USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 992 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 SER OG : rot -125:sc= 1.46 USER MOD Set 1.2: A 80 CYS SG : rot 90:sc= -0.501 USER MOD Set 2.1: A 43 HIS : no HE2:sc= 0.119 K(o=0.61,f=-0.59) USER MOD Set 2.2: A 45 THR OG1 : rot 100:sc= 0.488 USER MOD Set 3.1: A 15 SER OG : rot 175:sc= 0.365 USER MOD Set 3.2: A 16 GLN : amide:sc= 0.281 K(o=4.4,f=2.3) USER MOD Set 3.3: A 34 SER OG : rot -86:sc= 0.292 USER MOD Set 3.4: A 40 SER OG : rot -122:sc= 0.983 USER MOD Set 3.5: A 62 SER OG : rot 159:sc= 2.47 USER MOD Set 4.1: A 8 CYS SG : rot -157:sc= 0.019 USER MOD Set 4.2: A 12 SER OG : rot 48:sc= 1.59 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.0112 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.16) USER MOD Single : A 5 MET CE :methyl -167:sc= -0.0734 (180deg=-0.837) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.24 K(o=1.2,f=-6.3!) USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 159:sc= -0.667 (180deg=-2.11) USER MOD Single : A 23 LYS NZ :NH3+ -170:sc= 1.25 (180deg=1.08) USER MOD Single : A 24 THR OG1 : rot 73:sc= 0.0215 USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 1 (180deg=0.924) USER MOD Single : A 33 THR OG1 : rot -160:sc=-0.00285 USER MOD Single : A 35 CYS SG : rot 51:sc= -0.66 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0123 USER MOD Single : A 49 MET CE :methyl -162:sc= -0.017 (180deg=-0.0957) USER MOD Single : A 50 MET CE :methyl -137:sc= 0 (180deg=-0.00858) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= 0.795 K(o=0.8,f=-0.44) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.22 K(o=2.2,f=-0.0046) USER MOD Single : A 69 ASN : amide:sc= 1.07 K(o=1.1,f=-0.022) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 CYS SG : rot 180:sc= 0.42 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 92 THR OG1 : rot -21:sc= 0.177 USER MOD Single : A 93 GLN : amide:sc= -0.182! C(o=-0.18!,f=-7!) USER MOD Single : A 100 GLN : amide:sc= 0.653 K(o=0.65,f=-0.58) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.0013) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 118 GLN : amide:sc= 0.429 X(o=0.43,f=-0.0047) USER MOD Single : A 120 LYS NZ :NH3+ -153:sc= 1.32 (180deg=1.12) USER MOD Single : A 125 ASN : amide:sc= 0.19 X(o=0.19,f=-0.1) USER MOD Single : A 129 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.19) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.197 1.923 1.725 1.00 0.00 N ATOM 2 CA MET A 1 4.198 1.790 0.232 1.00 0.00 C ATOM 3 C MET A 1 5.070 0.603 -0.215 1.00 0.00 C ATOM 4 O MET A 1 6.135 0.389 0.360 1.00 0.00 O ATOM 5 CB MET A 1 4.644 3.114 -0.447 1.00 0.00 C ATOM 6 CG MET A 1 4.568 3.100 -1.984 1.00 0.00 C ATOM 7 SD MET A 1 2.950 2.652 -2.670 1.00 0.00 S ATOM 8 CE MET A 1 2.032 4.200 -2.429 1.00 0.00 C ATOM 0 H1 MET A 1 4.293 2.926 1.984 1.00 0.00 H new ATOM 0 H2 MET A 1 3.304 1.551 2.106 1.00 0.00 H new ATOM 0 H3 MET A 1 4.993 1.385 2.122 1.00 0.00 H new ATOM 0 HA MET A 1 3.177 1.587 -0.090 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.022 3.927 -0.072 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.669 3.333 -0.148 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.842 4.088 -2.355 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.312 2.400 -2.363 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.015 4.082 -2.803 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.002 4.444 -1.367 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.527 5.005 -2.972 1.00 0.00 H new ATOM 18 N LYS A 2 4.663 -0.159 -1.251 1.00 0.00 N ATOM 19 CA LYS A 2 5.438 -1.299 -1.785 1.00 0.00 C ATOM 20 C LYS A 2 6.681 -0.832 -2.533 1.00 0.00 C ATOM 21 O LYS A 2 6.607 0.096 -3.336 1.00 0.00 O ATOM 22 CB LYS A 2 4.594 -2.206 -2.700 1.00 0.00 C ATOM 23 CG LYS A 2 3.439 -2.938 -1.998 1.00 0.00 C ATOM 24 CD LYS A 2 2.559 -3.685 -3.020 1.00 0.00 C ATOM 25 CE LYS A 2 1.536 -2.797 -3.758 1.00 0.00 C ATOM 26 NZ LYS A 2 0.359 -2.437 -2.909 1.00 0.00 N ATOM 0 H LYS A 2 3.784 -0.000 -1.743 1.00 0.00 H new ATOM 0 HA LYS A 2 5.745 -1.884 -0.918 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.183 -1.601 -3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.250 -2.947 -3.158 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.839 -3.645 -1.271 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.832 -2.222 -1.444 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.206 -4.161 -3.757 1.00 0.00 H new ATOM 0 HD3 LYS A 2 2.023 -4.482 -2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.029 -1.884 -4.092 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.188 -3.317 -4.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.294 -1.841 -3.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.132 -3.304 -2.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.683 -1.916 -2.069 1.00 0.00 H new ATOM 40 N LYS A 3 7.797 -1.531 -2.339 1.00 0.00 N ATOM 41 CA LYS A 3 9.061 -1.297 -3.054 1.00 0.00 C ATOM 42 C LYS A 3 9.383 -2.456 -4.001 1.00 0.00 C ATOM 43 O LYS A 3 9.463 -3.609 -3.584 1.00 0.00 O ATOM 44 CB LYS A 3 10.153 -1.030 -2.007 1.00 0.00 C ATOM 45 CG LYS A 3 11.442 -0.418 -2.579 1.00 0.00 C ATOM 46 CD LYS A 3 12.470 -0.108 -1.474 1.00 0.00 C ATOM 47 CE LYS A 3 11.939 0.885 -0.426 1.00 0.00 C ATOM 48 NZ LYS A 3 12.973 1.208 0.594 1.00 0.00 N ATOM 0 H LYS A 3 7.855 -2.295 -1.666 1.00 0.00 H new ATOM 0 HA LYS A 3 8.988 -0.423 -3.701 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.754 -0.360 -1.245 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.400 -1.968 -1.509 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.881 -1.106 -3.301 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.201 0.498 -3.118 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.753 -1.036 -0.977 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.373 0.299 -1.928 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.617 1.801 -0.922 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.062 0.463 0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.660 2.022 1.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.115 0.387 1.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.868 1.441 0.119 1.00 0.00 H new ATOM 62 N VAL A 4 9.553 -2.127 -5.280 1.00 0.00 N ATOM 63 CA VAL A 4 9.867 -3.055 -6.372 1.00 0.00 C ATOM 64 C VAL A 4 11.381 -3.135 -6.584 1.00 0.00 C ATOM 65 O VAL A 4 11.977 -2.196 -7.114 1.00 0.00 O ATOM 66 CB VAL A 4 9.161 -2.636 -7.680 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.379 -3.681 -8.781 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.644 -2.490 -7.493 1.00 0.00 C ATOM 0 H VAL A 4 9.472 -1.162 -5.601 1.00 0.00 H new ATOM 0 HA VAL A 4 9.499 -4.042 -6.093 1.00 0.00 H new ATOM 0 HB VAL A 4 9.596 -1.677 -7.961 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.872 -3.362 -9.691 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.446 -3.785 -8.978 1.00 0.00 H new ATOM 0 HG13 VAL A 4 8.975 -4.640 -8.458 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.188 -2.194 -8.438 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.224 -3.442 -7.170 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.442 -1.730 -6.739 1.00 0.00 H new ATOM 78 N MET A 5 12.013 -4.243 -6.190 1.00 0.00 N ATOM 79 CA MET A 5 13.411 -4.510 -6.554 1.00 0.00 C ATOM 80 C MET A 5 13.471 -5.184 -7.924 1.00 0.00 C ATOM 81 O MET A 5 12.836 -6.216 -8.137 1.00 0.00 O ATOM 82 CB MET A 5 14.115 -5.396 -5.515 1.00 0.00 C ATOM 83 CG MET A 5 15.612 -5.569 -5.811 1.00 0.00 C ATOM 84 SD MET A 5 16.601 -4.064 -5.637 1.00 0.00 S ATOM 85 CE MET A 5 17.175 -4.267 -3.932 1.00 0.00 C ATOM 0 H MET A 5 11.582 -4.970 -5.620 1.00 0.00 H new ATOM 0 HA MET A 5 13.931 -3.553 -6.585 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.992 -4.958 -4.525 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.636 -6.375 -5.492 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.014 -6.330 -5.142 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.725 -5.946 -6.828 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.604 -3.330 -3.579 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.334 -4.544 -3.296 1.00 0.00 H new ATOM 0 HE3 MET A 5 17.932 -5.050 -3.894 1.00 0.00 H new ATOM 95 N PHE A 6 14.287 -4.655 -8.825 1.00 0.00 N ATOM 96 CA PHE A 6 14.638 -5.278 -10.096 1.00 0.00 C ATOM 97 C PHE A 6 16.031 -5.901 -9.970 1.00 0.00 C ATOM 98 O PHE A 6 16.998 -5.183 -9.725 1.00 0.00 O ATOM 99 CB PHE A 6 14.558 -4.222 -11.204 1.00 0.00 C ATOM 100 CG PHE A 6 13.140 -3.777 -11.493 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.295 -4.625 -12.224 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.644 -2.558 -10.998 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.975 -4.239 -12.502 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.321 -2.171 -11.282 1.00 0.00 C ATOM 105 CZ PHE A 6 10.492 -2.997 -12.067 1.00 0.00 C ATOM 0 H PHE A 6 14.738 -3.751 -8.688 1.00 0.00 H new ATOM 0 HA PHE A 6 13.943 -6.077 -10.356 1.00 0.00 H new ATOM 0 HB2 PHE A 6 15.154 -3.356 -10.917 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.000 -4.625 -12.115 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.662 -5.579 -12.574 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.278 -1.919 -10.400 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.327 -4.903 -13.055 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.939 -1.237 -10.897 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.495 -2.677 -12.331 1.00 0.00 H new ATOM 115 N VAL A 7 16.151 -7.220 -10.133 1.00 0.00 N ATOM 116 CA VAL A 7 17.424 -7.962 -10.013 1.00 0.00 C ATOM 117 C VAL A 7 17.828 -8.583 -11.348 1.00 0.00 C ATOM 118 O VAL A 7 17.002 -9.165 -12.049 1.00 0.00 O ATOM 119 CB VAL A 7 17.410 -9.015 -8.878 1.00 0.00 C ATOM 120 CG1 VAL A 7 17.071 -8.371 -7.530 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.410 -10.156 -9.091 1.00 0.00 C ATOM 0 H VAL A 7 15.357 -7.820 -10.356 1.00 0.00 H new ATOM 0 HA VAL A 7 18.182 -7.230 -9.735 1.00 0.00 H new ATOM 0 HB VAL A 7 18.418 -9.430 -8.887 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.069 -9.135 -6.752 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.817 -7.612 -7.291 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.086 -7.907 -7.586 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.464 -10.849 -8.251 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.402 -9.748 -9.160 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.652 -10.684 -10.013 1.00 0.00 H new ATOM 131 N CYS A 8 19.106 -8.475 -11.708 1.00 0.00 N ATOM 132 CA CYS A 8 19.659 -9.130 -12.905 1.00 0.00 C ATOM 133 C CYS A 8 20.954 -9.919 -12.623 1.00 0.00 C ATOM 134 O CYS A 8 21.524 -9.843 -11.531 1.00 0.00 O ATOM 135 CB CYS A 8 19.867 -8.037 -13.964 1.00 0.00 C ATOM 136 SG CYS A 8 19.919 -8.777 -15.623 1.00 0.00 S ATOM 0 H CYS A 8 19.791 -7.933 -11.182 1.00 0.00 H new ATOM 0 HA CYS A 8 18.958 -9.884 -13.263 1.00 0.00 H new ATOM 0 HB2 CYS A 8 19.059 -7.307 -13.908 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.795 -7.501 -13.767 1.00 0.00 H new ATOM 0 HG CYS A 8 20.562 -7.987 -16.431 1.00 0.00 H new ATOM 142 N LYS A 9 21.444 -10.655 -13.633 1.00 0.00 N ATOM 143 CA LYS A 9 22.782 -11.279 -13.613 1.00 0.00 C ATOM 144 C LYS A 9 23.845 -10.167 -13.586 1.00 0.00 C ATOM 145 O LYS A 9 23.603 -9.049 -14.044 1.00 0.00 O ATOM 146 CB LYS A 9 22.971 -12.214 -14.826 1.00 0.00 C ATOM 147 CG LYS A 9 22.070 -13.459 -14.768 1.00 0.00 C ATOM 148 CD LYS A 9 22.431 -14.447 -15.894 1.00 0.00 C ATOM 149 CE LYS A 9 21.572 -15.722 -15.827 1.00 0.00 C ATOM 150 NZ LYS A 9 21.965 -16.707 -16.878 1.00 0.00 N ATOM 0 H LYS A 9 20.923 -10.836 -14.491 1.00 0.00 H new ATOM 0 HA LYS A 9 22.888 -11.895 -12.720 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.759 -11.661 -15.741 1.00 0.00 H new ATOM 0 HB3 LYS A 9 24.013 -12.528 -14.877 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.179 -13.948 -13.800 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.025 -13.162 -14.859 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.291 -13.964 -16.861 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.485 -14.714 -15.820 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.675 -16.179 -14.843 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.521 -15.460 -15.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.365 -17.553 -16.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.843 -16.279 -17.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.961 -16.976 -16.747 1.00 0.00 H new ATOM 164 N ARG A 10 25.017 -10.446 -13.011 1.00 0.00 N ATOM 165 CA ARG A 10 26.024 -9.399 -12.729 1.00 0.00 C ATOM 166 C ARG A 10 26.592 -8.736 -13.999 1.00 0.00 C ATOM 167 O ARG A 10 26.660 -9.359 -15.054 1.00 0.00 O ATOM 168 CB ARG A 10 27.091 -9.943 -11.766 1.00 0.00 C ATOM 169 CG ARG A 10 28.127 -10.883 -12.409 1.00 0.00 C ATOM 170 CD ARG A 10 29.433 -10.136 -12.706 1.00 0.00 C ATOM 171 NE ARG A 10 30.301 -10.893 -13.629 1.00 0.00 N ATOM 172 CZ ARG A 10 31.155 -11.862 -13.336 1.00 0.00 C ATOM 173 NH1 ARG A 10 31.324 -12.329 -12.133 1.00 0.00 N ATOM 174 NH2 ARG A 10 31.874 -12.398 -14.280 1.00 0.00 N ATOM 0 H ARG A 10 25.300 -11.384 -12.729 1.00 0.00 H new ATOM 0 HA ARG A 10 25.524 -8.574 -12.222 1.00 0.00 H new ATOM 0 HB2 ARG A 10 27.616 -9.101 -11.316 1.00 0.00 H new ATOM 0 HB3 ARG A 10 26.591 -10.476 -10.957 1.00 0.00 H new ATOM 0 HG2 ARG A 10 28.327 -11.722 -11.742 1.00 0.00 H new ATOM 0 HG3 ARG A 10 27.723 -11.299 -13.332 1.00 0.00 H new ATOM 0 HD2 ARG A 10 29.204 -9.162 -13.139 1.00 0.00 H new ATOM 0 HD3 ARG A 10 29.967 -9.953 -11.773 1.00 0.00 H new ATOM 0 HE ARG A 10 30.235 -10.638 -14.614 1.00 0.00 H new ATOM 0 HH11 ARG A 10 30.783 -11.947 -11.357 1.00 0.00 H new ATOM 0 HH12 ARG A 10 31.997 -13.077 -11.966 1.00 0.00 H new ATOM 0 HH21 ARG A 10 31.779 -12.071 -15.242 1.00 0.00 H new ATOM 0 HH22 ARG A 10 32.533 -13.144 -14.058 1.00 0.00 H new ATOM 188 N ASN A 11 26.998 -7.468 -13.877 1.00 0.00 N ATOM 189 CA ASN A 11 27.513 -6.610 -14.964 1.00 0.00 C ATOM 190 C ASN A 11 26.527 -6.339 -16.142 1.00 0.00 C ATOM 191 O ASN A 11 26.915 -5.748 -17.148 1.00 0.00 O ATOM 192 CB ASN A 11 28.906 -7.129 -15.394 1.00 0.00 C ATOM 193 CG ASN A 11 29.729 -6.118 -16.175 1.00 0.00 C ATOM 194 OD1 ASN A 11 29.818 -4.953 -15.815 1.00 0.00 O ATOM 195 ND2 ASN A 11 30.391 -6.521 -17.235 1.00 0.00 N ATOM 0 H ASN A 11 26.978 -6.984 -12.979 1.00 0.00 H new ATOM 0 HA ASN A 11 27.622 -5.603 -14.561 1.00 0.00 H new ATOM 0 HB2 ASN A 11 29.462 -7.425 -14.505 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.777 -8.024 -16.002 1.00 0.00 H new ATOM 0 HD21 ASN A 11 30.975 -5.864 -17.752 1.00 0.00 H new ATOM 0 HD22 ASN A 11 30.322 -7.491 -17.541 1.00 0.00 H new ATOM 202 N SER A 12 25.247 -6.728 -16.011 1.00 0.00 N ATOM 203 CA SER A 12 24.152 -6.361 -16.931 1.00 0.00 C ATOM 204 C SER A 12 23.684 -4.918 -16.696 1.00 0.00 C ATOM 205 O SER A 12 24.077 -4.285 -15.716 1.00 0.00 O ATOM 206 CB SER A 12 22.998 -7.354 -16.727 1.00 0.00 C ATOM 207 OG SER A 12 21.880 -7.025 -17.530 1.00 0.00 O ATOM 0 H SER A 12 24.935 -7.322 -15.243 1.00 0.00 H new ATOM 0 HA SER A 12 24.508 -6.412 -17.960 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.337 -8.361 -16.969 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.704 -7.360 -15.677 1.00 0.00 H new ATOM 0 HG SER A 12 22.176 -6.857 -18.449 1.00 0.00 H new ATOM 213 N CYS A 13 22.807 -4.398 -17.560 1.00 0.00 N ATOM 214 CA CYS A 13 22.092 -3.130 -17.362 1.00 0.00 C ATOM 215 C CYS A 13 20.558 -3.289 -17.295 1.00 0.00 C ATOM 216 O CYS A 13 19.859 -2.291 -17.188 1.00 0.00 O ATOM 217 CB CYS A 13 22.562 -2.116 -18.420 1.00 0.00 C ATOM 218 SG CYS A 13 22.030 -2.580 -20.099 1.00 0.00 S ATOM 0 H CYS A 13 22.568 -4.857 -18.439 1.00 0.00 H new ATOM 0 HA CYS A 13 22.347 -2.741 -16.376 1.00 0.00 H new ATOM 0 HB2 CYS A 13 22.169 -1.129 -18.175 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.649 -2.042 -18.392 1.00 0.00 H new ATOM 0 HG CYS A 13 22.451 -1.691 -20.949 1.00 0.00 H new ATOM 224 N ARG A 14 19.995 -4.509 -17.348 1.00 0.00 N ATOM 225 CA ARG A 14 18.540 -4.744 -17.510 1.00 0.00 C ATOM 226 C ARG A 14 17.754 -4.446 -16.243 1.00 0.00 C ATOM 227 O ARG A 14 16.656 -3.925 -16.338 1.00 0.00 O ATOM 228 CB ARG A 14 18.254 -6.167 -18.042 1.00 0.00 C ATOM 229 CG ARG A 14 19.049 -6.479 -19.317 1.00 0.00 C ATOM 230 CD ARG A 14 18.705 -7.840 -19.924 1.00 0.00 C ATOM 231 NE ARG A 14 18.803 -8.985 -18.985 1.00 0.00 N ATOM 232 CZ ARG A 14 19.795 -9.855 -18.874 1.00 0.00 C ATOM 233 NH1 ARG A 14 20.993 -9.633 -19.321 1.00 0.00 N ATOM 234 NH2 ARG A 14 19.584 -10.993 -18.285 1.00 0.00 N ATOM 0 H ARG A 14 20.537 -5.370 -17.279 1.00 0.00 H new ATOM 0 HA ARG A 14 18.190 -4.035 -18.260 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.503 -6.898 -17.273 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.188 -6.270 -18.246 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.859 -5.700 -20.056 1.00 0.00 H new ATOM 0 HG3 ARG A 14 20.115 -6.449 -19.089 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.690 -7.799 -20.320 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.369 -8.023 -20.768 1.00 0.00 H new ATOM 0 HE ARG A 14 18.015 -9.117 -18.351 1.00 0.00 H new ATOM 0 HH11 ARG A 14 21.209 -8.751 -19.786 1.00 0.00 H new ATOM 0 HH12 ARG A 14 21.719 -10.340 -19.207 1.00 0.00 H new ATOM 0 HH21 ARG A 14 18.660 -11.211 -17.912 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.342 -11.669 -18.195 1.00 0.00 H new ATOM 248 N SER A 15 18.323 -4.679 -15.061 1.00 0.00 N ATOM 249 CA SER A 15 17.737 -4.227 -13.782 1.00 0.00 C ATOM 250 C SER A 15 17.717 -2.702 -13.676 1.00 0.00 C ATOM 251 O SER A 15 16.685 -2.133 -13.330 1.00 0.00 O ATOM 252 CB SER A 15 18.464 -4.861 -12.597 1.00 0.00 C ATOM 253 OG SER A 15 19.850 -4.955 -12.866 1.00 0.00 O ATOM 0 H SER A 15 19.202 -5.185 -14.954 1.00 0.00 H new ATOM 0 HA SER A 15 16.700 -4.561 -13.757 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.300 -4.265 -11.699 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.057 -5.853 -12.400 1.00 0.00 H new ATOM 0 HG SER A 15 20.315 -5.294 -12.073 1.00 0.00 H new ATOM 259 N GLN A 16 18.799 -2.030 -14.082 1.00 0.00 N ATOM 260 CA GLN A 16 18.853 -0.560 -14.145 1.00 0.00 C ATOM 261 C GLN A 16 17.861 0.013 -15.167 1.00 0.00 C ATOM 262 O GLN A 16 17.143 0.962 -14.864 1.00 0.00 O ATOM 263 CB GLN A 16 20.288 -0.097 -14.445 1.00 0.00 C ATOM 264 CG GLN A 16 21.153 -0.035 -13.175 1.00 0.00 C ATOM 265 CD GLN A 16 20.710 1.059 -12.194 1.00 0.00 C ATOM 266 OE1 GLN A 16 20.106 2.060 -12.547 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.007 0.923 -10.920 1.00 0.00 N ATOM 0 H GLN A 16 19.663 -2.486 -14.377 1.00 0.00 H new ATOM 0 HA GLN A 16 18.554 -0.174 -13.170 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.746 -0.778 -15.162 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.261 0.887 -14.913 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.118 -1.001 -12.672 1.00 0.00 H new ATOM 0 HG3 GLN A 16 22.191 0.139 -13.458 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.511 0.096 -10.599 1.00 0.00 H new ATOM 0 HE22 GLN A 16 20.733 1.644 -10.253 1.00 0.00 H new ATOM 276 N MET A 17 17.754 -0.592 -16.356 1.00 0.00 N ATOM 277 CA MET A 17 16.767 -0.204 -17.378 1.00 0.00 C ATOM 278 C MET A 17 15.327 -0.472 -16.914 1.00 0.00 C ATOM 279 O MET A 17 14.450 0.366 -17.110 1.00 0.00 O ATOM 280 CB MET A 17 17.084 -0.919 -18.710 1.00 0.00 C ATOM 281 CG MET A 17 17.325 0.052 -19.869 1.00 0.00 C ATOM 282 SD MET A 17 15.842 0.836 -20.550 1.00 0.00 S ATOM 283 CE MET A 17 15.704 2.365 -19.583 1.00 0.00 C ATOM 0 H MET A 17 18.351 -1.368 -16.640 1.00 0.00 H new ATOM 0 HA MET A 17 16.841 0.872 -17.538 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.967 -1.545 -18.579 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.258 -1.582 -18.965 1.00 0.00 H new ATOM 0 HG2 MET A 17 18.005 0.834 -19.530 1.00 0.00 H new ATOM 0 HG3 MET A 17 17.832 -0.485 -20.671 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.094 3.086 -20.127 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.238 2.147 -18.622 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.697 2.782 -19.418 1.00 0.00 H new ATOM 293 N ALA A 18 15.090 -1.597 -16.227 1.00 0.00 N ATOM 294 CA ALA A 18 13.789 -1.892 -15.607 1.00 0.00 C ATOM 295 C ALA A 18 13.404 -0.868 -14.525 1.00 0.00 C ATOM 296 O ALA A 18 12.318 -0.297 -14.593 1.00 0.00 O ATOM 297 CB ALA A 18 13.804 -3.328 -15.081 1.00 0.00 C ATOM 0 H ALA A 18 15.790 -2.326 -16.085 1.00 0.00 H new ATOM 0 HA ALA A 18 13.010 -1.804 -16.364 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.843 -3.556 -14.619 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.982 -4.016 -15.907 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.597 -3.436 -14.341 1.00 0.00 H new ATOM 303 N GLU A 19 14.311 -0.548 -13.594 1.00 0.00 N ATOM 304 CA GLU A 19 14.119 0.542 -12.625 1.00 0.00 C ATOM 305 C GLU A 19 13.880 1.887 -13.332 1.00 0.00 C ATOM 306 O GLU A 19 13.007 2.639 -12.910 1.00 0.00 O ATOM 307 CB GLU A 19 15.334 0.634 -11.689 1.00 0.00 C ATOM 308 CG GLU A 19 15.144 1.649 -10.550 1.00 0.00 C ATOM 309 CD GLU A 19 16.480 2.311 -10.166 1.00 0.00 C ATOM 310 OE1 GLU A 19 16.848 3.314 -10.823 1.00 0.00 O ATOM 311 OE2 GLU A 19 17.137 1.847 -9.202 1.00 0.00 O ATOM 0 H GLU A 19 15.200 -1.037 -13.490 1.00 0.00 H new ATOM 0 HA GLU A 19 13.231 0.318 -12.034 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.531 -0.349 -11.262 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.213 0.911 -12.271 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.431 2.414 -10.856 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.720 1.148 -9.680 1.00 0.00 H new ATOM 318 N GLY A 20 14.578 2.158 -14.441 1.00 0.00 N ATOM 319 CA GLY A 20 14.381 3.331 -15.294 1.00 0.00 C ATOM 320 C GLY A 20 12.934 3.485 -15.761 1.00 0.00 C ATOM 321 O GLY A 20 12.273 4.446 -15.377 1.00 0.00 O ATOM 0 H GLY A 20 15.320 1.545 -14.779 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.679 4.226 -14.748 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.033 3.256 -16.164 1.00 0.00 H new ATOM 325 N PHE A 21 12.392 2.526 -16.525 1.00 0.00 N ATOM 326 CA PHE A 21 10.970 2.574 -16.922 1.00 0.00 C ATOM 327 C PHE A 21 10.045 2.599 -15.698 1.00 0.00 C ATOM 328 O PHE A 21 9.008 3.261 -15.712 1.00 0.00 O ATOM 329 CB PHE A 21 10.618 1.401 -17.859 1.00 0.00 C ATOM 330 CG PHE A 21 10.960 1.660 -19.309 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.090 2.426 -20.108 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.135 1.134 -19.867 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.412 2.692 -21.450 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.449 1.392 -21.210 1.00 0.00 C ATOM 335 CZ PHE A 21 11.593 2.178 -22.003 1.00 0.00 C ATOM 0 H PHE A 21 12.904 1.718 -16.878 1.00 0.00 H new ATOM 0 HA PHE A 21 10.813 3.503 -17.470 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.146 0.508 -17.524 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.552 1.190 -17.778 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.172 2.810 -19.688 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.797 0.531 -19.263 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.749 3.293 -22.055 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.353 0.985 -21.638 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.845 2.384 -23.033 1.00 0.00 H new ATOM 345 N ALA A 22 10.427 1.930 -14.609 1.00 0.00 N ATOM 346 CA ALA A 22 9.617 1.855 -13.401 1.00 0.00 C ATOM 347 C ALA A 22 9.574 3.170 -12.603 1.00 0.00 C ATOM 348 O ALA A 22 8.523 3.462 -12.047 1.00 0.00 O ATOM 349 CB ALA A 22 10.087 0.644 -12.593 1.00 0.00 C ATOM 0 H ALA A 22 11.311 1.425 -14.544 1.00 0.00 H new ATOM 0 HA ALA A 22 8.571 1.712 -13.673 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.496 0.564 -11.681 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.962 -0.261 -13.187 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.139 0.765 -12.334 1.00 0.00 H new ATOM 355 N LYS A 23 10.608 4.025 -12.610 1.00 0.00 N ATOM 356 CA LYS A 23 10.511 5.379 -12.013 1.00 0.00 C ATOM 357 C LYS A 23 9.683 6.347 -12.868 1.00 0.00 C ATOM 358 O LYS A 23 9.011 7.208 -12.312 1.00 0.00 O ATOM 359 CB LYS A 23 11.883 5.968 -11.610 1.00 0.00 C ATOM 360 CG LYS A 23 12.882 6.218 -12.754 1.00 0.00 C ATOM 361 CD LYS A 23 13.675 7.531 -12.601 1.00 0.00 C ATOM 362 CE LYS A 23 14.516 7.625 -11.318 1.00 0.00 C ATOM 363 NZ LYS A 23 15.201 8.949 -11.220 1.00 0.00 N ATOM 0 H LYS A 23 11.518 3.811 -13.018 1.00 0.00 H new ATOM 0 HA LYS A 23 9.961 5.247 -11.081 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.711 6.912 -11.094 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.348 5.292 -10.892 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.582 5.384 -12.804 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.341 6.237 -13.700 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.335 7.644 -13.461 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.976 8.367 -12.624 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.876 7.478 -10.448 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.258 6.826 -11.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 15.890 8.927 -10.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.694 9.152 -12.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.496 9.692 -11.037 1.00 0.00 H new ATOM 377 N THR A 24 9.657 6.177 -14.195 1.00 0.00 N ATOM 378 CA THR A 24 8.824 6.999 -15.097 1.00 0.00 C ATOM 379 C THR A 24 7.340 6.615 -15.027 1.00 0.00 C ATOM 380 O THR A 24 6.480 7.487 -14.915 1.00 0.00 O ATOM 381 CB THR A 24 9.311 6.902 -16.554 1.00 0.00 C ATOM 382 OG1 THR A 24 10.709 7.079 -16.614 1.00 0.00 O ATOM 383 CG2 THR A 24 8.683 7.959 -17.460 1.00 0.00 C ATOM 0 H THR A 24 10.210 5.469 -14.678 1.00 0.00 H new ATOM 0 HA THR A 24 8.927 8.028 -14.753 1.00 0.00 H new ATOM 0 HB THR A 24 9.015 5.913 -16.903 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.155 6.283 -16.256 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.064 7.841 -18.475 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.600 7.839 -17.463 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.937 8.952 -17.090 1.00 0.00 H new ATOM 391 N LEU A 25 7.025 5.312 -15.058 1.00 0.00 N ATOM 392 CA LEU A 25 5.641 4.797 -15.135 1.00 0.00 C ATOM 393 C LEU A 25 5.038 4.523 -13.755 1.00 0.00 C ATOM 394 O LEU A 25 3.871 4.821 -13.504 1.00 0.00 O ATOM 395 CB LEU A 25 5.620 3.532 -16.021 1.00 0.00 C ATOM 396 CG LEU A 25 6.195 3.750 -17.433 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.253 2.419 -18.178 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.371 4.732 -18.269 1.00 0.00 C ATOM 0 H LEU A 25 7.729 4.574 -15.030 1.00 0.00 H new ATOM 0 HA LEU A 25 5.015 5.567 -15.585 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.187 2.744 -15.526 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.593 3.178 -16.108 1.00 0.00 H new ATOM 0 HG LEU A 25 7.190 4.174 -17.299 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.660 2.578 -19.176 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.891 1.724 -17.632 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.249 2.003 -18.258 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.827 4.844 -19.253 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.355 4.352 -18.380 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.343 5.701 -17.770 1.00 0.00 H new ATOM 410 N GLY A 26 5.861 4.030 -12.830 1.00 0.00 N ATOM 411 CA GLY A 26 5.541 3.859 -11.407 1.00 0.00 C ATOM 412 C GLY A 26 5.576 5.149 -10.596 1.00 0.00 C ATOM 413 O GLY A 26 5.328 5.084 -9.392 1.00 0.00 O ATOM 0 H GLY A 26 6.808 3.726 -13.057 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.549 3.416 -11.321 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.245 3.150 -10.971 1.00 0.00 H new ATOM 417 N ALA A 27 5.841 6.300 -11.231 1.00 0.00 N ATOM 418 CA ALA A 27 5.769 7.617 -10.582 1.00 0.00 C ATOM 419 C ALA A 27 4.458 7.789 -9.780 1.00 0.00 C ATOM 420 O ALA A 27 3.364 7.795 -10.352 1.00 0.00 O ATOM 421 CB ALA A 27 5.908 8.706 -11.658 1.00 0.00 C ATOM 0 H ALA A 27 6.112 6.344 -12.213 1.00 0.00 H new ATOM 0 HA ALA A 27 6.585 7.705 -9.865 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.856 9.689 -11.190 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.866 8.596 -12.165 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.100 8.606 -12.383 1.00 0.00 H new ATOM 427 N GLY A 28 4.575 7.886 -8.450 1.00 0.00 N ATOM 428 CA GLY A 28 3.442 8.027 -7.523 1.00 0.00 C ATOM 429 C GLY A 28 2.586 6.766 -7.304 1.00 0.00 C ATOM 430 O GLY A 28 1.438 6.902 -6.875 1.00 0.00 O ATOM 0 H GLY A 28 5.478 7.868 -7.977 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.828 8.352 -6.557 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.794 8.822 -7.892 1.00 0.00 H new ATOM 434 N LYS A 29 3.097 5.554 -7.601 1.00 0.00 N ATOM 435 CA LYS A 29 2.328 4.289 -7.538 1.00 0.00 C ATOM 436 C LYS A 29 2.984 3.256 -6.631 1.00 0.00 C ATOM 437 O LYS A 29 2.302 2.572 -5.875 1.00 0.00 O ATOM 438 CB LYS A 29 2.168 3.700 -8.950 1.00 0.00 C ATOM 439 CG LYS A 29 1.430 4.655 -9.903 1.00 0.00 C ATOM 440 CD LYS A 29 1.209 4.035 -11.289 1.00 0.00 C ATOM 441 CE LYS A 29 0.534 5.023 -12.259 1.00 0.00 C ATOM 442 NZ LYS A 29 1.442 6.135 -12.683 1.00 0.00 N ATOM 0 H LYS A 29 4.065 5.422 -7.895 1.00 0.00 H new ATOM 0 HA LYS A 29 1.352 4.528 -7.117 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.152 3.471 -9.359 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.622 2.759 -8.888 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.467 4.925 -9.470 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.003 5.577 -10.006 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.167 3.718 -11.702 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.592 3.142 -11.193 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.193 4.482 -13.142 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.351 5.445 -11.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.999 6.669 -13.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.612 6.771 -11.