USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1210 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 5 THR OG1 : rot 48:sc= 0.344 USER MOD Set 1.2: A 140 THR OG1 : rot -139:sc= 0.0593 USER MOD Set 2.1: A 118 LYS NZ :NH3+ -164:sc= 1.18 (180deg=0.579) USER MOD Set 2.2: A 123 GLN :FLIP amide:sc= -0.749 F(o=-1.2,f=0.43) USER MOD Set 3.1: A 50 THR OG1 : rot -160:sc= -0.485 USER MOD Set 3.2: A 54 THR OG1 : rot -58:sc= 0.748 USER MOD Set 4.1: A 21 ASN : amide:sc= -0.122 K(o=0.21,f=-5.5!) USER MOD Set 4.2: A 34 CYS SG : rot 96:sc= 0.331 USER MOD Set 5.1: A 7 LYS NZ :NH3+ -158:sc= 0.932 (180deg=0.28) USER MOD Set 5.2: A 142 TYR OH : rot 24:sc= 0.695 USER MOD Single : A 1 ALA N :NH3+ -105:sc= 1.12 (180deg=-1.35!) USER MOD Single : A 4 TYR OH : rot 130:sc= 0.298 USER MOD Single : A 13 THR OG1 : rot -49:sc= 0.251 USER MOD Single : A 24 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 25 HIS : no HD1:sc= -0.261 X(o=-0.26,f=0.0029) USER MOD Single : A 28 GLN : amide:sc= -0.263 K(o=-0.26,f=-7.6!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 56 LYS NZ :NH3+ -153:sc= 1.5 (180deg=0.756) USER MOD Single : A 57 THR OG1 : rot 105:sc= 0.98 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot -89:sc= -0.0185 USER MOD Single : A 63 THR OG1 : rot 57:sc= 0.511 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HE2:sc= -1.46 K(o=-1.5,f=-3.5!) USER MOD Single : A 72 ASN : amide:sc= 0.283 K(o=0.28,f=-2.8!) USER MOD Single : A 74 ASN : amide:sc= 0.0911 X(o=0.091,f=-0.0064) USER MOD Single : A 75 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.3!) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.259 USER MOD Single : A 77 SER OG : rot 85:sc= 0.74 USER MOD Single : A 89 TYR OH : rot 122:sc= -0.105 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 100 SER OG : rot -27:sc= 0.734 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -47:sc= 0.637 USER MOD Single : A 110 SER OG : rot -76:sc= 0.485 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.02 USER MOD Single : A 115 SER OG : rot -87:sc= 0.371 USER MOD Single : A 122 HIS : no HE2:sc= -0.588 K(o=-0.59,f=-1.8) USER MOD Single : A 124 SER OG : rot 110:sc= 0 USER MOD Single : A 126 SER OG : rot 66:sc= 0.834 USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 MET CE :methyl -122:sc= -1.72 (180deg=-7.44!) USER MOD Single : A 134 THR OG1 : rot -71:sc= 0.969 USER MOD Single : A 135 THR OG1 : rot -68:sc= 0.74 USER MOD Single : A 143 CYS SG : rot 150:sc= -0.115 USER MOD Single : A 146 LYS NZ :NH3+ 138:sc= 1.24 (180deg=0.779) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0779 USER MOD Single : A 150 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot -21:sc= 0.879 USER MOD Single : A 157 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.7!) USER MOD Single : A 158 ASN : amide:sc=-0.00875 K(o=-0.0088,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 11.690 6.252 -16.380 1.00 2.95 N ATOM 2 CA ALA A 1 11.955 6.611 -14.980 1.00 2.30 C ATOM 3 C ALA A 1 10.623 6.871 -14.298 1.00 1.77 C ATOM 4 O ALA A 1 9.710 7.361 -14.960 1.00 1.97 O ATOM 5 CB ALA A 1 12.860 7.844 -14.892 1.00 2.72 C ATOM 0 H1 ALA A 1 11.823 5.228 -16.507 1.00 2.95 H new ATOM 0 H2 ALA A 1 10.712 6.507 -16.625 1.00 2.95 H new ATOM 0 H3 ALA A 1 12.347 6.766 -17.001 1.00 2.95 H new ATOM 0 HA ALA A 1 12.476 5.794 -14.481 1.00 2.30 H new ATOM 0 HB1 ALA A 1 13.041 8.089 -13.845 1.00 2.72 H new ATOM 0 HB2 ALA A 1 13.809 7.634 -15.385 1.00 2.72 H new ATOM 0 HB3 ALA A 1 12.375 8.687 -15.383 1.00 2.72 H new ATOM 11 N PRO A 2 10.493 6.536 -13.011 1.00 1.29 N ATOM 12 CA PRO A 2 9.289 6.795 -12.246 1.00 0.93 C ATOM 13 C PRO A 2 9.203 8.290 -11.922 1.00 0.83 C ATOM 14 O PRO A 2 10.163 9.033 -12.125 1.00 1.00 O ATOM 15 CB PRO A 2 9.449 5.939 -10.987 1.00 0.93 C ATOM 16 CG PRO A 2 10.959 5.946 -10.755 1.00 1.22 C ATOM 17 CD PRO A 2 11.539 5.980 -12.170 1.00 1.39 C ATOM 0 HA PRO A 2 8.369 6.546 -12.776 1.00 0.93 H new ATOM 0 HB2 PRO A 2 8.909 6.362 -10.140 1.00 0.93 H new ATOM 0 HB3 PRO A 2 9.068 4.928 -11.135 1.00 0.93 H new ATOM 0 HG2 PRO A 2 11.271 6.813 -10.173 1.00 1.22 H new ATOM 0 HG3 PRO A 2 11.285 5.061 -10.209 1.00 1.22 H new ATOM 0 HD2 PRO A 2 12.440 6.593 -12.209 1.00 1.39 H new ATOM 0 HD3 PRO A 2 11.819 4.980 -12.503 1.00 1.39 H new ATOM 25 N ALA A 3 8.061 8.743 -11.403 1.00 0.72 N ATOM 26 CA ALA A 3 7.877 10.123 -10.975 1.00 0.79 C ATOM 27 C ALA A 3 6.839 10.142 -9.860 1.00 0.69 C ATOM 28 O ALA A 3 5.883 9.367 -9.920 1.00 0.65 O ATOM 29 CB ALA A 3 7.401 10.975 -12.156 1.00 0.98 C ATOM 0 H ALA A 3 7.237 8.158 -11.269 1.00 0.72 H new ATOM 0 HA ALA A 3 8.819 10.535 -10.613 1.00 0.79 H new ATOM 0 HB1 ALA A 3 7.265 12.006 -11.829 1.00 0.98 H new ATOM 0 HB2 ALA A 3 8.145 10.941 -12.952 1.00 0.98 H new ATOM 0 HB3 ALA A 3 6.454 10.584 -12.528 1.00 0.98 H new ATOM 35 N TYR A 4 7.017 11.005 -8.856 1.00 0.74 N ATOM 36 CA TYR A 4 6.099 11.071 -7.725 1.00 0.68 C ATOM 37 C TYR A 4 4.920 11.969 -8.087 1.00 0.70 C ATOM 38 O TYR A 4 5.026 12.835 -8.953 1.00 0.89 O ATOM 39 CB TYR A 4 6.772 11.614 -6.448 1.00 0.80 C ATOM 40 CG TYR A 4 8.288 11.575 -6.379 1.00 1.22 C ATOM 41 CD1 TYR A 4 8.988 10.369 -6.573 1.00 1.39 C ATOM 42 CD2 TYR A 4 8.999 12.761 -6.106 1.00 2.09 C ATOM 43 CE1 TYR A 4 10.394 10.349 -6.514 1.00 2.09 C ATOM 44 CE2 TYR A 4 10.401 12.748 -6.037 1.00 2.71 C ATOM 45 CZ TYR A 4 11.105 11.542 -6.248 1.00 2.63 C ATOM 46 OH TYR A 4 12.466 11.546 -6.179 1.00 3.37 O ATOM 0 H TYR A 4 7.791 11.667 -8.807 1.00 0.74 H new ATOM 0 HA TYR A 4 5.766 10.054 -7.515 1.00 0.68 H new ATOM 0 HB2 TYR A 4 6.457 12.649 -6.317 1.00 0.80 H new ATOM 0 HB3 TYR A 4 6.383 11.052 -5.599 1.00 0.80 H new ATOM 0 HD1 TYR A 4 8.444 9.456 -6.768 1.00 1.39 H new ATOM 0 HD2 TYR A 4 8.462 13.685 -5.949 1.00 2.09 H new ATOM 0 HE1 TYR A 4 10.929 9.424 -6.672 1.00 2.09 H new ATOM 0 HE2 TYR A 4 10.940 13.659 -5.823 1.00 2.71 H new ATOM 0 HH TYR A 4 12.820 12.263 -6.745 1.00 3.37 H new ATOM 56 N THR A 5 3.806 11.793 -7.381 1.00 0.57 N ATOM 57 CA THR A 5 2.592 12.571 -7.566 1.00 0.59 C ATOM 58 C THR A 5 1.753 12.398 -6.303 1.00 0.52 C ATOM 59 O THR A 5 2.091 11.565 -5.464 1.00 0.46 O ATOM 60 CB THR A 5 1.814 12.098 -8.811 1.00 0.65 C ATOM 61 OG1 THR A 5 2.369 10.944 -9.412 1.00 1.11 O ATOM 62 CG2 THR A 5 1.768 13.204 -9.864 1.00 1.31 C ATOM 0 H THR A 5 3.724 11.088 -6.648 1.00 0.57 H new ATOM 0 HA THR A 5 2.833 13.622 -7.728 1.00 0.59 H new ATOM 0 HB THR A 5 0.813 11.850 -8.457 1.00 0.65 H new ATOM 0 HG1 THR A 5 2.541 10.267 -8.724 1.00 1.11 H new ATOM 0 HG21 THR A 5 1.215 12.854 -10.736 1.00 1.31 H new ATOM 0 HG22 THR A 5 1.272 14.081 -9.449 1.00 1.31 H new ATOM 0 HG23 THR A 5 2.784 13.467 -10.160 1.00 1.31 H new ATOM 70 N VAL A 6 0.660 13.146 -6.162 1.00 0.57 N ATOM 71 CA VAL A 6 -0.229 13.066 -5.015 1.00 0.57 C ATOM 72 C VAL A 6 -1.666 13.221 -5.500 1.00 0.52 C ATOM 73 O VAL A 6 -1.901 13.909 -6.494 1.00 0.61 O ATOM 74 CB VAL A 6 0.201 14.120 -3.974 1.00 0.71 C ATOM 75 CG1 VAL A 6 -0.028 15.560 -4.452 1.00 1.49 C ATOM 76 CG2 VAL A 6 -0.513 13.923 -2.639 1.00 1.59 C ATOM 0 H VAL A 6 0.367 13.834 -6.855 1.00 0.57 H new ATOM 0 HA VAL A 6 -0.169 12.098 -4.517 1.00 0.57 H new ATOM 0 HB VAL A 6 1.272 13.969 -3.840 1.00 0.71 H new ATOM 0 HG11 VAL A 6 0.293 16.256 -3.677 1.00 1.49 H new ATOM 0 HG12 VAL A 6 0.547 15.738 -5.361 1.00 1.49 H new ATOM 0 HG13 VAL A 6 -1.088 15.711 -4.658 1.00 1.49 H new ATOM 0 HG21 VAL A 6 -0.182 14.685 -1.934 1.00 1.59 H new ATOM 0 HG22 VAL A 6 -1.590 14.007 -2.786 1.00 1.59 H new ATOM 0 HG23 VAL A 6 -0.277 12.935 -2.243 1.00 1.59 H new ATOM 86 N LYS A 7 -2.617 12.556 -4.838 1.00 0.49 N ATOM 87 CA LYS A 7 -4.029 12.637 -5.192 1.00 0.55 C ATOM 88 C LYS A 7 -4.873 12.540 -3.927 1.00 0.62 C ATOM 89 O LYS A 7 -4.626 11.680 -3.081 1.00 0.71 O ATOM 90 CB LYS A 7 -4.376 11.491 -6.153 1.00 0.60 C ATOM 91 CG LYS A 7 -4.796 12.004 -7.534 1.00 0.83 C ATOM 92 CD LYS A 7 -5.014 10.788 -8.436 1.00 0.92 C ATOM 93 CE LYS A 7 -5.092 11.151 -9.917 1.00 1.51 C ATOM 94 NZ LYS A 7 -4.832 9.960 -10.757 1.00 2.32 N ATOM 0 H LYS A 7 -2.425 11.947 -4.042 1.00 0.49 H new ATOM 0 HA LYS A 7 -4.236 13.588 -5.683 1.00 0.55 H new ATOM 0 HB2 LYS A 7 -3.513 10.833 -6.258 1.00 0.60 H new ATOM 0 HB3 LYS A 7 -5.183 10.894 -5.728 1.00 0.60 H new ATOM 0 HG2 LYS A 7 -5.709 12.594 -7.461 1.00 0.83 H new ATOM 0 HG3 LYS A 7 -4.027 12.656 -7.950 1.00 0.83 H new ATOM 0 HD2 LYS A 7 -4.200 10.079 -8.284 1.00 0.92 H new ATOM 0 HD3 LYS A 7 -5.935 10.285 -8.142 1.00 0.92 H new ATOM 0 HE2 LYS A 7 -6.077 11.557 -10.147 1.00 1.51 H new ATOM 0 HE3 LYS A 7 -4.365 11.930 -10.145 1.00 1.51 H new ATOM 0 HZ1 LYS A 7 -4.521 10.263 -11.702 1.00 2.32 H new ATOM 0 HZ2 LYS A 7 -4.089 9.381 -10.317 1.00 2.32 H new ATOM 0 HZ3 LYS A 7 -5.703 9.399 -10.842 1.00 2.32 H new ATOM 108 N ARG A 8 -5.904 13.382 -3.816 1.00 0.73 N ATOM 109 CA ARG A 8 -6.775 13.408 -2.655 1.00 0.81 C ATOM 110 C ARG A 8 -8.048 12.627 -2.942 1.00 0.78 C ATOM 111 O ARG A 8 -9.010 13.178 -3.467 1.00 0.96 O ATOM 112 CB ARG A 8 -7.067 14.866 -2.295 1.00 1.07 C ATOM 113 CG ARG A 8 -7.653 14.956 -0.888 1.00 1.75 C ATOM 114 CD ARG A 8 -7.427 16.347 -0.302 1.00 1.80 C ATOM 115 NE ARG A 8 -8.106 17.385 -1.089 1.00 2.09 N ATOM 116 CZ ARG A 8 -7.533 18.233 -1.956 1.00 2.42 C ATOM 117 NH1 ARG A 8 -8.301 19.092 -2.629 1.00 2.88 N ATOM 118 NH2 ARG A 8 -6.216 18.237 -2.164 1.00 3.15 N ATOM 0 H ARG A 8 -6.152 14.063 -4.534 1.00 0.73 H new ATOM 0 HA ARG A 8 -6.291 12.931 -1.803 1.00 0.81 H new ATOM 0 HB2 ARG A 8 -6.150 15.453 -2.353 1.00 1.07 H new ATOM 0 HB3 ARG A 8 -7.765 15.293 -3.015 1.00 1.07 H new ATOM 0 HG2 ARG A 8 -8.720 14.737 -0.918 1.00 1.75 H new ATOM 0 HG3 ARG A 8 -7.191 14.205 -0.247 1.00 1.75 H new ATOM 0 HD2 ARG A 8 -7.791 16.373 0.725 1.00 1.80 H new ATOM 0 HD3 ARG A 8 -6.358 16.558 -0.267 1.00 1.80 H new ATOM 0 HE ARG A 8 -9.115 17.469 -0.964 1.00 2.09 H new ATOM 0 HH11 ARG A 8 -9.310 19.098 -2.481 1.00 2.88 H new ATOM 0 HH12 ARG A 8 -7.879 19.743 -3.291 1.00 2.88 H new ATOM 0 HH21 ARG A 8 -5.618 17.584 -1.658 1.00 3.15 H new ATOM 0 HH22 ARG A 8 -5.807 18.893 -2.829 1.00 3.15 H new ATOM 132 N ALA A 9 -8.050 11.344 -2.594 1.00 0.69 N ATOM 133 CA ALA A 9 -9.202 10.464 -2.720 1.00 0.70 C ATOM 134 C ALA A 9 -8.954 9.228 -1.856 1.00 0.69 C ATOM 135 O ALA A 9 -7.828 9.009 -1.406 1.00 0.74 O ATOM 136 CB ALA A 9 -9.387 10.053 -4.188 1.00 0.73 C ATOM 0 H ALA A 9 -7.229 10.878 -2.207 1.00 0.69 H new ATOM 0 HA ALA A 9 -10.106 10.976 -2.390 1.00 0.70 H new ATOM 0 HB1 ALA A 9 -10.251 9.394 -4.275 1.00 0.73 H new ATOM 0 HB2 ALA A 9 -9.546 10.943 -4.798 1.00 0.73 H new ATOM 0 HB3 ALA A 9 -8.496 9.530 -4.535 1.00 0.73 H new ATOM 142 N ASP A 10 -9.980 8.397 -1.657 1.00 0.72 N ATOM 143 CA ASP A 10 -9.763 7.059 -1.119 1.00 0.74 C ATOM 144 C ASP A 10 -9.025 6.254 -2.186 1.00 0.59 C ATOM 145 O ASP A 10 -9.389 6.302 -3.366 1.00 0.70 O ATOM 146 CB ASP A 10 -11.088 6.357 -0.783 1.00 0.96 C ATOM 147 CG ASP A 10 -11.645 6.722 0.597 1.00 2.11 C ATOM 148 OD1 ASP A 10 -10.852 6.760 1.566 1.00 3.21 O ATOM 149 OD2 ASP A 10 -12.877 6.913 0.677 1.00 2.88 O ATOM 0 H ASP A 10 -10.954 8.625 -1.858 1.00 0.72 H new ATOM 0 HA ASP A 10 -9.189 7.131 -0.195 1.00 0.74 H new ATOM 0 HB2 ASP A 10 -11.827 6.612 -1.543 1.00 0.96 H new ATOM 0 HB3 ASP A 10 -10.940 5.278 -0.832 1.00 0.96 H new ATOM 154 N ILE A 11 -7.999 5.505 -1.780 1.00 0.51 N ATOM 155 CA ILE A 11 -7.223 4.660 -2.677 1.00 0.53 C ATOM 156 C ILE A 11 -8.095 3.468 -3.100 1.00 0.74 C ATOM 157 O ILE A 11 -8.065 2.400 -2.508 1.00 1.13 O ATOM 158 CB ILE A 11 -5.889 4.296 -1.988 1.00 0.56 C ATOM 159 CG1 ILE A 11 -4.778 3.951 -2.993 1.00 0.81 C ATOM 160 CG2 ILE A 11 -6.021 3.231 -0.888 1.00 0.83 C ATOM 161 CD1 ILE A 11 -5.136 2.880 -4.020 1.00 0.61 C ATOM 0 H ILE A 11 -7.684 5.470 -0.811 1.00 0.51 H new ATOM 0 HA ILE A 11 -6.945 5.167 -3.601 1.00 0.53 H new ATOM 0 HB ILE A 11 -5.586 5.208 -1.474 1.00 0.56 H new ATOM 0 HG12 ILE A 11 -4.496 4.860 -3.524 1.00 0.81 H new ATOM 0 HG13 ILE A 11 -3.900 3.620 -2.439 1.00 0.81 H new ATOM 0 HG21 ILE A 11 -5.041 3.032 -0.455 1.00 0.83 H new ATOM 0 HG22 ILE A 11 -6.695 3.592 -0.111 1.00 0.83 H new ATOM 0 HG23 ILE A 11 -6.421 2.312 -1.317 1.00 0.83 H new ATOM 0 HD11 ILE A 11 -4.286 2.711 -4.681 1.00 0.61 H new ATOM 0 HD12 ILE A 11 -5.386 1.952 -3.506 1.00 0.61 H new ATOM 0 HD13 ILE A 11 -5.992 3.211 -4.608 1.00 0.61 H new ATOM 173 N ALA A 12 -8.939 3.670 -4.106 1.00 0.61 N ATOM 174 CA ALA A 12 -9.867 2.682 -4.628 1.00 0.84 C ATOM 175 C ALA A 12 -10.386 3.170 -5.969 1.00 0.84 C ATOM 176 O ALA A 12 -10.299 2.467 -6.968 1.00 1.07 O ATOM 177 CB ALA A 12 -11.039 2.504 -3.665 1.00 1.01 C ATOM 0 H ALA A 12 -8.995 4.562 -4.597 1.00 0.61 H new ATOM 0 HA ALA A 12 -9.358 1.725 -4.743 1.00 0.84 H new ATOM 0 HB1 ALA A 12 -11.729 1.761 -4.065 1.00 1.01 H new ATOM 0 HB2 ALA A 12 -10.667 2.169 -2.697 1.00 1.01 H new ATOM 0 HB3 ALA A 12 -11.559 3.455 -3.545 1.00 1.01 H new ATOM 183 N THR A 13 -10.896 4.402 -6.007 1.00 0.88 N ATOM 184 CA THR A 13 -11.335 5.026 -7.248 1.00 1.01 C ATOM 185 C THR A 13 -10.144 5.704 -7.932 1.00 0.95 C ATOM 186 O THR A 13 -10.270 6.798 -8.481 1.00 1.27 O ATOM 187 CB THR A 13 -12.512 5.968 -6.946 1.00 1.20 C ATOM 188 OG1 THR A 13 -13.078 6.442 -8.144 1.00 1.66 O ATOM 189 CG2 THR A 13 -12.176 7.149 -6.030 1.00 1.23 C ATOM 0 H THR A 13 -11.014 4.989 -5.181 1.00 0.88 H new ATOM 0 HA THR A 13 -11.705 4.286 -7.958 1.00 1.01 H new ATOM 0 HB THR A 13 -13.228 5.360 -6.393 1.00 1.20 H new ATOM 0 HG1 THR A 13 -12.368 6.769 -8.734 1.00 1.66 H new ATOM 0 HG21 THR A 13 -13.069 7.755 -5.876 1.00 1.23 H new ATOM 0 HG22 THR A 13 -11.821 6.775 -5.070 1.00 1.23 H new ATOM 0 HG23 THR A 13 -11.399 7.758 -6.492 1.00 1.23 H new ATOM 197 N ALA A 14 -8.987 5.043 -7.897 1.00 0.73 N ATOM 198 CA ALA A 14 -7.819 5.443 -8.648 1.00 0.70 C ATOM 199 C ALA A 14 -8.076 5.146 -10.124 1.00 0.91 C ATOM 200 O ALA A 14 -9.031 4.446 -10.460 1.00 2.29 O ATOM 201 CB ALA A 14 -6.621 4.654 -8.114 1.00 0.70 C ATOM 0 H ALA A 14 -8.843 4.204 -7.335 1.00 0.73 H new ATOM 0 HA ALA A 14 -7.610 6.508 -8.542 1.00 0.70 H new ATOM 0 HB1 ALA A 14 -5.724 4.937 -8.665 1.00 0.70 H new ATOM 0 HB2 ALA A 14 -6.482 4.875 -7.056 1.00 0.70 H new ATOM 0 HB3 ALA A 14 -6.803 3.587 -8.241 1.00 0.70 H new ATOM 207 N ILE A 15 -7.221 5.664 -11.004 1.00 0.80 N ATOM 208 CA ILE A 15 -7.349 5.447 -12.444 1.00 0.88 C ATOM 209 C ILE A 15 -6.005 5.054 -13.059 1.00 0.80 C ATOM 210 O ILE A 15 -5.839 5.074 -14.275 1.00 0.94 O ATOM 211 CB ILE A 15 -8.004 6.669 -13.122 1.00 1.19 C ATOM 212 CG1 ILE A 15 -7.329 8.024 -12.831 1.00 1.35 C ATOM 213 CG2 ILE A 15 -9.470 6.772 -12.676 1.00 1.34 C ATOM 214 CD1 ILE A 15 -5.914 8.146 -13.403 1.00 1.78 C ATOM 0 H ILE A 15 -6.424 6.243 -10.741 1.00 0.80 H new ATOM 0 HA ILE A 15 -8.017 4.604 -12.621 1.00 0.88 H new ATOM 0 HB ILE A 15 -7.897 6.489 -14.192 1.00 1.19 H new ATOM 0 HG12 ILE A 15 -7.947 8.823 -13.242 1.00 1.35 H new ATOM 0 HG13 ILE A 15 -7.289 8.175 -11.752 1.00 1.35 H new ATOM 0 HG21 ILE A 15 -9.936 7.634 -13.153 1.00 1.34 H new ATOM 0 HG22 ILE A 15 -10.003 5.866 -12.965 1.00 1.34 H new ATOM 0 HG23 ILE A 15 -9.514 6.889 -11.593 1.00 1.34 H new ATOM 0 HD11 ILE A 15 -5.505 9.126 -13.157 1.00 1.78 H new ATOM 0 HD12 ILE A 15 -5.280 7.370 -12.973 1.00 1.78 H new ATOM 0 HD13 ILE A 15 -5.948 8.028 -14.486 1.00 1.78 H new ATOM 226 N GLU A 16 -5.041 4.701 -12.214 1.00 0.79 N ATOM 227 CA GLU A 16 -3.775 4.134 -12.609 1.00 0.70 C ATOM 228 C GLU A 16 -3.985 2.649 -12.938 1.00 0.65 C ATOM 229 O GLU A 16 -4.999 2.068 -12.555 1.00 0.72 O ATOM 230 CB GLU A 16 -2.803 4.333 -11.440 1.00 0.62 C ATOM 231 CG GLU A 16 -2.333 5.791 -11.280 1.00 0.75 C ATOM 232 CD GLU A 16 -3.312 6.794 -10.646 1.00 1.07 C ATOM 233 OE1 GLU A 16 -4.418 6.433 -10.178 1.00 2.17 O ATOM 234 OE2 GLU A 16 -2.927 7.985 -10.595 1.00 1.85 O ATOM 0 H GLU A 16 -5.132 4.809 -11.204 1.00 0.79 H new ATOM 0 HA GLU A 16 -3.364 4.614 -13.497 1.00 0.70 H new ATOM 0 HB2 GLU A 16 -3.285 4.011 -10.517 1.00 0.62 H new ATOM 0 HB3 GLU A 16 -1.933 3.692 -11.586 1.00 0.62 H new ATOM 0 HG2 GLU A 16 -1.423 5.786 -10.680 1.00 0.75 H new ATOM 0 HG3 GLU A 16 -2.062 6.166 -12.267 1.00 0.75 H new ATOM 241 N ASP A 17 -3.040 2.027 -13.650 1.00 0.56 N ATOM 242 CA ASP A 17 -3.207 0.667 -14.174 1.00 0.58 C ATOM 243 C ASP A 17 -3.389 -0.333 -13.033 1.00 0.56 C ATOM 244 O ASP A 17 -4.142 -1.305 -13.144 1.00 0.64 O ATOM 245 CB ASP A 17 -1.978 0.210 -14.970 1.00 0.55 C ATOM 246 CG ASP A 17 -1.564 1.128 -16.114 1.00 1.02 C ATOM 247 OD1 ASP A 17 -2.408 1.387 -16.994 1.00 1.89 O ATOM 248 OD2 ASP A 17 -0.389 1.573 -16.091 1.00 1.86 O ATOM 0 H ASP A 17 -2.141 2.450 -13.879 1.00 0.56 H new ATOM 0 HA ASP A 17 -4.085 0.695 -14.819 1.00 0.58 H new ATOM 0 HB2 ASP A 17 -1.137 0.111 -14.283 1.00 0.55 H new ATOM 0 HB3 ASP A 17 -2.177 -0.782 -15.376 1.00 0.55 H new ATOM 253 N ALA A 18 -2.636 -0.112 -11.952 1.00 0.50 N ATOM 254 CA ALA A 18 -2.608 -0.977 -10.792 1.00 0.38 C ATOM 255 C ALA A 18 -2.905 -0.168 -9.538 1.00 0.26 C ATOM 256 O ALA A 18 -2.670 1.041 -9.481 1.00 0.27 O ATOM 257 CB ALA A 18 -1.241 -1.658 -10.691 1.00 0.42 C ATOM 0 H ALA A 18 -2.018 0.695 -11.867 1.00 0.50 H new ATOM 0 HA ALA A 18 -3.372 -1.748 -10.892 1.00 0.38 H new ATOM 0 HB1 ALA A 18 -1.222 -2.309 -9.817 1.00 0.42 