USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 990 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 125 ASN : amide:sc= -0.187 K(o=1.1,f=-0.7) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -163:sc= 1.29 (180deg=1.21) USER MOD Set 2.1: A 11 ASN : amide:sc= 1.26 K(o=4.5,f=1.6) USER MOD Set 2.2: A 12 SER OG : rot 162:sc= 0.642 USER MOD Set 2.3: A 43 HIS : no HE2:sc= 1.18 K(o=4.5,f=-0.49!) USER MOD Set 2.4: A 60 GLN : amide:sc= 1.46 K(o=4.5,f=-2.5!) USER MOD Set 3.1: A 33 THR OG1 : rot 163:sc= 0.61 USER MOD Set 3.2: A 73 TYR OH : rot 30:sc= 0.549 USER MOD Set 4.1: A 5 MET CE :methyl -169:sc= -0.471 (180deg=-1.04) USER MOD Set 4.2: A 35 SER OG : rot -140:sc= 1.24 USER MOD Single : A 1 MET CE :methyl -146:sc= 0 (180deg=-0.151) USER MOD Single : A 1 MET N :NH3+ -107:sc= 0.0671 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -162:sc= 1.26 (180deg=1.19) USER MOD Single : A 9 LYS NZ :NH3+ -158:sc= 1.27 (180deg=1.18) USER MOD Single : A 13 SER OG : rot 62:sc= 0.781 USER MOD Single : A 15 SER OG : rot 180:sc= 0.00602 USER MOD Single : A 16 GLN : amide:sc= 0.665 K(o=0.67,f=-3.1!) USER MOD Single : A 17 MET CE :methyl 161:sc= -2.42 (180deg=-3.05!) USER MOD Single : A 23 LYS NZ :NH3+ 175:sc= 1 (180deg=0.98) USER MOD Single : A 24 THR OG1 : rot -120:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 1.33 (180deg=1.33) USER MOD Single : A 34 SER OG : rot 170:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0521 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 135:sc= -1.97! (180deg=-2.47!) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0513 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0937 USER MOD Single : A 62 SER OG : rot 78:sc= 1.12 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.691 K(o=0.69,f=-7.3!) USER MOD Single : A 78 SER OG : rot -140:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.139 USER MOD Single : A 93 GLN : amide:sc= -0.122 K(o=-0.12,f=-0.87) USER MOD Single : A 100 GLN : amide:sc= 0.579 K(o=0.58,f=-4.4!) USER MOD Single : A 107 GLN : amide:sc= 0.591 K(o=0.59,f=-0.027) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 86:sc= 0.662 USER MOD Single : A 118 GLN : amide:sc= 0.704 K(o=0.7,f=-5.2!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.725 -0.742 0.999 1.00 0.00 N ATOM 2 CA MET A 1 2.071 -0.412 -0.419 1.00 0.00 C ATOM 3 C MET A 1 2.641 -1.651 -1.142 1.00 0.00 C ATOM 4 O MET A 1 3.178 -2.546 -0.491 1.00 0.00 O ATOM 5 CB MET A 1 2.968 0.857 -0.507 1.00 0.00 C ATOM 6 CG MET A 1 4.488 0.632 -0.407 1.00 0.00 C ATOM 7 SD MET A 1 5.467 2.113 -0.001 1.00 0.00 S ATOM 8 CE MET A 1 5.376 3.041 -1.562 1.00 0.00 C ATOM 0 H1 MET A 1 0.691 -0.791 1.102 1.00 0.00 H new ATOM 0 H2 MET A 1 2.142 -1.660 1.254 1.00 0.00 H new ATOM 0 H3 MET A 1 2.101 -0.005 1.629 1.00 0.00 H new ATOM 0 HA MET A 1 1.161 -0.147 -0.957 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.759 1.358 -1.452 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.671 1.540 0.289 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.677 -0.128 0.351 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.843 0.231 -1.356 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.309 3.582 -1.719 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.215 2.348 -2.388 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.549 3.750 -1.516 1.00 0.00 H new ATOM 18 N LYS A 2 2.522 -1.742 -2.476 1.00 0.00 N ATOM 19 CA LYS A 2 2.868 -2.973 -3.221 1.00 0.00 C ATOM 20 C LYS A 2 4.386 -3.074 -3.288 1.00 0.00 C ATOM 21 O LYS A 2 5.014 -2.146 -3.790 1.00 0.00 O ATOM 22 CB LYS A 2 2.195 -3.022 -4.617 1.00 0.00 C ATOM 23 CG LYS A 2 0.738 -2.518 -4.602 1.00 0.00 C ATOM 24 CD LYS A 2 0.113 -2.466 -6.005 1.00 0.00 C ATOM 25 CE LYS A 2 -1.070 -1.482 -6.058 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.308 -1.998 -5.403 1.00 0.00 N ATOM 0 H LYS A 2 2.189 -0.979 -3.066 1.00 0.00 H new ATOM 0 HA LYS A 2 2.477 -3.845 -2.697 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.775 -2.419 -5.315 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.215 -4.047 -4.988 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.139 -3.170 -3.966 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.707 -1.523 -4.158 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.869 -2.167 -6.731 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.227 -3.462 -6.290 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.777 -0.549 -5.577 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.291 -1.248 -7.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.062 -1.286 -5.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.612 -2.873 -5.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.114 -2.195 -4.400 1.00 0.00 H new ATOM 40 N LYS A 3 4.996 -4.142 -2.779 1.00 0.00 N ATOM 41 CA LYS A 3 6.449 -4.310 -2.875 1.00 0.00 C ATOM 42 C LYS A 3 6.755 -5.012 -4.179 1.00 0.00 C ATOM 43 O LYS A 3 6.091 -5.999 -4.499 1.00 0.00 O ATOM 44 CB LYS A 3 7.032 -5.050 -1.673 1.00 0.00 C ATOM 45 CG LYS A 3 6.657 -4.380 -0.352 1.00 0.00 C ATOM 46 CD LYS A 3 7.394 -5.035 0.817 1.00 0.00 C ATOM 47 CE LYS A 3 7.007 -4.275 2.089 1.00 0.00 C ATOM 48 NZ LYS A 3 7.618 -4.884 3.297 1.00 0.00 N ATOM 0 H LYS A 3 4.513 -4.901 -2.298 1.00 0.00 H new ATOM 0 HA LYS A 3 6.927 -3.331 -2.864 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.673 -6.079 -1.672 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.117 -5.091 -1.764 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.903 -3.319 -0.394 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.581 -4.452 -0.195 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.121 -6.087 0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.472 -4.997 0.660 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.326 -3.236 2.004 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.922 -4.268 2.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.113 -4.556 4.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.552 -5.920 3.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.618 -4.604 3.359 1.00 0.00 H new ATOM 62 N VAL A 4 7.753 -4.505 -4.889 1.00 0.00 N ATOM 63 CA VAL A 4 8.099 -4.842 -6.252 1.00 0.00 C ATOM 64 C VAL A 4 9.549 -5.315 -6.291 1.00 0.00 C ATOM 65 O VAL A 4 10.399 -4.809 -5.557 1.00 0.00 O ATOM 66 CB VAL A 4 7.940 -3.602 -7.165 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.685 -3.981 -8.630 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.855 -2.597 -6.758 1.00 0.00 C ATOM 0 H VAL A 4 8.380 -3.802 -4.498 1.00 0.00 H new ATOM 0 HA VAL A 4 7.436 -5.631 -6.608 1.00 0.00 H new ATOM 0 HB VAL A 4 8.905 -3.110 -7.040 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.581 -3.075 -9.227 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.523 -4.569 -9.005 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.770 -4.569 -8.700 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.837 -1.772 -7.471 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.884 -3.092 -6.752 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.072 -2.211 -5.762 1.00 0.00 H new ATOM 78 N MET A 5 9.848 -6.231 -7.200 1.00 0.00 N ATOM 79 CA MET A 5 11.207 -6.628 -7.565 1.00 0.00 C ATOM 80 C MET A 5 11.276 -6.751 -9.082 1.00 0.00 C ATOM 81 O MET A 5 10.279 -7.121 -9.699 1.00 0.00 O ATOM 82 CB MET A 5 11.635 -7.958 -6.931 1.00 0.00 C ATOM 83 CG MET A 5 11.595 -7.999 -5.404 1.00 0.00 C ATOM 84 SD MET A 5 12.598 -9.362 -4.762 1.00 0.00 S ATOM 85 CE MET A 5 12.493 -9.025 -2.988 1.00 0.00 C ATOM 0 H MET A 5 9.132 -6.736 -7.722 1.00 0.00 H new ATOM 0 HA MET A 5 11.890 -5.866 -7.190 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.991 -8.748 -7.316 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.650 -8.187 -7.257 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.960 -7.054 -5.002 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.565 -8.112 -5.067 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.210 -9.650 -2.456 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.719 -7.975 -2.803 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.486 -9.247 -2.634 1.00 0.00 H new ATOM 95 N PHE A 6 12.448 -6.508 -9.673 1.00 0.00 N ATOM 96 CA PHE A 6 12.751 -6.782 -11.074 1.00 0.00 C ATOM 97 C PHE A 6 14.047 -7.564 -11.018 1.00 0.00 C ATOM 98 O PHE A 6 14.973 -7.151 -10.315 1.00 0.00 O ATOM 99 CB PHE A 6 12.903 -5.520 -11.940 1.00 0.00 C ATOM 100 CG PHE A 6 11.659 -4.663 -12.055 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.257 -3.888 -10.957 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.909 -4.625 -13.246 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.094 -3.108 -11.029 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.755 -3.826 -13.324 1.00 0.00 C ATOM 105 CZ PHE A 6 9.342 -3.073 -12.212 1.00 0.00 C ATOM 0 H PHE A 6 13.237 -6.101 -9.170 1.00 0.00 H new ATOM 0 HA PHE A 6 11.932 -7.321 -11.550 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.708 -4.911 -11.528 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.211 -5.821 -12.941 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.846 -3.892 -10.052 1.00 0.00 H new ATOM 0 HD2 PHE A 6 11.220 -5.209 -14.099 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.777 -2.533 -10.172 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.185 -3.791 -14.241 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.448 -2.469 -12.268 1.00 0.00 H new ATOM 115 N VAL A 7 14.099 -8.705 -11.695 1.00 0.00 N ATOM 116 CA VAL A 7 15.201 -9.634 -11.522 1.00 0.00 C ATOM 117 C VAL A 7 15.389 -10.450 -12.801 1.00 0.00 C ATOM 118 O VAL A 7 14.426 -10.918 -13.410 1.00 0.00 O ATOM 119 CB VAL A 7 14.962 -10.456 -10.223 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.496 -10.885 -10.000 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.882 -11.677 -10.081 1.00 0.00 C ATOM 0 H VAL A 7 13.392 -9.005 -12.366 1.00 0.00 H new ATOM 0 HA VAL A 7 16.154 -9.125 -11.376 1.00 0.00 H new ATOM 0 HB VAL A 7 15.220 -9.743 -9.440 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.420 -11.453 -9.073 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.863 -10.000 -9.936 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.168 -11.506 -10.833 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.654 -12.198 -9.151 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.724 -12.351 -10.923 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.922 -11.350 -10.068 1.00 0.00 H new ATOM 131 N CYS A 8 16.654 -10.602 -13.187 1.00 0.00 N ATOM 132 CA CYS A 8 17.160 -11.488 -14.229 1.00 0.00 C ATOM 133 C CYS A 8 18.194 -12.422 -13.570 1.00 0.00 C ATOM 134 O CYS A 8 18.526 -12.251 -12.394 1.00 0.00 O ATOM 135 CB CYS A 8 17.762 -10.626 -15.355 1.00 0.00 C ATOM 136 SG CYS A 8 18.302 -11.483 -16.861 1.00 0.00 S ATOM 0 H CYS A 8 17.405 -10.070 -12.747 1.00 0.00 H new ATOM 0 HA CYS A 8 16.379 -12.101 -14.678 1.00 0.00 H new ATOM 0 HB2 CYS A 8 17.022 -9.878 -15.639 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.618 -10.088 -14.947 1.00 0.00 H new ATOM 141 N LYS A 9 18.727 -13.409 -14.307 1.00 0.00 N ATOM 142 CA LYS A 9 19.730 -14.334 -13.763 1.00 0.00 C ATOM 143 C LYS A 9 21.024 -13.594 -13.381 1.00 0.00 C ATOM 144 O LYS A 9 21.695 -13.977 -12.427 1.00 0.00 O ATOM 145 CB LYS A 9 19.979 -15.473 -14.770 1.00 0.00 C ATOM 146 CG LYS A 9 20.641 -16.694 -14.109 1.00 0.00 C ATOM 147 CD LYS A 9 20.912 -17.811 -15.132 1.00 0.00 C ATOM 148 CE LYS A 9 21.359 -19.138 -14.484 1.00 0.00 C ATOM 149 NZ LYS A 9 22.597 -19.013 -13.673 1.00 0.00 N ATOM 0 H LYS A 9 18.479 -13.586 -15.281 1.00 0.00 H new ATOM 0 HA LYS A 9 19.350 -14.775 -12.841 1.00 0.00 H new ATOM 0 HB2 LYS A 9 19.032 -15.773 -15.219 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.614 -15.110 -15.578 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.578 -16.392 -13.641 1.00 0.00 H new ATOM 0 HG3 LYS A 9 19.997 -17.074 -13.316 1.00 0.00 H new ATOM 0 HD2 LYS A 9 20.008 -17.986 -15.716 1.00 0.00 H new ATOM 0 HD3 LYS A 9 21.682 -17.477 -15.828 1.00 0.00 H new ATOM 0 HE2 LYS A 9 20.555 -19.513 -13.850 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.520 -19.879 -15.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 23.047 -19.946 -13.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.254 -18.357 -14.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.358 -18.648 -12.729 1.00 0.00 H new ATOM 163 N ARG A 10 21.367 -12.527 -14.111 1.00 0.00 N ATOM 164 CA ARG A 10 22.436 -11.581 -13.763 1.00 0.00 C ATOM 165 C ARG A 10 21.784 -10.267 -13.340 1.00 0.00 C ATOM 166 O ARG A 10 20.632 -10.022 -13.686 1.00 0.00 O ATOM 167 CB ARG A 10 23.375 -11.378 -14.965 1.00 0.00 C ATOM 168 CG ARG A 10 24.109 -12.668 -15.368 1.00 0.00 C ATOM 169 CD ARG A 10 25.072 -12.425 -16.540 1.00 0.00 C ATOM 170 NE ARG A 10 24.344 -11.989 -17.749 1.00 0.00 N ATOM 171 CZ ARG A 10 24.065 -12.708 -18.845 1.00 0.00 C ATOM 172 NH1 ARG A 10 24.476 -13.969 -18.972 1.00 0.00 N ATOM 173 NH2 ARG A 10 23.362 -12.140 -19.816 1.00 0.00 N ATOM 0 H ARG A 10 20.896 -12.290 -14.984 1.00 0.00 H new ATOM 0 HA ARG A 10 23.039 -11.968 -12.942 1.00 0.00 H new ATOM 0 HB2 ARG A 10 22.798 -11.013 -15.814 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.108 -10.608 -14.723 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.665 -13.054 -14.513 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.381 -13.430 -15.646 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.805 -11.668 -16.261 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.625 -13.339 -16.755 1.00 0.00 H new ATOM 0 HE ARG A 10 24.014 -11.024 -17.750 1.00 0.00 H new ATOM 0 HH11 ARG A 10 25.015 -14.407 -18.225 1.00 0.00 H new ATOM 0 HH12 ARG A 10 24.251 -14.496 -19.816 1.00 0.00 H new ATOM 0 HH21 ARG A 10 23.046 -11.175 -19.719 1.00 0.00 H new ATOM 0 HH22 ARG A 10 23.138 -12.668 -20.659 1.00 0.00 H new ATOM 187 N ASN A 11 22.523 -9.383 -12.657 1.00 0.00 N ATOM 188 CA ASN A 11 22.008 -8.038 -12.361 1.00 0.00 C ATOM 189 C ASN A 11 21.941 -7.205 -13.636 1.00 0.00 C ATOM 190 O ASN A 11 20.897 -6.674 -13.997 1.00 0.00 O ATOM 191 CB ASN A 11 22.866 -7.304 -11.312 1.00 0.00 C ATOM 192 CG ASN A 11 22.346 -5.877 -11.107 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.472 -5.649 -10.279 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.822 -4.901 -11.875 1.00 0.00 N ATOM 0 H ASN A 11 23.462 -9.568 -12.304 1.00 0.00 H new ATOM 0 HA ASN A 11 21.007 -8.163 -11.947 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.841 -7.847 -10.367 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.906 -7.277 -11.637 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.459 -3.953 -11.778 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.550 -5.101 -12.561 1.00 0.00 H new ATOM 201 N SER A 12 23.070 -7.101 -14.333 1.00 0.00 N ATOM 202 CA SER A 12 23.251 -6.165 -15.439 1.00 0.00 C ATOM 203 C SER A 12 22.842 -6.791 -16.775 1.00 0.00 C ATOM 204 O SER A 12 23.563 -6.713 -17.768 1.00 0.00 O ATOM 205 CB SER A 12 24.675 -5.613 -15.365 1.00 0.00 C ATOM 206 OG SER A 12 24.880 -5.185 -14.023 1.00 0.00 O ATOM 0 H SER A 12 23.894 -7.671 -14.143 1.00 0.00 H new ATOM 0 HA SER A 12 22.580 -5.310 -15.356 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.401 -6.377 -15.642 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.805 -4.783 -16.060 1.00 0.00 H new ATOM 0 HG SER A 12 25.841 -5.093 -13.852 1.00 0.00 H new ATOM 212 N SER A 13 21.677 -7.441 -16.775 1.00 0.00 N ATOM 213 CA SER A 13 21.006 -7.926 -17.963 1.00 0.00 C ATOM 214 C SER A 13 19.515 -7.655 -17.770 1.00 0.00 C ATOM 215 O SER A 13 18.919 -8.189 -16.842 1.00 0.00 O ATOM 216 CB SER A 13 21.305 -9.415 -18.178 1.00 0.00 C ATOM 217 OG SER A 13 22.704 -9.645 -18.306 1.00 0.00 O ATOM 0 H SER A 13 21.166 -7.646 -15.917 1.00 0.00 H new ATOM 0 HA SER A 13 21.359 -7.416 -18.860 1.00 0.00 H new ATOM 0 HB2 SER A 13 20.914 -9.992 -17.340 1.00 0.00 H new ATOM 0 HB3 