A 43 13.835 3.019 1.298 1.00 0.00 H new ATOM 0 HB2 ALA A 43 15.126 4.157 1.753 1.00 0.00 H new ATOM 0 HB3 ALA A 43 14.028 3.512 2.997 1.00 0.00 H new ATOM 538 N LEU A 44 11.017 4.287 0.842 1.00 0.00 N ATOM 539 CA LEU A 44 9.625 3.855 0.906 1.00 0.00 C ATOM 540 C LEU A 44 9.528 2.334 0.939 1.00 0.00 C ATOM 541 O LEU A 44 10.337 1.636 0.329 1.00 0.00 O ATOM 542 CB LEU A 44 8.845 4.401 -0.291 1.00 0.00 C ATOM 543 CG LEU A 44 7.543 3.676 -0.632 1.00 0.00 C ATOM 544 CD1 LEU A 44 6.489 3.943 0.432 1.00 0.00 C ATOM 545 CD2 LEU A 44 7.038 4.101 -2.003 1.00 0.00 C ATOM 0 H LEU A 44 11.396 4.350 -0.103 1.00 0.00 H new ATOM 0 HA LEU A 44 9.191 4.249 1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.614 5.449 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.494 4.371 -1.166 1.00 0.00 H new ATOM 0 HG LEU A 44 7.743 2.605 -0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.569 3.419 0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.849 3.588 1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.293 5.014 0.489 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.111 3.575 -2.228 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.855 5.176 -2.006 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.786 3.858 -2.758 1.00 0.00 H new ATOM 557 N GLY A 45 8.530 1.824 1.656 1.00 0.00 N ATOM 558 CA GLY A 45 8.344 0.388 1.754 1.00 0.00 C ATOM 559 C GLY A 45 6.944 0.014 2.199 1.00 0.00 C ATOM 560 O GLY A 45 6.440 0.537 3.194 1.00 0.00 O ATOM 0 H GLY A 45 7.847 2.380 2.171 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.548 -0.069 0.786 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.068 -0.022 2.459 1.00 0.00 H new ATOM 564 N LEU A 46 6.313 -0.893 1.461 1.00 0.00 N ATOM 565 CA LEU A 46 4.962 -1.336 1.784 1.00 0.00 C ATOM 566 C LEU A 46 4.960 -2.793 2.236 1.00 0.00 C ATOM 567 O LEU A 46 5.801 -3.585 1.811 1.00 0.00 O ATOM 568 CB LEU A 46 4.044 -1.164 0.573 1.00 0.00 C ATOM 569 CG LEU A 46 2.596 -1.620 0.757 1.00 0.00 C ATOM 570 CD1 LEU A 46 1.771 -0.524 1.412 1.00 0.00 C ATOM 571 CD2 LEU A 46 1.989 -2.022 -0.579 1.00 0.00 C ATOM 0 H LEU A 46 6.716 -1.336 0.635 1.00 0.00 H new ATOM 0 HA LEU A 46 4.591 -0.720 2.603 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.039 -0.111 0.293 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.473 -1.714 -0.264 1.00 0.00 H new ATOM 0 HG LEU A 46 2.590 -2.491 1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.743 -0.866 1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.193 -0.285 2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.784 0.366 0.783 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.958 -2.344 -0.428 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.008 -1.170 -1.258 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.566 -2.841 -1.009 1.00 0.00 H new ATOM 583 N GLU A 47 4.008 -3.139 3.097 1.00 0.00 N ATOM 584 CA GLU A 47 3.897 -4.502 3.604 1.00 0.00 C ATOM 585 C GLU A 47 2.460 -5.006 3.500 1.00 0.00 C ATOM 586 O GLU A 47 1.556 -4.471 4.141 1.00 0.00 O ATOM 587 CB GLU A 47 4.368 -4.569 5.058 1.00 0.00 C ATOM 588 CG GLU A 47 4.327 -5.968 5.647 1.00 0.00 C ATOM 589 CD GLU A 47 5.586 -6.761 5.356 1.00 0.00 C ATOM 590 OE1 GLU A 47 6.135 -6.616 4.243 1.00 0.00 O ATOM 591 OE2 GLU A 47 6.023 -7.527 6.240 1.00 0.00 O ATOM 0 H GLU A 47 3.304 -2.495 3.458 1.00 0.00 H new ATOM 0 HA GLU A 47 4.534 -5.142 2.993 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.387 -4.188 5.119 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.745 -3.911 5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.186 -5.900 6.726 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.465 -6.502 5.246 1.00 0.00 H new ATOM 598 N ALA A 48 2.258 -6.037 2.686 1.00 0.00 N ATOM 599 CA ALA A 48 0.933 -6.614 2.498 1.00 0.00 C ATOM 600 C ALA A 48 0.749 -7.859 3.359 1.00 0.00 C ATOM 601 O ALA A 48 1.539 -8.801 3.283 1.00 0.00 O ATOM 602 CB ALA A 48 0.705 -6.946 1.031 1.00 0.00 C ATOM 0 H ALA A 48 2.996 -6.490 2.146 1.00 0.00 H new ATOM 0 HA ALA A 48 0.195 -5.876 2.811 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.289 -7.376 0.905 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.785 -6.037 0.436 1.00 0.00 H new ATOM 0 HB3 ALA A 48 1.456 -7.664 0.699 1.00 0.00 H new ATOM 608 N VAL A 49 -0.297 -7.857 4.178 1.00 0.00 N ATOM 609 CA VAL A 49 -0.585 -8.987 5.054 1.00 0.00 C ATOM 610 C VAL A 49 -2.087 -9.166 5.245 1.00 0.00 C ATOM 611 O VAL A 49 -2.795 -8.223 5.594 1.00 0.00 O ATOM 612 CB VAL A 49 0.079 -8.812 6.432 1.00 0.00 C ATOM 613 CG1 VAL A 49 -0.332 -9.937 7.370 1.00 0.00 C ATOM 614 CG2 VAL A 49 1.593 -8.752 6.290 1.00 0.00 C ATOM 0 H VAL A 49 -0.960 -7.085 4.254 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.175 -9.874 4.571 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.261 -7.870 6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.147 -9.796 8.339 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.415 -9.928 7.496 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.023 -10.893 6.948 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.046 -8.628 7.274 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.953 -9.676 5.838 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.866 -7.908 5.656 1.00 0.00 H new ATOM 624 N SER A 50 -2.566 -10.384 5.012 1.00 0.00 N ATOM 625 CA SER A 50 -3.985 -10.687 5.155 1.00 0.00 C ATOM 626 C SER A 50 -4.295 -11.189 6.563 1.00 0.00 C ATOM 627 O SER A 50 -3.406 -11.652 7.278 1.00 0.00 O ATOM 628 CB SER A 50 -4.412 -11.733 4.124 1.00 0.00 C ATOM 629 OG SER A 50 -5.822 -11.768 3.985 1.00 0.00 O ATOM 0 H SER A 50 -1.992 -11.177 4.724 1.00 0.00 H new ATOM 0 HA SER A 50 -4.546 -9.768 4.984 1.00 0.00 H new ATOM 0 HB2 SER A 50 -3.954 -11.507 3.161 1.00 0.00 H new ATOM 0 HB3 SER A 50 -4.049 -12.715 4.426 1.00 0.00 H new ATOM 0 HG SER A 50 -6.194 -10.888 4.204 1.00 0.00 H new ATOM 635 N ASP A 51 -5.561 -11.094 6.953 1.00 0.00 N ATOM 636 CA ASP A 51 -5.990 -11.538 8.274 1.00 0.00 C ATOM 637 C ASP A 51 -5.400 -12.906 8.605 1.00 0.00 C ATOM 638 O ASP A 51 -5.102 -13.201 9.762 1.00 0.00 O ATOM 639 CB ASP A 51 -7.516 -11.596 8.345 1.00 0.00 C ATOM 640 CG ASP A 51 -8.177 -10.571 7.446 1.00 0.00 C ATOM 641 OD1 ASP A 51 -7.850 -9.372 7.572 1.00 0.00 O ATOM 642 OD2 ASP A 51 -9.023 -10.966 6.616 1.00 0.00 O ATOM 0 H ASP A 51 -6.309 -10.713 6.373 1.00 0.00 H new ATOM 0 HA ASP A 51 -5.627 -10.818 9.008 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -7.852 -12.594 8.062 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -7.835 -11.432 9.374 1.00 0.00 H new ATOM 647 N SER A 52 -5.235 -13.737 7.581 1.00 0.00 N ATOM 648 CA SER A 52 -4.686 -15.075 7.763 1.00 0.00 C ATOM 649 C SER A 52 -3.164 -15.057 7.661 1.00 0.00 C ATOM 650 O SER A 52 -2.548 -16.024 7.216 1.00 0.00 O ATOM 651 CB SER A 52 -5.267 -16.034 6.722 1.00 0.00 C ATOM 652 OG SER A 52 -6.518 -16.548 7.144 1.00 0.00 O ATOM 0 H SER A 52 -5.474 -13.507 6.616 1.00 0.00 H new ATOM 0 HA SER A 52 -4.962 -15.421 8.759 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.386 -15.515 5.771 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.571 -16.856 6.552 1.00 0.00 H new ATOM 0 HG SER A 52 -6.869 -17.157 6.461 1.00 0.00 H new ATOM 658 N GLY A 53 -2.563 -13.946 8.077 1.00 0.00 N ATOM 659 CA GLY A 53 -1.118 -13.821 8.025 1.00 0.00 C ATOM 660 C GLY A 53 -0.549 -14.232 6.682 1.00 0.00 C ATOM 661 O GLY A 53 0.401 -15.014 6.614 1.00 0.00 O ATOM 0 H GLY A 53 -3.051 -13.131 8.449 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -0.838 -12.789 8.234 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -0.675 -14.437 8.808 1.00 0.00 H new ATOM 665 N THR A 54 -1.131 -13.707 5.608 1.00 0.00 N ATOM 666 CA THR A 54 -0.678 -14.027 4.260 1.00 0.00 C ATOM 667 C THR A 54 0.115 -12.872 3.658 1.00 0.00 C ATOM 668 O THR A 54 -0.456 -11.868 3.234 1.00 0.00 O ATOM 669 CB THR A 54 -1.863 -14.359 3.333 1.00 0.00 C ATOM 670 OG1 THR A 54 -2.761 -15.260 3.991 1.00 0.00 O ATOM 671 CG2 THR A 54 -1.375 -14.981 2.033 1.00 0.00 C ATOM 0 H THR A 54 -1.917 -13.058 5.646 1.00 0.00 H new ATOM 0 HA THR A 54 -0.034 -14.903 4.342 1.00 0.00 H new ATOM 0 HB THR A 54 -2.385 -13.431 3.100 1.00 0.00 H new ATOM 0 HG1 THR A 54 -3.686 -15.004 3.792 1.00 0.00 H new ATOM 0 HG21 THR A 54 -2.229 -15.207 1.395 1.00 0.00 H new ATOM 0 HG22 THR A 54 -0.714 -14.282 1.521 1.00 0.00 H new ATOM 0 HG23 THR A 54 -0.832 -15.901 2.251 1.00 0.00 H new ATOM 679 N LYS A 55 1.435 -13.022 3.623 1.00 0.00 N ATOM 680 CA LYS A 55 2.307 -11.993 3.071 1.00 0.00 C ATOM 681 C LYS A 55 2.265 -12.004 1.546 1.00 0.00 C ATOM 682 O LYS A 55 2.737 -12.946 0.910 1.00 0.00 O ATOM 683 CB LYS A 55 3.745 -12.201 3.553 1.00 0.00 C ATOM 684 CG LYS A 55 3.892 -12.150 5.064 1.00 0.00 C ATOM 685 CD LYS A 55 5.185 -12.804 5.521 1.00 0.00 C ATOM 686 CE LYS A 55 5.297 -12.820 7.037 1.00 0.00 C ATOM 687 NZ LYS A 55 4.524 -13.943 7.638 1.00 0.00 N ATOM 0 H LYS A 55 1.924 -13.847 3.971 1.00 0.00 H new ATOM 0 HA LYS A 55 1.949 -11.024 3.420 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.104 -13.165 3.194 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.383 -11.437 3.108 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.870 -11.113 5.398 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.044 -12.653 5.530 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.232 -13.825 5.141 1.00 0.00 H new ATOM 0 HD3 LYS A 55 6.034 -12.267 5.098 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.345 -12.907 7.323 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.934 -11.874 7.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.626 -13.920 8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.519 -13.847 7.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.887 -14.848 7.275 1.00 0.00 H new ATOM 701 N ALA A 56 1.699 -10.951 0.966 1.00 0.00 N ATOM 702 CA ALA A 56 1.599 -10.839 -0.484 1.00 0.00 C ATOM 703 C ALA A 56 2.828 -10.151 -1.067 1.00 0.00 C ATOM 704 O ALA A 56 3.412 -9.268 -0.439 1.00 0.00 O ATOM 705 CB ALA A 56 0.336 -10.083 -0.869 1.00 0.00 C ATOM 0 H ALA A 56 1.303 -10.163 1.478 1.00 0.00 H new ATOM 0 HA ALA A 56 1.547 -11.846 -0.899 1.00 0.00 H new ATOM 0 HB1 ALA A 56 0.274 -10.007 -1.955 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.537 -10.617 -0.492 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.364 -9.083 -0.436 1.00 0.00 H new ATOM 711 N GLU A 57 3.215 -10.561 -2.271 1.00 0.00 N ATOM 712 CA GLU A 57 4.376 -9.983 -2.937 1.00 0.00 C ATOM 713 C GLU A 57 4.168 -8.495 -3.201 1.00 0.00 C ATOM 714 O GLU A 57 3.092 -8.072 -3.623 1.00 0.00 O ATOM 715 CB GLU A 57 4.651 -10.712 -4.255 1.00 0.00 C ATOM 716 CG GLU A 57 6.097 -10.618 -4.712 1.00 0.00 C ATOM 717 CD GLU A 57 6.352 -9.413 -5.596 1.00 0.00 C ATOM 718 OE1 GLU A 57 5.405 -8.962 -6.273 1.00 0.00 O ATOM 719 OE2 GLU A 57 7.500 -8.920 -5.609 1.00 0.00 O ATOM 0 H GLU A 57 2.742 -11.290 -2.804 1.00 0.00 H new ATOM 0 HA GLU A 57 5.236 -10.100 -2.278 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.382 -11.762 -4.143 1.00 0.00 H new ATOM 0 HB3 GLU A 57 4.006 -10.299 -5.030 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.748 -10.568 -3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.362 -11.525 -5.255 1.00 0.00 H new ATOM 726 N VAL A 58 5.207 -7.704 -2.948 1.00 0.00 N ATOM 727 CA VAL A 58 5.140 -6.263 -3.158 1.00 0.00 C ATOM 728 C VAL A 58 6.383 -5.754 -3.877 1.00 0.00 C ATOM 729 O VAL A 58 7.498 -6.194 -3.598 1.00 0.00 O ATOM 730 CB VAL A 58 4.987 -5.508 -1.824 1.00 0.00 C ATOM 731 CG1 VAL A 58 4.898 -4.009 -2.065 1.00 0.00 C ATOM 732 CG2 VAL A 58 3.765 -6.008 -1.067 1.00 0.00 C ATOM 0 H VAL A 58 6.105 -8.038 -2.597 1.00 0.00 H new ATOM 0 HA VAL A 58 4.263 -6.074 -3.777 1.00 0.00 H new ATOM 0 HB VAL A 58 5.869 -5.701 -1.214 1.00 0.00 H new ATOM 0 HG11 VAL A 58 4.790 -3.493 -1.111 1.00 0.00 H new ATOM 0 HG12 VAL A 58 5.805 -3.666 -2.563 1.00 0.00 H new ATOM 0 HG13 VAL A 58 4.035 -3.792 -2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.672 -5.464 -0.127 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.872 -5.846 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.875 -7.073 -0.861 1.00 0.00 H new ATOM 742 N SER A 59 6.184 -4.823 -4.805 1.00 0.00 N ATOM 743 CA SER A 59 7.289 -4.255 -5.568 1.00 0.00 C ATOM 744 C SER A 59 7.178 -2.735 -5.637 1.00 0.00 C ATOM 745 O SER A 59 6.087 -2.189 -5.805 1.00 0.00 O ATOM 746 CB SER A 59 7.315 -4.840 -6.982 1.00 0.00 C ATOM 747 OG SER A 59 8.305 -4.211 -7.776 1.00 0.00 O ATOM 0 H SER A 59 5.267 -4.446 -5.046 1.00 0.00 H new ATOM 0 HA SER A 59 8.218 -4.511 -5.059 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.511 -5.911 -6.932 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.338 -4.716 -7.448 1.00 0.00 H new ATOM 0 HG SER A 59 8.302 -4.604 -8.674 1.00 0.00 H new ATOM 753 N ILE A 60 8.314 -2.059 -5.506 1.00 0.00 N ATOM 754 CA ILE A 60 8.344 -0.602 -5.554 1.00 0.00 C ATOM 755 C ILE A 60 9.337 -0.107 -6.600 1.00 0.00 C ATOM 756 O ILE A 60 10.525 -0.423 -6.540 1.00 0.00 O ATOM 757 CB ILE A 60 8.717 -0.002 -4.185 1.00 0.00 C ATOM 758 CG1 ILE A 60 7.705 -0.434 -3.122 1.00 0.00 C ATOM 759 CG2 ILE A 60 8.785 1.516 -4.274 1.00 0.00 C ATOM 760 CD1 ILE A 60 8.249 -0.375 -1.711 1.00 0.00 C ATOM 0 H ILE A 60 9.225 -2.496 -5.366 1.00 0.00 H new ATOM 0 HA ILE A 60 7.340 -0.274 -5.825 1.00 0.00 H new ATOM 0 HB ILE A 60 9.700 -0.374 -3.896 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.824 0.204 -3.190 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.379 -1.452 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 60 9.050 1.926 -3.299 1.00 0.00 H new ATOM 0 HG22 ILE A 60 9.540 1.804 -5.006 1.00 0.00 H new ATOM 0 HG23 ILE A 60 7.815 1.906 -4.581 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.478 -0.695 -1.010 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.113 -1.035 -1.626 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.549 0.647 -1.479 1.00 0.00 H new ATOM 772 N GLN A 61 8.841 0.670 -7.557 1.00 0.00 N ATOM 773 CA GLN A 61 9.685 1.210 -8.617 1.00 0.00 C ATOM 774 C GLN A 61 10.054 2.662 -8.333 1.00 0.00 C ATOM 775 O GLN A 61 9.212 3.455 -7.912 1.00 0.00 O ATOM 776 CB GLN A 61 8.974 1.106 -9.967 1.00 0.00 C ATOM 777 CG GLN A 61 9.791 1.651 -11.128 1.00 0.00 C ATOM 778 CD GLN A 61 10.814 0.656 -11.640 1.00 0.00 C ATOM 779 OE1 GLN A 61 11.900 0.520 -11.077 1.00 0.00 O ATOM 780 NE2 GLN A 61 10.471 -0.047 -12.713 1.00 0.00 N ATOM 0 H GLN A 61 7.859 0.940 -7.621 1.00 0.00 H new ATOM 0 HA GLN A 61 10.602 0.622 -8.652 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.733 0.061 -10.162 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.029 1.646 -9.913 1.00 0.00 H new ATOM 0 HG2 GLN A 61 9.120 1.927 -11.941 1.00 0.00 H new ATOM 0 HG3 GLN A 61 10.301 2.561 -10.813 1.00 0.00 H new ATOM 0 HE21 GLN A 61 9.560 0.098 -13.148 1.00 0.00 H new ATOM 0 HE22 GLN A 61 11.119 -0.732 -13.102 1.00 0.00 H new ATOM 789 N ASN A 62 11.317 3.003 -8.566 1.00 0.00 N ATOM 790 CA ASN A 62 11.797 4.361 -8.334 1.00 0.00 C ATOM 791 C ASN A 62 11.976 5.107 -9.652 1.00 0.00 C ATOM 792 O ASN A 62 12.552 4.580 -10.602 1.00 0.00 O ATOM 793 CB ASN A 62 13.121 4.332 -7.568 1.00 0.00 C ATOM 794 CG ASN A 62 13.006 