H new ATOM 0 HB2 ALA A 18 -1.062 -2.251 -11.588 1.00 0.42 H new ATOM 0 HB3 ALA A 18 -0.463 -0.900 -10.596 1.00 0.42 H new ATOM 263 N VAL A 19 -3.399 -0.853 -8.512 1.00 0.26 N ATOM 264 CA VAL A 19 -3.880 -0.236 -7.291 1.00 0.27 C ATOM 265 C VAL A 19 -3.250 -1.005 -6.141 1.00 0.24 C ATOM 266 O VAL A 19 -3.510 -2.194 -6.001 1.00 0.44 O ATOM 267 CB VAL A 19 -5.419 -0.316 -7.287 1.00 0.40 C ATOM 268 CG1 VAL A 19 -6.023 0.118 -5.951 1.00 0.55 C ATOM 269 CG2 VAL A 19 -5.992 0.580 -8.394 1.00 0.75 C ATOM 0 H VAL A 19 -3.476 -1.870 -8.510 1.00 0.26 H new ATOM 0 HA VAL A 19 -3.610 0.816 -7.202 1.00 0.27 H new ATOM 0 HB VAL A 19 -5.681 -1.360 -7.457 1.00 0.40 H new ATOM 0 HG11 VAL A 19 -7.109 0.043 -6.001 1.00 0.55 H new ATOM 0 HG12 VAL A 19 -5.651 -0.529 -5.156 1.00 0.55 H new ATOM 0 HG13 VAL A 19 -5.740 1.150 -5.742 1.00 0.55 H new ATOM 0 HG21 VAL A 19 -7.080 0.518 -8.385 1.00 0.75 H new ATOM 0 HG22 VAL A 19 -5.686 1.612 -8.222 1.00 0.75 H new ATOM 0 HG23 VAL A 19 -5.618 0.247 -9.362 1.00 0.75 H new ATOM 279 N VAL A 20 -2.413 -0.364 -5.328 1.00 0.23 N ATOM 280 CA VAL A 20 -1.849 -1.001 -4.147 1.00 0.24 C ATOM 281 C VAL A 20 -2.783 -0.698 -2.979 1.00 0.23 C ATOM 282 O VAL A 20 -3.419 0.354 -2.951 1.00 0.35 O ATOM 283 CB VAL A 20 -0.424 -0.492 -3.872 1.00 0.35 C ATOM 284 CG1 VAL A 20 0.251 -1.280 -2.742 1.00 1.07 C ATOM 285 CG2 VAL A 20 0.472 -0.591 -5.112 1.00 1.14 C ATOM 0 H VAL A 20 -2.111 0.600 -5.469 1.00 0.23 H new ATOM 0 HA VAL A 20 -1.768 -2.078 -4.295 1.00 0.24 H new ATOM 0 HB VAL A 20 -0.537 0.553 -3.583 1.00 0.35 H new ATOM 0 HG11 VAL A 20 1.256 -0.891 -2.577 1.00 1.07 H new ATOM 0 HG12 VAL A 20 -0.333 -1.177 -1.827 1.00 1.07 H new ATOM 0 HG13 VAL A 20 0.310 -2.333 -3.018 1.00 1.07 H new ATOM 0 HG21 VAL A 20 1.469 -0.221 -4.871 1.00 1.14 H new ATOM 0 HG22 VAL A 20 0.539 -1.631 -5.431 1.00 1.14 H new ATOM 0 HG23 VAL A 20 0.047 0.008 -5.917 1.00 1.14 H new ATOM 295 N ASN A 21 -2.861 -1.597 -1.999 1.00 0.23 N ATOM 296 CA ASN A 21 -3.741 -1.454 -0.854 1.00 0.30 C ATOM 297 C ASN A 21 -2.956 -1.696 0.427 1.00 0.33 C ATOM 298 O ASN A 21 -2.054 -2.537 0.439 1.00 0.39 O ATOM 299 CB ASN A 21 -4.867 -2.482 -0.971 1.00 0.49 C ATOM 300 CG ASN A 21 -6.066 -2.098 -0.123 1.00 1.05 C ATOM 301 OD1 ASN A 21 -6.043 -1.110 0.601 1.00 1.89 O ATOM 302 ND2 ASN A 21 -7.138 -2.867 -0.211 1.00 1.76 N ATOM 0 H ASN A 21 -2.306 -2.453 -1.983 1.00 0.23 H new ATOM 0 HA ASN A 21 -4.159 -0.448 -0.828 1.00 0.30 H new ATOM 0 HB2 ASN A 21 -5.172 -2.571 -2.014 1.00 0.49 H new ATOM 0 HB3 ASN A 21 -4.500 -3.461 -0.661 1.00 0.49 H new ATOM 0 HD21 ASN A 21 -7.972 -2.643 0.332 1.00 1.76 H new ATOM 0 HD22 ASN A 21 -7.131 -3.684 -0.822 1.00 1.76 H new ATOM 309 N ALA A 22 -3.319 -1.003 1.508 1.00 0.42 N ATOM 310 CA ALA A 22 -2.811 -1.312 2.832 1.00 0.47 C ATOM 311 C ALA A 22 -3.557 -2.553 3.316 1.00 0.55 C ATOM 312 O ALA A 22 -4.624 -2.454 3.916 1.00 0.99 O ATOM 313 CB ALA A 22 -3.025 -0.114 3.765 1.00 0.53 C ATOM 0 H ALA A 22 -3.970 -0.218 1.484 1.00 0.42 H new ATOM 0 HA ALA A 22 -1.739 -1.511 2.818 1.00 0.47 H new ATOM 0 HB1 ALA A 22 -2.642 -0.352 4.757 1.00 0.53 H new ATOM 0 HB2 ALA A 22 -2.496 0.754 3.370 1.00 0.53 H new ATOM 0 HB3 ALA A 22 -4.090 0.110 3.832 1.00 0.53 H new ATOM 319 N ALA A 23 -3.030 -3.731 2.993 1.00 0.40 N ATOM 320 CA ALA A 23 -3.655 -4.994 3.337 1.00 0.45 C ATOM 321 C ALA A 23 -3.176 -5.454 4.710 1.00 0.59 C ATOM 322 O ALA A 23 -2.066 -5.141 5.134 1.00 0.87 O ATOM 323 CB ALA A 23 -3.320 -6.022 2.263 1.00 0.50 C ATOM 0 H ALA A 23 -2.153 -3.831 2.483 1.00 0.40 H new ATOM 0 HA ALA A 23 -4.738 -4.876 3.384 1.00 0.45 H new ATOM 0 HB1 ALA A 23 -3.786 -6.975 2.514 1.00 0.50 H new ATOM 0 HB2 ALA A 23 -3.695 -5.677 1.299 1.00 0.50 H new ATOM 0 HB3 ALA A 23 -2.239 -6.150 2.207 1.00 0.50 H new ATOM 329 N ASN A 24 -4.020 -6.200 5.423 1.00 0.66 N ATOM 330 CA ASN A 24 -3.794 -6.364 6.850 1.00 0.73 C ATOM 331 C ASN A 24 -2.721 -7.389 7.186 1.00 0.82 C ATOM 332 O ASN A 24 -2.050 -7.222 8.198 1.00 2.26 O ATOM 333 CB ASN A 24 -5.098 -6.696 7.589 1.00 1.07 C ATOM 334 CG ASN A 24 -5.838 -5.423 7.983 1.00 1.56 C ATOM 335 OD1 ASN A 24 -5.733 -4.405 7.316 1.00 2.75 O ATOM 336 ND2 ASN A 24 -6.573 -5.440 9.086 1.00 1.91 N ATOM 0 H ASN A 24 -4.837 -6.683 5.049 1.00 0.66 H new ATOM 0 HA ASN A 24 -3.422 -5.400 7.196 1.00 0.73 H new ATOM 0 HB2 ASN A 24 -5.735 -7.310 6.953 1.00 1.07 H new ATOM 0 HB3 ASN A 24 -4.877 -7.283 8.480 1.00 1.07 H new ATOM 0 HD21 ASN A 24 -7.060 -4.596 9.387 1.00 1.91 H new ATOM 0 HD22 ASN A 24 -6.652 -6.297 9.633 1.00 1.91 H new ATOM 343 N HIS A 25 -2.634 -8.466 6.396 1.00 0.83 N ATOM 344 CA HIS A 25 -1.922 -9.725 6.645 1.00 0.68 C ATOM 345 C HIS A 25 -2.854 -10.828 6.175 1.00 0.80 C ATOM 346 O HIS A 25 -2.624 -11.493 5.166 1.00 1.54 O ATOM 347 CB HIS A 25 -1.517 -9.914 8.124 1.00 0.71 C ATOM 348 CG HIS A 25 -1.171 -11.325 8.535 1.00 0.90 C ATOM 349 ND1 HIS A 25 -1.503 -11.904 9.740 1.00 1.52 N ATOM 350 CD2 HIS A 25 -0.486 -12.256 7.803 1.00 1.15 C ATOM 351 CE1 HIS A 25 -1.030 -13.162 9.727 1.00 1.76 C ATOM 352 NE2 HIS A 25 -0.410 -13.424 8.567 1.00 1.51 N ATOM 0 H HIS A 25 -3.100 -8.480 5.489 1.00 0.83 H new ATOM 0 HA HIS A 25 -0.976 -9.735 6.104 1.00 0.68 H new ATOM 0 HB2 HIS A 25 -0.659 -9.275 8.331 1.00 0.71 H new ATOM 0 HB3 HIS A 25 -2.335 -9.563 8.753 1.00 0.71 H new ATOM 0 HD2 HIS A 25 -0.078 -12.114 6.813 1.00 1.15 H new ATOM 0 HE1 HIS A 25 -1.135 -13.866 10.540 1.00 1.76 H new ATOM 0 HE2 HIS A 25 0.031 -14.303 8.296 1.00 1.51 H new ATOM 360 N ARG A 26 -3.977 -10.970 6.871 1.00 1.04 N ATOM 361 CA ARG A 26 -5.064 -11.739 6.340 1.00 1.22 C ATOM 362 C ARG A 26 -5.694 -10.857 5.286 1.00 1.29 C ATOM 363 O ARG A 26 -6.059 -9.714 5.553 1.00 2.28 O ATOM 364 CB ARG A 26 -6.078 -12.083 7.425 1.00 1.61 C ATOM 365 CG ARG A 26 -5.518 -13.109 8.414 1.00 1.86 C ATOM 366 CD ARG A 26 -6.722 -13.678 9.156 1.00 2.24 C ATOM 367 NE ARG A 26 -6.374 -14.722 10.122 1.00 2.69 N ATOM 368 CZ ARG A 26 -7.309 -15.401 10.797 1.00 3.41 C ATOM 369 NH1 ARG A 26 -6.952 -16.366 11.647 1.00 3.94 N ATOM 370 NH2 ARG A 26 -8.599 -15.111 10.613 1.00 3.89 N ATOM 0 H ARG A 26 -4.144 -10.563 7.791 1.00 1.04 H new ATOM 0 HA ARG A 26 -4.720 -12.689 5.931 1.00 1.22 H new ATOM 0 HB2 ARG A 26 -6.360 -11.177 7.961 1.00 1.61 H new ATOM 0 HB3 ARG A 26 -6.984 -12.477 6.965 1.00 1.61 H new ATOM 0 HG2 ARG A 26 -4.973 -13.896 7.893 1.00 1.86 H new ATOM 0 HG3 ARG A 26 -4.818 -12.642 9.107 1.00 1.86 H new ATOM 0 HD2 ARG A 26 -7.233 -12.868 9.677 1.00 2.24 H new ATOM 0 HD3 ARG A 26 -7.426 -14.086 8.431 1.00 2.24 H new ATOM 0 HE ARG A 26 -5.391 -14.938 10.285 1.00 2.69 H new ATOM 0 HH11 ARG A 26 -5.965 -16.587 11.783 1.00 3.94 H new ATOM 0 HH12 ARG A 26 -7.666 -16.883 12.161 1.00 3.94 H new ATOM 0 HH21 ARG A 26 -8.868 -14.375 9.960 1.00 3.89 H new ATOM 0 HH22 ARG A 26 -9.315 -15.626 11.125 1.00 3.89 H new ATOM 384 N GLY A 27 -5.827 -11.411 4.094 1.00 0.88 N ATOM 385 CA GLY A 27 -6.631 -10.854 3.038 1.00 0.88 C ATOM 386 C GLY A 27 -8.082 -11.136 3.380 1.00 1.18 C ATOM 387 O GLY A 27 -8.689 -12.057 2.841 1.00 1.93 O ATOM 0 H GLY A 27 -5.365 -12.282 3.834 1.00 0.88 H new ATOM 0 HA2 GLY A 27 -6.459 -9.781 2.949 1.00 0.88 H new ATOM 0 HA3 GLY A 27 -6.368 -11.300 2.079 1.00 0.88 H new ATOM 391 N GLN A 28 -8.609 -10.352 4.315 1.00 1.22 N ATOM 392 CA GLN A 28 -10.017 -10.288 4.654 1.00 1.65 C ATOM 393 C GLN A 28 -10.460 -8.851 4.404 1.00 1.53 C ATOM 394 O GLN A 28 -9.638 -7.935 4.419 1.00 1.97 O ATOM 395 CB GLN A 28 -10.238 -10.676 6.126 1.00 2.20 C ATOM 396 CG GLN A 28 -10.078 -12.185 6.370 1.00 2.80 C ATOM 397 CD GLN A 28 -10.375 -12.573 7.822 1.00 3.37 C ATOM 398 OE1 GLN A 28 -9.548 -13.163 8.517 1.00 4.01 O ATOM 399 NE2 GLN A 28 -11.568 -12.267 8.313 1.00 3.91 N ATOM 0 H GLN A 28 -8.039 -9.720 4.877 1.00 1.22 H new ATOM 0 HA GLN A 28 -10.597 -10.986 4.050 1.00 1.65 H new ATOM 0 HB2 GLN A 28 -9.529 -10.133 6.751 1.00 2.20 H new ATOM 0 HB3 GLN A 28 -11.237 -10.366 6.434 1.00 2.20 H new ATOM 0 HG2 GLN A 28 -10.748 -12.731 5.706 1.00 2.80 H new ATOM 0 HG3 GLN A 28 -9.062 -12.486 6.116 1.00 2.80 H new ATOM 0 HE21 GLN A 28 -12.249 -11.778 7.732 1.00 3.91 H new ATOM 0 HE22 GLN A 28 -11.805 -12.521 9.272 1.00 3.91 H new ATOM 408 N VAL A 29 -11.758 -8.635 4.190 1.00 1.81 N ATOM 409 CA VAL A 29 -12.303 -7.290 4.275 1.00 1.79 C ATOM 410 C VAL A 29 -12.125 -6.846 5.725 1.00 1.75 C ATOM 411 O VAL A 29 -12.304 -7.650 6.640 1.00 2.33 O ATOM 412 CB VAL A 29 -13.772 -7.290 3.825 1.00 2.34 C ATOM 413 CG1 VAL A 29 -14.416 -5.907 3.976 1.00 2.85 C ATOM 414 CG2 VAL A 29 -13.846 -7.704 2.350 1.00 2.96 C ATOM 0 H VAL A 29 -12.436 -9.362 3.961 1.00 1.81 H new ATOM 0 HA VAL A 29 -11.790 -6.590 3.615 1.00 1.79 H new ATOM 0 HB VAL A 29 -14.314 -7.992 4.458 1.00 2.34 H new ATOM 0 HG11 VAL A 29 -15.454 -5.951 3.647 1.00 2.85 H new ATOM 0 HG12 VAL A 29 -14.380 -5.601 5.021 1.00 2.85 H new ATOM 0 HG13 VAL A 29 -13.873 -5.184 3.367 1.00 2.85 H new ATOM 0 HG21 VAL A 29 -14.886 -7.706 2.024 1.00 2.96 H new ATOM 0 HG22 VAL A 29 -13.278 -6.998 1.745 1.00 2.96 H new ATOM 0 HG23 VAL A 29 -13.427 -8.703 2.231 1.00 2.96 H new ATOM 424 N GLY A 30 -11.736 -5.590 5.939 1.00 1.87 N ATOM 425 CA GLY A 30 -11.346 -5.120 7.251 1.00 2.13 C ATOM 426 C GLY A 30 -11.454 -3.605 7.328 1.00 1.92 C ATOM 427 O GLY A 30 -12.174 -2.985 6.544 1.00 2.54 O ATOM 0 H GLY A 30 -11.685 -4.880 5.208 1.00 1.87 H new ATOM 0 HA2 GLY A 30 -11.982 -5.575 8.011 1.00 2.13 H new ATOM 0 HA3 GLY A 30 -10.323 -5.429 7.465 1.00 2.13 H new ATOM 431 N ASP A 31 -10.776 -3.033 8.320 1.00 2.00 N ATOM 432 CA ASP A 31 -11.004 -1.670 8.773 1.00 2.22 C ATOM 433 C ASP A 31 -10.149 -0.670 7.987 1.00 2.00 C ATOM 434 O ASP A 31 -9.225 -1.053 7.269 1.00 2.42 O ATOM 435 CB ASP A 31 -10.682 -1.618 10.276 1.00 3.09 C ATOM 436 CG ASP A 31 -11.458 -0.530 11.018 1.00 3.96 C ATOM 437 OD1 ASP A 31 -12.124 0.280 10.337 1.00 4.72 O ATOM 438 OD2 ASP A 31 -11.385 -0.539 12.265 1.00 4.51 O ATOM 0 H ASP A 31 -10.041 -3.515 8.838 1.00 2.00 H new ATOM 0 HA ASP A 31 -12.043 -1.388 8.601 1.00 2.22 H new ATOM 0 HB2 ASP A 31 -10.907 -2.586 10.723 1.00 3.09 H new ATOM 0 HB3 ASP A 31 -9.613 -1.447 10.407 1.00 3.09 H new ATOM 443 N GLY A 32 -10.424 0.625 8.149 1.00 2.20 N ATOM 444 CA GLY A 32 -9.574 1.688 7.649 1.00 2.22 C ATOM 445 C GLY A 32 -9.634 1.811 6.130 1.00 1.70 C ATOM 446 O GLY A 32 -10.610 1.421 5.483 1.00 1.90 O ATOM 0 H GLY A 32 -11.254 0.961 8.637 1.00 2.20 H new ATOM 0 HA2 GLY A 32 -9.875 2.634 8.100 1.00 2.22 H new ATOM 0 HA3 GLY A 32 -8.545 1.502 7.956 1.00 2.22 H new ATOM 450 N VAL A 33 -8.586 2.402 5.552 1.00 1.77 N ATOM 451 CA VAL A 33 -8.451 2.523 4.110 1.00 1.58 C ATOM 452 C VAL A 33 -8.093 1.142 3.566 1.00 1.68 C ATOM 453 O VAL A 33 -6.928 0.797 3.400 1.00 2.96 O ATOM 454 CB VAL A 33 -7.421 3.610 3.759 1.00 2.09 C ATOM 455 CG1 VAL A 33 -7.199 3.709 2.247 1.00 2.43 C ATOM 456 CG2 VAL A 33 -7.932 4.973 4.243 1.00 2.77 C ATOM 0 H VAL A 33 -7.811 2.808 6.076 1.00 1.77 H new ATOM 0 HA VAL A 33 -9.381 2.845 3.642 1.00 1.58 H new ATOM 0 HB VAL A 33 -6.483 3.340 4.244 1.00 2.09 H new ATOM 0 HG11 VAL A 33 -6.465 4.487 2.037 1.00 2.43 H new ATOM 0 HG12 VAL A 33 -6.833 2.754 1.870 1.00 2.43 H new ATOM 0 HG13 VAL A 33 -8.140 3.956 1.756 1.00 2.43 H new ATOM 0 HG21 VAL A 33 -7.203 5.744 3.995 1.00 2.77 H new ATOM 0 HG22 VAL A 33 -8.880 5.200 3.756 1.00 2.77 H new ATOM 0 HG23 VAL A 33 -8.077 4.945 5.323 1.00 2.77 H new ATOM 466 N CYS A 34 -9.131 0.347 3.319 1.00 1.20 N ATOM 467 CA CYS A 34 -9.042 -0.977 2.730 1.00 1.69 C ATOM 468 C CYS A 34 -10.385 -1.265 2.057 1.00 1.44 C ATOM 469 O CYS A 34 -10.463 -1.575 0.868 1.00 1.30 O ATOM 470 CB CYS A 34 -8.731 -2.007 3.830 1.00 2.40 C ATOM 471 SG CYS A 34 -7.765 -3.366 3.124 1.00 3.49 S ATOM 0 H CYS A 34 -10.090 0.621 3.533 1.00 1.20 H new ATOM 0 HA CYS A 34 -8.242 -1.036 1.992 1.00 1.69 H new ATOM 0 HB2 CYS A 34 -8.176 -1.534 4.640 1.00 2.40 H new ATOM 0 HB3 CYS A 34 -9.658 -2.389 4.259 1.00 2.40 H new ATOM 0 HG CYS A 34 -6.499 -3.151 3.328 1.00 3.49 H new ATOM 477 N ARG A 35 -11.462 -1.096 2.832 1.00 1.50 N ATOM 478 CA ARG A 35 -12.851 -1.317 2.439 1.00 1.43 C ATOM 479 C ARG A 35 -13.207 -0.643 1.112 1.00 1.15 C ATOM 480 O ARG A 35 -13.933 -1.229 0.313 1.00 1.07 O ATOM 481 CB ARG A 35 -13.744 -0.829 3.587 1.00 1.78 C ATOM 482 CG ARG A 35 -15.174 -1.376 3.532 1.00 2.24 C ATOM 483 CD ARG A 35 -15.927 -0.819 4.745 1.00 2.62 C ATOM 484 NE ARG A 35 -17.225 -1.477 4.957 1.00 3.48 N ATOM 485 CZ ARG A 35 -18.033 -1.221 5.996 1.00 4.04 C ATOM 486 NH1 ARG A 35 -19.162 -1.911 6.156 1.00 5.09 N ATOM 487 NH2 ARG A 35 -17.707 -0.273 6.876 1.00 4.05 N ATOM 0 H ARG A 35 -11.380 -0.785 3.800 1.00 1.50 H new ATOM 0 HA ARG A 35 -13.011 -2.381 2.263 1.00 1.43 H new ATOM 0 HB2 ARG A 35 -13.291 -1.117 4.535 1.00 1.78 H new ATOM 0 HB3 ARG A 35 -13.780 0.260 3.569 1.00 1.78 H new ATOM 0 HG2 ARG A 35 -15.664 -1.076 2.606 1.00 2.24 H new ATOM 0 HG3 ARG A 35 -15.169 -2.466 3.551 1.00 2.24 H new ATOM 0 HD2 ARG A 35 -15.312 -0.941 5.637 1.00 2.62 H new ATOM 0 HD3 ARG A 35 -16.084 0.251 4.610 1.00 2.62 H new ATOM 0 HE ARG A 35 -17.529 -2.170 4.273 1.00 3.48 H new ATOM 0 HH11 ARG A 35 -19.415 -2.638 5.486 1.00 5.09 H new ATOM 0 HH12 ARG A 35 -19.773 -1.712 6.948 1.00 5.09 H new ATOM 0 HH21 ARG A 35 -16.843 0.257 6.758 1.00 4.05 H new ATOM 0 HH22 ARG A 35 -18.321 -0.078 7.667 1.00 4.05 H new ATOM 501 N ALA A 36 -12.715 0.579 0.876 1.00 1.10 N ATOM 502 CA ALA A 36 -12.971 1.324 -0.355 1.00 0.98 C ATOM 503 C ALA A 36 -12.692 0.452 -1.579 1.00 0.74 C ATOM 504 O ALA A 36 -13.510 0.370 -2.495 1.00 0.79 O ATOM 505 CB ALA A 36 -12.119 2.603 -0.386 1.00 1.00 C ATOM 0 H ALA A 36 -12.124 1.079 1.541 1.00 1.10 H new ATOM 0 HA ALA A 36 -14.022 1.610 -0.380 1.00 0.98 H new ATOM 0 HB1 ALA A 36 -12.318 3.150 -1.307 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -12.372 3.229 0.470 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -11.063 2.338 -0.342 1.00 1.00 H new ATOM 511 N VAL A 37 -11.531 -0.203 -1.581 1.00 0.61 N ATOM 512 CA VAL A 37 -11.108 -1.078 -2.659 1.00 0.53 C ATOM 513 C VAL A 37 -12.061 -2.258 -2.753 1.00 0.56 C ATOM 514 O VAL A 37 -12.550 -2.563 -3.838 1.00 0.65 O ATOM 515 CB VAL A 37 -9.684 -1.567 -2.388 1.00 0.68 C ATOM 516 CG1 VAL A 37 -9.159 -2.430 -3.525 1.00 0.87 C ATOM 517 CG2 VAL A 37 -8.707 -0.405 -2.261 1.00 0.79 C ATOM 0 H VAL A 37 -10.854 -0.136 -0.821 1.00 0.61 H new ATOM 0 HA VAL A 37 -11.122 -0.535 -3.604 1.00 0.53 H new ATOM 0 HB VAL A 37 -9.745 -2.135 -1.460 1.00 0.68 H new ATOM 0 HG11 VAL A 37 -8.145 -2.758 -3.295 1.00 0.87 H new ATOM 0 HG12 VAL A 37 -9.803 -3.301 -3.648 1.00 0.87 H new ATOM 0 HG13 VAL A 37 -9.152 -1.851 -4.448 1.00 0.87 H new ATOM 0 HG21 VAL A 37 -7.706 -0.791 -2.069 1.00 0.79 H new ATOM 0 HG22 VAL A 37 -8.703 0.170 -3.187 1.00 0.79 H new ATOM 0 HG23 VAL A 37 -9.012 0.239 -1.436 1.00 0.79 H new ATOM 527 N ALA A 38 -12.317 -2.926 -1.623 1.00 0.64 N ATOM 528 CA ALA A 38 -13.104 -4.151 -1.578 1.00 0.78 C ATOM 529 C ALA A 38 -14.442 -3.992 -2.295 1.00 0.94 C ATOM 530 O ALA A 38 -14.927 -4.934 -2.911 1.00 1.72 O ATOM 531 CB ALA A 38 -13.329 -4.578 -0.125 1.00 0.93 C ATOM 0 H ALA A 38 -11.978 -2.624 -0.709 1.00 0.64 H new ATOM 0 HA ALA A 38 -12.542 -4.926 -2.099 1.00 0.78 H new ATOM 0 HB1 ALA A 38 -13.918 -5.495 -0.102 1.00 0.93 H new ATOM 0 HB2 ALA A 38 -12.367 -4.753 0.356 1.00 0.93 H new ATOM 0 HB3 ALA A 38 -13.862 -3.790 0.407 1.00 0.93 H new ATOM 537 N ARG A 39 -15.061 -2.812 -2.211 1.00 0.82 N ATOM 538 CA ARG A 39 -16.354 -2.586 -2.849 1.00 0.96 C ATOM 539 C ARG A 39 -16.265 -2.694 -4.373 1.00 1.01 C ATOM 540 O ARG A 39 -17.194 -3.209 -4.985 1.00 1.45 O ATOM 541 CB ARG A 39 -16.943 -1.243 -2.404 1.00 1.10 C ATOM 542 CG ARG A 39 -17.207 -1.256 -0.892 1.00 1.39 C ATOM 543 CD ARG A 39 -17.694 0.104 -0.387 1.00 1.80 C ATOM 544 NE ARG A 39 -19.149 0.262 -0.536 1.00 1.69 N ATOM 545 CZ ARG A 39 -19.836 1.348 -0.157 1.00 2.04 C ATOM 546 NH1 ARG A 39 -21.168 1.348 -0.202 1.00 2.27 N ATOM 547 NH2 ARG A 39 -19.186 2.430 0.275 1.00 2.88 N ATOM 0 H ARG A 39 -14.689 -2.005 -1.710 1.00 0.82 H new ATOM 0 HA ARG A 39 -17.032 -3.375 -2.524 1.00 0.96 H new ATOM 0 HB2 ARG A 39 -16.255 -0.435 -2.654 1.00 1.10 H new ATOM 0 HB3 ARG A 39 -17.871 -1.049 -2.941 1.00 1.10 H new ATOM 0 HG2 ARG A 39 -17.952 -2.017 -0.660 1.00 1.39 H new ATOM 0 HG3 ARG A 39 -16.293 -1.533 -0.366 1.00 1.39 H new ATOM 0 HD2 ARG A 39 -17.423 0.218 0.663 1.00 1.80 H new ATOM 0 HD3 ARG A 39 -17.186 0.897 -0.936 1.00 1.80 H new ATOM 0 HE ARG A 39 -19.670 -0.507 -0.956 1.00 1.69 H new ATOM 0 HH11 ARG A 39 -21.667 0.520 -0.526 1.00 2.27 H new ATOM 0 HH12 ARG A 39 -21.688 2.176 0.087 1.00 2.27 H new ATOM 0 HH21 ARG A 39 -18.167 2.430 0.317 1.00 2.88 H new ATOM 0 HH22 ARG A 39 -19.708 3.257 0.564 1.00 2.88 H new ATOM 561 N LYS A 40 -15.194 -2.197 -5.004 1.00 0.79 N ATOM 562 CA LYS A 40 -15.020 -2.397 -6.444 1.00 0.86 C ATOM 563 C LYS A 40 -14.588 -3.830 -6.726 1.00 0.81 C ATOM 564 O LYS A 40 -15.142 -4.476 -7.610 1.00 1.12 O ATOM 565 CB LYS A 40 -13.989 -1.432 -7.054 1.00 1.04 C ATOM 566 CG LYS A 40 -14.617 -0.130 -7.562 1.00 1.28 C ATOM 567 CD LYS A 40 -14.777 0.936 -6.478 1.00 1.39 C ATOM 568 CE LYS A 40 -15.473 2.140 -7.123 1.00 1.91 C ATOM 569 NZ LYS A 40 -15.443 3.338 -6.258 1.00 2.72 N ATOM 0 H LYS A 