SER A 13 20.792 -9.766 -19.074 1.00 0.00 H new ATOM 0 HG SER A 13 23.157 -9.377 -17.479 1.00 0.00 H new ATOM 223 N ARG A 14 18.922 -6.833 -18.641 1.00 0.00 N ATOM 224 CA ARG A 14 17.502 -6.452 -18.738 1.00 0.00 C ATOM 225 C ARG A 14 16.957 -5.657 -17.548 1.00 0.00 C ATOM 226 O ARG A 14 16.005 -4.895 -17.732 1.00 0.00 O ATOM 227 CB ARG A 14 16.634 -7.669 -19.052 1.00 0.00 C ATOM 228 CG ARG A 14 16.979 -8.360 -20.360 1.00 0.00 C ATOM 229 CD ARG A 14 15.882 -9.395 -20.560 1.00 0.00 C ATOM 230 NE ARG A 14 16.335 -10.441 -21.468 1.00 0.00 N ATOM 231 CZ ARG A 14 15.611 -11.483 -21.888 1.00 0.00 C ATOM 232 NH1 ARG A 14 14.436 -11.768 -21.331 1.00 0.00 N ATOM 233 NH2 ARG A 14 16.064 -12.243 -22.875 1.00 0.00 N ATOM 0 H ARG A 14 19.472 -6.372 -19.366 1.00 0.00 H new ATOM 0 HA ARG A 14 17.450 -5.751 -19.571 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.729 -8.388 -18.238 1.00 0.00 H new ATOM 0 HB3 ARG A 14 15.590 -7.358 -19.083 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.007 -7.650 -21.186 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.961 -8.830 -20.311 1.00 0.00 H new ATOM 0 HD2 ARG A 14 15.605 -9.832 -19.600 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.989 -8.916 -20.962 1.00 0.00 H new ATOM 0 HE ARG A 14 17.292 -10.372 -21.815 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.077 -11.188 -20.573 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.895 -12.567 -21.662 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.962 -12.032 -23.311 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.515 -13.039 -23.199 1.00 0.00 H new ATOM 247 N SER A 15 17.527 -5.819 -16.357 1.00 0.00 N ATOM 248 CA SER A 15 17.288 -4.963 -15.206 1.00 0.00 C ATOM 249 C SER A 15 18.108 -3.681 -15.494 1.00 0.00 C ATOM 250 O SER A 15 18.150 -3.253 -16.650 1.00 0.00 O ATOM 251 CB SER A 15 17.665 -5.745 -13.934 1.00 0.00 C ATOM 252 OG SER A 15 17.362 -7.131 -14.067 1.00 0.00 O ATOM 0 H SER A 15 18.187 -6.573 -16.164 1.00 0.00 H new ATOM 0 HA SER A 15 16.252 -4.667 -15.039 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.729 -5.621 -13.731 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.127 -5.334 -13.080 1.00 0.00 H new ATOM 0 HG SER A 15 17.614 -7.601 -13.245 1.00 0.00 H new ATOM 258 N GLN A 16 18.773 -3.052 -14.516 1.00 0.00 N ATOM 259 CA GLN A 16 19.609 -1.849 -14.690 1.00 0.00 C ATOM 260 C GLN A 16 18.887 -0.739 -15.483 1.00 0.00 C ATOM 261 O GLN A 16 19.511 0.057 -16.182 1.00 0.00 O ATOM 262 CB GLN A 16 21.020 -2.197 -15.202 1.00 0.00 C ATOM 263 CG GLN A 16 21.093 -2.616 -16.678 1.00 0.00 C ATOM 264 CD GLN A 16 22.518 -2.849 -17.186 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.497 -2.457 -16.555 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.672 -3.517 -18.323 1.00 0.00 N ATOM 0 H GLN A 16 18.745 -3.374 -13.549 1.00 0.00 H new ATOM 0 HA GLN A 16 19.770 -1.413 -13.704 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.667 -1.332 -15.054 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.422 -3.005 -14.591 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.515 -3.530 -16.815 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.621 -1.846 -17.288 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.854 -3.839 -18.840 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.608 -3.709 -18.679 1.00 0.00 H new ATOM 275 N MET A 17 17.559 -0.729 -15.432 1.00 0.00 N ATOM 276 CA MET A 17 16.652 0.134 -16.155 1.00 0.00 C ATOM 277 C MET A 17 15.231 -0.083 -15.608 1.00 0.00 C ATOM 278 O MET A 17 14.539 0.884 -15.308 1.00 0.00 O ATOM 279 CB MET A 17 16.661 -0.197 -17.657 1.00 0.00 C ATOM 280 CG MET A 17 16.511 1.044 -18.544 1.00 0.00 C ATOM 281 SD MET A 17 15.233 2.267 -18.188 1.00 0.00 S ATOM 282 CE MET A 17 15.980 3.375 -16.939 1.00 0.00 C ATOM 0 H MET A 17 17.055 -1.382 -14.832 1.00 0.00 H new ATOM 0 HA MET A 17 16.968 1.169 -16.024 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.593 -0.705 -17.906 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.851 -0.893 -17.875 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.468 1.565 -18.535 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.348 0.694 -19.564 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.430 4.316 -16.912 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.935 2.901 -15.959 1.00 0.00 H new ATOM 0 HE3 MET A 17 17.020 3.570 -17.201 1.00 0.00 H new ATOM 292 N ALA A 18 14.778 -1.342 -15.488 1.00 0.00 N ATOM 293 CA ALA A 18 13.382 -1.673 -15.194 1.00 0.00 C ATOM 294 C ALA A 18 12.991 -1.353 -13.758 1.00 0.00 C ATOM 295 O ALA A 18 11.978 -0.701 -13.519 1.00 0.00 O ATOM 296 CB ALA A 18 13.098 -3.130 -15.604 1.00 0.00 C ATOM 0 H ALA A 18 15.377 -2.161 -15.594 1.00 0.00 H new ATOM 0 HA ALA A 18 12.737 -1.031 -15.794 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.059 -3.374 -15.384 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.281 -3.250 -16.672 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.753 -3.799 -15.046 1.00 0.00 H new ATOM 302 N GLU A 19 13.832 -1.733 -12.806 1.00 0.00 N ATOM 303 CA GLU A 19 13.685 -1.292 -11.425 1.00 0.00 C ATOM 304 C GLU A 19 13.863 0.224 -11.368 1.00 0.00 C ATOM 305 O GLU A 19 13.158 0.897 -10.618 1.00 0.00 O ATOM 306 CB GLU A 19 14.682 -2.020 -10.505 1.00 0.00 C ATOM 307 CG GLU A 19 16.174 -1.708 -10.717 1.00 0.00 C ATOM 308 CD GLU A 19 16.691 -2.119 -12.088 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.492 -1.348 -13.047 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.288 -3.204 -12.216 1.00 0.00 O ATOM 0 H GLU A 19 14.628 -2.350 -12.966 1.00 0.00 H new ATOM 0 HA GLU A 19 12.687 -1.542 -11.064 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.428 -1.782 -9.472 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.538 -3.093 -10.629 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.336 -0.639 -10.582 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.756 -2.218 -9.950 1.00 0.00 H new ATOM 317 N GLY A 20 14.762 0.750 -12.212 1.00 0.00 N ATOM 318 CA GLY A 20 15.023 2.166 -12.409 1.00 0.00 C ATOM 319 C GLY A 20 13.724 2.927 -12.640 1.00 0.00 C ATOM 320 O GLY A 20 13.296 3.704 -11.790 1.00 0.00 O ATOM 0 H GLY A 20 15.352 0.162 -12.801 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.537 2.571 -11.537 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.687 2.303 -13.262 1.00 0.00 H new ATOM 324 N PHE A 21 13.032 2.672 -13.751 1.00 0.00 N ATOM 325 CA PHE A 21 11.763 3.340 -14.021 1.00 0.00 C ATOM 326 C PHE A 21 10.728 3.071 -12.952 1.00 0.00 C ATOM 327 O PHE A 21 9.855 3.915 -12.749 1.00 0.00 O ATOM 328 CB PHE A 21 11.194 2.951 -15.384 1.00 0.00 C ATOM 329 CG PHE A 21 11.529 3.972 -16.439 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.093 5.306 -16.315 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.341 3.593 -17.510 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.478 6.252 -17.286 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.753 4.539 -18.457 1.00 0.00 C ATOM 334 CZ PHE A 21 12.313 5.870 -18.354 1.00 0.00 C ATOM 0 H PHE A 21 13.327 2.013 -14.472 1.00 0.00 H new ATOM 0 HA PHE A 21 11.988 4.407 -14.021 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.589 1.979 -15.680 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.112 2.846 -15.310 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.470 5.601 -15.484 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.653 2.564 -17.609 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.132 7.272 -17.211 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.407 4.246 -19.265 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.615 6.598 -19.092 1.00 0.00 H new ATOM 344 N ALA A 22 10.788 1.939 -12.258 1.00 0.00 N ATOM 345 CA ALA A 22 9.761 1.635 -11.285 1.00 0.00 C ATOM 346 C ALA A 22 9.865 2.518 -10.045 1.00 0.00 C ATOM 347 O ALA A 22 8.820 2.904 -9.530 1.00 0.00 O ATOM 348 CB ALA A 22 9.796 0.147 -10.971 1.00 0.00 C ATOM 0 H ALA A 22 11.521 1.236 -12.351 1.00 0.00 H new ATOM 0 HA ALA A 22 8.783 1.866 -11.708 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.024 -0.088 -10.238 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.616 -0.422 -11.883 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.773 -0.117 -10.566 1.00 0.00 H new ATOM 354 N LYS A 23 11.063 2.941 -9.607 1.00 0.00 N ATOM 355 CA LYS A 23 11.127 3.933 -8.516 1.00 0.00 C ATOM 356 C LYS A 23 10.579 5.285 -8.975 1.00 0.00 C ATOM 357 O LYS A 23 10.003 6.011 -8.173 1.00 0.00 O ATOM 358 CB LYS A 23 12.521 4.049 -7.861 1.00 0.00 C ATOM 359 CG LYS A 23 13.631 4.763 -8.666 1.00 0.00 C ATOM 360 CD LYS A 23 14.714 3.805 -9.188 1.00 0.00 C ATOM 361 CE LYS A 23 15.655 3.235 -8.107 1.00 0.00 C ATOM 362 NZ LYS A 23 16.723 4.197 -7.712 1.00 0.00 N ATOM 0 H LYS A 23 11.964 2.630 -9.971 1.00 0.00 H new ATOM 0 HA LYS A 23 10.480 3.562 -7.721 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.404 4.572 -6.912 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.868 3.042 -7.629 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.180 5.285 -9.510 1.00 0.00 H new ATOM 0 HG3 LYS A 23 14.098 5.520 -8.036 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.227 2.975 -9.700 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.314 4.330 -9.931 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.071 2.965 -7.227 1.00 0.00 H new ATOM 0 HE3 LYS A 23 16.115 2.319 -8.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.275 3.799 -6.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.351 4.371 -8.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.289 5.093 -7.412 1.00 0.00 H new ATOM 376 N THR A 24 10.717 5.607 -10.261 1.00 0.00 N ATOM 377 CA THR A 24 10.313 6.871 -10.841 1.00 0.00 C ATOM 378 C THR A 24 8.792 6.936 -11.016 1.00 0.00 C ATOM 379 O THR A 24 8.128 7.827 -10.489 1.00 0.00 O ATOM 380 CB THR A 24 11.132 7.003 -12.130 1.00 0.00 C ATOM 381 OG1 THR A 24 12.484 7.237 -11.792 1.00 0.00 O ATOM 382 CG2 THR A 24 10.628 8.041 -13.114 1.00 0.00 C ATOM 0 H THR A 24 11.127 4.969 -10.943 1.00 0.00 H new ATOM 0 HA THR A 24 10.520 7.729 -10.202 1.00 0.00 H new ATOM 0 HB THR A 24 11.021 6.059 -12.663 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.772 8.095 -12.169 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.275 8.056 -13.991 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.611 7.791 -13.418 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.634 9.023 -12.642 1.00 0.00 H new ATOM 390 N LEU A 25 8.232 5.972 -11.741 1.00 0.00 N ATOM 391 CA LEU A 25 6.819 5.942 -12.123 1.00 0.00 C ATOM 392 C LEU A 25 5.974 5.468 -10.943 1.00 0.00 C ATOM 393 O LEU A 25 4.881 5.980 -10.694 1.00 0.00 O ATOM 394 CB LEU A 25 6.658 4.991 -13.322 1.00 0.00 C ATOM 395 CG LEU A 25 7.436 5.400 -14.583 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.394 4.242 -15.580 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.901 6.680 -15.228 1.00 0.00 C ATOM 0 H LEU A 25 8.758 5.170 -12.088 1.00 0.00 H new ATOM 0 HA LEU A 25 6.482 6.940 -12.403 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.980 3.994 -13.022 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.599 4.922 -13.573 1.00 0.00 H new ATOM 0 HG LEU A 25 8.463 5.617 -14.288 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.942 4.517 -16.481 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.851 3.360 -15.132 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.358 4.022 -15.839 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.492 6.916 -16.113 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.859 6.535 -15.515 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.970 7.502 -14.516 1.00 0.00 H new ATOM 409 N GLY A 26 6.496 4.502 -10.185 1.00 0.00 N ATOM 410 CA GLY A 26 5.849 3.919 -9.019 1.00 0.00 C ATOM 411 C GLY A 26 5.998 4.776 -7.764 1.00 0.00 C ATOM 412 O GLY A 26 5.529 4.359 -6.708 1.00 0.00 O ATOM 0 H GLY A 26 7.411 4.094 -10.376 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.789 3.776 -9.231 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.272 2.932 -8.831 1.00 0.00 H new ATOM 416 N ALA A 27 6.629 5.953 -7.866 1.00 0.00 N ATOM 417 CA ALA A 27 6.840 6.873 -6.757 1.00 0.00 C ATOM 418 C ALA A 27 5.498 7.167 -6.081 1.00 0.00 C ATOM 419 O ALA A 27 4.518 7.486 -6.764 1.00 0.00 O ATOM 420 CB ALA A 27 7.490 8.165 -7.276 1.00 0.00 C ATOM 0 H ALA A 27 7.014 6.294 -8.747 1.00 0.00 H new ATOM 0 HA ALA A 27 7.509 6.425 -6.022 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.647 8.852 -6.445 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.449 7.930 -7.739 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.836 8.631 -8.013 1.00 0.00 H new ATOM 426 N GLY A 28 5.454 7.030 -4.754 1.00 0.00 N ATOM 427 CA GLY A 28 4.258 7.238 -3.943 1.00 0.00 C ATOM 428 C GLY A 28 3.228 6.101 -4.025 1.00 0.00 C ATOM 429 O GLY A 28 2.141 6.240 -3.465 1.00 0.00 O ATOM 0 H GLY A 28 6.270 6.765 -4.203 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.557 7.366 -2.903 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.780 8.167 -4.254 1.00 0.00 H new ATOM 433 N LYS A 29 3.534 4.991 -4.718 1.00 0.00 N ATOM 434 CA LYS A 29 2.567 3.916 -4.996 1.00 0.00 C ATOM 435 C LYS A 29 3.115 2.560 -4.589 1.00 0.00 C ATOM 436 O LYS A 29 2.443 1.822 -3.874 1.00 0.00 O ATOM 437 CB LYS A 29 2.173 3.889 -6.493 1.00 0.00 C ATOM 438 CG LYS A 29 1.734 5.245 -7.061 1.00 0.00 C ATOM 439 CD LYS A 29 1.601 5.192 -8.593 1.00 0.00 C ATOM 440 CE LYS A 29 1.482 6.607 -9.185 1.00 0.00 C ATOM 441 NZ LYS A 29 2.775 7.356 -9.205 1.00 0.00 N ATOM 0 H LYS A 29 4.462 4.814 -5.102 1.00 0.00 H new ATOM 0 HA LYS A 29 1.678 4.126 -4.402 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.021 3.524 -7.072 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.363 3.173 -6.629 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.780 5.535 -6.621 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.459 6.010 -6.783 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.468 4.687 -9.020 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.724 4.605 -8.865 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.097 6.535 -10.202 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.752 7.174 -8.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.614 8.317 -9.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.160 7.410 -8.