3.609 -6.240 1.00 0.00 C ATOM 795 OD1 ASN A 62 12.049 2.871 -6.003 1.00 0.00 O ATOM 796 ND2 ASN A 62 13.983 3.818 -5.366 1.00 0.00 N ATOM 0 H ASN A 62 12.026 2.359 -8.915 1.00 0.00 H new ATOM 0 HA ASN A 62 11.051 4.887 -7.738 1.00 0.00 H new ATOM 0 HB2 ASN A 62 13.880 3.844 -8.179 1.00 0.00 H new ATOM 0 HB3 ASN A 62 13.459 5.353 -7.394 1.00 0.00 H new ATOM 0 HD21 ASN A 62 13.960 3.359 -4.456 1.00 0.00 H new ATOM 0 HD22 ASN A 62 14.757 4.438 -5.605 1.00 0.00 H new ATOM 803 N ASN A 63 11.476 6.338 -9.701 1.00 0.00 N ATOM 804 CA ASN A 63 11.580 7.158 -10.903 1.00 0.00 C ATOM 805 C ASN A 63 12.296 8.472 -10.605 1.00 0.00 C ATOM 806 O ASN A 63 12.235 8.986 -9.488 1.00 0.00 O ATOM 807 CB ASN A 63 10.190 7.440 -11.475 1.00 0.00 C ATOM 808 CG ASN A 63 9.566 6.213 -12.111 1.00 0.00 C ATOM 809 OD1 ASN A 63 10.059 5.703 -13.118 1.00 0.00 O ATOM 810 ND2 ASN A 63 8.476 5.732 -11.525 1.00 0.00 N ATOM 0 H ASN A 63 10.995 6.789 -8.923 1.00 0.00 H new ATOM 0 HA ASN A 63 12.163 6.606 -11.640 1.00 0.00 H new ATOM 0 HB2 ASN A 63 9.540 7.804 -10.679 1.00 0.00 H new ATOM 0 HB3 ASN A 63 10.260 8.235 -12.218 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.013 4.908 -11.908 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.102 6.187 -10.692 1.00 0.00 H new ATOM 817 N LYS A 64 12.975 9.011 -11.613 1.00 0.00 N ATOM 818 CA LYS A 64 13.701 10.266 -11.461 1.00 0.00 C ATOM 819 C LYS A 64 12.780 11.459 -11.693 1.00 0.00 C ATOM 820 O LYS A 64 13.241 12.566 -11.974 1.00 0.00 O ATOM 821 CB LYS A 64 14.878 10.319 -12.439 1.00 0.00 C ATOM 822 CG LYS A 64 16.024 11.195 -11.964 1.00 0.00 C ATOM 823 CD LYS A 64 17.099 11.332 -13.028 1.00 0.00 C ATOM 824 CE LYS A 64 17.998 10.106 -13.074 1.00 0.00 C ATOM 825 NZ LYS A 64 18.930 10.058 -11.913 1.00 0.00 N ATOM 0 H LYS A 64 13.037 8.598 -12.544 1.00 0.00 H new ATOM 0 HA LYS A 64 14.081 10.316 -10.441 1.00 0.00 H new ATOM 0 HB2 LYS A 64 15.249 9.307 -12.603 1.00 0.00 H new ATOM 0 HB3 LYS A 64 14.524 10.689 -13.401 1.00 0.00 H new ATOM 0 HG2 LYS A 64 15.644 12.182 -11.701 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.458 10.769 -11.060 1.00 0.00 H new ATOM 0 HD2 LYS A 64 16.632 11.478 -14.002 1.00 0.00 H new ATOM 0 HD3 LYS A 64 17.701 12.218 -12.827 1.00 0.00 H new ATOM 0 HE2 LYS A 64 17.384 9.205 -13.084 1.00 0.00 H new ATOM 0 HE3 LYS A 64 18.572 10.111 -14.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 19.665 9.344 -12.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 19.375 10.989 -11.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 18.401 9.807 -11.053 1.00 0.00 H new ATOM 839 N ASP A 65 11.478 11.228 -11.571 1.00 0.00 N ATOM 840 CA ASP A 65 10.492 12.285 -11.765 1.00 0.00 C ATOM 841 C ASP A 65 9.970 12.794 -10.424 1.00 0.00 C ATOM 842 O ASP A 65 9.881 14.000 -10.199 1.00 0.00 O ATOM 843 CB ASP A 65 9.329 11.777 -12.619 1.00 0.00 C ATOM 844 CG ASP A 65 8.122 12.692 -12.556 1.00 0.00 C ATOM 845 OD1 ASP A 65 7.407 12.660 -11.533 1.00 0.00 O ATOM 846 OD2 ASP A 65 7.892 13.439 -13.530 1.00 0.00 O ATOM 0 H ASP A 65 11.080 10.318 -11.339 1.00 0.00 H new ATOM 0 HA ASP A 65 10.979 13.111 -12.283 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.656 11.683 -13.654 1.00 0.00 H new ATOM 0 HB3 ASP A 65 9.044 10.780 -12.283 1.00 0.00 H new ATOM 851 N GLY A 66 9.626 11.864 -9.538 1.00 0.00 N ATOM 852 CA GLY A 66 9.117 12.238 -8.231 1.00 0.00 C ATOM 853 C GLY A 66 7.932 11.393 -7.807 1.00 0.00 C ATOM 854 O GLY A 66 7.048 11.864 -7.090 1.00 0.00 O ATOM 0 H GLY A 66 9.691 10.859 -9.702 1.00 0.00 H new ATOM 0 HA2 GLY A 66 9.913 12.139 -7.493 1.00 0.00 H new ATOM 0 HA3 GLY A 66 8.824 13.288 -8.245 1.00 0.00 H new ATOM 858 N THR A 67 7.911 10.141 -8.253 1.00 0.00 N ATOM 859 CA THR A 67 6.824 9.229 -7.918 1.00 0.00 C ATOM 860 C THR A 67 7.332 7.799 -7.771 1.00 0.00 C ATOM 861 O THR A 67 8.507 7.520 -8.011 1.00 0.00 O ATOM 862 CB THR A 67 5.715 9.261 -8.986 1.00 0.00 C ATOM 863 OG1 THR A 67 6.245 8.862 -10.255 1.00 0.00 O ATOM 864 CG2 THR A 67 5.111 10.653 -9.098 1.00 0.00 C ATOM 0 H THR A 67 8.634 9.735 -8.847 1.00 0.00 H new ATOM 0 HA THR A 67 6.411 9.565 -6.967 1.00 0.00 H new ATOM 0 HB THR A 67 4.932 8.566 -8.685 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.533 8.883 -10.928 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.330 10.651 -9.859 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.682 10.942 -8.138 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.887 11.365 -9.377 1.00 0.00 H new ATOM 872 N TYR A 68 6.440 6.898 -7.377 1.00 0.00 N ATOM 873 CA TYR A 68 6.798 5.496 -7.196 1.00 0.00 C ATOM 874 C TYR A 68 5.658 4.581 -7.633 1.00 0.00 C ATOM 875 O TYR A 68 4.484 4.915 -7.475 1.00 0.00 O ATOM 876 CB TYR A 68 7.155 5.223 -5.734 1.00 0.00 C ATOM 877 CG TYR A 68 8.323 6.042 -5.232 1.00 0.00 C ATOM 878 CD1 TYR A 68 8.184 7.400 -4.973 1.00 0.00 C ATOM 879 CD2 TYR A 68 9.565 5.457 -5.017 1.00 0.00 C ATOM 880 CE1 TYR A 68 9.249 8.152 -4.515 1.00 0.00 C ATOM 881 CE2 TYR A 68 10.635 6.201 -4.558 1.00 0.00 C ATOM 882 CZ TYR A 68 10.472 7.548 -4.309 1.00 0.00 C ATOM 883 OH TYR A 68 11.534 8.294 -3.852 1.00 0.00 O ATOM 0 H TYR A 68 5.463 7.113 -7.177 1.00 0.00 H new ATOM 0 HA TYR A 68 7.667 5.286 -7.820 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.284 5.429 -5.112 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.388 4.165 -5.617 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.228 7.876 -5.132 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.696 4.403 -5.212 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.125 9.207 -4.319 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.593 5.731 -4.395 1.00 0.00 H new ATOM 0 HH TYR A 68 12.322 7.719 -3.759 1.00 0.00 H new ATOM 893 N ALA A 69 6.013 3.424 -8.182 1.00 0.00 N ATOM 894 CA ALA A 69 5.021 2.459 -8.639 1.00 0.00 C ATOM 895 C ALA A 69 4.972 1.245 -7.718 1.00 0.00 C ATOM 896 O ALA A 69 5.830 0.365 -7.787 1.00 0.00 O ATOM 897 CB ALA A 69 5.323 2.029 -10.067 1.00 0.00 C ATOM 0 H ALA A 69 6.980 3.132 -8.321 1.00 0.00 H new ATOM 0 HA ALA A 69 4.043 2.940 -8.615 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.574 1.308 -10.396 1.00 0.00 H new ATOM 0 HB2 ALA A 69 5.300 2.900 -10.722 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.311 1.570 -10.108 1.00 0.00 H new ATOM 903 N VAL A 70 3.961 1.203 -6.855 1.00 0.00 N ATOM 904 CA VAL A 70 3.799 0.096 -5.920 1.00 0.00 C ATOM 905 C VAL A 70 2.692 -0.849 -6.374 1.00 0.00 C ATOM 906 O VAL A 70 1.656 -0.414 -6.878 1.00 0.00 O ATOM 907 CB VAL A 70 3.478 0.603 -4.502 1.00 0.00 C ATOM 908 CG1 VAL A 70 3.027 -0.547 -3.614 1.00 0.00 C ATOM 909 CG2 VAL A 70 4.684 1.309 -3.902 1.00 0.00 C ATOM 0 H VAL A 70 3.242 1.923 -6.784 1.00 0.00 H new ATOM 0 HA VAL A 70 4.746 -0.443 -5.899 1.00 0.00 H new ATOM 0 HB VAL A 70 2.662 1.322 -4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.804 -0.170 -2.616 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.133 -1.004 -4.037 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.821 -1.292 -3.552 1.00 0.00 H new ATOM 0 HG21 VAL A 70 4.438 1.661 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 70 5.522 0.615 -3.848 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.957 2.159 -4.528 1.00 0.00 H new ATOM 919 N THR A 71 2.918 -2.146 -6.192 1.00 0.00 N ATOM 920 CA THR A 71 1.941 -3.154 -6.582 1.00 0.00 C ATOM 921 C THR A 71 1.949 -4.332 -5.615 1.00 0.00 C ATOM 922 O THR A 71 2.981 -4.661 -5.030 1.00 0.00 O ATOM 923 CB THR A 71 2.209 -3.674 -8.008 1.00 0.00 C ATOM 924 OG1 THR A 71 2.668 -2.603 -8.841 1.00 0.00 O ATOM 925 CG2 THR A 71 0.951 -4.285 -8.606 1.00 0.00 C ATOM 0 H THR A 71 3.770 -2.523 -5.777 1.00 0.00 H new ATOM 0 HA THR A 71 0.963 -2.673 -6.556 1.00 0.00 H new ATOM 0 HB THR A 71 2.977 -4.445 -7.952 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.838 -2.941 -9.745 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.164 -4.645 -9.612 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.620 -5.118 -7.985 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.165 -3.531 -8.649 1.00 0.00 H new ATOM 933 N TYR A 72 0.792 -4.965 -5.451 1.00 0.00 N ATOM 934 CA TYR A 72 0.666 -6.106 -4.552 1.00 0.00 C ATOM 935 C TYR A 72 -0.192 -7.201 -5.179 1.00 0.00 C ATOM 936 O TYR A 72 -1.277 -6.936 -5.696 1.00 0.00 O ATOM 937 CB TYR A 72 0.058 -5.667 -3.218 1.00 0.00 C ATOM 938 CG TYR A 72 -1.432 -5.421 -3.284 1.00 0.00 C ATOM 939 CD1 TYR A 72 -2.336 -6.466 -3.134 1.00 0.00 C ATOM 940 CD2 TYR A 72 -1.937 -4.144 -3.495 1.00 0.00 C ATOM 941 CE1 TYR A 72 -3.698 -6.246 -3.194 1.00 0.00 C ATOM 942 CE2 TYR A 72 -3.298 -3.914 -3.555 1.00 0.00 C ATOM 943 CZ TYR A 72 -4.174 -4.969 -3.405 1.00 0.00 C ATOM 944 OH TYR A 72 -5.531 -4.745 -3.464 1.00 0.00 O ATOM 0 H TYR A 72 -0.071 -4.707 -5.929 1.00 0.00 H new ATOM 0 HA TYR A 72 1.663 -6.508 -4.374 1.00 0.00 H new ATOM 0 HB2 TYR A 72 0.259 -6.432 -2.468 1.00 0.00 H new ATOM 0 HB3 TYR A 72 0.554 -4.755 -2.885 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -1.967 -7.467 -2.968 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -1.253 -3.316 -3.614 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -4.387 -7.070 -3.076 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.674 -2.915 -3.718 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.709 -3.787 -3.360 1.00 0.00 H new ATOM 954 N VAL A 73 0.303 -8.433 -5.128 1.00 0.00 N ATOM 955 CA VAL A 73 -0.417 -9.570 -5.688 1.00 0.00 C ATOM 956 C VAL A 73 -0.845 -10.543 -4.595 1.00 0.00 C ATOM 957 O VAL A 73 -0.059 -11.357 -4.111 1.00 0.00 O ATOM 958 CB VAL A 73 0.441 -10.323 -6.723 1.00 0.00 C ATOM 959 CG1 VAL A 73 -0.330 -11.501 -7.300 1.00 0.00 C ATOM 960 CG2 VAL A 73 0.894 -9.380 -7.826 1.00 0.00 C ATOM 0 H VAL A 73 1.200 -8.669 -4.704 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.303 -9.171 -6.182 1.00 0.00 H new ATOM 0 HB VAL A 73 1.328 -10.711 -6.221 1.00 0.00 H new ATOM 0 HG11 VAL A 73 0.292 -12.021 -8.029 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -0.599 -12.188 -6.498 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.235 -11.140 -7.787 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.499 -9.929 -8.548 1.00 0.00 H new ATOM 0 HG22 VAL A 73 0.022 -8.961 -8.327 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.487 -8.574 -7.394 1.00 0.00 H new ATOM 970 N PRO A 74 -2.123 -10.458 -4.195 1.00 0.00 N ATOM 971 CA PRO A 74 -2.685 -11.324 -3.154 1.00 0.00 C ATOM 972 C PRO A 74 -2.824 -12.770 -3.616 1.00 0.00 C ATOM 973 O PRO A 74 -3.464 -13.050 -4.631 1.00 0.00 O ATOM 974 CB PRO A 74 -4.064 -10.712 -2.891 1.00 0.00 C ATOM 975 CG PRO A 74 -4.415 -10.010 -4.158 1.00 0.00 C ATOM 976 CD PRO A 74 -3.116 -9.510 -4.728 1.00 0.00 C ATOM 0 HA PRO A 74 -2.047 -11.368 -2.271 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.798 -11.480 -2.648 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.036 -10.020 -2.050 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.912 -10.686 -4.854 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -5.102 -9.185 -3.970 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.128 -9.511 -5.818 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -2.906 -8.488 -4.413 1.00 0.00 H new ATOM 984 N LEU A 75 -2.221 -13.686 -2.866 1.00 0.00 N ATOM 985 CA LEU A 75 -2.278 -15.105 -3.199 1.00 0.00 C ATOM 986 C LEU A 75 -3.618 -15.708 -2.789 1.00 0.00 C ATOM 987 O LEU A 75 -4.103 -16.654 -3.411 1.00 0.00 O ATOM 988 CB LEU A 75 -1.137 -15.856 -2.510 1.00 0.00 C ATOM 989 CG LEU A 75 0.278 -15.457 -2.930 1.00 0.00 C ATOM 990 CD1 LEU A 75 1.303 -16.032 -1.965 1.00 0.00 C ATOM 991 CD2 LEU A 75 0.564 -15.920 -4.351 1.00 0.00 C ATOM 0 H LEU A 75 -1.687 -13.472 -2.024 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.171 -15.204 -4.279 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.230 -15.710 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.264 -16.922 -2.699 1.00 0.00 H new ATOM 0 HG LEU A 75 0.351 -14.370 -2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.304 -15.738 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.112 -15.652 -0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.229 -17.119 -1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.575 -15.627 -4.632 1.00 0.00 H new ATOM 0 HD22 LEU A 75 0.472 -17.005 -4.406 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.150 -15.460 -5.034 1.00 0.00 H new ATOM 1003 N THR A 76 -4.215 -15.152 -1.739 1.00 0.00 N ATOM 1004 CA THR A 76 -5.499 -15.633 -1.247 1.00 0.00 C ATOM 1005 C THR A 76 -6.491 -14.486 -1.086 1.00 0.00 C ATOM 1006 O THR A 76 -6.103 -13.351 -0.811 1.00 0.00 O ATOM 1007 CB THR A 76 -5.348 -16.357 0.104 1.00 0.00 C ATOM 1008 OG1 THR A 76 -6.581 -16.993 0.460 1.00 0.00 O ATOM 1009 CG2 THR A 76 -4.940 -15.383 1.198 1.00 0.00 C ATOM 0 H THR A 76 -3.829 -14.368 -1.213 1.00 0.00 H new ATOM 0 HA THR A 76 -5.877 -16.337 -1.988 1.00 0.00 H new ATOM 0 HB THR A 76 -4.567 -17.111 0.001 1.00 0.00 H new ATOM 0 HG1 THR A 76 -6.476 -17.452 1.319 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.840 -15.918 2.142 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.987 -14.923 0.938 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.701 -14.609 1.298 1.00 0.00 H new ATOM 1017 N ALA A 77 -7.773 -14.790 -1.260 1.00 0.00 N ATOM 1018 CA ALA A 77 -8.821 -13.785 -1.132 1.00 0.00 C ATOM 1019 C ALA A 77 -9.089 -13.455 0.332 1.00 0.00 C ATOM 1020 O ALA A 77 -8.869 -14.282 1.216 1.00 0.00 O ATOM 1021 CB ALA A 77 -10.097 -14.262 -1.810 1.00 0.00 C ATOM 0 H ALA A 77 -8.111 -15.725 -1.490 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.479 -12.875 -1.626 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -10.871 -13.501 -1.706 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.902 -14.440 -2.868 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.433 -15.187 -1.343 1.00 0.00 H new ATOM 1027 N GLY A 78 -9.566 -12.239 0.583 1.00 0.00 N ATOM 1028 CA GLY A 78 -9.855 -11.821 1.942 1.00 0.00 C ATOM 1029 C GLY A 78 -9.402 -10.402 2.221 1.00 0.00 C ATOM 1030 O GLY A 78 -8.772 -9.767 1.376 1.00 0.00 O ATOM 0 H GLY A 78 -9.757 -11.536 -0.131 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -10.927 -11.899 2.123 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.364 -12.500 2.640 1.00 0.00 H new ATOM 1034 N MET A 79 -9.724 -9.902 3.410 1.00 0.00 N ATOM 1035 CA MET A 79 -9.346 -8.548 3.798 1.00 0.00 C ATOM 1036 C MET A 79 -7.836 -8.436 3.978 1.00 0.00 C ATOM 1037 O MET A 79 -7.222 -9.245 4.675 1.00 0.00 O ATOM 1038 CB MET A 79 -10.057 -8.148 5.092 1.00 0.00 C ATOM 1039 CG MET A 79 -11.572 -8.141 4.976 1.00 0.00 C ATOM 1040 SD MET A 79 -12.199 -6.665 4.151 1.00 0.00 S ATOM 1041 CE MET A 79 -11.507 -5.378 5.188 1.00 0.00 C ATOM 0 H MET A 79 -10.246 -10.414 4.121 1.00 0.00 H new ATOM 0 HA MET A 79 -9.650 -7.870 3.001 1.00 0.00 H new ATOM 0 HB2 MET A 79 -9.765 -8.836 5.885 1.00 0.00 H new ATOM 0 HB3 MET A 79 -9.719 -7.156 5.391 1.00 0.00 H new ATOM 0 HG2 MET A 79 -11.894 -9.025 4.425 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.009 -8.209 5.972 1.00 0.00 H new ATOM 0 HE1 MET A 79 -12.255 -4.603 5.354 1.00 0.00 H new ATOM 0 HE2 MET A 79 -11.207 -5.804 6.145 1.00 0.00 H new ATOM 0 HE3 MET