USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 749 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 130 LYS NZ :NH3+ -118:sc= -0.362 (180deg=-1.34!) USER MOD Set 1.2: A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -153:sc= -0.0524 (180deg=-0.527) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -161:sc= -0.0749 (180deg=-0.462) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.312 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 133:sc= 0.0191 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -1.15 K(o=-1.1,f=-0.041) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc=-0.000506 K(o=-0.00051,f=-1.4) USER MOD Single : A 101 SER OG : rot -90:sc= 0.687 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl 180:sc= -0.0112 (180deg=-0.0112) USER MOD Single : A 110 ASN : amide:sc= -0.325 X(o=-0.32,f=-0.089) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.177 X(o=-0.18,f=-0.0099) USER MOD Single : A 120 SER OG : rot -63:sc= 0.34 USER MOD Single : A 121 ASN : amide:sc= -7.15! C(o=-7.1!,f=-14!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.012 USER MOD Single : A 125 HIS : no HD1:sc= -0.0342 X(o=-0.034,f=-0.47) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -166:sc= -0.158 (180deg=-0.532) USER MOD Single : A 142 MET CE :methyl 179:sc= 0 (180deg=-0.00112) USER MOD Single : A 144 HIS : no HD1:sc= -0.637 K(o=-0.64,f=-0.042) USER MOD Single : A 169 THR OG1 : rot 170:sc= -0.231 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N TYR A 40 68.735 -50.282 58.951 1.00 12.42 N ATOM 22 CA TYR A 40 68.977 -48.950 58.409 1.00 22.11 C ATOM 23 C TYR A 40 67.726 -48.083 58.516 1.00 24.45 C ATOM 24 O TYR A 40 66.607 -48.593 58.582 1.00 54.20 O ATOM 25 CB TYR A 40 69.423 -49.043 56.949 1.00 23.35 C ATOM 26 CG TYR A 40 68.325 -49.481 56.007 1.00 15.54 C ATOM 27 CD1 TYR A 40 67.804 -48.607 55.061 1.00 4.01 C ATOM 28 CD2 TYR A 40 67.808 -50.770 56.064 1.00 42.42 C ATOM 29 CE1 TYR A 40 66.800 -49.003 54.199 1.00 21.02 C ATOM 30 CE2 TYR A 40 66.805 -51.176 55.204 1.00 64.40 C ATOM 31 CZ TYR A 40 66.304 -50.288 54.274 1.00 1.50 C ATOM 32 OH TYR A 40 65.304 -50.688 53.417 1.00 50.22 O ATOM 0 HA TYR A 40 69.770 -48.486 58.995 1.00 22.11 H new ATOM 0 HB2 TYR A 40 69.798 -48.070 56.630 1.00 23.35 H new ATOM 0 HB3 TYR A 40 70.254 -49.744 56.876 1.00 23.35 H new ATOM 0 HD1 TYR A 40 68.191 -47.601 54.999 1.00 4.01 H new ATOM 0 HD2 TYR A 40 68.197 -51.466 56.793 1.00 42.42 H new ATOM 0 HE1 TYR A 40 66.405 -48.310 53.470 1.00 21.02 H new ATOM 0 HE2 TYR A 40 66.416 -52.182 55.259 1.00 64.40 H new ATOM 0 HH TYR A 40 65.070 -51.622 53.601 1.00 50.22 H new ATOM 41 N ARG A 41 67.924 -46.769 58.533 1.00 42.12 N ATOM 42 CA ARG A 41 66.813 -45.830 58.633 1.00 44.44 C ATOM 43 C ARG A 41 66.928 -44.738 57.573 1.00 33.02 C ATOM 44 O ARG A 41 67.869 -44.724 56.779 1.00 31.23 O ATOM 45 CB ARG A 41 66.773 -45.201 60.026 1.00 62.11 C ATOM 46 CG ARG A 41 68.040 -44.444 60.390 1.00 45.24 C ATOM 47 CD ARG A 41 67.965 -42.990 59.950 1.00 64.11 C ATOM 48 NE ARG A 41 68.919 -42.151 60.670 1.00 64.53 N ATOM 49 CZ ARG A 41 69.305 -40.951 60.251 1.00 15.12 C ATOM 50 NH1 ARG A 41 68.822 -40.453 59.122 1.00 43.04 N ATOM 51 NH2 ARG A 41 70.177 -40.248 60.962 1.00 50.04 N ATOM 0 H ARG A 41 68.843 -46.330 58.479 1.00 42.12 H new ATOM 0 HA ARG A 41 65.888 -46.381 58.464 1.00 44.44 H new ATOM 0 HB2 ARG A 41 65.924 -44.520 60.083 1.00 62.11 H new ATOM 0 HB3 ARG A 41 66.603 -45.985 60.764 1.00 62.11 H new ATOM 0 HG2 ARG A 41 68.197 -44.492 61.468 1.00 45.24 H new ATOM 0 HG3 ARG A 41 68.899 -44.924 59.921 1.00 45.24 H new ATOM 0 HD2 ARG A 41 68.160 -42.925 58.880 1.00 64.11 H new ATOM 0 HD3 ARG A 41 66.955 -42.613 60.113 1.00 64.11 H new ATOM 0 HE ARG A 41 69.310 -42.506 61.542 1.00 64.53 H new ATOM 0 HH11 ARG A 41 68.152 -40.991 58.573 1.00 43.04 H new ATOM 0 HH12 ARG A 41 69.120 -39.531 58.802 1.00 43.04 H new ATOM 0 HH21 ARG A 41 70.551 -40.629 61.831 1.00 50.04 H new ATOM 0 HH22 ARG A 41 70.473 -39.327 60.640 1.00 50.04 H new ATOM 62 N LYS A 42 65.963 -43.824 57.566 1.00 32.10 N ATOM 63 CA LYS A 42 65.955 -42.727 56.604 1.00 23.45 C ATOM 64 C LYS A 42 64.860 -41.719 56.940 1.00 51.40 C ATOM 65 O LYS A 42 63.788 -42.088 57.420 1.00 73.12 O ATOM 66 CB LYS A 42 65.751 -43.265 55.187 1.00 74.10 C ATOM 67 CG LYS A 42 65.650 -42.177 54.132 1.00 31.54 C ATOM 68 CD LYS A 42 66.070 -42.687 52.764 1.00 11.00 C ATOM 69 CE LYS A 42 65.080 -43.706 52.221 1.00 51.30 C ATOM 70 NZ LYS A 42 65.444 -45.096 52.611 1.00 22.21 N ATOM 0 H LYS A 42 65.176 -43.821 58.215 1.00 32.10 H new ATOM 0 HA LYS A 42 66.919 -42.222 56.658 1.00 23.45 H new ATOM 0 HB2 LYS A 42 66.580 -43.927 54.936 1.00 74.10 H new ATOM 0 HB3 LYS A 42 64.843 -43.868 55.163 1.00 74.10 H new ATOM 0 HG2 LYS A 42 64.625 -41.808 54.085 1.00 31.54 H new ATOM 0 HG3 LYS A 42 66.280 -41.334 54.416 1.00 31.54 H new ATOM 0 HD2 LYS A 42 66.149 -41.850 52.071 1.00 11.00 H new ATOM 0 HD3 LYS A 42 67.059 -43.139 52.831 1.00 11.00 H new ATOM 0 HE2 LYS A 42 64.081 -43.475 52.591 1.00 51.30 H new ATOM 0 HE3 LYS A 42 65.042 -43.632 51.134 1.00 51.30 H new ATOM 0 HZ1 LYS A 42 65.074 -45.763 51.904 1.00 22.21 H new ATOM 0 HZ2 LYS A 42 66.479 -45.183 52.661 1.00 22.21 H new ATOM 0 HZ3 LYS A 42 65.033 -45.315 53.541 1.00 22.21 H new ATOM 80 N LYS A 43 65.137 -40.445 56.683 1.00 61.12 N ATOM 81 CA LYS A 43 64.175 -39.383 56.953 1.00 31.31 C ATOM 82 C LYS A 43 63.274 -39.143 55.746 1.00 74.32 C ATOM 83 O LYS A 43 62.050 -39.168 55.859 1.00 52.23 O ATOM 84 CB LYS A 43 64.905 -38.090 57.325 1.00 3.53 C ATOM 85 CG LYS A 43 66.014 -38.287 58.343 1.00 40.43 C ATOM 86 CD LYS A 43 66.321 -37.000 59.090 1.00 51.55 C ATOM 87 CE LYS A 43 67.441 -37.196 60.100 1.00 2.13 C ATOM 88 NZ LYS A 43 68.101 -35.909 60.451 1.00 70.32 N ATOM 0 H LYS A 43 66.020 -40.123 56.288 1.00 61.12 H new ATOM 0 HA LYS A 43 63.552 -39.696 57.791 1.00 31.31 H new ATOM 0 HB2 LYS A 43 65.327 -37.649 56.422 1.00 3.53 H new ATOM 0 HB3 LYS A 43 64.183 -37.376 57.721 1.00 3.53 H new ATOM 0 HG2 LYS A 43 65.723 -39.061 59.054 1.00 40.43 H new ATOM 0 HG3 LYS A 43 66.914 -38.639 57.839 1.00 40.43 H new ATOM 0 HD2 LYS A 43 66.603 -36.224 58.379 1.00 51.55 H new ATOM 0 HD3 LYS A 43 65.424 -36.653 59.603 1.00 51.55 H new ATOM 0 HE2 LYS A 43 67.040 -37.657 61.003 1.00 2.13 H new ATOM 0 HE3 LYS A 43 68.181 -37.885 59.693 1.00 2.13 H new ATOM 0 HZ1 LYS A 43 68.859 -36.084 61.142 1.00 70.32 H new ATOM 0 HZ2 LYS A 43 68.506 -35.481 59.594 1.00 70.32 H new ATOM 0 HZ3 LYS A 43 67.400 -35.261 60.863 1.00 70.32 H new ATOM 98 N GLY A 44 63.890 -38.913 54.590 1.00 71.44 N ATOM 99 CA GLY A 44 63.129 -38.673 53.379 1.00 13.14 C ATOM 100 C GLY A 44 62.841 -37.202 53.156 1.00 10.21 C ATOM 101 O GLY A 44 63.495 -36.549 52.343 1.00 72.21 O ATOM 0 H GLY A 44 64.903 -38.889 54.471 1.00 71.44 H new ATOM 0 HA2 GLY A 44 63.679 -39.066 52.524 1.00 13.14 H new ATOM 0 HA3 GLY A 44 62.188 -39.220 53.431 1.00 13.14 H new ATOM 105 N LYS A 45 61.857 -36.678 53.879 1.00 22.31 N ATOM 106 CA LYS A 45 61.482 -35.274 53.757 1.00 43.21 C ATOM 107 C LYS A 45 61.189 -34.913 52.305 1.00 51.22 C ATOM 108 O LYS A 45 62.048 -34.385 51.600 1.00 75.22 O ATOM 109 CB LYS A 45 62.597 -34.377 54.302 1.00 10.25 C ATOM 110 CG LYS A 45 62.105 -33.030 54.800 1.00 44.12 C ATOM 111 CD LYS A 45 61.466 -33.142 56.174 1.00 12.02 C ATOM 112 CE LYS A 45 61.237 -31.774 56.797 1.00 43.01 C ATOM 113 NZ LYS A 45 62.518 -31.057 57.046 1.00 31.03 N ATOM 0 H LYS A 45 61.305 -37.205 54.556 1.00 22.31 H new ATOM 0 HA LYS A 45 60.577 -35.114 54.342 1.00 43.21 H new ATOM 0 HB2 LYS A 45 63.102 -34.894 55.118 1.00 10.25 H new ATOM 0 HB3 LYS A 45 63.338 -34.217 53.519 1.00 10.25 H new ATOM 0 HG2 LYS A 45 62.939 -32.330 54.842 1.00 44.12 H new ATOM 0 HG3 LYS A 45 61.382 -32.622 54.094 1.00 44.12 H new ATOM 0 HD2 LYS A 45 60.515 -33.669 56.092 1.00 12.02 H new ATOM 0 HD3 LYS A 45 62.105 -33.737 56.826 1.00 12.02 H new ATOM 0 HE2 LYS A 45 60.608 -31.176 56.138 1.00 43.01 H new ATOM 0 HE3 LYS A 45 60.696 -31.889 57.736 1.00 43.01 H new ATOM 0 HZ1 LYS A 45 62.363 -30.300 57.742 1.00 31.03 H new ATOM 0 HZ2 LYS A 45 63.224 -31.726 57.414 1.00 31.03 H new ATOM 0 HZ3 LYS A 45 62.863 -30.643 56.156 1.00 31.03 H new ATOM 123 N GLY A 46 59.968 -35.200 51.862 1.00 34.43 N ATOM 124 CA GLY A 46 59.584 -34.897 50.496 1.00 14.35 C ATOM 125 C GLY A 46 58.453 -33.892 50.421 1.00 23.13 C ATOM 126 O GLY A 46 57.569 -33.874 51.278 1.00 1.34 O ATOM 0 H GLY A 46 59.238 -35.637 52.425 1.00 34.43 H new ATOM 0 HA2 GLY A 46 60.448 -34.508 49.957 1.00 14.35 H new ATOM 0 HA3 GLY A 46 59.283 -35.816 49.994 1.00 14.35 H new ATOM 130 N LYS A 47 58.480 -33.048 49.395 1.00 54.43 N ATOM 131 CA LYS A 47 57.450 -32.033 49.210 1.00 45.01 C ATOM 132 C LYS A 47 56.976 -31.996 47.760 1.00 21.45 C ATOM 133 O LYS A 47 57.608 -32.570 46.876 1.00 72.33 O ATOM 134 CB LYS A 47 57.982 -30.657 49.619 1.00 1.32 C ATOM 135 CG LYS A 47 58.258 -30.530 51.107 1.00 21.53 C ATOM 136 CD LYS A 47 58.835 -29.167 51.452 1.00 33.43 C ATOM 137 CE LYS A 47 58.915 -28.961 52.957 1.00 31.54 C ATOM 138 NZ LYS A 47 59.121 -27.529 53.310 1.00 20.45 N ATOM 0 H LYS A 47 59.205 -33.047 48.678 1.00 54.43 H new ATOM 0 HA LYS A 47 56.602 -32.292 49.844 1.00 45.01 H new ATOM 0 HB2 LYS A 47 58.901 -30.454 49.069 1.00 1.32 H new ATOM 0 HB3 LYS A 47 57.260 -29.895 49.326 1.00 1.32 H new ATOM 0 HG2 LYS A 47 57.334 -30.687 51.664 1.00 21.53 H new ATOM 0 HG3 LYS A 47 58.954 -31.310 51.417 1.00 21.53 H new ATOM 0 HD2 LYS A 47 59.830 -29.071 51.017 1.00 33.43 H new ATOM 0 HD3 LYS A 47 58.217 -28.386 51.009 1.00 33.43 H new ATOM 0 HE2 LYS A 47 57.998 -29.321 53.422 1.00 31.54 H new ATOM 0 HE3 LYS A 47 59.733 -29.556 53.362 1.00 31.54 H new ATOM 0 HZ1 LYS A 47 59.170 -27.430 54.344 1.00 20.45 H new ATOM 0 HZ2 LYS A 47 60.009 -27.192 52.887 1.00 20.45 H new ATOM 0 HZ3 LYS A 47 58.328 -26.964 52.946 1.00 20.45 H new ATOM 148 N GLY A 48 55.858 -31.316 47.525 1.00 25.51 N ATOM 149 CA GLY A 48 55.319 -31.215 46.181 1.00 34.44 C ATOM 150 C GLY A 48 54.161 -30.241 46.093 1.00 32.00 C ATOM 151 O GLY A 48 53.347 -30.144 47.013 1.00 55.35 O ATOM 0 H GLY A 48 55.316 -30.833 48.241 1.00 25.51 H new ATOM 0 HA2 GLY A 48 56.108 -30.899 45.499 1.00 34.44 H new ATOM 0 HA3 GLY A 48 54.988 -32.199 45.851 1.00 34.44 H new ATOM 155 N THR A 49 54.086 -29.514 44.982 1.00 63.43 N ATOM 156 CA THR A 49 53.022 -28.540 44.777 1.00 64.11 C ATOM 157 C THR A 49 52.517 -28.571 43.339 1.00 43.14 C ATOM 158 O THR A 49 53.250 -28.940 42.420 1.00 11.21 O ATOM 159 CB THR A 49 53.494 -27.112 45.112 1.00 53.31 C ATOM 160 OG1 THR A 49 54.816 -26.901 44.603 1.00 1.11 O ATOM 161 CG2 THR A 49 53.481 -26.877 46.615 1.00 23.03 C ATOM 0 H THR A 49 54.750 -29.582 44.211 1.00 63.43 H new ATOM 0 HA THR A 49 52.210 -28.814 45.451 1.00 64.11 H new ATOM 0 HB THR A 49 52.808 -26.407 44.643 1.00 53.31 H new ATOM 0 HG1 THR A 49 55.108 -25.991 44.818 1.00 1.11 H new ATOM 0 HG21 THR A 49 53.818 -25.862 46.828 1.00 23.03 H new ATOM 0 HG22 THR A 49 52.468 -27.010 46.995 1.00 23.03 H new