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.453 6.863 -9.821 1.00 0.00 H new ATOM 455 N ILE A 30 4.318 2.213 -5.056 1.00 0.00 N ATOM 456 CA ILE A 30 4.874 0.865 -4.937 1.00 0.00 C ATOM 457 C ILE A 30 6.373 0.953 -4.604 1.00 0.00 C ATOM 458 O ILE A 30 7.042 1.905 -5.001 1.00 0.00 O ATOM 459 CB ILE A 30 4.530 0.054 -6.214 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.204 0.609 -7.487 1.00 0.00 C ATOM 461 CG2 ILE A 30 3.004 0.002 -6.439 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.906 -0.192 -8.766 1.00 0.00 C ATOM 0 H ILE A 30 4.938 2.868 -5.532 1.00 0.00 H new ATOM 0 HA ILE A 30 4.425 0.316 -4.109 1.00 0.00 H new ATOM 0 HB ILE A 30 4.920 -0.949 -6.040 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.880 1.639 -7.635 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.283 0.633 -7.331 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.788 -0.572 -7.340 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.526 -0.474 -5.583 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.618 1.015 -6.553 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.419 0.268 -9.611 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.256 -1.217 -8.643 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.832 -0.195 -8.951 1.00 0.00 H new ATOM 474 N ALA A 31 6.890 -0.014 -3.837 1.00 0.00 N ATOM 475 CA ALA A 31 8.251 -0.017 -3.297 1.00 0.00 C ATOM 476 C ALA A 31 9.096 -1.015 -4.083 1.00 0.00 C ATOM 477 O ALA A 31 8.928 -2.216 -3.890 1.00 0.00 O ATOM 478 CB ALA A 31 8.223 -0.400 -1.807 1.00 0.00 C ATOM 0 H ALA A 31 6.355 -0.840 -3.568 1.00 0.00 H new ATOM 0 HA ALA A 31 8.686 0.978 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.239 -0.400 -1.412 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.620 0.322 -1.257 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.790 -1.394 -1.695 1.00 0.00 H new ATOM 484 N VAL A 32 9.981 -0.559 -4.971 1.00 0.00 N ATOM 485 CA VAL A 32 10.908 -1.463 -5.654 1.00 0.00 C ATOM 486 C VAL A 32 12.082 -1.780 -4.730 1.00 0.00 C ATOM 487 O VAL A 32 12.638 -0.891 -4.076 1.00 0.00 O ATOM 488 CB VAL A 32 11.280 -0.928 -7.051 1.00 0.00 C ATOM 489 CG1 VAL A 32 12.126 0.351 -7.046 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.993 -2.011 -7.867 1.00 0.00 C ATOM 0 H VAL A 32 10.075 0.422 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 32 10.431 -2.421 -5.863 1.00 0.00 H new ATOM 0 HB VAL A 32 10.330 -0.659 -7.513 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.338 0.651 -8.072 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.579 1.147 -6.541 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.063 0.165 -6.522 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.248 -1.616 -8.850 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.903 -2.316 -7.351 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.335 -2.873 -7.981 1.00 0.00 H new ATOM 500 N THR A 33 12.467 -3.050 -4.718 1.00 0.00 N ATOM 501 CA THR A 33 13.612 -3.585 -4.041 1.00 0.00 C ATOM 502 C THR A 33 14.267 -4.501 -5.058 1.00 0.00 C ATOM 503 O THR A 33 13.657 -5.456 -5.534 1.00 0.00 O ATOM 504 CB THR A 33 13.177 -4.388 -2.815 1.00 0.00 C ATOM 505 OG1 THR A 33 12.177 -3.714 -2.062 1.00 0.00 O ATOM 506 CG2 THR A 33 14.381 -4.650 -1.902 1.00 0.00 C ATOM 0 H THR A 33 11.945 -3.770 -5.217 1.00 0.00 H new ATOM 0 HA THR A 33 14.286 -2.804 -3.689 1.00 0.00 H new ATOM 0 HB THR A 33 12.762 -5.327 -3.181 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.736 -4.350 -1.461 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.060 -5.223 -1.032 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.136 -5.214 -2.449 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.803 -3.700 -1.575 1.00 0.00 H new ATOM 514 N SER A 34 15.495 -4.192 -5.439 1.00 0.00 N ATOM 515 CA SER A 34 16.137 -4.857 -6.560 1.00 0.00 C ATOM 516 C SER A 34 16.918 -6.118 -6.145 1.00 0.00 C ATOM 517 O SER A 34 18.020 -6.365 -6.641 1.00 0.00 O ATOM 518 CB SER A 34 16.960 -3.826 -7.335 1.00 0.00 C ATOM 519 OG SER A 34 16.222 -2.611 -7.429 1.00 0.00 O ATOM 0 H SER A 34 16.070 -3.481 -4.986 1.00 0.00 H new ATOM 0 HA SER A 34 15.377 -5.251 -7.234 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.911 -3.650 -6.832 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.192 -4.203 -8.331 1.00 0.00 H new ATOM 0 HG SER A 34 16.802 -1.902 -7.779 1.00 0.00 H new ATOM 525 N SER A 35 16.371 -6.905 -5.217 1.00 0.00 N ATOM 526 CA SER A 35 16.963 -8.150 -4.734 1.00 0.00 C ATOM 527 C SER A 35 17.026 -9.206 -5.856 1.00 0.00 C ATOM 528 O SER A 35 16.287 -9.121 -6.842 1.00 0.00 O ATOM 529 CB SER A 35 16.159 -8.659 -3.530 1.00 0.00 C ATOM 530 OG SER A 35 15.743 -7.570 -2.717 1.00 0.00 O ATOM 0 H SER A 35 15.481 -6.687 -4.770 1.00 0.00 H new ATOM 0 HA SER A 35 17.989 -7.960 -4.418 1.00 0.00 H new ATOM 0 HB2 SER A 35 15.289 -9.217 -3.875 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.767 -9.348 -2.943 1.00 0.00 H new ATOM 0 HG SER A 35 15.825 -7.817 -1.772 1.00 0.00 H new ATOM 536 N GLY A 36 17.889 -10.217 -5.711 1.00 0.00 N ATOM 537 CA GLY A 36 18.128 -11.233 -6.721 1.00 0.00 C ATOM 538 C GLY A 36 19.126 -12.240 -6.172 1.00 0.00 C ATOM 539 O GLY A 36 19.376 -12.274 -4.966 1.00 0.00 O ATOM 0 H GLY A 36 18.448 -10.347 -4.868 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.195 -11.731 -6.985 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.514 -10.777 -7.632 1.00 0.00 H new ATOM 543 N LEU A 37 19.684 -13.072 -7.044 1.00 0.00 N ATOM 544 CA LEU A 37 20.690 -14.070 -6.759 1.00 0.00 C ATOM 545 C LEU A 37 21.788 -13.935 -7.805 1.00 0.00 C ATOM 546 O LEU A 37 21.544 -13.362 -8.870 1.00 0.00 O ATOM 547 CB LEU A 37 20.030 -15.449 -6.846 1.00 0.00 C ATOM 548 CG LEU A 37 19.178 -15.766 -5.611 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.061 -16.737 -6.001 1.00 0.00 C ATOM 550 CD2 LEU A 37 20.042 -16.341 -4.488 1.00 0.00 C ATOM 0 H LEU A 37 19.424 -13.061 -8.030 1.00 0.00 H new ATOM 0 HA LEU A 37 21.119 -13.942 -5.765 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.404 -15.494 -7.737 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.801 -16.212 -6.958 1.00 0.00 H new ATOM 0 HG LEU A 37 18.730 -14.845 -5.238 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.454 -16.964 -5.125 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.435 -16.282 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.498 -17.658 -6.388 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.416 -16.558 -3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.520 -17.259 -4.830 1.00 0.00 H new ATOM 0 HD23 LEU A 37 20.807 -15.616 -4.210 1.00 0.00 H new ATOM 562 N GLU A 38 22.979 -14.474 -7.502 1.00 0.00 N ATOM 563 CA GLU A 38 24.157 -14.470 -8.399 1.00 0.00 C ATOM 564 C GLU A 38 24.562 -13.056 -8.848 1.00 0.00 C ATOM 565 O GLU A 38 25.271 -12.859 -9.840 1.00 0.00 O ATOM 566 CB GLU A 38 23.871 -15.319 -9.641 1.00 0.00 C ATOM 567 CG GLU A 38 23.291 -16.695 -9.321 1.00 0.00 C ATOM 568 CD GLU A 38 23.303 -17.620 -10.550 1.00 0.00 C ATOM 569 OE1 GLU A 38 24.370 -18.188 -10.891 1.00 0.00 O ATOM 570 OE2 GLU A 38 22.245 -17.808 -11.198 1.00 0.00 O ATOM 0 H GLU A 38 23.159 -14.935 -6.610 1.00 0.00 H new ATOM 0 HA GLU A 38 24.985 -14.887 -7.826 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.175 -14.782 -10.286 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.795 -15.446 -10.205 1.00 0.00 H new ATOM 0 HG2 GLU A 38 23.865 -17.153 -8.516 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.269 -16.583 -8.960 1.00 0.00 H new ATOM 577 N SER A 39 24.077 -12.070 -8.109 1.00 0.00 N ATOM 578 CA SER A 39 24.107 -10.680 -8.466 1.00 0.00 C ATOM 579 C SER A 39 25.466 -9.997 -8.298 1.00 0.00 C ATOM 580 O SER A 39 26.400 -10.506 -7.671 1.00 0.00 O ATOM 581 CB SER A 39 22.919 -10.016 -7.756 1.00 0.00 C ATOM 582 OG SER A 39 22.869 -10.377 -6.379 1.00 0.00 O ATOM 0 H SER A 39 23.634 -12.236 -7.205 1.00 0.00 H new ATOM 0 HA SER A 39 23.985 -10.563 -9.543 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.998 -8.933 -7.847 1.00 0.00 H new ATOM 0 HB3 SER A 39 21.990 -10.310 -8.245 1.00 0.00 H new ATOM 0 HG SER A 39 22.103 -9.938 -5.953 1.00 0.00 H new ATOM 588 N SER A 40 25.549 -8.839 -8.951 1.00 0.00 N ATOM 589 CA SER A 40 26.715 -8.008 -9.201 1.00 0.00 C ATOM 590 C SER A 40 26.185 -6.575 -9.370 1.00 0.00 C ATOM 591 O SER A 40 24.970 -6.356 -9.326 1.00 0.00 O ATOM 592 CB SER A 40 27.381 -8.542 -10.480 1.00 0.00 C ATOM 593 OG SER A 40 28.155 -9.705 -10.219 1.00 0.00 O ATOM 0 H SER A 40 24.712 -8.421 -9.358 1.00 0.00 H new ATOM 0 HA SER A 40 27.456 -8.022 -8.402 1.00 0.00 H new ATOM 0 HB2 SER A 40 26.615 -8.772 -11.221 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.018 -7.769 -10.910 1.00 0.00 H new ATOM 0 HG SER A 40 28.563 -10.020 -11.052 1.00 0.00 H new ATOM 599 N ARG A 41 27.057 -5.583 -9.557 1.00 0.00 N ATOM 600 CA ARG A 41 26.640 -4.186 -9.673 1.00 0.00 C ATOM 601 C ARG A 41 26.338 -3.856 -11.139 1.00 0.00 C ATOM 602 O ARG A 41 26.899 -4.455 -12.055 1.00 0.00 O ATOM 603 CB ARG A 41 27.709 -3.262 -9.049 1.00 0.00 C ATOM 604 CG ARG A 41 27.187 -1.876 -8.631 1.00 0.00 C ATOM 605 CD ARG A 41 28.219 -1.136 -7.772 1.00 0.00 C ATOM 606 NE ARG A 41 27.752 0.220 -7.423 1.00 0.00 N ATOM 607 CZ ARG A 41 28.367 1.076 -6.596 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.516 0.755 -6.007 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.812 2.263 -6.373 1.00 0.00 N ATOM 0 H ARG A 41 28.064 -5.724 -9.632 1.00 0.00 H new ATOM 0 HA ARG A 41 25.719 -4.019 -9.114 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.133 -3.756 -8.175 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.520 -3.130 -9.765 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.958 -1.287 -9.519 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.257 -1.987 -8.074 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.411 -1.703 -6.861 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.164 -1.070 -8.311 1.00 0.00 H new ATOM 0 HE ARG A 41 26.881 0.534 -7.851 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.942 -0.155 -6.182 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.971 1.419 -5.380 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.933 2.509 -6.828 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.265 2.928 -5.747 1.00 0.00 H new ATOM 623 N VAL A 42 25.459 -2.876 -11.313 1.00 0.00 N ATOM 624 CA VAL A 42 25.108 -2.190 -12.557 1.00 0.00 C ATOM 625 C VAL A 42 26.342 -1.815 -13.392 1.00 0.00 C ATOM 626 O VAL A 42 27.412 -1.537 -12.846 1.00 0.00 O ATOM 627 CB VAL A 42 24.252 -0.965 -12.174 1.00 0.00 C ATOM 628 CG1 VAL A 42 24.822 -0.168 -10.984 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.997 0.000 -13.325 1.00 0.00 C ATOM 0 H VAL A 42 24.928 -2.508 -10.524 1.00 0.00 H new ATOM 0 HA VAL A 42 24.538 -2.855 -13.205 1.00 0.00 H new ATOM 0 HB VAL A 42 23.302 -1.412 -11.883 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.171 0.679 -10.768 1.00 0.00 H new ATOM 0 HG12 VAL A 42 24.879 -0.814 -10.108 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.819 0.195 -11.233 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.388 0.833 -12.973 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.948 0.378 -13.700 1.00 0.00 H new ATOM 0 HG23 VAL A 42 23.472 -0.520 -14.126 1.00 0.00 H new ATOM 639 N HIS A 43 26.172 -1.786 -14.719 1.00 0.00 N ATOM 640 CA HIS A 43 27.247 -1.457 -15.661 1.00 0.00 C ATOM 641 C HIS A 43 27.318 0.063 -15.918 1.00 0.00 C ATOM 642 O HIS A 43 26.299 0.745 -15.807 1.00 0.00 O ATOM 643 CB HIS A 43 27.101 -2.334 -16.921 1.00 0.00 C ATOM 644 CG HIS A 43 27.585 -3.761 -16.735 1.00 0.00 C ATOM 645 ND1 HIS A 43 27.869 -4.653 -17.741 1.00 0.00 N ATOM 646 CD2 HIS A 43 27.877 -4.408 -15.557 1.00 0.00 C ATOM 647 CE1 HIS A 43 28.300 -5.801 -17.195 1.00 0.00 C ATOM 648 NE2 HIS A 43 28.326 -5.702 -15.853 1.00 0.00 N ATOM 0 H HIS A 43 25.281 -1.991 -15.171 1.00 0.00 H new ATOM 0 HA HIS A 43 28.222 -1.696 -15.235 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.053 -2.352 -17.220 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.658 -1.875 -17.738 1.00 0.00 H new ATOM 0 HD1 HIS A 43 27.769 -4.472 -18.740 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.777 -3.988 -14.567 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.586 -6.680 -17.754 1.00 0.00 H new ATOM 656 N PRO A 44 28.500 0.613 -16.271 1.00 0.00 N ATOM 657 CA PRO A 44 28.755 2.058 -16.319 1.00 0.00 C ATOM 658 C PRO A 44 27.838 2.825 -17.272 1.00 0.00 C ATOM 659 O PRO A 44 27.190 3.789 -16.862 1.00 0.00 O ATOM 660 CB PRO A 44 30.227 2.204 -16.737 1.00 0.00 C ATOM 661 CG PRO A 44 30.527 0.883 -17.450 1.00 0.00 C ATOM 662 CD PRO A 44 29.727 -0.100 -16.604 1.00 0.00 C ATOM 0 HA PRO A 44 28.547 2.497 -15.343 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.374 3.059 -17.397 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.877 2.351 -15.874 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.199 0.893 -18.489 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.592 0.650 -17.454 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.516 -1.016 -17.155 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.274 -0.387 -15.706 1.00 0.00 H new ATOM 670 N THR A 45 27.753 2.400 -18.535 1.00 0.00 N ATOM 671 CA THR A 45 27.056 3.160 -19.572 1.00 0.00 C ATOM 672 C THR A 45 25.545 3.195 -19.295 1.00 0.00 C ATOM 673 O THR A 45 24.886 4.163 -19.677 1.00 0.00 O ATOM 674 CB THR A 45 27.430 2.590 -20.949 1.00 0.00 C ATOM 675 OG1 THR A 45 28.834 2.378 -21.016 1.00 0.00 O ATOM 676 CG2 THR A 45 26.992 3.483 -22.118 1.00 0.00 C ATOM 0 H THR A 45 28.162 1.526 -18.865 1.00 0.00 H new ATOM 0 HA THR A 45 27.372 4.203 -19.564 1.00 0.00 H new ATOM 0 HB THR A 45 26.892 1.648 -21.052 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.068 2.013 -21.895 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.288 3.021 -23.060 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.909 3.604 -22.097 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.468 4.459 -22.028 1.00 0.00 H new ATOM 684 N ALA A 46 25.009 2.207 -18.553 1.00 0.00 N ATOM 685 CA ALA A 46 23.620 2.231 -18.118 1.00 0.00 C ATOM 686 C ALA A 46 23.367 3.498 -17.335 1.00 0.00 C ATOM 687 O ALA A 46 22.480 4.258 -17.688 1.00 0.00 O ATOM 688 CB ALA A 46 23.263 1.005 -17.252 1.00 0.00 C ATOM 0 H ALA A 46 25.528 1.384 -18.247 1.00 0.00 H new ATOM 0 HA ALA A 46 22.988 2.200 -19.006 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.217 1.065 -16.950 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.423 0.094 -17.828 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.896 0.989 -16.365 1.00 0.00 H new ATOM 694 N ILE A 47 24.172 3.754 -16.309 1.00 0.00 N ATOM 695 CA ILE A 47 23.892 4.833 -15.368 1.00 0.00 C ATOM 696 C ILE A 47 23.869 6.157 -16.126 1.00 0.00 C ATOM 697 O ILE A 47 23.001 6.976 -15.856 1.00 0.00 O ATOM 698 CB ILE A 47 24.976 4.846 -14.259 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.975 3.541 -13.433 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.817 6.056 -13.319 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.314 3.272 -12.732 1.00 0.00 C ATOM 0 H ILE A 47 25.023 3.229 -16.108 1.00 0.00 H new ATOM 0 HA ILE A 47 22.922 4.682 -14.895 1.00 0.00 H new ATOM 0 HB ILE A 47 25.934 4.927 -14.772 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.184 3.592 -12.685 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.740 2.703 -14.089 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.595 6.029 -12.556 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.905 6.978 -13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.838 6.019 -12.841 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.249 2.341 -12.168 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.105 3.190 -13.477 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.540 4.093 -12.052 1.00 0.00 H new ATOM 713 N ALA A 48 24.758 6.349 -17.105 1.00 0.00 N ATOM 714 CA ALA A 48 24.790 7.572 -17.891 1.00 0.00 C ATOM 715 C ALA A 48 23.493 7.756 -18.684 1.00 0.00 C ATOM 716 O ALA A 48 22.877 8.814 -18.608 1.00 0.00 O ATOM 717 CB ALA A 48 26.020 7.586 -18.809 1.00 0.00 C ATOM 0 H ALA A 48 25.467 5.664 -17.368 1.00 0.00 H new ATOM 0 HA ALA A 48 24.870 8.417 -17.208 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.029 8.508 -19.391 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.926 7.529 -18.205 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.980 6.731 -19.484 1.00 0.00 H new ATOM 723 N MET A 49 23.037 6.726 -19.404 1.00 0.00 N ATOM 724 CA MET A 49 21.804 6.789 -20.202 1.00 0.00 C ATOM 725 C MET A 49 20.568 6.912 -19.296 1.00 0.00 C ATOM 726 O MET A 49 19.595 7.620 -19.583 1.00 0.00 O ATOM 727 CB MET A 49 21.709 5.511 -21.057 1.00 0.00 C ATOM 728 CG MET A 49 22.842 5.426 -22.085 1.00 0.00 C ATOM 729 SD MET A 49 22.793 6.717 -23.356 1.00 0.00 S ATOM 730 CE MET A 49 24.448 7.387 -23.065 1.00 0.00 C ATOM 0 H MET A 49 23.511 5.824 -19.451 1.00 0.00 H new ATOM 0 HA MET A 49 21.834 7.670 -20.843 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.742 4.636 -20.407 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.749 5.489 -21.572 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.797 5.483 -21.562 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.803 4.451 -22.572 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.633 8.211 -23.754 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.519 7.749 -22.039 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.190 