A 79 -10.637 -4.943 4.696 1.00 0.00 H new ATOM 1051 N TYR A 80 -7.242 -7.430 3.345 1.00 0.00 N ATOM 1052 CA TYR A 80 -5.803 -7.215 3.434 1.00 0.00 C ATOM 1053 C TYR A 80 -5.488 -5.970 4.258 1.00 0.00 C ATOM 1054 O TYR A 80 -6.298 -5.047 4.346 1.00 0.00 O ATOM 1055 CB TYR A 80 -5.199 -7.079 2.035 1.00 0.00 C ATOM 1056 CG TYR A 80 -4.750 -8.394 1.439 1.00 0.00 C ATOM 1057 CD1 TYR A 80 -5.657 -9.244 0.818 1.00 0.00 C ATOM 1058 CD2 TYR A 80 -3.418 -8.786 1.496 1.00 0.00 C ATOM 1059 CE1 TYR A 80 -5.250 -10.447 0.273 1.00 0.00 C ATOM 1060 CE2 TYR A 80 -3.002 -9.986 0.953 1.00 0.00 C ATOM 1061 CZ TYR A 80 -3.922 -10.813 0.343 1.00 0.00 C ATOM 1062 OH TYR A 80 -3.513 -12.010 -0.200 1.00 0.00 O ATOM 0 H TYR A 80 -7.735 -6.751 2.765 1.00 0.00 H new ATOM 0 HA TYR A 80 -5.363 -8.079 3.931 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -5.935 -6.622 1.373 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -4.347 -6.401 2.081 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.697 -8.960 0.760 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.695 -8.141 1.973 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -5.968 -11.097 -0.205 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -1.963 -10.275 1.006 1.00 0.00 H new ATOM 0 HH TYR A 80 -4.298 -12.551 -0.427 1.00 0.00 H new ATOM 1072 N THR A 81 -4.304 -5.953 4.862 1.00 0.00 N ATOM 1073 CA THR A 81 -3.880 -4.823 5.681 1.00 0.00 C ATOM 1074 C THR A 81 -2.649 -4.147 5.089 1.00 0.00 C ATOM 1075 O THR A 81 -1.516 -4.534 5.379 1.00 0.00 O ATOM 1076 CB THR A 81 -3.567 -5.262 7.124 1.00 0.00 C ATOM 1077 OG1 THR A 81 -4.732 -5.839 7.724 1.00 0.00 O ATOM 1078 CG2 THR A 81 -3.093 -4.081 7.958 1.00 0.00 C ATOM 0 H THR A 81 -3.622 -6.708 4.800 1.00 0.00 H new ATOM 0 HA THR A 81 -4.708 -4.114 5.696 1.00 0.00 H new ATOM 0 HB THR A 81 -2.771 -6.005 7.090 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.524 -6.117 8.640 1.00 0.00 H new ATOM 0 HG21 THR A 81 -2.878 -4.415 8.973 1.00 0.00 H new ATOM 0 HG22 THR A 81 -2.190 -3.662 7.515 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.871 -3.318 7.984 1.00 0.00 H new ATOM 1086 N LEU A 82 -2.877 -3.135 4.260 1.00 0.00 N ATOM 1087 CA LEU A 82 -1.785 -2.403 3.627 1.00 0.00 C ATOM 1088 C LEU A 82 -1.029 -1.561 4.650 1.00 0.00 C ATOM 1089 O LEU A 82 -1.633 -0.843 5.449 1.00 0.00 O ATOM 1090 CB LEU A 82 -2.325 -1.507 2.511 1.00 0.00 C ATOM 1091 CG LEU A 82 -3.259 -2.178 1.504 1.00 0.00 C ATOM 1092 CD1 LEU A 82 -3.939 -1.136 0.629 1.00 0.00 C ATOM 1093 CD2 LEU A 82 -2.494 -3.178 0.650 1.00 0.00 C ATOM 0 H LEU A 82 -3.808 -2.802 4.010 1.00 0.00 H new ATOM 0 HA LEU A 82 -1.094 -3.129 3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.856 -0.672 2.968 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -1.478 -1.088 1.967 1.00 0.00 H new ATOM 0 HG LEU A 82 -4.029 -2.717 2.056 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.600 -1.633 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.521 -0.460 1.255 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.184 -0.568 0.086 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.175 -3.646 -0.061 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.702 -2.662 0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.056 -3.944 1.291 1.00 0.00 H new ATOM 1105 N THR A 83 0.297 -1.651 4.620 1.00 0.00 N ATOM 1106 CA THR A 83 1.135 -0.897 5.543 1.00 0.00 C ATOM 1107 C THR A 83 2.283 -0.212 4.809 1.00 0.00 C ATOM 1108 O THR A 83 3.168 -0.873 4.268 1.00 0.00 O ATOM 1109 CB THR A 83 1.715 -1.804 6.645 1.00 0.00 C ATOM 1110 OG1 THR A 83 0.665 -2.559 7.260 1.00 0.00 O ATOM 1111 CG2 THR A 83 2.439 -0.981 7.699 1.00 0.00 C ATOM 0 H THR A 83 0.813 -2.239 3.966 1.00 0.00 H new ATOM 0 HA THR A 83 0.498 -0.141 6.002 1.00 0.00 H new ATOM 0 HB THR A 83 2.431 -2.485 6.185 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.042 -3.134 7.958 1.00 0.00 H new ATOM 0 HG21 THR A 83 2.840 -1.644 8.466 1.00 0.00 H new ATOM 0 HG22 THR A 83 3.256 -0.430 7.233 1.00 0.00 H new ATOM 0 HG23 THR A 83 1.741 -0.278 8.155 1.00 0.00 H new ATOM 1119 N MET A 84 2.261 1.117 4.796 1.00 0.00 N ATOM 1120 CA MET A 84 3.302 1.892 4.130 1.00 0.00 C ATOM 1121 C MET A 84 4.022 2.800 5.121 1.00 0.00 C ATOM 1122 O MET A 84 3.390 3.561 5.854 1.00 0.00 O ATOM 1123 CB MET A 84 2.700 2.727 2.999 1.00 0.00 C ATOM 1124 CG MET A 84 3.736 3.274 2.030 1.00 0.00 C ATOM 1125 SD MET A 84 2.992 4.078 0.598 1.00 0.00 S ATOM 1126 CE MET A 84 2.665 2.664 -0.452 1.00 0.00 C ATOM 0 H MET A 84 1.534 1.679 5.239 1.00 0.00 H new ATOM 0 HA MET A 84 4.028 1.195 3.711 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.986 2.116 2.448 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.142 3.559 3.430 1.00 0.00 H new ATOM 0 HG2 MET A 84 4.374 3.987 2.551 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.377 2.460 1.692 1.00 0.00 H new ATOM 0 HE1 MET A 84 2.721 2.967 -1.498 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.406 1.888 -0.259 1.00 0.00 H new ATOM 0 HE3 MET A 84 1.669 2.275 -0.239 1.00 0.00 H new ATOM 1136 N LYS A 85 5.348 2.715 5.139 1.00 0.00 N ATOM 1137 CA LYS A 85 6.155 3.530 6.040 1.00 0.00 C ATOM 1138 C LYS A 85 7.264 4.247 5.277 1.00 0.00 C ATOM 1139 O LYS A 85 8.132 3.610 4.680 1.00 0.00 O ATOM 1140 CB LYS A 85 6.761 2.660 7.143 1.00 0.00 C ATOM 1141 CG LYS A 85 5.790 2.340 8.267 1.00 0.00 C ATOM 1142 CD LYS A 85 6.513 2.139 9.588 1.00 0.00 C ATOM 1143 CE LYS A 85 5.769 1.166 10.489 1.00 0.00 C ATOM 1144 NZ LYS A 85 6.605 0.722 11.638 1.00 0.00 N ATOM 0 H LYS A 85 5.887 2.090 4.540 1.00 0.00 H new ATOM 0 HA LYS A 85 5.505 4.279 6.493 1.00 0.00 H new ATOM 0 HB2 LYS A 85 7.117 1.728 6.705 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.631 3.169 7.559 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.067 3.150 8.366 1.00 0.00 H new ATOM 0 HG3 LYS A 85 5.228 1.440 8.018 1.00 0.00 H new ATOM 0 HD2 LYS A 85 7.519 1.765 9.400 1.00 0.00 H new ATOM 0 HD3 LYS A 85 6.619 3.098 10.095 1.00 0.00 H new ATOM 0 HE2 LYS A 85 4.861 1.639 10.862 1.00 0.00 H new ATOM 0 HE3 LYS A 85 5.460 0.297 9.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 6.061 0.060 12.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 7.460 0.248 11.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 6.879 1.548 12.208 1.00 0.00 H new ATOM 1158 N TYR A 86 7.230 5.575 5.303 1.00 0.00 N ATOM 1159 CA TYR A 86 8.232 6.379 4.613 1.00 0.00 C ATOM 1160 C TYR A 86 9.321 6.837 5.578 1.00 0.00 C ATOM 1161 O TYR A 86 9.037 7.428 6.618 1.00 0.00 O ATOM 1162 CB TYR A 86 7.576 7.593 3.953 1.00 0.00 C ATOM 1163 CG TYR A 86 8.360 8.142 2.782 1.00 0.00 C ATOM 1164 CD1 TYR A 86 8.326 7.516 1.542 1.00 0.00 C ATOM 1165 CD2 TYR A 86 9.134 9.288 2.916 1.00 0.00 C ATOM 1166 CE1 TYR A 86 9.041 8.015 0.470 1.00 0.00 C ATOM 1167 CE2 TYR A 86 9.851 9.795 1.849 1.00 0.00 C ATOM 1168 CZ TYR A 86 9.802 9.154 0.629 1.00 0.00 C ATOM 1169 OH TYR A 86 10.514 9.654 -0.437 1.00 0.00 O ATOM 0 H TYR A 86 6.519 6.117 5.794 1.00 0.00 H new ATOM 0 HA TYR A 86 8.691 5.759 3.843 1.00 0.00 H new ATOM 0 HB2 TYR A 86 6.578 7.317 3.614 1.00 0.00 H new ATOM 0 HB3 TYR A 86 7.453 8.379 4.698 1.00 0.00 H new ATOM 0 HD1 TYR A 86 7.731 6.624 1.414 1.00 0.00 H new ATOM 0 HD2 TYR A 86 9.176 9.791 3.871 1.00 0.00 H new ATOM 0 HE1 TYR A 86 9.004 7.516 -0.487 1.00 0.00 H new ATOM 0 HE2 TYR A 86 10.446 10.688 1.970 1.00 0.00 H new ATOM 0 HH TYR A 86 10.996 10.461 -0.159 1.00 0.00 H new ATOM 1179 N GLY A 87 10.573 6.559 5.223 1.00 0.00 N ATOM 1180 CA GLY A 87 11.687 6.950 6.066 1.00 0.00 C ATOM 1181 C GLY A 87 11.518 6.490 7.500 1.00 0.00 