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.347 5.739 -13.009 1.00 0.00 H new ATOM 456 N ILE A 30 4.311 3.165 -6.728 1.00 0.00 N ATOM 457 CA ILE A 30 5.194 2.303 -5.936 1.00 0.00 C ATOM 458 C ILE A 30 6.604 2.918 -5.843 1.00 0.00 C ATOM 459 O ILE A 30 6.931 3.860 -6.562 1.00 0.00 O ATOM 460 CB ILE A 30 5.253 0.865 -6.518 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.211 0.704 -8.055 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.163 -0.034 -5.909 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.446 1.280 -8.752 1.00 0.00 C ATOM 0 H ILE A 30 4.832 3.725 -7.403 1.00 0.00 H new ATOM 0 HA ILE A 30 4.781 2.232 -4.930 1.00 0.00 H new ATOM 0 HB ILE A 30 6.257 0.556 -6.228 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.122 -0.354 -8.301 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.319 1.197 -8.442 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.233 -1.033 -6.339 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.301 -0.093 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.181 0.386 -6.127 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.356 1.136 -9.829 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.524 2.345 -8.533 1.00 0.00 H new ATOM 0 HD13 ILE A 30 7.339 0.770 -8.391 1.00 0.00 H new ATOM 475 N ALA A 31 7.444 2.360 -4.969 1.00 0.00 N ATOM 476 CA ALA A 31 8.881 2.664 -4.901 1.00 0.00 C ATOM 477 C ALA A 31 9.668 1.666 -5.775 1.00 0.00 C ATOM 478 O ALA A 31 9.201 0.551 -6.002 1.00 0.00 O ATOM 479 CB ALA A 31 9.320 2.680 -3.431 1.00 0.00 C ATOM 0 H ALA A 31 7.144 1.674 -4.277 1.00 0.00 H new ATOM 0 HA ALA A 31 9.093 3.653 -5.306 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.385 2.905 -3.372 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.758 3.442 -2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.130 1.704 -2.984 1.00 0.00 H new ATOM 485 N VAL A 32 10.851 2.037 -6.280 1.00 0.00 N ATOM 486 CA VAL A 32 11.648 1.214 -7.220 1.00 0.00 C ATOM 487 C VAL A 32 13.149 1.240 -6.912 1.00 0.00 C ATOM 488 O VAL A 32 13.688 2.276 -6.522 1.00 0.00 O ATOM 489 CB VAL A 32 11.417 1.620 -8.694 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.940 1.515 -9.078 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.858 3.047 -9.041 1.00 0.00 C ATOM 0 H VAL A 32 11.294 2.927 -6.049 1.00 0.00 H new ATOM 0 HA VAL A 32 11.291 0.194 -7.076 1.00 0.00 H new ATOM 0 HB VAL A 32 12.036 0.918 -9.252 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.813 1.808 -10.120 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.602 0.487 -8.946 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.351 2.175 -8.442 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.658 3.244 -10.094 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.305 3.758 -8.428 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.925 3.155 -8.848 1.00 0.00 H new ATOM 501 N THR A 33 13.830 0.113 -7.133 1.00 0.00 N ATOM 502 CA THR A 33 15.287 -0.034 -6.948 1.00 0.00 C ATOM 503 C THR A 33 15.852 -1.084 -7.909 1.00 0.00 C ATOM 504 O THR A 33 15.203 -2.099 -8.149 1.00 0.00 O ATOM 505 CB THR A 33 15.608 -0.463 -5.501 1.00 0.00 C ATOM 506 OG1 THR A 33 14.954 0.370 -4.563 1.00 0.00 O ATOM 507 CG2 THR A 33 17.095 -0.411 -5.159 1.00 0.00 C ATOM 0 H THR A 33 13.380 -0.745 -7.453 1.00 0.00 H new ATOM 0 HA THR A 33 15.746 0.933 -7.155 1.00 0.00 H new ATOM 0 HB THR A 33 15.260 -1.494 -5.443 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.401 0.298 -3.694 1.00 0.00 H new ATOM 0 HG21 THR A 33 17.242 -0.726 -4.126 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.645 -1.078 -5.823 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.461 0.608 -5.283 1.00 0.00 H new ATOM 515 N SER A 34 17.052 -0.873 -8.451 1.00 0.00 N ATOM 516 CA SER A 34 17.818 -1.862 -9.228 1.00 0.00 C ATOM 517 C SER A 34 18.968 -2.483 -8.429 1.00 0.00 C ATOM 518 O SER A 34 19.592 -1.841 -7.585 1.00 0.00 O ATOM 519 CB SER A 34 18.338 -1.239 -10.520 1.00 0.00 C ATOM 520 OG SER A 34 19.297 -2.070 -11.150 1.00 0.00 O ATOM 0 H SER A 34 17.538 0.019 -8.361 1.00 0.00 H new ATOM 0 HA SER A 34 17.131 -2.673 -9.471 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.505 -1.063 -11.201 1.00 0.00 H new ATOM 0 HB3 SER A 34 18.783 -0.268 -10.303 1.00 0.00 H new ATOM 0 HG SER A 34 20.185 -1.884 -10.780 1.00 0.00 H new ATOM 526 N CYS A 35 19.269 -3.744 -8.746 1.00 0.00 N ATOM 527 CA CYS A 35 20.309 -4.554 -8.126 1.00 0.00 C ATOM 528 C CYS A 35 20.812 -5.649 -9.091 1.00 0.00 C ATOM 529 O CYS A 35 20.180 -5.967 -10.100 1.00 0.00 O ATOM 530 CB CYS A 35 19.677 -5.108 -6.834 1.00 0.00 C ATOM 531 SG CYS A 35 20.768 -6.239 -5.933 1.00 0.00 S ATOM 0 H CYS A 35 18.768 -4.248 -9.477 1.00 0.00 H new ATOM 0 HA CYS A 35 21.204 -3.979 -7.888 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.409 -4.276 -6.183 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.752 -5.628 -7.084 1.00 0.00 H new ATOM 0 HG CYS A 35 21.934 -5.685 -5.777 1.00 0.00 H new ATOM 537 N GLY A 36 21.950 -6.257 -8.766 1.00 0.00 N ATOM 538 CA GLY A 36 22.470 -7.459 -9.423 1.00 0.00 C ATOM 539 C GLY A 36 23.203 -8.334 -8.412 1.00 0.00 C ATOM 540 O GLY A 36 23.651 -7.836 -7.380 1.00 0.00 O ATOM 0 H GLY A 36 22.555 -5.920 -8.017 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.651 -8.019 -9.874 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.146 -7.178 -10.230 1.00 0.00 H new ATOM 544 N LEU A 37 23.361 -9.630 -8.698 1.00 0.00 N ATOM 545 CA LEU A 37 23.981 -10.591 -7.754 1.00 0.00 C ATOM 546 C LEU A 37 25.388 -10.161 -7.283 1.00 0.00 C ATOM 547 O LEU A 37 25.718 -10.291 -6.108 1.00 0.00 O ATOM 548 CB LEU A 37 24.021 -11.998 -8.382 1.00 0.00 C ATOM 549 CG LEU A 37 22.672 -12.557 -8.876 1.00 0.00 C ATOM 550 CD1 LEU A 37 22.873 -13.997 -9.340 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.582 -12.537 -7.804 1.00 0.00 C ATOM 0 H LEU A 37 23.068 -10.049 -9.581 1.00 0.00 H new ATOM 0 HA LEU A 37 23.355 -10.607 -6.862 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.714 -11.979 -9.223 1.00 0.00 H new ATOM 0 HB3 LEU A 37 24.431 -12.691 -7.647 1.00 0.00 H new ATOM 0 HG LEU A 37 22.339 -11.913 -9.690 1.00 0.00 H new ATOM 0 HD11 LEU A 37 21.924 -14.402 -9.692 1.00 0.00 H new ATOM 0 HD12 LEU A 37 23.600 -14.020 -10.152 1.00 0.00 H new ATOM 0 HD13 LEU A 37 23.239 -14.600 -8.509 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.659 -12.943 -8.216 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.897 -13.142 -6.954 1.00 0.00 H new ATOM 0 HD23 LEU A 37 21.413 -11.511 -7.477 1.00 0.00 H new ATOM 563 N GLU A 38 26.166 -9.557 -8.188 1.00 0.00 N ATOM 564 CA GLU A 38 27.445 -8.871 -7.908 1.00 0.00 C ATOM 565 C GLU A 38 27.401 -7.435 -8.480 1.00 0.00 C ATOM 566 O GLU A 38 28.352 -6.944 -9.090 1.00 0.00 O ATOM 567 CB GLU A 38 28.653 -9.683 -8.413 1.00 0.00 C ATOM 568 CG GLU A 38 28.711 -11.130 -7.910 1.00 0.00 C ATOM 569 CD GLU A 38 29.995 -11.820 -8.412 1.00 0.00 C ATOM 570 OE1 GLU A 38 30.196 -11.905 -9.649 1.00 0.00 O ATOM 571 OE2 GLU A 38 30.815 -12.276 -7.578 1.00 0.00 O ATOM 0 H GLU A 38 25.917 -9.528 -9.177 1.00 0.00 H new ATOM 0 HA GLU A 38 27.578 -8.795 -6.829 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.636 -9.692 -9.503 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.568 -9.172 -8.113 1.00 0.00 H new ATOM 0 HG2 GLU A 38 28.684 -11.145 -6.820 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.836 -11.678 -8.258 1.00 0.00 H new ATOM 578 N SER A 39 26.247 -6.776 -8.295 1.00 0.00 N ATOM 579 CA SER A 39 25.839 -5.492 -8.894 1.00 0.00 C ATOM 580 C SER A 39 25.599 -5.503 -10.420 1.00 0.00 C ATOM 581 O SER A 39 25.898 -6.466 -11.129 1.00 0.00 O ATOM 582 CB SER A 39 26.791 -4.375 -8.457 1.00 0.00 C ATOM 583 OG SER A 39 26.090 -3.150 -8.529 1.00 0.00 O ATOM 0 H SER A 39 25.523 -7.150 -7.681 1.00 0.00 H new ATOM 0 HA SER A 39 24.844 -5.293 -8.497 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.145 -4.552 -7.442 1.00 0.00 H new ATOM 0 HB3 SER A 39 27.670 -4.350 -9.101 1.00 0.00 H new ATOM 0 HG SER A 39 26.680 -2.419 -8.251 1.00 0.00 H new ATOM 589 N SER A 40 25.000 -4.420 -10.914 1.00 0.00 N ATOM 590 CA SER A 40 24.675 -4.133 -12.323 1.00 0.00 C ATOM 591 C SER A 40 24.997 -2.654 -12.651 1.00 0.00 C ATOM 592 O SER A 40 25.326 -1.877 -11.751 1.00 0.00 O ATOM 593 CB SER A 40 23.201 -4.490 -12.590 1.00 0.00 C ATOM 594 OG SER A 40 22.330 -3.639 -11.868 1.00 0.00 O ATOM 0 H SER A 40 24.705 -3.661 -10.300 1.00 0.00 H new ATOM 0 HA SER A 40 25.288 -4.745 -12.984 1.00 0.00 H new ATOM 0 HB2 SER A 40 22.992 -4.409 -13.657 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.018 -5.527 -12.307 1.00 0.00 H new ATOM 0 HG SER A 40 21.754 -4.178 -11.287 1.00 0.00 H new ATOM 600 N ARG A 41 24.952 -2.240 -13.927 1.00 0.00 N ATOM 601 CA ARG A 41 25.444 -0.917 -14.384 1.00 0.00 C ATOM 602 C ARG A 41 24.485 -0.133 -15.266 1.00 0.00 C ATOM 603 O ARG A 41 23.499 -0.656 -15.773 1.00 0.00 O ATOM 604 CB ARG A 41 26.830 -1.087 -15.058 1.00 0.00 C ATOM 605 CG ARG A 41 26.785 -1.791 -16.432 1.00 0.00 C ATOM 606 CD ARG A 41 28.103 -1.650 -17.206 1.00 0.00 C ATOM 607 NE ARG A 41 29.230 -2.274 -16.488 1.00 0.00 N ATOM 608 CZ ARG A 41 30.320 -1.711 -15.997 1.00 0.00 C ATOM 609 NH1 ARG A 41 30.559 -0.433 -16.087 1.00 0.00 N ATOM 610 NH2 ARG A 41 31.193 -2.461 -15.394 1.00 0.00 N ATOM 0 H ARG A 41 24.572 -2.813 -14.681 1.00 0.00 H new ATOM 0 HA ARG A 41 25.531 -0.302 -13.489 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.284 -0.104 -15.181 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.478 -1.657 -14.392 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.563 -2.848 -16.288 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.972 -1.372 -17.025 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.998 -2.110 -18.188 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.317 -0.594 -17.370 1.00 0.00 H new ATOM 0 HE ARG A 41 29.158 -3.282 -16.351 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.889 0.180 -16.553 1.00 0.00 H new ATOM 0 HH12 ARG A 41 31.416 -0.045 -15.692 1.00 0.00 H new ATOM 0 HH21 ARG A 41 31.030 -3.464 -15.307 1.00 0.00 H new ATOM 0 HH22 ARG A 41 32.041 -2.047 -15.008 1.00 0.00 H new ATOM 624 N VAL A 42 24.830 1.136 -15.462 1.00 0.00 N ATOM 625 CA VAL A 42 24.218 2.046 -16.441 1.00 0.00 C ATOM 626 C VAL A 42 25.223 2.269 -17.581 1.00 0.00 C ATOM 627 O VAL A 42 26.433 2.173 -17.371 1.00 0.00 O ATOM 628 CB VAL A 42 23.726 3.355 -15.784 1.00 0.00 C ATOM 629 CG1 VAL A 42 22.728 3.053 -14.665 1.00 0.00 C ATOM 630 CG2 VAL A 42 24.834 4.263 -15.252 1.00 0.00 C ATOM 0 H VAL A 42 25.573 1.582 -14.924 1.00 0.00 H new ATOM 0 HA VAL A 42 23.316 1.598 -16.859 1.00 0.00 H new ATOM 0 HB VAL A 42 23.245 3.909 -16.590 1.00 0.00 H new ATOM 0 HG11 VAL A 42 22.393 3.987 -14.214 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.870 2.520 -15.076 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.208 2.436 -13.906 1.00 0.00 H new ATOM 0 HG21 VAL A 42 24.392 5.156 -14.810 1.00 0.00 H new ATOM 0 HG22 VAL A 42 25.409 3.730 -14.495 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.492 4.552 -16.071 1.00 0.00 H new ATOM 640 N HIS A 43 24.737 2.522 -18.797 1.00 0.00 N ATOM 641 CA HIS A 43 25.556 2.546 -20.021 1.00 0.00 C ATOM 642 C HIS A 43 25.160 3.745 -20.892 1.00 0.00 C ATOM 643 O HIS A 43 23.961 3.909 -21.099 1.00 0.00 O ATOM 644 CB HIS A 43 25.341 1.206 -20.753 1.00 0.00 C ATOM 645 CG HIS A 43 26.047 1.119 -22.082 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.424 1.249 -22.268 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.442 0.971 -23.298 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.623 1.177 -23.593 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.454 1.013 -24.235 1.00 0.00 N ATOM 0 H HIS A 43 23.751 2.719 -18.967 1.00 0.00 H new ATOM 0 HA HIS A 43 26.614 2.661 -19.786 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.688 0.394 -20.114 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.273 1.055 -20.909 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.133 1.373 -21.545 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.386 0.846 -23.487 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.587 1.242 -24.076 1.00 0.00 H new ATOM 657 N PRO A 44 26.082 4.566 -21.445 1.00 0.00 N ATOM 658 CA PRO A 44 25.724 5.780 -22.193 1.00 0.00 C ATOM 659 C PRO A 44 24.717 5.571 -23.331 1.00 0.00 C ATOM 660 O PRO A 44 23.800 6.376 -23.499 1.00 0.00 O ATOM 661 CB PRO A 44 27.053 6.352 -22.698 1.00 0.00 C ATOM 662 CG PRO A 44 28.026 5.937 -21.598 1.00 0.00 C ATOM 663 CD PRO A 44 27.524 4.546 -21.216 1.00 0.00 C ATOM 0 HA PRO A 44 25.193 6.468 -21.535 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.333 5.936 -23.666 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.011 7.435 -22.816 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.055 5.912 -21.956 1.00 0.00 H new ATOM 0 HG3 PRO A 44 27.999 6.624 -20.752 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.005 3.777 -21.820 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.751 4.321 -20.174 1.00 0.00 H new ATOM 671 N THR A 45 24.783 4.444 -24.047 1.00 0.00 N ATOM 672 CA THR A 45 23.779 4.107 -25.078 1.00 0.00 C ATOM 673 C THR A 45 22.419 3.779 -24.460 1.00 0.00 C ATOM 674 O THR A 45 21.399 4.174 -25.009 1.00 0.00 O ATOM 675 CB THR A 45 24.261 2.959 -25.987 1.00 0.00 C ATOM 676 OG1 THR A 45 25.625 3.116 -26.330 1.00 0.00 O ATOM 677 CG2 THR A 45 23.474 2.829 -27.288 1.00 0.00 C ATOM 0 H THR A 45 25.518 3.746 -23.936 1.00 0.00 H new ATOM 0 HA THR A 45 23.654 4.994 -25.699 1.00 0.00 H new ATOM 0 HB THR A 45 24.102 2.057 -25.396 1.00 0.00 H new ATOM 0 HG1 THR A 45 26.174 2.533 -25.765 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.872 2.000 -27.873 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.424 2.642 -27.061 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.562 3.752 -27.860 1.00 0.00 H new ATOM 685 N ALA A 46 22.369 3.160 -23.275 1.00 0.00 N ATOM 686 CA ALA A 46 21.123 2.973 -22.521 1.00 0.00 C ATOM 687 C ALA A 46 20.620 4.266 -21.850 1.00 0.00 C ATOM 688 O ALA A 46 19.477 4.314 -21.414 1.00 0.00 O ATOM 689 CB ALA A 46 21.296 1.813 -21.529 1.00 0.00 C ATOM 0 H ALA A 46 23.191 2.774 -22.811 1.00 0.00 H new ATOM 0 HA ALA A 46 20.334 2.711 -23.226 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.372 1.673 -20.968 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.531 0.899 -22.075 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.108 2.043 -20.839 1.00 0.00 H new ATOM 695 N ILE A 47 21.430 5.324 -21.764 1.00 0.00 N ATOM 696 CA ILE A 47 20.930 6.652 -21.377 1.00 0.00 C ATOM 697 C ILE A 47 20.234 7.244 -22.616 1.00 0.00 C ATOM 698 O ILE A 47 19.042 7.553 -22.588 1.00 0.00 O ATOM 699 CB ILE A 47 22.049 7.581 -20.843 1.00 0.00 C ATOM 700 CG1 ILE A 47 22.788 6.917 -19.659 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.422 8.926 -20.442 1.00 0.00 C ATOM 702 CD1 ILE A 47 23.912 7.758 -19.036 1.00 0.00 C ATOM 0 H ILE A 47 22.431 5.291 -21.956 1.00 0.00 H new ATOM 0 HA ILE A 47 20.230 6.559 -20.547 1.00 0.00 H new ATOM 0 HB ILE A 47 22.792 7.757 -21.621 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.060 6.681 -18.883 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.209 5.971 -19.999 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.198 9.591 -20.064 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.947 9.380 -21.312 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.675 8.762 -19.665 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.368 7.205 -18.215 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.667 7.973 -19.792 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.500 8.694 -18.659 1.00 0.00 H new ATOM 714 N ALA A 48 20.949 7.307 -23.746 1.00 0.00 N ATOM 715 CA ALA A 48 20.506 8.033 -24.936 1.00 0.00 C ATOM 716 C ALA A 48 19.377 7.349 -25.727 1.00 0.00 C ATOM 717 O ALA A 48 18.486 8.030 -26.234 1.00 0.00 O ATOM 718 CB ALA A 48 21.733 8.295 -25.820 1.00 0.00 C ATOM 0 H ALA A 48 21.855 6.852 -23.858 1.00 0.00 H new ATOM 0 HA ALA A 48 20.058 8.968 -24.600 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.427 8.836 -26.715 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.460 8.890 -25.267 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.184 7.345 -26.107 1.00 0.00 H new ATOM 724 N MET A 49 19.356 6.011 -25.789 1.00 0.00 N ATOM 725 CA MET A 49 18.274 5.246 -26.435 1.00 0.00 C ATOM 726 C MET A 49 16.948 5.295 -25.659 1.00 0.00 C ATOM 727 O MET A 49 15.926 4.840 -26.172 1.00 0.00 O ATOM 728 CB MET A 49 18.708 3.786 -26.658 1.00 0.00 C ATOM 729 CG MET A 49 19.862 3.632 -27.658 1.00 0.00 C ATOM 730 SD MET A 49 19.452 4.029 -29.377 1.00 0.00 S ATOM 731 CE MET A 49 20.193 5.683 -29.508 1.00 0.00 C ATOM 0 H MET A 49 20.090 5.424 -25.392 1.00 0.00 H new ATOM 0 HA MET A 49 18.089 5.725 -27.397 1.00 0.00 H new ATOM 0 HB2 MET A 49 19.007 3.355 -25.702 1.00 0.00 H new ATOM 0 HB3 MET A 49 17.852 3.212 -27.013 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.685 4.273 -27.340 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.223 2.605 -27.616 1.00 0.00 H new ATOM 0 HE1 MET