6.605 -23.226 1.00 0.00 H new ATOM 740 N MET A 50 20.601 6.231 -18.162 1.00 0.00 N ATOM 741 CA MET A 50 19.479 6.187 -17.255 1.00 0.00 C ATOM 742 C MET A 50 19.416 7.544 -16.546 1.00 0.00 C ATOM 743 O MET A 50 18.323 8.060 -16.342 1.00 0.00 O ATOM 744 CB MET A 50 19.553 4.951 -16.340 1.00 0.00 C ATOM 745 CG MET A 50 19.619 3.570 -17.052 1.00 0.00 C ATOM 746 SD MET A 50 19.296 3.424 -18.844 1.00 0.00 S ATOM 747 CE MET A 50 19.819 1.702 -19.168 1.00 0.00 C ATOM 0 H MET A 50 21.410 5.694 -17.849 1.00 0.00 H new ATOM 0 HA MET A 50 18.530 6.050 -17.774 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.431 5.049 -15.702 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.682 4.957 -15.685 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.615 3.164 -16.872 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.911 2.914 -16.545 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.076 1.207 -19.793 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.781 1.704 -19.681 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.913 1.166 -18.223 1.00 0.00 H new ATOM 757 N GLU A 51 20.549 8.210 -16.315 1.00 0.00 N ATOM 758 CA GLU A 51 20.603 9.575 -15.833 1.00 0.00 C ATOM 759 C GLU A 51 20.177 10.558 -16.932 1.00 0.00 C ATOM 760 O GLU A 51 19.710 11.650 -16.605 1.00 0.00 O ATOM 761 CB GLU A 51 22.000 9.877 -15.264 1.00 0.00 C ATOM 762 CG GLU A 51 22.093 11.259 -14.606 1.00 0.00 C ATOM 763 CD GLU A 51 23.437 11.440 -13.877 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.447 11.794 -14.533 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.486 11.261 -12.635 1.00 0.00 O ATOM 0 H GLU A 51 21.470 7.799 -16.464 1.00 0.00 H new ATOM 0 HA GLU A 51 19.891 9.702 -15.018 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.261 9.113 -14.531 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.735 9.813 -16.066 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.980 12.034 -15.364 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.273 11.384 -13.899 1.00 0.00 H new ATOM 772 N GLU A 52 20.229 10.177 -18.218 1.00 0.00 N ATOM 773 CA GLU A 52 19.629 11.002 -19.263 1.00 0.00 C ATOM 774 C GLU A 52 18.107 11.041 -19.087 1.00 0.00 C ATOM 775 O GLU A 52 17.498 12.081 -19.345 1.00 0.00 O ATOM 776 CB GLU A 52 20.047 10.629 -20.698 1.00 0.00 C ATOM 777 CG GLU A 52 21.506 10.968 -21.023 1.00 0.00 C ATOM 778 CD GLU A 52 21.740 12.487 -21.121 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.481 13.075 -22.199 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.191 13.108 -20.129 1.00 0.00 O ATOM 0 H GLU A 52 20.672 9.320 -18.549 1.00 0.00 H new ATOM 0 HA GLU A 52 20.029 12.008 -19.133 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.890 9.561 -20.847 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.397 11.148 -21.403 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.155 10.551 -20.253 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.786 10.497 -21.965 1.00 0.00 H new ATOM 787 N VAL A 53 17.496 9.959 -18.581 1.00 0.00 N ATOM 788 CA VAL A 53 16.094 9.974 -18.156 1.00 0.00 C ATOM 789 C VAL A 53 15.946 10.321 -16.656 1.00 0.00 C ATOM 790 O VAL A 53 14.863 10.188 -16.087 1.00 0.00 O ATOM 791 CB VAL A 53 15.345 8.713 -18.626 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.161 8.750 -20.151 1.00 0.00 C ATOM 793 CG2 VAL A 53 15.979 7.374 -18.226 1.00 0.00 C ATOM 0 H VAL A 53 17.958 9.058 -18.457 1.00 0.00 H new ATOM 0 HA VAL A 53 15.586 10.794 -18.664 1.00 0.00 H new ATOM 0 HB VAL A 53 14.389 8.749 -18.103 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.631 7.855 -20.475 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.585 9.633 -20.427 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.137 8.788 -20.634 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.370 6.555 -18.608 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.983 7.307 -18.646 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.035 7.308 -17.139 1.00 0.00 H new ATOM 803 N GLY A 54 17.010 10.824 -16.019 1.00 0.00 N ATOM 804 CA GLY A 54 17.002 11.337 -14.654 1.00 0.00 C ATOM 805 C GLY A 54 16.970 10.246 -13.579 1.00 0.00 C ATOM 806 O GLY A 54 16.647 10.542 -12.427 1.00 0.00 O ATOM 0 H GLY A 54 17.928 10.885 -16.459 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.887 11.955 -14.504 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.135 11.985 -14.525 1.00 0.00 H new ATOM 810 N ILE A 55 17.277 8.996 -13.938 1.00 0.00 N ATOM 811 CA ILE A 55 17.124 7.826 -13.079 1.00 0.00 C ATOM 812 C ILE A 55 18.456 7.428 -12.445 1.00 0.00 C ATOM 813 O ILE A 55 19.498 7.418 -13.100 1.00 0.00 O ATOM 814 CB ILE A 55 16.421 6.694 -13.845 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.991 7.165 -14.200 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.448 5.343 -13.100 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.969 6.059 -14.446 1.00 0.00 C ATOM 0 H ILE A 55 17.649 8.768 -14.860 1.00 0.00 H new ATOM 0 HA ILE A 55 16.475 8.070 -12.238 1.00 0.00 H new ATOM 0 HB ILE A 55 16.971 6.492 -14.764 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.626 7.798 -13.391 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.045 7.789 -15.092 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.935 4.588 -13.696 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.482 5.037 -12.939 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.947 5.448 -12.138 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.003 6.503 -14.686 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.299 5.437 -15.278 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.873 5.446 -13.550 1.00 0.00 H new ATOM 829 N ASP A 56 18.383 7.025 -11.173 1.00 0.00 N ATOM 830 CA ASP A 56 19.466 6.402 -10.420 1.00 0.00 C ATOM 831 C ASP A 56 19.286 4.885 -10.458 1.00 0.00 C ATOM 832 O ASP A 56 18.198 4.393 -10.160 1.00 0.00 O ATOM 833 CB ASP A 56 19.453 6.916 -8.971 1.00 0.00 C ATOM 834 CG ASP A 56 20.231 5.983 -8.025 1.00 0.00 C ATOM 835 OD1 ASP A 56 21.479 6.069 -7.978 1.00 0.00 O ATOM 836 OD2 ASP A 56 19.581 5.158 -7.342 1.00 0.00 O ATOM 0 H ASP A 56 17.532 7.130 -10.621 1.00 0.00 H new ATOM 0 HA ASP A 56 20.428 6.658 -10.864 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.889 7.914 -8.936 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.423 7.006 -8.627 1.00 0.00 H new ATOM 841 N ILE A 57 20.352 4.155 -10.793 1.00 0.00 N ATOM 842 CA ILE A 57 20.461 2.691 -10.685 1.00 0.00 C ATOM 843 C ILE A 57 21.789 2.325 -10.013 1.00 0.00 C ATOM 844 O ILE A 57 21.851 1.323 -9.327 1.00 0.00 O ATOM 845 CB ILE A 57 20.323 1.977 -12.054 1.00 0.00 C ATOM 846 CG1 ILE A 57 21.102 2.734 -13.148 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.857 1.742 -12.464 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.150 1.985 -14.470 1.00 0.00 C ATOM 0 H ILE A 57 21.201 4.582 -11.163 1.00 0.00 H new ATOM 0 HA ILE A 57 19.630 2.342 -10.073 1.00 0.00 H new ATOM 0 HB ILE A 57 20.766 0.988 -11.939 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.641 3.709 -13.306 1.00 0.00 H new ATOM 0 HG13 ILE A 57 22.120 2.915 -12.802 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.826 1.239 -13.430 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.365 1.121 -11.716 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.342 2.700 -12.537 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.712 2.569 -15.199 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.637 1.021 -14.324 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.135 1.827 -14.836 1.00 0.00 H new ATOM 860 N SER A 58 22.831 3.127 -10.205 1.00 0.00 N ATOM 861 CA SER A 58 24.156 3.178 -9.573 1.00 0.00 C ATOM 862 C SER A 58 24.369 2.418 -8.245 1.00 0.00 C ATOM 863 O SER A 58 25.447 1.861 -8.044 1.00 0.00 O ATOM 864 CB SER A 58 24.474 4.677 -9.399 1.00 0.00 C ATOM 865 OG SER A 58 23.872 5.451 -10.434 1.00 0.00 O ATOM 0 H SER A 58 22.759 3.863 -10.907 1.00 0.00 H new ATOM 0 HA SER A 58 24.834 2.637 -10.232 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.114 5.018 -8.429 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.554 4.827 -9.409 1.00 0.00 H new ATOM 0 HG SER A 58 24.086 6.398 -10.301 1.00 0.00 H new ATOM 871 N GLY A 59 23.386 2.365 -7.346 1.00 0.00 N ATOM 872 CA GLY A 59 23.446 1.695 -6.048 1.00 0.00 C ATOM 873 C GLY A 59 22.570 0.439 -5.957 1.00 0.00 C ATOM 874 O GLY A 59 21.960 0.222 -4.910 1.00 0.00 O ATOM 0 H GLY A 59 22.483 2.810 -7.512 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.480 1.421 -5.839 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.139 2.397 -5.273 1.00 0.00 H new ATOM 878 N GLN A 60 22.454 -0.371 -7.027 1.00 0.00 N ATOM 879 CA GLN A 60 21.545 -1.531 -7.055 1.00 0.00 C ATOM 880 C GLN A 60 21.832 -2.579 -5.980 1.00 0.00 C ATOM 881 O GLN A 60 20.921 -3.309 -5.579 1.00 0.00 O ATOM 882 CB GLN A 60 21.638 -2.296 -8.388 1.00 0.00 C ATOM 883 CG GLN A 60 21.202 -1.478 -9.606 1.00 0.00 C ATOM 884 CD GLN A 60 20.545 -2.316 -10.693 1.00 0.00 C ATOM 885 OE1 GLN A 60 21.135 -2.616 -11.726 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.291 -2.668 -10.480 1.00 0.00 N ATOM 0 H GLN A 60 22.983 -0.241 -7.889 1.00 0.00 H new ATOM 0 HA GLN A 60 20.565 -1.083 -6.892 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.666 -2.627 -8.534 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.021 -3.192 -8.325 1.00 0.00 H new ATOM 0 HG2 GLN A 60 20.506 -0.704 -9.284 1.00 0.00 H new ATOM 0 HG3 GLN A 60 22.072 -0.971 -10.024 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.828 -2.403 -9.611 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.785 -3.205 -11.185 1.00 0.00 H new ATOM 895 N THR A 61 23.097 -2.713 -5.584 1.00 0.00 N ATOM 896 CA THR A 61 23.576 -3.798 -4.744 1.00 0.00 C ATOM 897 C THR A 61 22.787 -3.802 -3.430 1.00 0.00 C ATOM 898 O THR A 61 22.708 -2.787 -2.730 1.00 0.00 O ATOM 899 CB THR A 61 25.108 -3.698 -4.581 1.00 0.00 C ATOM 900 OG1 THR A 61 25.577 -2.360 -4.707 1.00 0.00 O ATOM 901 CG2 THR A 61 25.799 -4.505 -5.686 1.00 0.00 C ATOM 0 H THR A 61 23.829 -2.053 -5.847 1.00 0.00 H new ATOM 0 HA THR A 61 23.398 -4.769 -5.206 1.00 0.00 H new ATOM 0 HB THR A 61 25.339 -4.077 -3.586 1.00 0.00 H new ATOM 0 HG1 THR A 61 26.550 -2.343 -4.595 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.880 -4.432 -5.568 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.496 -5.550 -5.617 1.00 0.00 H new ATOM 0 HG23 THR A 61 25.513 -4.108 -6.660 1.00 0.00 H new ATOM 909 N SER A 62 22.167 -4.944 -3.134 1.00 0.00 N ATOM 910 CA SER A 62 21.197 -5.146 -2.085 1.00 0.00 C ATOM 911 C SER A 62 21.400 -6.571 -1.554 1.00 0.00 C ATOM 912 O SER A 62 22.242 -7.329 -2.055 1.00 0.00 O ATOM 913 CB SER A 62 19.800 -4.967 -2.707 1.00 0.00 C ATOM 914 OG SER A 62 19.574 -3.639 -3.157 1.00 0.00 O ATOM 0 H SER A 62 22.348 -5.799 -3.660 1.00 0.00 H new ATOM 0 HA SER A 62 21.305 -4.440 -1.261 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.687 -5.656 -3.544 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.041 -5.233 -1.971 1.00 0.00 H new ATOM 0 HG SER A 62 20.027 -3.503 -4.016 1.00 0.00 H new ATOM 920 N ASP A 63 20.632 -6.937 -0.534 1.00 0.00 N ATOM 921 CA ASP A 63 20.629 -8.281 0.036 1.00 0.00 C ATOM 922 C ASP A 63 20.249 -9.338 -1.015 1.00 0.00 C ATOM 923 O ASP A 63 19.519 -9.024 -1.966 1.00 0.00 O ATOM 924 CB ASP A 63 19.620 -8.327 1.182 1.00 0.00 C ATOM 925 CG ASP A 63 20.254 -7.915 2.519 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.035 -8.708 3.095 1.00 0.00 O ATOM 927 OD2 ASP A 63 19.982 -6.783 2.991 1.00 0.00 O ATOM 0 H ASP A 63 19.984 -6.299 -0.072 1.00 0.00 H new ATOM 0 HA ASP A 63 21.633 -8.507 0.395 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.784 -7.664 0.957 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.214 -9.335 1.268 1.00 0.00 H new ATOM 932 N PRO A 64 20.691 -10.600 -0.851 1.00 0.00 N ATOM 933 CA PRO A 64 20.229 -11.703 -1.678 1.00 0.00 C ATOM 934 C PRO A 64 18.727 -11.920 -1.464 1.00 0.00 C ATOM 935 O PRO A 64 18.202 -11.646 -0.384 1.00 0.00 O ATOM 936 CB PRO A 64 21.049 -12.918 -1.234 1.00 0.00 C ATOM 937 CG PRO A 64 21.341 -12.620 0.237 1.00 0.00 C ATOM 938 CD PRO A 64 21.515 -11.102 0.242 1.00 0.00 C ATOM 0 HA PRO A 64 20.364 -11.515 -2.743 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.491 -13.847 -1.354 1.00 0.00 H new ATOM 0 HB3 PRO A 64 21.966 -13.020 -1.815 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.523 -12.936 0.885 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.239 -13.132 0.584 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.201 -10.676 1.195 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.561 -10.829 0.100 1.00 0.00 H new ATOM 946 N ILE A 65 18.035 -12.482 -2.458 1.00 0.00 N ATOM 947 CA ILE A 65 16.580 -12.657 -2.406 1.00 0.00 C ATOM 948 C ILE A 65 16.171 -13.575 -1.241 1.00 0.00 C ATOM 949 O ILE A 65 15.063 -13.474 -0.717 1.00 0.00 O ATOM 950 CB ILE A 65 16.078 -13.144 -3.789 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.724 -12.497 -4.121 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.052 -14.677 -3.935 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.224 -12.787 -5.541 1.00 0.00 C ATOM 0 H ILE A 65 18.463 -12.827 -3.317 1.00 0.00 H new ATOM 0 HA ILE A 65 16.095 -11.703 -2.200 1.00 0.00 H new ATOM 0 HB ILE A 65 16.808 -12.813 -4.528 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.980 -12.849 -3.406 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.807 -11.418 -3.990 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.690 -14.942 -4.928 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.058 -15.073 -3.798 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.389 -15.103 -3.182 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.264 -12.295 -5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.946 -12.410 -6.265 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.106 -13.863 -5.673 1.00 0.00 H new ATOM 965 N GLU A 66 17.091 -14.441 -0.801 1.00 0.00 N ATOM 966 CA GLU A 66 16.870 -15.425 0.254 1.00 0.00 C ATOM 967 C GLU A 66 16.630 -14.735 1.600 1.00 0.00 C ATOM 968 O GLU A 66 16.008 -15.295 2.504 1.00 0.00 O ATOM 969 CB GLU A 66 18.105 -16.332 0.416 1.00 0.00 C ATOM 970 CG GLU A 66 18.756 -16.734 -0.907 1.00 0.00 C ATOM 971 CD GLU A 66 19.872 -17.773 -0.693 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.028 -17.376 -0.417 1.00 0.00 O ATOM 973 OE2 GLU A 66 19.600 -18.995 -0.802 1.00 0.00 O ATOM 0 H GLU A 66 18.036 -14.474 -1.183 1.00 0.00 H new ATOM 0 HA GLU A 66 15.998 -16.012 -0.032 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.843 -15.818 1.031 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.813 -17.233 0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.000 -17.143 -1.576 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.168 -15.850 -1.394 1.00 0.00 H new ATOM 980 N ASN A 67 17.173 -13.522 1.732 1.00 0.00 N ATOM 981 CA ASN A 67 17.052 -12.683 2.920 1.00 0.00 C ATOM 982 C ASN A 67 15.594 -12.284 3.195 1.00 0.00 C ATOM 983 O ASN A 67 15.237 -11.971 4.334 1.00 0.00 O ATOM 984 CB ASN A 67 17.898 -11.419 2.728 1.00 0.00 C ATOM 985 CG ASN A 67 18.163 -10.727 4.059 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.475 -9.786 4.450 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.176 -11.185 4.781 1.00 0.00 N ATOM 0 H ASN A 67 17.724 -13.087 0.992 1.00 0.00 H new ATOM 0 HA ASN A 67 17.406 -13.257 3.777 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.845 -11.680 2.256 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.384 -10.733 2.054 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.397 -10.756 5.679 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.734 -11.967 4.438 1.00 0.00 H new ATOM 994 N PHE A 68 14.755 -12.293 2.155 1.00 0.00 N ATOM 995 CA PHE A 68 13.367 -11.852 2.166 1.00 0.00 C ATOM 996 C PHE A 68 12.426 -13.057 2.157 1.00 0.00 C ATOM 997 O PHE A 68 12.853 -14.215 2.223 1.00 0.00 O ATOM 998 CB