C ATOM 1182 O GLY A 87 12.215 6.962 8.397 1.00 0.00 O ATOM 0 H GLY A 87 10.834 6.070 4.367 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.609 6.534 5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 87 11.791 8.035 6.046 1.00 0.00 H new ATOM 1186 N GLY A 88 10.587 5.566 7.718 1.00 0.00 N ATOM 1187 CA GLY A 88 10.343 5.058 9.056 1.00 0.00 C ATOM 1188 C GLY A 88 9.142 5.708 9.713 1.00 0.00 C ATOM 1189 O GLY A 88 8.991 5.657 10.933 1.00 0.00 O ATOM 0 H GLY A 88 9.997 5.160 6.992 1.00 0.00 H new ATOM 0 HA2 GLY A 88 10.189 3.980 9.009 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.226 5.227 9.672 1.00 0.00 H new ATOM 1193 N GLU A 89 8.286 6.323 8.902 1.00 0.00 N ATOM 1194 CA GLU A 89 7.094 6.988 9.413 1.00 0.00 C ATOM 1195 C GLU A 89 5.867 6.618 8.584 1.00 0.00 C ATOM 1196 O GLU A 89 5.892 6.682 7.354 1.00 0.00 O ATOM 1197 CB GLU A 89 7.287 8.506 9.408 1.00 0.00 C ATOM 1198 CG GLU A 89 8.501 8.967 10.197 1.00 0.00 C ATOM 1199 CD GLU A 89 8.171 9.284 11.642 1.00 0.00 C ATOM 1200 OE1 GLU A 89 7.693 8.377 12.355 1.00 0.00 O ATOM 1201 OE2 GLU A 89 8.392 10.440 12.061 1.00 0.00 O ATOM 0 H GLU A 89 8.396 6.374 7.889 1.00 0.00 H new ATOM 0 HA GLU A 89 6.934 6.653 10.438 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.382 8.848 8.378 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.395 8.979 9.820 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.267 8.192 10.165 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.924 9.852 9.722 1.00 0.00 H new ATOM 1208 N LEU A 90 4.795 6.230 9.266 1.00 0.00 N ATOM 1209 CA LEU A 90 3.557 5.849 8.594 1.00 0.00 C ATOM 1210 C LEU A 90 2.984 7.020 7.803 1.00 0.00 C ATOM 1211 O LEU A 90 3.132 8.179 8.194 1.00 0.00 O ATOM 1212 CB LEU A 90 2.530 5.357 9.615 1.00 0.00 C ATOM 1213 CG LEU A 90 2.538 3.855 9.904 1.00 0.00 C ATOM 1214 CD1 LEU A 90 1.583 3.526 11.042 1.00 0.00 C ATOM 1215 CD2 LEU A 90 2.172 3.069 8.654 1.00 0.00 C ATOM 0 H LEU A 90 4.758 6.171 10.284 1.00 0.00 H new ATOM 0 HA LEU A 90 3.784 5.041 7.898 1.00 0.00 H new ATOM 0 HB2 LEU A 90 2.696 5.888 10.552 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.536 5.634 9.263 1.00 0.00 H new ATOM 0 HG LEU A 90 3.545 3.568 10.207 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.602 2.453 11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 90 1.890 4.061 11.941 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.572 3.828 10.768 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.183 2.002 8.879 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.176 3.359 8.320 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.895 3.281 7.866 1.00 0.00 H new ATOM 1227 N VAL A 91 2.326 6.711 6.690 1.00 0.00 N ATOM 1228 CA VAL A 91 1.727 7.738 5.846 1.00 0.00 C ATOM 1229 C VAL A 91 0.244 7.908 6.156 1.00 0.00 C ATOM 1230 O VAL A 91 -0.395 7.040 6.751 1.00 0.00 O ATOM 1231 CB VAL A 91 1.892 7.402 4.352 1.00 0.00 C ATOM 1232 CG1 VAL A 91 3.149 8.052 3.794 1.00 0.00 C ATOM 1233 CG2 VAL A 91 1.923 5.895 4.145 1.00 0.00 C ATOM 0 H VAL A 91 2.194 5.758 6.352 1.00 0.00 H new ATOM 0 HA VAL A 91 2.250 8.670 6.062 1.00 0.00 H new ATOM 0 HB VAL A 91 1.035 7.802 3.811 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.249 7.803 2.737 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.080 9.134 3.907 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.020 7.685 4.337 1.00 0.00 H new ATOM 0 HG21 VAL A 91 2.040 5.676 3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.760 5.469 4.698 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.991 5.459 4.505 1.00 0.00 H new ATOM 1243 N PRO A 92 -0.318 9.054 5.745 1.00 0.00 N ATOM 1244 CA PRO A 92 -1.734 9.366 5.967 1.00 0.00 C ATOM 1245 C PRO A 92 -2.658 8.495 5.124 1.00 0.00 C ATOM 1246 O PRO A 92 -3.875 8.684 5.122 1.00 0.00 O ATOM 1247 CB PRO A 92 -1.845 10.832 5.542 1.00 0.00 C ATOM 1248 CG PRO A 92 -0.733 11.030 4.570 1.00 0.00 C ATOM 1249 CD PRO A 92 0.383 10.134 5.030 1.00 0.00 C ATOM 0 HA PRO A 92 -2.035 9.183 6.999 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -2.812 11.039 5.084 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -1.747 11.501 6.397 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -1.048 10.773 3.559 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.414 12.072 4.549 1.00 0.00 H new ATOM 0 HD2 PRO A 92 0.962 9.750 4.190 1.00 0.00 H new ATOM 0 HD3 PRO A 92 1.079 10.662 5.682 1.00 0.00 H new ATOM 1257 N HIS A 93 -2.074 7.538 4.409 1.00 0.00 N ATOM 1258 CA HIS A 93 -2.847 6.637 3.562 1.00 0.00 C ATOM 1259 C HIS A 93 -2.674 5.189 4.011 1.00 0.00 C ATOM 1260 O HIS A 93 -3.006 4.257 3.277 1.00 0.00 O ATOM 1261 CB HIS A 93 -2.421 6.785 2.101 1.00 0.00 C ATOM 1262 CG HIS A 93 -2.373 8.206 1.633 1.00 0.00 C ATOM 1263 ND1 HIS A 93 -3.317 8.753 0.789 1.00 0.00 N ATOM 1264 CD2 HIS A 93 -1.487 9.196 1.896 1.00 0.00 C ATOM 1265 CE1 HIS A 93 -3.013 10.016 0.552 1.00 0.00 C ATOM 1266 NE2 HIS A 93 -1.907 10.310 1.212 1.00 0.00 N ATOM 0 H HIS A 93 -1.069 7.367 4.400 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.900 6.905 3.654 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.437 6.335 1.971 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -3.113 6.227 1.471 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -4.124 8.259 0.408 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -0.613 9.123 2.526 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.573 10.694 -0.075 1.00 0.00 H new ATOM 1275 N PHE A 94 -2.153 5.007 5.219 1.00 0.00 N ATOM 1276 CA PHE A 94 -1.934 3.672 5.765 1.00 0.00 C ATOM 1277 C PHE A 94 -1.886 3.709 7.290 1.00 0.00 C ATOM 1278 O PHE A 94 -1.523 4.715 7.900 1.00 0.00 O ATOM 1279 CB PHE A 94 -0.634 3.081 5.217 1.00 0.00 C ATOM 1280 CG PHE A 94 -0.612 2.966 3.719 1.00 0.00 C ATOM 1281 CD1 PHE A 94 -0.393 4.083 2.929 1.00 0.00 C ATOM 1282 CD2 PHE A 94 -0.809 1.742 3.102 1.00 0.00 C ATOM 1283 CE1 PHE A 94 -0.374 3.981 1.551 1.00 0.00 C ATOM 1284 CE2 PHE A 94 -0.790 1.633 1.724 1.00 0.00 C ATOM 1285 CZ PHE A 94 -0.571 2.754 0.948 1.00 0.00 C ATOM 0 H PHE A 94 -1.874 5.767 5.839 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.769 3.041 5.461 1.00 0.00 H new ATOM 0 HB2 PHE A 94 0.202 3.703 5.538 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.482 2.093 5.652 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.235 5.044 3.395 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.980 0.862 3.705 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -0.205 4.860 0.946 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.946 0.673 1.255 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.554 2.672 -0.129 1.00 0.00 H new ATOM 1295 N PRO A 95 -2.262 2.586 7.920 1.00 0.00 N ATOM 1296 CA PRO A 95 -2.696 1.384 7.204 1.00 0.00 C ATOM 1297 C PRO A 95 -4.048 1.570 6.523 1.00 0.00 C ATOM 1298 O PRO A 95 -4.857 2.395 6.946 1.00 0.00 O ATOM 1299 CB PRO A 95 -2.795 0.329 8.308 1.00 0.00 C ATOM 1300 CG PRO A 95 -3.032 1.108 9.556 1.00 0.00 C ATOM 1301 CD PRO A 95 -2.292 2.405 9.381 1.00 0.00 C ATOM 0 HA PRO A 95 -2.008 1.118 6.402 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.610 -0.369 8.116 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.880 -0.260 8.376 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -4.097 1.284 9.710 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -2.669 0.566 10.429 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -2.803 3.230 9.878 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.287 2.354 9.800 1.00 0.00 H new ATOM 1309 N ALA A 96 -4.286 0.799 5.468 1.00 0.00 N ATOM 1310 CA ALA A 96 -5.541 