ATOM 0 HG23 THR A 49 54.148 -27.590 47.100 1.00 23.03 H new ATOM 169 N THR A 50 51.261 -28.181 43.149 1.00 52.51 N ATOM 170 CA THR A 50 50.657 -28.165 41.822 1.00 74.14 C ATOM 171 C THR A 50 49.520 -27.153 41.747 1.00 72.31 C ATOM 172 O THR A 50 48.625 -27.146 42.592 1.00 13.33 O ATOM 173 CB THR A 50 50.119 -29.556 41.433 1.00 62.24 C ATOM 174 OG1 THR A 50 51.000 -30.575 41.917 1.00 55.22 O ATOM 175 CG2 THR A 50 49.977 -29.677 39.923 1.00 5.31 C ATOM 0 H THR A 50 50.641 -27.872 43.898 1.00 52.51 H new ATOM 0 HA THR A 50 51.441 -27.878 41.121 1.00 74.14 H new ATOM 0 HB THR A 50 49.136 -29.681 41.887 1.00 62.24 H new ATOM 0 HG1 THR A 50 50.650 -31.456 41.667 1.00 55.22 H new ATOM 0 HG21 THR A 50 49.596 -30.667 39.672 1.00 5.31 H new ATOM 0 HG22 THR A 50 49.283 -28.918 39.561 1.00 5.31 H new ATOM 0 HG23 THR A 50 50.950 -29.533 39.453 1.00 5.31 H new ATOM 183 N VAL A 51 49.561 -26.300 40.730 1.00 45.13 N ATOM 184 CA VAL A 51 48.531 -25.283 40.543 1.00 60.42 C ATOM 185 C VAL A 51 47.798 -25.480 39.221 1.00 1.11 C ATOM 186 O VAL A 51 48.268 -26.198 38.339 1.00 50.11 O ATOM 187 CB VAL A 51 49.130 -23.865 40.580 1.00 50.24 C ATOM 188 CG1 VAL A 51 49.556 -23.501 41.993 1.00 22.02 C ATOM 189 CG2 VAL A 51 50.303 -23.757 39.616 1.00 72.11 C ATOM 0 H VAL A 51 50.296 -26.292 40.022 1.00 45.13 H new ATOM 0 HA VAL A 51 47.825 -25.392 41.366 1.00 60.42 H new ATOM 0 HB VAL A 51 48.363 -23.158 40.265 1.00 50.24 H new ATOM 0 HG11 VAL A 51 49.977 -22.496 41.999 1.00 22.02 H new ATOM 0 HG12 VAL A 51 48.690 -23.536 42.654 1.00 22.02 H new ATOM 0 HG13 VAL A 51 50.307 -24.210 42.341 1.00 22.02 H new ATOM 0 HG21 VAL A 51 50.714 -22.748 39.655 1.00 72.11 H new ATOM 0 HG22 VAL A 51 51.074 -24.474 39.899 1.00 72.11 H new ATOM 0 HG23 VAL A 51 49.962 -23.971 38.603 1.00 72.11 H new ATOM 199 N GLY A 52 46.643 -24.835 39.089 1.00 64.41 N ATOM 200 CA GLY A 52 45.863 -24.951 37.870 1.00 23.54 C ATOM 201 C GLY A 52 44.437 -24.468 38.047 1.00 12.00 C ATOM 202 O GLY A 52 43.664 -25.058 38.803 1.00 65.13 O ATOM 0 H GLY A 52 46.233 -24.234 39.804 1.00 64.41 H new ATOM 0 HA2 GLY A 52 46.343 -24.375 37.079 1.00 23.54 H new ATOM 0 HA3 GLY A 52 45.853 -25.992 37.546 1.00 23.54 H new ATOM 206 N MET A 53 44.088 -23.393 37.350 1.00 43.22 N ATOM 207 CA MET A 53 42.744 -22.830 37.434 1.00 14.35 C ATOM 208 C MET A 53 42.422 -22.003 36.194 1.00 70.42 C ATOM 209 O MET A 53 43.307 -21.385 35.602 1.00 52.41 O ATOM 210 CB MET A 53 42.608 -21.966 38.688 1.00 24.52 C ATOM 211 CG MET A 53 43.629 -20.843 38.766 1.00 22.42 C ATOM 212 SD MET A 53 43.040 -19.314 38.011 1.00 33.40 S ATOM 213 CE MET A 53 44.589 -18.470 37.705 1.00 61.24 C ATOM 0 H MET A 53 44.716 -22.893 36.720 1.00 43.22 H new ATOM 0 HA MET A 53 42.034 -23.655 37.492 1.00 14.35 H new ATOM 0 HB2 MET A 53 41.606 -21.538 38.717 1.00 24.52 H new ATOM 0 HB3 MET A 53 42.709 -22.600 39.569 1.00 24.52 H new ATOM 0 HG2 MET A 53 43.878 -20.655 39.811 1.00 22.42 H new ATOM 0 HG3 MET A 53 44.548 -21.158 38.271 1.00 22.42 H new ATOM 0 HE1 MET A 53 44.392 -17.505 37.239 1.00 61.24 H new ATOM 0 HE2 MET A 53 45.112 -18.317 38.649 1.00 61.24 H new ATOM 0 HE3 MET A 53 45.207 -19.074 37.041 1.00 61.24 H new ATOM 221 N GLY A 54 41.151 -21.995 35.806 1.00 12.31 N ATOM 222 CA GLY A 54 40.736 -21.240 34.637 1.00 31.14 C ATOM 223 C GLY A 54 39.835 -20.074 34.991 1.00 21.23 C ATOM 224 O GLY A 54 39.596 -19.798 36.167 1.00 0.32 O ATOM 0 H GLY A 54 40.401 -22.498 36.280 1.00 12.31 H new ATOM 0 HA2 GLY A 54 41.618 -20.868 34.116 1.00 31.14 H new ATOM 0 HA3 GLY A 54 40.214 -21.903 33.947 1.00 31.14 H new ATOM 266 N ARG A 58 34.170 -20.574 27.031 1.00 34.45 N ATOM 267 CA ARG A 58 33.776 -19.845 25.832 1.00 30.14 C ATOM 268 C ARG A 58 32.298 -19.469 25.887 1.00 50.54 C ATOM 269 O ARG A 58 31.427 -20.337 25.955 1.00 75.43 O ATOM 270 CB ARG A 58 34.054 -20.684 24.585 1.00 55.21 C ATOM 271 CG ARG A 58 34.147 -19.865 23.307 1.00 31.32 C ATOM 272 CD ARG A 58 32.772 -19.442 22.816 1.00 11.43 C ATOM 273 NE ARG A 58 32.734 -19.284 21.364 1.00 62.33 N ATOM 274 CZ ARG A 58 33.181 -18.203 20.732 1.00 34.12 C ATOM 275 NH1 ARG A 58 33.697 -17.194 21.419 1.00 22.24 N ATOM 276 NH2 ARG A 58 33.113 -18.133 19.409 1.00 74.13 N ATOM 0 HA ARG A 58 34.365 -18.929 25.783 1.00 30.14 H new ATOM 0 HB2 ARG A 58 34.987 -21.230 24.725 1.00 55.21 H new ATOM 0 HB3 ARG A 58 33.264 -21.427 24.474 1.00 55.21 H new ATOM 0 HG2 ARG A 58 34.759 -18.981 23.484 1.00 31.32 H new ATOM 0 HG3 ARG A 58 34.647 -20.449 22.534 1.00 31.32 H new ATOM 0 HD2 ARG A 58 32.034 -20.185 23.119 1.00 11.43 H new ATOM 0 HD3 ARG A 58 32.491 -18.502 23.290 1.00 11.43 H new ATOM 0 HE ARG A 58 32.344 -20.043 20.806 1.00 62.33 H new ATOM 0 HH11 ARG A 58 33.752 -17.245 22.436 1.00 22.24 H new ATOM 0 HH12 ARG A 58 34.039 -16.366 20.931 1.00 22.24 H new ATOM 0 HH21 ARG A 58 32.718 -18.908 18.877 1.00 74.13 H new ATOM 0 HH22 ARG A 58 33.456 -17.304 18.924 1.00 74.13 H new ATOM 287 N ARG A 59 32.021 -18.169 25.856 1.00 32.30 N ATOM 288 CA ARG A 59 30.650 -17.678 25.904 1.00 5.12 C ATOM 289 C ARG A 59 29.937 -17.926 24.577 1.00 72.42 C ATOM 290 O ARG A 59 30.423 -17.532 23.517 1.00 65.42 O ATOM 291 CB ARG A 59 30.631 -16.184 26.233 1.00 34.42 C ATOM 292 CG ARG A 59 29.376 -15.738 26.965 1.00 42.34 C ATOM 293 CD ARG A 59 29.338 -14.227 27.134 1.00 13.10 C ATOM 294 NE ARG A 59 28.517 -13.824 28.273 1.00 13.20 N ATOM 295 CZ ARG A 59 28.018 -12.603 28.425 1.00 51.24 C ATOM 296 NH1 ARG A 59 28.255 -11.669 27.513 1.00 4.14 N ATOM 297 NH2 ARG A 59 27.280 -12.313 29.489 1.00 43.21 N ATOM 0 H ARG A 59 32.729 -17.437 25.798 1.00 32.30 H new ATOM 0 HA ARG A 59 30.123 -18.222 26.688 1.00 5.12 H new ATOM 0 HB2 ARG A 59 31.502 -15.944 26.843 1.00 34.42 H new ATOM 0 HB3 ARG A 59 30.723 -15.616 25.308 1.00 34.42 H new ATOM 0 HG2 ARG A 59 28.495 -16.066 26.413 1.00 42.34 H new ATOM 0 HG3 ARG A 59 29.335 -16.216 27.944 1.00 42.34 H new ATOM 0 HD2 ARG A 59 30.353 -13.852 27.268 1.00 13.10 H new ATOM 0 HD3 ARG A 59 28.946 -13.770 26.225 1.00 13.10 H new ATOM 0 HE ARG A 59 28.316 -14.519 28.992 1.00 13.20 H new ATOM 0 HH11 ARG A 59 28.821 -11.888 26.694 1.00 4.14 H new ATOM 0 HH12 ARG A 59 27.871 -10.732 27.631 1.00 4.14 H new ATOM 0 HH21 ARG A 59 27.095 -13.029 30.192 1.00 43.21 H new ATOM 0 HH22 ARG A 59 26.898 -11.374 29.604 1.00 43.21 H new ATOM 308 N PHE A 60 28.784 -18.583 24.645 1.00 74.14 N ATOM 309 CA PHE A 60 28.006 -18.885 23.449 1.00 32.25 C ATOM 310 C PHE A 60 26.638 -18.213 23.508 1.00 45.41 C ATOM 311 O PHE A 60 26.161 -17.840 24.580 1.00 71.43 O ATOM 312 CB PHE A 60 27.836 -20.397 23.295 1.00 15.24 C ATOM 313 CG PHE A 60 27.296 -21.070 24.524 1.00 32.44 C ATOM 314 CD1 PHE A 60 25.931 -21.131 24.754 1.00 53.53 C ATOM 315 CD2 PHE A 60 28.154 -21.641 25.451 1.00 21.45 C ATOM 316 CE1 PHE A 60 25.432 -21.749 25.886 1.00 72.25 C ATOM 317 CE2 PHE A 60 27.660 -22.260 26.584 1.00 61.41 C ATOM 318 CZ PHE A 60 26.298 -22.315 26.801 1.00 40.22 C ATOM 0 H PHE A 60 28.368 -18.916 25.515 1.00 74.14 H new ATOM 0 HA PHE A 60 28.546 -18.497 22.586 1.00 32.25 H new ATOM 0 HB2 PHE A 60 27.166 -20.595 22.458 1.00 15.24 H new ATOM 0 HB3 PHE A 60 28.800 -20.839 23.043 1.00 15.24 H new ATOM 0 HD1 PHE A 60 25.249 -20.691 24.041 1.00 53.53 H new ATOM 0 HD2 PHE A 60 29.221 -21.602 25.286 1.00 21.45 H new ATOM 0 HE1 PHE A 60 24.366 -21.789 26.054 1.00 72.25 H new ATOM 0 HE2 PHE A 60 28.339 -22.700 27.299 1.00 61.41 H new ATOM 0 HZ PHE A 60 25.910 -22.800 27.685 1.00 40.22 H new ATOM 327 N ILE A 61 26.010 -18.060 22.346 1.00 71.21 N ATOM 328 CA ILE A 61 24.697 -17.432 22.263 1.00 31.23 C ATOM 329 C ILE A 61 23.794 -18.173 21.282 1.00 75.34 C ATOM 330 O ILE A 61 24.226 -18.563 20.198 1.00 72.35 O ATOM 331 CB ILE A 61 24.804 -15.958 21.833 1.00 63.43 C ATOM 332 CG1 ILE A 61 25.733 -15.193 22.779 1.00 5.34 C ATOM 333 CG2 ILE A 61 23.426 -15.314 21.800 1.00 10.44 C ATOM 334 CD1 ILE A 61 27.184 -15.223 22.356 1.00 74.10 C ATOM 0 H ILE A 61 26.390 -18.363 21.449 1.00 71.21 H new ATOM 0 HA ILE A 61 24.261 -17.479 23.261 1.00 31.23 H new ATOM 0 HB ILE A 61 25.226 -15.918 20.829 1.00 63.43 H new ATOM 0 HG12 ILE A 61 25.402 -14.156 22.840 1.00 5.34 H new ATOM 0 HG13 ILE A 61 25.646 -15.615 23.780 1.00 5.34 H new ATOM 0 HG21 ILE A 61 23.519 -14.272 21.494 1.00 10.44 H new ATOM 0 HG22 ILE A 61 22.793 -15.846 21.090 1.00 10.44 H new ATOM 0 HG23 ILE A 61 22.978 -15.362 22.792 1.00 10.44 H new ATOM 0 HD11 ILE A 61 27.783 -14.661 23.072 1.00 74.10 H new ATOM 0 HD12 ILE A 61 27.532 -16.255 22.322 1.00 74.10 H new ATOM 0 HD13 ILE A 61 27.284 -14.774 21.368 1.00 74.10 H new ATOM 345 N ASN A 62 22.538 -18.362 21.670 1.00 5.35 N ATOM 346 CA ASN A 62 21.573 -19.054 20.824 1.00 11.41 C ATOM 347 C ASN A 62 20.366 -18.166 20.536 1.00 13.34 C ATOM 348 O ASN A 62 19.837 -17.511 21.432 1.00 31.22 O ATOM 349 CB ASN A 62 21.117 -20.353 21.492 1.00 23.53 C ATOM 350 CG ASN A 62 22.273 -21.289 21.786 1.00 51.33 C ATOM 351 OD1 ASN A 62 22.984 -21.719 20.878 1.00 15.41 O ATOM 352 ND2 ASN A 62 22.466 -21.610 23.060 1.00 63.20 N ATOM 0 H ASN A 62 22.164 -18.046 22.565 1.00 5.35 H new ATOM 0 HA ASN A 62 22.061 -19.291 19.878 1.00 11.41 H new ATOM 0 HB2 ASN A 62 20.598 -20.118 22.421 1.00 23.53 H new ATOM 0 HB3 ASN A 62 20.399 -20.858 20.846 1.00 23.53 H new ATOM 0 HD21 ASN A 62 23.228 -22.237 23.318 1.00 63.20 H new ATOM 0 HD22 ASN A 62 21.852 -21.230 23.780 1.00 63.20 H new ATOM 358 N MET A 63 19.936 -18.153 19.279 1.00 40.22 N ATOM 359 CA MET A 63 18.789 -17.347 18.872 1.00 74.15 C ATOM 360 C MET A 63 17.889 -18.125 17.919 1.00 41.32 C ATOM 361 O MET A 63 18.153 -19.287 17.608 1.00 61.35 O ATOM 362 CB MET A 63 19.260 -16.052 18.206 1.00 21.34 C ATOM 363 CG MET A 63 19.756 -15.007 19.192 1.00 43.33 C ATOM 364 SD MET A 63 18.423 -14.296 20.178 1.00 42.23 S ATOM 365 CE MET A 63 17.895 -12.955 19.115 1.00 4.33 C ATOM 0 H MET A 63 20.363 -18.690 18.525 1.00 40.22 H new ATOM 0 HA MET A 63 18.214 -17.100 19.765 1.00 74.15 H new ATOM 0 HB2 MET A 63 20.060 -16.285 17.503 1.00 21.34 H new ATOM 0 HB3 MET A 63 18.438 -15.632 17.626 1.00 21.34 H new ATOM 0 HG2 MET A 63 20.492 -15.460 19.856 1.00 43.33 H new ATOM 0 HG3 MET A 63 20.264 -14.211 18.647 1.00 43.33 H new ATOM 0 HE1 MET A 63 17.073 -12.418 19.588 1.00 4.33 H new ATOM 0 HE2 MET A 63 18.728 -12.271 18.951 1.00 4.33 H new ATOM 0 HE3 MET A 63 17.562 -13.358 18.159 1.00 4.33 H new ATOM 373 N TYR A 64 16.824 -17.478 17.458 1.00 63.32 N ATOM 374 CA TYR A 64 15.882 -18.111 16.542 1.00 71.04 C ATOM 375 C TYR A 64 15.245 -17.078 15.617 1.00 54.00 C ATOM 376 O TYR A 64 15.359 -15.874 15.841 1.00 5.41 O ATOM 377 CB TYR A 64 14.795 -18.850 17.324 1.00 73.43 C ATOM 378 CG TYR A 64 14.208 -20.027 16.579 1.00 23.41 C ATOM 379 CD1 TYR A 64 14.953 -21.180 16.364 1.00 5.40 C ATOM 380 CD2 TYR A 64 12.907 -19.986 16.092 1.00 50.12 C ATOM 381 CE1 TYR A 64 14.419 -22.257 15.683 1.00 54.32 C ATOM 382 CE2 TYR A 64 12.365 -21.059 15.412 1.00 40.54 C ATOM 383 CZ TYR A 64 13.125 -22.192 15.209 1.00 53.10 C ATOM 384 OH TYR A 64 12.590 -23.263 14.532 1.00 53.22 O ATOM 0 H TYR