40 -14.451 -1.665 -4.551 1.00 0.79 H new ATOM 0 HA LYS A 40 -15.985 -2.193 -6.908 1.00 0.86 H new ATOM 0 HB2 LYS A 40 -13.232 -1.196 -6.306 1.00 1.04 H new ATOM 0 HB3 LYS A 40 -13.478 -1.929 -7.879 1.00 1.04 H new ATOM 0 HG2 LYS A 40 -14.000 0.271 -8.366 1.00 1.28 H new ATOM 0 HG3 LYS A 40 -15.595 -0.351 -7.990 1.00 1.28 H new ATOM 0 HD2 LYS A 40 -15.366 0.552 -5.645 1.00 1.39 H new ATOM 0 HD3 LYS A 40 -13.806 1.224 -6.075 1.00 1.39 H new ATOM 0 HE2 LYS A 40 -14.990 2.369 -8.073 1.00 1.91 H new ATOM 0 HE3 LYS A 40 -16.508 1.882 -7.345 1.00 1.91 H new ATOM 0 HZ1 LYS A 40 -15.926 4.125 -6.738 1.00 2.72 H new ATOM 0 HZ2 LYS A 40 -15.926 3.131 -5.361 1.00 2.72 H new ATOM 0 HZ3 LYS A 40 -14.456 3.603 -6.066 1.00 2.72 H new ATOM 583 N TRP A 41 -13.569 -4.311 -6.019 1.00 0.70 N ATOM 584 CA TRP A 41 -12.871 -5.536 -6.370 1.00 0.69 C ATOM 585 C TRP A 41 -12.872 -6.493 -5.181 1.00 0.57 C ATOM 586 O TRP A 41 -11.823 -6.785 -4.609 1.00 0.62 O ATOM 587 CB TRP A 41 -11.456 -5.168 -6.830 1.00 0.93 C ATOM 588 CG TRP A 41 -11.405 -4.268 -8.029 1.00 1.03 C ATOM 589 CD1 TRP A 41 -11.891 -4.565 -9.256 1.00 1.38 C ATOM 590 CD2 TRP A 41 -10.887 -2.906 -8.125 1.00 0.97 C ATOM 591 NE1 TRP A 41 -11.684 -3.500 -10.108 1.00 1.49 N ATOM 592 CE2 TRP A 41 -11.074 -2.445 -9.462 1.00 1.21 C ATOM 593 CE3 TRP A 41 -10.302 -2.002 -7.213 1.00 0.99 C ATOM 594 CZ2 TRP A 41 -10.686 -1.161 -9.877 1.00 1.26 C ATOM 595 CZ3 TRP A 41 -9.912 -0.711 -7.616 1.00 1.10 C ATOM 596 CH2 TRP A 41 -10.099 -0.291 -8.944 1.00 1.14 C ATOM 0 H TRP A 41 -13.205 -3.856 -5.182 1.00 0.70 H new ATOM 0 HA TRP A 41 -13.373 -6.054 -7.188 1.00 0.69 H new ATOM 0 HB2 TRP A 41 -10.934 -4.683 -6.005 1.00 0.93 H new ATOM 0 HB3 TRP A 41 -10.911 -6.085 -7.056 1.00 0.93 H new ATOM 0 HD1 TRP A 41 -12.369 -5.495 -9.527 1.00 1.38 H new ATOM 0 HE1 TRP A 41 -11.949 -3.494 -11.093 1.00 1.49 H new ATOM 0 HE3 TRP A 41 -10.151 -2.306 -6.188 1.00 0.99 H new ATOM 0 HZ2 TRP A 41 -10.837 -0.847 -10.899 1.00 1.26 H new ATOM 0 HZ3 TRP A 41 -9.466 -0.038 -6.899 1.00 1.10 H new ATOM 0 HH2 TRP A 41 -9.792 0.699 -9.247 1.00 1.14 H new ATOM 607 N PRO A 42 -14.039 -7.037 -4.812 1.00 0.61 N ATOM 608 CA PRO A 42 -14.146 -7.947 -3.687 1.00 0.73 C ATOM 609 C PRO A 42 -13.421 -9.249 -4.007 1.00 0.66 C ATOM 610 O PRO A 42 -12.780 -9.839 -3.141 1.00 0.73 O ATOM 611 CB PRO A 42 -15.647 -8.150 -3.465 1.00 0.95 C ATOM 612 CG PRO A 42 -16.258 -7.877 -4.839 1.00 0.94 C ATOM 613 CD PRO A 42 -15.336 -6.811 -5.429 1.00 0.76 C ATOM 0 HA PRO A 42 -13.681 -7.559 -2.781 1.00 0.73 H new ATOM 0 HB2 PRO A 42 -15.868 -9.161 -3.123 1.00 0.95 H new ATOM 0 HB3 PRO A 42 -16.036 -7.466 -2.711 1.00 0.95 H new ATOM 0 HG2 PRO A 42 -16.280 -8.776 -5.455 1.00 0.94 H new ATOM 0 HG3 PRO A 42 -17.285 -7.521 -4.759 1.00 0.94 H new ATOM 0 HD2 PRO A 42 -15.276 -6.900 -6.514 1.00 0.76 H new ATOM 0 HD3 PRO A 42 -15.705 -5.809 -5.212 1.00 0.76 H new ATOM 621 N GLN A 43 -13.496 -9.703 -5.261 1.00 0.61 N ATOM 622 CA GLN A 43 -12.854 -10.944 -5.656 1.00 0.63 C ATOM 623 C GLN A 43 -11.336 -10.852 -5.466 1.00 0.57 C ATOM 624 O GLN A 43 -10.709 -11.850 -5.124 1.00 0.60 O ATOM 625 CB GLN A 43 -13.269 -11.320 -7.086 1.00 0.77 C ATOM 626 CG GLN A 43 -13.169 -12.835 -7.298 1.00 1.00 C ATOM 627 CD GLN A 43 -13.920 -13.275 -8.550 1.00 1.21 C ATOM 628 OE1 GLN A 43 -15.083 -13.652 -8.469 1.00 2.19 O ATOM 629 NE2 GLN A 43 -13.283 -13.249 -9.713 1.00 1.87 N ATOM 0 H GLN A 43 -13.995 -9.226 -6.012 1.00 0.61 H new ATOM 0 HA GLN A 43 -13.190 -11.754 -5.009 1.00 0.63 H new ATOM 0 HB2 GLN A 43 -14.290 -10.988 -7.273 1.00 0.77 H new ATOM 0 HB3 GLN A 43 -12.630 -10.804 -7.803 1.00 0.77 H new ATOM 0 HG2 GLN A 43 -12.121 -13.123 -7.381 1.00 1.00 H new ATOM 0 HG3 GLN A 43 -13.574 -13.353 -6.429 1.00 1.00 H new ATOM 0 HE21 GLN A 43 -12.315 -12.931 -9.757 1.00 1.87 H new ATOM 0 HE22 GLN A 43 -13.761 -13.547 -10.563 1.00 1.87 H new ATOM 638 N ALA A 44 -10.744 -9.661 -5.617 1.00 0.55 N ATOM 639 CA ALA A 44 -9.320 -9.464 -5.374 1.00 0.57 C ATOM 640 C ALA A 44 -8.933 -9.765 -3.927 1.00 0.65 C ATOM 641 O ALA A 44 -7.804 -10.166 -3.673 1.00 0.87 O ATOM 642 CB ALA A 44 -8.905 -8.034 -5.716 1.00 0.57 C ATOM 0 H ALA A 44 -11.238 -8.817 -5.908 1.00 0.55 H new ATOM 0 HA ALA A 44 -8.795 -10.166 -6.021 1.00 0.57 H new ATOM 0 HB1 ALA A 44 -7.839 -7.910 -5.527 1.00 0.57 H new ATOM 0 HB2 ALA A 44 -9.113 -7.837 -6.768 1.00 0.57 H new ATOM 0 HB3 ALA A 44 -9.467 -7.334 -5.098 1.00 0.57 H new ATOM 648 N PHE A 45 -9.832 -9.536 -2.966 1.00 0.69 N ATOM 649 CA PHE A 45 -9.567 -9.821 -1.559 1.00 0.85 C ATOM 650 C PHE A 45 -9.667 -11.314 -1.260 1.00 0.78 C ATOM 651 O PHE A 45 -9.183 -11.761 -0.223 1.00 1.03 O ATOM 652 CB PHE A 45 -10.560 -9.072 -0.658 1.00 1.37 C ATOM 653 CG PHE A 45 -10.242 -7.611 -0.424 1.00 1.00 C ATOM 654 CD1 PHE A 45 -10.135 -6.718 -1.506 1.00 1.02 C ATOM 655 CD2 PHE A 45 -10.063 -7.138 0.890 1.00 0.99 C ATOM 656 CE1 PHE A 45 -9.844 -5.366 -1.274 1.00 1.15 C ATOM 657 CE2 PHE A 45 -9.794 -5.781 1.123 1.00 1.07 C ATOM 658 CZ PHE A 45 -9.692 -4.894 0.040 1.00 1.21 C ATOM 0 H PHE A 45 -10.759 -9.149 -3.143 1.00 0.69 H new ATOM 0 HA PHE A 45 -8.551 -9.485 -1.353 1.00 0.85 H new ATOM 0 HB2 PHE A 45 -11.554 -9.145 -1.100 1.00 1.37 H new ATOM 0 HB3 PHE A 45 -10.603 -9.577 0.307 1.00 1.37 H new ATOM 0 HD1 PHE A 45 -10.277 -7.074 -2.516 1.00 1.02 H new ATOM 0 HD2 PHE A 45 -10.133 -7.823 1.722 1.00 0.99 H new ATOM 0 HE1 PHE A 45 -9.737 -4.687 -2.107 1.00 1.15 H new ATOM 0 HE2 PHE A 45 -9.666 -5.420 2.133 1.00 1.07 H new ATOM 0 HZ PHE A 45 -9.496 -3.847 0.217 1.00 1.21 H new ATOM 668 N ARG A 46 -10.345 -12.087 -2.109 1.00 0.74 N ATOM 669 CA ARG A 46 -10.755 -13.436 -1.782 1.00 1.02 C ATOM 670 C ARG A 46 -9.509 -14.304 -1.649 1.00 1.12 C ATOM 671 O ARG A 46 -8.868 -14.652 -2.636 1.00 1.98 O ATOM 672 CB ARG A 46 -11.745 -13.929 -2.848 1.00 1.17 C ATOM 673 CG ARG A 46 -12.645 -15.043 -2.306 1.00 1.58 C ATOM 674 CD ARG A 46 -13.717 -15.384 -3.346 1.00 1.92 C ATOM 675 NE ARG A 46 -14.731 -16.299 -2.800 1.00 2.29 N ATOM 676 CZ ARG A 46 -15.749 -16.820 -3.498 1.00 2.92 C ATOM 677 NH1 ARG A 46 -16.636 -17.612 -2.894 1.00 3.32 N ATOM 678 NH2 ARG A 46 -15.880 -16.546 -4.797 1.00 3.81 N ATOM 0 H ARG A 46 -10.622 -11.786 -3.043 1.00 0.74 H new ATOM 0 HA ARG A 46 -11.278 -13.484 -0.827 1.00 1.02 H new ATOM 0 HB2 ARG A 46 -12.360 -13.096 -3.188 1.00 1.17 H new ATOM 0 HB3 ARG A 46 -11.195 -14.294 -3.716 1.00 1.17 H new ATOM 0 HG2 ARG A 46 -12.050 -15.927 -2.078 1.00 1.58 H new ATOM 0 HG3 ARG A 46 -13.114 -14.726 -1.375 1.00 1.58 H new ATOM 0 HD2 ARG A 46 -14.199 -14.467 -3.686 1.00 1.92 H new ATOM 0 HD3 ARG A 46 -13.247 -15.839 -4.218 1.00 1.92 H new ATOM 0 HE ARG A 46 -14.653 -16.556 -1.816 1.00 2.29 H new ATOM 0 HH11 ARG A 46 -16.539 -17.821 -1.900 1.00 3.32 H new ATOM 0 HH12 ARG A 46 -17.411 -18.008 -3.426 1.00 3.32 H new ATOM 0 HH21 ARG A 46 -15.204 -15.939 -5.261 1.00 3.81 H new ATOM 0 HH22 ARG A 46 -16.656 -16.944 -5.326 1.00 3.81 H new ATOM 692 N ASN A 47 -9.168 -14.640 -0.408 1.00 1.49 N ATOM 693 CA ASN A 47 -7.966 -15.362 -0.020 1.00 1.59 C ATOM 694 C ASN A 47 -6.688 -14.636 -0.442 1.00 1.35 C ATOM 695 O ASN A 47 -5.686 -15.255 -0.807 1.00 1.67 O ATOM 696 CB ASN A 47 -7.999 -16.823 -0.501 1.00 2.16 C ATOM 697 CG ASN A 47 -9.204 -17.586 0.031 1.00 2.75 C ATOM 698 OD1 ASN A 47 -9.837 -17.176 0.996 1.00 3.15 O ATOM 699 ND2 ASN A 47 -9.544 -18.709 -0.586 1.00 3.37 N ATOM 0 H ASN A 47 -9.754 -14.403 0.392 1.00 1.49 H new ATOM 0 HA ASN A 47 -7.951 -15.389 1.070 1.00 1.59 H new ATOM 0 HB2 ASN A 47 -8.013 -16.843 -1.591 1.00 2.16 H new ATOM 0 HB3 ASN A 47 -7.086 -17.327 -0.185 1.00 2.16 H new ATOM 0 HD21 ASN A 47 -10.346 -19.248 -0.259 1.00 3.37 H new ATOM 0 HD22 ASN A 47 -9.004 -19.034 -1.388 1.00 3.37 H new ATOM 706 N ALA A 48 -6.661 -13.311 -0.298 1.00 0.94 N ATOM 707 CA ALA A 48 -5.506 -12.508 -0.680 1.00 1.03 C ATOM 708 C ALA A 48 -4.505 -12.376 0.469 1.00 1.08 C ATOM 709 O ALA A 48 -3.737 -11.420 0.519 1.00 1.94 O ATOM 710 CB ALA A 48 -5.990 -11.134 -1.124 1.00 1.01 C ATOM 0 H ALA A 48 -7.436 -12.769 0.085 1.00 0.94 H new ATOM 0 HA ALA A 48 -4.988 -13.005 -1.500 1.00 1.03 H new ATOM 0 HB1 ALA A 48 -5.135 -10.523 -1.413 1.00 1.01 H new ATOM 0 HB2 ALA A 48 -6.662 -11.243 -1.975 1.00 1.01 H new ATOM 0 HB3 ALA A 48 -6.520 -10.652 -0.302 1.00 1.01 H new ATOM 716 N ALA A 49 -4.527 -13.315 1.414 1.00 0.70 N ATOM 717 CA ALA A 49 -3.658 -13.287 2.571 1.00 0.69 C ATOM 718 C ALA A 49 -2.217 -13.538 2.143 1.00 0.63 C ATOM 719 O ALA A 49 -1.964 -14.324 1.224 1.00 0.64 O ATOM 720 CB ALA A 49 -4.152 -14.340 3.566 1.00 0.85 C ATOM 0 H ALA A 49 -5.155 -14.118 1.391 1.00 0.70 H new ATOM 0 HA ALA A 49 -3.683 -12.310 3.053 1.00 0.69 H new ATOM 0 HB1 ALA A 49 -3.511 -14.337 4.447 1.00 0.85 H new ATOM 0 HB2 ALA A 49 -5.176 -14.110 3.861 1.00 0.85 H new ATOM 0 HB3 ALA A 49 -4.122 -15.324 3.099 1.00 0.85 H new ATOM 726 N THR A 50 -1.280 -12.860 2.802 1.00 0.62 N ATOM 727 CA THR A 50 0.141 -12.977 2.532 1.00 0.57 C ATOM 728 C THR A 50 0.878 -12.503 3.790 1.00 0.52 C ATOM 729 O THR A 50 0.304 -11.735 4.562 1.00 0.55 O ATOM 730 CB THR A 50 0.460 -12.163 1.265 1.00 0.62 C ATOM 731 OG1 THR A 50 1.496 -12.772 0.532 1.00 1.04 O ATOM 732 CG2 THR A 50 0.778 -10.687 1.504 1.00 0.50 C ATOM 0 H THR A 50 -1.497 -12.203 3.552 1.00 0.62 H new ATOM 0 HA THR A 50 0.465 -13.998 2.328 1.00 0.57 H new ATOM 0 HB THR A 50 -0.465 -12.168 0.689 1.00 0.62 H new ATOM 0 HG1 THR A 50 1.900 -12.114 -0.071 1.00 1.04 H new ATOM 0 HG21 THR A 50 0.989 -10.201 0.551 1.00 0.50 H new ATOM 0 HG22 THR A 50 -0.076 -10.203 1.977 1.00 0.50 H new ATOM 0 HG23 THR A 50 1.649 -10.603 2.154 1.00 0.50 H new ATOM 740 N PRO A 51 2.102 -12.973 4.060 1.00 0.48 N ATOM 741 CA PRO A 51 2.774 -12.674 5.311 1.00 0.45 C ATOM 742 C PRO A 51 3.182 -11.202 5.383 1.00 0.39 C ATOM 743 O PRO A 51 3.184 -10.478 4.387 1.00 0.42 O ATOM 744 CB PRO A 51 3.981 -13.615 5.360 1.00 0.50 C ATOM 745 CG PRO A 51 4.290 -13.861 3.885 1.00 0.53 C ATOM 746 CD PRO A 51 2.910 -13.847 3.231 1.00 0.54 C ATOM 0 HA PRO A 51 2.123 -12.830 6.171 1.00 0.45 H new ATOM 0 HB2 PRO A 51 4.825 -13.161 5.878 1.00 0.50 H new ATOM 0 HB3 PRO A 51 3.748 -14.542 5.883 1.00 0.50 H new ATOM 0 HG2 PRO A 51 4.938 -13.086 3.475 1.00 0.53 H new ATOM 0 HG3 PRO A 51 4.797 -14.814 3.734 1.00 0.53 H new ATOM 0 HD2 PRO A 51 2.964 -13.478 2.207 1.00 0.54 H new ATOM 0 HD3 PRO A 51 2.486 -14.850 3.187 1.00 0.54 H new ATOM 754 N VAL A 52 3.548 -10.759 6.583 1.00 0.37 N ATOM 755 CA VAL A 52 4.058 -9.417 6.800 1.00 0.37 C ATOM 756 C VAL A 52 5.314 -9.208 5.951 1.00 0.33 C ATOM 757 O VAL A 52 6.077 -10.145 5.723 1.00 0.36 O ATOM 758 CB VAL A 52 4.311 -9.227 8.304 1.00 0.47 C ATOM 759 CG1 VAL A 52 4.958 -7.879 8.612 1.00 0.77 C ATOM 760 CG2 VAL A 52 2.984 -9.303 9.074 1.00 0.71 C ATOM 0 H VAL A 52 3.498 -11.325 7.430 1.00 0.37 H new ATOM 0 HA VAL A 52 3.337 -8.662 6.488 1.00 0.37 H new ATOM 0 HB VAL A 52 4.989 -10.023 8.613 1.00 0.47 H new ATOM 0 HG11 VAL A 52 5.118 -7.789 9.686 1.00 0.77 H new ATOM 0 HG12 VAL A 52 5.915 -7.808 8.096 1.00 0.77 H new ATOM 0 HG13 VAL A 52 4.303 -7.076 8.274 1.00 0.77 H new ATOM 0 HG21 VAL A 52 3.173 -9.167 10.139 1.00 0.71 H new ATOM 0 HG22 VAL A 52 2.313 -8.519 8.722 1.00 0.71 H new ATOM 0 HG23 VAL A 52 2.523 -10.277 8.909 1.00 0.71 H new ATOM 770 N GLY A 53 5.518 -7.984 5.460 1.00 0.31 N ATOM 771 CA GLY A 53 6.729 -7.626 4.750 1.00 0.29 C ATOM 772 C GLY A 53 6.723 -8.113 3.307 1.00 0.28 C ATOM 773 O GLY A 53 7.785 -8.208 2.698 1.00 0.30 O ATOM 0 H GLY A 53 4.846 -7.222 5.547 1.00 0.31 H new ATOM 0 HA2 GLY A 53 6.848 -6.543 4.764 1.00 0.29 H new ATOM 0 HA3 GLY A 53 7.589 -8.048 5.269 1.00 0.29 H new ATOM 777 N THR A 54 5.552 -8.398 2.730 1.00 0.28 N ATOM 778 CA THR A 54 5.472 -8.837 1.345 1.00 0.29 C ATOM 779 C THR A 54 4.297 -8.157 0.639 1.00 0.24 C ATOM 780 O THR A 54 3.625 -7.297 1.217 1.00 0.24 O ATOM 781 CB THR A 54 5.410 -10.371 1.266 1.00 0.35 C ATOM 782 OG1 THR A 54 4.185 -10.858 1.751 1.00 0.59 O ATOM 783 CG2 THR A 54 6.538 -11.056 2.039 1.00 0.53 C ATOM 0 H THR A 54 4.651 -8.331 3.204 1.00 0.28 H new ATOM 0 HA THR A 54 6.377 -8.535 0.818 1.00 0.29 H new ATOM 0 HB THR A 54 5.521 -10.609 0.208 1.00 0.35 H new ATOM 0 HG1 THR A 54 4.061 -10.566 2.678 1.00 0.59 H new ATOM 0 HG21 THR A 54 6.439 -12.137 1.945 1.00 0.53 H new ATOM 0 HG22 THR A 54 7.500 -10.743 1.633 1.00 0.53 H new ATOM 0 HG23 THR A 54 6.480 -10.777 3.091 1.00 0.53 H new ATOM 791 N ALA A 55 4.070 -8.530 -0.623 1.00 0.25 N ATOM 792 CA ALA A 55 3.009 -8.021 -1.466 1.00 0.25 C ATOM 793 C ALA A 55 2.438 -9.206 -2.234 1.00 0.32 C ATOM 794 O ALA A 55 3.195 -10.095 -2.623 1.00 0.51 O ATOM 795 CB ALA A 55 3.567 -6.972 -2.437 1.00 0.30 C ATOM 0 H ALA A 55 4.650 -9.224 -1.096 1.00 0.25 H new ATOM 0 HA ALA A 55 2.233 -7.541 -0.870 1.00 0.25 H new ATOM 0 HB1 ALA A 55 2.762 -6.595 -3.067 1.00 0.30 H new ATOM 0 HB2 ALA A 55 4.002 -6.148 -1.872 1.00 0.30 H new ATOM 0 HB3 ALA A 55 4.334 -7.427 -3.063 1.00 0.30 H new ATOM 801 N LYS A 56 1.127 -9.220 -2.477 1.00 0.35 N ATOM 802 CA LYS A 56 0.476 -10.285 -3.225 1.00 0.44 C ATOM 803 C LYS A 56 -0.415 -9.640 -4.268 1.00 0.39 C ATOM 804 O LYS A 56 -1.385 -8.977 -3.905 1.00 0.40 O ATOM 805 CB LYS A 56 -0.333 -11.159 -2.259 1.00 0.55 C ATOM 806 CG LYS A 56 -0.945 -12.391 -2.942 1.00 0.85 C ATOM 807 CD LYS A 56 -1.766 -13.181 -1.917 1.00 0.86 C ATOM 808 CE LYS A 56 -2.103 -14.590 -2.409 1.00 1.26 C ATOM 809 NZ LYS A 56 -2.828 -15.364 -1.375 1.00 2.40 N ATOM 0 H LYS A 56 0.490 -8.490 -2.158 1.00 0.35 H new ATOM 0 HA LYS A 56 1.204 -10.926 -3.722 1.00 0.44 H new ATOM 0 HB2 LYS A 56 0.313 -11.485 -1.443 1.00 0.55 H new ATOM 0 HB3 LYS A 56 -1.130 -10.561 -1.816 1.00 0.55 H new ATOM 0 HG2 LYS A 56 -1.579 -12.083 -3.774 1.00 0.85 H new ATOM 0 HG3 LYS A 56 -0.158 -13.020 -3.357 1.00 0.85 H new ATOM 0 HD2 LYS A 56 -1.210 -13.248 -0.982 1.00 0.86 H new ATOM 0 HD3 LYS A 56 -2.689 -12.643 -1.701 1.00 0.86 H new ATOM 0 HE2 LYS A 56 -2.711 -14.526 -3.311 1.00 1.26 H new ATOM 0 HE3 LYS A 56 -1.185 -15.112 -2.680 1.00 1.26 H new ATOM 0 HZ1 LYS A 56 -2.649 -16.379 -1.513 1.00 2.40 H new ATOM 0 HZ2 LYS A 56 -2.496 -15.079 -0.432 1.00 2.40 H new ATOM 0 HZ3 LYS A 56 -3.848 -15.178 -1.454 1.00 2.40 H new ATOM 823 N THR A 57 -0.107 -9.814 -5.550 1.00 0.43 N ATOM 824 CA THR A 57 -1.017 -9.342 -6.574 1.00 0.33 C ATOM 825 C THR A 57 -2.152 -10.348 -6.709 1.00 0.30 C ATOM 826 O THR A 57 -1.930 -11.557 -6.655 1.00 0.41 O ATOM 827 CB THR A 57 -0.280 -9.159 -7.902 1.00 0.47 C ATOM 828 OG1 THR A 57 0.805 -8.292 -7.686 1.00 0.72 O ATOM 829 CG2 THR A 57 -1.175 -8.530 -8.976 1.00 0.57 C ATOM 0 H THR A 57 0.741 -10.265 -5.892 1.00 0.43 H new ATOM 0 HA THR A 57 -1.425 -8.371 -6.294 1.00 0.33 H new ATOM 0 HB THR A 57 0.038 -10.142 -8.250 1.00 0.47 H new ATOM 0 HG1 THR A 57 1.638 -8.808 -7.668 1.00 0.72 H new ATOM 0 HG21 THR A 57 -0.610 -8.419 -9.901 1.00 0.57 H new ATOM 0 HG22 THR A 57 -2.038 -9.172 -9.153 1.00 0.57 H new ATOM 0 HG23 THR A 57 -1.515 -7.551 -8.639 1.00 0.57 H new ATOM 837 N VAL A 58 -3.362 -9.848 -6.936 1.00 0.30 N ATOM 838 CA VAL A 58 -4.484 -10.625 -7.417 1.00 0.34 C ATOM 839 C VAL A 58 -5.034 -9.817 -8.588 1.00 0.43 C ATOM 840 O VAL A 58 -5.085 -8.589 -8.533 1.00 0.98 O ATOM 841 CB VAL A 58 -5.513 -10.853 -6.294 1.00 0.47 C ATOM 842 CG1 VAL A 58 -6.600 -11.831 -6.757 1.00 1.17 C ATOM 843 CG2 VAL A 58 -4.848 -11.442 -5.041 1.00 1.12 C ATOM 0 H VAL A 58 -3.589 -8.865 -6.785 1.00 0.30 H new ATOM 0 HA VAL A 58 -4.207 -11.629 -7.738 1.00 0.34 H new ATOM 0 HB VAL A 58 -5.949 -9.883 -6.055 1.00 0.47 H new ATOM 0 HG11 VAL A 58 -7.320 -11.982 -5.953 1.00 1.17 H new ATOM 0 HG12 VAL A 58 -7.110 -11.422 -7.629 1.00 1.17 H new ATOM 0 HG13 VAL A 58 -6.143 -12.785 -7.019 1.00 1.17 H new ATOM 0 HG21 VAL A 58 -5.600 -11.592 -4.266 1.00 1.12 H new ATOM 0 HG22 VAL A 58 -4.387 -12.398 -5.289 1.00 1.12 H new ATOM 0 HG23 VAL A 58 -4.084 -10.755 -4.677 1.00 1.12 H new ATOM 853 N LYS A 59 -5.393 -10.478 -9.684 1.00 0.40 N ATOM 854 CA LYS A 59 -6.061 -9.800 -10.782 1.00 0.41 C ATOM 855 C LYS A 59 -7.541 -9.935 -10.488 1.00 0.44 C ATOM 856 O LYS A 59 -7.996 -11.060 -10.293 1.00 0.57 O ATOM 857 CB LYS A 59 -5.682 -10.465 -12.108 1.00 0.55 C ATOM 858 CG LYS A 59 -4.238 -10.097 -12.470 1.00 0.90 C ATOM 859 CD LYS A 59 -3.636 -11.065 -13.491 1.00 1.53 C ATOM 860 CE LYS A 59 -4.427 -11.044 -14.801 1.00 1.40 C ATOM 861 NZ LYS A 59 -3.820 -11.929 -15.820 1.00 2.12 N ATOM 0 H LYS A 59 -5.233 -11.474 -9.832 1.00 0.40 H new ATOM 0 HA LYS A 59 -5.775 -8.752 -10.871 1.00 0.41 H new ATOM 0 HB2 LYS A 59 -5.783 -11.547 -12.026 1.00 0.55 H new ATOM 0 HB3 LYS A 59 -6.360 -10.140 -12.897 1.00 0.55 H new ATOM 0 HG2 LYS A 59 -4.212 -9.084 -12.872 1.00 0.90 H new ATOM 0 HG3 LYS A 59 -3.627 -10.097 -11.567 1.00 0.90 H new ATOM 0 HD2 LYS A 59 -2.598 -10.795 -13.685 1.00 1.53 H new ATOM 0 HD3 LYS A 59 -3.632 -12.075 -13.081 1.00 1.53 H new ATOM 0 HE2 LYS A 59 -5.454 -11.357 -14.612 1.00 1.40 H new ATOM 0 HE3 LYS A 59 -4.471 -10.024 -15.184 1.00 1.40 H new ATOM 0 HZ1 LYS A 59 -4.383 -11.889 -16.694 1.00 2.12 H new ATOM 0 HZ2 LYS A 59 -2.849 -11.614 -16.019 1.00 2.12 H new ATOM 0 HZ3 LYS A 59 -3.801 -12.906 -15.464 1.00 2.12 H new ATOM 875 N CYS A 60 -8.282 -8.829 -10.390 1.00 0.44 N ATOM 876 CA