0.878 4.731 1.00 0.00 C ATOM 1311 C ALA A 96 -6.112 -0.512 4.468 1.00 0.00 C ATOM 1312 O ALA A 96 -5.377 -1.442 4.136 1.00 0.00 O ATOM 1313 CB ALA A 96 -5.338 1.625 3.421 1.00 0.00 C ATOM 0 H ALA A 96 -3.626 0.112 5.104 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.258 1.427 5.341 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.284 1.676 2.881 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.984 2.635 3.629 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.601 1.100 2.813 1.00 0.00 H new ATOM 1319 N ARG A 97 -7.425 -0.645 4.618 1.00 0.00 N ATOM 1320 CA ARG A 97 -8.094 -1.922 4.398 1.00 0.00 C ATOM 1321 C ARG A 97 -8.651 -2.006 2.980 1.00 0.00 C ATOM 1322 O ARG A 97 -9.241 -1.051 2.475 1.00 0.00 O ATOM 1323 CB ARG A 97 -9.222 -2.113 5.413 1.00 0.00 C ATOM 1324 CG ARG A 97 -10.435 -1.237 5.147 1.00 0.00 C ATOM 1325 CD ARG A 97 -11.441 -1.937 4.246 1.00 0.00 C ATOM 1326 NE ARG A 97 -12.810 -1.507 4.518 1.00 0.00 N ATOM 1327 CZ ARG A 97 -13.285 -0.312 4.183 1.00 0.00 C ATOM 1328 NH1 ARG A 97 -12.506 0.567 3.568 1.00 0.00 N ATOM 1329 NH2 ARG A 97 -14.543 0.006 4.464 1.00 0.00 N ATOM 0 H ARG A 97 -8.047 0.116 4.891 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.359 -2.716 4.529 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.531 -3.158 5.408 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.841 -1.898 6.411 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.911 -0.976 6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.116 -0.304 4.682 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.197 -1.733 3.203 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.365 -3.015 4.386 1.00 0.00 H new ATOM 0 HE ARG A 97 -13.435 -2.159 4.991 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.539 0.327 3.351 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.874 1.483 3.312 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -15.146 -0.667 4.937 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.907 0.923 4.207 1.00 0.00 H new ATOM 1343 N VAL A 98 -8.459 -3.157 2.341 1.00 0.00 N ATOM 1344 CA VAL A 98 -8.943 -3.367 0.982 1.00 0.00 C ATOM 1345 C VAL A 98 -9.479 -4.782 0.802 1.00 0.00 C ATOM 1346 O VAL A 98 -8.732 -5.757 0.885 1.00 0.00 O ATOM 1347 CB VAL A 98 -7.831 -3.116 -0.054 1.00 0.00 C ATOM 1348 CG1 VAL A 98 -8.327 -3.432 -1.457 1.00 0.00 C ATOM 1349 CG2 VAL A 98 -7.335 -1.680 0.034 1.00 0.00 C ATOM 0 H VAL A 98 -7.972 -3.958 2.743 1.00 0.00 H new ATOM 0 HA VAL A 98 -9.750 -2.653 0.819 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.995 -3.779 0.168 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -7.528 -3.249 -2.175 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -8.629 -4.478 -1.509 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -9.180 -2.796 -1.693 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.550 -1.520 -0.705 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -8.162 -0.997 -0.162 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -6.938 -1.493 1.032 1.00 0.00 H new ATOM 1359 N LYS A 99 -10.781 -4.888 0.556 1.00 0.00 N ATOM 1360 CA LYS A 99 -11.420 -6.184 0.362 1.00 0.00 C ATOM 1361 C LYS A 99 -11.028 -6.789 -0.983 1.00 0.00 C ATOM 1362 O LYS A 99 -11.275 -6.199 -2.035 1.00 0.00 O ATOM 1363 CB LYS A 99 -12.942 -6.043 0.446 1.00 0.00 C ATOM 1364 CG LYS A 99 -13.689 -7.331 0.148 1.00 0.00 C ATOM 1365 CD LYS A 99 -15.151 -7.233 0.550 1.00 0.00 C ATOM 1366 CE LYS A 99 -15.980 -6.545 -0.523 1.00 0.00 C ATOM 1367 NZ LYS A 99 -17.387 -7.030 -0.534 1.00 0.00 N ATOM 0 H LYS A 99 -11.414 -4.091 0.486 1.00 0.00 H new ATOM 0 HA LYS A 99 -11.079 -6.851 1.153 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -13.212 -5.699 1.444 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -13.267 -5.274 -0.255 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -13.618 -7.556 -0.916 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -13.219 -8.157 0.681 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -15.547 -8.232 0.732 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -15.236 -6.681 1.486 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -15.969 -5.468 -0.356 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.528 -6.721 -1.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -17.919 -6.536 -1.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -17.400 -8.053 -0.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -17.827 -6.840 0.389 1.00 0.00 H new ATOM 1381 N VAL A 100 -10.418 -7.969 -0.941 1.00 0.00 N ATOM 1382 CA VAL A 100 -9.995 -8.654 -2.156 1.00 0.00 C ATOM 1383 C VAL A 100 -10.932 -9.809 -2.491 1.00 0.00 C ATOM 1384 O VAL A 100 -11.276 -10.613 -1.625 1.00 0.00 O ATOM 1385 CB VAL A 100 -8.559 -9.195 -2.025 1.00 0.00 C ATOM 1386 CG1 VAL A 100 -8.225 -10.113 -3.190 1.00 0.00 C ATOM 1387 CG2 VAL A 100 -7.564 -8.047 -1.937 1.00 0.00 C ATOM 0 H VAL A 100 -10.206 -8.470 -0.078 1.00 0.00 H new ATOM 0 HA VAL A 100 -10.027 -7.919 -2.960 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.491 -9.777 -1.106 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -7.206 -10.485 -3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.919 -10.953 -3.202 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.310 -9.560 -4.125 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.554 -8.447 -1.845 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.632 -7.437 -2.838 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.792 -7.434 -1.065 1.00 0.00 H new ATOM 1397 N GLU A 101 -11.342 -9.885 -3.753 1.00 0.00 N ATOM 1398 CA GLU A 101 -12.240 -10.942 -4.202 1.00 0.00 C ATOM 1399 C GLU A 101 -11.457 -12.097 -4.818 1.00 0.00 C ATOM 1400 O GLU A 101 -10.315 -11.944 -5.252 1.00 0.00 O ATOM 1401 CB GLU A 101 -13.243 -10.392 -5.218 1.00 0.00 C ATOM 1402 CG GLU A 101 -14.481 -9.781 -4.583 1.00 0.00 C ATOM 1403 CD GLU A 101 -15.590 -9.534 -5.587 1.00 0.00 C ATOM 1404 OE1 GLU A 101 -15.866 -10.440 -6.401 1.00 0.00 O ATOM 1405 OE2 GLU A 101 -16.182 -8.435 -5.559 1.00 0.00 O ATOM 0 H GLU A 101 -11.067 -9.227 -4.482 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.782 -11.316 -3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.750 -9.638 -5.831 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.548 -11.197 -5.887 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.847 -10.443 -3.799 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.212 -8.839 -4.105 1.00 0.00 H new ATOM 1412 N PRO A 102 -12.083 -13.282 -4.857 1.00 0.00 N ATOM 1413 CA PRO A 102 -11.464 -14.487 -5.417 1.00 0.00 C ATOM 1414 C PRO A 102 -11.309 -14.408 -6.932 1.00 0.00 C ATOM 1415 O PRO A 102 -12.095 -13.750 -7.612 1.00 0.00 O ATOM 1416 CB PRO A 102 -12.444 -15.600 -5.037 1.00 0.00 C ATOM 1417 CG PRO A 102 -13.756 -14.912 -4.883 1.00 0.00 C ATOM 1418 CD PRO A 102 -13.445 -13.538 -4.358 1.00 0.00 C ATOM 0 HA PRO A 102 -10.455 -14.641 -5.035 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.488 -16.369 -5.808 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -12.144 -16.093 -4.112 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -14.281 -14.856 -5.836 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -14.403 -15.455 -4.194 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -14.154 -12.797 -4.727 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -13.487 -13.505 -3.269 1.00 0.00 H new ATOM 1426 N ALA A 103 -10.291 -15.085 -7.454 1.00 0.00 N ATOM 1427 CA ALA A 103 -10.036 -15.093 -8.889 1.00 0.00 C ATOM 1428 C ALA A 103 -10.887 -16.145 -9.593 1.00 0.00 C ATOM 1429 O ALA A 103 -10.397 -16.888 -10.443 1.00 