A 64 16.591 -16.516 17.704 1.00 63.32 H new ATOM 0 HA TYR A 64 16.433 -18.828 15.933 1.00 71.04 H new ATOM 0 HB2 TYR A 64 15.213 -19.200 18.268 1.00 73.43 H new ATOM 0 HB3 TYR A 64 13.996 -18.150 17.569 1.00 73.43 H new ATOM 0 HD1 TYR A 64 15.966 -21.235 16.735 1.00 5.40 H new ATOM 0 HD2 TYR A 64 12.310 -19.100 16.248 1.00 50.12 H new ATOM 0 HE1 TYR A 64 15.012 -23.145 15.523 1.00 54.32 H new ATOM 0 HE2 TYR A 64 11.352 -21.011 15.041 1.00 40.54 H new ATOM 0 HH TYR A 64 11.670 -23.056 14.267 1.00 53.22 H new ATOM 393 N GLY A 65 14.575 -17.560 14.575 1.00 11.43 N ATOM 394 CA GLY A 65 13.929 -16.668 13.630 1.00 30.24 C ATOM 395 C GLY A 65 12.552 -17.153 13.224 1.00 25.13 C ATOM 396 O GLY A 65 12.422 -18.068 12.412 1.00 52.33 O ATOM 0 H GLY A 65 14.468 -18.553 14.368 1.00 11.43 H new ATOM 0 HA2 GLY A 65 13.846 -15.675 14.071 1.00 30.24 H new ATOM 0 HA3 GLY A 65 14.553 -16.571 12.742 1.00 30.24 H new ATOM 400 N PHE A 66 11.518 -16.538 13.791 1.00 50.22 N ATOM 401 CA PHE A 66 10.143 -16.913 13.485 1.00 53.40 C ATOM 402 C PHE A 66 9.174 -15.808 13.891 1.00 61.10 C ATOM 403 O PHE A 66 9.323 -15.193 14.948 1.00 53.21 O ATOM 404 CB PHE A 66 9.777 -18.216 14.200 1.00 53.30 C ATOM 405 CG PHE A 66 8.323 -18.576 14.083 1.00 62.31 C ATOM 406 CD1 PHE A 66 7.428 -18.230 15.082 1.00 42.11 C ATOM 407 CD2 PHE A 66 7.853 -19.260 12.974 1.00 11.45 C ATOM 408 CE1 PHE A 66 6.089 -18.559 14.977 1.00 63.43 C ATOM 409 CE2 PHE A 66 6.515 -19.592 12.864 1.00 22.25 C ATOM 410 CZ PHE A 66 5.633 -19.242 13.867 1.00 51.20 C ATOM 0 H PHE A 66 11.607 -15.778 14.465 1.00 50.22 H new ATOM 0 HA PHE A 66 10.065 -17.062 12.408 1.00 53.40 H new ATOM 0 HB2 PHE A 66 10.378 -19.027 13.790 1.00 53.30 H new ATOM 0 HB3 PHE A 66 10.038 -18.128 15.255 1.00 53.30 H new ATOM 0 HD1 PHE A 66 7.780 -17.697 15.953 1.00 42.11 H new ATOM 0 HD2 PHE A 66 8.539 -19.537 12.187 1.00 11.45 H new ATOM 0 HE1 PHE A 66 5.401 -18.282 15.762 1.00 63.43 H new ATOM 0 HE2 PHE A 66 6.160 -20.125 11.994 1.00 22.25 H new ATOM 0 HZ PHE A 66 4.588 -19.502 13.783 1.00 51.20 H new ATOM 419 N ASP A 67 8.181 -15.560 13.044 1.00 65.40 N ATOM 420 CA ASP A 67 7.186 -14.528 13.314 1.00 71.10 C ATOM 421 C ASP A 67 5.780 -15.120 13.336 1.00 55.43 C ATOM 422 O ASP A 67 5.530 -16.207 12.813 1.00 62.34 O ATOM 423 CB ASP A 67 7.270 -13.420 12.263 1.00 71.00 C ATOM 424 CG ASP A 67 8.245 -12.326 12.651 1.00 50.21 C ATOM 425 OD1 ASP A 67 9.317 -12.234 12.018 1.00 41.41 O ATOM 426 OD2 ASP A 67 7.935 -11.561 13.588 1.00 33.15 O ATOM 0 H ASP A 67 8.043 -16.059 12.165 1.00 65.40 H new ATOM 0 HA ASP A 67 7.397 -14.103 14.295 1.00 71.10 H new ATOM 0 HB2 ASP A 67 7.573 -13.851 11.309 1.00 71.00 H new ATOM 0 HB3 ASP A 67 6.281 -12.986 12.117 1.00 71.00 H new ATOM 430 N PRO A 68 4.840 -14.391 13.954 1.00 12.12 N ATOM 431 CA PRO A 68 3.443 -14.826 14.059 1.00 42.12 C ATOM 432 C PRO A 68 2.724 -14.793 12.715 1.00 42.15 C ATOM 433 O PRO A 68 3.335 -14.533 11.677 1.00 43.32 O ATOM 434 CB PRO A 68 2.826 -13.808 15.020 1.00 22.43 C ATOM 435 CG PRO A 68 3.675 -12.591 14.880 1.00 22.21 C ATOM 436 CD PRO A 68 5.066 -13.087 14.599 1.00 54.12 C ATOM 0 HA PRO A 68 3.362 -15.858 14.400 1.00 42.12 H new ATOM 0 HB2 PRO A 68 1.788 -13.598 14.762 1.00 22.43 H new ATOM 0 HB3 PRO A 68 2.831 -14.178 16.045 1.00 22.43 H new ATOM 0 HG2 PRO A 68 3.316 -11.956 14.070 1.00 22.21 H new ATOM 0 HG3 PRO A 68 3.651 -11.991 15.790 1.00 22.21 H new ATOM 0 HD2 PRO A 68 5.611 -12.405 13.946 1.00 54.12 H new ATOM 0 HD3 PRO A 68 5.649 -13.187 15.514 1.00 54.12 H new ATOM 441 N THR A 69 1.421 -15.058 12.739 1.00 60.23 N ATOM 442 CA THR A 69 0.618 -15.060 11.522 1.00 71.14 C ATOM 443 C THR A 69 -0.842 -14.748 11.827 1.00 13.15 C ATOM 444 O THR A 69 -1.390 -15.215 12.826 1.00 44.35 O ATOM 445 CB THR A 69 0.703 -16.415 10.795 1.00 64.31 C ATOM 446 OG1 THR A 69 0.769 -17.480 11.750 1.00 22.31 O ATOM 447 CG2 THR A 69 1.920 -16.467 9.885 1.00 64.53 C ATOM 0 H THR A 69 0.899 -15.274 13.588 1.00 60.23 H new ATOM 0 HA THR A 69 1.024 -14.284 10.873 1.00 71.14 H new ATOM 0 HB THR A 69 -0.192 -16.530 10.184 1.00 64.31 H new ATOM 0 HG1 THR A 69 0.821 -18.338 11.280 1.00 22.31 H new ATOM 0 HG21 THR A 69 1.958 -17.434 9.383 1.00 64.53 H new ATOM 0 HG22 THR A 69 1.852 -15.674 9.140 1.00 64.53 H new ATOM 0 HG23 THR A 69 2.824 -16.331 10.478 1.00 64.53 H new ATOM 468 N TYR A 71 -4.811 -14.117 9.791 1.00 2.22 N ATOM 469 CA TYR A 71 -5.616 -14.170 8.577 1.00 2.44 C ATOM 470 C TYR A 71 -6.905 -13.370 8.741 1.00 21.52 C ATOM 471 O TYR A 71 -7.383 -12.740 7.798 1.00 74.51 O ATOM 472 CB TYR A 71 -5.946 -15.622 8.222 1.00 65.53 C ATOM 473 CG TYR A 71 -4.759 -16.552 8.314 1.00 74.35 C ATOM 474 CD1 TYR A 71 -4.003 -16.860 7.188 1.00 62.34 C ATOM 475 CD2 TYR A 71 -4.391 -17.125 9.524 1.00 22.45 C ATOM 476 CE1 TYR A 71 -2.917 -17.710 7.266 1.00 62.33 C ATOM 477 CE2 TYR A 71 -3.306 -17.976 9.613 1.00 42.15 C ATOM 478 CZ TYR A 71 -2.572 -18.265 8.481 1.00 30.10 C ATOM 479 OH TYR A 71 -1.491 -19.112 8.565 1.00 14.35 O ATOM 0 HA TYR A 71 -5.036 -13.727 7.768 1.00 2.44 H new ATOM 0 HB2 TYR A 71 -6.731 -15.981 8.888 1.00 65.53 H new ATOM 0 HB3 TYR A 71 -6.347 -15.657 7.209 1.00 65.53 H new ATOM 0 HD1 TYR A 71 -4.270 -16.427 6.235 1.00 62.34 H new ATOM 0 HD2 TYR A 71 -4.963 -16.901 10.412 1.00 22.45 H new ATOM 0 HE1 TYR A 71 -2.341 -17.939 6.381 1.00 62.33 H new ATOM 0 HE2 TYR A 71 -3.034 -18.412 10.563 1.00 42.15 H new ATOM 0 HH TYR A 71 -1.384 -19.415 9.491 1.00 14.35 H new ATOM 488 N SER A 72 -7.462 -13.400 9.947 1.00 21.43 N ATOM 489 CA SER A 72 -8.697 -12.681 10.237 1.00 64.52 C ATOM 490 C SER A 72 -8.426 -11.476 11.134 1.00 41.25 C ATOM 491 O SER A 72 -8.452 -11.582 12.360 1.00 22.10 O ATOM 492 CB SER A 72 -9.709 -13.611 10.907 1.00 33.14 C ATOM 493 OG SER A 72 -10.765 -12.875 11.500 1.00 53.22 O ATOM 0 H SER A 72 -7.078 -13.915 10.739 1.00 21.43 H new ATOM 0 HA SER A 72 -9.111 -12.325 9.293 1.00 64.52 H new ATOM 0 HB2 SER A 72 -10.114 -14.304 10.170 1.00 33.14 H new ATOM 0 HB3 SER A 72 -9.208 -14.211 11.667 1.00 33.14 H new ATOM 0 HG SER A 72 -11.623 -13.280 11.256 1.00 53.22 H new ATOM 498 N PHE A 73 -8.167 -10.331 10.512 1.00 71.24 N ATOM 499 CA PHE A 73 -7.889 -9.104 11.252 1.00 13.43 C ATOM 500 C PHE A 73 -8.123 -7.877 10.377 1.00 30.43 C ATOM 501 O PHE A 73 -8.521 -7.994 9.218 1.00 12.22 O ATOM 502 CB PHE A 73 -6.449 -9.110 11.769 1.00 23.15 C ATOM 503 CG PHE A 73 -5.419 -9.081 10.676 1.00 24.34 C ATOM 504 CD1 PHE A 73 -4.690 -7.930 10.425 1.00 71.51 C ATOM 505 CD2 PHE A 73 -5.182 -10.203 9.900 1.00 20.21 C ATOM 506 CE1 PHE A 73 -3.741 -7.900 9.420 1.00 25.24 C ATOM 507 CE2 PHE A 73 -4.235 -10.179 8.894 1.00 34.41 C ATOM 508 CZ PHE A 73 -3.514 -9.025 8.654 1.00 41.44 C ATOM 0 H PHE A 73 -8.144 -10.226 9.498 1.00 71.24 H new ATOM 0 HA PHE A 73 -8.571 -9.058 12.101 1.00 13.43 H new ATOM 0 HB2 PHE A 73 -6.301 -8.248 12.419 1.00 23.15 H new ATOM 0 HB3 PHE A 73 -6.294 -10.000 12.379 1.00 23.15 H new ATOM 0 HD1 PHE A 73 -4.865 -7.046 11.021 1.00 71.51 H new ATOM 0 HD2 PHE A 73 -5.744 -11.107 10.083 1.00 20.21 H new ATOM 0 HE1 PHE A 73 -3.178 -6.997 9.235 1.00 25.24 H new ATOM 0 HE2 PHE A 73 -4.059 -11.061 8.296 1.00 34.41 H new ATOM 0 HZ PHE A 73 -2.774 -9.004 7.868 1.00 41.44 H new ATOM 517 N ILE A 74 -7.873 -6.700 10.941 1.00 23.52 N ATOM 518 CA ILE A 74 -8.054 -5.450 10.213 1.00 11.52 C ATOM 519 C ILE A 74 -6.718 -4.891 9.738 1.00 33.42 C ATOM 520 O ILE A 74 -5.737 -4.884 10.483 1.00 2.15 O ATOM 521 CB ILE A 74 -8.763 -4.392 11.079 1.00 63.21 C ATOM 522 CG1 ILE A 74 -10.139 -4.898 11.518 1.00 41.14 C ATOM 523 CG2 ILE A 74 -8.892 -3.083 10.315 1.00 65.10 C ATOM 524 CD1 ILE A 74 -10.655 -4.233 12.774 1.00 64.10 C ATOM 0 H ILE A 74 -7.545 -6.586 11.900 1.00 23.52 H new ATOM 0 HA ILE A 74 -8.677 -5.676 9.348 1.00 11.52 H new ATOM 0 HB ILE A 74 -8.163 -4.212 11.971 1.00 63.21 H new ATOM 0 HG12 ILE A 74 -10.852 -4.733 10.710 1.00 41.14 H new ATOM 0 HG13 ILE A 74 -10.086 -5.974 11.682 1.00 41.14 H new ATOM 0 HG21 ILE A 74 -9.395 -2.345 10.940 1.00 65.10 H new ATOM 0 HG22 ILE A 74 -7.900 -2.718 10.049 1.00 65.10 H new ATOM 0 HG23 ILE A 74 -9.473 -3.247 9.408 1.00 65.10 H new ATOM 0 HD11 ILE A 74 -11.634 -4.641 13.026 1.00 64.10 H new ATOM 0 HD12 ILE A 74 -9.963 -4.419 13.595 1.00 64.10 H new ATOM 0 HD13 ILE A 74 -10.741 -3.159 12.608 1.00 64.10 H new ATOM 535 N GLN A 75 -6.687 -4.421 8.496 1.00 44.14 N ATOM 536 CA GLN A 75 -5.470 -3.857 7.923 1.00 13.13 C ATOM 537 C GLN A 75 -5.463 -2.338 8.045 1.00 21.32 C ATOM 538 O GLN A 75 -6.259 -1.650 7.406 1.00 63.15 O ATOM 539 CB GLN A 75 -5.338 -4.264 6.454 1.00 61.20 C ATOM 540 CG GLN A 75 -4.848 -5.689 6.258 1.00 25.13 C ATOM 541 CD GLN A 75 -4.534 -6.004 4.809 1.00 53.40 C ATOM 542 OE1 GLN A 75 -5.136 -5.441 3.894 1.00 22.12 O ATOM 543 NE2 GLN A 75 -3.588 -6.909 4.592 1.00 14.53 N ATOM 0 H GLN A 75 -7.490 -4.419 7.867 1.00 44.14 H new ATOM 0 HA GLN A 75 -4.620 -4.250 8.480 1.00 13.13 H new ATOM 0 HB2 GLN A 75 -6.306 -4.152 5.966 1.00 61.20 H new ATOM 0 HB3 GLN A 75 -4.650 -3.581 5.957 1.00 61.20 H new ATOM 0 HG2 GLN A 75 -3.955 -5.848 6.862 1.00 25.13 H new ATOM 0 HG3 GLN A 75 -5.606 -6.383 6.621 1.00 25.13 H new ATOM 0 HE21 GLN A 75 -3.115 -7.351 5.380 1.00 14.53 H new ATOM 0 HE22 GLN A 75 -3.334 -7.163 3.637 1.00 14.53 H new ATOM 550 N PHE A 76 -4.560 -1.819 8.871 1.00 10.22 N ATOM 551 CA PHE A 76 -4.451 -0.380 9.078 1.00 20.41 C ATOM 552 C PHE A 76 -3.525 0.251 8.042 1.00 35.24 C ATOM 553 O PHE A 76 -2.445 -0.270 7.760 1.00 73.51 O ATOM 554 CB PHE A 76 -3.935 -0.084 10.488 1.00 21.11 C ATOM 555 CG PHE A 76 -3.746 1.381 10.762 1.00 13.12 C ATOM 556 CD1 PHE A 76 -2.607 2.039 10.329 1.00 60.24 C ATOM 557 CD2 PHE A 76 -4.708 2.098 11.454 1.00 63.12 C ATOM 558 CE1 PHE A 76 -2.431 3.386 10.580 1.00 30.31 C ATOM 559 CE2 PHE A 76 -4.538 3.446 11.709 1.00 44.21 C ATOM 560 CZ PHE A 76 -3.398 4.091 11.270 1.00 54.01 C ATOM 0 H PHE A 76 -3.893 -2.374 9.408 1.00 10.22 H new ATOM 0 HA PHE A 76 -5.444 0.054 8.963 1.00 20.41 H new ATOM 0 HB2 PHE A 76 -4.635 -0.494 11.216 1.00 21.11 H new ATOM 0 HB3 PHE A 76 -2.985 -0.598 10.634 1.00 21.11 H new ATOM 0 HD1 PHE A 76 -1.848 1.493 9.789 1.00 60.24 H new ATOM 0 HD2 PHE A 76 -5.601 1.598 11.798 1.00 63.12 H new ATOM 0 HE1 PHE A 76 -1.538 3.887 10.237 1.00 30.31 H new ATOM 0 HE2 PHE A 76 -5.295 3.994 12.250 1.00 44.21 H new ATOM 0 HZ PHE A 76 -3.263 5.144 11.466 1.00 54.01 H new ATOM 569 N VAL A 77 -3.954 1.374 7.478 1.00 1.44 N ATOM 570 CA VAL A 77 -3.165 2.077 6.474 1.00 12.42 C ATOM 571 C VAL A 77 -3.352 3.585 6.585 1.00 62.14 C ATOM 572 O VAL A 77 -4.418 4.063 6.973 1.00 33.01 O ATOM 573 CB VAL A 77 -3.541 1.627 5.050 1.00 71.14 C ATOM 574 CG1 VAL A 77 -2.593 2.240 4.029 1.00 3.22 C ATOM 575 CG2 VAL A 77 -3.533 0.109 4.951 1.00 22.23 C ATOM 0 H VAL A 77 -4.845 1.818 7.699 1.00 1.44 H new ATOM 0 HA VAL A 77 -2.120 1.829 6.662 1.00 12.42 H new ATOM 0 HB VAL A 77 -4.550 1.977 4.832 1.00 71.14 H new ATOM 0 HG11 VAL A 77 -2.874 1.911 3.028 1.00 3.22 H new ATOM 0 HG12 VAL A 77 -2.653 3.327 4.084 1.00 3.22 H new ATOM 0 HG13 VAL A 