CYS A 60 -9.706 -8.981 -10.112 1.00 0.54 C ATOM 877 C CYS A 60 -10.392 -9.413 -11.400 1.00 0.74 C ATOM 878 O CYS A 60 -11.043 -10.452 -11.453 1.00 1.66 O ATOM 879 CB CYS A 60 -10.321 -7.692 -9.557 1.00 0.62 C ATOM 880 SG CYS A 60 -11.893 -8.119 -8.752 1.00 1.18 S ATOM 0 H CYS A 60 -7.943 -7.872 -10.492 1.00 0.44 H new ATOM 0 HA CYS A 60 -9.848 -9.738 -9.340 1.00 0.54 H new ATOM 0 HB2 CYS A 60 -9.643 -7.223 -8.844 1.00 0.62 H new ATOM 0 HB3 CYS A 60 -10.487 -6.973 -10.359 1.00 0.62 H new ATOM 0 HG CYS A 60 -12.857 -8.058 -9.622 1.00 1.18 H new ATOM 886 N ASP A 61 -10.202 -8.595 -12.435 1.00 0.65 N ATOM 887 CA ASP A 61 -10.817 -8.763 -13.737 1.00 0.64 C ATOM 888 C ASP A 61 -9.735 -8.432 -14.759 1.00 0.59 C ATOM 889 O ASP A 61 -9.078 -9.328 -15.281 1.00 0.71 O ATOM 890 CB ASP A 61 -12.054 -7.858 -13.866 1.00 0.74 C ATOM 891 CG ASP A 61 -13.139 -8.207 -12.848 1.00 1.44 C ATOM 892 OD1 ASP A 61 -14.032 -9.004 -13.205 1.00 1.77 O ATOM 893 OD2 ASP A 61 -13.054 -7.653 -11.726 1.00 2.67 O ATOM 0 H ASP A 61 -9.597 -7.775 -12.382 1.00 0.65 H new ATOM 0 HA ASP A 61 -11.180 -9.778 -13.896 1.00 0.64 H new ATOM 0 HB2 ASP A 61 -11.756 -6.818 -13.733 1.00 0.74 H new ATOM 0 HB3 ASP A 61 -12.462 -7.946 -14.873 1.00 0.74 H new ATOM 898 N GLU A 62 -9.471 -7.140 -14.973 1.00 0.54 N ATOM 899 CA GLU A 62 -8.472 -6.681 -15.928 1.00 0.62 C ATOM 900 C GLU A 62 -7.655 -5.550 -15.295 1.00 0.69 C ATOM 901 O GLU A 62 -7.279 -4.580 -15.944 1.00 1.30 O ATOM 902 CB GLU A 62 -9.180 -6.273 -17.230 1.00 0.76 C ATOM 903 CG GLU A 62 -8.256 -6.497 -18.435 1.00 1.34 C ATOM 904 CD GLU A 62 -8.908 -6.121 -19.769 1.00 1.40 C ATOM 905 OE1 GLU A 62 -8.166 -6.120 -20.776 1.00 2.23 O ATOM 906 OE2 GLU A 62 -10.132 -5.860 -19.777 1.00 1.63 O ATOM 0 H GLU A 62 -9.949 -6.384 -14.484 1.00 0.54 H new ATOM 0 HA GLU A 62 -7.767 -7.472 -16.183 1.00 0.62 H new ATOM 0 HB2 GLU A 62 -10.094 -6.854 -17.352 1.00 0.76 H new ATOM 0 HB3 GLU A 62 -9.473 -5.224 -17.179 1.00 0.76 H new ATOM 0 HG2 GLU A 62 -7.347 -5.910 -18.303 1.00 1.34 H new ATOM 0 HG3 GLU A 62 -7.957 -7.545 -18.466 1.00 1.34 H new ATOM 913 N THR A 63 -7.361 -5.680 -13.999 1.00 0.44 N ATOM 914 CA THR A 63 -6.468 -4.776 -13.292 1.00 0.41 C ATOM 915 C THR A 63 -5.630 -5.593 -12.322 1.00 0.34 C ATOM 916 O THR A 63 -6.069 -6.649 -11.855 1.00 0.44 O ATOM 917 CB THR A 63 -7.249 -3.656 -12.586 1.00 0.51 C ATOM 918 OG1 THR A 63 -6.359 -2.775 -11.927 1.00 0.71 O ATOM 919 CG2 THR A 63 -8.237 -4.190 -11.543 1.00 0.80 C ATOM 0 H THR A 63 -7.742 -6.422 -13.412 1.00 0.44 H new ATOM 0 HA THR A 63 -5.806 -4.277 -14.000 1.00 0.41 H new ATOM 0 HB THR A 63 -7.808 -3.140 -13.366 1.00 0.51 H new ATOM 0 HG1 THR A 63 -5.721 -2.409 -12.575 1.00 0.71 H new ATOM 0 HG21 THR A 63 -8.760 -3.355 -11.077 1.00 0.80 H new ATOM 0 HG22 THR A 63 -8.960 -4.845 -12.029 1.00 0.80 H new ATOM 0 HG23 THR A 63 -7.695 -4.750 -10.781 1.00 0.80 H new ATOM 927 N TYR A 64 -4.423 -5.106 -12.037 1.00 0.33 N ATOM 928 CA TYR A 64 -3.488 -5.736 -11.139 1.00 0.34 C ATOM 929 C TYR A 64 -3.591 -4.979 -9.826 1.00 0.33 C ATOM 930 O TYR A 64 -3.162 -3.830 -9.738 1.00 0.62 O ATOM 931 CB TYR A 64 -2.085 -5.635 -11.748 1.00 0.48 C ATOM 932 CG TYR A 64 -2.030 -6.102 -13.190 1.00 0.48 C ATOM 933 CD1 TYR A 64 -1.974 -7.475 -13.483 1.00 0.57 C ATOM 934 CD2 TYR A 64 -2.099 -5.164 -14.240 1.00 0.58 C ATOM 935 CE1 TYR A 64 -1.975 -7.911 -14.819 1.00 0.67 C ATOM 936 CE2 TYR A 64 -2.102 -5.593 -15.578 1.00 0.71 C ATOM 937 CZ TYR A 64 -2.040 -6.974 -15.872 1.00 0.72 C ATOM 938 OH TYR A 64 -2.053 -7.422 -17.159 1.00 0.91 O ATOM 0 H TYR A 64 -4.070 -4.239 -12.441 1.00 0.33 H new ATOM 0 HA TYR A 64 -3.698 -6.793 -10.974 1.00 0.34 H new ATOM 0 HB2 TYR A 64 -1.745 -4.601 -11.694 1.00 0.48 H new ATOM 0 HB3 TYR A 64 -1.393 -6.230 -11.152 1.00 0.48 H new ATOM 0 HD1 TYR A 64 -1.930 -8.196 -12.680 1.00 0.57 H new ATOM 0 HD2 TYR A 64 -2.150 -4.109 -14.015 1.00 0.58 H new ATOM 0 HE1 TYR A 64 -1.926 -8.967 -15.041 1.00 0.67 H new ATOM 0 HE2 TYR A 64 -2.152 -4.870 -16.379 1.00 0.71 H new ATOM 0 HH TYR A 64 -2.101 -6.658 -17.771 1.00 0.91 H new ATOM 948 N ILE A 65 -4.174 -5.594 -8.802 1.00 0.30 N ATOM 949 CA ILE A 65 -4.254 -4.970 -7.503 1.00 0.27 C ATOM 950 C ILE A 65 -3.286 -5.708 -6.595 1.00 0.27 C ATOM 951 O ILE A 65 -3.150 -6.925 -6.682 1.00 0.35 O ATOM 952 CB ILE A 65 -5.701 -4.918 -7.004 1.00 0.30 C ATOM 953 CG1 ILE A 65 -5.652 -4.772 -5.483 1.00 0.38 C ATOM 954 CG2 ILE A 65 -6.559 -6.126 -7.401 1.00 0.35 C ATOM 955 CD1 ILE A 65 -6.958 -4.269 -4.927 1.00 0.72 C ATOM 0 H ILE A 65 -4.595 -6.522 -8.855 1.00 0.30 H new ATOM 0 HA ILE A 65 -3.955 -3.922 -7.531 1.00 0.27 H new ATOM 0 HB ILE A 65 -6.189 -4.069 -7.484 1.00 0.30 H new ATOM 0 HG12 ILE A 65 -5.412 -5.735 -5.033 1.00 0.38 H new ATOM 0 HG13 ILE A 65 -4.852 -4.084 -5.209 1.00 0.38 H new ATOM 0 HG21 ILE A 65 -7.567 -6.002 -7.005 1.00 0.35 H new ATOM 0 HG22 ILE A 65 -6.603 -6.200 -8.488 1.00 0.35 H new ATOM 0 HG23 ILE A 65 -6.118 -7.035 -6.993 1.00 0.35 H new ATOM 0 HD11 ILE A 65 -6.882 -4.179 -3.843 1.00 0.72 H new ATOM 0 HD12 ILE A 65 -7.185 -3.293 -5.357 1.00 0.72 H new ATOM 0 HD13 ILE A 65 -7.754 -4.970 -5.178 1.00 0.72 H new ATOM 967 N ILE A 66 -2.572 -4.956 -5.764 1.00 0.24 N ATOM 968 CA ILE A 66 -1.404 -5.431 -5.054 1.00 0.21 C ATOM 969 C ILE A 66 -1.655 -5.180 -3.574 1.00 0.32 C ATOM 970 O ILE A 66 -1.807 -4.041 -3.147 1.00 0.69 O ATOM 971 CB ILE A 66 -0.153 -4.714 -5.594 1.00 0.26 C ATOM 972 CG1 ILE A 66 -0.076 -4.810 -7.134 1.00 0.55 C ATOM 973 CG2 ILE A 66 1.095 -5.322 -4.943 1.00 0.36 C ATOM 974 CD1 ILE A 66 1.105 -4.051 -7.747 1.00 0.77 C ATOM 0 H ILE A 66 -2.799 -3.981 -5.566 1.00 0.24 H new ATOM 0 HA ILE A 66 -1.227 -6.497 -5.200 1.00 0.21 H new ATOM 0 HB ILE A 66 -0.212 -3.656 -5.340 1.00 0.26 H new ATOM 0 HG12 ILE A 66 -0.008 -5.860 -7.419 1.00 0.55 H new ATOM 0 HG13 ILE A 66 -1.003 -4.424 -7.559 1.00 0.55 H new ATOM 0 HG21 ILE A 66 1.985 -4.819 -5.321 1.00 0.36 H new ATOM 0 HG22 ILE A 66 1.039 -5.196 -3.862 1.00 0.36 H new ATOM 0 HG23 ILE A 66 1.150 -6.384 -5.183 1.00 0.36 H new ATOM 0 HD11 ILE A 66 1.089 -4.167 -8.831 1.00 0.77 H new ATOM 0 HD12 ILE A 66 1.028 -2.993 -7.494 1.00 0.77 H new ATOM 0 HD13 ILE A 66 2.039 -4.452 -7.353 1.00 0.77 H new ATOM 986 N HIS A 67 -1.738 -6.237 -2.780 1.00 0.26 N ATOM 987 CA HIS A 67 -2.023 -6.129 -1.365 1.00 0.28 C ATOM 988 C HIS A 67 -0.708 -6.182 -0.608 1.00 0.30 C ATOM 989 O HIS A 67 -0.045 -7.214 -0.595 1.00 0.39 O ATOM 990 CB HIS A 67 -2.984 -7.260 -0.992 1.00 0.34 C ATOM 991 CG HIS A 67 -4.406 -6.984 -1.428 1.00 0.98 C ATOM 992 ND1 HIS A 67 -5.477 -7.830 -1.249 1.00 1.97 N ATOM 993 CD2 HIS A 67 -4.881 -5.856 -2.049 1.00 2.17 C ATOM 994 CE1 HIS A 67 -6.569 -7.219 -1.751 1.00 2.41 C ATOM 995 NE2 HIS A 67 -6.259 -6.001 -2.225 1.00 2.60 N ATOM 0 H HIS A 67 -1.608 -7.195 -3.104 1.00 0.26 H new ATOM 0 HA HIS A 67 -2.506 -5.187 -1.104 1.00 0.28 H new ATOM 0 HB2 HIS A 67 -2.642 -8.188 -1.449 1.00 0.34 H new ATOM 0 HB3 HIS A 67 -2.962 -7.409 0.087 1.00 0.34 H new ATOM 0 HD1 HIS A 67 -5.449 -8.753 -0.815 1.00 1.97 H new ATOM 0 HD2 HIS A 67 -4.291 -5.003 -2.350 1.00 2.17 H new ATOM 0 HE1 HIS A 67 -7.559 -7.650 -1.770 1.00 2.41 H new ATOM 1003 N ALA A 68 -0.313 -5.050 -0.024 1.00 0.29 N ATOM 1004 CA ALA A 68 0.951 -4.896 0.678 1.00 0.29 C ATOM 1005 C ALA A 68 0.695 -4.999 2.176 1.00 0.28 C ATOM 1006 O ALA A 68 -0.204 -4.324 2.672 1.00 0.39 O ATOM 1007 CB ALA A 68 1.525 -3.517 0.343 1.00 0.31 C ATOM 0 H ALA A 68 -0.878 -4.201 -0.029 1.00 0.29 H new ATOM 0 HA ALA A 68 1.657 -5.671 0.378 1.00 0.29 H new ATOM 0 HB1 ALA A 68 2.475 -3.383 0.861 1.00 0.31 H new ATOM 0 HB2 ALA A 68 1.684 -3.441 -0.733 1.00 0.31 H new ATOM 0 HB3 ALA A 68 0.825 -2.744 0.662 1.00 0.31 H new ATOM 1013 N VAL A 69 1.462 -5.815 2.901 1.00 0.26 N ATOM 1014 CA VAL A 69 1.197 -6.049 4.316 1.00 0.27 C ATOM 1015 C VAL A 69 2.256 -5.349 5.153 1.00 0.26 C ATOM 1016 O VAL A 69 3.416 -5.762 5.172 1.00 0.28 O ATOM 1017 CB VAL A 69 1.141 -7.551 4.608 1.00 0.31 C ATOM 1018 CG1 VAL A 69 0.890 -7.806 6.099 1.00 0.73 C ATOM 1019 CG2 VAL A 69 -0.005 -8.176 3.809 1.00 0.60 C ATOM 0 H VAL A 69 2.267 -6.321 2.532 1.00 0.26 H new ATOM 0 HA VAL A 69 0.225 -5.633 4.581 1.00 0.27 H new ATOM 0 HB VAL A 69 2.096 -7.994 4.325 1.00 0.31 H new ATOM 0 HG11 VAL A 69 0.854 -8.880 6.283 1.00 0.73 H new ATOM 0 HG12 VAL A 69 1.696 -7.364 6.684 1.00 0.73 H new ATOM 0 HG13 VAL A 69 -0.059 -7.356 6.390 1.00 0.73 H new ATOM 0 HG21 VAL A 69 -0.050 -9.246 4.013 1.00 0.60 H new ATOM 0 HG22 VAL A 69 -0.947 -7.711 4.100 1.00 0.60 H new ATOM 0 HG23 VAL A 69 0.165 -8.016 2.744 1.00 0.60 H new ATOM 1029 N GLY A 70 1.838 -4.313 5.878 1.00 0.32 N ATOM 1030 CA GLY A 70 2.718 -3.598 6.782 1.00 0.35 C ATOM 1031 C GLY A 70 2.825 -4.347 8.108 1.00 0.34 C ATOM 1032 O GLY A 70 1.867 -4.990 8.535 1.00 0.35 O ATOM 0 H GLY A 70 0.884 -3.952 5.851 1.00 0.32 H new ATOM 0 HA2 GLY A 70 3.706 -3.493 6.334 1.00 0.35 H new ATOM 0 HA3 GLY A 70 2.337 -2.591 6.953 1.00 0.35 H new ATOM 1036 N PRO A 71 3.975 -4.266 8.783 1.00 0.37 N ATOM 1037 CA PRO A 71 4.153 -4.834 10.104 1.00 0.37 C ATOM 1038 C PRO A 71 3.406 -3.993 11.130 1.00 0.47 C ATOM 1039 O PRO A 71 3.319 -2.771 11.015 1.00 0.58 O ATOM 1040 CB PRO A 71 5.658 -4.797 10.361 1.00 0.38 C ATOM 1041 CG PRO A 71 6.117 -3.599 9.535 1.00 0.39 C ATOM 1042 CD PRO A 71 5.175 -3.589 8.336 1.00 0.37 C ATOM 0 HA PRO A 71 3.763 -5.849 10.177 1.00 0.37 H new ATOM 0 HB2 PRO A 71 5.884 -4.668 11.420 1.00 0.38 H new ATOM 0 HB3 PRO A 71 6.145 -5.718 10.041 1.00 0.38 H new ATOM 0 HG2 PRO A 71 6.047 -2.672 10.104 1.00 0.39 H new ATOM 0 HG3 PRO A 71 7.156 -3.704 9.224 1.00 0.39 H new ATOM 0 HD2 PRO A 71 4.955 -2.570 8.018 1.00 0.37 H new ATOM 0 HD3 PRO A 71 5.620 -4.101 7.483 1.00 0.37 H new ATOM 1050 N ASN A 72 2.877 -4.644 12.160 1.00 0.69 N ATOM 1051 CA ASN A 72 2.249 -3.953 13.270 1.00 0.82 C ATOM 1052 C ASN A 72 3.307 -3.630 14.318 1.00 0.69 C ATOM 1053 O ASN A 72 3.643 -4.479 15.136 1.00 0.75 O ATOM 1054 CB ASN A 72 1.066 -4.760 13.848 1.00 1.22 C ATOM 1055 CG ASN A 72 1.299 -6.261 14.040 1.00 1.52 C ATOM 1056 OD1 ASN A 72 2.385 -6.793 13.852 1.00 2.42 O ATOM 1057 ND2 ASN A 72 0.245 -6.999 14.362 1.00 2.02 N ATOM 0 H ASN A 72 2.873 -5.660 12.245 1.00 0.69 H new ATOM 0 HA ASN A 72 1.819 -3.016 12.917 1.00 0.82 H new ATOM 0 HB2 ASN A 72 0.797 -4.329 14.812 1.00 1.22 H new ATOM 0 HB3 ASN A 72 0.208 -4.628 13.189 1.00 1.22 H new ATOM 0 HD21 ASN A 72 0.339 -8.011 14.453 1.00 2.02 H new ATOM 0 HD22 ASN A 72 -0.660 -6.555 14.519 1.00 2.02 H new ATOM 1064 N PHE A 73 3.778 -2.377 14.358 1.00 0.66 N ATOM 1065 CA PHE A 73 4.690 -1.894 15.403 1.00 0.72 C ATOM 1066 C PHE A 73 4.155 -2.183 16.807 1.00 0.79 C ATOM 1067 O PHE A 73 4.919 -2.395 17.740 1.00 1.00 O ATOM 1068 CB PHE A 73 4.952 -0.393 15.237 1.00 0.92 C ATOM 1069 CG PHE A 73 6.179 -0.074 14.417 1.00 1.46 C ATOM 1070 CD1 PHE A 73 7.365 0.303 15.076 1.00 1.39 C ATOM 1071 CD2 PHE A 73 6.151 -0.172 13.014 1.00 2.99 C ATOM 1072 CE1 PHE A 73 8.523 0.581 14.336 1.00 2.12 C ATOM 1073 CE2 PHE A 73 7.316 0.092 12.275 1.00 3.97 C ATOM 1074 CZ PHE A 73 8.498 0.458 12.939 1.00 3.40 C ATOM 0 H PHE A 73 3.537 -1.668 13.665 1.00 0.66 H new ATOM 0 HA PHE A 73 5.629 -2.436 15.288 1.00 0.72 H new ATOM 0 HB2 PHE A 73 4.083 0.068 14.767 1.00 0.92 H new ATOM 0 HB3 PHE A 73 5.058 0.059 16.223 1.00 0.92 H new ATOM 0 HD1 PHE A 73 7.383 0.378 16.153 1.00 1.39 H new ATOM 0 HD2 PHE A 73 5.238 -0.449 12.508 1.00 2.99 H new ATOM 0 HE1 PHE A 73 9.428 0.888 14.838 1.00 2.12 H new ATOM 0 HE2 PHE A 73 7.303 0.014 11.198 1.00 3.97 H new ATOM 0 HZ PHE A 73 9.396 0.646 12.369 1.00 3.40 H new ATOM 1084 N ASN A 74 2.833 -2.230 16.958 1.00 0.77 N ATOM 1085 CA ASN A 74 2.149 -2.458 18.229 1.00 0.91 C ATOM 1086 C ASN A 74 2.468 -3.838 18.803 1.00 0.90 C ATOM 1087 O ASN A 74 2.125 -4.126 19.946 1.00 1.11 O ATOM 1088 CB ASN A 74 0.631 -2.306 18.036 1.00 0.98 C ATOM 1089 CG ASN A 74 -0.070 -1.845 19.309 1.00 1.68 C ATOM 1090 OD1 ASN A 74 -0.469 -0.692 19.410 1.00 2.83 O ATOM 1091 ND2 ASN A 74 -0.245 -2.716 20.291 1.00 2.36 N ATOM 0 H ASN A 74 2.189 -2.107 16.176 1.00 0.77 H new ATOM 0 HA ASN A 74 2.505 -1.714 18.941 1.00 0.91 H new ATOM 0 HB2 ASN A 74 0.438 -1.589 17.238 1.00 0.98 H new ATOM 0 HB3 ASN A 74 0.210 -3.259 17.717 1.00 0.98 H new ATOM 0 HD21 ASN A 74 -0.718 -2.430 21.148 1.00 2.36 H new ATOM 0 HD22 ASN A 74 0.094 -3.673 20.190 1.00 2.36 H new ATOM 1098 N ASN A 75 3.064 -4.719 18.001 1.00 0.74 N ATOM 1099 CA ASN A 75 3.416 -6.062 18.402 1.00 0.80 C ATOM 1100 C ASN A 75 4.758 -6.470 17.791 1.00 0.74 C ATOM 1101 O ASN A 75 5.023 -7.664 17.681 1.00 0.82 O ATOM 1102 CB ASN A 75 2.287 -7.006 17.964 1.00 0.92 C ATOM 1103 CG ASN A 75 2.313 -8.317 18.738 1.00 1.24 C ATOM 1104 OD1 ASN A 75 2.657 -8.354 19.912 1.00 1.89 O ATOM 1105 ND2 ASN A 75 1.881 -9.408 18.119 1.00 2.01 N ATOM 0 H ASN A 75 3.317 -4.505 17.036 1.00 0.74 H new ATOM 0 HA ASN A 75 3.530 -6.116 19.485 1.00 0.80 H new ATOM 0 HB2 ASN A 75 1.325 -6.515 18.112 1.00 0.92 H new ATOM 0 HB3 ASN A 75 2.379 -7.212 16.898 1.00 0.92 H new ATOM 0 HD21 ASN A 75 1.832 -10.294 18.622 1.00 2.01 H new ATOM 0 HD22 ASN A 75 1.598 -9.361 17.140 1.00 2.01 H new ATOM 1112 N THR A 76 5.623 -5.519 17.400 1.00 0.69 N ATOM 1113 CA THR A 76 6.978 -5.916 16.993 1.00 0.68 C ATOM 1114 C THR A 76 8.031 -4.899 17.435 1.00 0.72 C ATOM 1115 O THR A 76 7.703 -3.785 17.838 1.00 0.95 O ATOM 1116 CB THR A 76 7.016 -6.225 15.484 1.00 0.65 C ATOM 1117 OG1 THR A 76 8.168 -6.953 15.111 1.00 0.80 O ATOM 1118 CG2 THR A 76 6.997 -4.970 14.607 1.00 0.61 C ATOM 0 H THR A 76 5.423 -4.520 17.358 1.00 0.69 H new ATOM 0 HA THR A 76 7.240 -6.838 17.512 1.00 0.68 H new ATOM 0 HB THR A 76 6.112 -6.811 15.318 1.00 0.65 H new ATOM 0 HG1 THR A 76 8.147 -7.127 14.147 1.00 0.80 H new ATOM 0 HG21 THR A 76 7.026 -5.260 13.557 1.00 0.61 H new ATOM 0 HG22 THR A 76 6.087 -4.403 14.802 1.00 0.61 H new ATOM 0 HG23 THR A 76 7.865 -4.352 14.837 1.00 0.61 H new ATOM 1126 N SER A 77 9.303 -5.296 17.394 1.00 0.73 N ATOM 1127 CA SER A 77 10.423 -4.453 17.776 1.00 0.83 C ATOM 1128 C SER A 77 10.675 -3.451 16.656 1.00 0.76 C ATOM 1129 O SER A 77 10.487 -3.783 15.491 1.00 0.78 O ATOM 1130 CB SER A 77 11.668 -5.323 17.973 1.00 0.98 C ATOM 1131 OG SER A 77 11.370 -6.456 18.763 1.00 1.95 O ATOM 0 H SER A 77 9.583 -6.228 17.089 1.00 0.73 H new ATOM 0 HA SER A 77 10.201 -3.928 18.705 1.00 0.83 H new ATOM 0 HB2 SER A 77 12.052 -5.641 17.004 1.00 0.98 H new ATOM 0 HB3 SER A 77 12.454 -4.738 18.451 1.00 0.98 H new ATOM 0 HG SER A 77 11.008 -7.166 18.193 1.00 1.95 H new ATOM 1137 N GLU A 78 11.146 -2.240 16.964 1.00 0.79 N ATOM 1138 CA GLU A 78 11.315 -1.224 15.928 1.00 0.75 C ATOM 1139 C GLU A 78 12.226 -1.696 14.795 1.00 0.64 C ATOM 1140 O GLU A 78 11.957 -1.402 13.638 1.00 0.58 O ATOM 1141 CB GLU A 78 11.772 0.112 16.523 1.00 0.90 C ATOM 1142 CG GLU A 78 13.121 0.027 17.248 1.00 1.93 C ATOM 1143 CD GLU A 78 13.574 1.400 17.749 1.00 2.31 C ATOM 1144 OE1 GLU A 78 14.778 1.697 17.589 1.00 3.08 O ATOM 1145 OE2 GLU A 78 12.712 2.128 18.290 1.00 2.81 O ATOM 0 H GLU A 78 11.412 -1.945 17.903 1.00 0.79 H new ATOM 0 HA GLU A 78 10.335 -1.057 15.480 1.00 0.75 H new ATOM 0 HB2 GLU A 78 11.843 0.851 15.725 1.00 0.90 H new ATOM 0 HB3 GLU A 78 11.015 0.468 17.221 1.00 0.90 H new ATOM 0 HG2 GLU A 78 13.040 -0.661 18.090 1.00 1.93 H new ATOM 0 HG3 GLU A 78 13.873 -0.382 16.573 1.00 1.93 H new ATOM 1152 N ALA A 79 13.257 -2.484 15.106 1.00 0.69 N ATOM 1153 CA ALA A 79 14.119 -3.100 14.108 1.00 0.67 C ATOM 1154 C ALA A 79 13.299 -3.884 13.086 1.00 0.57 C ATOM 1155 O ALA A 79 13.389 -3.656 11.883 1.00 0.53 O ATOM 1156 CB ALA A 79 15.085 -4.045 14.819 1.00 0.77 C ATOM 0 H ALA A 79 13.515 -2.711 16.066 1.00 0.69 H new ATOM 0 HA ALA A 79 14.665 -2.320 13.578 1.00 0.67 H new ATOM 0 HB1 ALA A 79 15.739 -4.516 14.085 1.00 0.77 H new ATOM 0 HB2 ALA A 79 15.686 -3.482 15.533 1.00 0.77 H new ATOM 0 HB3 ALA A 79 14.520 -4.813 15.347 1.00 0.77 H new ATOM 1162 N GLU A 80 12.505 -4.830 13.585 1.00 0.56 N ATOM 1163 CA GLU A 80 11.643 -5.684 12.786 1.00 0.52 C ATOM 1164 C GLU A 80 10.615 -4.833 12.044 1.00 0.44 C ATOM 1165 O GLU A 80 10.187 -5.186 10.952 1.00 0.41 O ATOM 1166 CB GLU A 80 10.916 -6.667 13.711 1.00 0.66 C ATOM 1167 CG GLU A 80 11.853 -7.595 14.495 1.00 0.99 C ATOM 1168 CD GLU A 80 11.080 -8.421 15.533 1.00 1.45 C ATOM 1169 OE1 GLU A 80 10.485 -7.806 16.453 1.00 2.48 O ATOM 1170 OE2 GLU A 80 11.106 -9.664 15.418 1.00 1.72 O ATOM 0 H GLU A 80 12.446 -5.025 14.584 1.00 0.56 H new ATOM 0 HA GLU A 80 12.245 -6.232 12.061 1.00 0.52 H new ATOM 0 HB2 GLU A 80 10.306 -6.103 14.417 1.00 0.66 H new ATOM 0 HB3 GLU A 80 10.235 -7.274 13.115 1.00 0.66 H new ATOM 0 HG2 GLU A 80 12.367 -8.264 13.805 1.00 0.99 H new ATOM 0 HG3 GLU A 80 12.619 -7.003 14.996 1.00 0.99 H new ATOM 1177 N GLY A 81 10.199 -3.716 12.639 1.00 0.50 N ATOM 1178 CA GLY A 81 9.041 -2.970 12.178 1.00 0.45 C ATOM 1179 C GLY A 81 9.410 -2.113 10.979 1.00 0.44 C ATOM 1180 O GLY A 81 8.764 -2.158 9.938 1.00 0.40 O ATOM 0 H GLY A 81 10.658 -3.307 13.453 1.00 0.50 H new ATOM 0 HA2 GLY A 81 8.240 -3.658 11.909 1.00 0.45 H new ATOM 0 HA3 GLY A 81 8.663 -2.339 12.982 1.00 0.45 H new ATOM 1184 N ASP A 82 10.454 -1.306 11.115 1.00 0.58 N ATOM 1185 CA ASP