PHE A 68 13.110 -10.982 0.924 1.00 0.00 C ATOM 999 CG PHE A 68 14.024 -9.790 0.812 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.261 -9.924 0.166 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.655 -8.566 1.392 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.144 -8.834 0.104 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.527 -7.464 1.314 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.772 -7.598 0.668 1.00 0.00 C ATOM 0 H PHE A 68 15.047 -12.627 1.236 1.00 0.00 H new ATOM 0 HA PHE A 68 13.179 -11.273 3.070 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.222 -11.598 0.032 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.077 -10.634 0.944 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.535 -10.867 -0.284 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.705 -8.470 1.897 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.106 -8.943 -0.375 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.242 -6.517 1.749 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.441 -6.753 0.605 1.00 0.00 H new ATOM 1014 N ASN A 69 11.125 -12.770 2.054 1.00 0.00 N ATOM 1015 CA ASN A 69 10.098 -13.750 1.797 1.00 0.00 C ATOM 1016 C ASN A 69 9.187 -13.142 0.756 1.00 0.00 C ATOM 1017 O ASN A 69 8.774 -11.986 0.909 1.00 0.00 O ATOM 1018 CB ASN A 69 9.291 -14.053 3.058 1.00 0.00 C ATOM 1019 CG ASN A 69 8.323 -15.229 2.948 1.00 0.00 C ATOM 1020 OD1 ASN A 69 7.896 -15.620 1.868 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.911 -15.781 4.077 1.00 0.00 N ATOM 0 H ASN A 69 10.761 -11.822 2.152 1.00 0.00 H new ATOM 0 HA ASN A 69 10.543 -14.687 1.463 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.985 -14.251 3.875 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.725 -13.162 3.330 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.231 -16.541 4.055 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.274 -15.447 4.970 1.00 0.00 H new ATOM 1028 N ALA A 70 8.844 -13.887 -0.281 1.00 0.00 N ATOM 1029 CA ALA A 70 8.043 -13.333 -1.330 1.00 0.00 C ATOM 1030 C ALA A 70 6.606 -13.211 -0.856 1.00 0.00 C ATOM 1031 O ALA A 70 5.832 -12.452 -1.430 1.00 0.00 O ATOM 1032 CB ALA A 70 8.126 -14.188 -2.582 1.00 0.00 C ATOM 0 H ALA A 70 9.109 -14.864 -0.408 1.00 0.00 H new ATOM 0 HA ALA A 70 8.422 -12.342 -1.581 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.509 -13.747 -3.365 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.161 -14.238 -2.920 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.767 -15.193 -2.361 1.00 0.00 H new ATOM 1038 N ASP A 71 6.232 -13.952 0.186 1.00 0.00 N ATOM 1039 CA ASP A 71 4.890 -13.881 0.710 1.00 0.00 C ATOM 1040 C ASP A 71 4.595 -12.492 1.299 1.00 0.00 C ATOM 1041 O ASP A 71 3.436 -12.072 1.351 1.00 0.00 O ATOM 1042 CB ASP A 71 4.672 -14.964 1.769 1.00 0.00 C ATOM 1043 CG ASP A 71 3.230 -14.936 2.301 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.299 -15.318 1.550 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.026 -14.586 3.489 1.00 0.00 O ATOM 0 H ASP A 71 6.845 -14.603 0.676 1.00 0.00 H new ATOM 0 HA ASP A 71 4.199 -14.051 -0.116 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.886 -15.943 1.341 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.370 -14.817 2.593 1.00 0.00 H new ATOM 1050 N ASP A 72 5.641 -11.762 1.720 1.00 0.00 N ATOM 1051 CA ASP A 72 5.534 -10.383 2.180 1.00 0.00 C ATOM 1052 C ASP A 72 5.385 -9.402 1.009 1.00 0.00 C ATOM 1053 O ASP A 72 4.777 -8.335 1.145 1.00 0.00 O ATOM 1054 CB ASP A 72 6.776 -10.002 2.988 1.00 0.00 C ATOM 1055 CG ASP A 72 6.600 -8.616 3.638 1.00 0.00 C ATOM 1056 OD1 ASP A 72 5.754 -8.483 4.554 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.330 -7.662 3.273 1.00 0.00 O ATOM 0 H ASP A 72 6.594 -12.125 1.748 1.00 0.00 H new ATOM 0 HA ASP A 72 4.642 -10.317 2.803 1.00 0.00 H new ATOM 0 HB2 ASP A 72 6.958 -10.750 3.759 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.651 -9.996 2.338 1.00 0.00 H new ATOM 1062 N TYR A 73 5.944 -9.772 -0.146 1.00 0.00 N ATOM 1063 CA TYR A 73 5.902 -9.009 -1.379 1.00 0.00 C ATOM 1064 C TYR A 73 4.541 -9.143 -2.072 1.00 0.00 C ATOM 1065 O TYR A 73 3.692 -9.953 -1.682 1.00 0.00 O ATOM 1066 CB TYR A 73 7.093 -9.380 -2.287 1.00 0.00 C ATOM 1067 CG TYR A 73 8.359 -8.622 -1.932 1.00 0.00 C ATOM 1068 CD1 TYR A 73 8.969 -8.820 -0.680 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.873 -7.651 -2.816 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.040 -8.010 -0.274 1.00 0.00 C ATOM 1071 CE2 TYR A 73 9.953 -6.842 -2.420 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.523 -7.000 -1.135 1.00 0.00 C ATOM 1073 OH TYR A 73 11.521 -6.167 -0.726 1.00 0.00 O ATOM 0 H TYR A 73 6.457 -10.648 -0.243 1.00 0.00 H new ATOM 0 HA TYR A 73 6.010 -7.950 -1.143 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.282 -10.451 -2.211 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.831 -9.175 -3.325 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.610 -9.601 -0.027 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.437 -7.529 -3.797 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.494 -8.158 0.695 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.348 -6.099 -3.098 1.00 0.00 H new ATOM 0 HH TYR A 73 12.100 -6.637 -0.090 1.00 0.00 H new ATOM 1083 N ASP A 74 4.312 -8.292 -3.080 1.00 0.00 N ATOM 1084 CA ASP A 74 3.094 -8.317 -3.888 1.00 0.00 C ATOM 1085 C ASP A 74 3.406 -8.629 -5.350 1.00 0.00 C ATOM 1086 O ASP A 74 2.672 -9.392 -5.984 1.00 0.00 O ATOM 1087 CB ASP A 74 2.364 -6.979 -3.773 1.00 0.00 C ATOM 1088 CG ASP A 74 1.083 -6.991 -4.625 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.046 -7.498 -4.132 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.102 -6.453 -5.756 1.00 0.00 O ATOM 0 H ASP A 74 4.972 -7.565 -3.356 1.00 0.00 H new ATOM 0 HA ASP A 74 2.449 -9.110 -3.509 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.113 -6.783 -2.731 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.018 -6.171 -4.101 1.00 0.00 H new ATOM 1095 N VAL A 75 4.506 -8.078 -5.879 1.00 0.00 N ATOM 1096 CA VAL A 75 4.812 -8.110 -7.291 1.00 0.00 C ATOM 1097 C VAL A 75 6.299 -8.403 -7.496 1.00 0.00 C ATOM 1098 O VAL A 75 7.176 -7.805 -6.868 1.00 0.00 O ATOM 1099 CB VAL A 75 4.326 -6.800 -7.950 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.431 -5.504 -7.127 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.966 -6.610 -9.332 1.00 0.00 C ATOM 0 H VAL A 75 5.209 -7.594 -5.320 1.00 0.00 H new ATOM 0 HA VAL A 75 4.279 -8.921 -7.788 1.00 0.00 H new ATOM 0 HB VAL A 75 3.251 -6.959 -8.032 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.054 -4.668 -7.716 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.840 -5.602 -6.216 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.473 -5.323 -6.865 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.607 -5.681 -9.774 1.00 0.00 H new ATOM 0 HG22 VAL A 75 6.050 -6.568 -9.228 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.696 -7.447 -9.976 1.00 0.00 H new ATOM 1111 N VAL A 76 6.603 -9.302 -8.426 1.00 0.00 N ATOM 1112 CA VAL A 76 7.965 -9.641 -8.790 1.00 0.00 C ATOM 1113 C VAL A 76 7.954 -9.851 -10.301 1.00 0.00 C ATOM 1114 O VAL A 76 7.055 -10.495 -10.850 1.00 0.00 O ATOM 1115 CB VAL A 76 8.405 -10.891 -8.014 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.766 -11.426 -8.485 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.468 -10.682 -6.484 1.00 0.00 C ATOM 0 H VAL A 76 5.899 -9.819 -8.952 1.00 0.00 H new ATOM 0 HA VAL A 76 8.682 -8.861 -8.536 1.00 0.00 H new ATOM 0 HB VAL A 76 7.626 -11.622 -8.231 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.030 -12.310 -7.904 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.708 -11.690 -9.541 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.527 -10.659 -8.344 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.786 -11.607 -6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.181 -9.890 -6.254 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.482 -10.401 -6.114 1.00 0.00 H new ATOM 1127 N ILE A 77 8.942 -9.260 -10.963 1.00 0.00 N ATOM 1128 CA ILE A 77 9.027 -9.154 -12.400 1.00 0.00 C ATOM 1129 C ILE A 77 10.285 -9.914 -12.783 1.00 0.00 C ATOM 1130 O ILE A 77 11.403 -9.425 -12.600 1.00 0.00 O ATOM 1131 CB ILE A 77 9.106 -7.667 -12.774 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.985 -6.794 -12.157 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.143 -7.509 -14.296 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.561 -7.180 -12.563 1.00 0.00 C ATOM 0 H ILE A 77 9.733 -8.827 -10.487 1.00 0.00 H new ATOM 0 HA ILE A 77 8.166 -9.568 -12.924 1.00 0.00 H new ATOM 0 HB ILE A 77 10.033 -7.294 -12.339 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.063 -6.845 -11.071 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.158 -5.756 -12.440 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.199 -6.451 -14.551 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.017 -8.025 -14.694 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.240 -7.939 -14.729 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.850 -6.510 -12.079 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.457 -7.099 -13.645 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.360 -8.206 -12.255 1.00 0.00 H new ATOM 1146 N SER A 78 10.117 -11.120 -13.292 1.00 0.00 N ATOM 1147 CA SER A 78 11.212 -12.013 -13.563 1.00 0.00 C ATOM 1148 C SER A 78 11.469 -11.937 -15.055 1.00 0.00 C ATOM 1149 O SER A 78 11.152 -12.856 -15.801 1.00 0.00 O ATOM 1150 CB SER A 78 10.829 -13.412 -13.092 1.00 0.00 C ATOM 1151 OG SER A 78 10.511 -13.391 -11.706 1.00 0.00 O ATOM 0 H SER A 78 9.203 -11.505 -13.529 1.00 0.00 H new ATOM 0 HA SER A 78 12.127 -11.745 -13.034 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.975 -13.775 -13.664 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.652 -14.103 -13.274 1.00 0.00 H new ATOM 0 HG SER A 78 10.873 -14.193 -11.275 1.00 0.00 H new ATOM 1157 N LEU A 79 12.003 -10.804 -15.509 1.00 0.00 N ATOM 1158 CA LEU A 79 12.127 -10.469 -16.931 1.00 0.00 C ATOM 1159 C LEU A 79 13.187 -11.298 -17.684 1.00 0.00 C ATOM 1160 O LEU A 79 13.684 -10.853 -18.718 1.00 0.00 O ATOM 1161 CB LEU A 79 12.216 -8.939 -17.130 1.00 0.00 C ATOM 1162 CG LEU A 79 13.207 -8.173 -16.229 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.609 -8.779 -16.235 1.00 0.00 C ATOM 1164 CD2 LEU A 79 13.281 -6.707 -16.664 1.00 0.00 C ATOM 0 H LEU A 79 12.368 -10.080 -14.891 1.00 0.00 H new ATOM 0 HA LEU A 79 11.206 -10.781 -17.423 1.00 0.00 H new ATOM 0 HB2 LEU A 79 12.485 -8.747 -18.169 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.222 -8.519 -16.975 1.00 0.00 H new ATOM 0 HG LEU A 79 12.828 -8.248 -15.210 1.00 0.00 H new ATOM 0 HD11 LEU A 79 15.260 -8.196 -15.583 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.562 -9.807 -15.876 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.007 -8.766 -17.250 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.982 -6.172 -16.023 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.619 -6.651 -17.699 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.294 -6.252 -16.580 1.00 0.00 H new ATOM 1176 N CYS A 80 13.536 -12.489 -17.190 1.00 0.00 N ATOM 1177 CA CYS A 80 14.393 -13.464 -17.845 1.00 0.00 C ATOM 1178 C CYS A 80 13.935 -14.893 -17.488 1.00 0.00 C ATOM 1179 O CYS A 80 14.727 -15.690 -16.972 1.00 0.00 O ATOM 1180 CB CYS A 80 15.864 -13.244 -17.442 1.00 0.00 C ATOM 1181 SG CYS A 80 16.594 -11.666 -17.938 1.00 0.00 S ATOM 0 H CYS A 80 13.210 -12.809 -16.278 1.00 0.00 H new ATOM 0 HA CYS A 80 14.315 -13.335 -18.924 1.00 0.00 H new ATOM 0 HB2 CYS A 80 15.940 -13.332 -16.358 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.462 -14.049 -17.870 1.00 0.00 H new ATOM 1186 N GLY A 81 12.670 -15.234 -17.736 1.00 0.00 N ATOM 1187 CA GLY A 81 12.146 -16.574 -17.499 1.00 0.00 C ATOM 1188 C GLY A 81 11.771 -16.810 -16.034 1.00 0.00 C ATOM 1189 O GLY A 81 11.657 -15.869 -15.246 1.00 0.00 O ATOM 0 H GLY A 81 11.979 -14.583 -18.109 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.268 -16.732 -18.125 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.891 -17.310 -17.802 1.00 0.00 H new ATOM 1193 N SER A 82 11.538 -18.073 -15.667 1.00 0.00 N ATOM 1194 CA SER A 82 10.968 -18.449 -14.374 1.00 0.00 C ATOM 1195 C SER A 82 11.450 -19.845 -13.964 1.00 0.00 C ATOM 1196 O SER A 82 11.754 -20.676 -14.825 1.00 0.00 O ATOM 1197 CB SER A 82 9.431 -18.357 -14.442 1.00 0.00 C ATOM 1198 OG SER A 82 8.887 -19.013 -15.583 1.00 0.00 O ATOM 0 H SER A 82 11.743 -18.871 -16.268 1.00 0.00 H new ATOM 0 HA SER A 82 11.309 -17.757 -13.604 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.005 -18.796 -13.540 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.135 -17.308 -14.457 1.00 0.00 H new ATOM 0 HG SER A 82 7.911 -18.926 -15.576 1.00 0.00 H new ATOM 1204 N GLY A 83 11.557 -20.094 -12.649 1.00 0.00 N ATOM 1205 CA GLY A 83 12.024 -21.374 -12.110 1.00 0.00 C ATOM 1206 C GLY A 83 13.455 -21.695 -12.548 1.00 0.00 C ATOM 1207 O GLY A 83 13.807 -22.867 -12.683 1.00 0.00 O ATOM 0 H GLY A 83 11.321 -19.409 -11.931 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.976 -21.348 -11.021 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.357 -22.171 -12.440 1.00 0.00 H new ATOM 1211 N VAL A 84 14.269 -20.662 -12.807 1.00 0.00 N ATOM 1212 CA VAL A 84 15.577 -20.818 -13.447 1.00 0.00 C ATOM 1213 C VAL A 84 16.599 -21.479 -12.502 1.00 0.00 C ATOM 1214 O VAL A 84 17.453 -22.247 -12.946 1.00 0.00 O ATOM 1215 CB VAL A 84 16.035 -19.461 -14.042 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.037 -18.940 -15.089 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.266 -18.356 -12.997 1.00 0.00 C ATOM 0 H VAL A 84 14.036 -19.696 -12.578 1.00 0.00 H new ATOM 0 HA VAL A 84 15.495 -21.512 -14.284 1.00 0.00 H new ATOM 0 HB VAL A 84 16.997 -19.682 -14.505 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.389 -17.988 -15.485 1.00 0.00 H new ATOM 0 HG12 VAL A 84 14.952 -19.662 -15.901 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.061 -18.801 -14.624 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.584 -17.442 -13.498 1.00 0.00 H new ATOM 0 HG22 VAL A 84 15.339 -18.169 -12.454 1.00 0.00 H new ATOM 0 HG23 VAL A 84 17.039 -18.673 -12.297 1.00 0.00 H new ATOM 1227 N ASN A 85 16.490 -21.180 -11.203 1.00 0.00 N ATOM 1228 CA ASN A 85 17.238 -21.737 -10.061 1.00 0.00 C ATOM 1229 C ASN A 85 16.666 -21.062 -8.806 1.00 0.00 C ATOM 1230 O ASN A 85 16.395 -21.707 -7.794 1.00 0.00 O ATOM 1231 CB ASN A 85 18.741 -21.409 -10.151 1.00 0.00 C ATOM 1232 CG ASN A 85 19.464 -21.786 -8.855 1.00 0.00 C ATOM 1233 OD1 ASN A 85 19.734 -20.934 -8.012 1.00 0.00 O ATOM 1234 ND2 ASN A 85 19.774 -23.058 -8.659 1.00 0.00 N ATOM 0 H ASN A 85 15.817 -20.480 -10.892 1.00 0.00 H new ATOM 0 HA ASN A 85 17.137 -22.822 -10.045 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.185 -21.947 -10.989 1.00 0.00 H new ATOM 0 HB3 ASN A 85 18.873 -20.345 -10.349 1.00 0.00 H new ATOM 0 HD21 ASN A 85 20.243 -23.342 -7.799 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.543 -23.754 -9.368 1.00 0.00 H new ATOM 1241 N LEU A 86 16.456 -19.743 -8.937 1.00 0.00 N ATOM 1242 CA LEU A 86 15.742 -18.848 -8.031 1.00 0.00 C ATOM 1243 C LEU A 86 14.420 -19.484 -7.539 1.00 0.00 C ATOM 1244 O LEU A 86 13.735 -20.106 -8.359 1.00 0.00 O ATOM 1245 CB LEU A 86 15.539 -17.537 -8.825 1.00 0.00 C ATOM 1246 CG LEU A 86 14.540 -16.529 -8.228 1.00 0.00 C ATOM 1247 CD1 LEU A 86 15.019 -15.094 -8.485 1.00 0.00 C ATOM 1248 CD2 LEU A 86 13.170 -16.668 -8.908 1.00 0.00 C ATOM 0 H LEU A 86 16.813 -19.239 -9.749 1.00 0.00 H new ATOM 0 HA LEU A 86 16.299 -18.650 -7.115 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.506 -17.043 -8.924 1.00 0.00 H new ATOM 0 HB3 LEU A 86 15.207 -17.794 -9.831 1.00 0.00 H new ATOM 0 HG LEU A 86 14.466 -16.732 -7.160 1.00 0.00 H