77 -1.573 1.921 4.243 1.00 3.22 H new ATOM 0 HG21 VAL A 77 -3.801 -0.191 3.938 1.00 22.23 H new ATOM 0 HG22 VAL A 77 -2.538 -0.266 5.189 1.00 22.23 H new ATOM 0 HG23 VAL A 77 -4.255 -0.305 5.655 1.00 22.23 H new ATOM 585 N ASP A 78 -2.307 4.332 6.242 1.00 51.00 N ATOM 586 CA ASP A 78 -2.356 5.788 6.301 1.00 42.44 C ATOM 587 C ASP A 78 -2.632 6.379 4.922 1.00 61.24 C ATOM 588 O ASP A 78 -2.141 5.894 3.903 1.00 53.35 O ATOM 589 CB ASP A 78 -1.041 6.341 6.853 1.00 5.42 C ATOM 590 CG ASP A 78 -1.260 7.393 7.923 1.00 62.02 C ATOM 591 OD1 ASP A 78 -0.754 8.522 7.756 1.00 4.50 O ATOM 592 OD2 ASP A 78 -1.936 7.087 8.928 1.00 44.44 O ATOM 0 H ASP A 78 -1.416 3.953 5.920 1.00 51.00 H new ATOM 0 HA ASP A 78 -3.170 6.073 6.968 1.00 42.44 H new ATOM 0 HB2 ASP A 78 -0.451 5.523 7.267 1.00 5.42 H new ATOM 0 HB3 ASP A 78 -0.460 6.772 6.037 1.00 5.42 H new ATOM 596 N PRO A 79 -3.437 7.451 4.886 1.00 21.45 N ATOM 597 CA PRO A 79 -3.797 8.131 3.639 1.00 60.20 C ATOM 598 C PRO A 79 -2.617 8.875 3.024 1.00 75.25 C ATOM 599 O PRO A 79 -2.537 9.035 1.804 1.00 10.03 O ATOM 600 CB PRO A 79 -4.883 9.118 4.074 1.00 54.21 C ATOM 601 CG PRO A 79 -4.612 9.369 5.517 1.00 2.34 C ATOM 602 CD PRO A 79 -4.058 8.083 6.064 1.00 41.11 C ATOM 0 HA PRO A 79 -4.122 7.429 2.871 1.00 60.20 H new ATOM 0 HB2 PRO A 79 -4.834 10.041 3.496 1.00 54.21 H new ATOM 0 HB3 PRO A 79 -5.879 8.701 3.925 1.00 54.21 H new ATOM 0 HG2 PRO A 79 -3.901 10.186 5.644 1.00 2.34 H new ATOM 0 HG3 PRO A 79 -5.524 9.655 6.041 1.00 2.34 H new ATOM 0 HD2 PRO A 79 -3.329 8.263 6.854 1.00 41.11 H new ATOM 0 HD3 PRO A 79 -4.842 7.457 6.490 1.00 41.11 H new ATOM 607 N LEU A 80 -1.701 9.328 3.872 1.00 32.22 N ATOM 608 CA LEU A 80 -0.523 10.056 3.411 1.00 21.02 C ATOM 609 C LEU A 80 0.179 9.299 2.288 1.00 63.03 C ATOM 610 O LEU A 80 0.146 9.715 1.129 1.00 23.22 O ATOM 611 CB LEU A 80 0.447 10.283 4.572 1.00 61.11 C ATOM 612 CG LEU A 80 -0.118 11.030 5.782 1.00 54.04 C ATOM 613 CD1 LEU A 80 0.890 11.038 6.921 1.00 21.10 C ATOM 614 CD2 LEU A 80 -0.503 12.451 5.399 1.00 44.43 C ATOM 0 H LEU A 80 -1.751 9.204 4.883 1.00 32.22 H new ATOM 0 HA LEU A 80 -0.850 11.021 3.025 1.00 21.02 H new ATOM 0 HB2 LEU A 80 0.814 9.313 4.908 1.00 61.11 H new ATOM 0 HB3 LEU A 80 1.308 10.837 4.197 1.00 61.11 H new ATOM 0 HG LEU A 80 -1.015 10.511 6.120 1.00 54.04 H new ATOM 0 HD11 LEU A 80 0.472 11.573 7.773 1.00 21.10 H new ATOM 0 HD12 LEU A 80 1.118 10.013 7.213 1.00 21.10 H new ATOM 0 HD13 LEU A 80 1.804 11.534 6.594 1.00 21.10 H new ATOM 0 HD21 LEU A 80 -0.903 12.967 6.272 1.00 44.43 H new ATOM 0 HD22 LEU A 80 0.377 12.981 5.036 1.00 44.43 H new ATOM 0 HD23 LEU A 80 -1.260 12.424 4.615 1.00 44.43 H new ATOM 625 N THR A 81 0.813 8.184 2.638 1.00 44.14 N ATOM 626 CA THR A 81 1.521 7.369 1.659 1.00 72.44 C ATOM 627 C THR A 81 0.909 5.977 1.556 1.00 3.32 C ATOM 628 O THR A 81 0.699 5.460 0.459 1.00 72.53 O ATOM 629 CB THR A 81 3.014 7.236 2.016 1.00 12.30 C ATOM 630 OG1 THR A 81 3.627 6.241 1.189 1.00 14.05 O ATOM 631 CG2 THR A 81 3.190 6.864 3.481 1.00 41.42 C ATOM 0 H THR A 81 0.850 7.825 3.592 1.00 44.14 H new ATOM 0 HA THR A 81 1.427 7.875 0.698 1.00 72.44 H new ATOM 0 HB THR A 81 3.494 8.199 1.843 1.00 12.30 H new ATOM 0 HG1 THR A 81 4.576 6.163 1.420 1.00 14.05 H new ATOM 0 HG21 THR A 81 4.252 6.776 3.709 1.00 41.42 H new ATOM 0 HG22 THR A 81 2.747 7.637 4.109 1.00 41.42 H new ATOM 0 HG23 THR A 81 2.697 5.912 3.676 1.00 41.42 H new ATOM 639 N GLY A 82 0.620 5.375 2.707 1.00 52.13 N ATOM 640 CA GLY A 82 0.033 4.048 2.723 1.00 50.14 C ATOM 641 C GLY A 82 0.752 3.107 3.669 1.00 64.31 C ATOM 642 O GLY A 82 1.107 1.991 3.295 1.00 13.11 O ATOM 0 H GLY A 82 0.782 5.783 3.628 1.00 52.13 H new ATOM 0 HA2 GLY A 82 -1.015 4.121 3.015 1.00 50.14 H new ATOM 0 HA3 GLY A 82 0.055 3.632 1.716 1.00 50.14 H new ATOM 646 N ALA A 83 0.969 3.561 4.900 1.00 51.13 N ATOM 647 CA ALA A 83 1.650 2.752 5.903 1.00 50.14 C ATOM 648 C ALA A 83 0.983 1.389 6.054 1.00 1.12 C ATOM 649 O ALA A 83 -0.108 1.161 5.532 1.00 24.41 O ATOM 650 CB ALA A 83 1.677 3.479 7.238 1.00 62.32 C ATOM 0 H ALA A 83 0.683 4.484 5.226 1.00 51.13 H new ATOM 0 HA ALA A 83 2.675 2.591 5.569 1.00 50.14 H new ATOM 0 HB1 ALA A 83 2.189 2.863 7.977 1.00 62.32 H new ATOM 0 HB2 ALA A 83 2.206 4.426 7.126 1.00 62.32 H new ATOM 0 HB3 ALA A 83 0.656 3.670 7.569 1.00 62.32 H new ATOM 656 N GLN A 84 1.646 0.487 6.770 1.00 34.40 N ATOM 657 CA GLN A 84 1.117 -0.854 6.988 1.00 55.44 C ATOM 658 C GLN A 84 1.168 -1.226 8.466 1.00 42.32 C ATOM 659 O GLN A 84 2.246 -1.374 9.042 1.00 65.33 O ATOM 660 CB GLN A 84 1.904 -1.877 6.165 1.00 65.05 C ATOM 661 CG GLN A 84 2.553 -1.287 4.924 1.00 54.43 C ATOM 662 CD GLN A 84 4.035 -1.028 5.106 1.00 72.13 C ATOM 663 OE1 GLN A 84 4.819 -1.141 4.162 1.00 24.44 O ATOM 664 NE2 GLN A 84 4.430 -0.678 6.326 1.00 10.53 N ATOM 0 H GLN A 84 2.550 0.660 7.209 1.00 34.40 H new ATOM 0 HA GLN A 84 0.076 -0.863 6.665 1.00 55.44 H new ATOM 0 HB2 GLN A 84 2.677 -2.320 6.794 1.00 65.05 H new ATOM 0 HB3 GLN A 84 1.234 -2.684 5.867 1.00 65.05 H new ATOM 0 HG2 GLN A 84 2.408 -1.967 4.085 1.00 54.43 H new ATOM 0 HG3 GLN A 84 2.054 -0.353 4.667 1.00 54.43 H new ATOM 0 HE21 GLN A 84 3.747 -0.596 7.079 1.00 10.53 H new ATOM 0 HE22 GLN A 84 5.416 -0.491 6.509 1.00 10.53 H new ATOM 671 N ILE A 85 -0.004 -1.376 9.074 1.00 64.24 N ATOM 672 CA ILE A 85 -0.092 -1.731 10.485 1.00 3.41 C ATOM 673 C ILE A 85 -1.226 -2.720 10.733 1.00 24.03 C ATOM 674 O ILE A 85 -2.258 -2.676 10.064 1.00 22.15 O ATOM 675 CB ILE A 85 -0.309 -0.487 11.366 1.00 71.40 C ATOM 676 CG1 ILE A 85 0.939 0.398 11.352 1.00 62.41 C ATOM 677 CG2 ILE A 85 -0.656 -0.899 12.789 1.00 35.52 C ATOM 678 CD1 ILE A 85 0.638 1.863 11.120 1.00 72.14 C ATOM 0 H ILE A 85 -0.905 -1.257 8.612 1.00 64.24 H new ATOM 0 HA ILE A 85 0.857 -2.195 10.754 1.00 3.41 H new ATOM 0 HB ILE A 85 -1.143 0.086 10.961 1.00 71.40 H new ATOM 0 HG12 ILE A 85 1.463 0.289 12.302 1.00 62.41 H new ATOM 0 HG13 ILE A 85 1.615 0.046 10.573 1.00 62.41 H new ATOM 0 HG21 ILE A 85 -0.806 -0.008 13.399 1.00 35.52 H new ATOM 0 HG22 ILE A 85 -1.570 -1.493 12.783 1.00 35.52 H new ATOM 0 HG23 ILE A 85 0.159 -1.491 13.205 1.00 35.52 H new ATOM 0 HD11 ILE A 85 1.569 2.430 11.123 1.00 72.14 H new ATOM 0 HD12 ILE A 85 0.142 1.984 10.157 1.00 72.14 H new ATOM 0 HD13 ILE A 85 -0.013 2.231 11.913 1.00 72.14 H new ATOM 689 N GLU A 86 -1.028 -3.610 11.700 1.00 72.32 N ATOM 690 CA GLU A 86 -2.034 -4.609 12.037 1.00 23.31 C ATOM 691 C GLU A 86 -3.035 -4.054 13.047 1.00 61.20 C ATOM 692 O GLU A 86 -2.670 -3.704 14.170 1.00 53.44 O ATOM 693 CB GLU A 86 -1.369 -5.867 12.600 1.00 23.43 C ATOM 694 CG GLU A 86 -2.352 -6.860 13.196 1.00 24.12 C ATOM 695 CD GLU A 86 -1.827 -8.283 13.178 1.00 61.31 C ATOM 696 OE1 GLU A 86 -0.768 -8.533 13.790 1.00 23.34 O ATOM 697 OE2 GLU A 86 -2.476 -9.146 12.550 1.00 70.53 O ATOM 0 H GLU A 86 -0.179 -3.659 12.264 1.00 72.32 H new ATOM 0 HA GLU A 86 -2.570 -4.869 11.124 1.00 23.31 H new ATOM 0 HB2 GLU A 86 -0.807 -6.357 11.805 1.00 23.43 H new ATOM 0 HB3 GLU A 86 -0.650 -5.576 13.366 1.00 23.43 H new ATOM 0 HG2 GLU A 86 -2.576 -6.572 14.223 1.00 24.12 H new ATOM 0 HG3 GLU A 86 -3.289 -6.815 12.641 1.00 24.12 H new ATOM 702 N GLU A 87 -4.298 -3.976 12.640 1.00 54.21 N ATOM 703 CA GLU A 87 -5.350 -3.462 13.508 1.00 32.34 C ATOM 704 C GLU A 87 -6.296 -4.580 13.937 1.00 31.33 C ATOM 705 O GLU A 87 -6.639 -5.455 13.144 1.00 32.32 O ATOM 706 CB GLU A 87 -6.137 -2.359 12.797 1.00 51.01 C ATOM 707 CG GLU A 87 -7.407 -1.951 13.524 1.00 72.13 C ATOM 708 CD GLU A 87 -7.638 -0.453 13.497 1.00 63.03 C ATOM 709 OE1 GLU A 87 -8.709 -0.026 13.019 1.00 42.30 O ATOM 710 OE2 GLU A 87 -6.747 0.294 13.955 1.00 11.31 O ATOM 0 H GLU A 87 -4.617 -4.262 11.715 1.00 54.21 H new ATOM 0 HA GLU A 87 -4.879 -3.046 14.398 1.00 32.34 H new ATOM 0 HB2 GLU A 87 -5.497 -1.484 12.683 1.00 51.01 H new ATOM 0 HB3 GLU A 87 -6.396 -2.698 11.794 1.00 51.01 H new ATOM 0 HG2 GLU A 87 -8.260 -2.455 13.069 1.00 72.13 H new ATOM 0 HG3 GLU A 87 -7.353 -2.288 14.559 1.00 72.13 H new ATOM 715 N ASN A 88 -6.712 -4.544 15.199 1.00 13.14 N ATOM 716 CA ASN A 88 -7.617 -5.554 15.735 1.00 54.23 C ATOM 717 C ASN A 88 -8.859 -4.907 16.339 1.00 62.12 C ATOM 718 O ASN A 88 -9.094 -3.711 16.168 1.00 40.41 O ATOM 719 CB ASN A 88 -6.903 -6.399 16.792 1.00 33.41 C ATOM 720 CG ASN A 88 -5.455 -6.674 16.432 1.00 33.20 C ATOM 721 OD1 ASN A 88 -5.157 -7.162 15.342 1.00 35.03 O ATOM 722 ND2 ASN A 88 -4.547 -6.361 17.349 1.00 1.14 N ATOM 0 H ASN A 88 -6.437 -3.826 15.869 1.00 13.14 H new ATOM 0 HA ASN A 88 -7.929 -6.199 14.913 1.00 54.23 H new ATOM 0 HB2 ASN A 88 -6.944 -5.885 17.752 1.00 33.41 H new ATOM 0 HB3 ASN A 88 -7.430 -7.345 16.914 1.00 33.41 H new ATOM 0 HD21 ASN A 88 -3.557 -6.523 17.163 1.00 1.14 H new ATOM 0 HD22 ASN A 88 -4.839 -5.958 18.239 1.00 1.14 H new ATOM 728 N VAL A 89 -9.650 -5.705 17.049 1.00 14.43 N ATOM 729 CA VAL A 89 -10.868 -5.210 17.680 1.00 35.42 C ATOM 730 C VAL A 89 -10.555 -4.120 18.698 1.00 72.43 C ATOM 731 O VAL A 89 -11.284 -3.135 18.812 1.00 24.41 O ATOM 732 CB VAL A 89 -11.637 -6.345 18.381 1.00 14.22 C ATOM 733 CG1 VAL A 89 -12.913 -5.813 19.016 1.00 2.21 C ATOM 734 CG2 VAL A 89 -11.948 -7.464 17.399 1.00 54.32 C ATOM 0 H VAL A 89 -9.469 -6.697 17.202 1.00 14.43 H new ATOM 0 HA VAL A 89 -11.490 -4.795 16.887 1.00 35.42 H new ATOM 0 HB VAL A 89 -11.007 -6.751 19.172 1.00 14.22 H new ATOM 0 HG11 VAL A 89 -13.443 -6.629 19.507 1.00 2.21 H new ATOM 0 HG12 VAL A 89 -12.662 -5.049 19.752 1.00 2.21 H new ATOM 0 HG13 VAL A 89 -13.549 -5.379 18.245 1.00 2.21 H new ATOM 0 HG21 VAL A 89 -12.492 -8.257 17.912 1.00 54.32 H new ATOM 0 HG22 VAL A 89 -12.558 -7.074 16.584 1.00 54.32 H new ATOM 0 HG23 VAL A 89 -11.017 -7.864 16.996 1.00 54.32 H new ATOM 744 N TYR A 90 -9.464 -4.301 19.434 1.00 74.35 N ATOM 745 CA TYR A 90 -9.053 -3.332 20.444 1.00 13.24 C ATOM 746 C TYR A 90 -7.719 -2.691 20.074 1.00 73.21 C ATOM 747 O TYR A 90 -6.831 -2.553 20.914 1.00 73.14 O ATOM 748 CB TYR A 90 -8.946 -4.007 21.812 1.00 21.33 C ATOM 749 CG TYR A 90 -8.196 -5.320 21.784 1.00 3.15 C ATOM 750 CD1 TYR A 90 -8.862 -6.516 21.545 1.00 31.31 C ATOM 751 CD2 TYR A 90 -6.825 -5.364 21.996 1.00 30.21 C ATOM 752 CE1 TYR A 90 -8.182 -7.718 21.519 1.00 2.32 C ATOM 753 CE2 TYR A 90 -6.137 -6.561 21.970 1.00 75.52 C ATOM 754 CZ TYR A 90 -6.820 -7.736 21.731 1.00 74.12 C ATOM 755 OH TYR A 90 -6.137 -8.931 21.706 1.00 2.24 O ATOM 0 H TYR A 90 -8.848 -5.110 19.350 1.00 74.35 H new ATOM 0 HA TYR A 90 -9.810 -2.549 20.490 1.00 13.24 H new ATOM 0 HB2 TYR A 90 -8.448 -3.328 22.504 1.00 21.33 H new ATOM 0 HB3 TYR A 90 -9.949 -4.180 22.202 1.00 21.33 H new ATOM 0 HD1 TYR A 90 -9.929 -6.505 21.377 1.00 31.31 H new ATOM 0 HD2 TYR A 90 -6.287 -4.447 22.184 1.00 30.21 H new ATOM 0 HE1 TYR A 90 -8.715 -8.639 21.334 1.00 2.32 H new ATOM 0 HE2 TYR A 90 -5.070 -6.577 22.136 1.00 75.52 H new ATOM 0 HH TYR A 90 -5.185 -8.767 21.873 1.00 2.24 H new ATOM 764 N ALA A 91 -7.588 -2.301 18.811 1.00 55.32 N ATOM 765 CA ALA A 91 -6.365 -1.672 18.329 1.00 35.21 