A 82 10.938 -0.472 10.023 1.00 0.59 C ATOM 1186 C ASP A 82 11.458 -1.374 8.903 1.00 0.54 C ATOM 1187 O ASP A 82 11.228 -1.106 7.724 1.00 0.53 O ATOM 1188 CB ASP A 82 12.014 0.505 10.518 1.00 0.71 C ATOM 1189 CG ASP A 82 11.400 1.752 11.162 1.00 1.36 C ATOM 1190 OD1 ASP A 82 11.505 1.916 12.396 1.00 2.31 O ATOM 1191 OD2 ASP A 82 10.747 2.552 10.454 1.00 2.26 O ATOM 0 H ASP A 82 10.986 -1.211 11.980 1.00 0.58 H new ATOM 0 HA ASP A 82 10.121 0.134 9.632 1.00 0.59 H new ATOM 0 HB2 ASP A 82 12.656 0.002 11.241 1.00 0.71 H new ATOM 0 HB3 ASP A 82 12.647 0.802 9.682 1.00 0.71 H new ATOM 1196 N ARG A 83 12.139 -2.472 9.256 1.00 0.56 N ATOM 1197 CA ARG A 83 12.637 -3.413 8.262 1.00 0.57 C ATOM 1198 C ARG A 83 11.486 -3.975 7.436 1.00 0.48 C ATOM 1199 O ARG A 83 11.511 -3.877 6.213 1.00 0.50 O ATOM 1200 CB ARG A 83 13.438 -4.527 8.944 1.00 0.65 C ATOM 1201 CG ARG A 83 14.175 -5.399 7.926 1.00 0.82 C ATOM 1202 CD ARG A 83 14.868 -6.547 8.663 1.00 1.38 C ATOM 1203 NE ARG A 83 15.924 -7.158 7.843 1.00 1.76 N ATOM 1204 CZ ARG A 83 16.581 -8.281 8.156 1.00 2.26 C ATOM 1205 NH1 ARG A 83 17.599 -8.692 7.396 1.00 2.77 N ATOM 1206 NH2 ARG A 83 16.226 -8.987 9.229 1.00 2.78 N ATOM 0 H ARG A 83 12.354 -2.724 10.221 1.00 0.56 H new ATOM 0 HA ARG A 83 13.306 -2.889 7.580 1.00 0.57 H new ATOM 0 HB2 ARG A 83 14.157 -4.087 9.635 1.00 0.65 H new ATOM 0 HB3 ARG A 83 12.766 -5.148 9.536 1.00 0.65 H new ATOM 0 HG2 ARG A 83 13.474 -5.793 7.190 1.00 0.82 H new ATOM 0 HG3 ARG A 83 14.908 -4.804 7.381 1.00 0.82 H new ATOM 0 HD2 ARG A 83 15.298 -6.176 9.593 1.00 1.38 H new ATOM 0 HD3 ARG A 83 14.132 -7.304 8.932 1.00 1.38 H new ATOM 0 HE ARG A 83 16.174 -6.692 6.971 1.00 1.76 H new ATOM 0 HH11 ARG A 83 17.876 -8.150 6.577 1.00 2.77 H new ATOM 0 HH12 ARG A 83 18.100 -9.548 7.634 1.00 2.77 H new ATOM 0 HH21 ARG A 83 15.452 -8.672 9.814 1.00 2.78 H new ATOM 0 HH22 ARG A 83 16.728 -9.843 9.466 1.00 2.78 H new ATOM 1220 N ASP A 84 10.489 -4.579 8.077 1.00 0.42 N ATOM 1221 CA ASP A 84 9.420 -5.257 7.357 1.00 0.37 C ATOM 1222 C ASP A 84 8.529 -4.253 6.635 1.00 0.30 C ATOM 1223 O ASP A 84 7.933 -4.584 5.616 1.00 0.29 O ATOM 1224 CB ASP A 84 8.594 -6.161 8.277 1.00 0.41 C ATOM 1225 CG ASP A 84 9.252 -7.525 8.495 1.00 0.71 C ATOM 1226 OD1 ASP A 84 8.512 -8.442 8.912 1.00 1.26 O ATOM 1227 OD2 ASP A 84 10.466 -7.645 8.204 1.00 1.96 O ATOM 0 H ASP A 84 10.401 -4.612 9.093 1.00 0.42 H new ATOM 0 HA ASP A 84 9.888 -5.899 6.611 1.00 0.37 H new ATOM 0 HB2 ASP A 84 8.457 -5.668 9.240 1.00 0.41 H new ATOM 0 HB3 ASP A 84 7.602 -6.303 7.848 1.00 0.41 H new ATOM 1232 N LEU A 85 8.443 -3.009 7.106 1.00 0.30 N ATOM 1233 CA LEU A 85 7.765 -1.956 6.378 1.00 0.29 C ATOM 1234 C LEU A 85 8.462 -1.736 5.034 1.00 0.26 C ATOM 1235 O LEU A 85 7.809 -1.624 3.996 1.00 0.27 O ATOM 1236 CB LEU A 85 7.769 -0.705 7.259 1.00 0.33 C ATOM 1237 CG LEU A 85 7.078 0.501 6.626 1.00 0.37 C ATOM 1238 CD1 LEU A 85 5.623 0.178 6.283 1.00 0.41 C ATOM 1239 CD2 LEU A 85 7.130 1.647 7.635 1.00 0.47 C ATOM 0 H LEU A 85 8.841 -2.712 7.997 1.00 0.30 H new ATOM 0 HA LEU A 85 6.731 -2.218 6.155 1.00 0.29 H new ATOM 0 HB2 LEU A 85 7.279 -0.937 8.205 1.00 0.33 H new ATOM 0 HB3 LEU A 85 8.800 -0.440 7.491 1.00 0.33 H new ATOM 0 HG LEU A 85 7.584 0.774 5.700 1.00 0.37 H new ATOM 0 HD11 LEU A 85 5.152 1.052 5.834 1.00 0.41 H new ATOM 0 HD12 LEU A 85 5.591 -0.653 5.579 1.00 0.41 H new ATOM 0 HD13 LEU A 85 5.087 -0.096 7.192 1.00 0.41 H new ATOM 0 HD21 LEU A 85 6.643 2.526 7.212 1.00 0.47 H new ATOM 0 HD22 LEU A 85 6.615 1.351 8.549 1.00 0.47 H new ATOM 0 HD23 LEU A 85 8.169 1.883 7.865 1.00 0.47 H new ATOM 1251 N ALA A 86 9.797 -1.702 5.038 1.00 0.25 N ATOM 1252 CA ALA A 86 10.564 -1.566 3.812 1.00 0.24 C ATOM 1253 C ALA A 86 10.397 -2.813 2.946 1.00 0.23 C ATOM 1254 O ALA A 86 10.336 -2.707 1.725 1.00 0.26 O ATOM 1255 CB ALA A 86 12.037 -1.306 4.136 1.00 0.28 C ATOM 0 H ALA A 86 10.364 -1.768 5.883 1.00 0.25 H new ATOM 0 HA ALA A 86 10.189 -0.712 3.248 1.00 0.24 H new ATOM 0 HB1 ALA A 86 12.601 -1.206 3.209 1.00 0.28 H new ATOM 0 HB2 ALA A 86 12.125 -0.387 4.716 1.00 0.28 H new ATOM 0 HB3 ALA A 86 12.435 -2.140 4.715 1.00 0.28 H new ATOM 1261 N ALA A 87 10.321 -3.990 3.568 1.00 0.24 N ATOM 1262 CA ALA A 87 10.136 -5.257 2.881 1.00 0.26 C ATOM 1263 C ALA A 87 8.843 -5.232 2.074 1.00 0.24 C ATOM 1264 O ALA A 87 8.853 -5.544 0.887 1.00 0.27 O ATOM 1265 CB ALA A 87 10.127 -6.396 3.901 1.00 0.29 C ATOM 0 H ALA A 87 10.388 -4.085 4.581 1.00 0.24 H new ATOM 0 HA ALA A 87 10.961 -5.420 2.188 1.00 0.26 H new ATOM 0 HB1 ALA A 87 9.988 -7.346 3.385 1.00 0.29 H new ATOM 0 HB2 ALA A 87 11.075 -6.410 4.439 1.00 0.29 H new ATOM 0 HB3 ALA A 87 9.311 -6.245 4.608 1.00 0.29 H new ATOM 1271 N ALA A 88 7.741 -4.821 2.705 1.00 0.25 N ATOM 1272 CA ALA A 88 6.438 -4.714 2.076 1.00 0.26 C ATOM 1273 C ALA A 88 6.542 -3.821 0.847 1.00 0.26 C ATOM 1274 O ALA A 88 6.192 -4.235 -0.256 1.00 0.29 O ATOM 1275 CB ALA A 88 5.422 -4.168 3.082 1.00 0.28 C ATOM 0 H ALA A 88 7.738 -4.549 3.688 1.00 0.25 H new ATOM 0 HA ALA A 88 6.096 -5.698 1.755 1.00 0.26 H new ATOM 0 HB1 ALA A 88 4.445 -4.089 2.606 1.00 0.28 H new ATOM 0 HB2 ALA A 88 5.356 -4.843 3.935 1.00 0.28 H new ATOM 0 HB3 ALA A 88 5.740 -3.183 3.422 1.00 0.28 H new ATOM 1281 N TYR A 89 7.050 -2.598 1.018 1.00 0.25 N ATOM 1282 CA TYR A 89 7.177 -1.680 -0.101 1.00 0.26 C ATOM 1283 C TYR A 89 8.063 -2.247 -1.216 1.00 0.26 C ATOM 1284 O TYR A 89 7.791 -2.027 -2.394 1.00 0.28 O ATOM 1285 CB TYR A 89 7.712 -0.339 0.398 1.00 0.27 C ATOM 1286 CG TYR A 89 6.761 0.461 1.277 1.00 0.36 C ATOM 1287 CD1 TYR A 89 5.429 0.683 0.874 1.00 0.55 C ATOM 1288 CD2 TYR A 89 7.234 1.068 2.456 1.00 0.45 C ATOM 1289 CE1 TYR A 89 4.602 1.559 1.595 1.00 0.78 C ATOM 1290 CE2 TYR A 89 6.404 1.924 3.203 1.00 0.63 C ATOM 1291 CZ TYR A 89 5.088 2.188 2.760 1.00 0.80 C ATOM 1292 OH TYR A 89 4.280 3.054 3.430 1.00 1.10 O ATOM 0 H TYR A 89 7.375 -2.230 1.912 1.00 0.25 H new ATOM 0 HA TYR A 89 6.188 -1.534 -0.536 1.00 0.26 H new ATOM 0 HB2 TYR A 89 8.630 -0.519 0.957 1.00 0.27 H new ATOM 0 HB3 TYR A 89 7.979 0.270 -0.466 1.00 0.27 H new ATOM 0 HD1 TYR A 89 5.041 0.175 0.003 1.00 0.55 H new ATOM 0 HD2 TYR A 89 8.243 0.875 2.790 1.00 0.45 H new ATOM 0 HE1 TYR A 89 3.594 1.751 1.258 1.00 0.78 H new ATOM 0 HE2 TYR A 89 6.771 2.378 4.112 1.00 0.63 H new ATOM 0 HH TYR A 89 4.163 2.745 4.353 1.00 1.10 H new ATOM 1302 N ARG A 90 9.121 -2.983 -0.879 1.00 0.28 N ATOM 1303 CA ARG A 90 9.998 -3.585 -1.875 1.00 0.28 C ATOM 1304 C ARG A 90 9.270 -4.672 -2.652 1.00 0.27 C ATOM 1305 O ARG A 90 9.443 -4.785 -3.863 1.00 0.28 O ATOM 1306 CB ARG A 90 11.271 -4.094 -1.195 1.00 0.31 C ATOM 1307 CG ARG A 90 12.299 -4.551 -2.233 1.00 0.36 C ATOM 1308 CD ARG A 90 13.639 -4.801 -1.540 1.00 0.96 C ATOM 1309 NE ARG A 90 14.651 -5.288 -2.488 1.00 1.20 N ATOM 1310 CZ ARG A 90 15.908 -5.610 -2.161 1.00 1.54 C ATOM 1311 NH1 ARG A 90 16.745 -6.070 -3.091 1.00 2.04 N ATOM 1312 NH2 ARG A 90 16.323 -5.473 -0.901 1.00 1.92 N ATOM 0 H ARG A 90 9.391 -3.176 0.085 1.00 0.28 H new ATOM 0 HA ARG A 90 10.293 -2.833 -2.607 1.00 0.28 H new ATOM 0 HB2 ARG A 90 11.699 -3.305 -0.577 1.00 0.31 H new ATOM 0 HB3 ARG A 90 11.027 -4.922 -0.530 1.00 0.31 H new ATOM 0 HG2 ARG A 90 11.956 -5.461 -2.726 1.00 0.36 H new ATOM 0 HG3 ARG A 90 12.413 -3.793 -3.008 1.00 0.36 H new ATOM 0 HD2 ARG A 90 13.988 -3.879 -1.075 1.00 0.96 H new ATOM 0 HD3 ARG A 90 13.506 -5.530 -0.741 1.00 0.96 H new ATOM 0 HE ARG A 90 14.376 -5.388 -3.465 1.00 1.20 H new ATOM 0 HH11 ARG A 90 16.428 -6.177 -4.054 1.00 2.04 H new ATOM 0 HH12 ARG A 90 17.703 -6.315 -2.839 1.00 2.04 H new ATOM 0 HH21 ARG A 90 15.683 -5.123 -0.188 1.00 1.92 H new ATOM 0 HH22 ARG A 90 17.281 -5.718 -0.650 1.00 1.92 H new ATOM 1326 N ALA A 91 8.454 -5.474 -1.975 1.00 0.29 N ATOM 1327 CA ALA A 91 7.674 -6.506 -2.624 1.00 0.31 C ATOM 1328 C ALA A 91 6.687 -5.867 -3.595 1.00 0.33 C ATOM 1329 O ALA A 91 6.527 -6.361 -4.707 1.00 0.37 O ATOM 1330 CB ALA A 91 6.973 -7.361 -1.570 1.00 0.32 C ATOM 0 H ALA A 91 8.320 -5.422 -0.965 1.00 0.29 H new ATOM 0 HA ALA A 91 8.325 -7.163 -3.200 1.00 0.31 H new ATOM 0 HB1 ALA A 91 6.387 -8.137 -2.062 1.00 0.32 H new ATOM 0 HB2 ALA A 91 7.718 -7.824 -0.923 1.00 0.32 H new ATOM 0 HB3 ALA A 91 6.313 -6.733 -0.972 1.00 0.32 H new ATOM 1336 N VAL A 92 6.054 -4.753 -3.209 1.00 0.33 N ATOM 1337 CA VAL A 92 5.193 -4.007 -4.116 1.00 0.34 C ATOM 1338 C VAL A 92 6.004 -3.653 -5.352 1.00 0.39 C ATOM 1339 O VAL A 92 5.657 -4.085 -6.443 1.00 0.48 O ATOM 1340 CB VAL A 92 4.603 -2.760 -3.437 1.00 0.37 C ATOM 1341 CG1 VAL A 92 3.829 -1.884 -4.427 1.00 0.63 C ATOM 1342 CG2 VAL A 92 3.639 -3.160 -2.323 1.00 0.60 C ATOM 0 H VAL A 92 6.126 -4.353 -2.273 1.00 0.33 H new ATOM 0 HA VAL A 92 4.339 -4.620 -4.406 1.00 0.34 H new ATOM 0 HB VAL A 92 5.447 -2.198 -3.036 1.00 0.37 H new ATOM 0 HG11 VAL A 92 3.429 -1.014 -3.907 1.00 0.63 H new ATOM 0 HG12 VAL A 92 4.498 -1.555 -5.222 1.00 0.63 H new ATOM 0 HG13 VAL A 92 3.009 -2.459 -4.857 1.00 0.63 H new ATOM 0 HG21 VAL A 92 3.232 -2.264 -1.855 1.00 0.60 H new ATOM 0 HG22 VAL A 92 2.825 -3.752 -2.741 1.00 0.60 H new ATOM 0 HG23 VAL A 92 4.170 -3.750 -1.576 1.00 0.60 H new ATOM 1352 N ALA A 93 7.099 -2.908 -5.183 1.00 0.39 N ATOM 1353 CA ALA A 93 7.966 -2.455 -6.260 1.00 0.39 C ATOM 1354 C ALA A 93 8.335 -3.579 -7.226 1.00 0.38 C ATOM 1355 O ALA A 93 8.393 -3.373 -8.437 1.00 0.41 O ATOM 1356 CB ALA A 93 9.208 -1.806 -5.650 1.00 0.38 C ATOM 0 H ALA A 93 7.411 -2.597 -4.263 1.00 0.39 H new ATOM 0 HA ALA A 93 7.426 -1.721 -6.858 1.00 0.39 H new ATOM 0 HB1 ALA A 93 9.867 -1.462 -6.447 1.00 0.38 H new ATOM 0 HB2 ALA A 93 8.910 -0.958 -5.034 1.00 0.38 H new ATOM 0 HB3 ALA A 93 9.734 -2.535 -5.034 1.00 0.38 H new ATOM 1362 N ALA A 94 8.562 -4.777 -6.698 1.00 0.38 N ATOM 1363 CA ALA A 94 8.845 -5.928 -7.531 1.00 0.38 C ATOM 1364 C ALA A 94 7.640 -6.199 -8.422 1.00 0.39 C ATOM 1365 O ALA A 94 7.777 -6.189 -9.641 1.00 0.36 O ATOM 1366 CB ALA A 94 9.206 -7.143 -6.680 1.00 0.39 C ATOM 0 H ALA A 94 8.554 -4.971 -5.697 1.00 0.38 H new ATOM 0 HA ALA A 94 9.710 -5.721 -8.162 1.00 0.38 H new ATOM 0 HB1 ALA A 94 9.414 -7.993 -7.329 1.00 0.39 H new ATOM 0 HB2 ALA A 94 10.089 -6.919 -6.082 1.00 0.39 H new ATOM 0 HB3 ALA A 94 8.373 -7.386 -6.020 1.00 0.39 H new ATOM 1372 N GLU A 95 6.461 -6.408 -7.830 1.00 0.45 N ATOM 1373 CA GLU A 95 5.223 -6.647 -8.553 1.00 0.44 C ATOM 1374 C GLU A 95 4.935 -5.553 -9.592 1.00 0.37 C ATOM 1375 O GLU A 95 4.419 -5.869 -10.658 1.00 0.35 O ATOM 1376 CB GLU A 95 4.052 -6.831 -7.576 1.00 0.47 C ATOM 1377 CG GLU A 95 4.212 -8.053 -6.658 1.00 0.77 C ATOM 1378 CD GLU A 95 4.226 -9.377 -7.425 1.00 1.05 C ATOM 1379 OE1 GLU A 95 3.124 -9.919 -7.665 1.00 1.84 O ATOM 1380 OE2 GLU A 95 5.334 -9.851 -7.767 1.00 1.70 O ATOM 0 H GLU A 95 6.345 -6.415 -6.817 1.00 0.45 H new ATOM 0 HA GLU A 95 5.343 -7.574 -9.113 1.00 0.44 H new ATOM 0 HB2 GLU A 95 3.955 -5.935 -6.963 1.00 0.47 H new ATOM 0 HB3 GLU A 95 3.127 -6.930 -8.143 1.00 0.47 H new ATOM 0 HG2 GLU A 95 5.139 -7.957 -6.092 1.00 0.77 H new ATOM 0 HG3 GLU A 95 3.397 -8.067 -5.935 1.00 0.77 H new ATOM 1387 N ILE A 96 5.293 -4.285 -9.352 1.00 0.38 N ATOM 1388 CA ILE A 96 5.143 -3.211 -10.327 1.00 0.38 C ATOM 1389 C ILE A 96 5.897 -3.588 -11.596 1.00 0.34 C ATOM 1390 O ILE A 96 5.332 -3.595 -12.692 1.00 0.35 O ATOM 1391 CB ILE A 96 5.658 -1.884 -9.735 1.00 0.46 C ATOM 1392 CG1 ILE A 96 4.857 -1.550 -8.468 1.00 0.56 C ATOM 1393 CG2 ILE A 96 5.545 -0.756 -10.759 1.00 0.46 C ATOM 1394 CD1 ILE A 96 5.166 -0.195 -7.822 1.00 1.36 C ATOM 0 H ILE A 96 5.698 -3.979 -8.467 1.00 0.38 H new ATOM 0 HA ILE A 96 4.091 -3.072 -10.575 1.00 0.38 H new ATOM 0 HB ILE A 96 6.711 -1.992 -9.475 1.00 0.46 H new ATOM 0 HG12 ILE A 96 3.795 -1.581 -8.713 1.00 0.56 H new ATOM 0 HG13 ILE A 96 5.037 -2.332 -7.731 1.00 0.56 H new ATOM 0 HG21 ILE A 96 5.914 0.171 -10.321 1.00 0.46 H new ATOM 0 HG22 ILE A 96 6.139 -1.003 -11.639 1.00 0.46 H new ATOM 0 HG23 ILE A 96 4.502 -0.631 -11.049 1.00 0.46 H new ATOM 0 HD11 ILE A 96 4.544 -0.064 -6.936 1.00 1.36 H new ATOM 0 HD12 ILE A 96 6.217 -0.160 -7.536 1.00 1.36 H new ATOM 0 HD13 ILE A 96 4.957 0.604 -8.534 1.00 1.36 H new ATOM 1406 N ASN A 97 7.185 -3.901 -11.449 1.00 0.33 N ATOM 1407 CA ASN A 97 7.993 -4.284 -12.595 1.00 0.37 C ATOM 1408 C ASN A 97 7.489 -5.601 -13.185 1.00 0.42 C ATOM 1409 O ASN A 97 7.596 -5.832 -14.385 1.00 0.65 O ATOM 1410 CB ASN A 97 9.458 -4.405 -12.172 1.00 0.48 C ATOM 1411 CG ASN A 97 10.328 -4.689 -13.388 1.00 1.19 C ATOM 1412 OD1 ASN A 97 10.359 -3.902 -14.323 1.00 2.23 O ATOM 1413 ND2 ASN A 97 11.048 -5.802 -13.400 1.00 1.49 N ATOM 0 H ASN A 97 7.681 -3.896 -10.558 1.00 0.33 H new ATOM 0 HA ASN A 97 7.911 -3.516 -13.365 1.00 0.37 H new ATOM 0 HB2 ASN A 97 9.783 -3.484 -11.689 1.00 0.48 H new ATOM 0 HB3 ASN A 97 9.569 -5.205 -11.440 1.00 0.48 H new ATOM 0 HD21 ASN A 97 11.643 -6.016 -14.200 1.00 1.49 H new ATOM 0 HD22 ASN A 97 11.007 -6.445 -12.609 1.00 1.49 H new ATOM 1420 N ARG A 98 6.954 -6.480 -12.337 1.00 0.38 N ATOM 1421 CA ARG A 98 6.657 -7.863 -12.681 1.00 0.47 C ATOM 1422 C ARG A 98 5.453 -7.948 -13.611 1.00 0.48 C ATOM 1423 O ARG A 98 5.496 -8.645 -14.617 1.00 0.66 O ATOM 1424 CB ARG A 98 6.422 -8.654 -11.389 1.00 0.52 C ATOM 1425 CG ARG A 98 6.627 -10.152 -11.610 1.00 0.83 C ATOM 1426 CD ARG A 98 6.395 -10.844 -10.269 1.00 1.10 C ATOM 1427 NE ARG A 98 6.839 -12.242 -10.276 1.00 1.66 N ATOM 1428 CZ ARG A 98 6.824 -13.012 -9.181 1.00 2.22 C ATOM 1429 NH1 ARG A 98 7.317 -14.251 -9.231 1.00 2.84 N ATOM 1430 NH2 ARG A 98 6.323 -12.540 -8.041 1.00 3.01 N ATOM 0 H ARG A 98 6.712 -6.242 -11.375 1.00 0.38 H new ATOM 0 HA ARG A 98 7.502 -8.295 -13.217 1.00 0.47 H new ATOM 0 HB2 ARG A 98 7.104 -8.302 -10.615 1.00 0.52 H new ATOM 0 HB3 ARG A 98 5.410 -8.473 -11.028 1.00 0.52 H new ATOM 0 HG2 ARG A 98 5.933 -10.528 -12.362 1.00 0.83 H new ATOM 0 HG3 ARG A 98 7.634 -10.352 -11.977 1.00 0.83 H new ATOM 0 HD2 ARG A 98 6.926 -10.301 -9.487 1.00 1.10 H new ATOM 0 HD3 ARG A 98 5.334 -10.804 -10.021 1.00 1.10 H new ATOM 0 HE ARG A 98 7.173 -12.644 -11.152 1.00 1.66 H new ATOM 0 HH11 ARG A 98 7.705 -14.611 -10.103 1.00 2.84 H new ATOM 0 HH12 ARG A 98 7.306 -14.838 -8.397 1.00 2.84 H new ATOM 0 HH21 ARG A 98 5.950 -11.591 -8.002 1.00 3.01 H new ATOM 0 HH22 ARG A 98 6.312 -13.127 -7.207 1.00 3.01 H new ATOM 1444 N LEU A 99 4.369 -7.262 -13.250 1.00 0.42 N ATOM 1445 CA LEU A 99 3.197 -7.103 -14.097 1.00 0.45 C ATOM 1446 C LEU A 99 3.486 -6.079 -15.198 1.00 0.47 C ATOM 1447 O LEU A 99 2.787 -6.059 -16.206 1.00 0.60 O ATOM 1448 CB LEU A 99 1.987 -6.650 -13.264 1.00 0.47 C ATOM 1449 CG LEU A 99 1.333 -7.716 -12.372 1.00 0.62 C ATOM 1450 CD1 LEU A 99 1.010 -8.999 -13.138 1.00 1.85 C ATOM 1451 CD2 LEU A 99 2.132 -8.063 -11.117 1.00 1.48 C ATOM 0 H LEU A 99 4.283 -6.796 -12.347 1.00 0.42 H new ATOM 0 HA LEU A 99 2.964 -8.065 -14.553 1.00 0.45 H new ATOM 0 HB2 LEU A 99 2.300 -5.820 -12.631 1.00 0.47 H new ATOM 0 HB3 LEU A 99 1.229 -6.263 -13.945 1.00 0.47 H new ATOM 0 HG LEU A 99 0.405 -7.247 -12.045 1.00 0.62 H new ATOM 0 HD11 LEU A 99 0.550 -9.720 -12.462 1.00 1.85 H new ATOM 0 HD12 LEU A 99 0.321 -8.773 -13.952 1.00 1.85 H new ATOM 0 HD13 LEU A 99 1.929 -9.420 -13.546 1.00 1.85 H new ATOM 0 HD21 LEU A 99 1.599 -8.823 -10.545 1.00 1.48 H new ATOM 0 HD22 LEU A 99 3.112 -8.445 -11.404 1.00 1.48 H new ATOM 0 HD23 LEU A 99 2.256 -7.169 -10.506 1.00 1.48 H new ATOM 1463 N SER A 100 4.499 -5.230 -15.001 1.00 0.44 N ATOM 1464 CA SER A 100 4.983 -4.275 -15.987 1.00 0.50 C ATOM 1465 C SER A 100 3.928 -3.215 -16.297 1.00 0.50 C ATOM 1466 O SER A 100 3.670 -2.905 -17.459 1.00 0.87 O ATOM 1467 CB SER A 100 5.444 -5.007 -17.255 1.00 0.62 C ATOM 1468 OG SER A 100 6.254 -6.125 -16.943 1.00 0.96 O ATOM 0 H SER A 100 5.016 -5.192 -14.123 1.00 0.44 H new ATOM 0 HA SER A 100 5.843 -3.753 -15.569 1.00 0.50 H new ATOM 0 HB2 SER A 100 4.574 -5.334 -17.824 1.00 0.62 H new ATOM 0 HB3 SER A 100 6.001 -4.319 -17.891 1.00 0.62 H new ATOM 0 HG SER A 100 6.700 -5.976 -16.083 1.00 0.96 H new ATOM 1474 N ILE A 101 3.322 -2.637 -15.258 1.00 0.56 N ATOM 1475 CA ILE A 101 2.378 -1.547 -15.461 1.00 0.58 C ATOM 1476 C ILE A 101 3.111 -0.219 -15.628 1.00 0.49 C ATOM 1477 O ILE A 101 4.276 -0.082 -15.260 1.00 0.58 O ATOM 1478 CB ILE A 101 1.327 -1.466 -14.345 1.00 0.96 C ATOM 1479 CG1 ILE A 101 1.864 -1.561 -12.907 1.00 0.96 C ATOM 1480 CG2 ILE A 101 0.215 -2.479 -14.645 1.00 2.31 C ATOM 1481 CD1 ILE A 101 1.850 -2.971 -12.314 1.00 0.78 C ATOM 0 H ILE A 101 3.467 -2.903 -14.284 1.00 0.56 H new ATOM 0 HA ILE A 101 1.837 -1.760 -16.383 1.00 0.58 H new ATOM 0 HB ILE A 101 0.924 -0.454 -14.361 1.00 0.96 H new ATOM 0 HG12 ILE A 101 2.886 -1.184 -12.889 1.00 0.96 H new ATOM 0 HG13 ILE A 101 1.272 -0.906 -12.268 1.00 0.96 H new ATOM 0 HG21 ILE A 101 -0.540 -2.433 -13.860 1.00 2.31 H new ATOM 0 HG22 ILE A 101 -0.244 -2.242 -15.605 1.00 2.31 H new ATOM 0 HG23 ILE A 101 0.638 -3.483 -14.684 1.00 2.31 H new ATOM 0 HD11 ILE A 101 2.246 -2.943 -11.299 1.00 0.78 H new ATOM 0 HD12 ILE A 101 0.827 -3.347 -12.295 1.00 0.78 H new ATOM 0 HD13 ILE A 101 2.467 -3.629 -12.926 1.00 0.78 H new ATOM 1493 N SER A 102 2.406 0.769 -16.183 1.00 0.47 N ATOM 1494 CA SER A 102 2.951 2.088 -16.468 1.00 