new ATOM 0 HD11 LEU A 86 14.305 -14.390 -8.058 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.994 -14.947 -8.021 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.099 -14.924 -9.559 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.474 -15.949 -8.475 1.00 0.00 H new ATOM 0 HD22 LEU A 86 13.273 -16.476 -9.976 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.789 -17.678 -8.756 1.00 0.00 H new ATOM 1260 N PRO A 87 14.037 -19.335 -6.247 1.00 0.00 N ATOM 1261 CA PRO A 87 12.921 -20.092 -5.677 1.00 0.00 C ATOM 1262 C PRO A 87 11.534 -19.785 -6.272 1.00 0.00 C ATOM 1263 O PRO A 87 11.284 -18.643 -6.660 1.00 0.00 O ATOM 1264 CB PRO A 87 12.955 -19.864 -4.162 1.00 0.00 C ATOM 1265 CG PRO A 87 14.416 -19.522 -3.897 1.00 0.00 C ATOM 1266 CD PRO A 87 14.823 -18.757 -5.156 1.00 0.00 C ATOM 0 HA PRO A 87 13.062 -21.142 -5.935 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.290 -19.054 -3.861 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.643 -20.753 -3.613 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.532 -18.914 -3.000 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.021 -20.418 -3.755 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.619 -17.692 -5.049 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.891 -18.859 -5.347 1.00 0.00 H new ATOM 1274 N PRO A 88 10.590 -20.749 -6.284 1.00 0.00 N ATOM 1275 CA PRO A 88 9.291 -20.569 -6.933 1.00 0.00 C ATOM 1276 C PRO A 88 8.408 -19.494 -6.316 1.00 0.00 C ATOM 1277 O PRO A 88 7.683 -18.840 -7.059 1.00 0.00 O ATOM 1278 CB PRO A 88 8.604 -21.940 -6.907 1.00 0.00 C ATOM 1279 CG PRO A 88 9.771 -22.917 -6.805 1.00 0.00 C ATOM 1280 CD PRO A 88 10.759 -22.154 -5.927 1.00 0.00 C ATOM 0 HA PRO A 88 9.455 -20.205 -7.947 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.926 -22.034 -6.059 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.014 -22.111 -7.807 1.00 0.00 H new ATOM 0 HG2 PRO A 88 9.471 -23.862 -6.353 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.192 -23.151 -7.783 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.553 -22.318 -4.869 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.782 -22.485 -6.107 1.00 0.00 H new ATOM 1288 N GLU A 89 8.501 -19.237 -5.007 1.00 0.00 N ATOM 1289 CA GLU A 89 7.637 -18.259 -4.329 1.00 0.00 C ATOM 1290 C GLU A 89 7.716 -16.857 -4.960 1.00 0.00 C ATOM 1291 O GLU A 89 6.798 -16.042 -4.823 1.00 0.00 O ATOM 1292 CB GLU A 89 7.977 -18.231 -2.824 1.00 0.00 C ATOM 1293 CG GLU A 89 9.375 -17.672 -2.495 1.00 0.00 C ATOM 1294 CD GLU A 89 9.690 -17.750 -0.988 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.871 -18.877 -0.461 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.789 -16.682 -0.336 1.00 0.00 O ATOM 0 H GLU A 89 9.171 -19.696 -4.390 1.00 0.00 H new ATOM 0 HA GLU A 89 6.602 -18.577 -4.455 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.229 -17.631 -2.306 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.902 -19.244 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.128 -18.229 -3.052 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.437 -16.635 -2.825 1.00 0.00 H new ATOM 1303 N TRP A 90 8.802 -16.589 -5.689 1.00 0.00 N ATOM 1304 CA TRP A 90 9.065 -15.329 -6.354 1.00 0.00 C ATOM 1305 C TRP A 90 8.309 -15.205 -7.673 1.00 0.00 C ATOM 1306 O TRP A 90 7.955 -14.097 -8.064 1.00 0.00 O ATOM 1307 CB TRP A 90 10.581 -15.230 -6.540 1.00 0.00 C ATOM 1308 CG TRP A 90 11.308 -15.091 -5.235 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.024 -16.041 -4.593 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.263 -13.962 -4.322 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.368 -15.591 -3.331 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.851 -14.336 -3.081 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.722 -12.671 -4.414 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.833 -13.483 -1.964 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.669 -11.816 -3.303 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.218 -12.222 -2.077 1.00 0.00 C ATOM 0 H TRP A 90 9.544 -17.274 -5.832 1.00 0.00 H new ATOM 0 HA TRP A 90 8.705 -14.497 -5.748 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.940 -16.118 -7.060 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.812 -14.374 -7.175 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.287 -17.005 -5.003 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.933 -16.121 -2.668 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.337 -12.327 -5.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.285 -13.791 -1.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.205 -10.845 -3.391 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.169 -11.567 -1.220 1.00 0.00 H new ATOM 1327 N VAL A 91 8.019 -16.312 -8.348 1.00 0.00 N ATOM 1328 CA VAL A 91 7.301 -16.353 -9.608 1.00 0.00 C ATOM 1329 C VAL A 91 5.833 -16.736 -9.419 1.00 0.00 C ATOM 1330 O VAL A 91 5.074 -16.672 -10.382 1.00 0.00 O ATOM 1331 CB VAL A 91 8.064 -17.225 -10.622 1.00 0.00 C ATOM 1332 CG1 VAL A 91 9.362 -16.523 -11.045 1.00 0.00 C ATOM 1333 CG2 VAL A 91 8.415 -18.631 -10.118 1.00 0.00 C ATOM 0 H VAL A 91 8.290 -17.238 -8.017 1.00 0.00 H new ATOM 0 HA VAL A 91 7.263 -15.350 -10.032 1.00 0.00 H new ATOM 0 HB VAL A 91 7.381 -17.352 -11.462 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.896 -17.146 -11.762 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.124 -15.564 -11.505 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.989 -16.360 -10.169 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.951 -19.174 -10.897 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.045 -18.553 -9.232 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.499 -19.167 -9.867 1.00 0.00 H new ATOM 1343 N THR A 92 5.394 -17.068 -8.199 1.00 0.00 N ATOM 1344 CA THR A 92 3.996 -17.359 -7.897 1.00 0.00 C ATOM 1345 C THR A 92 3.297 -16.196 -7.179 1.00 0.00 C ATOM 1346 O THR A 92 2.411 -16.399 -6.341 1.00 0.00 O ATOM 1347 CB THR A 92 3.931 -18.692 -7.128 1.00 0.00 C ATOM 1348 OG1 THR A 92 4.618 -18.602 -5.890 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.581 -19.825 -7.917 1.00 0.00 C ATOM 0 H THR A 92 6.009 -17.142 -7.389 1.00 0.00 H new ATOM 0 HA THR A 92 3.434 -17.471 -8.824 1.00 0.00 H new ATOM 0 HB THR A 92 2.873 -18.899 -6.968 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.561 -19.460 -5.421 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.517 -20.750 -7.345 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.063 -19.950 -8.868 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.628 -19.585 -8.103 1.00 0.00 H new ATOM 1357 N GLN A 93 3.734 -14.968 -7.463 1.00 0.00 N ATOM 1358 CA GLN A 93 3.246 -13.774 -6.798 1.00 0.00 C ATOM 1359 C GLN A 93 1.818 -13.431 -7.246 1.00 0.00 C ATOM 1360 O GLN A 93 1.279 -14.066 -8.159 1.00 0.00 O ATOM 1361 CB GLN A 93 4.248 -12.634 -7.051 1.00 0.00 C ATOM 1362 CG GLN A 93 5.517 -12.827 -6.219 1.00 0.00 C ATOM 1363 CD GLN A 93 5.268 -12.519 -4.747 1.00 0.00 C ATOM 1364 OE1 GLN A 93 5.158 -11.356 -4.373 1.00 0.00 O ATOM 1365 NE2 GLN A 93 5.146 -13.532 -3.899 1.00 0.00 N ATOM 0 H GLN A 93 4.445 -14.780 -8.170 1.00 0.00 H new ATOM 0 HA GLN A 93 3.178 -13.940 -5.723 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.505 -12.598 -8.110 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.787 -11.678 -6.802 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.870 -13.853 -6.323 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.306 -12.178 -6.600 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.241 -14.491 -4.233 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.957 -13.352 -2.913 1.00 0.00 H new ATOM 1374 N GLU A 94 1.207 -12.405 -6.631 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.155 -11.982 -6.978 1.00 0.00 C ATOM 1376 C GLU A 94 -0.220 -11.524 -8.446 1.00 0.00 C ATOM 1377 O GLU A 94 -1.267 -11.616 -9.091 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.645 -10.868 -6.035 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.762 -11.304 -4.565 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.788 -12.441 -4.368 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.013 -12.174 -4.413 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.376 -13.607 -4.153 1.00 0.00 O ATOM 0 H GLU A 94 1.638 -11.853 -5.889 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.818 -12.838 -6.855 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.040 -10.023 -6.100 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.618 -10.517 -6.378 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.214 -11.633 -4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.052 -10.447 -3.957 1.00 0.00 H new ATOM 1389 N ILE A 95 0.915 -11.068 -8.977 1.00 0.00 N ATOM 1390 CA ILE A 95 1.162 -10.790 -10.377 1.00 0.00 C ATOM 1391 C ILE A 95 2.554 -11.366 -10.656 1.00 0.00 C ATOM 1392 O ILE A 95 3.520 -11.025 -9.967 1.00 0.00 O ATOM 1393 CB ILE A 95 1.018 -9.280 -10.701 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.605 -8.979 -12.103 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.663 -8.388 -9.626 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.296 -7.578 -12.643 1.00 0.00 C ATOM 0 H ILE A 95 1.732 -10.874 -8.398 1.00 0.00 H new ATOM 0 HA ILE A 95 0.426 -11.253 -11.034 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.046 -9.042 -10.704 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.687 -9.107 -12.063 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.222 -9.717 -12.808 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.536 -7.340 -9.898 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.185 -8.574 -8.664 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.726 -8.617 -9.553 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.747 -7.460 -13.628 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.217 -7.448 -12.721 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.704 -6.829 -11.965 1.00 0.00 H new ATOM 1408 N PHE A 96 2.638 -12.249 -11.651 1.00 0.00 N ATOM 1409 CA PHE A 96 3.888 -12.739 -12.207 1.00 0.00 C ATOM 1410 C PHE A 96 4.068 -12.001 -13.544 1.00 0.00 C ATOM 1411 O PHE A 96 3.106 -11.910 -14.314 1.00 0.00 O ATOM 1412 CB PHE A 96 3.831 -14.259 -12.386 1.00 0.00 C ATOM 1413 CG PHE A 96 4.877 -14.808 -13.343 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.245 -14.743 -13.011 1.00 0.00 C ATOM 1415 CD2 PHE A 96 4.486 -15.342 -14.585 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.213 -15.206 -13.922 1.00 0.00 C ATOM 1417 CE2 PHE A 96 5.453 -15.807 -15.492 1.00 0.00 C ATOM 1418 CZ PHE A 96 6.818 -15.736 -15.162 1.00 0.00 C ATOM 0 H PHE A 96 1.815 -12.650 -12.100 1.00 0.00 H new ATOM 0 HA PHE A 96 4.737 -12.548 -11.550 1.00 0.00 H new ATOM 0 HB2 PHE A 96 3.958 -14.734 -11.413 1.00 0.00 H new ATOM 0 HB3 PHE A 96 2.841 -14.535 -12.749 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.551 -14.338 -12.058 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.438 -15.395 -14.842 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.261 -15.154 -13.667 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.148 -16.219 -16.443 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.562 -16.088 -15.861 1.00 0.00 H new ATOM 1428 N GLU A 97 5.266 -11.492 -13.836 1.00 0.00 N ATOM 1429 CA GLU A 97 5.620 -10.953 -15.148 1.00 0.00 C ATOM 1430 C GLU A 97 7.010 -11.456 -15.520 1.00 0.00 C ATOM 1431 O GLU A 97 7.774 -11.906 -14.661 1.00 0.00 O ATOM 1432 CB GLU A 97 5.578 -9.418 -15.180 1.00 0.00 C ATOM 1433 CG GLU A 97 4.188 -8.771 -15.052 1.00 0.00 C ATOM 1434 CD GLU A 97 3.336 -8.802 -16.340 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.525 -9.679 -17.217 1.00 0.00 O ATOM 1436 OE2 GLU A 97 2.456 -7.916 -16.485 1.00 0.00 O ATOM 0 H GLU A 97 6.027 -11.442 -13.158 1.00 0.00 H new ATOM 0 HA GLU A 97 4.883 -11.298 -15.873 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.206 -9.042 -14.373 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.026 -9.083 -16.115 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.639 -9.278 -14.258 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.313 -7.734 -14.741 1.00 0.00 H new ATOM 1443 N ASP A 98 7.315 -11.363 -16.807 1.00 0.00 N ATOM 1444 CA ASP A 98 8.466 -11.950 -17.476 1.00 0.00 C ATOM 1445 C ASP A 98 8.359 -11.518 -18.932 1.00 0.00 C ATOM 1446 O ASP A 98 7.303 -11.706 -19.547 1.00 0.00 O ATOM 1447 CB ASP A 98 8.465 -13.487 -17.440 1.00 0.00 C ATOM 1448 CG ASP A 98 9.460 -14.098 -18.452 1.00 0.00 C ATOM 1449 OD1 ASP A 98 10.561 -13.540 -18.682 1.00 0.00 O ATOM 1450 OD2 ASP A 98 9.127 -15.160 -19.030 1.00 0.00 O ATOM 0 H ASP A 98 6.725 -10.840 -17.454 1.00 0.00 H new ATOM 0 HA ASP A 98 9.377 -11.620 -16.976 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.719 -13.825 -16.435 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.461 -13.853 -17.655 1.00 0.00 H new ATOM 1455 N TRP A 99 9.422 -10.924 -19.474 1.00 0.00 N ATOM 1456 CA TRP A 99 9.385 -10.293 -20.789 1.00 0.00 C ATOM 1457 C TRP A 99 10.699 -10.505 -21.527 1.00 0.00 C ATOM 1458 O TRP A 99 11.765 -10.502 -20.913 1.00 0.00 O ATOM 1459 CB TRP A 99 9.105 -8.789 -20.652 1.00 0.00 C ATOM 1460 CG TRP A 99 7.844 -8.393 -19.941 1.00 0.00 C ATOM 1461 CD1 TRP A 99 6.587 -8.830 -20.189 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.716 -7.475 -18.821 1.00 0.00 C ATOM 1463 NE1 TRP A 99 5.709 -8.256 -19.288 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.344 -7.375 -18.450 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.636 -6.725 -18.073 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.899 -6.541 -17.414 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.206 -5.917 -17.012 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.844 -5.806 -16.684 1.00 0.00 C ATOM 0 H TRP A 99 10.330 -10.868 -19.013 1.00 0.00 H new ATOM 0 HA TRP A 99 8.582 -10.756 -21.363 1.00 0.00 H new ATOM 0 HB2 TRP A 99 9.946 -8.334 -20.129 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.080 -8.356 -21.652 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.312 -9.522 -20.971 1.00 0.00 H new ATOM 0 HE1 TRP A 99 4.711 -8.463 -19.251 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.687 -6.771 -18.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.847 -6.466 -17.