A 49 19.772 6.203 -30.368 1.00 0.00 H new ATOM 0 HE2 MET A 49 19.980 6.250 -28.602 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.272 5.590 -29.633 1.00 0.00 H new ATOM 741 N MET A 50 16.953 5.823 -24.430 1.00 0.00 N ATOM 742 CA MET A 50 15.826 5.750 -23.489 1.00 0.00 C ATOM 743 C MET A 50 15.350 7.142 -23.041 1.00 0.00 C ATOM 744 O MET A 50 14.151 7.343 -22.850 1.00 0.00 O ATOM 745 CB MET A 50 16.213 4.861 -22.294 1.00 0.00 C ATOM 746 CG MET A 50 16.973 3.585 -22.690 1.00 0.00 C ATOM 747 SD MET A 50 16.147 2.484 -23.845 1.00 0.00 S ATOM 748 CE MET A 50 17.400 1.178 -23.952 1.00 0.00 C ATOM 0 H MET A 50 17.757 6.324 -24.052 1.00 0.00 H new ATOM 0 HA MET A 50 14.977 5.298 -24.002 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.829 5.441 -21.606 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.309 4.581 -21.754 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.929 3.878 -23.123 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.193 3.024 -21.782 1.00 0.00 H new ATOM 0 HE1 MET A 50 17.520 0.873 -24.992 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.350 1.554 -23.573 1.00 0.00 H new ATOM 0 HE3 MET A 50 17.085 0.321 -23.356 1.00 0.00 H new ATOM 758 N GLU A 51 16.231 8.147 -22.984 1.00 0.00 N ATOM 759 CA GLU A 51 15.820 9.541 -22.763 1.00 0.00 C ATOM 760 C GLU A 51 14.898 10.065 -23.886 1.00 0.00 C ATOM 761 O GLU A 51 14.050 10.923 -23.644 1.00 0.00 O ATOM 762 CB GLU A 51 17.030 10.466 -22.530 1.00 0.00 C ATOM 763 CG GLU A 51 17.830 10.808 -23.791 1.00 0.00 C ATOM 764 CD GLU A 51 18.997 11.763 -23.465 1.00 0.00 C ATOM 765 OE1 GLU A 51 18.750 12.984 -23.306 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.164 11.312 -23.385 1.00 0.00 O ATOM 0 H GLU A 51 17.238 8.021 -23.088 1.00 0.00 H new ATOM 0 HA GLU A 51 15.230 9.552 -21.847 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.679 11.393 -22.077 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.698 9.993 -21.810 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.219 9.893 -24.238 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.173 11.269 -24.528 1.00 0.00 H new ATOM 773 N GLU A 52 14.995 9.491 -25.097 1.00 0.00 N ATOM 774 CA GLU A 52 14.119 9.810 -26.240 1.00 0.00 C ATOM 775 C GLU A 52 12.656 9.343 -26.053 1.00 0.00 C ATOM 776 O GLU A 52 11.772 9.808 -26.778 1.00 0.00 O ATOM 777 CB GLU A 52 14.747 9.328 -27.564 1.00 0.00 C ATOM 778 CG GLU A 52 15.000 7.818 -27.649 1.00 0.00 C ATOM 779 CD GLU A 52 15.522 7.398 -29.039 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.560 7.907 -29.518 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.913 6.495 -29.662 1.00 0.00 O ATOM 0 H GLU A 52 15.695 8.781 -25.314 1.00 0.00 H new ATOM 0 HA GLU A 52 14.047 10.896 -26.289 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.093 9.618 -28.386 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.693 9.849 -27.711 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.723 7.528 -26.887 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.076 7.283 -27.432 1.00 0.00 H new ATOM 788 N VAL A 53 12.382 8.476 -25.061 1.00 0.00 N ATOM 789 CA VAL A 53 11.015 8.117 -24.606 1.00 0.00 C ATOM 790 C VAL A 53 10.754 8.592 -23.160 1.00 0.00 C ATOM 791 O VAL A 53 9.805 8.159 -22.506 1.00 0.00 O ATOM 792 CB VAL A 53 10.620 6.646 -24.885 1.00 0.00 C ATOM 793 CG1 VAL A 53 10.958 6.234 -26.323 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.243 5.611 -23.941 1.00 0.00 C ATOM 0 H VAL A 53 13.114 7.993 -24.540 1.00 0.00 H new ATOM 0 HA VAL A 53 10.322 8.676 -25.234 1.00 0.00 H new ATOM 0 HB VAL A 53 9.544 6.638 -24.712 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.667 5.196 -26.482 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.418 6.873 -27.021 1.00 0.00 H new ATOM 0 HG13 VAL A 53 12.030 6.340 -26.489 1.00 0.00 H new ATOM 0 HG21 VAL A 53 10.904 4.613 -24.220 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.329 5.659 -24.015 1.00 0.00 H new ATOM 0 HG23 VAL A 53 10.939 5.824 -22.916 1.00 0.00 H new ATOM 804 N GLY A 54 11.593 9.518 -22.668 1.00 0.00 N ATOM 805 CA GLY A 54 11.455 10.211 -21.385 1.00 0.00 C ATOM 806 C GLY A 54 12.033 9.490 -20.157 1.00 0.00 C ATOM 807 O GLY A 54 11.745 9.902 -19.031 1.00 0.00 O ATOM 0 H GLY A 54 12.423 9.815 -23.181 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.937 11.185 -21.468 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.395 10.394 -21.207 1.00 0.00 H new ATOM 811 N ILE A 55 12.825 8.426 -20.341 1.00 0.00 N ATOM 812 CA ILE A 55 13.337 7.588 -19.237 1.00 0.00 C ATOM 813 C ILE A 55 14.649 8.137 -18.657 1.00 0.00 C ATOM 814 O ILE A 55 15.452 8.746 -19.366 1.00 0.00 O ATOM 815 CB ILE A 55 13.475 6.108 -19.660 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.297 5.592 -20.508 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.628 5.196 -18.434 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.905 5.747 -19.877 1.00 0.00 C ATOM 0 H ILE A 55 13.133 8.117 -21.263 1.00 0.00 H new ATOM 0 HA ILE A 55 12.596 7.629 -18.439 1.00 0.00 H new ATOM 0 HB ILE A 55 14.371 6.074 -20.280 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.303 6.117 -21.463 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.463 4.536 -20.723 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.723 4.160 -18.760 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.519 5.484 -17.875 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.751 5.296 -17.795 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.151 5.352 -20.558 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.869 5.197 -18.937 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.707 6.802 -19.688 1.00 0.00 H new ATOM 830 N ASP A 56 14.883 7.879 -17.368 1.00 0.00 N ATOM 831 CA ASP A 56 16.059 8.338 -16.619 1.00 0.00 C ATOM 832 C ASP A 56 16.765 7.196 -15.859 1.00 0.00 C ATOM 833 O ASP A 56 16.175 6.536 -15.000 1.00 0.00 O ATOM 834 CB ASP A 56 15.630 9.471 -15.679 1.00 0.00 C ATOM 835 CG ASP A 56 16.732 9.871 -14.681 1.00 0.00 C ATOM 836 OD1 ASP A 56 17.902 10.026 -15.104 1.00 0.00 O ATOM 837 OD2 ASP A 56 16.407 10.034 -13.479 1.00 0.00 O ATOM 0 H ASP A 56 14.241 7.328 -16.798 1.00 0.00 H new ATOM 0 HA ASP A 56 16.800 8.711 -17.326 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.350 10.342 -16.272 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.742 9.162 -15.127 1.00 0.00 H new ATOM 842 N ILE A 57 18.051 6.990 -16.174 1.00 0.00 N ATOM 843 CA ILE A 57 18.982 6.116 -15.434 1.00 0.00 C ATOM 844 C ILE A 57 20.301 6.841 -15.088 1.00 0.00 C ATOM 845 O ILE A 57 21.216 6.240 -14.532 1.00 0.00 O ATOM 846 CB ILE A 57 19.227 4.769 -16.160 1.00 0.00 C ATOM 847 CG1 ILE A 57 19.980 4.944 -17.496 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.904 4.000 -16.339 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.372 3.618 -18.158 1.00 0.00 C ATOM 0 H ILE A 57 18.490 7.440 -16.977 1.00 0.00 H new ATOM 0 HA ILE A 57 18.498 5.872 -14.488 1.00 0.00 H new ATOM 0 HB ILE A 57 19.881 4.171 -15.525 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.355 5.513 -18.184 1.00 0.00 H new ATOM 0 HG13 ILE A 57 20.880 5.533 -17.322 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.098 3.057 -16.851 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.465 3.799 -15.362 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.212 4.599 -16.931 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.897 3.819 -19.092 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.023 3.056 -17.489 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.474 3.035 -18.365 1.00 0.00 H new ATOM 861 N SER A 58 20.421 8.133 -15.408 1.00 0.00 N ATOM 862 CA SER A 58 21.681 8.892 -15.353 1.00 0.00 C ATOM 863 C SER A 58 22.176 9.153 -13.930 1.00 0.00 C ATOM 864 O SER A 58 23.383 9.169 -13.684 1.00 0.00 O ATOM 865 CB SER A 58 21.512 10.242 -16.064 1.00 0.00 C ATOM 866 OG SER A 58 20.983 10.056 -17.368 1.00 0.00 O ATOM 0 H SER A 58 19.629 8.696 -15.720 1.00 0.00 H new ATOM 0 HA SER A 58 22.426 8.272 -15.852 1.00 0.00 H new ATOM 0 HB2 SER A 58 20.849 10.884 -15.485 1.00 0.00 H new ATOM 0 HB3 SER A 58 22.474 10.750 -16.125 1.00 0.00 H new ATOM 0 HG SER A 58 20.880 10.926 -17.806 1.00 0.00 H new ATOM 872 N GLY A 59 21.246 9.347 -12.990 1.00 0.00 N ATOM 873 CA GLY A 59 21.536 9.591 -11.573 1.00 0.00 C ATOM 874 C GLY A 59 21.618 8.326 -10.710 1.00 0.00 C ATOM 875 O GLY A 59 21.735 8.447 -9.489 1.00 0.00 O ATOM 0 H GLY A 59 20.247 9.339 -13.198 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.481 10.129 -11.497 1.00 0.00 H new ATOM 0 HA3 GLY A 59 20.764 10.244 -11.165 1.00 0.00 H new ATOM 879 N GLN A 60 21.518 7.124 -11.302 1.00 0.00 N ATOM 880 CA GLN A 60 21.366 5.861 -10.563 1.00 0.00 C ATOM 881 C GLN A 60 22.538 4.884 -10.756 1.00 0.00 C ATOM 882 O GLN A 60 23.266 4.919 -11.747 1.00 0.00 O ATOM 883 CB GLN A 60 20.036 5.187 -10.928 1.00 0.00 C ATOM 884 CG GLN A 60 18.815 6.067 -10.616 1.00 0.00 C ATOM 885 CD GLN A 60 18.077 6.457 -11.887 1.00 0.00 C ATOM 886 OE1 GLN A 60 18.313 7.503 -12.471 1.00 0.00 O ATOM 887 NE2 GLN A 60 17.189 5.623 -12.369 1.00 0.00 N ATOM 0 H GLN A 60 21.541 7.002 -12.314 1.00 0.00 H new ATOM 0 HA GLN A 60 21.367 6.125 -9.505 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.038 4.941 -11.990 1.00 0.00 H new ATOM 0 HB3 GLN A 60 19.949 4.247 -10.383 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.139 5.532 -9.950 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.136 6.965 -10.089 1.00 0.00 H new ATOM 0 HE21 GLN A 60 16.992 4.749 -11.881 1.00 0.00 H new ATOM 0 HE22 GLN A 60 16.695 5.847 -13.232 1.00 0.00 H new ATOM 896 N THR A 61 22.692 3.988 -9.778 1.00 0.00 N ATOM 897 CA THR A 61 23.638 2.859 -9.787 1.00 0.00 C ATOM 898 C THR A 61 23.149 1.749 -8.843 1.00 0.00 C ATOM 899 O THR A 61 22.275 1.985 -8.002 1.00 0.00 O ATOM 900 CB THR A 61 25.062 3.325 -9.433 1.00 0.00 C ATOM 901 OG1 THR A 61 25.968 2.287 -9.741 1.00 0.00 O ATOM 902 CG2 THR A 61 25.248 3.719 -7.967 1.00 0.00 C ATOM 0 H THR A 61 22.140 4.027 -8.921 1.00 0.00 H new ATOM 0 HA THR A 61 23.680 2.447 -10.795 1.00 0.00 H new ATOM 0 HB THR A 61 25.248 4.224 -10.021 1.00 0.00 H new ATOM 0 HG1 THR A 61 26.879 2.572 -9.521 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.278 4.035 -7.803 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.574 4.540 -7.722 1.00 0.00 H new ATOM 0 HG23 THR A 61 25.025 2.864 -7.329 1.00 0.00 H new ATOM 910 N SER A 62 23.669 0.533 -9.002 1.00 0.00 N ATOM 911 CA SER A 62 23.293 -0.653 -8.216 1.00 0.00 C ATOM 912 C SER A 62 24.342 -1.006 -7.146 1.00 0.00 C ATOM 913 O SER A 62 25.442 -0.448 -7.114 1.00 0.00 O ATOM 914 CB SER A 62 23.116 -1.847 -9.148 1.00 0.00 C ATOM 915 OG SER A 62 22.099 -1.614 -10.108 1.00 0.00 O ATOM 0 H SER A 62 24.385 0.334 -9.701 1.00 0.00 H new ATOM 0 HA SER A 62 22.360 -0.418 -7.704 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.057 -2.054 -9.657 1.00 0.00 H new ATOM 0 HB3 SER A 62 22.869 -2.733 -8.563 1.00 0.00 H new ATOM 0 HG SER A 62 22.231 -2.209 -10.876 1.00 0.00 H new ATOM 921 N ASP A 63 24.010 -1.974 -6.285 1.00 0.00 N ATOM 922 CA ASP A 63 24.935 -2.617 -5.340 1.00 0.00 C ATOM 923 C ASP A 63 24.681 -4.143 -5.307 1.00 0.00 C ATOM 924 O ASP A 63 23.589 -4.581 -5.696 1.00 0.00 O ATOM 925 CB ASP A 63 24.795 -2.001 -3.941 1.00 0.00 C ATOM 926 CG ASP A 63 25.379 -0.581 -3.856 1.00 0.00 C ATOM 927 OD1 ASP A 63 26.625 -0.451 -3.759 1.00 0.00 O ATOM 928 OD2 ASP A 63 24.600 0.405 -3.829 1.00 0.00 O ATOM 0 H ASP A 63 23.062 -2.344 -6.223 1.00 0.00 H new ATOM 0 HA ASP A 63 25.958 -2.446 -5.675 1.00 0.00 H new ATOM 0 HB2 ASP A 63 23.741 -1.973 -3.665 1.00 0.00 H new ATOM 0 HB3 ASP A 63 25.298 -2.640 -3.215 1.00 0.00 H new ATOM 933 N PRO A 64 25.647 -4.972 -4.856 1.00 0.00 N ATOM 934 CA PRO A 64 25.476 -6.424 -4.746 1.00 0.00 C ATOM 935 C PRO A 64 24.313 -6.819 -3.831 1.00 0.00 C ATOM 936 O PRO A 64 24.148 -6.249 -2.751 1.00 0.00 O ATOM 937 CB PRO A 64 26.811 -6.969 -4.219 1.00 0.00 C ATOM 938 CG PRO A 64 27.820 -5.907 -4.650 1.00 0.00 C ATOM 939 CD PRO A 64 27.016 -4.616 -4.504 1.00 0.00 C ATOM 0 HA PRO A 64 25.221 -6.848 -5.718 1.00 0.00 H new ATOM 0 HB2 PRO A 64 26.795 -7.093 -3.136 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.045 -7.943 -4.648 1.00 0.00 H new ATOM 0 HG2 PRO A 64 28.707 -5.908 -4.016 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.160 -6.061 -5.674 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.073 -4.231 -3.486 1.00 0.00 H new ATOM 0 HD3 PRO A 64 27.401 -3.837 -5.162 1.00 0.00 H new ATOM 947 N ILE A 65 23.518 -7.817 -4.224 1.00 0.00 N ATOM 948 CA ILE A 65 22.249 -8.140 -3.541 1.00 0.00 C ATOM 949 C ILE A 65 22.383 -8.474 -2.044 1.00 0.00 C ATOM 950 O ILE A 65 21.514 -8.115 -1.252 1.00 0.00 O ATOM 951 CB ILE A 65 21.500 -9.241 -4.329 1.00 0.00 C ATOM 952 CG1 ILE A 65 20.013 -9.259 -3.920 1.00 0.00 C ATOM 953 CG2 ILE A 65 22.160 -10.628 -4.192 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.166 -10.204 -4.772 1.00 0.00 C ATOM 0 H ILE A 65 23.727 -8.423 -5.017 1.00 0.00 H new ATOM 0 HA ILE A 65 21.654 -7.227 -3.542 1.00 0.00 H new ATOM 0 HB ILE A 65 21.564 -8.996 -5.389 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.934 -9.554 -2.874 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.609 -8.250 -3.998 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.591 -11.360 -4.766 1.00 0.00 H new ATOM 0 HG22 ILE A 65 23.181 -10.584 -4.571 1.00 0.00 H new ATOM 0 HG23 ILE A 65 22.175 -10.922 -3.142 1.00 0.00 H new ATOM 0 HD11 ILE A 65 18.131 -10.170 -4.433 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.216 -9.896 -5.816 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.546 -11.221 -4.675 1.00 0.00 H new ATOM 966 N GLU A 66 23.506 -9.064 -1.622 1.00 0.00 N ATOM 967 CA GLU A 66 23.747 -9.418 -0.213 1.00 0.00 C ATOM 968 C GLU A 66 23.970 -8.195 0.704 1.00 0.00 C ATOM 969 O GLU A 66 23.929 -8.334 1.929 1.00 0.00 O ATOM 970 CB GLU A 66 24.920 -10.409 -0.107 1.00 0.00 C ATOM 971 CG GLU A 66 24.643 -11.731 -0.833 1.00 0.00 C ATOM 972 CD GLU A 66 25.776 -12.743 -0.578 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.793 -12.726 -1.315 1.00 0.00 O ATOM 974 OE2 GLU A 66 25.662 -13.569 0.362 1.00 0.00 O ATOM 0 H GLU A 66 24.275 -9.311 -2.245 1.00 0.00 H new ATOM 0 HA GLU A 66 22.836 -9.894 0.148 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.817 -9.951 -0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 66 25.125 -10.612 0.944 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.695 -12.146 -0.492 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.545 -11.550 -1.903 1.00 0.00 H new ATOM 981 N ASN A 67 24.154 -6.986 0.145 1.00 0.00 N ATOM 982 CA ASN A 67 24.184 -5.742 0.930 1.00 0.00 C ATOM 983 C ASN A 67 22.773 -5.287 1.381 1.00 0.00 C ATOM 984 O ASN A 67 22.657 -4.510 2.332 1.00 0.00 O ATOM 985 CB ASN A 67 24.953 -4.642 0.158 1.00 0.00 C ATOM 986 CG ASN A 67 24.050 -3.573 -0.446 1.00 0.00 C ATOM 987 OD1 ASN A 67 23.900 -2.477 0.073 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.390 -3.869 -1.534 1.00 0.00 N ATOM 0 H ASN A 67 24.285 -6.845 -0.857 1.00 0.00 H new ATOM 0 HA ASN A 67 24.726 -5.940 1.855 1.00 0.00 H new ATOM 0 HB2 ASN A 67 25.664 -4.166 0.833 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.533 -5.108 -0.639 1.00 0.00 H new ATOM 0 HD21 ASN A 67 22.753 -3.187 -1.946 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.511 -4.782 -1.972 1.00 0.00 H new ATOM 995 N PHE A 68 21.712 -5.751 0.707 1.00 0.00 N ATOM 996 CA PHE A 68 20.323 -5.343 0.948 1.00 0.00 C ATOM 997 C PHE A 68 19.566 -6.315 1.876 1.00 0.00 C ATOM 998 O PHE A 68 20.007 -7.434 2.142 1.00 0.00 O ATOM 999 CB PHE A 68 19.594 -5.180 -0.401 1.00 0.00 C ATOM 1000 CG PHE A 68 20.147 -4.129 -1.347 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.308 -2.793 -0.925 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.460 -4.477 -2.675 1.00 0.00 C ATOM 1003 CE1 PHE A 68 20.785 -1.821 -1.820 1.00 0.00 C ATOM 1004 CE2 PHE A 68 20.941 -3.504 -3.567 1.00 0.00 C ATOM 1005 CZ PHE A 68 21.095 -2.178 -3.142 1.00 0.00 C ATOM 0 H PHE A 68 21.799 -6.439 -0.041 1.00 0.00 H new ATOM 0 HA PHE A 68 20.343 -4.386 1.470 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.607 -6.142 -0.914 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.550 -4.941 -0.198 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.064 -2.516 0.090 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.330 -5.496 -3.009 1.00 0.00 H new ATOM 0 HE1 PHE A 68 20.913 -0.800 -1.492 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.192 -3.778 -4.581 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.453 -1.429 -3.833 1.00 0.00 H new ATOM 1015 N ASN A 69 18.391 -5.874 2.343 1.00 0.00 N ATOM 1016 CA ASN A 69 17.441 -6.647 3.155 1.00 0.00 C ATOM 1017 C ASN A 69 16.110 -6.823 2.400 1.00 0.00 C ATOM 1018 O ASN A 69 15.372 -5.856 2.212 1.00 0.00 O ATOM 1019 CB ASN A 69 17.269 -5.965 4.534 1.00 0.00 C ATOM 1020 CG ASN A 69 17.255 -4.437 4.527 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.014 -3.788 5.233 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.420 -3.804 3.731 1.00 0.00 N ATOM 0 H ASN A 69 18.061 -4.927 2.157 1.00 0.00 H new ATOM 0 HA ASN A 69 17.828 -7.650 3.334 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.337 -6.315 4.977 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.077 -6.298 5.186 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.411 -2.784 3.708 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.782 -4.333 3.137 1.00 0.00 H new ATOM 1029 N ALA A 70 15.768 -8.041 1.990 1.00 0.00 N ATOM 1030 CA ALA A 70 14.649 -8.314 1.085 1.00 0.00 C ATOM 1031 C ALA A 70 13.255 -8.025 1.672 1.00 0.00 C ATOM 1032 O ALA A 70 12.284 -7.876 0.929 1.00 0.00 O ATOM 1033 CB ALA A 70 14.760 -9.776 0.682 1.00 0.00 C ATOM 0 H ALA A 70 16.267 -8.882 2.280 1.00 0.00 H new ATOM 0 HA ALA A 70 14.728 -7.635 0.236 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.945 -10.030 0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.713 -9.944 0.181 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.702 -10.404 1.571 1.00 0.00 H new ATOM 1039 N ASP A 71 13.153 -7.915 2.997 1.00 0.00 N ATOM 1040 CA ASP A 71 11.894 -7.640 3.710 1.00 0.00 C ATOM 1041 C ASP A 71 11.317 -6.253 3.372 1.00 0.00 C ATOM 1042 O ASP A 71 10.108 -6.026 3.444 1.00 0.00 O ATOM 1043 CB ASP A 71 12.180 -7.700 5.213 1.00 0.00 C ATOM 1044 CG ASP A 71 10.895 -7.613 6.054 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.072 -8.559 5.999 1.00 0.00 O ATOM 1046 OD2 ASP A 71 10.724 -6.621 6.803 1.00 0.00 O ATOM 0 H ASP A 71 13.954 -8.015 3.620 1.00 0.00 H new ATOM 0 HA ASP A 71 11.159 -8.384 3.404 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.702 -8.629 5.445 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.847 -6.883 5.487 1.00 0.00 H new ATOM 1051 N ASP A 72 12.198 -5.330 2.980 1.00 0.00 N ATOM 1052 CA ASP A 72 11.891 -3.943 2.637 1.00 0.00 C ATOM 1053 C ASP A 72 11.564 -3.773 1.140 1.00 0.00 C ATOM 1054 O ASP A 72 11.243 -2.670 0.701 1.00 0.00 O ATOM 1055 CB ASP A 72 13.083 -3.088 3.084 1.00 0.00 C ATOM 1056 CG ASP A 72 12.785 -1.578 3.067 1.00 0.00 C ATOM 1057 OD1 ASP A 72 11.850 -1.131 3.776 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.516 -0.822 2.381 1.00 0.00 O ATOM 0 H ASP A 72 13.192 -5.541 2.889 1.00 0.00 H new ATOM 0 HA ASP A 72 10.989 -3.616 3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.376 -3.383 4.092 1.00 0.00 H new ATOM 0 HB3 ASP A 72 13.933 -3.292 2.432 1.00 0.00 H new ATOM 1063 N TYR A 73 11.627 -4.868 0.368 1.00 0.00 N ATOM 1064 CA TYR A 73 11.279 -4.962 -1.045 1.00 0.00 C ATOM 1065 C TYR A 73 10.124 -5.946 -1.184 1.00 0.00 C ATOM 1066 O TYR A 73 10.309 -7.122 -1.490 1.00 0.00 O ATOM 1067 CB TYR A 73 12.506 -5.358 -1.874 1.00 0.00 C ATOM 1068 CG TYR A 73 13.661 -4.398 -1.692 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.795 -3.274 -2.524 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.548 -4.584 -0.619 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.823 -2.346 -2.281 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.565 -3.652 -0.358 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.707 -2.519 -1.192 1.00 0.00 C ATOM 1074 OH TYR A 73 16.683 -1.597 -0.961 1.00 0.00 O ATOM 0 H TYR A 73 11.942 -5.763 0.743 1.00 0.00 H new ATOM 0 HA TYR A 73 10.956 -3.996 -1.433 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.824 -6.362 -1.591 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.232 -5.396 -2.928 1.00 0.00 H new ATOM 0 HD1 TYR A 73 13.112 -3.123 -3.347 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.447 -5.454 0.013 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.938 -1.493 -2.933 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.236 -3.800 0.476 1.00 0.00 H new ATOM 0 HH TYR A 73 17.204 -1.862 -0.175 1.00 0.00 H new ATOM 1084 N ASP A 74 8.918 -5.459 -0.902 1.00 0.00 N ATOM 1085 CA ASP A 74 7.661 -6.218 -0.896 1.00 0.00 C ATOM 1086 C ASP A 74 7.399 -6.967 -2.215 1.00 0.00 C ATOM 1087 O ASP A 74 6.665 -7.955 -2.240 1.00 0.00 O ATOM 1088 CB ASP A 74 6.490 -5.248 -0.661 1.00 0.00 C ATOM 1089 CG ASP A 74 6.785 -4.190 0.413 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.514 -3.225 0.077 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.287 -4.322 1.558 1.00 0.00 O ATOM 0 H ASP A 74 8.780 -4.478 -0.659 1.00 0.00 H new ATOM 0 HA ASP A 74 7.745 -6.959 -0.101 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.248 -4.747 -1.598 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.608 -5.818 -0.368 1.00 0.00 H new ATOM 1096 N VAL A 75 7.986 -6.485 -3.316 1.00 0.00 N ATOM 1097 CA VAL A 75 7.815 -7.003 -4.673 1.00 0.00 C ATOM 1098 C VAL A 75 9.193 -7.116 -5.342 1.00 0.00 C ATOM 1099 O VAL A 75 9.983 -6.174 -5.297 1.00 0.00 O ATOM 1100 CB VAL A 75 6.826 -6.090 -5.430 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.692 -6.496 -6.902 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.432 -6.122 -4.787 1.00 0.00 C ATOM 0 H VAL A 75 8.621 -5.688 -3.281 1.00 0.00 H new ATOM 0 HA VAL A 75 7.386 -8.005 -4.675 1.00 0.00 H new ATOM 0 HB VAL A 75 7.234 -5.081 -5.371 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.988 -5.830 -7.400 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.665 -6.426 -7.389 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.328 -7.522 -6.965 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.760 -5.469 -5.343 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.046 -7.141 -4.806 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.499 -5.778 -3.755 1.00 0.00 H new ATOM 1112 N VAL A 76 9.515 -8.265 -5.949 1.00 0.00 N ATOM 1113 CA VAL A 76 10.857 -8.541 -6.512 1.00 0.00 C ATOM 1114 C VAL A 76 10.745 -9.159 -7.911 1.00 0.00 C ATOM 1115 O VAL A 76 10.114 -10.199 -8.085 1.00 0.00 O ATOM 1116 CB VAL A 76 11.687 -9.436 -5.562 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.040 -9.829 -6.171 1.00 0.00 C ATOM 1118 CG2 VAL A 76 11.994 -8.755 -4.217 1.00 0.00 C ATOM 0 H VAL A 76 8.857 -9.035 -6.067 1.00 0.00 H new ATOM 0 HA VAL A 76 11.385 -7.592 -6.610 1.00 0.00 H new ATOM 0 HB VAL A 76 11.062 -10.315 -5.405 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.587 -10.457 -5.468 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.876 -10.380 -7.097 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.619 -8.930 -6.381 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.578 -9.430 -3.592 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.561 -7.841 -4.393 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.060 -8.510 -3.711 1.00 0.00 H new ATOM 1128 N ILE A 77 11.358 -8.521 -8.912 1.00 0.00 N ATOM 1129 CA ILE A 77 11.350 -8.931 -10.327 1.00 0.00 C ATOM 1130 C ILE A 77 12.775 -9.318 -10.740 1.00 0.00 C ATOM 1131 O ILE A 77 13.686 -8.494 -10.670 1.00 0.00 O ATOM 1132 CB ILE A 77 10.810 -7.792 -11.237 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.280 -7.522 -11.241 1.00 0.00 C ATOM 1134 CG2 ILE A 77 11.191 -8.020 -12.715 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.527 -7.797 -9.942 1.00 0.00 C ATOM 0 H ILE A 77 11.897 -7.669 -8.757 1.00 0.00 H new ATOM 0 HA ILE A 77 10.687 -9.788 -10.446 1.00 0.00 H new ATOM 0 HB ILE A 77 11.288 -6.927 -10.778 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.120 -6.478 -11.511 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.831 -8.127 -12.028 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.797 -7.205 -13.322 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.276 -8.052 -12.810 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.769 -8.965 -13.058 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.470 -7.568 -10.079 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.639 -8.847 -9.672 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.933 -7.172 -9.147 1.00 0.00 H new ATOM 1147 N SER A 78 12.958 -10.542 -11.224 1.00 0.00 N ATOM 1148 CA SER A 78 14.180 -11.019 -11.878 1.00 0.00 C ATOM 1149 C SER A 78 14.113 -10.738 -13.381 1.00 0.00 C ATOM 1150 O SER A 78 13.056 -10.859 -13.993 1.00 0.00 O ATOM 1151 CB SER A 78 14.374 -12.515 -11.597 1.00 0.00 C ATOM 1152 OG SER A 78 15.357 -13.065 -12.457 1.00 0.00 O ATOM 0 H SER A 78 12.234 -11.259 -11.172 1.00 0.00 H new ATOM 0 HA SER A 78 15.040 -10.485 -11.474 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.671 -12.659 -10.558 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.429 -13.041 -11.734 1.00 0.00 H new ATOM 0 HG SER A 78 14.980 -13.832 -12.936 1.00 0.00 H new ATOM 1158 N LEU A 79 15.249 -10.410 -14.002 1.00 0.00 N ATOM 1159 CA LEU A 79 15.404 -10.312 -15.464 1.00 0.00 C ATOM 1160 C LEU A 79 16.417 -11.336 -16.000 1.00 0.00 C ATOM 1161 O LEU A 79 17.093 -11.095 -17.000 1.00 0.00 O ATOM 1162 CB LEU A 79 15.717 -8.859 -15.873 1.00 0.00 C ATOM 1163 CG LEU A 79 14.605 -7.858 -15.496 1.00 0.00 C ATOM 1164 CD1 LEU A 79 14.919 -7.135 -14.185 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.467 -6.788 -16.576 1.00 0.00 C ATOM 0 H LEU A 79 16.109 -10.200 -13.495 1.00 0.00 H new ATOM 0 HA LEU A 79 14.458 -10.574 -15.937 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.649 -8.550 -15.399 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.879 -8.820 -16.950 1.00 0.00 H new ATOM 0 HG LEU A 79 13.686 -8.435 -15.392 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.114 -6.438 -13.952 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.012 -7.864 -13.380 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.855 -6.586 -14.287 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.679 -6.089 -16.297 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.410 -6.250 -16.678 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.214 -7.260 -17.525 1.00 0.00 H new ATOM 1177 N CYS A 80 16.573 -12.457 -15.295 1.00 0.00 N ATOM 1178 CA CYS A 80 17.631 -13.445 -15.522 1.00 0.00 C ATOM 1179 C CYS A 80 17.240 -14.592 -16.473 1.00 0.00 C ATOM 1180 O CYS A 80 18.127 -15.303 -16.949 1.00 0.00 O ATOM 1181 CB CYS A 80 18.062 -13.998 -14.155 1.00 0.00 C ATOM 1182 SG CYS A 80 18.533 -12.636 -13.046 1.00 0.00 S ATOM 0 H CYS A 80 15.950 -12.711 -14.528 1.00 0.00 H new ATOM 0 HA CYS A 80 18.452 -12.937 -16.027 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.247 -14.571 -13.713 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.902 -14.682 -14.280 1.00 0.00 H new ATOM 0 HG CYS A 80 17.488 -12.234 -12.385 1.00 0.00 H new ATOM 1188 N GLY A 81 15.943 -14.793 -16.737 1.00 0.00 N ATOM 1189 CA GLY A 81 15.444 -15.956 -17.479 1.00 0.00 C ATOM 1190 C GLY A 81 15.549 -17.268 -16.684 1.00 0.00 C ATOM 1191 O GLY A 81 15.944 -18.295 -17.240 1.00 0.00 O ATOM 0 H GLY A 81 15.208 -14.151 -16.441 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.403 -15.786 -17.752 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.005 -16.055 -18.408 1.00 0.00 H new ATOM 1195 N CYS A 82 15.211 -17.220 -15.390 1.00 0.00 N ATOM 1196 CA CYS A 82 15.358 -18.285 -14.396 1.00 0.00 C ATOM 1197 C CYS A 82 16.828 -18.719 -14.166 1.00 0.00 C ATOM 1198 O CYS A 82 17.769 -18.152 -14.726 1.00 0.00 O ATOM 1199 CB CYS A 82 14.378 -19.425 -14.744 1.00 0.00 C ATOM 1200 SG CYS A 82 13.949 -20.386 -13.258 1.00 0.00 S ATOM 0 H CYS A 82 14.800 -16.379 -14.984 1.00 0.00 H new ATOM 0 HA CYS A 82 15.081 -17.906 -13.412 1.00 0.00 H new ATOM 0 HB2 CYS A 82 13.473 -19.010 -15.188 1.00 0.00 H new ATOM 0 HB3 CYS A 82 14.827 -20.081 -15.490 1.00 0.00 H new ATOM 0 HG CYS A 82 13.122 -21.336 -13.579 1.00 0.00 H new ATOM 1206 N GLY A 83 17.037 -19.683 -13.263 1.00 0.00 N ATOM 1207 CA GLY A 83 18.368 -20.173 -12.864 1.00 0.00 C ATOM 1208 C GLY A 83 19.208 -19.145 -12.087 1.00 0.00 C ATOM 1209 O GLY A 83 20.439 -19.199 -12.118 1.00 0.00 O ATOM 0 H GLY A 83 16.274 -20.156 -12.778 1.00 0.00 H new ATOM 0 HA2 GLY A 83 18.246 -21.065 -12.250 1.00 0.00 H new ATOM 0 HA3 GLY A 83 18.916 -20.473 -13.757 1.00 0.00 H new ATOM 1213 N VAL A 84 18.553 -18.178 -11.428 1.00 0.00 N ATOM 1214 CA VAL A 84 19.190 -17.065 -10.703 1.00 0.00 C ATOM 1215 C VAL A 84 19.517 -17.463 -9.254 1.00 0.00 C ATOM 1216 O VAL A 84 18.664 -17.962 -8.520 1.00 0.00 O ATOM 1217 CB VAL A 84 18.340 -15.778 -10.832 1.00 0.00 C ATOM 1218 CG1 VAL A 84 16.937 -15.868 -10.218 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.069 -14.552 -10.277 1.00 0.00 C ATOM 0 H VAL A 84 17.535 -18.146 -11.383 1.00 0.00 H new ATOM 0 HA VAL A 84 20.152 -16.836 -11.162 1.00 0.00 H new ATOM 0 HB VAL A 84 18.199 -15.665 -11.907 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.417 -14.920 -10.357 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.376 -16.664 -10.707 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.019 -16.084 -9.153 1.00 0.00 H new ATOM 0 HG21 VAL A 84 18.436 -13.671 -10.388 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.292 -14.708 -9.222 1.00 0.00 H new ATOM 0 HG23 VAL A 84 19.999 -14.402 -10.826 1.00 0.00 H new ATOM 1229 N ASN A 85 20.762 -17.220 -8.825 1.00 0.00 N ATOM 1230 CA ASN A 85 21.285 -17.619 -7.507 1.00 0.00 C ATOM 1231 C ASN A 85 20.923 -16.594 -6.408 1.00 0.00 C ATOM 1232 O ASN A 85 21.792 -16.013 -5.755 1.00 0.00 O ATOM 1233 CB ASN A 85 22.797 -17.916 -7.622 1.00 0.00 C ATOM 1234 CG ASN A 85 23.140 -19.147 -8.452 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.304 -19.972 -8.796 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.399 -19.325 -8.785 1.00 0.00 N ATOM 0 H ASN A 85 21.451 -16.730 -9.395 1.00 0.00 H new ATOM 0 HA ASN A 85 20.801 -18.541 -7.186 1.00 0.00 H new ATOM 0 HB2 ASN A 85 23.292 -17.049 -8.060 1.00 0.00 H new ATOM 0 HB3 ASN A 85 23.206 -18.044 -6.620 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.672 -20.145 -9.326 1.00 0.00 H new ATOM 0 HD22 ASN A 85 25.103 -18.643 -8.503 1.00 0.00 H new ATOM 1243 N LEU A 86 19.623 -16.343 -6.226 1.00 0.00 N ATOM 1244 CA LEU A 86 19.095 -15.449 -5.187 1.00 0.00 C ATOM 1245 C LEU A 86 19.153 -16.081 -3.778 1.00 0.00 C ATOM 1246 O LEU A 86 18.819 -17.264 -3.639 1.00 0.00 O ATOM 1247 CB LEU A 86 17.626 -15.091 -5.505 1.00 0.00 C ATOM 1248 CG LEU A 86 17.398 -14.170 -6.711 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.900 -14.010 -6.967 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.972 -12.773 -6.495 1.00 0.00 C ATOM 0 H LEU A 86 18.895 -16.761 -6.805 1.00 0.00 H new ATOM 0 HA LEU A 86 19.723 -14.558 -5.185 1.00 0.00 H new ATOM 0 HB2 LEU A 86 17.076 -16.017 -5.673 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.191 -14.617 -4.625 1.00 0.00 H new ATOM 0 HG LEU A 86 17.904 -14.637 -7.556 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.745 -13.355 -7.824 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.460 -14.986 -7.172 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.425 -13.575 -6.088 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.784 -12.162 -7.378 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.497 -12.314 -5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 86 19.046 -12.843 -6.325 1.00 0.00 H new ATOM 1262 N PRO A 87 19.501 -15.309 -2.724 1.00 0.00 N ATOM 1263 CA PRO A 87 19.345 -15.763 -1.340 1.00 0.00 C ATOM 1264 C PRO A 87 17.848 -16.001 -1.033 1.00 0.00 C ATOM 1265 O PRO A 87 16.997 -15.317 -1.612 1.00 0.00 O ATOM 1266 CB PRO A 87 19.989 -14.683 -0.457 1.00 0.00 C ATOM 1267 CG PRO A 87 20.909 -13.917 -1.413 1.00 0.00 C ATOM 1268 CD PRO A 87 20.206 -14.035 -2.765 1.00 0.00 C ATOM 0 HA PRO A 87 19.836 -16.717 -1.149 1.00 0.00 H new ATOM 0 HB2 PRO A 87 19.237 -14.028 -0.017 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.549 -15.124 0.367 1.00 0.00 H new ATOM 0 HG2 PRO A 87 21.023 -12.876 -1.111 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.908 -14.352 -1.442 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.514 -13.208 -2.921 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.924 -14.009 -3.585 1.00 0.00 H new ATOM 1276 N PRO A 88 17.485 -16.912 -0.111 1.00 0.00 N ATOM 1277 CA PRO A 88 16.093 -17.357 0.076 1.00 0.00 C ATOM 1278 C PRO A 88 15.104 -16.266 0.518 1.00 0.00 C ATOM 1279 O PRO A 88 13.904 -16.390 0.273 1.00 0.00 O ATOM 1280 CB PRO A 88 16.174 -18.516 1.079 1.00 0.00 C ATOM 1281 CG PRO A 88 17.473 -18.254 1.841 1.00 0.00 C ATOM 1282 CD PRO A 88 18.377 -17.656 0.768 1.00 0.00 C ATOM 0 HA PRO A 88 15.675 -17.660 -0.884 1.00 0.00 H new ATOM 0 HB2 PRO A 88 15.314 -18.526 1.748 1.00 0.00 H new ATOM 0 HB3 PRO A 88 16.196 -19.481 0.573 1.00 0.00 H new ATOM 0 HG2 PRO A 88 17.323 -17.566 2.673 1.00 0.00 H new ATOM 0 HG3 PRO A 88 17.890 -19.171 2.257 1.00 0.00 H new ATOM 0 HD2 PRO A 88 19.131 -17.003 1.207 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.909 -18.435 0.222 1.00 0.00 H new ATOM 1290 N GLU A 89 15.579 -15.163 1.103 1.00 0.00 N ATOM 1291 CA GLU A 89 14.721 -14.020 1.455 1.00 0.00 C ATOM 1292 C GLU A 89 14.235 -13.190 0.246 1.00 0.00 C ATOM 1293 O GLU A 89 13.290 -12.416 0.389 1.00 0.00 O ATOM 1294 CB GLU A 89 15.396 -13.161 2.531 1.00 0.00 C ATOM 1295 CG GLU A 89 16.741 -12.552 2.116 1.00 0.00 C ATOM 1296 CD GLU A 89 17.274 -11.600 3.207 1.00 0.00 C ATOM 1297 OE1 GLU A 89 17.907 -12.087 4.176 1.00 0.00 O ATOM 1298 OE2 GLU A 89 17.064 -10.366 3.108 1.00 0.00 O ATOM 0 H GLU A 89 16.561 -15.034 1.346 1.00 0.00 H new ATOM 0 HA GLU A 89 13.803 -14.436 1.870 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.718 -12.354 2.810 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.548 -13.772 3.421 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.465 -13.347 1.936 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.625 -12.008 1.178 1.00 0.00 H new ATOM 1305 N TRP A 90 14.807 -13.371 -0.953 1.00 0.00 N ATOM 1306 CA TRP A 90 14.426 -12.636 -2.178 1.00 0.00 C ATOM 1307 C TRP A 90 13.343 -13.323 -3.030 1.00 0.00 C ATOM 1308 O TRP A 90 12.950 -12.791 -4.068 1.00 0.00 O ATOM 1309 CB TRP A 90 15.684 -12.326 -2.999 1.00 0.00 C ATOM 1310 CG TRP A 90 16.608 -11.371 -2.324 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.643 -11.705 -1.522 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.515 -9.919 -2.271 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.197 -10.563 -0.977 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.500 -9.439 -1.363 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.648 -8.968 -2.849 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.567 -8.096 -0.977 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.725 -7.608 -2.491 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.663 -7.176 -1.535 1.00 0.00 C ATOM 0 H TRP A 90 15.560 -14.042 -1.106 1.00 0.00 H new ATOM 0 HA TRP A 90 13.957 -11.708 -1.852 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.217 -13.256 -3.200 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.388 -11.914 -3.963 1.00 0.00 H new ATOM 0 HD1 TRP A 90 17.985 -12.712 -1.335 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.015 -10.553 -0.368 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.915 -9.287 -3.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.305 -7.770 -0.259 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.060 -6.893 -2.953 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.688 -6.140 -1.231 1.00 0.00 H new ATOM 1329 N VAL A 91 12.882 -14.512 -2.618 1.00 0.00 N ATOM 1330 CA VAL A 91 11.938 -15.379 -3.366 1.00 0.00 C ATOM 1331 C VAL A 91 10.670 -15.742 -2.563 1.00 0.00 C ATOM 1332 O VAL A 91 9.966 -16.699 -2.888 1.00 0.00 O ATOM 1333 CB VAL A 91 12.659 -16.638 -3.898 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.748 -16.275 -4.917 1.00 0.00 C ATOM 1335 CG2 VAL A 91 13.306 -17.448 -2.768 1.00 0.00 C ATOM 0 H VAL A 91 13.161 -14.918 -1.725 1.00 0.00 H new ATOM 0 HA VAL A 91 11.586 -14.796 -4.217 1.00 0.00 H new ATOM 0 HB VAL A 91 11.891 -17.242 -4.380 1.00 0.00 H new ATOM 0 HG11 VAL A 91 14.234 -17.185 -5.270 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.297 -15.754 -5.761 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.487 -15.628 -4.444 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.802 -18.324 -3.186 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.039 -16.829 -2.250 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.538 -17.767 -2.063 1.00 0.00 H new ATOM 1345 N THR A 92 10.384 -14.988 -1.493 1.00 0.00 N ATOM 1346 CA THR A 92 9.347 -15.277 -0.472 1.00 0.00 C ATOM 1347 C THR A 92 8.334 -14.118 -0.292 1.00 0.00 C ATOM 1348 O THR A 92 7.396 -14.186 0.503 1.00 0.00 O ATOM 1349 CB THR A 92 10.049 -15.718 0.835 1.00 0.00 C ATOM 1350 OG1 THR A 92 9.149 -16.130 1.848 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.962 -14.635 1.406 1.00 0.00 C ATOM 0 H THR A 92 10.886 -14.121 -1.300 1.00 0.00 H new ATOM 0 HA THR A 92 8.721 -16.102 -0.814 1.00 0.00 H new ATOM 0 HB THR A 92 10.649 -16.577 0.536 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.261 -15.757 1.668 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.428 -14.998 2.322 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.735 -14.390 0.678 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.375 -13.743 1.626 1.00 0.00 H new ATOM 1359 N GLN A 93 8.504 -13.055 -1.079 1.00 0.00 N ATOM 1360 CA GLN A 93 7.673 -11.855 -1.191 1.00 0.00 C ATOM 1361 C GLN A 93 6.215 -12.139 -1.594 1.00 0.00 C ATOM 1362 O GLN A 93 5.899 -13.197 -2.146 1.00 0.00 O ATOM 1363 CB GLN A 93 8.324 -10.942 -2.249 1.00 0.00 C ATOM 1364 CG GLN A 93 9.479 -10.091 -1.701 1.00 0.00 C ATOM 1365 CD GLN A 93 10.745 -10.862 -1.325 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.967 -11.999 -1.717 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.630 -10.295 -0.538 1.00 0.00 N ATOM 0 H GLN A 93 9.301 -13.008 -1.713 1.00 0.00 H new ATOM 0 HA GLN A 93 7.625 -11.390 -0.207 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.695 -11.557 -3.069 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.563 -10.282 -2.665 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.740 -9.341 -2.447 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.126 -9.555 -0.820 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.474 -9.347 -0.194 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.474 -10.802 -0.270 1.00 0.00 H new ATOM 1376 N GLU A 94 5.329 -11.154 -1.384 1.00 0.00 N ATOM 1377 CA GLU A 94 3.918 -11.264 -1.790 1.00 0.00 C ATOM 1378 C GLU A 94 3.745 -11.367 -3.315 1.00 0.00 C ATOM 1379 O GLU A 94 2.876 -12.114 -3.775 1.00 0.00 O ATOM 1380 CB GLU A 94 3.063 -10.129 -1.201 1.00 0.00 C ATOM 1381 CG GLU A 94 3.480 -8.695 -1.561 1.00 0.00 C ATOM 1382 CD GLU A 94 2.434 -7.690 -1.035 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.518 -7.278 0.148 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.508 -7.318 -1.796 1.00 0.00 O ATOM 0 H GLU A 94 5.565 -10.269 -0.934 1.00 0.00 H new ATOM 0 HA GLU A 94 3.553 -12.202 -1.371 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.033 -10.276 -1.525 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.072 -10.224 -0.115 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.457 -8.473 -1.131 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.578 -8.597 -2.642 1.00 0.00 H new ATOM 1391 N ILE A 95 4.586 -10.672 -4.097 1.00 0.00 N ATOM 1392 CA ILE A 95 4.631 -10.788 -5.564 1.00 0.00 C ATOM 1393 C ILE A 95 6.085 -10.942 -6.034 1.00 0.00 C ATOM 1394 O ILE A 95 6.944 -10.107 -5.740 1.00 0.00 O ATOM 1395 CB ILE A 95 3.901 -9.596 -6.238 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.429 -9.512 -5.757 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.967 -9.707 -7.774 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.668 -8.269 -6.215 1.00 0.00 C ATOM 0 H ILE A 95 5.262 -10.006 -3.724 1.00 0.00 H new ATOM 0 HA ILE A 95 4.095 -11.686 -5.872 1.00 0.00 H new ATOM 0 HB ILE A 95 4.410 -8.678 -5.944 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.897 -10.395 -6.110 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.416 -9.546 -4.668 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.448 -8.860 -8.223 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.009 -9.706 -8.094 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.491 -10.634 -8.093 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.650 -8.303 -5.828 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.169 -7.377 -5.840 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.641 -8.239 -7.304 1.00 0.00 H new ATOM 1410 N PHE A 96 6.343 -11.998 -6.806 1.00 0.00 N ATOM 1411 CA PHE A 96 7.623 -12.272 -7.464 1.00 0.00 C ATOM 1412 C PHE A 96 7.425 -12.475 -8.977 1.00 0.00 C ATOM 1413 O PHE A 96 6.401 -13.014 -9.407 1.00 0.00 O ATOM 1414 CB PHE A 96 8.296 -13.489 -6.810 1.00 0.00 C ATOM 1415 CG PHE A 96 9.694 -13.785 -7.334 1.00 0.00 C ATOM 1416 CD1 PHE A 96 9.879 -14.627 -8.450 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.816 -13.206 -6.712 1.00 0.00 C ATOM 1418 CE1 PHE A 96 11.172 -14.877 -8.944 1.00 0.00 C ATOM 1419 CE2 PHE A 96 12.108 -13.452 -7.210 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.289 -14.285 -8.325 1.00 0.00 C ATOM 0 H PHE A 96 5.641 -12.713 -6.998 1.00 0.00 H new ATOM 0 HA PHE A 96 8.281 -11.413 -7.338 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.351 -13.325 -5.734 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.668 -14.366 -6.967 1.00 0.00 H new ATOM 0 HD1 PHE A 96 9.024 -15.082 -8.928 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.684 -12.570 -5.849 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.308 -15.523 -9.798 1.00 0.00 H new ATOM 0 HE2 PHE A 96 12.964 -12.998 -6.733 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.282 -14.471 -8.707 1.00 0.00 H new ATOM 1430 N GLU A 97 8.410 -12.077 -9.783 1.00 0.00 N ATOM 1431 CA GLU A 97 8.436 -12.301 -11.235 1.00 0.00 C ATOM 1432 C GLU A 97 9.830 -12.695 -11.744 1.00 0.00 C ATOM 1433 O GLU A 97 10.843 -12.357 -11.138 1.00 0.00 O ATOM 1434 CB GLU A 97 8.055 -11.021 -12.000 1.00 0.00 C ATOM 1435 CG GLU A 97 6.665 -10.420 -11.753 1.00 0.00 C ATOM 1436 CD GLU A 97 5.501 -11.345 -12.165 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.694 -12.281 -12.977 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.355 -11.080 -11.727 1.00 0.00 O ATOM 0 H GLU A 97 9.231 -11.579 -9.440 1.00 0.00 H new ATOM 0 HA GLU A 97 7.724 -13.107 -11.412 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.796 -10.257 -11.763 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.143 -11.230 -13.066 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.567 -10.179 -10.694 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.583 -9.482 -12.302 1.00 0.00 H new ATOM 1445 N ASP A 98 9.873 -13.347 -12.905 1.00 0.00 N ATOM 1446 CA ASP A 98 11.091 -13.590 -13.682 1.00 0.00 C ATOM 1447 C ASP A 98 10.785 -13.301 -15.157 1.00 0.00 C ATOM 1448 O ASP A 98 9.809 -13.825 -15.706 1.00 0.00 O ATOM 1449 CB ASP A 98 11.667 -14.998 -13.482 1.00 0.00 C ATOM 1450 CG ASP A 98 12.917 -15.190 -14.357 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.039 -14.868 -13.896 1.00 0.00 O ATOM 1452 OD2 ASP A 98 12.781 -15.638 -15.519 1.00 0.00 O ATOM 0 H ASP A 98 9.038 -13.733 -13.345 1.00 0.00 H new ATOM 0 HA ASP A 98 11.872 -12.919 -13.324 1.00 0.00 H new ATOM 0 HB2 ASP A 98 11.922 -15.149 -12.433 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.916 -15.746 -13.738 1.00 0.00 H new ATOM 1457 N TRP A 99 11.594 -12.446 -15.783 1.00 0.00 N ATOM 1458 CA TRP A 99 11.444 -11.984 -17.163 1.00 0.00 C ATOM 1459 C TRP A 99 12.576 -12.549 -18.039 1.00 0.00 C ATOM 1460 O TRP A 99 13.752 -12.482 -17.676 1.00 0.00 O ATOM 1461 CB TRP A 99 11.364 -10.444 -17.174 1.00 0.00 C ATOM 1462 CG TRP A 99 10.239 -9.799 -16.400 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.139 -10.420 -15.901 1.00 0.00 C ATOM 1464 CD2 TRP A 99 10.069 -8.385 -16.040 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.346 -9.520 -15.221 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.864 -8.253 -15.285 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.780 -7.190 -16.303 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.399 -7.021 -14.811 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.322 -5.942 -15.831 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.128 -5.859 -15.093 1.00 0.00 C ATOM 0 H TRP A 99 12.407 -12.039 -15.322 1.00 0.00 H new ATOM 0 HA TRP A 99 10.516 -12.357 -17.596 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.305 -10.055 -16.786 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.288 -10.118 -18.212 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.917 -11.470 -16.020 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.485 -9.766 -14.733 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.693 -7.234 -16.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.488 -6.967 -14.