0.53 C ATOM 1495 C SER A 102 2.612 3.083 -15.360 1.00 0.41 C ATOM 1496 O SER A 102 3.285 4.103 -15.220 1.00 0.46 O ATOM 1497 CB SER A 102 2.393 2.578 -17.804 1.00 0.75 C ATOM 1498 OG SER A 102 2.771 1.682 -18.828 1.00 1.01 O ATOM 0 H SER A 102 1.426 0.669 -16.449 1.00 0.47 H new ATOM 0 HA SER A 102 4.037 2.014 -16.521 1.00 0.53 H new ATOM 0 HB2 SER A 102 1.307 2.651 -17.752 1.00 0.75 H new ATOM 0 HB3 SER A 102 2.769 3.577 -18.023 1.00 0.75 H new ATOM 0 HG SER A 102 2.412 1.994 -19.685 1.00 1.01 H new ATOM 1504 N SER A 103 1.574 2.823 -14.566 1.00 0.38 N ATOM 1505 CA SER A 103 1.123 3.733 -13.534 1.00 0.34 C ATOM 1506 C SER A 103 0.509 2.930 -12.398 1.00 0.34 C ATOM 1507 O SER A 103 -0.131 1.904 -12.635 1.00 0.42 O ATOM 1508 CB SER A 103 0.111 4.702 -14.149 1.00 0.47 C ATOM 1509 OG SER A 103 -0.975 4.013 -14.736 1.00 1.52 O ATOM 0 H SER A 103 1.024 1.966 -14.628 1.00 0.38 H new ATOM 0 HA SER A 103 1.954 4.310 -13.129 1.00 0.34 H new ATOM 0 HB2 SER A 103 -0.260 5.379 -13.380 1.00 0.47 H new ATOM 0 HB3 SER A 103 0.605 5.315 -14.903 1.00 0.47 H new ATOM 0 HG SER A 103 -0.636 3.278 -15.289 1.00 1.52 H new ATOM 1515 N VAL A 104 0.699 3.380 -11.158 1.00 0.31 N ATOM 1516 CA VAL A 104 0.161 2.663 -10.020 1.00 0.30 C ATOM 1517 C VAL A 104 -0.114 3.645 -8.882 1.00 0.32 C ATOM 1518 O VAL A 104 0.658 4.574 -8.635 1.00 0.39 O ATOM 1519 CB VAL A 104 1.126 1.526 -9.652 1.00 0.33 C ATOM 1520 CG1 VAL A 104 2.570 2.014 -9.584 1.00 0.40 C ATOM 1521 CG2 VAL A 104 0.760 0.840 -8.335 1.00 0.34 C ATOM 0 H VAL A 104 1.216 4.228 -10.925 1.00 0.31 H new ATOM 0 HA VAL A 104 -0.797 2.198 -10.252 1.00 0.30 H new ATOM 0 HB VAL A 104 1.031 0.792 -10.452 1.00 0.33 H new ATOM 0 HG11 VAL A 104 3.223 1.182 -9.321 1.00 0.40 H new ATOM 0 HG12 VAL A 104 2.865 2.414 -10.554 1.00 0.40 H new ATOM 0 HG13 VAL A 104 2.655 2.795 -8.828 1.00 0.40 H new ATOM 0 HG21 VAL A 104 1.477 0.046 -8.127 1.00 0.34 H new ATOM 0 HG22 VAL A 104 0.783 1.570 -7.526 1.00 0.34 H new ATOM 0 HG23 VAL A 104 -0.241 0.415 -8.412 1.00 0.34 H new ATOM 1531 N ALA A 105 -1.239 3.438 -8.198 1.00 0.32 N ATOM 1532 CA ALA A 105 -1.605 4.186 -7.009 1.00 0.35 C ATOM 1533 C ALA A 105 -1.067 3.452 -5.784 1.00 0.34 C ATOM 1534 O ALA A 105 -1.096 2.225 -5.750 1.00 0.34 O ATOM 1535 CB ALA A 105 -3.127 4.280 -6.950 1.00 0.43 C ATOM 0 H ALA A 105 -1.928 2.734 -8.463 1.00 0.32 H new ATOM 0 HA ALA A 105 -1.183 5.191 -7.033 1.00 0.35 H new ATOM 0 HB1 ALA A 105 -3.423 4.839 -6.062 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -3.495 4.791 -7.840 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -3.552 3.277 -6.905 1.00 0.43 H new ATOM 1541 N ILE A 106 -0.587 4.183 -4.778 1.00 0.38 N ATOM 1542 CA ILE A 106 0.109 3.608 -3.639 1.00 0.37 C ATOM 1543 C ILE A 106 -0.242 4.411 -2.381 1.00 0.34 C ATOM 1544 O ILE A 106 0.022 5.611 -2.327 1.00 0.37 O ATOM 1545 CB ILE A 106 1.623 3.563 -3.949 1.00 0.39 C ATOM 1546 CG1 ILE A 106 2.495 3.313 -2.705 1.00 0.53 C ATOM 1547 CG2 ILE A 106 2.109 4.826 -4.678 1.00 0.68 C ATOM 1548 CD1 ILE A 106 2.453 1.851 -2.256 1.00 0.84 C ATOM 0 H ILE A 106 -0.674 5.198 -4.735 1.00 0.38 H new ATOM 0 HA ILE A 106 -0.204 2.581 -3.450 1.00 0.37 H new ATOM 0 HB ILE A 106 1.743 2.707 -4.613 1.00 0.39 H new ATOM 0 HG12 ILE A 106 3.525 3.595 -2.922 1.00 0.53 H new ATOM 0 HG13 ILE A 106 2.155 3.952 -1.890 1.00 0.53 H new ATOM 0 HG21 ILE A 106 3.178 4.745 -4.873 1.00 0.68 H new ATOM 0 HG22 ILE A 106 1.575 4.929 -5.623 1.00 0.68 H new ATOM 0 HG23 ILE A 106 1.919 5.701 -4.056 1.00 0.68 H new ATOM 0 HD11 ILE A 106 3.083 1.723 -1.376 1.00 0.84 H new ATOM 0 HD12 ILE A 106 1.427 1.575 -2.012 1.00 0.84 H new ATOM 0 HD13 ILE A 106 2.819 1.213 -3.060 1.00 0.84 H new ATOM 1560 N PRO A 107 -0.856 3.791 -1.364 1.00 0.30 N ATOM 1561 CA PRO A 107 -1.150 4.463 -0.112 1.00 0.29 C ATOM 1562 C PRO A 107 0.051 4.420 0.833 1.00 0.31 C ATOM 1563 O PRO A 107 0.830 3.467 0.832 1.00 0.38 O ATOM 1564 CB PRO A 107 -2.330 3.693 0.470 1.00 0.32 C ATOM 1565 CG PRO A 107 -2.108 2.263 -0.028 1.00 0.33 C ATOM 1566 CD PRO A 107 -1.412 2.447 -1.376 1.00 0.32 C ATOM 0 HA PRO A 107 -1.377 5.519 -0.257 1.00 0.29 H new ATOM 0 HB2 PRO A 107 -2.342 3.741 1.559 1.00 0.32 H new ATOM 0 HB3 PRO A 107 -3.282 4.095 0.123 1.00 0.32 H new ATOM 0 HG2 PRO A 107 -1.492 1.690 0.665 1.00 0.33 H new ATOM 0 HG3 PRO A 107 -3.051 1.726 -0.135 1.00 0.33 H new ATOM 0 HD2 PRO A 107 -0.628 1.702 -1.514 1.00 0.32 H new ATOM 0 HD3 PRO A 107 -2.117 2.324 -2.198 1.00 0.32 H new ATOM 1574 N LEU A 108 0.179 5.439 1.685 1.00 0.34 N ATOM 1575 CA LEU A 108 1.173 5.469 2.742 1.00 0.37 C ATOM 1576 C LEU A 108 0.811 4.422 3.809 1.00 0.41 C ATOM 1577 O LEU A 108 -0.047 4.669 4.656 1.00 0.56 O ATOM 1578 CB LEU A 108 1.224 6.912 3.292 1.00 0.40 C ATOM 1579 CG LEU A 108 2.446 7.234 4.168 1.00 0.46 C ATOM 1580 CD1 LEU A 108 2.383 6.480 5.496 1.00 0.63 C ATOM 1581 CD2 LEU A 108 3.720 6.947 3.378 1.00 0.73 C ATOM 0 H LEU A 108 -0.412 6.270 1.655 1.00 0.34 H new ATOM 0 HA LEU A 108 2.168 5.208 2.382 1.00 0.37 H new ATOM 0 HB2 LEU A 108 1.206 7.605 2.451 1.00 0.40 H new ATOM 0 HB3 LEU A 108 0.321 7.094 3.874 1.00 0.40 H new ATOM 0 HG LEU A 108 2.447 8.293 4.428 1.00 0.46 H new ATOM 0 HD11 LEU A 108 3.259 6.726 6.096 1.00 0.63 H new ATOM 0 HD12 LEU A 108 1.481 6.768 6.036 1.00 0.63 H new ATOM 0 HD13 LEU A 108 2.364 5.407 5.305 1.00 0.63 H new ATOM 0 HD21 LEU A 108 4.590 7.174 3.995 1.00 0.73 H new ATOM 0 HD22 LEU A 108 3.742 5.895 3.093 1.00 0.73 H new ATOM 0 HD23 LEU A 108 3.740 7.567 2.482 1.00 0.73 H new ATOM 1593 N LEU A 109 1.462 3.253 3.795 1.00 0.42 N ATOM 1594 CA LEU A 109 1.317 2.256 4.852 1.00 0.49 C ATOM 1595 C LEU A 109 1.979 2.757 6.137 1.00 0.75 C ATOM 1596 O LEU A 109 3.150 3.143 6.117 1.00 1.29 O ATOM 1597 CB LEU A 109 1.964 0.914 4.462 1.00 0.58 C ATOM 1598 CG LEU A 109 1.040 -0.028 3.687 1.00 0.68 C ATOM 1599 CD1 LEU A 109 0.602 0.547 2.341 1.00 1.28 C ATOM 1600 CD2 LEU A 109 1.775 -1.350 3.455 1.00 1.30 C ATOM 0 H LEU A 109 2.102 2.976 3.051 1.00 0.42 H new ATOM 0 HA LEU A 109 0.249 2.100 5.006 1.00 0.49 H new ATOM 0 HB2 LEU A 109 2.850 1.113 3.859 1.00 0.58 H new ATOM 0 HB3 LEU A 109 2.301 0.410 5.368 1.00 0.58 H new ATOM 0 HG LEU A 109 0.138 -0.173 4.282 1.00 0.68 H new ATOM 0 HD11 LEU A 109 -0.051 -0.165 1.837 1.00 1.28 H new ATOM 0 HD12 LEU A 109 0.065 1.482 2.502 1.00 1.28 H new ATOM 0 HD13 LEU A 109 1.480 0.735 1.723 1.00 1.28 H new ATOM 0 HD21 LEU A 109 1.129 -2.033 2.903 1.00 1.30 H new ATOM 0 HD22 LEU A 109 2.683 -1.166 2.881 1.00 1.30 H new ATOM 0 HD23 LEU A 109 2.037 -1.794 4.415 1.00 1.30 H new ATOM 1612 N SER A 110 1.228 2.671 7.240 1.00 1.09 N ATOM 1613 CA SER A 110 1.565 2.934 8.642 1.00 1.27 C ATOM 1614 C SER A 110 0.456 3.795 9.234 1.00 1.31 C ATOM 1615 O SER A 110 0.705 4.897 9.719 1.00 1.90 O ATOM 1616 CB SER A 110 2.947 3.568 8.848 1.00 1.98 C ATOM 1617 OG SER A 110 3.239 3.698 10.225 1.00 3.15 O ATOM 0 H SER A 110 0.253 2.381 7.161 1.00 1.09 H new ATOM 0 HA SER A 110 1.633 1.978 9.161 1.00 1.27 H new ATOM 0 HB2 SER A 110 3.709 2.955 8.366 1.00 1.98 H new ATOM 0 HB3 SER A 110 2.978 4.548 8.371 1.00 1.98 H new ATOM 0 HG SER A 110 2.738 4.454 10.596 1.00 3.15 H new ATOM 1623 N THR A 111 -0.776 3.288 9.208 1.00 1.03 N ATOM 1624 CA THR A 111 -1.935 3.999 9.714 1.00 1.51 C ATOM 1625 C THR A 111 -2.816 3.007 10.463 1.00 1.42 C ATOM 1626 O THR A 111 -2.595 1.794 10.381 1.00 1.98 O ATOM 1627 CB THR A 111 -2.657 4.708 8.557 1.00 2.21 C ATOM 1628 OG1 THR A 111 -3.695 5.511 9.075 1.00 3.17 O ATOM 1629 CG2 THR A 111 -3.245 3.739 7.525 1.00 2.31 C ATOM 0 H THR A 111 -0.993 2.365 8.831 1.00 1.03 H new ATOM 0 HA THR A 111 -1.648 4.782 10.416 1.00 1.51 H new ATOM 0 HB THR A 111 -1.909 5.312 8.043 1.00 2.21 H new ATOM 0 HG1 THR A 111 -4.156 5.965 8.339 1.00 3.17 H new ATOM 0 HG21 THR A 111 -3.740 4.305 6.736 1.00 2.31 H new ATOM 0 HG22 THR A 111 -2.445 3.138 7.093 1.00 2.31 H new ATOM 0 HG23 THR A 111 -3.968 3.085 8.011 1.00 2.31 H new ATOM 1637 N GLY A 112 -3.813 3.523 11.184 1.00 1.80 N ATOM 1638 CA GLY A 112 -4.790 2.742 11.924 1.00 2.17 C ATOM 1639 C GLY A 112 -4.136 1.888 13.005 1.00 1.83 C ATOM 1640 O GLY A 112 -4.054 2.295 14.160 1.00 2.31 O ATOM 0 H GLY A 112 -3.962 4.529 11.268 1.00 1.80 H new ATOM 0 HA2 GLY A 112 -5.518 3.412 12.382 1.00 2.17 H new ATOM 0 HA3 GLY A 112 -5.337 2.099 11.235 1.00 2.17 H new ATOM 1644 N ILE A 113 -3.698 0.688 12.628 1.00 1.71 N ATOM 1645 CA ILE A 113 -3.324 -0.376 13.548 1.00 1.70 C ATOM 1646 C ILE A 113 -1.843 -0.745 13.410 1.00 1.44 C ATOM 1647 O ILE A 113 -1.282 -1.417 14.273 1.00 1.82 O ATOM 1648 CB ILE A 113 -4.293 -1.551 13.316 1.00 2.21 C ATOM 1649 CG1 ILE A 113 -4.281 -2.533 14.496 1.00 3.43 C ATOM 1650 CG2 ILE A 113 -4.014 -2.265 11.982 1.00 2.85 C ATOM 1651 CD1 ILE A 113 -5.514 -3.444 14.478 1.00 4.16 C ATOM 0 H ILE A 113 -3.592 0.426 11.648 1.00 1.71 H new ATOM 0 HA ILE A 113 -3.420 -0.052 14.584 1.00 1.70 H new ATOM 0 HB ILE A 113 -5.297 -1.132 13.252 1.00 2.21 H new ATOM 0 HG12 ILE A 113 -3.377 -3.141 14.456 1.00 3.43 H new ATOM 0 HG13 ILE A 113 -4.251 -1.978 15.433 1.00 3.43 H new ATOM 0 HG21 ILE A 113 -4.718 -3.087 11.855 1.00 2.85 H new ATOM 0 HG22 ILE A 113 -4.129 -1.558 11.160 1.00 2.85 H new ATOM 0 HG23 ILE A 113 -2.996 -2.656 11.984 1.00 2.85 H new ATOM 0 HD11 ILE A 113 -5.474 -4.127 15.327 1.00 4.16 H new ATOM 0 HD12 ILE A 113 -6.416 -2.836 14.543 1.00 4.16 H new ATOM 0 HD13 ILE A 113 -5.529 -4.018 13.551 1.00 4.16 H new ATOM 1663 N PHE A 114 -1.182 -0.294 12.339 1.00 1.17 N ATOM 1664 CA PHE A 114 0.216 -0.631 12.094 1.00 1.07 C ATOM 1665 C PHE A 114 1.167 0.345 12.783 1.00 1.24 C ATOM 1666 O PHE A 114 2.352 0.054 12.921 1.00 2.46 O ATOM 1667 CB PHE A 114 0.462 -0.677 10.581 1.00 1.45 C ATOM 1668 CG PHE A 114 -0.450 -1.685 9.919 1.00 1.53 C ATOM 1669 CD1 PHE A 114 -1.623 -1.260 9.268 1.00 2.46 C ATOM 1670 CD2 PHE A 114 -0.196 -3.058 10.084 1.00 2.43 C ATOM 1671 CE1 PHE A 114 -2.570 -2.205 8.842 1.00 3.08 C ATOM 1672 CE2 PHE A 114 -1.141 -4.004 9.657 1.00 3.45 C ATOM 1673 CZ PHE A 114 -2.342 -3.570 9.074 1.00 3.45 C ATOM 0 H PHE A 114 -1.598 0.307 11.628 1.00 1.17 H new ATOM 0 HA PHE A 114 0.420 -1.612 12.523 1.00 1.07 H new ATOM 0 HB2 PHE A 114 0.294 0.310 10.151 1.00 1.45 H new ATOM 0 HB3 PHE A 114 1.502 -0.937 10.385 1.00 1.45 H new ATOM 0 HD1 PHE A 114 -1.795 -0.208 9.096 1.00 2.46 H new ATOM 0 HD2 PHE A 114 0.727 -3.385 10.540 1.00 2.43 H new ATOM 0 HE1 PHE A 114 -3.469 -1.883 8.338 1.00 3.08 H new ATOM 0 HE2 PHE A 114 -0.945 -5.059 9.776 1.00 3.45 H new ATOM 0 HZ PHE A 114 -3.097 -4.293 8.802 1.00 3.45 H new ATOM 1683 N SER A 115 0.649 1.504 13.194 1.00 0.94 N ATOM 1684 CA SER A 115 1.418 2.680 13.541 1.00 1.02 C ATOM 1685 C SER A 115 2.070 2.508 14.902 1.00 1.05 C ATOM 1686 O SER A 115 3.285 2.607 15.032 1.00 1.79 O ATOM 1687 CB SER A 115 0.472 3.884 13.559 1.00 1.33 C ATOM 1688 OG SER A 115 -0.160 4.006 12.305 1.00 1.55 O ATOM 0 H SER A 115 -0.356 1.645 13.295 1.00 0.94 H new ATOM 0 HA SER A 115 2.209 2.833 12.807 1.00 1.02 H new ATOM 0 HB2 SER A 115 -0.275 3.761 14.344 1.00 1.33 H new ATOM 0 HB3 SER A 115 1.028 4.793 13.788 1.00 1.33 H new ATOM 0 HG SER A 115 0.402 4.541 11.706 1.00 1.55 H new ATOM 1694 N ALA A 116 1.245 2.298 15.931 1.00 0.95 N ATOM 1695 CA ALA A 116 1.674 2.217 17.319 1.00 0.93 C ATOM 1696 C ALA A 116 2.617 3.366 17.717 1.00 1.20 C ATOM 1697 O ALA A 116 3.541 3.170 18.501 1.00 1.81 O ATOM 1698 CB ALA A 116 2.298 0.838 17.505 1.00 0.91 C ATOM 0 H ALA A 116 0.239 2.178 15.814 1.00 0.95 H new ATOM 0 HA ALA A 116 0.823 2.336 17.990 1.00 0.93 H new ATOM 0 HB1 ALA A 116 2.637 0.728 18.535 1.00 0.91 H new ATOM 0 HB2 ALA A 116 1.557 0.070 17.283 1.00 0.91 H new ATOM 0 HB3 ALA A 116 3.147 0.729 16.830 1.00 0.91 H new ATOM 1704 N GLY A 117 2.392 4.565 17.167 1.00 1.35 N ATOM 1705 CA GLY A 117 3.258 5.723 17.359 1.00 1.75 C ATOM 1706 C GLY A 117 3.771 6.243 16.017 1.00 1.45 C ATOM 1707 O GLY A 117 3.838 7.449 15.799 1.00 1.88 O ATOM 0 H GLY A 117 1.589 4.756 16.567 1.00 1.35 H new ATOM 0 HA2 GLY A 117 2.710 6.512 17.875 1.00 1.75 H new ATOM 0 HA3 GLY A 117 4.100 5.452 17.995 1.00 1.75 H new ATOM 1711 N LYS A 118 4.137 5.334 15.109 1.00 1.26 N ATOM 1712 CA LYS A 118 4.570 5.624 13.754 1.00 1.24 C ATOM 1713 C LYS A 118 3.457 6.316 12.956 1.00 1.52 C ATOM 1714 O LYS A 118 2.696 5.665 12.238 1.00 2.51 O ATOM 1715 CB LYS A 118 5.013 4.296 13.110 1.00 1.72 C ATOM 1716 CG LYS A 118 5.927 4.513 11.907 1.00 2.44 C ATOM 1717 CD LYS A 118 7.353 4.798 12.379 1.00 3.17 C ATOM 1718 CE LYS A 118 8.026 3.508 12.857 1.00 3.81 C ATOM 1719 NZ LYS A 118 9.497 3.611 12.806 1.00 4.63 N ATOM 0 H LYS A 118 4.137 4.335 15.315 1.00 1.26 H new ATOM 0 HA LYS A 118 5.409 6.320 13.759 1.00 1.24 H new ATOM 0 HB2 LYS A 118 5.531 3.690 13.853 1.00 1.72 H new ATOM 0 HB3 LYS A 118 4.132 3.734 12.798 1.00 1.72 H new ATOM 0 HG2 LYS A 118 5.916 3.630 11.268 1.00 2.44 H new ATOM 0 HG3 LYS A 118 5.560 5.346 11.307 1.00 2.44 H new ATOM 0 HD2 LYS A 118 7.931 5.237 11.566 1.00 3.17 H new ATOM 0 HD3 LYS A 118 7.336 5.528 13.188 1.00 3.17 H new ATOM 0 HE2 LYS A 118 7.711 3.289 13.877 1.00 3.81 H new ATOM 0 HE3 LYS A 118 7.697 2.674 12.237 1.00 3.81 H new ATOM 0 HZ1 LYS A 118 9.914 2.660 12.870 1.00 4.63 H new ATOM 0 HZ2 LYS A 118 9.783 4.055 11.910 1.00 4.63 H new ATOM 0 HZ3 LYS A 118 9.832 4.191 13.602 1.00 4.63 H new ATOM 1733 N ASP A 119 3.386 7.643 13.057 1.00 1.83 N ATOM 1734 CA ASP A 119 2.381 8.476 12.403 1.00 2.48 C ATOM 1735 C ASP A 119 3.082 9.619 11.673 1.00 1.90 C ATOM 1736 O ASP A 119 2.851 10.799 11.932 1.00 2.60 O ATOM 1737 CB ASP A 119 1.376 9.006 13.433 1.00 3.68 C ATOM 1738 CG ASP A 119 0.276 9.844 12.768 1.00 4.86 C ATOM 1739 OD1 ASP A 119 0.022 9.620 11.561 1.00 5.53 O ATOM 1740 OD2 ASP A 119 -0.315 10.686 13.480 1.00 5.74 O ATOM 0 H ASP A 119 4.048 8.183 13.614 1.00 1.83 H new ATOM 0 HA ASP A 119 1.824 7.883 11.677 1.00 2.48 H new ATOM 0 HB2 ASP A 119 0.925 8.169 13.966 1.00 3.68 H new ATOM 0 HB3 ASP A 119 1.898 9.612 14.174 1.00 3.68 H new ATOM 1745 N ARG A 120 3.988 9.278 10.755 1.00 1.17 N ATOM 1746 CA ARG A 120 4.613 10.268 9.894 1.00 0.71 C ATOM 1747 C ARG A 120 4.740 9.683 8.506 1.00 0.51 C ATOM 1748 O ARG A 120 5.536 8.775 8.276 1.00 0.50 O ATOM 1749 CB ARG A 120 5.974 10.724 10.445 1.00 1.01 C ATOM 1750 CG ARG A 120 5.746 11.890 11.411 1.00 1.49 C ATOM 1751 CD ARG A 120 7.037 12.449 12.004 1.00 2.24 C ATOM 1752 NE ARG A 120 6.707 13.586 12.878 1.00 2.42 N ATOM 1753 CZ ARG A 120 7.303 13.909 14.032 1.00 2.96 C ATOM 1754 NH1 ARG A 120 6.795 14.887 14.784 1.00 3.27 N ATOM 1755 NH2 ARG A 120 8.395 13.260 14.434 1.00 3.78 N ATOM 0 H ARG A 120 4.302 8.321 10.593 1.00 1.17 H new ATOM 0 HA ARG A 120 3.989 11.161 9.856 1.00 0.71 H new ATOM 0 HB2 ARG A 120 6.470 9.900 10.958 1.00 1.01 H new ATOM 0 HB3 ARG A 120 6.628 11.031 9.629 1.00 1.01 H new ATOM 0 HG2 ARG A 120 5.220 12.688 10.887 1.00 1.49 H new ATOM 0 HG3 ARG A 120 5.097 11.559 12.221 1.00 1.49 H new ATOM 0 HD2 ARG A 120 7.557 11.677 12.571 1.00 2.24 H new ATOM 0 HD3 ARG A 120 7.710 12.768 11.208 1.00 2.24 H new ATOM 0 HE ARG A 120 5.945 14.191 12.573 1.00 2.42 H new ATOM 0 HH11 ARG A 120 5.958 15.383 14.478 1.00 3.27 H new ATOM 0 HH12 ARG A 120 7.244 15.139 15.665 1.00 3.27 H new ATOM 0 HH21 ARG A 120 8.783 12.511 13.861 1.00 3.78 H new ATOM 0 HH22 ARG A 120 8.843 13.512 15.315 1.00 3.78 H new ATOM 1769 N VAL A 121 3.986 10.250 7.567 1.00 0.44 N ATOM 1770 CA VAL A 121 4.084 9.878 6.169 1.00 0.35 C ATOM 1771 C VAL A 121 5.516 10.007 5.702 1.00 0.31 C ATOM 1772 O VAL A 121 6.016 9.098 5.071 1.00 0.35 O ATOM 1773 CB VAL A 121 3.122 10.690 5.301 1.00 0.37 C ATOM 1774 CG1 VAL A 121 1.708 10.515 5.861 1.00 0.48 C ATOM 1775 CG2 VAL A 121 3.499 12.163 5.289 1.00 0.39 C ATOM 0 H VAL A 121 3.295 10.976 7.758 1.00 0.44 H new ATOM 0 HA VAL A 121 3.785 8.835 6.064 1.00 0.35 H new ATOM 0 HB VAL A 121 3.174 10.331 4.273 1.00 0.37 H new ATOM 0 HG11 VAL A 121 1.004 11.087 5.256 1.00 0.48 H new ATOM 0 HG12 VAL A 121 1.435 9.460 5.836 1.00 0.48 H new ATOM 0 HG13 VAL A 121 1.677 10.874 6.890 1.00 0.48 H new ATOM 0 HG21 VAL A 121 2.796 12.713 4.663 1.00 0.39 H new ATOM 0 HG22 VAL A 121 3.465 12.556 6.305 1.00 0.39 H new ATOM 0 HG23 VAL A 121 4.507 12.277 4.890 1.00 0.39 H new ATOM 1785 N HIS A 122 6.196 11.090 6.069 1.00 0.37 N ATOM 1786 CA HIS A 122 7.599 11.318 5.756 1.00 0.47 C ATOM 1787 C HIS A 122 8.434 10.062 5.996 1.00 0.43 C ATOM 1788 O HIS A 122 9.299 9.750 5.179 1.00 0.56 O ATOM 1789 CB HIS A 122 8.102 12.526 6.564 1.00 0.69 C ATOM 1790 CG HIS A 122 9.596 12.595 6.780 1.00 1.22 C ATOM 1791 ND1 HIS A 122 10.584 12.142 5.930 1.00 2.06 N ATOM 1792 CD2 HIS A 122 10.210 13.061 7.911 1.00 2.43 C ATOM 1793 CE1 HIS A 122 11.764 12.325 6.549 1.00 2.67 C ATOM 1794 NE2 HIS A 122 11.585 12.886 7.755 1.00 2.92 N ATOM 0 H HIS A 122 5.775 11.849 6.604 1.00 0.37 H new ATOM 0 HA HIS A 122 7.705 11.547 4.696 1.00 0.47 H new ATOM 0 HB2 HIS A 122 7.785 13.437 6.056 1.00 0.69 H new ATOM 0 HB3 HIS A 122 7.613 12.517 7.538 1.00 0.69 H new ATOM 0 HD1 HIS A 122 10.445 11.742 5.002 1.00 2.06 H new ATOM 0 HD2 HIS A 122 9.717 13.488 8.772 1.00 2.43 H new ATOM 0 HE1 HIS A 122 12.724 12.057 6.133 1.00 2.67 H new ATOM 1802 N GLN A 123 8.199 9.347 7.097 1.00 0.39 N ATOM 1803 CA GLN A 123 9.027 