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.936 -5.369 -16.435 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.528 -5.161 -15.877 1.00 0.00 H new ATOM 1479 N GLN A 100 10.643 -10.582 -22.858 1.00 0.00 N ATOM 1480 CA GLN A 100 11.811 -10.697 -23.726 1.00 0.00 C ATOM 1481 C GLN A 100 12.410 -9.298 -23.971 1.00 0.00 C ATOM 1482 O GLN A 100 12.536 -8.845 -25.110 1.00 0.00 O ATOM 1483 CB GLN A 100 11.419 -11.475 -25.001 1.00 0.00 C ATOM 1484 CG GLN A 100 12.615 -12.143 -25.697 1.00 0.00 C ATOM 1485 CD GLN A 100 13.033 -13.442 -24.998 1.00 0.00 C ATOM 1486 OE1 GLN A 100 13.815 -13.433 -24.050 1.00 0.00 O ATOM 1487 NE2 GLN A 100 12.502 -14.584 -25.411 1.00 0.00 N ATOM 0 H GLN A 100 9.762 -10.566 -23.372 1.00 0.00 H new ATOM 0 HA GLN A 100 12.608 -11.275 -23.259 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.686 -12.239 -24.741 1.00 0.00 H new ATOM 0 HB3 GLN A 100 10.935 -10.793 -25.700 1.00 0.00 H new ATOM 0 HG2 GLN A 100 12.358 -12.356 -26.735 1.00 0.00 H new ATOM 0 HG3 GLN A 100 13.458 -11.452 -25.713 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.853 -14.590 -26.198 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.742 -15.457 -24.942 1.00 0.00 H new ATOM 1496 N LEU A 101 12.712 -8.573 -22.885 1.00 0.00 N ATOM 1497 CA LEU A 101 13.320 -7.247 -22.948 1.00 0.00 C ATOM 1498 C LEU A 101 14.714 -7.369 -23.564 1.00 0.00 C ATOM 1499 O LEU A 101 15.396 -8.372 -23.369 1.00 0.00 O ATOM 1500 CB LEU A 101 13.337 -6.593 -21.537 1.00 0.00 C ATOM 1501 CG LEU A 101 12.553 -5.276 -21.423 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.101 -5.388 -21.887 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.541 -4.845 -19.953 1.00 0.00 C ATOM 0 H LEU A 101 12.538 -8.897 -21.934 1.00 0.00 H new ATOM 0 HA LEU A 101 12.731 -6.587 -23.585 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.930 -7.304 -20.818 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.372 -6.408 -21.251 1.00 0.00 H new ATOM 0 HG LEU A 101 13.051 -4.554 -22.070 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.609 -4.422 -21.778 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.076 -5.693 -22.933 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.581 -6.130 -21.281 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.988 -3.911 -19.852 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.061 -5.617 -19.351 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.565 -4.700 -19.608 1.00 0.00 H new ATOM 1515 N GLU A 102 15.150 -6.352 -24.303 1.00 0.00 N ATOM 1516 CA GLU A 102 16.531 -6.266 -24.744 1.00 0.00 C ATOM 1517 C GLU A 102 17.384 -5.785 -23.561 1.00 0.00 C ATOM 1518 O GLU A 102 16.856 -5.289 -22.561 1.00 0.00 O ATOM 1519 CB GLU A 102 16.649 -5.379 -25.999 1.00 0.00 C ATOM 1520 CG GLU A 102 16.189 -6.091 -27.279 1.00 0.00 C ATOM 1521 CD GLU A 102 17.021 -7.347 -27.620 1.00 0.00 C ATOM 1522 OE1 GLU A 102 18.269 -7.321 -27.483 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.428 -8.368 -28.041 1.00 0.00 O ATOM 0 H GLU A 102 14.562 -5.576 -24.607 1.00 0.00 H new ATOM 0 HA GLU A 102 16.906 -7.243 -25.050 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.054 -4.477 -25.857 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.685 -5.062 -26.118 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.143 -6.377 -27.170 1.00 0.00 H new ATOM 0 HG3 GLU A 102 16.243 -5.392 -28.113 1.00 0.00 H new ATOM 1530 N ASP A 103 18.707 -5.904 -23.671 1.00 0.00 N ATOM 1531 CA ASP A 103 19.659 -5.346 -22.723 1.00 0.00 C ATOM 1532 C ASP A 103 20.800 -4.662 -23.491 1.00 0.00 C ATOM 1533 O ASP A 103 21.246 -5.220 -24.501 1.00 0.00 O ATOM 1534 CB ASP A 103 20.228 -6.413 -21.797 1.00 0.00 C ATOM 1535 CG ASP A 103 21.241 -5.750 -20.858 1.00 0.00 C ATOM 1536 OD1 ASP A 103 20.806 -5.167 -19.837 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.444 -5.785 -21.172 1.00 0.00 O ATOM 0 H ASP A 103 19.152 -6.403 -24.441 1.00 0.00 H new ATOM 0 HA ASP A 103 19.133 -4.619 -22.104 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.429 -6.882 -21.223 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.708 -7.201 -22.377 1.00 0.00 H new ATOM 1542 N PRO A 104 21.275 -3.476 -23.080 1.00 0.00 N ATOM 1543 CA PRO A 104 22.224 -2.706 -23.864 1.00 0.00 C ATOM 1544 C PRO A 104 23.702 -2.959 -23.518 1.00 0.00 C ATOM 1545 O PRO A 104 24.554 -2.269 -24.077 1.00 0.00 O ATOM 1546 CB PRO A 104 21.802 -1.264 -23.608 1.00 0.00 C ATOM 1547 CG PRO A 104 21.421 -1.288 -22.132 1.00 0.00 C ATOM 1548 CD PRO A 104 20.740 -2.645 -22.003 1.00 0.00 C ATOM 0 HA PRO A 104 22.190 -2.990 -24.916 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.613 -0.563 -23.806 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.963 -0.969 -24.239 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.294 -1.206 -21.484 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.751 -0.469 -21.870 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.944 -3.091 -21.030 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.658 -2.547 -22.089 1.00 0.00 H new ATOM 1556 N ASP A 105 24.036 -3.885 -22.614 1.00 0.00 N ATOM 1557 CA ASP A 105 25.416 -4.086 -22.163 1.00 0.00 C ATOM 1558 C ASP A 105 26.345 -4.357 -23.353 1.00 0.00 C ATOM 1559 O ASP A 105 26.140 -5.317 -24.105 1.00 0.00 O ATOM 1560 CB ASP A 105 25.533 -5.250 -21.177 1.00 0.00 C ATOM 1561 CG ASP A 105 27.013 -5.519 -20.872 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.727 -4.556 -20.507 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.463 -6.684 -20.975 1.00 0.00 O ATOM 0 H ASP A 105 23.362 -4.513 -22.177 1.00 0.00 H new ATOM 0 HA ASP A 105 25.714 -3.167 -21.659 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.998 -5.015 -20.257 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.069 -6.143 -21.596 1.00 0.00 H new ATOM 1568 N GLY A 106 27.364 -3.505 -23.529 1.00 0.00 N ATOM 1569 CA GLY A 106 28.343 -3.613 -24.605 1.00 0.00 C ATOM 1570 C GLY A 106 27.774 -3.332 -26.002 1.00 0.00 C ATOM 1571 O GLY A 106 28.496 -3.510 -26.986 1.00 0.00 O ATOM 0 H GLY A 106 27.529 -2.709 -22.913 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.159 -2.917 -24.410 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.770 -4.616 -24.594 1.00 0.00 H new ATOM 1575 N GLN A 107 26.508 -2.915 -26.112 1.00 0.00 N ATOM 1576 CA GLN A 107 25.848 -2.601 -27.378 1.00 0.00 C ATOM 1577 C GLN A 107 25.901 -1.086 -27.633 1.00 0.00 C ATOM 1578 O GLN A 107 26.237 -0.297 -26.744 1.00 0.00 O ATOM 1579 CB GLN A 107 24.403 -3.144 -27.407 1.00 0.00 C ATOM 1580 CG GLN A 107 24.250 -4.608 -26.941 1.00 0.00 C ATOM 1581 CD GLN A 107 23.230 -5.413 -27.753 1.00 0.00 C ATOM 1582 OE1 GLN A 107 23.370 -5.577 -28.963 1.00 0.00 O ATOM 1583 NE2 GLN A 107 22.193 -5.948 -27.122 1.00 0.00 N ATOM 0 H GLN A 107 25.902 -2.784 -25.302 1.00 0.00 H new ATOM 0 HA GLN A 107 26.382 -3.099 -28.187 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.779 -2.510 -26.777 1.00 0.00 H new ATOM 0 HB3 GLN A 107 24.019 -3.059 -28.423 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.220 -5.102 -27.002 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.953 -4.616 -25.892 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.080 -5.810 -26.118 1.00 0.00 H new ATOM 0 HE22 GLN A 107 21.508 -6.498 -27.641 1.00 0.00 H new ATOM 1592 N SER A 108 25.567 -0.679 -28.859 1.00 0.00 N ATOM 1593 CA SER A 108 25.554 0.717 -29.282 1.00 0.00 C ATOM 1594 C SER A 108 24.412 1.504 -28.616 1.00 0.00 C ATOM 1595 O SER A 108 23.470 0.916 -28.076 1.00 0.00 O ATOM 1596 CB SER A 108 25.485 0.758 -30.819 1.00 0.00 C ATOM 1597 OG SER A 108 26.502 -0.056 -31.391 1.00 0.00 O ATOM 0 H SER A 108 25.293 -1.326 -29.598 1.00 0.00 H new ATOM 0 HA SER A 108 26.470 1.210 -28.957 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.506 0.414 -31.153 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.597 1.785 -31.166 1.00 0.00 H new ATOM 0 HG SER A 108 26.440 -0.018 -32.368 1.00 0.00 H new ATOM 1603 N LEU A 109 24.460 2.842 -28.690 1.00 0.00 N ATOM 1604 CA LEU A 109 23.498 3.736 -28.027 1.00 0.00 C ATOM 1605 C LEU A 109 22.067 3.506 -28.501 1.00 0.00 C ATOM 1606 O LEU A 109 21.141 3.708 -27.725 1.00 0.00 O ATOM 1607 CB LEU A 109 23.887 5.218 -28.211 1.00 0.00 C ATOM 1608 CG LEU A 109 25.227 5.645 -27.575 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.412 7.158 -27.746 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.328 5.281 -26.088 1.00 0.00 C ATOM 0 H LEU A 109 25.176 3.340 -29.218 1.00 0.00 H new ATOM 0 HA LEU A 109 23.537 3.493 -26.965 1.00 0.00 H new ATOM 0 HB2 LEU A 109 23.928 5.433 -29.279 1.00 0.00 H new ATOM 0 HB3 LEU A 109 23.094 5.837 -27.792 1.00 0.00 H new ATOM 0 HG LEU A 109 26.016 5.098 -28.091 1.00 0.00 H new ATOM 0 HD11 LEU A 109 26.358 7.462 -27.297 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.417 7.406 -28.807 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.592 7.683 -27.255 1.00 0.00 H new ATOM 0 HD21 LEU A 109 26.292 5.607 -25.698 1.00 0.00 H new ATOM 0 HD22 LEU A 109 24.528 5.776 -25.537 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.235 4.201 -25.971 1.00 0.00 H new ATOM 1622 N GLU A 110 21.867 3.014 -29.726 1.00 0.00 N ATOM 1623 CA GLU A 110 20.544 2.636 -30.229 1.00 0.00 C ATOM 1624 C GLU A 110 19.878 1.609 -29.313 1.00 0.00 C ATOM 1625 O GLU A 110 18.671 1.670 -29.092 1.00 0.00 O ATOM 1626 CB GLU A 110 20.629 2.107 -31.676 1.00 0.00 C ATOM 1627 CG GLU A 110 21.763 1.114 -31.966 1.00 0.00 C ATOM 1628 CD GLU A 110 21.721 0.626 -33.427 1.00 0.00 C ATOM 1629 OE1 GLU A 110 21.025 -0.377 -33.719 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.391 1.238 -34.292 1.00 0.00 O ATOM 0 H GLU A 110 22.620 2.866 -30.399 1.00 0.00 H new ATOM 0 HA GLU A 110 19.925 3.533 -30.235 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.682 1.627 -31.922 1.00 0.00 H new ATOM 0 HB3 GLU A 110 20.739 2.959 -32.347 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.724 1.588 -31.766 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.683 0.260 -31.293 1.00 0.00 H new ATOM 1637 N VAL A 111 20.653 0.702 -28.722 1.00 0.00 N ATOM 1638 CA VAL A 111 20.131 -0.336 -27.849 1.00 0.00 C ATOM 1639 C VAL A 111 19.806 0.254 -26.481 1.00 0.00 C ATOM 1640 O VAL A 111 18.744 -0.052 -25.957 1.00 0.00 O ATOM 1641 CB VAL A 111 21.081 -1.544 -27.811 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.428 -2.759 -27.136 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.506 -1.948 -29.235 1.00 0.00 C ATOM 0 H VAL A 111 21.666 0.670 -28.839 1.00 0.00 H new ATOM 0 HA VAL A 111 19.192 -0.724 -28.244 1.00 0.00 H new ATOM 0 HB VAL A 111 21.953 -1.240 -27.232 1.00 0.00 H new ATOM 0 HG11 VAL A 111 21.131 -3.592 -27.129 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.157 -2.504 -26.112 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.533 -3.044 -27.688 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.178 -2.805 -29.185 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.623 -2.213 -29.817 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.018 -1.113 -29.713 1.00 0.00 H new ATOM 1653 N PHE A 112 20.634 1.143 -25.913 1.00 0.00 N ATOM 1654 CA PHE A 112 20.275 1.861 -24.680 1.00 0.00 C ATOM 1655 C PHE A 112 18.962 2.627 -24.894 1.00 0.00 C ATOM 1656 O PHE A 112 18.046 2.524 -24.083 1.00 0.00 O ATOM 1657 CB PHE A 112 21.418 2.802 -24.254 1.00 0.00 C ATOM 1658 CG PHE A 112 22.620 2.113 -23.623 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.606 1.799 -22.249 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.754 1.783 -24.393 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.689 1.111 -21.667 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.837 1.108 -23.805 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.799 0.753 -22.447 1.00 0.00 C ATOM 0 H PHE A 112 21.553 1.382 -26.285 1.00 0.00 H new ATOM 0 HA PHE A 112 20.125 1.145 -23.872 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.755 3.358 -25.129 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.023 3.531 -23.546 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.762 2.087 -21.640 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.790 2.050 -25.439 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.665 0.858 -20.617 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.703 0.861 -24.401 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.620 0.207 -22.005 1.00 0.00 H new ATOM 1673 N ARG A 113 18.827 3.331 -26.022 1.00 0.00 N ATOM 1674 CA ARG A 113 17.627 4.111 -26.349 1.00 0.00 C ATOM 1675 C ARG A 113 16.409 3.196 -26.503 1.00 0.00 C ATOM 1676 O ARG A 113 15.358 3.469 -25.927 1.00 0.00 O ATOM 1677 CB ARG A 113 17.902 4.925 -27.630 1.00 0.00 C ATOM 1678 CG ARG A 113 18.930 6.049 -27.396 1.00 0.00 C ATOM 1679 CD ARG A 113 19.545 6.539 -28.711 1.00 0.00 C ATOM 1680 NE ARG A 113 20.511 7.632 -28.479 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.233 8.259 -29.419 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.126 7.911 -30.700 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.070 9.230 -29.070 1.00 0.00 N ATOM 0 H ARG A 113 19.551 3.377 -26.739 1.00 0.00 H new ATOM 0 HA ARG A 113 17.397 4.800 -25.537 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.267 4.258 -28.411 1.00 0.00 H new ATOM 0 HB3 ARG A 113 16.969 5.358 -27.991 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.447 6.883 -26.887 1.00 0.00 H new ATOM 0 HG3 ARG A 113 19.720 5.688 -26.737 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.045 5.710 -29.212 1.00 0.00 H new ATOM 0 HD3 ARG A 113 18.755 6.885 -29.378 1.00 0.00 H new ATOM 0 HE ARG A 113 20.641 7.938 -27.515 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.491 7.161 -30.973 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.679 8.394 -31.408 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.162 9.496 -28.090 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.621 9.709 -29.782 1.00 0.00 H new ATOM 1697 N THR A 114 16.565 2.069 -27.196 1.00 0.00 N ATOM 1698 CA THR A 114 15.539 1.060 -27.370 1.00 0.00 C ATOM 1699 C THR A 114 15.126 0.496 -26.013 1.00 0.00 C ATOM 1700 O THR A 114 13.934 0.386 -25.732 1.00 0.00 O ATOM 1701 CB THR A 114 16.134 -0.008 -28.306 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.161 0.466 -29.640 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.409 -1.345 -28.255 1.00 0.00 C ATOM 0 H THR A 114 17.440 1.832 -27.664 1.00 0.00 H new ATOM 0 HA THR A 114 14.629 1.465 -27.813 1.00 0.00 H new ATOM 0 HB THR A 114 17.147 -0.188 -27.945 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.984 0.976 -29.789 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.887 -2.044 -28.941 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.452 -1.744 -27.242 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.368 -1.206 -28.546 1.00 0.00 H new ATOM 1711 N VAL A 115 16.087 0.148 -25.155 1.00 0.00 N ATOM 1712 CA VAL A 115 15.794 -0.524 -23.905 1.00 0.00 C ATOM 1713 C VAL A 115 15.101 0.448 -22.969 1.00 0.00 C ATOM 1714 O VAL A 115 14.127 0.045 -22.351 1.00 0.00 O ATOM 1715 CB VAL A 115 17.048 -1.227 -23.346 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.793 -1.804 -21.947 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.407 -2.398 -24.273 1.00 0.00 C ATOM 0 H VAL A 115 17.079 0.326 -25.312 1.00 0.00 H new ATOM 0 HA VAL A 115 15.089 -1.343 -24.052 1.00 0.00 H new ATOM 0 HB VAL A 115 17.851 -0.492 -23.288 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.698 -2.292 -21.584 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.517 -0.999 -21.266 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.983 -2.532 -21.996 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.293 -2.906 -23.891 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.574 -3.100 -24.311 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.609 -2.020 -25.275 1.00 0.00 H new ATOM 1727 N ARG A 116 15.475 1.729 -22.937 1.00 0.00 N ATOM 1728 CA ARG A 116 14.723 2.715 -22.160 1.00 0.00 C ATOM 1729 C ARG A 116 13.262 2.741 -22.615 1.00 0.00 C ATOM 1730 O ARG A 116 12.379 2.718 -21.768 1.00 0.00 O ATOM 1731 CB ARG A 116 15.366 4.114 -22.240 1.00 0.00 C ATOM 1732 CG ARG A 116 16.659 4.209 -21.413 1.00 0.00 C ATOM 1733 CD ARG A 116 17.137 5.660 -21.229 1.00 0.00 C ATOM 1734 NE ARG A 116 17.779 6.237 -22.434 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.275 7.139 -23.295 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.983 7.450 -23.301 1.00 0.00 N ATOM 1737 NH2 ARG A 116 18.083 7.732 -24.166 1.00 0.00 N ATOM 0 H ARG A 116 16.283 2.104 -23.433 1.00 0.00 H new ATOM 0 HA ARG A 116 14.751 2.417 -21.112 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.585 4.352 -23.281 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.654 4.860 -21.885 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.494 3.758 -20.435 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.443 3.631 -21.903 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.285 6.280 -20.951 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.843 5.697 -20.400 1.00 0.00 H new ATOM 0 HE ARG A 116 18.723 5.908 -22.636 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.347 7.001 -22.642 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.627 8.138 -23.965 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.077 7.502 -24.178 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.710 8.417 -24.823 1.00 0.00 H new ATOM 1751 N GLY A 117 12.998 2.711 -23.923 1.00 0.00 N ATOM 1752 CA GLY A 117 11.641 2.713 -24.471 1.00 0.00 