C ATOM 766 C ALA A 91 -6.081 -0.376 19.080 1.00 71.21 C ATOM 767 O ALA A 91 -6.935 0.508 19.157 1.00 72.21 O ATOM 768 CB ALA A 91 -6.460 -1.407 16.833 1.00 3.04 C ATOM 0 H ALA A 91 -8.314 -2.410 18.103 1.00 55.32 H new ATOM 0 HA ALA A 91 -5.538 -2.357 18.513 1.00 35.21 H new ATOM 0 HB1 ALA A 91 -5.539 -0.937 16.488 1.00 3.04 H new ATOM 0 HB2 ALA A 91 -6.607 -2.349 16.305 1.00 3.04 H new ATOM 0 HB3 ALA A 91 -7.302 -0.745 16.634 1.00 3.04 H new ATOM 774 N ASP A 92 -4.878 -0.270 19.635 1.00 44.22 N ATOM 775 CA ASP A 92 -4.482 0.920 20.380 1.00 51.43 C ATOM 776 C ASP A 92 -3.560 1.803 19.545 1.00 11.32 C ATOM 777 O ASP A 92 -2.635 1.312 18.896 1.00 25.41 O ATOM 778 CB ASP A 92 -3.786 0.522 21.682 1.00 24.42 C ATOM 779 CG ASP A 92 -2.696 -0.509 21.465 1.00 13.15 C ATOM 780 OD1 ASP A 92 -2.998 -1.719 21.548 1.00 44.03 O ATOM 781 OD2 ASP A 92 -1.541 -0.107 21.212 1.00 35.35 O ATOM 0 H ASP A 92 -4.161 -0.993 19.583 1.00 44.22 H new ATOM 0 HA ASP A 92 -5.382 1.488 20.616 1.00 51.43 H new ATOM 0 HB2 ASP A 92 -3.355 1.409 22.146 1.00 24.42 H new ATOM 0 HB3 ASP A 92 -4.524 0.125 22.378 1.00 24.42 H new ATOM 785 N ILE A 93 -3.818 3.106 19.565 1.00 4.04 N ATOM 786 CA ILE A 93 -3.012 4.056 18.811 1.00 43.43 C ATOM 787 C ILE A 93 -1.529 3.886 19.120 1.00 31.10 C ATOM 788 O ILE A 93 -0.677 4.070 18.250 1.00 41.33 O ATOM 789 CB ILE A 93 -3.425 5.509 19.112 1.00 71.14 C ATOM 790 CG1 ILE A 93 -4.901 5.723 18.775 1.00 23.01 C ATOM 791 CG2 ILE A 93 -2.551 6.480 18.332 1.00 30.11 C ATOM 792 CD1 ILE A 93 -5.216 5.554 17.305 1.00 22.32 C ATOM 0 H ILE A 93 -4.580 3.528 20.096 1.00 4.04 H new ATOM 0 HA ILE A 93 -3.186 3.849 17.755 1.00 43.43 H new ATOM 0 HB ILE A 93 -3.284 5.698 20.176 1.00 71.14 H new ATOM 0 HG12 ILE A 93 -5.502 5.019 19.350 1.00 23.01 H new ATOM 0 HG13 ILE A 93 -5.195 6.725 19.089 1.00 23.01 H new ATOM 0 HG21 ILE A 93 -2.855 7.503 18.555 1.00 30.11 H new ATOM 0 HG22 ILE A 93 -1.508 6.341 18.617 1.00 30.11 H new ATOM 0 HG23 ILE A 93 -2.663 6.293 17.264 1.00 30.11 H new ATOM 0 HD11 ILE A 93 -6.280 5.720 17.140 1.00 22.32 H new ATOM 0 HD12 ILE A 93 -4.641 6.276 16.724 1.00 22.32 H new ATOM 0 HD13 ILE A 93 -4.953 4.544 16.990 1.00 22.32 H new ATOM 803 N ARG A 94 -1.226 3.532 20.365 1.00 41.24 N ATOM 804 CA ARG A 94 0.154 3.336 20.790 1.00 60.12 C ATOM 805 C ARG A 94 0.890 2.401 19.835 1.00 12.32 C ATOM 806 O ARG A 94 1.986 2.709 19.367 1.00 62.12 O ATOM 807 CB ARG A 94 0.198 2.770 22.210 1.00 71.13 C ATOM 808 CG ARG A 94 0.215 3.838 23.291 1.00 70.13 C ATOM 809 CD ARG A 94 -0.214 3.276 24.637 1.00 70.41 C ATOM 810 NE ARG A 94 0.003 4.228 25.723 1.00 75.14 N ATOM 811 CZ ARG A 94 1.205 4.547 26.192 1.00 15.32 C ATOM 812 NH1 ARG A 94 2.292 3.992 25.672 1.00 15.40 N ATOM 813 NH2 ARG A 94 1.323 5.421 27.182 1.00 44.41 N ATOM 0 H ARG A 94 -1.919 3.375 21.097 1.00 41.24 H new ATOM 0 HA ARG A 94 0.652 4.305 20.777 1.00 60.12 H new ATOM 0 HB2 ARG A 94 -0.667 2.125 22.362 1.00 71.13 H new ATOM 0 HB3 ARG A 94 1.084 2.144 22.315 1.00 71.13 H new ATOM 0 HG2 ARG A 94 1.218 4.257 23.374 1.00 70.13 H new ATOM 0 HG3 ARG A 94 -0.450 4.654 23.008 1.00 70.13 H new ATOM 0 HD2 ARG A 94 -1.269 3.006 24.597 1.00 70.41 H new ATOM 0 HD3 ARG A 94 0.342 2.361 24.841 1.00 70.41 H new ATOM 0 HE ARG A 94 -0.813 4.672 26.145 1.00 75.14 H new ATOM 0 HH11 ARG A 94 2.206 3.319 24.910 1.00 15.40 H new ATOM 0 HH12 ARG A 94 3.213 4.239 26.034 1.00 15.40 H new ATOM 0 HH21 ARG A 94 0.490 5.850 27.585 1.00 44.41 H new ATOM 0 HH22 ARG A 94 2.247 5.664 27.540 1.00 44.41 H new ATOM 824 N ASP A 95 0.279 1.255 19.551 1.00 12.30 N ATOM 825 CA ASP A 95 0.874 0.274 18.651 1.00 54.21 C ATOM 826 C ASP A 95 1.125 0.880 17.274 1.00 11.11 C ATOM 827 O ASP A 95 2.194 0.702 16.692 1.00 53.34 O ATOM 828 CB ASP A 95 -0.032 -0.951 18.526 1.00 43.44 C ATOM 829 CG ASP A 95 0.247 -1.990 19.594 1.00 10.22 C ATOM 830 OD1 ASP A 95 0.775 -1.615 20.661 1.00 1.34 O ATOM 831 OD2 ASP A 95 -0.062 -3.178 19.361 1.00 22.41 O ATOM 0 H ASP A 95 -0.628 0.983 19.931 1.00 12.30 H new ATOM 0 HA ASP A 95 1.831 -0.034 19.072 1.00 54.21 H new ATOM 0 HB2 ASP A 95 -1.074 -0.637 18.592 1.00 43.44 H new ATOM 0 HB3 ASP A 95 0.103 -1.400 17.542 1.00 43.44 H new ATOM 835 N ILE A 96 0.130 1.596 16.759 1.00 74.34 N ATOM 836 CA ILE A 96 0.243 2.228 15.450 1.00 51.11 C ATOM 837 C ILE A 96 1.425 3.192 15.406 1.00 42.42 C ATOM 838 O ILE A 96 2.123 3.285 14.396 1.00 74.31 O ATOM 839 CB ILE A 96 -1.042 2.992 15.082 1.00 54.12 C ATOM 840 CG1 ILE A 96 -2.254 2.061 15.155 1.00 33.43 C ATOM 841 CG2 ILE A 96 -0.917 3.599 13.692 1.00 3.53 C ATOM 842 CD1 ILE A 96 -3.574 2.772 14.963 1.00 4.52 C ATOM 0 H ILE A 96 -0.762 1.753 17.228 1.00 74.34 H new ATOM 0 HA ILE A 96 0.401 1.429 14.725 1.00 51.11 H new ATOM 0 HB ILE A 96 -1.185 3.800 15.799 1.00 54.12 H new ATOM 0 HG12 ILE A 96 -2.154 1.287 14.394 1.00 33.43 H new ATOM 0 HG13 ILE A 96 -2.258 1.559 16.122 1.00 33.43 H new ATOM 0 HG21 ILE A 96 -1.833 4.136 13.446 1.00 3.53 H new ATOM 0 HG22 ILE A 96 -0.074 4.290 13.671 1.00 3.53 H new ATOM 0 HG23 ILE A 96 -0.754 2.806 12.962 1.00 3.53 H new ATOM 0 HD11 ILE A 96 -4.389 2.051 15.027 1.00 4.52 H new ATOM 0 HD12 ILE A 96 -3.697 3.528 15.739 1.00 4.52 H new ATOM 0 HD13 ILE A 96 -3.590 3.251 13.984 1.00 4.52 H new ATOM 853 N GLN A 97 1.642 3.905 16.506 1.00 12.31 N ATOM 854 CA GLN A 97 2.739 4.860 16.591 1.00 63.51 C ATOM 855 C GLN A 97 4.081 4.171 16.365 1.00 1.44 C ATOM 856 O GLN A 97 4.992 4.747 15.771 1.00 11.03 O ATOM 857 CB GLN A 97 2.734 5.555 17.955 1.00 43.41 C ATOM 858 CG GLN A 97 2.100 6.936 17.931 1.00 64.34 C ATOM 859 CD GLN A 97 2.431 7.752 19.166 1.00 11.45 C ATOM 860 OE1 GLN A 97 3.200 7.316 20.023 1.00 22.44 O ATOM 861 NE2 GLN A 97 1.850 8.942 19.263 1.00 11.34 N ATOM 0 H GLN A 97 1.073 3.839 17.350 1.00 12.31 H new ATOM 0 HA GLN A 97 2.598 5.606 15.809 1.00 63.51 H new ATOM 0 HB2 GLN A 97 2.198 4.931 18.670 1.00 43.41 H new ATOM 0 HB3 GLN A 97 3.760 5.641 18.313 1.00 43.41 H new ATOM 0 HG2 GLN A 97 2.439 7.472 17.044 1.00 64.34 H new ATOM 0 HG3 GLN A 97 1.018 6.834 17.847 1.00 64.34 H new ATOM 0 HE21 GLN A 97 1.219 9.263 18.528 1.00 11.34 H new ATOM 0 HE22 GLN A 97 2.034 9.535 20.072 1.00 11.34 H new ATOM 868 N GLU A 98 4.193 2.935 16.842 1.00 70.33 N ATOM 869 CA GLU A 98 5.425 2.168 16.691 1.00 65.11 C ATOM 870 C GLU A 98 5.879 2.149 15.235 1.00 22.20 C ATOM 871 O GLU A 98 7.001 2.545 14.919 1.00 52.34 O ATOM 872 CB GLU A 98 5.224 0.737 17.194 1.00 71.44 C ATOM 873 CG GLU A 98 4.783 0.658 18.645 1.00 10.22 C ATOM 874 CD GLU A 98 5.797 1.259 19.598 1.00 21.02 C ATOM 875 OE1 GLU A 98 5.766 2.492 19.797 1.00 4.54 O ATOM 876 OE2 GLU A 98 6.623 0.499 20.144 1.00 62.00 O ATOM 0 H GLU A 98 3.447 2.444 17.335 1.00 70.33 H new ATOM 0 HA GLU A 98 6.199 2.650 17.288 1.00 65.11 H new ATOM 0 HB2 GLU A 98 4.480 0.243 16.570 1.00 71.44 H new ATOM 0 HB3 GLU A 98 6.157 0.185 17.076 1.00 71.44 H new ATOM 0 HG2 GLU A 98 3.831 1.176 18.760 1.00 10.22 H new ATOM 0 HG3 GLU A 98 4.613 -0.385 18.912 1.00 10.22 H new ATOM 881 N ARG A 99 5.000 1.686 14.353 1.00 2.21 N ATOM 882 CA ARG A 99 5.311 1.613 12.930 1.00 5.13 C ATOM 883 C ARG A 99 5.224 2.993 12.284 1.00 11.22 C ATOM 884 O ARG A 99 5.985 3.311 11.370 1.00 52.14 O ATOM 885 CB ARG A 99 4.355 0.648 12.226 1.00 22.34 C ATOM 886 CG ARG A 99 4.725 -0.815 12.409 1.00 41.50 C ATOM 887 CD ARG A 99 5.841 -1.229 11.461 1.00 11.54 C ATOM 888 NE ARG A 99 5.991 -2.680 11.393 1.00 32.14 N ATOM 889 CZ ARG A 99 6.763 -3.299 10.507 1.00 3.01 C ATOM 890 NH1 ARG A 99 7.450 -2.596 9.617 1.00 11.20 N ATOM 891 NH2 ARG A 99 6.848 -4.623 10.509 1.00 20.13 N ATOM 0 H ARG A 99 4.067 1.356 14.598 1.00 2.21 H new ATOM 0 HA ARG A 99 6.331 1.244 12.825 1.00 5.13 H new ATOM 0 HB2 ARG A 99 3.345 0.809 12.604 1.00 22.34 H new ATOM 0 HB3 ARG A 99 4.337 0.879 11.161 1.00 22.34 H new ATOM 0 HG2 ARG A 99 5.038 -0.986 13.439 1.00 41.50 H new ATOM 0 HG3 ARG A 99 3.848 -1.438 12.235 1.00 41.50 H new ATOM 0 HD2 ARG A 99 5.634 -0.839 10.465 1.00 11.54 H new ATOM 0 HD3 ARG A 99 6.780 -0.782 11.789 1.00 11.54 H new ATOM 0 HE ARG A 99 5.474 -3.250 12.063 1.00 32.14 H new ATOM 0 HH11 ARG A 99 7.386 -1.578 9.612 1.00 11.20 H new ATOM 0 HH12 ARG A 99 8.042 -3.073 8.937 1.00 11.20 H new ATOM 0 HH21 ARG A 99 6.320 -5.167 11.192 1.00 20.13 H new ATOM 0 HH22 ARG A 99 7.441 -5.097 9.828 1.00 20.13 H new ATOM 902 N PHE A 100 4.290 3.808 12.763 1.00 33.04 N ATOM 903 CA PHE A 100 4.102 5.153 12.232 1.00 54.13 C ATOM 904 C PHE A 100 5.424 5.914 12.199 1.00 54.03 C ATOM 905 O PHE A 100 5.670 6.715 11.297 1.00 30.32 O ATOM 906 CB PHE A 100 3.080 5.920 13.073 1.00 14.51 C ATOM 907 CG PHE A 100 2.665 7.229 12.466 1.00 72.41 C ATOM 908 CD1 PHE A 100 1.807 7.263 11.379 1.00 71.44 C ATOM 909 CD2 PHE A 100 3.134 8.426 12.983 1.00 22.21 C ATOM 910 CE1 PHE A 100 1.425 8.468 10.819 1.00 11.13 C ATOM 911 CE2 PHE A 100 2.755 9.634 12.428 1.00 51.02 C ATOM 912 CZ PHE A 100 1.899 9.654 11.344 1.00 24.12 C ATOM 0 H PHE A 100 3.651 3.560 13.519 1.00 33.04 H new ATOM 0 HA PHE A 100 3.728 5.064 11.212 1.00 54.13 H new ATOM 0 HB2 PHE A 100 2.196 5.297 13.213 1.00 14.51 H new ATOM 0 HB3 PHE A 100 3.500 6.104 14.062 1.00 14.51 H new ATOM 0 HD1 PHE A 100 1.433 6.339 10.965 1.00 71.44 H new ATOM 0 HD2 PHE A 100 3.804 8.415 13.830 1.00 22.21 H new ATOM 0 HE1 PHE A 100 0.756 8.482 9.971 1.00 11.13 H new ATOM 0 HE2 PHE A 100 3.127 10.560 12.841 1.00 51.02 H new ATOM 0 HZ PHE A 100 1.601 10.596 10.908 1.00 24.12 H new ATOM 921 N SER A 101 6.272 5.659 13.190 1.00 13.34 N ATOM 922 CA SER A 101 7.568 6.321 13.279 1.00 64.24 C ATOM 923 C SER A 101 8.378 6.103 12.005 1.00 43.02 C ATOM 924 O SER A 101 9.070 7.006 11.535 1.00 23.12 O ATOM 925 CB SER A 101 8.349 5.804 14.489 1.00 45.41 C ATOM 926 OG SER A 101 8.965 4.561 14.203 1.00 22.54 O ATOM 0 H SER A 101 6.084 4.998 13.944 1.00 13.34 H new ATOM 0 HA SER A 101 7.394 7.390 13.400 1.00 64.24 H new ATOM 0 HB2 SER A 101 9.108 6.533 14.775 1.00 45.41 H new ATOM 0 HB3 SER A 101 7.677 5.693 15.340 1.00 45.41 H new ATOM 0 HG SER A 101 8.355 3.831 14.441 1.00 22.54 H new ATOM 931 N GLU A 102 8.286 4.898 11.452 1.00 53.34 N ATOM 932 CA GLU A 102 9.012 4.560 10.232 1.00 22.41 C ATOM 933 C GLU A 102 8.493 5.372 9.049 1.00 13.23 C ATOM 934 O GLU A 102 9.236 6.135 8.432 1.00 0.31 O ATOM 935 CB GLU A 102 8.885 3.065 9.935 1.00 34.25 C ATOM 936 CG GLU A 102 9.932 2.214 10.635 1.00 30.33 C ATOM 937 CD GLU A 102 9.758 0.733 10.362 1.00 20.20 C ATOM 938 OE1 GLU A 102 8.598 0.276 10.291 1.00 2.52 O ATOM 939 OE2 GLU A 102 10.781 0.032 10.220 1.00 31.14 O ATOM 0 H GLU A 102 7.717 4.140 11.828 1.00 53.34 H new ATOM 0 HA GLU A 102 10.063 4.804 10.384 1.00 22.41 H new ATOM 0 HB2 GLU A 102 7.894 2.726 10.236 1.00 34.25 H new ATOM 0 HB3 GLU A 102 8.962 2.909 8.859 1.00 34.25 H new ATOM 0 HG2 GLU A 102 10.925 2.525 10.310 1.00 30.33 H new ATOM 0 HG3 GLU A 102 9.879 2.390 11.709 1.00 30.33 H new ATOM 944 N VAL A 103 7.212 5.198 8.736 1.00 63.31 N ATOM 945 CA VAL A 103 6.593 5.914 7.627 1.00 2.14 C ATOM 946 C VAL A 103 6.763 7.421 7.782 1.00 73.14 C ATOM 947 O VAL A 103 