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.890 -5.047 -16.037 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.774 -4.900 -14.744 1.00 0.00 H new ATOM 1481 N GLN A 100 12.232 -13.105 -19.206 1.00 0.00 N ATOM 1482 CA GLN A 100 13.145 -13.855 -20.093 1.00 0.00 C ATOM 1483 C GLN A 100 13.765 -12.899 -21.132 1.00 0.00 C ATOM 1484 O GLN A 100 13.491 -12.971 -22.332 1.00 0.00 O ATOM 1485 CB GLN A 100 12.422 -15.069 -20.719 1.00 0.00 C ATOM 1486 CG GLN A 100 11.944 -16.140 -19.713 1.00 0.00 C ATOM 1487 CD GLN A 100 10.749 -15.702 -18.863 1.00 0.00 C ATOM 1488 OE1 GLN A 100 9.692 -15.344 -19.365 1.00 0.00 O ATOM 1489 NE2 GLN A 100 10.867 -15.662 -17.554 1.00 0.00 N ATOM 0 H GLN A 100 11.283 -13.047 -19.576 1.00 0.00 H new ATOM 0 HA GLN A 100 13.971 -14.268 -19.515 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.559 -14.709 -21.279 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.093 -15.541 -21.436 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.677 -17.044 -20.260 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.772 -16.399 -19.053 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.738 -15.955 -17.111 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.088 -15.338 -16.981 1.00 0.00 H new ATOM 1498 N LEU A 101 14.550 -11.941 -20.632 1.00 0.00 N ATOM 1499 CA LEU A 101 15.076 -10.791 -21.379 1.00 0.00 C ATOM 1500 C LEU A 101 16.491 -11.005 -21.947 1.00 0.00 C ATOM 1501 O LEU A 101 17.351 -11.612 -21.308 1.00 0.00 O ATOM 1502 CB LEU A 101 15.004 -9.560 -20.439 1.00 0.00 C ATOM 1503 CG LEU A 101 13.827 -8.586 -20.641 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.174 -7.555 -21.706 1.00 0.00 C ATOM 1505 CD2 LEU A 101 12.506 -9.250 -21.028 1.00 0.00 C ATOM 0 H LEU A 101 14.850 -11.944 -19.657 1.00 0.00 H new ATOM 0 HA LEU A 101 14.463 -10.638 -22.267 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.970 -9.922 -19.411 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.931 -8.997 -20.549 1.00 0.00 H new ATOM 0 HG LEU A 101 13.676 -8.124 -19.665 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.334 -6.873 -21.839 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.053 -6.991 -21.394 1.00 0.00 H new ATOM 0 HD13 LEU A 101 14.383 -8.061 -22.648 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.737 -8.487 -21.148 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.631 -9.790 -21.966 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.206 -9.947 -20.245 1.00 0.00 H new ATOM 1517 N GLU A 102 16.734 -10.436 -23.131 1.00 0.00 N ATOM 1518 CA GLU A 102 18.052 -10.319 -23.769 1.00 0.00 C ATOM 1519 C GLU A 102 18.706 -8.971 -23.437 1.00 0.00 C ATOM 1520 O GLU A 102 18.034 -8.016 -23.043 1.00 0.00 O ATOM 1521 CB GLU A 102 17.944 -10.542 -25.290 1.00 0.00 C ATOM 1522 CG GLU A 102 17.154 -9.459 -26.040 1.00 0.00 C ATOM 1523 CD GLU A 102 16.922 -9.862 -27.506 1.00 0.00 C ATOM 1524 OE1 GLU A 102 17.877 -9.822 -28.319 1.00 0.00 O ATOM 1525 OE2 GLU A 102 15.773 -10.225 -27.861 1.00 0.00 O ATOM 0 H GLU A 102 15.989 -10.027 -23.695 1.00 0.00 H new ATOM 0 HA GLU A 102 18.698 -11.100 -23.368 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.949 -10.596 -25.708 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.472 -11.508 -25.470 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.195 -9.297 -25.548 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.697 -8.515 -26.000 1.00 0.00 H new ATOM 1532 N ASP A 103 20.024 -8.885 -23.598 1.00 0.00 N ATOM 1533 CA ASP A 103 20.821 -7.708 -23.237 1.00 0.00 C ATOM 1534 C ASP A 103 21.277 -6.923 -24.481 1.00 0.00 C ATOM 1535 O ASP A 103 21.885 -7.520 -25.377 1.00 0.00 O ATOM 1536 CB ASP A 103 22.015 -8.163 -22.385 1.00 0.00 C ATOM 1537 CG ASP A 103 22.445 -7.076 -21.396 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.956 -6.031 -21.851 1.00 0.00 O ATOM 1539 OD2 ASP A 103 22.222 -7.290 -20.179 1.00 0.00 O ATOM 0 H ASP A 103 20.582 -9.644 -23.990 1.00 0.00 H new ATOM 0 HA ASP A 103 20.204 -7.022 -22.656 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.750 -9.069 -21.839 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.852 -8.416 -23.036 1.00 0.00 H new ATOM 1544 N PRO A 104 21.013 -5.601 -24.572 1.00 0.00 N ATOM 1545 CA PRO A 104 21.392 -4.808 -25.738 1.00 0.00 C ATOM 1546 C PRO A 104 22.885 -4.419 -25.763 1.00 0.00 C ATOM 1547 O PRO A 104 23.348 -3.885 -26.770 1.00 0.00 O ATOM 1548 CB PRO A 104 20.472 -3.588 -25.693 1.00 0.00 C ATOM 1549 CG PRO A 104 20.284 -3.359 -24.195 1.00 0.00 C ATOM 1550 CD PRO A 104 20.239 -4.784 -23.641 1.00 0.00 C ATOM 0 HA PRO A 104 21.272 -5.382 -26.657 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.923 -2.724 -26.181 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.523 -3.778 -26.195 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.105 -2.784 -23.767 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.366 -2.812 -23.981 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.664 -4.827 -22.638 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.212 -5.142 -23.568 1.00 0.00 H new ATOM 1558 N ASP A 105 23.669 -4.697 -24.713 1.00 0.00 N ATOM 1559 CA ASP A 105 25.120 -4.479 -24.723 1.00 0.00 C ATOM 1560 C ASP A 105 25.803 -5.177 -25.919 1.00 0.00 C ATOM 1561 O ASP A 105 25.648 -6.385 -26.133 1.00 0.00 O ATOM 1562 CB ASP A 105 25.742 -4.946 -23.402 1.00 0.00 C ATOM 1563 CG ASP A 105 27.272 -4.783 -23.409 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.761 -3.658 -23.665 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.992 -5.784 -23.173 1.00 0.00 O ATOM 0 H ASP A 105 23.316 -5.078 -23.835 1.00 0.00 H new ATOM 0 HA ASP A 105 25.287 -3.408 -24.834 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.318 -4.374 -22.577 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.487 -5.992 -23.229 1.00 0.00 H new ATOM 1570 N GLY A 106 26.553 -4.399 -26.711 1.00 0.00 N ATOM 1571 CA GLY A 106 27.224 -4.859 -27.934 1.00 0.00 C ATOM 1572 C GLY A 106 26.297 -5.133 -29.134 1.00 0.00 C ATOM 1573 O GLY A 106 26.778 -5.604 -30.169 1.00 0.00 O ATOM 0 H GLY A 106 26.713 -3.411 -26.515 1.00 0.00 H new ATOM 0 HA2 GLY A 106 27.959 -4.110 -28.228 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.773 -5.772 -27.705 1.00 0.00 H new ATOM 1577 N GLN A 107 24.991 -4.859 -29.021 1.00 0.00 N ATOM 1578 CA GLN A 107 23.992 -5.084 -30.076 1.00 0.00 C ATOM 1579 C GLN A 107 23.758 -3.845 -30.962 1.00 0.00 C ATOM 1580 O GLN A 107 24.338 -2.776 -30.746 1.00 0.00 O ATOM 1581 CB GLN A 107 22.675 -5.604 -29.464 1.00 0.00 C ATOM 1582 CG GLN A 107 22.821 -6.763 -28.465 1.00 0.00 C ATOM 1583 CD GLN A 107 23.585 -7.968 -29.000 1.00 0.00 C ATOM 1584 OE1 GLN A 107 23.466 -8.374 -30.148 1.00 0.00 O ATOM 1585 NE2 GLN A 107 24.388 -8.594 -28.169 1.00 0.00 N ATOM 0 H GLN A 107 24.588 -4.464 -28.171 1.00 0.00 H new ATOM 0 HA GLN A 107 24.394 -5.848 -30.741 1.00 0.00 H new ATOM 0 HB2 GLN A 107 22.176 -4.775 -28.962 1.00 0.00 H new ATOM 0 HB3 GLN A 107 22.021 -5.926 -30.274 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.328 -6.395 -27.573 1.00 0.00 H new ATOM 0 HG3 GLN A 107 21.827 -7.087 -28.156 1.00 0.00 H new ATOM 0 HE21 GLN A 107 24.491 -8.260 -27.211 1.00 0.00 H new ATOM 0 HE22 GLN A 107 24.908 -9.414 -28.482 1.00 0.00 H new ATOM 1594 N SER A 108 22.885 -3.994 -31.966 1.00 0.00 N ATOM 1595 CA SER A 108 22.457 -2.887 -32.834 1.00 0.00 C ATOM 1596 C SER A 108 21.533 -1.934 -32.073 1.00 0.00 C ATOM 1597 O SER A 108 20.854 -2.338 -31.125 1.00 0.00 O ATOM 1598 CB SER A 108 21.786 -3.439 -34.102 1.00 0.00 C ATOM 1599 OG SER A 108 21.353 -2.374 -34.936 1.00 0.00 O ATOM 0 H SER A 108 22.454 -4.888 -32.201 1.00 0.00 H new ATOM 0 HA SER A 108 23.333 -2.315 -33.141 1.00 0.00 H new ATOM 0 HB2 SER A 108 22.487 -4.073 -34.645 1.00 0.00 H new ATOM 0 HB3 SER A 108 20.936 -4.064 -33.829 1.00 0.00 H new ATOM 0 HG SER A 108 20.929 -2.740 -35.740 1.00 0.00 H new ATOM 1605 N LEU A 109 21.440 -0.674 -32.496 1.00 0.00 N ATOM 1606 CA LEU A 109 20.582 0.319 -31.835 1.00 0.00 C ATOM 1607 C LEU A 109 19.090 0.009 -32.023 1.00 0.00 C ATOM 1608 O LEU A 109 18.271 0.354 -31.175 1.00 0.00 O ATOM 1609 CB LEU A 109 21.012 1.738 -32.241 1.00 0.00 C ATOM 1610 CG LEU A 109 22.513 2.032 -32.000 1.00 0.00 C ATOM 1611 CD1 LEU A 109 22.755 3.535 -32.083 1.00 0.00 C ATOM 1612 CD2 LEU A 109 23.046 1.530 -30.651 1.00 0.00 C ATOM 0 H LEU A 109 21.952 -0.311 -33.300 1.00 0.00 H new ATOM 0 HA LEU A 109 20.722 0.260 -30.756 1.00 0.00 H new ATOM 0 HB2 LEU A 109 20.788 1.887 -33.297 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.416 2.461 -31.684 1.00 0.00 H new ATOM 0 HG LEU A 109 23.051 1.488 -32.776 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.811 3.743 -31.913 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.468 3.896 -33.071 1.00 0.00 H new ATOM 0 HD13 LEU A 109 22.159 4.042 -31.324 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.104 1.777 -30.563 1.00 0.00 H new ATOM 0 HD22 LEU A 109 22.494 2.007 -29.841 1.00 0.00 H new ATOM 0 HD23 LEU A 109 22.919 0.449 -30.589 1.00 0.00 H new ATOM 1624 N GLU A 110 18.738 -0.768 -33.049 1.00 0.00 N ATOM 1625 CA GLU A 110 17.389 -1.328 -33.206 1.00 0.00 C ATOM 1626 C GLU A 110 17.088 -2.373 -32.115 1.00 0.00 C ATOM 1627 O GLU A 110 15.944 -2.495 -31.686 1.00 0.00 O ATOM 1628 CB GLU A 110 17.230 -1.941 -34.606 1.00 0.00 C ATOM 1629 CG GLU A 110 17.267 -0.875 -35.706 1.00 0.00 C ATOM 1630 CD GLU A 110 17.003 -1.505 -37.086 1.00 0.00 C ATOM 1631 OE1 GLU A 110 15.821 -1.591 -37.503 1.00 0.00 O ATOM 1632 OE2 GLU A 110 17.973 -1.911 -37.773 1.00 0.00 O ATOM 0 H GLU A 110 19.380 -1.029 -33.798 1.00 0.00 H new ATOM 0 HA GLU A 110 16.668 -0.518 -33.094 1.00 0.00 H new ATOM 0 HB2 GLU A 110 18.026 -2.666 -34.777 1.00 0.00 H new ATOM 0 HB3 GLU A 110 16.287 -2.484 -34.659 1.00 0.00 H new ATOM 0 HG2 GLU A 110 16.519 -0.109 -35.502 1.00 0.00 H new ATOM 0 HG3 GLU A 110 18.238 -0.380 -35.707 1.00 0.00 H new ATOM 1639 N VAL A 111 18.104 -3.062 -31.575 1.00 0.00 N ATOM 1640 CA VAL A 111 17.949 -3.983 -30.432 1.00 0.00 C ATOM 1641 C VAL A 111 17.746 -3.196 -29.142 1.00 0.00 C ATOM 1642 O VAL A 111 16.838 -3.532 -28.390 1.00 0.00 O ATOM 1643 CB VAL A 111 19.100 -5.003 -30.320 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.875 -5.976 -29.152 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.214 -5.839 -31.601 1.00 0.00 C ATOM 0 H VAL A 111 19.062 -2.998 -31.918 1.00 0.00 H new ATOM 0 HA VAL A 111 17.054 -4.579 -30.612 1.00 0.00 H new ATOM 0 HB VAL A 111 20.011 -4.428 -30.156 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.704 -6.681 -29.101 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.817 -5.416 -28.218 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.944 -6.521 -29.307 1.00 0.00 H new ATOM 0 HG21 VAL A 111 20.033 -6.552 -31.499 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.282 -6.379 -31.767 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.409 -5.182 -32.448 1.00 0.00 H new ATOM 1655 N PHE A 112 18.468 -2.091 -28.912 1.00 0.00 N ATOM 1656 CA PHE A 112 18.164 -1.170 -27.794 1.00 0.00 C ATOM 1657 C PHE A 112 16.716 -0.655 -27.877 1.00 0.00 C ATOM 1658 O PHE A 112 15.962 -0.756 -26.910 1.00 0.00 O ATOM 1659 CB PHE A 112 19.143 0.021 -27.785 1.00 0.00 C ATOM 1660 CG PHE A 112 20.518 -0.236 -27.192 1.00 0.00 C ATOM 1661 CD1 PHE A 112 21.582 -0.682 -27.999 1.00 0.00 C ATOM 1662 CD2 PHE A 112 20.748 0.003 -25.822 1.00 0.00 C ATOM 1663 CE1 PHE A 112 22.858 -0.879 -27.446 1.00 0.00 C ATOM 1664 CE2 PHE A 112 22.022 -0.210 -25.265 1.00 0.00 C ATOM 1665 CZ PHE A 112 23.079 -0.649 -26.079 1.00 0.00 C ATOM 0 H PHE A 112 19.266 -1.808 -29.481 1.00 0.00 H new ATOM 0 HA PHE A 112 18.280 -1.730 -26.866 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.273 0.364 -28.812 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.680 0.839 -27.232 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.416 -0.874 -29.049 1.00 0.00 H new ATOM 0 HD2 PHE A 112 19.940 0.352 -25.196 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.672 -1.209 -28.075 1.00 0.00 H new ATOM 0 HE2 PHE A 112 22.187 -0.036 -24.212 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.059 -0.809 -25.654 1.00 0.00 H new ATOM 1675 N ARG A 113 16.292 -0.183 -29.058 1.00 0.00 N ATOM 1676 CA ARG A 113 14.927 0.335 -29.300 1.00 0.00 C ATOM 1677 C ARG A 113 13.831 -0.751 -29.275 1.00 0.00 C ATOM 1678 O ARG A 113 12.671 -0.431 -29.031 1.00 0.00 O ATOM 1679 CB ARG A 113 14.911 1.164 -30.601 1.00 0.00 C ATOM 1680 CG ARG A 113 15.724 2.466 -30.458 1.00 0.00 C ATOM 1681 CD ARG A 113 15.595 3.362 -31.694 1.00 0.00 C ATOM 1682 NE ARG A 113 16.165 4.705 -31.451 1.00 0.00 N ATOM 1683 CZ ARG A 113 17.141 5.315 -32.096 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.787 4.761 -33.086 1.00 0.00 N ATOM 1685 NH2 ARG A 113 17.480 6.520 -31.747 1.00 0.00 N ATOM 0 H ARG A 113 16.889 -0.147 -29.884 1.00 0.00 H new ATOM 0 HA ARG A 113 14.673 0.986 -28.464 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.319 0.568 -31.417 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.882 1.405 -30.866 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.383 3.011 -29.578 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.774 2.222 -30.295 1.00 0.00 H new ATOM 0 HD2 ARG A 113 16.105 2.896 -32.537 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.544 3.456 -31.969 1.00 0.00 H new ATOM 0 HE ARG A 113 15.748 5.230 -30.682 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.543 3.818 -33.390 1.00 0.00 H new ATOM 0 HH12 ARG A 113 18.535 5.271 -33.556 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.993 6.985 -30.981 1.00 0.00 H new ATOM 0 HH22 ARG A 113 18.233 7.001 -32.239 1.00 0.00 H new ATOM 1699 N THR A 114 14.194 -2.028 -29.428 1.00 0.00 N ATOM 1700 CA THR A 114 13.311 -3.195 -29.221 1.00 0.00 C ATOM 1701 C THR A 114 13.220 -3.588 -27.747 1.00 0.00 C ATOM 1702 O THR A 114 12.122 -3.704 -27.203 1.00 0.00 O ATOM 1703 CB THR A 114 13.778 -4.402 -30.060 1.00 0.00 C ATOM 1704 OG1 THR A 114 13.765 -4.077 -31.433 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.867 -5.625 -29.909 1.00 0.00 C ATOM 0 H THR A 114 15.138 -2.293 -29.708 1.00 0.00 H new ATOM 0 HA THR A 114 12.316 -2.899 -29.553 1.00 0.00 H new ATOM 0 HB THR A 114 14.778 -4.639 -29.695 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.552 -3.534 -31.648 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.248 -6.441 -30.523 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.846 -5.936 -28.865 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.858 -5.369 -30.231 1.00 0.00 H new ATOM 1713 N VAL A 115 14.364 -3.782 -27.075 1.00 0.00 N ATOM 1714 CA VAL A 115 14.444 -4.287 -25.689 1.00 0.00 C ATOM 1715 C VAL A 115 13.847 -3.297 -24.703 1.00 0.00 C ATOM 1716 O VAL A 115 13.144 -3.728 -23.793 1.00 0.00 O ATOM 1717 CB VAL A 115 15.884 -4.717 -25.317 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.986 -5.108 -23.837 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.307 -5.936 -26.143 1.00 0.00 C ATOM 0 H VAL A 115 15.279 -3.590 -27.484 1.00 0.00 H new ATOM 0 HA VAL A 115 13.835 -5.189 -25.627 1.00 0.00 H new ATOM 0 HB VAL A 115 16.532 -3.865 -25.521 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.010 -5.405 -23.609 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.708 -4.257 -23.216 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.313 -5.941 -23.633 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.322 -6.226 -25.870 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.627 -6.764 -25.944 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.274 -5.686 -27.203 1.00 0.00 H new ATOM 1729 N ARG A 116 13.983 -1.988 -24.941 1.00 0.00 N ATOM 1730 CA ARG A 116 13.314 -0.953 -24.124 1.00 0.00 C ATOM 1731 C ARG A 116 11.804 -1.176 -24.037 1.00 0.00 C ATOM 1732 O ARG A 116 11.245 -1.140 -22.953 1.00 0.00 O ATOM 1733 CB ARG A 116 13.713 0.449 -24.634 1.00 0.00 C ATOM 1734 CG ARG A 116 12.904 0.984 -25.821 1.00 0.00 C ATOM 1735 CD ARG A 116 13.392 2.353 -26.299 1.00 0.00 C ATOM 1736 NE ARG A 116 12.631 2.761 -27.500 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.877 3.800 -28.272 1.00 0.00 C ATOM 1738 NH1 ARG A 116 13.866 4.600 -28.030 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.154 4.045 -29.322 1.00 0.00 N ATOM 0 H ARG A 116 14.554 -1.612 -25.698 1.00 0.00 H new ATOM 0 HA ARG A 116 13.660 -1.030 -23.093 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.621 1.155 -23.808 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.765 0.426 -24.917 1.00 0.00 H new ATOM 0 HG2 ARG A 116 12.963 0.274 -26.646 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.854 1.056 -25.537 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.265 3.092 -25.508 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.457 2.311 -26.528 1.00 0.00 H new ATOM 0 HE ARG A 116 11.834 2.178 -27.757 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.473 4.432 -27.228 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.038 5.398 -28.641 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.379 3.428 -29.563 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.361 4.855 -29.906 1.00 0.00 H new ATOM 1753 N GLY A 117 11.163 -1.527 -25.154 1.00 0.00 N ATOM 1754 CA GLY A 117 9.722 -1.804 -25.213 1.00 0.00 C ATOM 1755 C GLY A 117 9.340 -3.121 -24.533 1.00 0.00 C ATOM 1756 O GLY A 117 8.285 -3.203 -23.908 1.00 0.00 O ATOM 0 H GLY A 117 11.633 -1.629 -26.054 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.180 -0.986 -24.739 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.405 -1.834 -26.256 1.00 0.00 H new ATOM 1760 N GLN A 118 10.229 -4.123 -24.552 1.00 0.00 N ATOM 1761 CA GLN A 118 9.982 -5.402 -23.872 1.00 0.00 C ATOM 1762 C GLN A 118 10.053 -5.232 -22.354 1.00 0.00 C ATOM 1763 O GLN A 118 9.194 -5.740 -21.637 1.00 0.00 O ATOM 1764 CB GLN A 118 10.946 -6.513 -24.354 1.00 0.00 C ATOM 1765 CG GLN A 118 11.110 -6.686 -25.876 1.00 0.00 C ATOM 1766 CD GLN A 118 9.822 -6.538 -26.683 1.00 0.00 C ATOM 1767 OE1 GLN A 118 8.929 -7.371 -26.624 1.00 0.00 O ATOM 1768 NE2 GLN A 118 9.677 -5.479 -27.457 1.00 0.00 N ATOM 0 H GLN A 118 11.128 -4.072 -25.032 1.00 0.00 H new ATOM 0 HA GLN A 118 8.973 -5.720 -24.135 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.930 -6.316 -23.928 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.603 -7.461 -23.940 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.832 -5.953 -26.234 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.533 -7.672 -26.071 1.00 0.00 H new ATOM 0 HE21 GLN A 118 10.419 -4.781 -27.510 1.00 0.00 H new ATOM 0 HE22 GLN A 118 8.823 -5.359 -28.002 1.00 0.00 H new ATOM 1777 N VAL A 119 11.023 -4.452 -21.869 1.00 0.00 N ATOM 1778 CA VAL A 119 11.091 -4.020 -20.457 1.00 0.00 C ATOM 1779 C VAL A 119 9.887 -3.142 -20.105 1.00 0.00 C ATOM 1780 O VAL A 119 9.214 -3.420 -19.118 1.00 0.00 O ATOM 1781 CB VAL A 119 12.423 -3.296 -20.185 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.521 -2.740 -18.762 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.615 -4.248 -20.369 1.00 0.00 C ATOM 0 H VAL A 119 11.789 -4.097 -22.441 1.00 0.00 H new ATOM 0 HA VAL A 119 11.053 -4.900 -19.814 1.00 0.00 H new ATOM 0 HB VAL A 119 12.451 -2.475 -20.901 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.481 -2.241 -18.631 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.715 -2.025 -18.594 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.436 -3.557 -18.045 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.543 -3.712 -20.171 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.524 -5.084 -19.675 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.625 -4.625 -21.392 1.00 0.00 H new ATOM 1793 N LYS A 120 9.548 -2.144 -20.933 1.00 0.00 N ATOM 1794 CA LYS A 120 8.415 -1.220 -20.724 1.00 0.00 C ATOM 1795 C LYS A 120 7.097 -1.948 -20.516 1.00 0.00 C ATOM 1796 O LYS A 120 6.436 -1.678 -19.528 1.00 0.00 O ATOM 1797 CB LYS A 120 8.347 -0.222 -21.897 1.00 0.00 C ATOM 1798 CG LYS A 120 7.312 0.903 -21.725 1.00 0.00 C ATOM 1799 CD LYS A 120 5.945 0.629 -22.373 1.00 0.00 C ATOM 1800 CE LYS A 120 5.097 1.909 -22.323 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.756 1.713 -22.940 1.00 0.00 N ATOM 0 H LYS A 120 10.065 -1.949 -21.790 1.00 0.00 H new ATOM 0 HA LYS A 120 8.589 -0.668 -19.800 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.331 0.226 -22.032 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.118 -0.771 -22.810 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.164 1.081 -20.660 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.721 1.821 -22.148 1.00 0.00 H new ATOM 0 HD2 LYS A 120 6.077 0.306 -23.406 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.436 -0.180 -21.848 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.977 2.224 -21.287 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.621 2.712 -22.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.404 2.622 -23.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.830 1.033 -23.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 3.095 1.346 -22.225 1.00 0.00 H new ATOM 1815 N GLU A 121 6.721 -2.895 -21.375 1.00 0.00 N ATOM 1816 CA GLU A 121 5.426 -3.601 -21.238 1.00 0.00 C ATOM 1817 C GLU A 121 5.393 -4.548 -20.025 1.00 0.00 C ATOM 1818 O GLU A 121 4.340 -4.792 -19.432 1.00 0.00 O ATOM 1819 CB GLU A 121 5.054 -4.317 -22.547 1.00 0.00 C ATOM 1820 CG GLU A 121 5.918 -5.546 -22.873 1.00 0.00 C ATOM 1821 CD GLU A 121 5.563 -6.233 -24.211 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.717 -5.730 -24.990 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.145 -7.314 -24.478 1.00 0.00 O ATOM 0 H GLU A 121 7.283 -3.197 -22.171 1.00 0.00 H new ATOM 0 HA GLU A 121 4.663 -2.847 -21.044 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.011 -4.627 -22.492 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.132 -3.606 -23.369 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.965 -5.244 -22.899 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.816 -6.272 -22.066 1.00 0.00 H new ATOM 1830 N ARG A 122 6.562 -5.042 -19.602 1.00 0.00 N ATOM 1831 CA ARG A 122 6.724 -5.863 -18.391 1.00 0.00 C ATOM 1832 C ARG A 122 6.583 -5.006 -17.130 1.00 0.00 C ATOM 1833 O ARG A 122 5.721 -5.295 -16.307 1.00 0.00 O ATOM 1834 CB ARG A 122 8.010 -6.697 -18.510 1.00 0.00 C ATOM 1835 CG ARG A 122 7.744 -7.868 -19.470 1.00 0.00 C ATOM 1836 CD ARG A 122 9.025 -8.519 -19.996 1.00 0.00 C ATOM 1837 NE ARG A 122 8.713 -9.541 -21.024 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.234 -9.338 -22.242 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.074 -8.144 -22.725 1.00 0.00 N ATOM 1840 NH2 ARG A 122 7.871 -10.328 -22.998 1.00 0.00 N ATOM 0 H ARG A 122 7.439 -4.881 -20.098 1.00 0.00 H new ATOM 0 HA ARG A 122 5.920 -6.592 -18.294 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.828 -6.081 -18.882 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.311 -7.070 -17.531 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.146 -8.621 -18.957 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.153 -7.511 -20.313 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.678 -7.756 -20.421 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.569 -8.980 -19.172 1.00 0.00 H new ATOM 0 HE ARG A 122 8.887 -10.512 -20.763 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.320 -7.329 -22.163 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.703 -8.020 -23.667 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.952 -11.286 -22.657 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.505 -10.148 -23.933 1.00 0.00 H new ATOM 1854 N VAL A 123 7.311 -3.892 -17.037 1.00 0.00 N ATOM 1855 CA VAL A 123 7.119 -2.859 -16.003 1.00 0.00 C ATOM 1856 C VAL A 123 5.674 -2.351 -15.970 1.00 0.00 C ATOM 1857 O VAL A 123 5.086 -2.299 -14.898 1.00 0.00 O ATOM 1858 CB VAL A 123 8.099 -1.706 -16.270 1.00 0.00 C ATOM 1859 CG1 VAL A 123 7.866 -0.492 -15.379 1.00 0.00 C ATOM 1860 CG2 VAL A 123 9.555 -2.143 -16.044 1.00 0.00 C ATOM 0 H VAL A 123 8.066 -3.673 -17.687 1.00 0.00 H new ATOM 0 HA VAL A 123 7.320 -3.296 -15.025 1.00 0.00 H new ATOM 0 HB VAL A 123 7.919 -1.433 -17.310 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.593 0.283 -15.622 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.859 -0.109 -15.543 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.979 -0.781 -14.334 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.222 -1.304 -16.242 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.680 -2.471 -15.012 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.797 -2.965 -16.718 1.00 0.00 H new ATOM 1870 N GLU A 124 5.066 -2.012 -17.109 1.00 0.00 N ATOM 1871 CA GLU A 124 3.709 -1.481 -17.175 1.00 0.00 C ATOM 1872 C GLU A 124 2.664 -2.473 -16.658 1.00 0.00 C ATOM 1873 O GLU A 124 1.900 -2.121 -15.762 1.00 0.00 O ATOM 1874 CB GLU A 124 3.400 -1.072 -18.623 1.00 0.00 C ATOM 1875 CG GLU A 124 2.361 0.038 -18.657 1.00 0.00 C ATOM 1876 CD GLU A 124 1.657 0.116 -20.025 1.00 0.00 C ATOM 1877 OE1 GLU A 124 2.349 0.314 -21.050 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.411 -0.014 -20.080 1.00 0.00 O ATOM 0 H GLU A 124 5.511 -2.101 -18.022 1.00 0.00 H new ATOM 0 HA GLU A 124 3.655 -0.610 -16.522 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.313 -0.737 -19.115 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.036 -1.935 -19.180 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.620 -0.132 -17.876 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.840 0.992 -18.439 1.00 0.00 H new ATOM 1885 N ASN A 125 2.650 -3.720 -17.148 1.00 0.00 N ATOM 1886 CA ASN A 125 1.647 -4.692 -16.699 1.00 0.00 C ATOM 1887 C ASN A 125 1.886 -5.136 -15.242 1.00 0.00 C ATOM 1888 O ASN A 125 0.920 -5.360 -14.515 1.00 0.00 O ATOM 1889 CB ASN A 125 1.494 -5.851 -17.705 1.00 0.00 C ATOM 1890 CG ASN A 125 2.313 -7.080 -17.349 1.00 0.00 C ATOM 1891 OD1 ASN A 125 1.893 -7.942 -16.592 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.517 -7.178 -17.853 1.00 0.00 N ATOM 0 H ASN A 125 3.309 -4.074 -17.842 1.00 0.00 H new ATOM 0 HA ASN A 125 0.676 -4.197 -16.682 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.442 -6.131 -17.766 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.789 -5.503 -18.695 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.107 -7.975 -17.614 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.866 -6.457 -18.485 1.00 0.00 H new ATOM 1899 N LEU A 126 3.151 -5.175 -14.791 1.00 0.00 N ATOM 1900 CA LEU A 126 3.501 -5.370 -13.381 1.00 0.00 C ATOM 1901 C LEU A 126 2.957 -4.229 -12.525 1.00 0.00 C ATOM 1902 O LEU A 126 2.296 -4.478 -11.522 1.00 0.00 O ATOM 1903 CB LEU A 126 5.029 -5.546 -13.250 1.00 0.00 C ATOM 1904 CG LEU A 126 5.640 -5.776 -11.849 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.836 -4.498 -11.036 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.847 -6.781 -11.012 1.00 0.00 C ATOM 0 H LEU A 126 3.962 -5.071 -15.401 1.00 0.00 H new ATOM 0 HA LEU A 126 3.032 -6.280 -13.006 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.318 -6.389 -13.877 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.500 -4.658 -13.672 1.00 0.00 H new ATOM 0 HG LEU A 126 6.625 -6.188 -12.066 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.269 -4.746 -10.067 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.506 -3.826 -11.571 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.873 -4.009 -10.889 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.324 -6.901 -10.039 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.829 -6.417 -10.874 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.822 -7.742 -11.525 1.00 0.00 H new ATOM 1918 N ILE A 127 3.196 -2.975 -12.904 1.00 0.00 N ATOM 1919 CA ILE A 127 2.759 -1.855 -12.061 1.00 0.00 C ATOM 1920 C ILE A 127 1.234 -1.697 -12.088 1.00 0.00 C ATOM 1921 O ILE A 127 0.624 -1.497 -11.039 1.00 0.00 O ATOM 1922 CB ILE A 127 3.541 -0.582 -12.429 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.019 -0.787 -12.019 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.974 0.674 -11.740 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.973 0.275 -12.560 1.00 0.00 C ATOM 0 H ILE A 127 3.676 -2.709 -13.764 1.00 0.00 H new ATOM 0 HA ILE A 127 2.996 -2.065 -11.018 1.00 0.00 H new ATOM 0 HB ILE A 127 3.452 -0.419 -13.503 1.00 0.00 H new ATOM 0 HG12 ILE A 127 5.084 -0.797 -10.931 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.348 -1.766 -12.367 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.560 1.545 -12.032 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.936 0.817 -12.041 1.00 0.00 H new ATOM 0 HG23 ILE A 127 3.024 0.549 -10.658 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.987 0.057 -12.226 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.941 0.272 -13.650 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.673 1.256 -12.191 1.00 0.00 H new ATOM 1937 N ALA A 128 0.593 -1.892 -13.242 1.00 0.00 N ATOM 1938 CA ALA A 128 -0.858 -1.794 -13.402 1.00 0.00 C ATOM 1939 C ALA A 128 -1.653 -2.805 -12.550 1.00 0.00 C ATOM 1940 O ALA A 128 -2.801 -2.525 -12.192 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.188 -1.943 -14.894 1.00 0.00 C ATOM 0 H ALA A 128 1.078 -2.127 -14.108 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.170 -0.817 -13.032 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.266 -1.873 -15.037 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.695 -1.150 -15.457 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.837 -2.912 -15.249 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.048 -3.950 -12.189 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.656 -4.958 -11.292 1.00 0.00 C ATOM 1949 C LYS A 129 -1.341 -4.778 -9.796 1.00 0.00 C ATOM 1950 O LYS A 129 -2.002 -5.425 -8.982 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.382 -6.388 -11.802 1.00 0.00 C ATOM 1952 CG LYS A 129 0.048 -6.892 -11.572 1.00 0.00 C ATOM 1953 CD LYS A 129 0.208 -8.327 -12.089 1.00 0.00 C ATOM 1954 CE LYS A 129 1.650 -8.801 -11.882 1.00 0.00 C ATOM 1955 NZ LYS A 129 1.789 -10.247 -12.223 1.00 0.00 N ATOM 0 H LYS A 129 -0.115 -4.207 -12.512 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.731 -4.783 -11.340 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.076 -7.072 -11.313 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.597 -6.425 -12.870 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.756 -6.237 -12.080 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.285 -6.855 -10.509 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.480 -8.990 -11.565 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.050 -8.372 -13.147 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.324 -8.210 -12.503 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.946 -8.638 -10.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.662 -10.621 -11.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.972 -10.772 -11.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.830 -10.358 -13.256 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.380 -3.916 -9.419 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.013 -3.681 -7.998 1.00 0.00 C ATOM 1971 C ILE A 130 -0.323 -2.265 -7.474 1.00 0.00 C ATOM 1972 O ILE A 130 -0.385 -2.078 -6.255 1.00 0.00 O ATOM 1973 CB ILE A 130 1.442 -4.107 -7.690 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.495 -3.117 -8.229 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.699 -5.532 -8.206 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.936 -3.488 -7.855 1.00 0.00 C ATOM 0 H ILE A 130 0.165 -3.363 -10.080 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.678 -4.336 -7.435 1.00 0.00 H new ATOM 0 HB ILE A 130 1.553 -4.095 -6.606 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.412 -3.067 -9.315 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.274 -2.121 -7.846 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.726 -5.820 -7.983 1.00 0.00 H new ATOM 0 HG22 ILE A 130 1.014 -6.225 -7.718 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.539 -5.563 -9.284 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.621 -2.748 -8.268 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.036 -3.510 -6.770 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.176 -4.471 -8.261 1.00 0.00 H new ATOM 1988 N SER A 131 -0.530 -1.290 -8.368 1.00 0.00 N ATOM 1989 CA SER A 131 -0.997 0.076 -8.057 1.00 0.00 C ATOM 1990 C SER A 131 -2.410 0.077 -7.453 1.00 0.00 C ATOM 1991 O SER A 131 -2.605 0.696 -6.380 1.00 0.00 O ATOM 1992 CB SER A 131 -0.939 0.924 -9.329 1.00 0.00 C ATOM 1993 OG SER A 131 -1.123 2.295 -9.014 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.328 -0.542 -8.045 1.00 0.00 O ATOM 0 H SER A 131 -0.372 -1.431 -9.366 1.00 0.00 H new ATOM 0 HA SER A 131 -0.339 0.507 -7.302 1.00 0.00 H new ATOM 0 HB2 SER A 131 0.021 0.783 -9.825 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.709 0.598 -10.028 1.00 0.00 H new ATOM 0 HG SER A 131 -1.082 2.828 -9.836 1.00 0.00 H new TER 2000 SER A 131