8.193 7.397 1.00 0.45 C ATOM 1804 C GLN A 123 8.644 7.062 6.460 1.00 0.41 C ATOM 1805 O GLN A 123 9.515 6.486 5.809 1.00 0.47 O ATOM 1806 CB GLN A 123 8.935 7.778 8.872 1.00 0.65 C ATOM 1807 CG GLN A 123 9.845 6.557 9.112 1.00 1.20 C ATOM 1808 CD GLN A 123 10.268 6.364 10.567 1.00 1.79 C ATOM 1809 OE1 GLN A 123 10.980 5.285 10.864 1.00 2.58 O flip ATOM 1810 NE2 GLN A 123 9.978 7.175 11.439 1.00 2.64 N flip ATOM 0 H GLN A 123 7.462 9.543 7.775 1.00 0.39 H new ATOM 0 HA GLN A 123 10.073 8.454 7.235 1.00 0.45 H new ATOM 0 HB2 GLN A 123 9.238 8.605 9.514 1.00 0.65 H new ATOM 0 HB3 GLN A 123 7.904 7.535 9.130 1.00 0.65 H new ATOM 0 HG2 GLN A 123 9.326 5.660 8.775 1.00 1.20 H new ATOM 0 HG3 GLN A 123 10.739 6.658 8.496 1.00 1.20 H new ATOM 0 HE21 GLN A 123 9.430 8.003 11.204 1.00 2.64 H new ATOM 0 HE22 GLN A 123 10.284 7.022 12.400 1.00 2.64 H new ATOM 1819 N SER A 124 7.354 6.736 6.361 1.00 0.38 N ATOM 1820 CA SER A 124 6.992 5.545 5.605 1.00 0.46 C ATOM 1821 C SER A 124 7.368 5.715 4.135 1.00 0.46 C ATOM 1822 O SER A 124 7.916 4.816 3.510 1.00 0.57 O ATOM 1823 CB SER A 124 5.506 5.296 5.755 1.00 0.54 C ATOM 1824 OG SER A 124 5.215 4.929 7.079 1.00 1.15 O ATOM 0 H SER A 124 6.578 7.254 6.774 1.00 0.38 H new ATOM 0 HA SER A 124 7.539 4.685 5.992 1.00 0.46 H new ATOM 0 HB2 SER A 124 4.949 6.194 5.486 1.00 0.54 H new ATOM 0 HB3 SER A 124 5.190 4.508 5.072 1.00 0.54 H new ATOM 0 HG SER A 124 4.723 5.654 7.519 1.00 1.15 H new ATOM 1830 N LEU A 125 7.098 6.910 3.623 1.00 0.44 N ATOM 1831 CA LEU A 125 7.362 7.433 2.298 1.00 0.51 C ATOM 1832 C LEU A 125 8.843 7.352 1.956 1.00 0.44 C ATOM 1833 O LEU A 125 9.179 7.214 0.787 1.00 0.49 O ATOM 1834 CB LEU A 125 6.867 8.885 2.275 1.00 0.80 C ATOM 1835 CG LEU A 125 6.914 9.605 0.926 1.00 0.97 C ATOM 1836 CD1 LEU A 125 6.003 8.936 -0.102 1.00 2.23 C ATOM 1837 CD2 LEU A 125 6.411 11.028 1.179 1.00 1.46 C ATOM 0 H LEU A 125 6.635 7.613 4.198 1.00 0.44 H new ATOM 0 HA LEU A 125 6.841 6.840 1.546 1.00 0.51 H new ATOM 0 HB2 LEU A 125 5.837 8.899 2.633 1.00 0.80 H new ATOM 0 HB3 LEU A 125 7.460 9.458 2.988 1.00 0.80 H new ATOM 0 HG LEU A 125 7.929 9.582 0.529 1.00 0.97 H new ATOM 0 HD11 LEU A 125 6.063 9.476 -1.047 1.00 2.23 H new ATOM 0 HD12 LEU A 125 6.320 7.904 -0.252 1.00 2.23 H new ATOM 0 HD13 LEU A 125 4.975 8.950 0.259 1.00 2.23 H new ATOM 0 HD21 LEU A 125 6.424 11.590 0.245 1.00 1.46 H new ATOM 0 HD22 LEU A 125 5.393 10.991 1.566 1.00 1.46 H new ATOM 0 HD23 LEU A 125 7.058 11.519 1.906 1.00 1.46 H new ATOM 1849 N SER A 126 9.736 7.428 2.945 1.00 0.41 N ATOM 1850 CA SER A 126 11.152 7.198 2.684 1.00 0.44 C ATOM 1851 C SER A 126 11.365 5.757 2.227 1.00 0.37 C ATOM 1852 O SER A 126 12.006 5.514 1.207 1.00 0.42 O ATOM 1853 CB SER A 126 12.001 7.502 3.920 1.00 0.52 C ATOM 1854 OG SER A 126 11.865 8.862 4.274 1.00 0.80 O ATOM 0 H SER A 126 9.507 7.643 3.915 1.00 0.41 H new ATOM 0 HA SER A 126 11.471 7.875 1.892 1.00 0.44 H new ATOM 0 HB2 SER A 126 11.690 6.868 4.750 1.00 0.52 H new ATOM 0 HB3 SER A 126 13.047 7.273 3.719 1.00 0.52 H new ATOM 0 HG SER A 126 10.945 9.034 4.563 1.00 0.80 H new ATOM 1860 N HIS A 127 10.830 4.790 2.976 1.00 0.32 N ATOM 1861 CA HIS A 127 11.006 3.380 2.653 1.00 0.31 C ATOM 1862 C HIS A 127 10.309 3.047 1.335 1.00 0.33 C ATOM 1863 O HIS A 127 10.855 2.318 0.509 1.00 0.43 O ATOM 1864 CB HIS A 127 10.491 2.512 3.806 1.00 0.34 C ATOM 1865 CG HIS A 127 11.199 2.817 5.103 1.00 0.50 C ATOM 1866 ND1 HIS A 127 12.497 2.477 5.417 1.00 0.83 N ATOM 1867 CD2 HIS A 127 10.703 3.558 6.142 1.00 0.78 C ATOM 1868 CE1 HIS A 127 12.768 3.001 6.626 1.00 0.87 C ATOM 1869 NE2 HIS A 127 11.710 3.675 7.103 1.00 0.88 N ATOM 0 H HIS A 127 10.271 4.963 3.811 1.00 0.32 H new ATOM 0 HA HIS A 127 12.067 3.167 2.524 1.00 0.31 H new ATOM 0 HB2 HIS A 127 9.420 2.673 3.931 1.00 0.34 H new ATOM 0 HB3 HIS A 127 10.628 1.460 3.557 1.00 0.34 H new ATOM 0 HD2 HIS A 127 9.710 3.977 6.207 1.00 0.78 H new ATOM 0 HE1 HIS A 127 13.710 2.894 7.143 1.00 0.87 H new ATOM 0 HE2 HIS A 127 11.653 4.174 7.991 1.00 0.88 H new ATOM 1877 N LEU A 128 9.105 3.590 1.138 1.00 0.33 N ATOM 1878 CA LEU A 128 8.332 3.416 -0.077 1.00 0.41 C ATOM 1879 C LEU A 128 9.153 3.893 -1.261 1.00 0.52 C ATOM 1880 O LEU A 128 9.448 3.108 -2.150 1.00 0.68 O ATOM 1881 CB LEU A 128 6.978 4.133 0.044 1.00 0.58 C ATOM 1882 CG LEU A 128 6.012 3.965 -1.148 1.00 0.79 C ATOM 1883 CD1 LEU A 128 6.130 5.127 -2.138 1.00 1.86 C ATOM 1884 CD2 LEU A 128 6.191 2.649 -1.909 1.00 1.81 C ATOM 0 H LEU A 128 8.639 4.171 1.835 1.00 0.33 H new ATOM 0 HA LEU A 128 8.106 2.362 -0.236 1.00 0.41 H new ATOM 0 HB2 LEU A 128 6.479 3.773 0.944 1.00 0.58 H new ATOM 0 HB3 LEU A 128 7.165 5.197 0.187 1.00 0.58 H new ATOM 0 HG LEU A 128 5.019 3.955 -0.698 1.00 0.79 H new ATOM 0 HD11 LEU A 128 5.435 4.974 -2.964 1.00 1.86 H new ATOM 0 HD12 LEU A 128 5.891 6.062 -1.632 1.00 1.86 H new ATOM 0 HD13 LEU A 128 7.148 5.174 -2.525 1.00 1.86 H new ATOM 0 HD21 LEU A 128 5.477 2.604 -2.732 1.00 1.81 H new ATOM 0 HD22 LEU A 128 7.205 2.593 -2.305 1.00 1.81 H new ATOM 0 HD23 LEU A 128 6.018 1.811 -1.233 1.00 1.81 H new ATOM 1896 N LEU A 129 9.536 5.166 -1.291 1.00 0.51 N ATOM 1897 CA LEU A 129 10.239 5.724 -2.434 1.00 0.59 C ATOM 1898 C LEU A 129 11.534 4.968 -2.702 1.00 0.56 C ATOM 1899 O LEU A 129 11.812 4.670 -3.854 1.00 0.62 O ATOM 1900 CB LEU A 129 10.483 7.225 -2.248 1.00 0.65 C ATOM 1901 CG LEU A 129 9.184 8.042 -2.338 1.00 0.69 C ATOM 1902 CD1 LEU A 129 9.495 9.497 -1.996 1.00 1.21 C ATOM 1903 CD2 LEU A 129 8.562 8.002 -3.738 1.00 1.47 C ATOM 0 H LEU A 129 9.369 5.829 -0.534 1.00 0.51 H new ATOM 0 HA LEU A 129 9.607 5.604 -3.314 1.00 0.59 H new ATOM 0 HB2 LEU A 129 10.952 7.397 -1.279 1.00 0.65 H new ATOM 0 HB3 LEU A 129 11.183 7.574 -3.007 1.00 0.65 H new ATOM 0 HG LEU A 129 8.472 7.604 -1.639 1.00 0.69 H new ATOM 0 HD11 LEU A 129 8.581 10.088 -2.056 1.00 1.21 H new ATOM 0 HD12 LEU A 129 9.899 9.555 -0.985 1.00 1.21 H new ATOM 0 HD13 LEU A 129 10.227 9.888 -2.702 1.00 1.21 H new ATOM 0 HD21 LEU A 129 7.647 8.595 -3.747 1.00 1.47 H new ATOM 0 HD22 LEU A 129 9.267 8.412 -4.461 1.00 1.47 H new ATOM 0 HD23 LEU A 129 8.329 6.971 -4.003 1.00 1.47 H new ATOM 1915 N ALA A 130 12.307 4.605 -1.677 1.00 0.51 N ATOM 1916 CA ALA A 130 13.553 3.867 -1.873 1.00 0.54 C ATOM 1917 C ALA A 130 13.353 2.583 -2.695 1.00 0.52 C ATOM 1918 O ALA A 130 14.238 2.172 -3.439 1.00 0.61 O ATOM 1919 CB ALA A 130 14.173 3.549 -0.510 1.00 0.57 C ATOM 0 H ALA A 130 12.090 4.811 -0.702 1.00 0.51 H new ATOM 0 HA ALA A 130 14.231 4.498 -2.448 1.00 0.54 H new ATOM 0 HB1 ALA A 130 15.103 2.998 -0.653 1.00 0.57 H new ATOM 0 HB2 ALA A 130 14.379 4.478 0.022 1.00 0.57 H new ATOM 0 HB3 ALA A 130 13.479 2.944 0.073 1.00 0.57 H new ATOM 1925 N ALA A 131 12.201 1.931 -2.541 1.00 0.48 N ATOM 1926 CA ALA A 131 11.829 0.723 -3.251 1.00 0.53 C ATOM 1927 C ALA A 131 11.232 1.044 -4.618 1.00 0.48 C ATOM 1928 O ALA A 131 11.580 0.440 -5.623 1.00 0.45 O ATOM 1929 CB ALA A 131 10.777 -0.011 -2.424 1.00 0.59 C ATOM 0 H ALA A 131 11.480 2.247 -1.893 1.00 0.48 H new ATOM 0 HA ALA A 131 12.721 0.114 -3.398 1.00 0.53 H new ATOM 0 HB1 ALA A 131 10.481 -0.925 -2.940 1.00 0.59 H new ATOM 0 HB2 ALA A 131 11.192 -0.263 -1.448 1.00 0.59 H new ATOM 0 HB3 ALA A 131 9.905 0.630 -2.293 1.00 0.59 H new ATOM 1935 N MET A 132 10.256 1.937 -4.667 1.00 0.50 N ATOM 1936 CA MET A 132 9.446 2.186 -5.843 1.00 0.50 C ATOM 1937 C MET A 132 10.225 2.975 -6.889 1.00 0.47 C ATOM 1938 O MET A 132 9.881 2.947 -8.068 1.00 0.48 O ATOM 1939 CB MET A 132 8.180 2.900 -5.386 1.00 0.66 C ATOM 1940 CG MET A 132 7.044 2.812 -6.397 1.00 1.65 C ATOM 1941 SD MET A 132 5.433 2.984 -5.584 1.00 3.12 S ATOM 1942 CE MET A 132 4.330 2.956 -7.013 1.00 4.16 C ATOM 0 H MET A 132 10.001 2.521 -3.870 1.00 0.50 H new ATOM 0 HA MET A 132 9.172 1.251 -6.331 1.00 0.50 H new ATOM 0 HB2 MET A 132 7.850 2.471 -4.440 1.00 0.66 H new ATOM 0 HB3 MET A 132 8.410 3.949 -5.198 1.00 0.66 H new ATOM 0 HG2 MET A 132 7.161 3.593 -7.149 1.00 1.65 H new ATOM 0 HG3 MET A 132 7.091 1.857 -6.920 1.00 1.65 H new ATOM 0 HE1 MET A 132 3.739 3.872 -7.034 1.00 4.16 H new ATOM 0 HE2 MET A 132 4.920 2.884 -7.927 1.00 4.16 H new ATOM 0 HE3 MET A 132 3.664 2.096 -6.942 1.00 4.16 H new ATOM 1952 N ASP A 133 11.309 3.629 -6.473 1.00 0.51 N ATOM 1953 CA ASP A 133 12.270 4.269 -7.363 1.00 0.59 C ATOM 1954 C ASP A 133 12.942 3.225 -8.253 1.00 0.58 C ATOM 1955 O ASP A 133 13.366 3.526 -9.362 1.00 0.69 O ATOM 1956 CB ASP A 133 13.315 5.027 -6.541 1.00 0.69 C ATOM 1957 CG ASP A 133 14.219 5.870 -7.434 1.00 0.91 C ATOM 1958 OD1 ASP A 133 13.683 6.847 -8.005 1.00 2.00 O ATOM 1959 OD2 ASP A 133 15.429 5.561 -7.489 1.00 1.44 O ATOM 0 H ASP A 133 11.546 3.729 -5.486 1.00 0.51 H new ATOM 0 HA ASP A 133 11.745 4.979 -8.003 1.00 0.59 H new ATOM 0 HB2 ASP A 133 12.815 5.670 -5.817 1.00 0.69 H new ATOM 0 HB3 ASP A 133 13.919 4.318 -5.974 1.00 0.69 H new ATOM 1964 N THR A 134 13.010 1.970 -7.794 1.00 0.51 N ATOM 1965 CA THR A 134 13.592 0.896 -8.585 1.00 0.55 C ATOM 1966 C THR A 134 12.648 0.439 -9.712 1.00 0.53 C ATOM 1967 O THR A 134 13.026 -0.412 -10.515 1.00 0.87 O ATOM 1968 CB THR A 134 14.067 -0.263 -7.681 1.00 0.62 C ATOM 1969 OG1 THR A 134 13.046 -1.186 -7.371 1.00 0.61 O ATOM 1970 CG2 THR A 134 14.704 0.226 -6.366 1.00 0.68 C ATOM 0 H THR A 134 12.667 1.680 -6.878 1.00 0.51 H new ATOM 0 HA THR A 134 14.480 1.285 -9.084 1.00 0.55 H new ATOM 0 HB THR A 134 14.824 -0.770 -8.279 1.00 0.62 H new ATOM 0 HG1 THR A 134 12.405 -0.771 -6.757 1.00 0.61 H new ATOM 0 HG21 THR A 134 15.018 -0.633 -5.773 1.00 0.68 H new ATOM 0 HG22 THR A 134 15.570 0.848 -6.591 1.00 0.68 H new ATOM 0 HG23 THR A 134 13.975 0.809 -5.803 1.00 0.68 H new ATOM 1978 N THR A 135 11.426 0.984 -9.796 1.00 0.32 N ATOM 1979 CA THR A 135 10.483 0.677 -10.865 1.00 0.35 C ATOM 1980 C THR A 135 10.495 1.826 -11.875 1.00 0.43 C ATOM 1981 O THR A 135 11.169 2.827 -11.655 1.00 0.65 O ATOM 1982 CB THR A 135 9.076 0.441 -10.285 1.00 0.42 C ATOM 1983 OG1 THR A 135 8.345 1.641 -10.131 1.00 0.45 O ATOM 1984 CG2 THR A 135 9.120 -0.276 -8.933 1.00 0.51 C ATOM 0 H THR A 135 11.068 1.654 -9.116 1.00 0.32 H new ATOM 0 HA THR A 135 10.777 -0.240 -11.375 1.00 0.35 H new ATOM 0 HB THR A 135 8.572 -0.192 -11.015 1.00 0.42 H new ATOM 0 HG1 THR A 135 8.757 2.187 -9.430 1.00 0.45 H new ATOM 0 HG21 THR A 135 8.104 -0.420 -8.564 1.00 0.51 H new ATOM 0 HG22 THR A 135 9.604 -1.245 -9.051 1.00 0.51 H new ATOM 0 HG23 THR A 135 9.683 0.326 -8.220 1.00 0.51 H new ATOM 1992 N GLU A 136 9.712 1.740 -12.953 1.00 0.50 N ATOM 1993 CA GLU A 136 9.593 2.849 -13.896 1.00 0.73 C ATOM 1994 C GLU A 136 8.141 3.295 -14.066 1.00 0.68 C ATOM 1995 O GLU A 136 7.831 4.030 -15.000 1.00 1.01 O ATOM 1996 CB GLU A 136 10.235 2.475 -15.239 1.00 1.07 C ATOM 1997 CG GLU A 136 11.751 2.294 -15.101 1.00 1.27 C ATOM 1998 CD GLU A 136 12.459 2.690 -16.395 1.00 1.98 C ATOM 1999 OE1 GLU A 136 12.787 1.792 -17.195 1.00 2.56 O ATOM 2000 OE2 GLU A 136 12.632 3.921 -16.575 1.00 2.99 O ATOM 0 H GLU A 136 9.156 0.919 -13.192 1.00 0.50 H new ATOM 0 HA GLU A 136 10.133 3.703 -13.487 1.00 0.73 H new ATOM 0 HB2 GLU A 136 9.789 1.553 -15.613 1.00 1.07 H new ATOM 0 HB3 GLU A 136 10.025 3.252 -15.974 1.00 1.07 H new ATOM 0 HG2 GLU A 136 12.122 2.902 -14.276 1.00 1.27 H new ATOM 0 HG3 GLU A 136 11.978 1.256 -14.859 1.00 1.27 H new ATOM 2007 N ALA A 137 7.243 2.888 -13.165 1.00 0.40 N ATOM 2008 CA ALA A 137 5.858 3.323 -13.252 1.00 0.41 C ATOM 2009 C ALA A 137 5.698 4.702 -12.603 1.00 0.41 C ATOM 2010 O ALA A 137 6.518 5.118 -11.784 1.00 0.51 O ATOM 2011 CB ALA A 137 4.959 2.290 -12.570 1.00 0.50 C ATOM 0 H ALA A 137 7.450 2.268 -12.382 1.00 0.40 H new ATOM 0 HA ALA A 137 5.565 3.407 -14.298 1.00 0.41 H new ATOM 0 HB1 ALA A 137 3.920 2.613 -12.634 1.00 0.50 H new ATOM 0 HB2 ALA A 137 5.070 1.326 -13.067 1.00 0.50 H new ATOM 0 HB3 ALA A 137 5.245 2.193 -11.523 1.00 0.50 H new ATOM 2017 N ARG A 138 4.613 5.411 -12.924 1.00 0.41 N ATOM 2018 CA ARG A 138 4.217 6.577 -12.142 1.00 0.45 C ATOM 2019 C ARG A 138 3.907 6.144 -10.718 1.00 0.43 C ATOM 2020 O ARG A 138 3.458 5.021 -10.489 1.00 0.44 O ATOM 2021 CB ARG A 138 2.999 7.278 -12.755 1.00 0.54 C ATOM 2022 CG ARG A 138 3.448 8.349 -13.747 1.00 1.10 C ATOM 2023 CD ARG A 138 2.217 9.051 -14.320 1.00 1.34 C ATOM 2024 NE ARG A 138 2.601 10.192 -15.161 1.00 1.66 N ATOM 2025 CZ ARG A 138 1.761 10.896 -15.928 1.00 2.09 C ATOM 2026 NH1 ARG A 138 2.215 11.926 -16.642 1.00 2.56 N ATOM 2027 NH2 ARG A 138 0.469 10.568 -15.978 1.00 2.75 N ATOM 0 H ARG A 138 4.001 5.199 -13.712 1.00 0.41 H new ATOM 0 HA ARG A 138 5.042 7.289 -12.143 1.00 0.45 H new ATOM 0 HB2 ARG A 138 2.366 6.548 -13.259 1.00 0.54 H new ATOM 0 HB3 ARG A 138 2.397 7.731 -11.967 1.00 0.54 H new ATOM 0 HG2 ARG A 138 4.096 9.072 -13.251 1.00 1.10 H new ATOM 0 HG3 ARG A 138 4.030 7.897 -14.550 1.00 1.10 H new ATOM 0 HD2 ARG A 138 1.632 8.343 -14.907 1.00 1.34 H new ATOM 0 HD3 ARG A 138 1.579 9.394 -13.506 1.00 1.34 H new ATOM 0 HE ARG A 138 3.583 10.469 -15.160 1.00 1.66 H new ATOM 0 HH11 ARG A 138 3.203 12.177 -16.604 1.00 2.56 H new ATOM 0 HH12 ARG A 138 1.575 12.463 -17.227 1.00 2.56 H new ATOM 0 HH21 ARG A 138 0.121 9.780 -15.431 1.00 2.75 H new ATOM 0 HH22 ARG A 138 -0.171 11.105 -16.563 1.00 2.75 H new ATOM 2041 N VAL A 139 4.104 7.065 -9.777 1.00 0.48 N ATOM 2042 CA VAL A 139 4.014 6.807 -8.359 1.00 0.47 C ATOM 2043 C VAL A 139 3.034 7.823 -7.820 1.00 0.45 C ATOM 2044 O VAL A 139 3.397 8.948 -7.471 1.00 0.64 O ATOM 2045 CB VAL A 139 5.402 6.911 -7.710 1.00 0.55 C ATOM 2046 CG1 VAL A 139 5.312 6.649 -6.206 1.00 0.76 C ATOM 2047 CG2 VAL A 139 6.341 5.899 -8.364 1.00 0.72 C ATOM 0 H VAL A 139 4.336 8.034 -9.995 1.00 0.48 H new ATOM 0 HA VAL A 139 3.665 5.798 -8.137 1.00 0.47 H new ATOM 0 HB VAL A 139 5.791 7.918 -7.858 1.00 0.55 H new ATOM 0 HG11 VAL A 139 6.305 6.727 -5.763 1.00 0.76 H new ATOM 0 HG12 VAL A 139 4.651 7.385 -5.747 1.00 0.76 H new ATOM 0 HG13 VAL A 139 4.916 5.648 -6.034 1.00 0.76 H new ATOM 0 HG21 VAL A 139 7.328 5.969 -7.906 1.00 0.72 H new ATOM 0 HG22 VAL A 139 5.947 4.893 -8.223 1.00 0.72 H new ATOM 0 HG23 VAL A 139 6.420 6.112 -9.430 1.00 0.72 H new ATOM 2057 N THR A 140 1.765 7.444 -7.801 1.00 0.43 N ATOM 2058 CA THR A 140 0.734 8.349 -7.366 1.00 0.42 C ATOM 2059 C THR A 140 0.445 8.021 -5.913 1.00 0.34 C ATOM 2060 O THR A 140 -0.134 6.977 -5.625 1.00 0.33 O ATOM 2061 CB THR A 140 -0.494 8.187 -8.258 1.00 0.48 C ATOM 2062 OG1 THR A 140 -0.153 8.104 -9.626 1.00 0.73 O ATOM 2063 CG2 THR A 140 -1.330 9.439 -8.073 1.00 0.52 C ATOM 0 H THR A 140 1.435 6.521 -8.081 1.00 0.43 H new ATOM 0 HA THR A 140 1.040 9.392 -7.444 1.00 0.42 H new ATOM 0 HB THR A 140 -1.014 7.270 -7.982 1.00 0.48 H new ATOM 0 HG1 THR A 140 -0.794 8.623 -10.155 1.00 0.73 H new ATOM 0 HG21 THR A 140 -2.225 9.374 -8.692 1.00 0.52 H new ATOM 0 HG22 THR A 140 -1.619 9.532 -7.026 1.00 0.52 H new ATOM 0 HG23 THR A 140 -0.748 10.312 -8.368 1.00 0.52 H new ATOM 2071 N ILE A 141 0.870 8.883 -4.989 1.00 0.34 N ATOM 2072 CA ILE A 141 0.674 8.630 -3.576 1.00 0.33 C ATOM 2073 C ILE A 141 -0.756 9.046 -3.222 1.00 0.34 C ATOM 2074 O ILE A 141 -1.237 10.094 -3.661 1.00 0.41 O ATOM 2075 CB ILE A 141 1.775 9.341 -2.759 1.00 0.39 C ATOM 2076 CG1 ILE A 141 2.112 8.580 -1.465 1.00 0.40 C ATOM 2077 CG2 ILE A 141 1.440 10.775 -2.368 1.00 0.50 C ATOM 2078 CD1 ILE A 141 3.130 7.467 -1.717 1.00 0.61 C ATOM 0 H ILE A 141 1.350 9.758 -5.201 1.00 0.34 H new ATOM 0 HA ILE A 141 0.774 7.574 -3.326 1.00 0.33 H new ATOM 0 HB ILE A 141 2.627 9.358 -3.438 1.00 0.39 H new ATOM 0 HG12 ILE A 141 2.508 9.276 -0.725 1.00 0.40 H new ATOM 0 HG13 ILE A 141 1.201 8.153 -1.045 1.00 0.40 H new ATOM 0 HG21 ILE A 141 2.266 11.199 -1.797 1.00 0.50 H new ATOM 0 HG22 ILE A 141 1.278 11.369 -3.267 1.00 0.50 H new ATOM 0 HG23 ILE A 141 0.536 10.784 -1.759 1.00 0.50 H new ATOM 0 HD11 ILE A 141 3.344 6.951 -0.781 1.00 0.61 H new ATOM 0 HD12 ILE A 141 2.723 6.758 -2.437 1.00 0.61 H new ATOM 0 HD13 ILE A 141 4.050 7.898 -2.112 1.00 0.61 H new ATOM 2090 N TYR A 142 -1.438 8.215 -2.437 1.00 0.35 N ATOM 2091 CA TYR A 142 -2.784 8.464 -1.945 1.00 0.38 C ATOM 2092 C TYR A 142 -2.740 8.356 -0.424 1.00 0.47 C ATOM 2093 O TYR A 142 -1.773 7.857 0.156 1.00 0.60 O ATOM 2094 CB TYR A 142 -3.780 7.436 -2.507 1.00 0.39 C ATOM 2095 CG TYR A 142 -4.224 7.617 -3.951 1.00 0.40 C ATOM 2096 CD1 TYR A 142 -3.324 7.365 -4.999 1.00 0.42 C ATOM 2097 CD2 TYR A 142 -5.563 7.941 -4.251 1.00 0.51 C ATOM 2098 CE1 TYR A 142 -3.745 7.431 -6.339 1.00 0.49 C ATOM 2099 CE2 TYR A 142 -5.995 7.997 -5.591 1.00 0.61 C ATOM 2100 CZ TYR A 142 -5.090 7.732 -6.643 1.00 0.58 C ATOM 2101 OH TYR A 142 -5.521 7.758 -7.937 1.00 0.74 O ATOM 0 H TYR A 142 -1.055 7.325 -2.118 1.00 0.35 H new ATOM 0 HA TYR A 142 -3.117 9.452 -2.263 1.00 0.38 H new ATOM 0 HB2 TYR A 142 -3.334 6.446 -2.412 1.00 0.39 H new ATOM 0 HB3 TYR A 142 -4.669 7.447 -1.876 1.00 0.39 H new ATOM 0 HD1 TYR A 142 -2.297 7.118 -4.773 1.00 0.42 H new ATOM 0 HD2 TYR A 142 -6.259 8.147 -3.452 1.00 0.51 H new ATOM 0 HE1 TYR A 142 -3.039 7.251 -7.136 1.00 0.49 H new ATOM 0 HE2 TYR A 142 -7.022 8.244 -5.815 1.00 0.61 H new ATOM 0 HH TYR A 142 -4.934 7.200 -8.489 1.00 0.74 H new ATOM 2111 N CYS A 143 -3.806 8.807 