7.006 8.131 6.806 1.00 50.12 O ATOM 948 CB VAL A 103 5.092 5.586 7.517 1.00 42.13 C ATOM 949 CG1 VAL A 103 4.388 5.852 8.838 1.00 64.15 C ATOM 950 CG2 VAL A 103 4.454 6.388 6.392 1.00 21.13 C ATOM 0 H VAL A 103 6.584 4.568 9.235 1.00 63.31 H new ATOM 0 HA VAL A 103 7.097 5.587 6.718 1.00 2.14 H new ATOM 0 HB VAL A 103 4.985 4.527 7.284 1.00 42.13 H new ATOM 0 HG11 VAL A 103 3.329 5.614 8.740 1.00 64.15 H new ATOM 0 HG12 VAL A 103 4.829 5.230 9.617 1.00 64.15 H new ATOM 0 HG13 VAL A 103 4.501 6.903 9.105 1.00 64.15 H new ATOM 0 HG21 VAL A 103 3.393 6.145 6.328 1.00 21.13 H new ATOM 0 HG22 VAL A 103 4.570 7.453 6.593 1.00 21.13 H new ATOM 0 HG23 VAL A 103 4.941 6.142 5.448 1.00 21.13 H new ATOM 960 N ARG A 104 6.634 7.902 9.014 1.00 41.44 N ATOM 961 CA ARG A 104 6.773 9.326 9.295 1.00 4.15 C ATOM 962 C ARG A 104 8.207 9.790 9.058 1.00 31.21 C ATOM 963 O ARG A 104 8.447 10.757 8.336 1.00 25.52 O ATOM 964 CB ARG A 104 6.361 9.624 10.738 1.00 23.02 C ATOM 965 CG ARG A 104 6.458 11.095 11.108 1.00 11.14 C ATOM 966 CD ARG A 104 5.995 11.342 12.535 1.00 22.50 C ATOM 967 NE ARG A 104 7.085 11.200 13.496 1.00 22.30 N ATOM 968 CZ ARG A 104 6.926 11.315 14.810 1.00 71.22 C ATOM 969 NH1 ARG A 104 5.728 11.571 15.316 1.00 21.44 N ATOM 970 NH2 ARG A 104 7.967 11.173 15.621 1.00 51.20 N ATOM 0 H ARG A 104 6.434 7.327 9.833 1.00 41.44 H new ATOM 0 HA ARG A 104 6.117 9.871 8.616 1.00 4.15 H new ATOM 0 HB2 ARG A 104 5.336 9.286 10.891 1.00 23.02 H new ATOM 0 HB3 ARG A 104 6.991 9.046 11.414 1.00 23.02 H new ATOM 0 HG2 ARG A 104 7.488 11.433 10.995 1.00 11.14 H new ATOM 0 HG3 ARG A 104 5.852 11.685 10.420 1.00 11.14 H new ATOM 0 HD2 ARG A 104 5.573 12.344 12.611 1.00 22.50 H new ATOM 0 HD3 ARG A 104 5.198 10.641 12.784 1.00 22.50 H new ATOM 0 HE ARG A 104 8.020 11.002 13.139 1.00 22.30 H new ATOM 0 HH11 ARG A 104 4.925 11.680 14.696 1.00 21.44 H new ATOM 0 HH12 ARG A 104 5.609 11.659 16.325 1.00 21.44 H new ATOM 0 HH21 ARG A 104 8.890 10.975 15.236 1.00 51.20 H new ATOM 0 HH22 ARG A 104 7.844 11.262 16.630 1.00 51.20 H new ATOM 981 N LYS A 105 9.158 9.093 9.672 1.00 63.12 N ATOM 982 CA LYS A 105 10.568 9.431 9.528 1.00 62.33 C ATOM 983 C LYS A 105 10.956 9.534 8.057 1.00 34.23 C ATOM 984 O LYS A 105 11.653 10.464 7.651 1.00 32.21 O ATOM 985 CB LYS A 105 11.439 8.384 10.225 1.00 31.21 C ATOM 986 CG LYS A 105 12.902 8.780 10.328 1.00 33.53 C ATOM 987 CD LYS A 105 13.645 7.910 11.328 1.00 32.20 C ATOM 988 CE LYS A 105 13.937 6.530 10.759 1.00 1.53 C ATOM 989 NZ LYS A 105 15.185 6.516 9.948 1.00 51.30 N ATOM 0 H LYS A 105 8.977 8.290 10.274 1.00 63.12 H new ATOM 0 HA LYS A 105 10.732 10.401 9.997 1.00 62.33 H new ATOM 0 HB2 LYS A 105 11.048 8.207 11.227 1.00 31.21 H new ATOM 0 HB3 LYS A 105 11.364 7.442 9.682 1.00 31.21 H new ATOM 0 HG2 LYS A 105 13.373 8.694 9.349 1.00 33.53 H new ATOM 0 HG3 LYS A 105 12.977 9.825 10.627 1.00 33.53 H new ATOM 0 HD2 LYS A 105 14.580 8.394 11.608 1.00 32.20 H new ATOM 0 HD3 LYS A 105 13.052 7.812 12.237 1.00 32.20 H new ATOM 0 HE2 LYS A 105 14.026 5.813 11.575 1.00 1.53 H new ATOM 0 HE3 LYS A 105 13.099 6.207 10.141 1.00 1.53 H new ATOM 0 HZ1 LYS A 105 15.348 5.558 9.578 1.00 51.30 H new ATOM 0 HZ2 LYS A 105 15.091 7.182 9.155 1.00 51.30 H new ATOM 0 HZ3 LYS A 105 15.989 6.799 10.544 1.00 51.30 H new ATOM 999 N LYS A 106 10.499 8.573 7.262 1.00 42.44 N ATOM 1000 CA LYS A 106 10.796 8.556 5.834 1.00 14.53 C ATOM 1001 C LYS A 106 10.122 9.725 5.124 1.00 61.53 C ATOM 1002 O LYS A 106 10.742 10.409 4.310 1.00 42.41 O ATOM 1003 CB LYS A 106 10.335 7.235 5.212 1.00 72.21 C ATOM 1004 CG LYS A 106 11.295 6.082 5.453 1.00 24.51 C ATOM 1005 CD LYS A 106 10.823 4.812 4.767 1.00 53.10 C ATOM 1006 CE LYS A 106 9.770 4.089 5.595 1.00 52.33 C ATOM 1007 NZ LYS A 106 9.391 2.782 4.989 1.00 21.13 N ATOM 0 H LYS A 106 9.921 7.795 7.582 1.00 42.44 H new ATOM 0 HA LYS A 106 11.875 8.652 5.712 1.00 14.53 H new ATOM 0 HB2 LYS A 106 9.357 6.974 5.617 1.00 72.21 H new ATOM 0 HB3 LYS A 106 10.208 7.373 4.138 1.00 72.21 H new ATOM 0 HG2 LYS A 106 12.286 6.349 5.085 1.00 24.51 H new ATOM 0 HG3 LYS A 106 11.390 5.904 6.524 1.00 24.51 H new ATOM 0 HD2 LYS A 106 10.412 5.057 3.788 1.00 53.10 H new ATOM 0 HD3 LYS A 106 11.673 4.150 4.599 1.00 53.10 H new ATOM 0 HE2 LYS A 106 10.150 3.925 6.603 1.00 52.33 H new ATOM 0 HE3 LYS A 106 8.884 4.718 5.686 1.00 52.33 H new ATOM 0 HZ1 LYS A 106 8.672 2.320 5.582 1.00 21.13 H new ATOM 0 HZ2 LYS A 106 9.005 2.940 4.036 1.00 21.13 H new ATOM 0 HZ3 LYS A 106 10.231 2.172 4.925 1.00 21.13 H new ATOM 1017 N MET A 107 8.850 9.951 5.439 1.00 73.21 N ATOM 1018 CA MET A 107 8.095 11.041 4.833 1.00 14.53 C ATOM 1019 C MET A 107 8.843 12.363 4.969 1.00 33.01 C ATOM 1020 O MET A 107 9.031 13.084 3.990 1.00 44.42 O ATOM 1021 CB MET A 107 6.714 11.154 5.481 1.00 10.25 C ATOM 1022 CG MET A 107 5.652 11.725 4.554 1.00 62.20 C ATOM 1023 SD MET A 107 5.726 13.524 4.441 1.00 53.12 S ATOM 1024 CE MET A 107 4.743 13.810 2.971 1.00 73.12 C ATOM 0 H MET A 107 8.321 9.394 6.110 1.00 73.21 H new ATOM 0 HA MET A 107 7.974 10.820 3.772 1.00 14.53 H new ATOM 0 HB2 MET A 107 6.398 10.167 5.818 1.00 10.25 H new ATOM 0 HB3 MET A 107 6.788 11.784 6.367 1.00 10.25 H new ATOM 0 HG2 MET A 107 5.775 11.297 3.559 1.00 62.20 H new ATOM 0 HG3 MET A 107 4.666 11.427 4.910 1.00 62.20 H new ATOM 0 HE1 MET A 107 4.694 14.880 2.768 1.00 73.12 H new ATOM 0 HE2 MET A 107 5.200 13.300 2.123 1.00 73.12 H new ATOM 0 HE3 MET A 107 3.736 13.424 3.126 1.00 73.12 H new ATOM 1032 N VAL A 108 9.268 12.674 6.189 1.00 43.34 N ATOM 1033 CA VAL A 108 9.996 13.910 6.452 1.00 60.12 C ATOM 1034 C VAL A 108 11.402 13.855 5.864 1.00 12.53 C ATOM 1035 O VAL A 108 11.925 14.861 5.386 1.00 2.33 O ATOM 1036 CB VAL A 108 10.094 14.192 7.963 1.00 50.11 C ATOM 1037 CG1 VAL A 108 10.801 13.048 8.676 1.00 5.51 C ATOM 1038 CG2 VAL A 108 10.812 15.510 8.212 1.00 24.35 C ATOM 0 H VAL A 108 9.121 12.088 7.011 1.00 43.34 H new ATOM 0 HA VAL A 108 9.437 14.715 5.975 1.00 60.12 H new ATOM 0 HB VAL A 108 9.085 14.271 8.367 1.00 50.11 H new ATOM 0 HG11 VAL A 108 10.861 13.265 9.742 1.00 5.51 H new ATOM 0 HG12 VAL A 108 10.242 12.124 8.525 1.00 5.51 H new ATOM 0 HG13 VAL A 108 11.807 12.934 8.272 1.00 5.51 H new ATOM 0 HG21 VAL A 108 10.873 15.694 9.285 1.00 24.35 H new ATOM 0 HG22 VAL A 108 11.818 15.461 7.795 1.00 24.35 H new ATOM 0 HG23 VAL A 108 10.261 16.320 7.735 1.00 24.35 H new ATOM 1048 N GLU A 109 12.008 12.672 5.903 1.00 50.22 N ATOM 1049 CA GLU A 109 13.353 12.487 5.373 1.00 63.43 C ATOM 1050 C GLU A 109 13.410 12.845 3.891 1.00 11.44 C ATOM 1051 O GLU A 109 14.405 13.382 3.408 1.00 63.11 O ATOM 1052 CB GLU A 109 13.812 11.041 5.578 1.00 22.01 C ATOM 1053 CG GLU A 109 15.183 10.749 4.994 1.00 21.41 C ATOM 1054 CD GLU A 109 16.303 11.402 5.781 1.00 53.12 C ATOM 1055 OE1 GLU A 109 17.483 11.157 5.451 1.00 3.40 O ATOM 1056 OE2 GLU A 109 16.001 12.159 6.727 1.00 3.12 O ATOM 0 H GLU A 109 11.589 11.829 6.296 1.00 50.22 H new ATOM 0 HA GLU A 109 14.023 13.154 5.915 1.00 63.43 H new ATOM 0 HB2 GLU A 109 13.827 10.821 6.646 1.00 22.01 H new ATOM 0 HB3 GLU A 109 13.083 10.370 5.125 1.00 22.01 H new ATOM 0 HG2 GLU A 109 15.341 9.671 4.970 1.00 21.41 H new ATOM 0 HG3 GLU A 109 15.217 11.099 3.962 1.00 21.41 H new ATOM 1061 N ASN A 110 12.332 12.541 3.174 1.00 13.22 N ATOM 1062 CA ASN A 110 12.257 12.828 1.746 1.00 74.55 C ATOM 1063 C ASN A 110 12.610 14.286 1.466 1.00 23.24 C ATOM 1064 O ASN A 110 13.137 14.615 0.404 1.00 61.44 O ATOM 1065 CB ASN A 110 10.857 12.518 1.214 1.00 21.41 C ATOM 1066 CG ASN A 110 10.821 12.423 -0.298 1.00 2.33 C ATOM 1067 OD1 ASN A 110 10.002 13.070 -0.953 1.00 72.20 O ATOM 1068 ND2 ASN A 110 11.710 11.614 -0.861 1.00 14.55 N ATOM 0 H ASN A 110 11.499 12.096 3.559 1.00 13.22 H new ATOM 0 HA ASN A 110 12.980 12.193 1.234 1.00 74.55 H new ATOM 0 HB2 ASN A 110 10.508 11.578 1.643 1.00 21.41 H new ATOM 0 HB3 ASN A 110 10.166 13.294 1.543 1.00 21.41 H new ATOM 0 HD21 ASN A 110 11.733 11.509 -1.875 1.00 14.55 H new ATOM 0 HD22 ASN A 110 12.370 11.097 -0.279 1.00 14.55 H new ATOM 1074 N ASP A 111 12.313 15.155 2.426 1.00 51.20 N ATOM 1075 CA ASP A 111 12.600 16.578 2.284 1.00 32.12 C ATOM 1076 C ASP A 111 11.842 17.170 1.100 1.00 2.13 C ATOM 1077 O ASP A 111 12.444 17.592 0.113 1.00 13.24 O ATOM 1078 CB ASP A 111 14.103 16.803 2.107 1.00 3.33 C ATOM 1079 CG ASP A 111 14.818 17.000 3.429 1.00 14.22 C ATOM 1080 OD1 ASP A 111 15.565 16.087 3.840 1.00 20.52 O ATOM 1081 OD2 ASP A 111 14.631 18.065 4.052 1.00 43.13 O ATOM 0 H ASP A 111 11.874 14.899 3.310 1.00 51.20 H new ATOM 0 HA ASP A 111 12.270 17.082 3.193 1.00 32.12 H new ATOM 0 HB2 ASP A 111 14.537 15.949 1.586 1.00 3.33 H new ATOM 0 HB3 ASP A 111 14.265 17.677 1.476 1.00 3.33 H new ATOM 1085 N ASP A 112 10.517 17.196 1.205 1.00 22.55 N ATOM 1086 CA ASP A 112 9.676 17.736 0.144 1.00 14.41 C ATOM 1087 C ASP A 112 8.757 18.828 0.681 1.00 11.42 C ATOM 1088 O ASP A 112 8.480 19.812 -0.006 1.00 62.33 O ATOM 1089 CB ASP A 112 8.846 16.620 -0.494 1.00 4.31 C ATOM 1090 CG ASP A 112 8.229 17.040 -1.815 1.00 34.31 C ATOM 1091 OD1 ASP A 112 7.521 16.215 -2.428 1.00 55.12 O ATOM 1092 OD2 ASP A 112 8.456 18.194 -2.233 1.00 42.44 O ATOM 0 H ASP A 112 10.003 16.849 2.015 1.00 22.55 H new ATOM 0 HA ASP A 112 10.325 18.175 -0.614 1.00 14.41 H new ATOM 0 HB2 ASP A 112 9.478 15.746 -0.653 1.00 4.31 H new ATOM 0 HB3 ASP A 112 8.055 16.320 0.194 1.00 4.31 H new ATOM 1096 N ILE A 113 8.287 18.648 1.910 1.00 11.44 N ATOM 1097 CA ILE A 113 7.400 19.618 2.538 1.00 1.43 C ATOM 1098 C ILE A 113 7.930 20.046 3.902 1.00 64.42 C ATOM 1099 O ILE A 113 9.004 19.618 4.324 1.00 52.34 O ATOM 1100 CB ILE A 113 5.977 19.052 2.709 1.00 40.40 C ATOM 1101 CG1 ILE A 113 6.018 17.736 3.487 1.00 13.13 C ATOM 1102 CG2 ILE A 113 5.321 18.851 1.351 1.00 53.21 C ATOM 1103 CD1 ILE A 113 6.011 17.921 4.988 1.00 41.31 C ATOM 0 H ILE A 113 8.506 17.839 2.491 1.00 11.44 H new ATOM 0 HA ILE A 113 7.362 20.484 1.877 1.00 1.43 H new ATOM 0 HB ILE A 113 5.382 19.768 3.276 1.00 40.40 H new ATOM 0 HG12 ILE A 113 5.161 17.127 3.200 1.00 13.13 H new ATOM 0 HG13 ILE A 113 6.912 17.182 3.201 1.00 13.13 H new ATOM 0 HG21 ILE A 113 4.316 18.451 1.488 1.00 53.21 H new ATOM 0 HG22 ILE A 113 5.263 19.807 0.830 1.00 53.21 H new ATOM 0 HG23 ILE A 113 5.913 18.151 0.761 1.00 53.21 H new ATOM 0 HD11 ILE A 113 6.041 16.946 5.475 1.00 41.31 H new ATOM 0 HD12 ILE A 113 6.883 18.503 5.287 1.00 41.31 H new ATOM 0 HD13 ILE A 113 5.104 18.447 5.286 1.00 41.31 H new ATOM 1114 N GLU A 114 7.170 20.894 4.587 1.00 23.53 N ATOM 1115 CA GLU A 114 7.564 21.380 5.905 1.00 53.12 C ATOM 1116 C GLU A 114 6.422 21.228 6.905 1.00 4.55 C ATOM 1117 O GLU A 114 6.640 20.869 8.062 1.00 3.03 O ATOM 1118 CB GLU A 114 7.995 22.846 5.824 1.00 32.13 C ATOM 1119 CG GLU A 114 7.138 23.681 4.888 1.00 25.33 C ATOM 1120 CD GLU A 114 7.653 23.673 3.463 1.00 44.31 C ATOM 1121 OE1 GLU A 114 8.849 23.970 3.261 1.00 25.10 O ATOM 1122 OE2 GLU A 114 6.859 23.370 2.547 1.00 34.51 O ATOM 0 H GLU A 114 6.278 21.259 4.252 1.00 23.53 H