0.00 O ATOM 1430 CB ALA A 103 -8.559 -15.339 -9.161 1.00 0.00 C ATOM 0 H ALA A 103 -9.630 -15.635 -6.905 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.311 -14.116 -9.287 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.383 -15.342 -10.237 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.967 -14.549 -8.699 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.267 -16.302 -8.743 1.00 0.00 H new ATOM 1436 N VAL A 104 -12.165 -16.204 -9.231 1.00 0.00 N ATOM 1437 CA VAL A 104 -13.085 -17.165 -9.828 1.00 0.00 C ATOM 1438 C VAL A 104 -13.199 -16.955 -11.334 1.00 0.00 C ATOM 1439 O VAL A 104 -13.478 -15.849 -11.797 1.00 0.00 O ATOM 1440 CB VAL A 104 -14.487 -17.064 -9.199 1.00 0.00 C ATOM 1441 CG1 VAL A 104 -14.458 -17.527 -7.750 1.00 0.00 C ATOM 1442 CG2 VAL A 104 -15.016 -15.642 -9.303 1.00 0.00 C ATOM 0 H VAL A 104 -12.586 -15.598 -8.527 1.00 0.00 H new ATOM 0 HA VAL A 104 -12.678 -18.157 -9.633 1.00 0.00 H new ATOM 0 HB VAL A 104 -15.161 -17.719 -9.750 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.458 -17.448 -7.323 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -14.125 -18.564 -7.706 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -13.770 -16.901 -7.182 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.008 -15.589 -8.854 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -14.343 -14.964 -8.778 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -15.077 -15.352 -10.352 1.00 0.00 H new ATOM 1452 N ASP A 105 -12.980 -18.023 -12.092 1.00 0.00 N ATOM 1453 CA ASP A 105 -13.060 -17.957 -13.547 1.00 0.00 C ATOM 1454 C ASP A 105 -14.511 -17.878 -14.009 1.00 0.00 C ATOM 1455 O ASP A 105 -15.432 -18.200 -13.257 1.00 0.00 O ATOM 1456 CB ASP A 105 -12.378 -19.175 -14.172 1.00 0.00 C ATOM 1457 CG ASP A 105 -11.791 -18.873 -15.537 1.00 0.00 C ATOM 1458 OD1 ASP A 105 -12.255 -17.910 -16.182 1.00 0.00 O ATOM 1459 OD2 ASP A 105 -10.867 -19.600 -15.960 1.00 0.00 O ATOM 0 H ASP A 105 -12.746 -18.945 -11.724 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.545 -17.054 -13.874 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.587 -19.525 -13.509 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -13.101 -19.986 -14.262 1.00 0.00 H new ATOM 1464 N THR A 106 -14.710 -17.445 -15.250 1.00 0.00 N ATOM 1465 CA THR A 106 -16.049 -17.321 -15.812 1.00 0.00 C ATOM 1466 C THR A 106 -16.321 -18.421 -16.832 1.00 0.00 C ATOM 1467 O THR A 106 -17.263 -19.199 -16.683 1.00 0.00 O ATOM 1468 CB THR A 106 -16.251 -15.951 -16.485 1.00 0.00 C ATOM 1469 OG1 THR A 106 -15.840 -14.904 -15.598 1.00 0.00 O ATOM 1470 CG2 THR A 106 -17.708 -15.749 -16.875 1.00 0.00 C ATOM 0 H THR A 106 -13.960 -17.174 -15.886 1.00 0.00 H new ATOM 0 HA THR A 106 -16.750 -17.417 -14.983 1.00 0.00 H new ATOM 0 HB THR A 106 -15.642 -15.921 -17.388 1.00 0.00 H new ATOM 0 HG1 THR A 106 -15.970 -14.036 -16.034 1.00 0.00 H new ATOM 0 HG21 THR A 106 -17.826 -14.774 -17.349 1.00 0.00 H new ATOM 0 HG22 THR A 106 -18.010 -16.530 -17.573 1.00 0.00 H new ATOM 0 HG23 THR A 106 -18.333 -15.797 -15.984 1.00 0.00 H new ATOM 1478 N SER A 107 -15.490 -18.479 -17.868 1.00 0.00 N ATOM 1479 CA SER A 107 -15.644 -19.482 -18.915 1.00 0.00 C ATOM 1480 C SER A 107 -15.512 -20.890 -18.343 1.00 0.00 C ATOM 1481 O SER A 107 -15.022 -21.076 -17.229 1.00 0.00 O ATOM 1482 CB SER A 107 -14.601 -19.267 -20.014 1.00 0.00 C ATOM 1483 OG SER A 107 -14.950 -19.971 -21.193 1.00 0.00 O ATOM 0 H SER A 107 -14.704 -17.844 -18.005 1.00 0.00 H new ATOM 0 HA SER A 107 -16.641 -19.374 -19.343 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.514 -18.203 -20.234 1.00 0.00 H new ATOM 0 HB3 SER A 107 -13.624 -19.601 -19.663 1.00 0.00 H new ATOM 0 HG SER A 107 -14.269 -19.816 -21.880 1.00 0.00 H new ATOM 1489 N SER A 108 -15.954 -21.879 -19.113 1.00 0.00 N ATOM 1490 CA SER A 108 -15.890 -23.271 -18.682 1.00 0.00 C ATOM 1491 C SER A 108 -14.872 -24.049 -19.509 1.00 0.00 C ATOM 1492 O SER A 108 -13.908 -24.597 -18.974 1.00 0.00 O ATOM 1493 CB SER A 108 -17.267 -23.927 -18.798 1.00 0.00 C ATOM 1494 OG SER A 108 -17.373 -25.047 -17.936 1.00 0.00 O ATOM 0 H SER A 108 -16.360 -21.742 -20.039 1.00 0.00 H new ATOM 0 HA SER A 108 -15.574 -23.288 -17.639 1.00 0.00 H new ATOM 0 HB2 SER A 108 -18.041 -23.200 -18.552 1.00 0.00 H new ATOM 0 HB3 SER A 108 -17.439 -24.239 -19.828 1.00 0.00 H new ATOM 0 HG SER A 108 -18.263 -25.447 -18.028 1.00 0.00 H new ATOM 1500 N GLY A 109 -15.093 -24.094 -20.820 1.00 0.00 N ATOM 1501 CA GLY A 109 -14.187 -24.807 -21.701 1.00 0.00 C ATOM 1502 C GLY A 109 -14.630 -26.235 -21.955 1.00 0.00 C ATOM 1503 O GLY A 109 -15.211 -26.891 -21.090 1.00 0.00 O ATOM 0 H GLY A 109 -15.883 -23.649 -21.287 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -14.117 -24.277 -22.651 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.188 -24.812 -21.264 1.00 0.00 H new ATOM 1507 N PRO A 110 -14.356 -26.736 -23.168 1.00 0.00 N ATOM 1508 CA PRO A 110 -14.722 -28.100 -23.562 1.00 0.00 C ATOM 1509 C PRO A 110 -13.899 -29.156 -22.832 1.00 0.00 C ATOM 1510 O PRO A 110 -13.141 -28.840 -21.915 1.00 0.00 O ATOM 1511 CB PRO A 110 -14.419 -28.129 -25.063 1.00 0.00 C ATOM 1512 CG PRO A 110 -13.372 -27.087 -25.258 1.00 0.00 C ATOM 1513 CD PRO A 110 -13.666 -26.011 -24.249 1.00 0.00 C ATOM 0 HA PRO A 110 -15.759 -28.330 -23.318 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -14.064 -29.111 -25.376 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -15.310 -27.910 -25.651 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.375 -27.502 -25.107 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.401 -26.689 -26.272 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -12.753 -25.533 -23.893 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -14.293 -25.226 -24.670 1.00 0.00 H new ATOM 1521 N SER A 111 -14.053 -30.410 -23.244 1.00 0.00 N ATOM 1522 CA SER A 111 -13.326 -31.512 -22.626 1.00 0.00 C ATOM 1523 C SER A 111 -11.823 -31.359 -22.839 1.00 0.00 C ATOM 1524 O SER A 111 -11.291 -31.739 -23.882 1.00 0.00 O ATOM 1525 CB SER A 111 -13.800 -32.849 -23.201 1.00 0.00 C ATOM 1526 OG SER A 111 -15.208 -32.978 -23.098 1.00 0.00 O ATOM 0 H SER A 111 -14.675 -30.688 -24.003 1.00 0.00 H new ATOM 0 HA SER A 111 -13.528 -31.492 -21.555 1.00 0.00 H new ATOM 0 HB2 SER A 111 -13.500 -32.926 -24.246 1.00 0.00 H new ATOM 0 HB3 SER A 111 -13.317 -33.669 -22.670 1.00 0.00 H new ATOM 0 HG SER A 111 -15.486 -33.839 -23.474 1.00 0.00 H new ATOM 1532 N SER A 112 -11.145 -30.799 -21.842 1.00 0.00 N ATOM 1533 CA SER A 112 -9.704 -30.592 -21.920 1.00 0.00 C ATOM 1534 C SER A 112 -9.294 -30.150 -23.322 1.00 0.00 C ATOM 1535 O SER A 112 -8.347 -30.681 -23.900 1.00 0.00 O ATOM 1536 CB SER A 112 -8.961 -31.874 -21.540 1.00 0.00 C ATOM 1537 OG SER A 112 -9.094 -32.859 -22.549 1.00 0.00 O ATOM 0 H SER A 112 -11.570 -30.481 -20.971 1.00 0.00 H new ATOM 0 HA SER A 112 -9.437 -29.804 -21.216 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.906 -31.653 -21.381 1.00 0.00 H new ATOM 0 HB3 SER A 112 -9.352 -32.259 -20.598 1.00 0.00 H new ATOM 0 HG SER A 112 -8.580 -32.590 -23.339 1.00 0.00 H new ATOM 1543 N GLY A 113 -10.015 -29.172 -23.863 1.00 0.00 N ATOM 1544 CA GLY A 113 -9.712 -28.675 -25.192 1.00 0.00 C ATOM 1545 C GLY A 113 -8.835 -27.439 -25.162 1.00 0.00 C ATOM 1546 O GLY A 113 -8.513 -26.873 -26.207 1.00 0.00 O ATOM 0 H GLY A 113 -10.803 -28.715 -23.404 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -9.213 -29.457 -25.764 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -10.642 -28.444 -25.711 1.00 0.00 H new TER 1550 GLY A 113