0.232 1.00 0.69 N ATOM 2112 CA CYS A 143 -3.946 8.682 1.668 1.00 0.86 C ATOM 2113 C CYS A 143 -5.440 8.592 1.965 1.00 1.04 C ATOM 2114 O CYS A 143 -6.031 7.527 1.806 1.00 2.30 O ATOM 2115 CB CYS A 143 -3.227 9.864 2.332 1.00 0.99 C ATOM 2116 SG CYS A 143 -3.287 9.727 4.138 1.00 2.41 S ATOM 0 H CYS A 143 -4.594 9.268 -0.223 1.00 0.69 H new ATOM 0 HA CYS A 143 -3.481 7.785 2.077 1.00 0.86 H new ATOM 0 HB2 CYS A 143 -2.189 9.896 2.000 1.00 0.99 H new ATOM 0 HB3 CYS A 143 -3.691 10.799 2.019 1.00 0.99 H new ATOM 0 HG CYS A 143 -2.229 10.282 4.651 1.00 2.41 H new ATOM 2122 N ARG A 144 -6.064 9.714 2.321 1.00 1.18 N ATOM 2123 CA ARG A 144 -7.508 9.850 2.360 1.00 1.34 C ATOM 2124 C ARG A 144 -7.847 11.228 1.795 1.00 1.41 C ATOM 2125 O ARG A 144 -6.972 11.908 1.259 1.00 2.51 O ATOM 2126 CB ARG A 144 -8.016 9.609 3.793 1.00 1.72 C ATOM 2127 CG ARG A 144 -9.291 8.760 3.768 1.00 1.88 C ATOM 2128 CD ARG A 144 -9.725 8.407 5.191 1.00 2.09 C ATOM 2129 NE ARG A 144 -10.942 7.587 5.174 1.00 2.48 N ATOM 2130 CZ ARG A 144 -11.615 7.207 6.267 1.00 2.64 C ATOM 2131 NH1 ARG A 144 -12.748 6.515 6.149 1.00 3.38 N ATOM 2132 NH2 ARG A 144 -11.155 7.521 7.481 1.00 3.00 N ATOM 0 H ARG A 144 -5.568 10.563 2.593 1.00 1.18 H new ATOM 0 HA ARG A 144 -8.015 9.104 1.749 1.00 1.34 H new ATOM 0 HB2 ARG A 144 -7.247 9.106 4.379 1.00 1.72 H new ATOM 0 HB3 ARG A 144 -8.215 10.563 4.281 1.00 1.72 H new ATOM 0 HG2 ARG A 144 -10.088 9.305 3.263 1.00 1.88 H new ATOM 0 HG3 ARG A 144 -9.117 7.848 3.197 1.00 1.88 H new ATOM 0 HD2 ARG A 144 -8.924 7.868 5.697 1.00 2.09 H new ATOM 0 HD3 ARG A 144 -9.904 9.320 5.759 1.00 2.09 H new ATOM 0 HE ARG A 144 -11.299 7.286 4.267 1.00 2.48 H new ATOM 0 HH11 ARG A 144 -13.104 6.274 5.224 1.00 3.38 H new ATOM 0 HH12 ARG A 144 -13.259 6.227 6.984 1.00 3.38 H new ATOM 0 HH21 ARG A 144 -10.289 8.052 7.577 1.00 3.00 H new ATOM 0 HH22 ARG A 144 -11.670 7.230 8.312 1.00 3.00 H new ATOM 2146 N ASP A 145 -9.092 11.669 1.922 1.00 1.28 N ATOM 2147 CA ASP A 145 -9.632 12.871 1.292 1.00 1.32 C ATOM 2148 C ASP A 145 -9.206 14.177 1.983 1.00 1.46 C ATOM 2149 O ASP A 145 -9.927 15.168 1.901 1.00 2.68 O ATOM 2150 CB ASP A 145 -11.169 12.766 1.315 1.00 2.09 C ATOM 2151 CG ASP A 145 -11.737 12.872 2.737 1.00 2.56 C ATOM 2152 OD1 ASP A 145 -12.603 13.741 2.989 1.00 3.48 O ATOM 2153 OD2 ASP A 145 -11.268 12.095 3.600 1.00 3.14 O ATOM 0 H ASP A 145 -9.783 11.180 2.490 1.00 1.28 H new ATOM 0 HA ASP A 145 -9.235 12.918 0.278 1.00 1.32 H new ATOM 0 HB2 ASP A 145 -11.595 13.556 0.696 1.00 2.09 H new ATOM 0 HB3 ASP A 145 -11.473 11.817 0.874 1.00 2.09 H new ATOM 2158 N LYS A 146 -8.071 14.225 2.691 1.00 1.04 N ATOM 2159 CA LYS A 146 -7.947 15.158 3.813 1.00 1.64 C ATOM 2160 C LYS A 146 -6.642 15.936 3.837 1.00 1.24 C ATOM 2161 O LYS A 146 -5.785 15.770 2.981 1.00 1.19 O ATOM 2162 CB LYS A 146 -8.161 14.374 5.124 1.00 2.59 C ATOM 2163 CG LYS A 146 -9.214 15.018 6.037 1.00 2.94 C ATOM 2164 CD LYS A 146 -10.534 15.149 5.273 1.00 3.22 C ATOM 2165 CE LYS A 146 -11.761 15.141 6.177 1.00 3.81 C ATOM 2166 NZ LYS A 146 -12.983 15.068 5.350 1.00 4.82 N ATOM 0 H LYS A 146 -7.249 13.647 2.514 1.00 1.04 H new ATOM 0 HA LYS A 146 -8.714 15.923 3.693 1.00 1.64 H new ATOM 0 HB2 LYS A 146 -8.467 13.355 4.887 1.00 2.59 H new ATOM 0 HB3 LYS A 146 -7.214 14.306 5.660 1.00 2.59 H new ATOM 0 HG2 LYS A 146 -9.357 14.411 6.931 1.00 2.94 H new ATOM 0 HG3 LYS A 146 -8.874 15.999 6.369 1.00 2.94 H new ATOM 0 HD2 LYS A 146 -10.522 16.075 4.698 1.00 3.22 H new ATOM 0 HD3 LYS A 146 -10.614 14.330 4.558 1.00 3.22 H new ATOM 0 HE2 LYS A 146 -11.719 14.291 6.858 1.00 3.81 H new ATOM 0 HE3 LYS A 146 -11.779 16.041 6.792 1.00 3.81 H new ATOM 0 HZ1 LYS A 146 -13.656 14.404 5.783 1.00 4.82 H new ATOM 0 HZ2 LYS A 146 -13.417 16.011 5.288 1.00 4.82 H new ATOM 0 HZ3 LYS A 146 -12.737 14.737 4.395 1.00 4.82 H new ATOM 2180 N THR A 147 -6.482 16.766 4.868 1.00 1.23 N ATOM 2181 CA THR A 147 -5.306 17.579 5.140 1.00 1.13 C ATOM 2182 C THR A 147 -4.024 16.739 5.191 1.00 0.99 C ATOM 2183 O THR A 147 -2.945 17.244 4.892 1.00 0.95 O ATOM 2184 CB THR A 147 -5.560 18.313 6.462 1.00 1.51 C ATOM 2185 OG1 THR A 147 -6.894 18.785 6.468 1.00 2.10 O ATOM 2186 CG2 THR A 147 -4.610 19.487 6.692 1.00 1.82 C ATOM 0 H THR A 147 -7.210 16.893 5.571 1.00 1.23 H new ATOM 0 HA THR A 147 -5.149 18.294 4.333 1.00 1.13 H new ATOM 0 HB THR A 147 -5.383 17.602 7.269 1.00 1.51 H new ATOM 0 HG1 THR A 147 -7.071 19.255 7.309 1.00 2.10 H new ATOM 0 HG21 THR A 147 -4.843 19.963 7.644 1.00 1.82 H new ATOM 0 HG22 THR A 147 -3.582 19.125 6.709 1.00 1.82 H new ATOM 0 HG23 THR A 147 -4.726 20.212 5.886 1.00 1.82 H new ATOM 2194 N TRP A 148 -4.117 15.451 5.541 1.00 1.04 N ATOM 2195 CA TRP A 148 -2.983 14.539 5.434 1.00 1.00 C ATOM 2196 C TRP A 148 -2.383 14.582 4.028 1.00 0.84 C ATOM 2197 O TRP A 148 -1.168 14.635 3.890 1.00 0.82 O ATOM 2198 CB TRP A 148 -3.387 13.108 5.816 1.00 1.15 C ATOM 2199 CG TRP A 148 -2.963 12.667 7.185 1.00 1.34 C ATOM 2200 CD1 TRP A 148 -1.723 12.231 7.508 1.00 2.19 C ATOM 2201 CD2 TRP A 148 -3.750 12.565 8.412 1.00 1.55 C ATOM 2202 NE1 TRP A 148 -1.687 11.862 8.839 1.00 2.34 N ATOM 2203 CE2 TRP A 148 -2.909 12.051 9.445 1.00 1.84 C ATOM 2204 CE3 TRP A 148 -5.092 12.839 8.758 1.00 2.40 C ATOM 2205 CZ2 TRP A 148 -3.369 11.823 10.749 1.00 2.23 C ATOM 2206 CZ3 TRP A 148 -5.566 12.613 10.065 1.00 3.10 C ATOM 2207 CH2 TRP A 148 -4.708 12.107 11.059 1.00 2.81 C ATOM 0 H TRP A 148 -4.969 15.021 5.901 1.00 1.04 H new ATOM 0 HA TRP A 148 -2.219 14.868 6.138 1.00 1.00 H new ATOM 0 HB2 TRP A 148 -4.471 13.023 5.744 1.00 1.15 H new ATOM 0 HB3 TRP A 148 -2.964 12.421 5.083 1.00 1.15 H new ATOM 0 HD1 TRP A 148 -0.886 12.179 6.827 1.00 2.19 H new ATOM 0 HE1 TRP A 148 -0.861 11.496 9.312 1.00 2.34 H new ATOM 0 HE3 TRP A 148 -5.765 13.228 8.008 1.00 2.40 H new ATOM 0 HZ2 TRP A 148 -2.703 11.434 11.505 1.00 2.23 H new ATOM 0 HZ3 TRP A 148 -6.596 12.830 10.306 1.00 3.10 H new ATOM 0 HH2 TRP A 148 -5.079 11.937 12.059 1.00 2.81 H new ATOM 2218 N GLU A 149 -3.213 14.580 2.987 1.00 0.85 N ATOM 2219 CA GLU A 149 -2.771 14.682 1.603 1.00 0.85 C ATOM 2220 C GLU A 149 -1.959 15.958 1.377 1.00 0.79 C ATOM 2221 O GLU A 149 -0.911 15.916 0.738 1.00 0.82 O ATOM 2222 CB GLU A 149 -3.989 14.569 0.679 1.00 1.06 C ATOM 2223 CG GLU A 149 -3.577 14.423 -0.791 1.00 2.11 C ATOM 2224 CD GLU A 149 -3.698 15.702 -1.630 1.00 2.89 C ATOM 2225 OE1 GLU A 149 -4.022 16.772 -1.063 1.00 3.60 O ATOM 2226 OE2 GLU A 149 -3.578 15.586 -2.869 1.00 3.76 O ATOM 0 H GLU A 149 -4.226 14.506 3.086 1.00 0.85 H new ATOM 0 HA GLU A 149 -2.096 13.860 1.365 1.00 0.85 H new ATOM 0 HB2 GLU A 149 -4.591 13.710 0.975 1.00 1.06 H new ATOM 0 HB3 GLU A 149 -4.616 15.453 0.795 1.00 1.06 H new ATOM 0 HG2 GLU A 149 -2.544 14.077 -0.830 1.00 2.11 H new ATOM 0 HG3 GLU A 149 -4.190 13.647 -1.249 1.00 2.11 H new ATOM 2233 N GLN A 150 -2.388 17.080 1.957 1.00 0.82 N ATOM 2234 CA GLN A 150 -1.646 18.334 1.885 1.00 0.87 C ATOM 2235 C GLN A 150 -0.255 18.165 2.501 1.00 0.77 C ATOM 2236 O GLN A 150 0.741 18.644 1.961 1.00 0.80 O ATOM 2237 CB GLN A 150 -2.435 19.433 2.606 1.00 1.02 C ATOM 2238 CG GLN A 150 -1.998 20.844 2.203 1.00 1.65 C ATOM 2239 CD GLN A 150 -2.853 21.894 2.913 1.00 1.80 C ATOM 2240 OE1 GLN A 150 -3.247 21.719 4.059 1.00 2.16 O ATOM 2241 NE2 GLN A 150 -3.170 22.999 2.249 1.00 2.32 N ATOM 0 H GLN A 150 -3.257 17.142 2.488 1.00 0.82 H new ATOM 0 HA GLN A 150 -1.516 18.620 0.841 1.00 0.87 H new ATOM 0 HB2 GLN A 150 -3.497 19.312 2.390 1.00 1.02 H new ATOM 0 HB3 GLN A 150 -2.313 19.314 3.683 1.00 1.02 H new ATOM 0 HG2 GLN A 150 -0.948 20.991 2.455 1.00 1.65 H new ATOM 0 HG3 GLN A 150 -2.087 20.964 1.123 1.00 1.65 H new ATOM 0 HE21 GLN A 150 -2.836 23.134 1.295 1.00 2.32 H new ATOM 0 HE22 GLN A 150 -3.747 23.713 2.693 1.00 2.32 H new ATOM 2250 N LYS A 151 -0.163 17.483 3.644 1.00 0.73 N ATOM 2251 CA LYS A 151 1.127 17.237 4.280 1.00 0.73 C ATOM 2252 C LYS A 151 1.999 16.402 3.360 1.00 0.64 C ATOM 2253 O LYS A 151 3.160 16.741 3.153 1.00 0.72 O ATOM 2254 CB LYS A 151 0.950 16.578 5.651 1.00 0.81 C ATOM 2255 CG LYS A 151 0.295 17.605 6.571 1.00 1.25 C ATOM 2256 CD LYS A 151 -0.033 17.037 7.955 1.00 1.25 C ATOM 2257 CE LYS A 151 -1.059 17.962 8.621 1.00 1.72 C ATOM 2258 NZ LYS A 151 -1.081 17.816 10.092 1.00 2.42 N ATOM 0 H LYS A 151 -0.963 17.094 4.144 1.00 0.73 H new ATOM 0 HA LYS A 151 1.626 18.190 4.452 1.00 0.73 H new ATOM 0 HB2 LYS A 151 0.330 15.685 5.570 1.00 0.81 H new ATOM 0 HB3 LYS A 151 1.913 16.263 6.052 1.00 0.81 H new ATOM 0 HG2 LYS A 151 0.959 18.462 6.683 1.00 1.25 H new ATOM 0 HG3 LYS A 151 -0.621 17.970 6.107 1.00 1.25 H new ATOM 0 HD2 LYS A 151 -0.433 16.027 7.866 1.00 1.25 H new ATOM 0 HD3 LYS A 151 0.870 16.970 8.562 1.00 1.25 H new ATOM 0 HE2 LYS A 151 -0.831 18.997 8.365 1.00 1.72 H new ATOM 0 HE3 LYS A 151 -2.050 17.746 8.223 1.00 1.72 H new ATOM 0 HZ1 LYS A 151 -1.790 18.462 10.494 1.00 2.42 H new ATOM 0 HZ2 LYS A 151 -1.325 16.836 10.340 1.00 2.42 H new ATOM 0 HZ3 LYS A 151 -0.143 18.047 10.478 1.00 2.42 H new ATOM 2272 N ILE A 152 1.453 15.339 2.778 1.00 0.56 N ATOM 2273 CA ILE A 152 2.195 14.491 1.863 1.00 0.54 C ATOM 2274 C ILE A 152 2.709 15.326 0.687 1.00 0.58 C ATOM 2275 O ILE A 152 3.841 15.125 0.261 1.00 0.68 O ATOM 2276 CB ILE A 152 1.337 13.293 1.425 1.00 0.56 C ATOM 2277 CG1 ILE A 152 0.978 12.405 2.630 1.00 0.75 C ATOM 2278 CG2 ILE A 152 2.133 12.447 0.429 1.00 0.83 C ATOM 2279 CD1 ILE A 152 -0.198 11.468 2.347 1.00 1.05 C ATOM 0 H ILE A 152 0.488 15.045 2.929 1.00 0.56 H new ATOM 0 HA ILE A 152 3.068 14.074 2.366 1.00 0.54 H new ATOM 0 HB ILE A 152 0.421 13.673 0.973 1.00 0.56 H new ATOM 0 HG12 ILE A 152 1.849 11.813 2.911 1.00 0.75 H new ATOM 0 HG13 ILE A 152 0.735 13.039 3.483 1.00 0.75 H new ATOM 0 HG21 ILE A 152 1.531 11.595 0.113 1.00 0.83 H new ATOM 0 HG22 ILE A 152 2.389 13.053 -0.440 1.00 0.83 H new ATOM 0 HG23 ILE A 152 3.047 12.090 0.904 1.00 0.83 H new ATOM 0 HD11 ILE A 152 -0.405 10.867 3.232 1.00 1.05 H new ATOM 0 HD12 ILE A 152 -1.080 12.057 2.094 1.00 1.05 H new ATOM 0 HD13 ILE A 152 0.052 10.812 1.513 1.00 1.05 H new ATOM 2291 N LYS A 153 1.925 16.283 0.178 1.00 0.60 N ATOM 2292 CA LYS A 153 2.393 17.195 -0.860 1.00 0.68 C ATOM 2293 C LYS A 153 3.638 17.934 -0.382 1.00 0.69 C ATOM 2294 O LYS A 153 4.658 17.899 -1.065 1.00 0.74 O ATOM 2295 CB LYS A 153 1.282 18.169 -1.282 1.00 0.79 C ATOM 2296 CG LYS A 153 1.779 19.138 -2.364 1.00 0.92 C ATOM 2297 CD LYS A 153 0.716 20.186 -2.699 1.00 1.22 C ATOM 2298 CE LYS A 153 1.356 21.238 -3.609 1.00 1.66 C ATOM 2299 NZ LYS A 153 0.422 22.337 -3.930 1.00 2.11 N ATOM 0 H LYS A 153 0.961 16.442 0.472 1.00 0.60 H new ATOM 0 HA LYS A 153 2.660 16.614 -1.743 1.00 0.68 H new ATOM 0 HB2 LYS A 153 0.426 17.608 -1.657 1.00 0.79 H new ATOM 0 HB3 LYS A 153 0.939 18.733 -0.414 1.00 0.79 H new ATOM 0 HG2 LYS A 153 2.687 19.634 -2.022 1.00 0.92 H new ATOM 0 HG3 LYS A 153 2.040 18.580 -3.263 1.00 0.92 H new ATOM 0 HD2 LYS A 153 -0.135 19.720 -3.196 1.00 1.22 H new ATOM 0 HD3 LYS A 153 0.338 20.650 -1.788 1.00 1.22 H new ATOM 0 HE2 LYS A 153 2.242 21.646 -3.123 1.00 1.66 H new ATOM 0 HE3 LYS A 153 1.689 20.764 -4.532 1.00 1.66 H new ATOM 0 HZ1 LYS A 153 0.896 23.026 -4.548 1.00 2.11 H new ATOM 0 HZ2 LYS A 153 -0.413 21.952 -4.417 1.00 2.11 H new ATOM 0 HZ3 LYS A 153 0.124 22.807 -3.051 1.00 2.11 H new ATOM 2313 N THR A 154 3.566 18.632 0.756 1.00 0.70 N ATOM 2314 CA THR A 154 4.716 19.422 1.199 1.00 0.76 C ATOM 2315 C THR A 154 5.962 18.543 1.339 1.00 0.76 C ATOM 2316 O THR A 154 7.044 18.935 0.911 1.00 0.85 O ATOM 2317 CB THR A 154 4.421 20.216 2.480 1.00 0.84 C ATOM 2318 OG1 THR A 154 4.103 19.377 3.568 1.00 1.90 O ATOM 2319 CG2 THR A 154 3.269 21.199 2.274 1.00 1.61 C ATOM 0 H THR A 154 2.751 18.667 1.369 1.00 0.70 H new ATOM 0 HA THR A 154 4.920 20.163 0.426 1.00 0.76 H new ATOM 0 HB THR A 154 5.336 20.761 2.710 1.00 0.84 H new ATOM 0 HG1 THR A 154 3.809 18.504 3.233 1.00 1.90 H new ATOM 0 HG21 THR A 154 3.086 21.745 3.200 1.00 1.61 H new ATOM 0 HG22 THR A 154 3.528 21.903 1.483 1.00 1.61 H new ATOM 0 HG23 THR A 154 2.370 20.652 1.992 1.00 1.61 H new ATOM 2327 N VAL A 155 5.819 17.336 1.891 1.00 0.73 N ATOM 2328 CA VAL A 155 6.936 16.411 2.022 1.00 0.80 C ATOM 2329 C VAL A 155 7.520 16.068 0.650 1.00 0.80 C ATOM 2330 O VAL A 155 8.729 16.173 0.460 1.00 0.90 O ATOM 2331 CB VAL A 155 6.483 15.166 2.792 1.00 0.87 C ATOM 2332 CG1 VAL A 155 7.595 14.121 2.822 1.00 1.22 C ATOM 2333 CG2 VAL A 155 6.144 15.540 4.238 1.00 1.53 C ATOM 0 H VAL A 155 4.935 16.980 2.254 1.00 0.73 H new ATOM 0 HA VAL A 155 7.737 16.883 2.591 1.00 0.80 H new ATOM 0 HB VAL A 155 5.606 14.760 2.288 1.00 0.87 H new ATOM 0 HG11 VAL A 155 7.255 13.244 3.373 1.00 1.22 H new ATOM 0 HG12 VAL A 155 7.851 13.832 1.802 1.00 1.22 H new ATOM 0 HG13 VAL A 155 8.474 14.539 3.312 1.00 1.22 H new ATOM 0 HG21 VAL A 155 5.823 14.650 4.778 1.00 1.53 H new ATOM 0 HG22 VAL A 155 7.026 15.960 4.722 1.00 1.53 H new ATOM 0 HG23 VAL A 155 5.341 16.277 4.244 1.00 1.53 H new ATOM 2343 N LEU A 156 6.682 15.661 -0.304 1.00 0.73 N ATOM 2344 CA LEU A 156 7.099 15.345 -1.667 1.00 0.77 C ATOM 2345 C LEU A 156 7.884 16.503 -2.284 1.00 0.85 C ATOM 2346 O LEU A 156 8.824 16.256 -3.030 1.00 1.02 O ATOM 2347 CB LEU A 156 5.893 14.993 -2.559 1.00 0.77 C ATOM 2348 CG LEU A 156 5.400 13.533 -2.511 1.00 0.61 C ATOM 2349 CD1 LEU A 156 4.331 13.347 -3.590 1.00 0.98 C ATOM 2350 CD2 LEU A 156 6.508 12.502 -2.754 1.00 0.97 C ATOM 0 H LEU A 156 5.681 15.541 -0.148 1.00 0.73 H new ATOM 0 HA LEU A 156 7.749 14.472 -1.610 1.00 0.77 H new ATOM 0 HB2 LEU A 156 5.063 15.642 -2.281 1.00 0.77 H new ATOM 0 HB3 LEU A 156 6.152 15.231 -3.591 1.00 0.77 H new ATOM 0 HG LEU A 156 5.014 13.361 -1.506 1.00 0.61 H new ATOM 0 HD11 LEU A 156 3.970 12.319 -3.571 1.00 0.98 H new ATOM 0 HD12 LEU A 156 3.500 14.027 -3.400 1.00 0.98 H new ATOM 0 HD13 LEU A 156 4.760 13.563 -4.568 1.00 0.98 H new ATOM 0 HD21 LEU A 156 6.087 11.498 -2.705 1.00 0.97 H new ATOM 0 HD22 LEU A 156 6.947 12.665 -3.739 1.00 0.97 H new ATOM 0 HD23 LEU A 156 7.279 12.610 -1.991 1.00 0.97 H new ATOM 2362 N GLN A 157 7.507 17.754 -2.009 1.00 0.81 N ATOM 2363 CA GLN A 157 8.261 18.896 -2.512 1.00 0.92 C ATOM 2364 C GLN A 157 9.572 19.099 -1.748 1.00 0.99 C ATOM 2365 O GLN A 157 10.529 19.615 -2.316 1.00 1.12 O ATOM 2366 CB GLN A 157 7.411 20.173 -2.470 1.00 0.98 C ATOM 2367 CG GLN A 157 6.232 20.078 -3.451 1.00 1.39 C ATOM 2368 CD GLN A 157 5.606 21.439 -3.746 1.00 1.98 C ATOM 2369 OE1 GLN A 157 4.428 21.672 -3.490 1.00 3.14 O ATOM 2370 NE2 GLN A 157 6.381 22.354 -4.319 1.00 2.14 N ATOM 0 H GLN A 157 6.692 17.997 -1.446 1.00 0.81 H new ATOM 0 HA GLN A 157 8.517 18.680 -3.549 1.00 0.92 H new ATOM 0 HB2 GLN A 157 7.036 20.332 -1.459 1.00 0.98 H new ATOM 0 HB3 GLN A 157 8.029 21.035 -2.720 1.00 0.98 H new ATOM 0 HG2 GLN A 157 6.575 19.629 -4.383 1.00 1.39 H new ATOM 0 HG3 GLN A 157 5.472 19.414 -3.038 1.00 1.39 H new ATOM 0 HE21 GLN A 157 7.357 22.140 -4.523 1.00 2.14 H new ATOM 0 HE22 GLN A 157 6.000 23.270 -4.555 1.00 2.14 H new ATOM 2379 N ASN A 158 9.622 18.744 -0.462 1.00 0.97 N ATOM 2380 CA ASN A 158 10.797 18.980 0.370 1.00 1.13 C ATOM 2381 C ASN A 158 11.865 17.900 0.195 1.00 1.25 C ATOM 2382 O ASN A 158 13.005 18.124 0.598 1.00 1.53 O ATOM 2383 CB ASN A 158 10.398 19.034 1.853 1.00 1.17 C ATOM 2384 CG ASN A 158 9.827 20.383 2.271 1.00 1.49 C ATOM 2385 OD1 ASN A 158 9.736 21.319 1.487 1.00 2.12 O ATOM 2386 ND2 ASN A 158 9.463 20.520 3.539 1.00 1.96 N ATOM 0 H ASN A 158 8.852 18.287 0.027 1.00 0.97 H new ATOM 0 HA ASN A 158 11.217 19.933 0.049 1.00 1.13 H new ATOM 0 HB2 ASN A 158 9.661 18.257 2.053 1.00 1.17 H new ATOM 0 HB3 ASN A 158 11.271 18.810 2.466 1.00 1.17 H new ATOM 0 HD21 ASN A 158 9.102 21.414 3.872 1.00 1.96 H new ATOM 0 HD22 ASN A 158 9.544 19.732 4.181 1.00 1.96 H new ATOM 2393 N ARG A 159 11.504 16.710 -0.291 1.00 1.15 N ATOM 2394 CA ARG A 159 12.378 15.544 -0.216 1.00 1.33 C ATOM 2395 C ARG A 159 13.164 15.353 -1.503 1.00 1.48 C ATOM 2396 O ARG A 159 14.340 14.936 -1.387 1.00 2.05 O ATOM 2397 CB ARG A 159 11.555 14.306 0.180 1.00 1.47 C ATOM 2398 CG ARG A 159 10.512 13.835 -0.852 1.00 1.82 C ATOM 2399 CD ARG A 159 10.777 12.451 -1.469 1.00 2.77 C ATOM 2400 NE ARG A 159 11.636 12.488 -2.664 1.00 3.76 N ATOM 2401 CZ ARG A 159 12.973 12.527 -2.680 1.00 4.08 C ATOM 2402 NH1 ARG A 159 13.669 12.363 -1.560 1.00 4.91 N ATOM 2403 NH2 ARG A 159 13.630 12.735 -3.819 1.00 4.35 N ATOM 0 H ARG A 159 10.607 16.531 -0.742 1.00 1.15 H new ATOM 0 HA ARG A 159 13.126 15.703 0.561 1.00 1.33 H new ATOM 0 HB2 ARG A 159 12.243 13.483 0.375 1.00 1.47 H new ATOM 0 HB3 ARG A 159 11.040 14.520 1.117 1.00 1.47 H new ATOM 0 HG2 ARG A 159 9.533 13.820 -0.374 1.00 1.82 H new ATOM 0 HG3 ARG A 159 10.463 14.570 -1.656 1.00 1.82 H new ATOM 0 HD2 ARG A 159 11.242 11.812 -0.718 1.00 2.77 H new ATOM 0 HD3 ARG A 159 9.824 11.992 -1.732 1.00 2.77 H new ATOM 0 HE ARG A 159 11.165 12.483 -3.569 1.00 3.76 H new ATOM 0 HH11 ARG A 159 13.184 12.205 -0.677 1.00 4.91 H new ATOM 0 HH12 ARG A 159 14.688 12.395 -1.584 1.00 4.91 H new ATOM 0 HH21 ARG A 159 13.114 12.866 -4.689 1.00 4.35 H new ATOM 0 HH22 ARG A 159 14.650 12.763 -3.822 1.00 4.35 H new TER 2417 ARG A 159