new ATOM 0 HA GLU A 114 8.406 20.780 6.249 1.00 53.12 H new ATOM 0 HB2 GLU A 114 7.959 23.282 6.822 1.00 32.13 H new ATOM 0 HB3 GLU A 114 9.032 22.893 5.493 1.00 32.13 H new ATOM 0 HG2 GLU A 114 6.116 23.303 4.903 1.00 25.33 H new ATOM 0 HG3 GLU A 114 7.103 24.708 5.252 1.00 25.33 H new ATOM 1127 N MET A 115 5.204 21.505 6.450 1.00 12.01 N ATOM 1128 CA MET A 115 4.027 21.398 7.305 1.00 41.42 C ATOM 1129 C MET A 115 2.838 20.845 6.525 1.00 30.34 C ATOM 1130 O MET A 115 1.701 20.898 6.992 1.00 24.13 O ATOM 1131 CB MET A 115 3.673 22.765 7.894 1.00 74.31 C ATOM 1132 CG MET A 115 4.857 23.478 8.527 1.00 14.02 C ATOM 1133 SD MET A 115 4.384 25.008 9.356 1.00 31.24 S ATOM 1134 CE MET A 115 5.991 25.662 9.803 1.00 53.13 C ATOM 0 H MET A 115 5.006 21.805 5.495 1.00 12.01 H new ATOM 0 HA MET A 115 4.259 20.709 8.117 1.00 41.42 H new ATOM 0 HB2 MET A 115 3.259 23.395 7.107 1.00 74.31 H new ATOM 0 HB3 MET A 115 2.893 22.637 8.644 1.00 74.31 H new ATOM 0 HG2 MET A 115 5.335 22.813 9.246 1.00 14.02 H new ATOM 0 HG3 MET A 115 5.596 23.700 7.757 1.00 14.02 H new ATOM 0 HE1 MET A 115 5.865 26.610 10.325 1.00 53.13 H new ATOM 0 HE2 MET A 115 6.504 24.954 10.454 1.00 53.13 H new ATOM 0 HE3 MET A 115 6.583 25.820 8.902 1.00 53.13 H new ATOM 1142 N GLN A 116 3.109 20.315 5.338 1.00 14.31 N ATOM 1143 CA GLN A 116 2.060 19.752 4.494 1.00 32.40 C ATOM 1144 C GLN A 116 1.522 18.454 5.088 1.00 63.40 C ATOM 1145 O GLN A 116 0.316 18.211 5.081 1.00 3.21 O ATOM 1146 CB GLN A 116 2.593 19.500 3.083 1.00 13.14 C ATOM 1147 CG GLN A 116 1.531 19.623 2.002 1.00 72.24 C ATOM 1148 CD GLN A 116 2.108 20.034 0.661 1.00 34.43 C ATOM 1149 OE1 GLN A 116 2.267 21.222 0.379 1.00 41.11 O ATOM 1150 NE2 GLN A 116 2.428 19.051 -0.173 1.00 63.20 N ATOM 0 H GLN A 116 4.046 20.263 4.938 1.00 14.31 H new ATOM 0 HA GLN A 116 1.243 20.472 4.443 1.00 32.40 H new ATOM 0 HB2 GLN A 116 3.396 20.208 2.875 1.00 13.14 H new ATOM 0 HB3 GLN A 116 3.029 18.502 3.041 1.00 13.14 H new ATOM 0 HG2 GLN A 116 1.015 18.669 1.894 1.00 72.24 H new ATOM 0 HG3 GLN A 116 0.785 20.355 2.312 1.00 72.24 H new ATOM 0 HE21 GLN A 116 2.279 18.080 0.102 1.00 63.20 H new ATOM 0 HE22 GLN A 116 2.823 19.267 -1.088 1.00 63.20 H new ATOM 1157 N ALA A 117 2.425 17.625 5.601 1.00 32.02 N ATOM 1158 CA ALA A 117 2.040 16.353 6.201 1.00 52.33 C ATOM 1159 C ALA A 117 1.591 16.540 7.646 1.00 45.24 C ATOM 1160 O ALA A 117 0.532 16.054 8.045 1.00 61.23 O ATOM 1161 CB ALA A 117 3.194 15.365 6.128 1.00 70.23 C ATOM 0 H ALA A 117 3.428 17.811 5.613 1.00 32.02 H new ATOM 0 HA ALA A 117 1.198 15.954 5.636 1.00 52.33 H new ATOM 0 HB1 ALA A 117 2.893 14.420 6.580 1.00 70.23 H new ATOM 0 HB2 ALA A 117 3.465 15.199 5.085 1.00 70.23 H new ATOM 0 HB3 ALA A 117 4.052 15.767 6.667 1.00 70.23 H new ATOM 1167 N LEU A 118 2.402 17.247 8.425 1.00 15.12 N ATOM 1168 CA LEU A 118 2.089 17.498 9.828 1.00 4.43 C ATOM 1169 C LEU A 118 0.830 18.350 9.960 1.00 3.31 C ATOM 1170 O LEU A 118 0.041 18.170 10.886 1.00 2.03 O ATOM 1171 CB LEU A 118 3.263 18.193 10.518 1.00 51.52 C ATOM 1172 CG LEU A 118 3.460 17.868 11.998 1.00 61.32 C ATOM 1173 CD1 LEU A 118 4.925 18.008 12.384 1.00 22.45 C ATOM 1174 CD2 LEU A 118 2.590 18.769 12.862 1.00 72.51 C ATOM 0 H LEU A 118 3.281 17.657 8.109 1.00 15.12 H new ATOM 0 HA LEU A 118 1.909 16.538 10.312 1.00 4.43 H new ATOM 0 HB2 LEU A 118 4.177 17.933 9.985 1.00 51.52 H new ATOM 0 HB3 LEU A 118 3.131 19.270 10.418 1.00 51.52 H new ATOM 0 HG LEU A 118 3.158 16.835 12.167 1.00 61.32 H new ATOM 0 HD11 LEU A 118 5.047 17.773 13.441 1.00 22.45 H new ATOM 0 HD12 LEU A 118 5.526 17.321 11.788 1.00 22.45 H new ATOM 0 HD13 LEU A 118 5.254 19.031 12.200 1.00 22.45 H new ATOM 0 HD21 LEU A 118 2.743 18.524 13.913 1.00 72.51 H new ATOM 0 HD22 LEU A 118 2.861 19.811 12.689 1.00 72.51 H new ATOM 0 HD23 LEU A 118 1.542 18.619 12.603 1.00 72.51 H new ATOM 1185 N GLY A 119 0.648 19.278 9.025 1.00 32.44 N ATOM 1186 CA GLY A 119 -0.517 20.142 9.054 1.00 30.42 C ATOM 1187 C GLY A 119 -1.813 19.365 9.182 1.00 60.04 C ATOM 1188 O GLY A 119 -2.775 19.845 9.780 1.00 12.11 O ATOM 0 H GLY A 119 1.287 19.446 8.248 1.00 32.44 H new ATOM 0 HA2 GLY A 119 -0.430 20.837 9.889 1.00 30.42 H new ATOM 0 HA3 GLY A 119 -0.544 20.740 8.143 1.00 30.42 H new ATOM 1192 N SER A 120 -1.837 18.164 8.616 1.00 14.34 N ATOM 1193 CA SER A 120 -3.026 17.320 8.664 1.00 10.20 C ATOM 1194 C SER A 120 -2.644 15.849 8.789 1.00 11.01 C ATOM 1195 O SER A 120 -2.663 15.106 7.808 1.00 22.22 O ATOM 1196 CB SER A 120 -3.880 17.533 7.411 1.00 70.52 C ATOM 1197 OG SER A 120 -4.891 16.545 7.310 1.00 73.15 O ATOM 0 H SER A 120 -1.047 17.752 8.119 1.00 14.34 H new ATOM 0 HA SER A 120 -3.606 17.602 9.543 1.00 10.20 H new ATOM 0 HB2 SER A 120 -4.336 18.523 7.441 1.00 70.52 H new ATOM 0 HB3 SER A 120 -3.246 17.501 6.525 1.00 70.52 H new ATOM 0 HG SER A 120 -4.477 15.663 7.205 1.00 73.15 H new ATOM 1202 N ASN A 121 -2.298 15.435 10.004 1.00 54.11 N ATOM 1203 CA ASN A 121 -1.910 14.052 10.258 1.00 22.23 C ATOM 1204 C ASN A 121 -2.624 13.505 11.490 1.00 21.12 C ATOM 1205 O ASN A 121 -2.032 13.383 12.564 1.00 45.44 O ATOM 1206 CB ASN A 121 -0.395 13.952 10.448 1.00 55.44 C ATOM 1207 CG ASN A 121 0.318 13.520 9.180 1.00 71.44 C ATOM 1208 OD1 ASN A 121 -0.288 13.434 8.112 1.00 63.32 O ATOM 1209 ND2 ASN A 121 1.612 13.246 9.294 1.00 41.13 N ATOM 0 H ASN A 121 -2.278 16.037 10.827 1.00 54.11 H new ATOM 0 HA ASN A 121 -2.202 13.455 9.394 1.00 22.23 H new ATOM 0 HB2 ASN A 121 -0.007 14.919 10.769 1.00 55.44 H new ATOM 0 HB3 ASN A 121 -0.177 13.241 11.245 1.00 55.44 H new ATOM 0 HD21 ASN A 121 2.145 12.950 8.476 1.00 41.13 H new ATOM 0 HD22 ASN A 121 2.073 13.331 10.200 1.00 41.13 H new ATOM 1215 N THR A 122 -3.902 13.176 11.329 1.00 70.20 N ATOM 1216 CA THR A 122 -4.698 12.642 12.427 1.00 22.24 C ATOM 1217 C THR A 122 -5.586 11.495 11.957 1.00 63.22 C ATOM 1218 O THR A 122 -5.650 10.443 12.593 1.00 62.33 O ATOM 1219 CB THR A 122 -5.581 13.733 13.063 1.00 13.32 C ATOM 1220 OG1 THR A 122 -4.929 15.004 12.975 1.00 52.45 O ATOM 1221 CG2 THR A 122 -5.878 13.408 14.519 1.00 60.34 C ATOM 0 H THR A 122 -4.408 13.270 10.448 1.00 70.20 H new ATOM 0 HA THR A 122 -3.996 12.271 13.174 1.00 22.24 H new ATOM 0 HB THR A 122 -6.523 13.771 12.517 1.00 13.32 H new ATOM 0 HG1 THR A 122 -5.497 15.692 13.380 1.00 52.45 H new ATOM 0 HG21 THR A 122 -6.503 14.192 14.947 1.00 60.34 H new ATOM 0 HG22 THR A 122 -6.401 12.454 14.579 1.00 60.34 H new ATOM 0 HG23 THR A 122 -4.943 13.345 15.076 1.00 60.34 H new ATOM 1229 N THR A 123 -6.271 11.705 10.836 1.00 71.14 N ATOM 1230 CA THR A 123 -7.155 10.689 10.280 1.00 41.03 C ATOM 1231 C THR A 123 -6.366 9.477 9.797 1.00 21.12 C ATOM 1232 O THR A 123 -5.195 9.592 9.436 1.00 53.33 O ATOM 1233 CB THR A 123 -7.986 11.247 9.110 1.00 52.34 C ATOM 1234 OG1 THR A 123 -8.857 10.231 8.599 1.00 65.23 O ATOM 1235 CG2 THR A 123 -7.080 11.751 7.996 1.00 41.12 C ATOM 0 H THR A 123 -6.230 12.570 10.296 1.00 71.14 H new ATOM 0 HA THR A 123 -7.828 10.384 11.081 1.00 41.03 H new ATOM 0 HB THR A 123 -8.580 12.082 9.481 1.00 52.34 H new ATOM 0 HG1 THR A 123 -9.383 10.594 7.856 1.00 65.23 H new ATOM 0 HG21 THR A 123 -7.689 12.141 7.180 1.00 41.12 H new ATOM 0 HG22 THR A 123 -6.438 12.544 8.380 1.00 41.12 H new ATOM 0 HG23 THR A 123 -6.464 10.930 7.629 1.00 41.12 H new ATOM 1243 N ILE A 124 -7.015 8.318 9.792 1.00 44.11 N ATOM 1244 CA ILE A 124 -6.373 7.087 9.351 1.00 14.55 C ATOM 1245 C ILE A 124 -7.303 6.271 8.458 1.00 24.15 C ATOM 1246 O ILE A 124 -8.525 6.413 8.523 1.00 74.42 O ATOM 1247 CB ILE A 124 -5.937 6.219 10.546 1.00 52.00 C ATOM 1248 CG1 ILE A 124 -7.162 5.685 11.291 1.00 32.32 C ATOM 1249 CG2 ILE A 124 -5.047 7.020 11.485 1.00 72.21 C ATOM 1250 CD1 ILE A 124 -7.585 4.303 10.845 1.00 22.34 C ATOM 0 H ILE A 124 -7.985 8.206 10.088 1.00 44.11 H new ATOM 0 HA ILE A 124 -5.490 7.379 8.783 1.00 14.55 H new ATOM 0 HB ILE A 124 -5.366 5.370 10.170 1.00 52.00 H new ATOM 0 HG12 ILE A 124 -6.947 5.663 12.359 1.00 32.32 H new ATOM 0 HG13 ILE A 124 -7.994 6.375 11.148 1.00 32.32 H new ATOM 0 HG21 ILE A 124 -4.747 6.393 12.325 1.00 72.21 H new ATOM 0 HG22 ILE A 124 -4.160 7.356 10.948 1.00 72.21 H new ATOM 0 HG23 ILE A 124 -5.596 7.886 11.856 1.00 72.21 H new ATOM 0 HD11 ILE A 124 -8.459 3.988 11.415 1.00 22.34 H new ATOM 0 HD12 ILE A 124 -7.832 4.323 9.784 1.00 22.34 H new ATOM 0 HD13 ILE A 124 -6.769 3.600 11.014 1.00 22.34 H new ATOM 1261 N HIS A 125 -6.717 5.414 7.628 1.00 43.55 N ATOM 1262 CA HIS A 125 -7.493 4.573 6.723 1.00 70.21 C ATOM 1263 C HIS A 125 -7.585 3.146 7.253 1.00 20.34 C ATOM 1264 O HIS A 125 -6.573 2.459 7.394 1.00 3.21 O ATOM 1265 CB HIS A 125 -6.867 4.572 5.329 1.00 70.05 C ATOM 1266 CG HIS A 125 -7.857 4.352 4.227 1.00 60.54 C ATOM 1267 ND1 HIS A 125 -9.074 3.735 4.422 1.00 74.02 N ATOM 1268 CD2 HIS A 125 -7.804 4.672 2.913 1.00 51.42 C ATOM 1269 CE1 HIS A 125 -9.727 3.683 3.275 1.00 20.12 C ATOM 1270 NE2 HIS A 125 -8.979 4.245 2.343 1.00 72.51 N ATOM 0 H HIS A 125 -5.707 5.283 7.563 1.00 43.55 H new ATOM 0 HA HIS A 125 -8.500 4.984 6.659 1.00 70.21 H new ATOM 0 HB2 HIS A 125 -6.361 5.524 5.167 1.00 70.05 H new ATOM 0 HB3 HIS A 125 -6.105 3.794 5.283 1.00 70.05 H new ATOM 0 HD2 HIS A 125 -6.990 5.170 2.407 1.00 51.42 H new ATOM 0 HE1 HIS A 125 -10.707 3.254 3.125 1.00 20.12 H new ATOM 0 HE2 HIS A 125 -9.232 4.346 1.360 1.00 72.51 H new ATOM 1277 N ALA A 126 -8.804 2.706 7.548 1.00 62.04 N ATOM 1278 CA ALA A 126 -9.028 1.360 8.061 1.00 44.11 C ATOM 1279 C ALA A 126 -9.571 0.441 6.972 1.00 35.02 C ATOM 1280 O ALA A 126 -10.580 0.745 6.337 1.00 50.43 O ATOM 1281 CB ALA A 126 -9.980 1.399 9.246 1.00 5.41 C ATOM 0 H ALA A 126 -9.652 3.263 7.440 1.00 62.04 H new ATOM 0 HA ALA A 126 -8.070 0.960 8.393 1.00 44.11 H new ATOM 0 HB1 ALA A 126 -10.138 0.387 9.619 1.00 5.41 H new ATOM 0 HB2 ALA A 126 -9.551 2.014 10.037 1.00 5.41 H new ATOM 0 HB3 ALA A 126 -10.934 1.824 8.933 1.00 5.41 H new ATOM 1287 N TYR A 127 -8.896 -0.684 6.763 1.00 34.43 N ATOM 1288 CA TYR A 127 -9.309 -1.646 5.749 1.00 30.03 C ATOM 1289 C TYR A 127 -9.838 -2.924 6.394 1.00 22.54 C ATOM 1290 O TYR A 127 -9.068 -3.748 6.889 1.00 20.31 O ATOM 1291 CB TYR A 127 -8.138 -1.977 4.822 1.00 20.03 C ATOM 1292 CG TYR A 127 -8.167 -1.214 3.516 1.00 33.22 C ATOM 1293 CD1 TYR A 127 -8.670 -1.797 2.360 1.00 13.22 C ATOM 1294 CD2 TYR A 127 -7.690 0.088 3.439 1.00 34.42 C ATOM 1295 CE1 TYR A 127 -8.697 -1.106 1.165 1.00 45.54 C ATOM 1296 CE2 TYR A 127 -7.714 0.788 2.248 1.00 21.05 C ATOM 1297 CZ TYR A 127 -8.218 0.187 1.114 1.00 4.50 C ATOM 1298 OH TYR A 127 -8.243 0.881 -0.074 1.00 2.45 O ATOM 0 H TYR A 127 -8.060 -0.952 7.283 1.00 34.43 H new ATOM 0 HA TYR A 127 -10.111 -1.196 5.164 1.00 30.03 H new ATOM 0 HB2 TYR A 127 -7.203 -1.761 5.339 1.00 20.03 H new ATOM 0 HB3 TYR A 127 -8.144 -3.046 4.609 1.00 20.03 H new ATOM 0 HD1 TYR A 127 -9.047 -2.809 2.397 1.00 13.22 H new ATOM 0 HD2 TYR A 127 -7.294 0.561 4.325 1.00 34.42 H new ATOM 0 HE1 TYR A 127 -9.091 -1.575 0.275 1.00 45.54 H new ATOM 0 HE2 TYR A 127 -7.340 1.800 2.206 1.00 21.05 