C ATOM 1753 C GLY A 117 10.864 1.458 -24.067 1.00 0.00 C ATOM 1754 O GLY A 117 9.799 1.566 -23.456 1.00 0.00 O ATOM 0 H GLY A 117 13.726 2.684 -24.637 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.109 3.598 -24.122 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.688 2.777 -25.558 1.00 0.00 H new ATOM 1758 N GLN A 118 11.426 0.272 -24.346 1.00 0.00 N ATOM 1759 CA GLN A 118 10.848 -1.031 -23.992 1.00 0.00 C ATOM 1760 C GLN A 118 10.515 -1.068 -22.508 1.00 0.00 C ATOM 1761 O GLN A 118 9.400 -1.393 -22.105 1.00 0.00 O ATOM 1762 CB GLN A 118 11.851 -2.160 -24.317 1.00 0.00 C ATOM 1763 CG GLN A 118 11.927 -2.524 -25.811 1.00 0.00 C ATOM 1764 CD GLN A 118 10.716 -3.327 -26.313 1.00 0.00 C ATOM 1765 OE1 GLN A 118 9.991 -3.965 -25.545 1.00 0.00 O ATOM 1766 NE2 GLN A 118 10.476 -3.344 -27.614 1.00 0.00 N ATOM 0 H GLN A 118 12.317 0.192 -24.836 1.00 0.00 H new ATOM 0 HA GLN A 118 9.937 -1.177 -24.572 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.842 -1.860 -23.977 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.576 -3.050 -23.751 1.00 0.00 H new ATOM 0 HG2 GLN A 118 12.012 -1.608 -26.395 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.834 -3.101 -25.990 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.075 -2.817 -28.250 1.00 0.00 H new ATOM 0 HE22 GLN A 118 9.692 -3.884 -27.981 1.00 0.00 H new ATOM 1775 N VAL A 119 11.497 -0.710 -21.695 1.00 0.00 N ATOM 1776 CA VAL A 119 11.381 -0.764 -20.255 1.00 0.00 C ATOM 1777 C VAL A 119 10.301 0.204 -19.788 1.00 0.00 C ATOM 1778 O VAL A 119 9.426 -0.216 -19.033 1.00 0.00 O ATOM 1779 CB VAL A 119 12.744 -0.445 -19.627 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.584 -0.280 -18.126 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.761 -1.574 -19.865 1.00 0.00 C ATOM 0 H VAL A 119 12.402 -0.372 -22.023 1.00 0.00 H new ATOM 0 HA VAL A 119 11.086 -1.764 -19.937 1.00 0.00 H new ATOM 0 HB VAL A 119 13.109 0.470 -20.093 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.552 -0.053 -17.680 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.890 0.536 -17.922 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.194 -1.204 -17.698 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.713 -1.309 -19.405 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.389 -2.498 -19.423 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.903 -1.716 -20.936 1.00 0.00 H new ATOM 1791 N LYS A 120 10.331 1.465 -20.225 1.00 0.00 N ATOM 1792 CA LYS A 120 9.392 2.464 -19.734 1.00 0.00 C ATOM 1793 C LYS A 120 7.989 1.956 -19.981 1.00 0.00 C ATOM 1794 O LYS A 120 7.171 1.987 -19.073 1.00 0.00 O ATOM 1795 CB LYS A 120 9.601 3.796 -20.465 1.00 0.00 C ATOM 1796 CG LYS A 120 8.752 4.914 -19.839 1.00 0.00 C ATOM 1797 CD LYS A 120 8.989 6.255 -20.546 1.00 0.00 C ATOM 1798 CE LYS A 120 8.121 7.354 -19.911 1.00 0.00 C ATOM 1799 NZ LYS A 120 8.261 8.659 -20.617 1.00 0.00 N ATOM 0 H LYS A 120 10.995 1.813 -20.916 1.00 0.00 H new ATOM 0 HA LYS A 120 9.552 2.631 -18.669 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.655 4.072 -20.428 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.338 3.682 -21.517 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.696 4.650 -19.900 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.996 5.010 -18.781 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.042 6.529 -20.478 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.752 6.162 -21.606 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.076 7.044 -19.927 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.401 7.477 -18.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.659 9.370 -20.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.253 8.969 -20.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.969 8.550 -21.609 1.00 0.00 H new ATOM 1813 N GLU A 121 7.726 1.458 -21.183 1.00 0.00 N ATOM 1814 CA GLU A 121 6.406 1.025 -21.583 1.00 0.00 C ATOM 1815 C GLU A 121 5.936 -0.167 -20.739 1.00 0.00 C ATOM 1816 O GLU A 121 4.796 -0.185 -20.273 1.00 0.00 O ATOM 1817 CB GLU A 121 6.466 0.722 -23.081 1.00 0.00 C ATOM 1818 CG GLU A 121 5.113 0.278 -23.643 1.00 0.00 C ATOM 1819 CD GLU A 121 5.165 0.126 -25.173 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.520 -0.970 -25.669 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.831 1.101 -25.891 1.00 0.00 O ATOM 0 H GLU A 121 8.434 1.345 -21.909 1.00 0.00 H new ATOM 0 HA GLU A 121 5.662 1.802 -21.407 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.804 1.610 -23.615 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.205 -0.059 -23.261 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.823 -0.670 -23.191 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.348 1.007 -23.374 1.00 0.00 H new ATOM 1828 N ARG A 122 6.803 -1.149 -20.477 1.00 0.00 N ATOM 1829 CA ARG A 122 6.403 -2.335 -19.712 1.00 0.00 C ATOM 1830 C ARG A 122 6.261 -2.025 -18.227 1.00 0.00 C ATOM 1831 O ARG A 122 5.309 -2.485 -17.599 1.00 0.00 O ATOM 1832 CB ARG A 122 7.324 -3.512 -20.016 1.00 0.00 C ATOM 1833 CG ARG A 122 7.174 -3.863 -21.506 1.00 0.00 C ATOM 1834 CD ARG A 122 7.674 -5.265 -21.782 1.00 0.00 C ATOM 1835 NE ARG A 122 8.078 -5.389 -23.199 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.741 -6.339 -24.076 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.933 -7.339 -23.730 1.00 0.00 N ATOM 1838 NH2 ARG A 122 8.240 -6.268 -25.306 1.00 0.00 N ATOM 0 H ARG A 122 7.777 -1.148 -20.779 1.00 0.00 H new ATOM 0 HA ARG A 122 5.408 -2.640 -20.035 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.358 -3.255 -19.788 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.064 -4.369 -19.395 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.128 -3.781 -21.800 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.732 -3.148 -22.111 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.520 -5.492 -21.133 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.893 -5.990 -21.553 1.00 0.00 H new ATOM 0 HE ARG A 122 8.693 -4.655 -23.552 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.560 -7.389 -22.782 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.687 -8.055 -24.413 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.863 -5.502 -25.560 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.999 -6.980 -25.996 1.00 0.00 H new ATOM 1852 N VAL A 123 7.143 -1.199 -17.672 1.00 0.00 N ATOM 1853 CA VAL A 123 7.030 -0.749 -16.290 1.00 0.00 C ATOM 1854 C VAL A 123 5.758 0.112 -16.160 1.00 0.00 C ATOM 1855 O VAL A 123 5.021 -0.047 -15.189 1.00 0.00 O ATOM 1856 CB VAL A 123 8.312 -0.016 -15.873 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.221 0.534 -14.447 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.554 -0.923 -15.917 1.00 0.00 C ATOM 0 H VAL A 123 7.953 -0.824 -18.166 1.00 0.00 H new ATOM 0 HA VAL A 123 6.928 -1.591 -15.605 1.00 0.00 H new ATOM 0 HB VAL A 123 8.412 0.794 -16.595 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.150 1.045 -14.194 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.391 1.237 -14.380 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.057 -0.288 -13.750 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.432 -0.353 -15.613 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.414 -1.764 -15.238 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.697 -1.295 -16.931 1.00 0.00 H new ATOM 1868 N GLU A 124 5.443 0.972 -17.134 1.00 0.00 N ATOM 1869 CA GLU A 124 4.214 1.761 -17.127 1.00 0.00 C ATOM 1870 C GLU A 124 3.006 0.834 -17.126 1.00 0.00 C ATOM 1871 O GLU A 124 2.091 1.022 -16.331 1.00 0.00 O ATOM 1872 CB GLU A 124 4.111 2.686 -18.357 1.00 0.00 C ATOM 1873 CG GLU A 124 4.869 4.014 -18.267 1.00 0.00 C ATOM 1874 CD GLU A 124 4.124 5.073 -17.427 1.00 0.00 C ATOM 1875 OE1 GLU A 124 3.719 4.790 -16.274 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.939 6.208 -17.930 1.00 0.00 O ATOM 0 H GLU A 124 6.035 1.138 -17.948 1.00 0.00 H new ATOM 0 HA GLU A 124 4.235 2.377 -16.228 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.476 2.141 -19.228 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.058 2.903 -18.535 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.852 3.837 -17.831 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.032 4.403 -19.272 1.00 0.00 H new ATOM 1883 N ASN A 125 3.008 -0.180 -17.990 1.00 0.00 N ATOM 1884 CA ASN A 125 1.884 -1.095 -18.144 1.00 0.00 C ATOM 1885 C ASN A 125 1.653 -1.898 -16.863 1.00 0.00 C ATOM 1886 O ASN A 125 0.510 -2.065 -16.442 1.00 0.00 O ATOM 1887 CB ASN A 125 2.127 -2.025 -19.341 1.00 0.00 C ATOM 1888 CG ASN A 125 0.967 -2.996 -19.538 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.064 -4.169 -19.193 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.147 -2.542 -20.091 1.00 0.00 N ATOM 0 H ASN A 125 3.795 -0.389 -18.605 1.00 0.00 H new ATOM 0 HA ASN A 125 0.982 -0.512 -18.333 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.262 -1.430 -20.244 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.050 -2.585 -19.187 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.938 -3.170 -20.235 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.214 -1.564 -20.373 1.00 0.00 H new ATOM 1897 N LEU A 126 2.729 -2.346 -16.211 1.00 0.00 N ATOM 1898 CA LEU A 126 2.702 -2.998 -14.915 1.00 0.00 C ATOM 1899 C LEU A 126 2.062 -2.092 -13.866 1.00 0.00 C ATOM 1900 O LEU A 126 1.169 -2.524 -13.145 1.00 0.00 O ATOM 1901 CB LEU A 126 4.155 -3.326 -14.529 1.00 0.00 C ATOM 1902 CG LEU A 126 4.358 -3.697 -13.052 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.607 -4.989 -12.736 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.855 -3.814 -12.779 1.00 0.00 C ATOM 0 H LEU A 126 3.672 -2.258 -16.591 1.00 0.00 H new ATOM 0 HA LEU A 126 2.105 -3.909 -14.964 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.504 -4.152 -15.148 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.782 -2.466 -14.763 1.00 0.00 H new ATOM 0 HG LEU A 126 3.953 -2.924 -12.399 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.754 -5.248 -11.687 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.544 -4.848 -12.929 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.987 -5.794 -13.365 1.00 0.00 H new ATOM 0 HD21 LEU A 126 6.015 -4.077 -11.733 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.282 -4.588 -13.417 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.339 -2.861 -12.991 1.00 0.00 H new ATOM 1916 N ILE A 127 2.500 -0.843 -13.764 1.00 0.00 N ATOM 1917 CA ILE A 127 2.002 0.080 -12.759 1.00 0.00 C ATOM 1918 C ILE A 127 0.533 0.360 -13.069 1.00 0.00 C ATOM 1919 O ILE A 127 -0.295 0.279 -12.170 1.00 0.00 O ATOM 1920 CB ILE A 127 2.904 1.325 -12.804 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.285 0.944 -12.236 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.311 2.498 -12.013 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.362 1.979 -12.533 1.00 0.00 C ATOM 0 H ILE A 127 3.211 -0.444 -14.377 1.00 0.00 H new ATOM 0 HA ILE A 127 2.038 -0.313 -11.743 1.00 0.00 H new ATOM 0 HB ILE A 127 2.991 1.656 -13.839 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.203 0.813 -11.157 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.589 -0.017 -12.651 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.983 3.354 -12.074 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.342 2.767 -12.433 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.187 2.208 -10.970 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.310 1.651 -12.106 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.470 2.093 -13.612 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.078 2.936 -12.094 1.00 0.00 H new ATOM 1935 N ALA A 128 0.195 0.609 -14.335 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.168 0.894 -14.757 1.00 0.00 C ATOM 1937 C ALA A 128 -2.132 -0.250 -14.414 1.00 0.00 C ATOM 1938 O ALA A 128 -3.296 0.024 -14.110 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.193 1.178 -16.264 1.00 0.00 C ATOM 0 H ALA A 128 0.870 0.617 -15.100 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.508 1.774 -14.211 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.215 1.391 -16.577 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.560 2.038 -16.483 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.822 0.307 -16.805 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.682 -1.517 -14.456 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.542 -2.636 -14.090 1.00 0.00 C ATOM 1947 C LYS A 129 -2.646 -2.810 -12.574 1.00 0.00 C ATOM 1948 O LYS A 129 -3.745 -3.109 -12.101 1.00 0.00 O ATOM 1949 CB LYS A 129 -2.221 -3.926 -14.871 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.878 -4.578 -14.519 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.527 -5.825 -15.343 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.320 -5.507 -16.828 1.00 0.00 C ATOM 1953 NZ LYS A 129 0.237 -6.666 -17.577 1.00 0.00 N ATOM 0 H LYS A 129 -0.738 -1.781 -14.737 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.552 -2.383 -14.413 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -3.017 -4.649 -14.692 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.230 -3.699 -15.937 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -0.087 -3.840 -14.650 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.888 -4.849 -13.463 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.379 -6.278 -14.942 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.324 -6.561 -15.240 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.271 -5.213 -17.271 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.354 -4.656 -16.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.627 -6.338 -18.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.991 -7.111 -17.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.517 -7.359 -17.755 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.564 -2.627 -11.802 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.609 -2.895 -10.374 1.00 0.00 C ATOM 1969 C ILE A 130 -2.160 -1.730 -9.546 1.00 0.00 C ATOM 1970 O ILE A 130 -2.903 -1.969 -8.590 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.268 -3.428 -9.850 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.834 -2.355 -9.817 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.144 -4.693 -10.626 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.210 -2.890 -9.420 1.00 0.00 C ATOM 0 H ILE A 130 -0.662 -2.298 -12.146 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.338 -3.694 -10.240 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.408 -3.711 -8.807 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.906 -1.892 -10.801 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.544 -1.572 -9.116 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.097 -5.060 -10.244 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.618 -5.462 -10.500 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.246 -4.454 -11.685 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.932 -2.073 -9.420 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.157 -3.327 -8.423 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.524 -3.652 -10.134 1.00 0.00 H new ATOM 1986 N SER A 131 -1.788 -0.496 -9.879 1.00 0.00 N ATOM 1987 CA SER A 131 -2.035 0.694 -9.096 1.00 0.00 C ATOM 1988 C SER A 131 -3.349 1.343 -9.529 1.00 0.00 C ATOM 1989 O SER A 131 -3.470 1.765 -10.704 1.00 0.00 O ATOM 1990 CB SER A 131 -0.827 1.624 -9.204 1.00 0.00 C ATOM 1991 OG SER A 131 0.319 0.966 -8.669 1.00 0.00 O ATOM 1992 OXT SER A 131 -4.277 1.413 -8.692 1.00 0.00 O ATOM 0 H SER A 131 -1.284 -0.299 -10.743 1.00 0.00 H new ATOM 0 HA SER A 131 -2.154 0.447 -8.041 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.653 1.895 -10.245 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.016 2.550 -8.661 1.00 0.00 H new ATOM 0 HG SER A 131 1.097 1.557 -8.737 1.00 0.00 H new TER 1998 SER A 131