H new ATOM 0 HH TYR A 127 -7.871 1.777 0.063 1.00 2.45 H new ATOM 1307 N PHE A 128 -11.158 -3.082 6.384 1.00 55.13 N ATOM 1308 CA PHE A 128 -11.790 -4.259 6.968 1.00 1.52 C ATOM 1309 C PHE A 128 -12.010 -5.339 5.912 1.00 3.01 C ATOM 1310 O PHE A 128 -12.771 -5.148 4.963 1.00 11.15 O ATOM 1311 CB PHE A 128 -13.126 -3.880 7.610 1.00 24.52 C ATOM 1312 CG PHE A 128 -12.983 -2.976 8.801 1.00 31.32 C ATOM 1313 CD1 PHE A 128 -12.689 -1.632 8.638 1.00 4.10 C ATOM 1314 CD2 PHE A 128 -13.143 -3.471 10.086 1.00 31.14 C ATOM 1315 CE1 PHE A 128 -12.557 -0.799 9.733 1.00 41.23 C ATOM 1316 CE2 PHE A 128 -13.011 -2.643 11.185 1.00 43.21 C ATOM 1317 CZ PHE A 128 -12.719 -1.305 11.007 1.00 23.10 C ATOM 0 H PHE A 128 -11.810 -2.410 5.978 1.00 55.13 H new ATOM 0 HA PHE A 128 -11.124 -4.655 7.735 1.00 1.52 H new ATOM 0 HB2 PHE A 128 -13.752 -3.390 6.865 1.00 24.52 H new ATOM 0 HB3 PHE A 128 -13.645 -4.789 7.914 1.00 24.52 H new ATOM 0 HD1 PHE A 128 -12.561 -1.230 7.644 1.00 4.10 H new ATOM 0 HD2 PHE A 128 -13.374 -4.516 10.230 1.00 31.14 H new ATOM 0 HE1 PHE A 128 -12.327 0.247 9.592 1.00 41.23 H new ATOM 0 HE2 PHE A 128 -13.136 -3.042 12.181 1.00 43.21 H new ATOM 0 HZ PHE A 128 -12.618 -0.655 11.864 1.00 23.10 H new ATOM 1326 N ARG A 129 -11.337 -6.471 6.085 1.00 15.55 N ATOM 1327 CA ARG A 129 -11.457 -7.582 5.146 1.00 21.42 C ATOM 1328 C ARG A 129 -12.298 -8.707 5.741 1.00 51.10 C ATOM 1329 O ARG A 129 -12.160 -9.047 6.917 1.00 41.33 O ATOM 1330 CB ARG A 129 -10.071 -8.110 4.770 1.00 14.32 C ATOM 1331 CG ARG A 129 -10.111 -9.330 3.865 1.00 74.22 C ATOM 1332 CD ARG A 129 -8.748 -9.610 3.248 1.00 0.12 C ATOM 1333 NE ARG A 129 -8.404 -8.635 2.217 1.00 31.33 N ATOM 1334 CZ ARG A 129 -7.400 -8.794 1.362 1.00 15.13 C ATOM 1335 NH1 ARG A 129 -6.646 -9.883 1.415 1.00 74.31 N ATOM 1336 NH2 ARG A 129 -7.148 -7.863 0.452 1.00 41.23 N ATOM 0 H ARG A 129 -10.703 -6.644 6.865 1.00 15.55 H new ATOM 0 HA ARG A 129 -11.955 -7.216 4.248 1.00 21.42 H new ATOM 0 HB2 ARG A 129 -9.512 -7.317 4.273 1.00 14.32 H new ATOM 0 HB3 ARG A 129 -9.527 -8.361 5.681 1.00 14.32 H new ATOM 0 HG2 ARG A 129 -10.438 -10.198 4.437 1.00 74.22 H new ATOM 0 HG3 ARG A 129 -10.845 -9.174 3.074 1.00 74.22 H new ATOM 0 HD2 ARG A 129 -7.987 -9.596 4.028 1.00 0.12 H new ATOM 0 HD3 ARG A 129 -8.744 -10.611 2.816 1.00 0.12 H new ATOM 0 HE ARG A 129 -8.965 -7.786 2.150 1.00 31.33 H new ATOM 0 HH11 ARG A 129 -6.836 -10.601 2.114 1.00 74.31 H new ATOM 0 HH12 ARG A 129 -5.876 -10.002 0.757 1.00 74.31 H new ATOM 0 HH21 ARG A 129 -7.725 -7.023 0.408 1.00 41.23 H new ATOM 0 HH22 ARG A 129 -6.377 -7.986 -0.204 1.00 41.23 H new ATOM 1347 N LYS A 130 -13.171 -9.283 4.921 1.00 42.34 N ATOM 1348 CA LYS A 130 -14.035 -10.371 5.362 1.00 34.40 C ATOM 1349 C LYS A 130 -13.222 -11.469 6.043 1.00 65.21 C ATOM 1350 O LYS A 130 -11.992 -11.424 6.059 1.00 4.13 O ATOM 1351 CB LYS A 130 -14.805 -10.953 4.175 1.00 34.25 C ATOM 1352 CG LYS A 130 -13.956 -11.129 2.927 1.00 22.14 C ATOM 1353 CD LYS A 130 -12.865 -12.165 3.137 1.00 15.43 C ATOM 1354 CE LYS A 130 -12.178 -12.523 1.828 1.00 32.23 C ATOM 1355 NZ LYS A 130 -11.490 -13.842 1.905 1.00 14.23 N ATOM 0 H LYS A 130 -13.299 -9.013 3.946 1.00 42.34 H new ATOM 0 HA LYS A 130 -14.745 -9.968 6.084 1.00 34.40 H new ATOM 0 HB2 LYS A 130 -15.221 -11.919 4.461 1.00 34.25 H new ATOM 0 HB3 LYS A 130 -15.646 -10.300 3.943 1.00 34.25 H new ATOM 0 HG2 LYS A 130 -14.590 -11.431 2.094 1.00 22.14 H new ATOM 0 HG3 LYS A 130 -13.505 -10.175 2.655 1.00 22.14 H new ATOM 0 HD2 LYS A 130 -12.128 -11.781 3.843 1.00 15.43 H new ATOM 0 HD3 LYS A 130 -13.295 -13.063 3.581 1.00 15.43 H new ATOM 0 HE2 LYS A 130 -12.915 -12.544 1.025 1.00 32.23 H new ATOM 0 HE3 LYS A 130 -11.453 -11.749 1.575 1.00 32.23 H new ATOM 0 HZ1 LYS A 130 -10.469 -13.710 1.758 1.00 14.23 H new ATOM 0 HZ2 LYS A 130 -11.654 -14.265 2.841 1.00 14.23 H new ATOM 0 HZ3 LYS A 130 -11.867 -14.473 1.169 1.00 14.23 H new ATOM 1365 N ASP A 131 -13.918 -12.453 6.602 1.00 62.45 N ATOM 1366 CA ASP A 131 -13.261 -13.564 7.281 1.00 61.14 C ATOM 1367 C ASP A 131 -13.720 -14.900 6.706 1.00 61.22 C ATOM 1368 O ASP A 131 -12.948 -15.856 6.642 1.00 73.04 O ATOM 1369 CB ASP A 131 -13.550 -13.513 8.782 1.00 34.25 C ATOM 1370 CG ASP A 131 -13.360 -14.860 9.453 1.00 5.55 C ATOM 1371 OD1 ASP A 131 -14.319 -15.661 9.456 1.00 35.11 O ATOM 1372 OD2 ASP A 131 -12.255 -15.112 9.974 1.00 12.32 O ATOM 0 H ASP A 131 -14.937 -12.504 6.598 1.00 62.45 H new ATOM 0 HA ASP A 131 -12.187 -13.472 7.122 1.00 61.14 H new ATOM 0 HB2 ASP A 131 -12.893 -12.780 9.251 1.00 34.25 H new ATOM 0 HB3 ASP A 131 -14.573 -13.172 8.941 1.00 34.25 H new ATOM 1376 N TRP A 132 -14.980 -14.957 6.291 1.00 55.45 N ATOM 1377 CA TRP A 132 -15.541 -16.178 5.721 1.00 1.01 C ATOM 1378 C TRP A 132 -15.637 -16.076 4.203 1.00 32.02 C ATOM 1379 O TRP A 132 -16.504 -16.693 3.584 1.00 22.53 O ATOM 1380 CB TRP A 132 -16.923 -16.452 6.314 1.00 24.33 C ATOM 1381 CG TRP A 132 -17.181 -17.905 6.573 1.00 13.15 C ATOM 1382 CD1 TRP A 132 -17.729 -18.809 5.707 1.00 63.44 C ATOM 1383 CD2 TRP A 132 -16.904 -18.624 7.781 1.00 73.22 C ATOM 1384 NE1 TRP A 132 -17.808 -20.043 6.303 1.00 15.40 N ATOM 1385 CE2 TRP A 132 -17.307 -19.957 7.574 1.00 35.24 C ATOM 1386 CE3 TRP A 132 -16.351 -18.271 9.015 1.00 64.41 C ATOM 1387 CZ2 TRP A 132 -17.177 -20.935 8.558 1.00 52.13 C ATOM 1388 CZ3 TRP A 132 -16.222 -19.242 9.990 1.00 42.40 C ATOM 1389 CH2 TRP A 132 -16.633 -20.561 9.757 1.00 51.11 C ATOM 0 H TRP A 132 -15.632 -14.174 6.338 1.00 55.45 H new ATOM 0 HA TRP A 132 -14.876 -17.005 5.969 1.00 1.01 H new ATOM 0 HB2 TRP A 132 -17.025 -15.900 7.248 1.00 24.33 H new ATOM 0 HB3 TRP A 132 -17.684 -16.071 5.634 1.00 24.33 H new ATOM 0 HD1 TRP A 132 -18.052 -18.585 4.701 1.00 63.44 H new ATOM 0 HE1 TRP A 132 -18.180 -20.888 5.869 1.00 15.40 H new ATOM 0 HE3 TRP A 132 -16.030 -17.257 9.203 1.00 64.41 H new ATOM 0 HZ2 TRP A 132 -17.494 -21.952 8.381 1.00 52.13 H new ATOM 0 HZ3 TRP A 132 -15.797 -18.980 10.948 1.00 42.40 H new ATOM 0 HH2 TRP A 132 -16.518 -21.297 10.539 1.00 51.11 H new ATOM 1399 N SER A 133 -14.740 -15.295 3.608 1.00 21.01 N ATOM 1400 CA SER A 133 -14.727 -15.111 2.162 1.00 54.02 C ATOM 1401 C SER A 133 -16.027 -14.471 1.684 1.00 50.25 C ATOM 1402 O SER A 133 -16.754 -15.046 0.873 1.00 32.33 O ATOM 1403 CB SER A 133 -14.516 -16.453 1.458 1.00 2.42 C ATOM 1404 OG SER A 133 -13.856 -16.279 0.216 1.00 3.00 O ATOM 0 H SER A 133 -14.013 -14.780 4.105 1.00 21.01 H new ATOM 0 HA SER A 133 -13.901 -14.444 1.912 1.00 54.02 H new ATOM 0 HB2 SER A 133 -13.929 -17.114 2.096 1.00 2.42 H new ATOM 0 HB3 SER A 133 -15.479 -16.938 1.297 1.00 2.42 H new ATOM 0 HG SER A 133 -13.732 -17.151 -0.213 1.00 3.00 H new ATOM 1409 N ASP A 134 -16.312 -13.277 2.191 1.00 72.20 N ATOM 1410 CA ASP A 134 -17.523 -12.556 1.817 1.00 52.54 C ATOM 1411 C ASP A 134 -17.193 -11.370 0.916 1.00 50.35 C ATOM 1412 O ASP A 134 -17.262 -11.469 -0.310 1.00 3.35 O ATOM 1413 CB ASP A 134 -18.262 -12.074 3.065 1.00 44.12 C ATOM 1414 CG ASP A 134 -19.418 -11.150 2.733 1.00 0.31 C ATOM 1415 OD1 ASP A 134 -20.016 -11.313 1.649 1.00 51.33 O ATOM 1416 OD2 ASP A 134 -19.724 -10.264 3.558 1.00 3.04 O ATOM 0 H ASP A 134 -15.721 -12.788 2.863 1.00 72.20 H new ATOM 0 HA ASP A 134 -18.167 -13.240 1.265 1.00 52.54 H new ATOM 0 HB2 ASP A 134 -18.637 -12.936 3.617 1.00 44.12 H new ATOM 0 HB3 ASP A 134 -17.562 -11.555 3.720 1.00 44.12 H new ATOM 1420 N LYS A 135 -16.834 -10.249 1.531 1.00 41.32 N ATOM 1421 CA LYS A 135 -16.493 -9.043 0.786 1.00 60.43 C ATOM 1422 C LYS A 135 -15.429 -8.232 1.520 1.00 22.23 C ATOM 1423 O LYS A 135 -15.078 -8.539 2.659 1.00 50.01 O ATOM 1424 CB LYS A 135 -17.740 -8.184 0.564 1.00 20.23 C ATOM 1425 CG LYS A 135 -18.778 -8.838 -0.331 1.00 14.42 C ATOM 1426 CD LYS A 135 -20.098 -8.086 -0.296 1.00 55.23 C ATOM 1427 CE LYS A 135 -20.877 -8.386 0.975 1.00 43.25 C ATOM 1428 NZ LYS A 135 -21.707 -7.225 1.403 1.00 53.14 N ATOM 0 H LYS A 135 -16.772 -10.150 2.544 1.00 41.32 H new ATOM 0 HA LYS A 135 -16.092 -9.346 -0.181 1.00 60.43 H new ATOM 0 HB2 LYS A 135 -18.194 -7.961 1.530 1.00 20.23 H new ATOM 0 HB3 LYS A 135 -17.442 -7.232 0.125 1.00 20.23 H new ATOM 0 HG2 LYS A 135 -18.406 -8.874 -1.355 1.00 14.42 H new ATOM 0 HG3 LYS A 135 -18.937 -9.868 -0.013 1.00 14.42 H new ATOM 0 HD2 LYS A 135 -19.909 -7.015 -0.364 1.00 55.23 H new ATOM 0 HD3 LYS A 135 -20.697 -8.360 -1.164 1.00 55.23 H new ATOM 0 HE2 LYS A 135 -21.519 -9.251 0.812 1.00 43.25 H new ATOM 0 HE3 LYS A 135 -20.183 -8.650 1.773 1.00 43.25 H new ATOM 0 HZ1 LYS A 135 -22.223 -7.469 2.273 1.00 53.14 H new ATOM 0 HZ2 LYS A 135 -21.092 -6.406 1.583 1.00 53.14 H new ATOM 0 HZ3 LYS A 135 -22.387 -6.989 0.652 1.00 53.14 H new ATOM 1438 N ALA A 136 -14.920 -7.197 0.861 1.00 44.40 N ATOM 1439 CA ALA A 136 -13.900 -6.340 1.452 1.00 30.55 C ATOM 1440 C ALA A 136 -14.404 -4.909 1.602 1.00 72.03 C ATOM 1441 O ALA A 136 -14.801 -4.275 0.624 1.00 43.32 O ATOM 1442 CB ALA A 136 -12.633 -6.371 0.611 1.00 75.14 C ATOM 0 H ALA A 136 -15.198 -6.931 -0.084 1.00 44.40 H new ATOM 0 HA ALA A 136 -13.672 -6.722 2.447 1.00 30.55 H new ATOM 0 HB1 ALA A 136 -11.880 -5.727 1.064 1.00 75.14 H new ATOM 0 HB2 ALA A 136 -12.254 -7.392 0.561 1.00 75.14 H new ATOM 0 HB3 ALA A 136 -12.856 -6.017 -0.396 1.00 75.14 H new ATOM 1448 N LEU A 137 -14.384 -4.405 2.831 1.00 51.01 N ATOM 1449 CA LEU A 137 -14.839 -3.047 3.108 1.00 23.52 C ATOM 1450 C LEU A 137 -13.671 -2.154 3.513 1.00 63.24 C ATOM 1451 O LEU A 137 -12.775 -2.576 4.243 1.00 75.43 O ATOM 1452 CB LEU A 137 -15.894 -3.059 4.216 1.00 43.51 C ATOM 1453 CG LEU A 137 -17.323 -2.727 3.785 1.00 5.02 C ATOM 1454 CD1 LEU A 137 -18.315 -3.150 4.857 1.00 2.41 C ATOM 1455 CD2 LEU A 137 -17.459 -1.241 3.487 1.00 41.44 C ATOM 0 H LEU A 137 -14.058 -4.916 3.651 1.00 51.01 H new ATOM 0 HA LEU A 137 -15.281 -2.645 2.197 1.00 23.52 H new ATOM 0 HB2 LEU A 137 -15.895 -4.046 4.678 1.00 43.51 H new ATOM 0 HB3 LEU A 137 -15.593 -2.347 4.985 1.00 43.51 H new ATOM 0 HG LEU A 137 -17.545 -3.282 2.873 1.00 5.02 H new ATOM 0 HD11 LEU A 137 -19.327 -2.906 4.533 1.00 2.41 H new ATOM 0 HD12 LEU A 137 -18.236 -4.225 5.022 1.00 2.41 H new ATOM 0 HD13 LEU A 137 -18.094 -2.623 5.785 1.00 2.41 H new ATOM 0 HD21 LEU A 137 -18.483 -1.023 3.182 1.00 41.44 H new ATOM 0 HD22 LEU A 137 -17.217 -0.667 4.381 1.00 41.44 H new ATOM 0 HD23 LEU A 137 -16.775 -0.967 2.684 1.00 41.44 H new ATOM 1466 N LYS A 138 -13.688 -0.914 3.035 1.00 41.34 N ATOM 1467 CA LYS A 138 -12.633 0.042 3.347 1.00 71.31 C ATOM 1468 C LYS A 138 -13.222 1.375 3.800 1.00 0.42 C ATOM 1469 O LYS A 138 -13.918 2.047 3.037 1.00 62.04 O ATOM 1470 CB LYS A 138 -11.734 0.259 2.128 1.00 13.53 C ATOM 1471 CG LYS A 138 -12.503 0.483 0.837 1.00 33.44 C ATOM 1472 CD LYS A 138 -11.570 0.567 -0.359 1.00 4.43 C ATOM 1473 CE LYS A 138 -12.346 0.641 -1.666 1.00 33.40 C ATOM 1474 NZ LYS A 138 -13.226 -0.545 -1.857 1.00 61.20 N ATOM 0 H LYS A 138 -14.422 -0.548 2.429 1.00 41.34 H new ATOM 0 HA LYS A 138 -12.037 -0.368 4.162 1.00 71.31 H new ATOM 0 HB2 LYS A 138 -11.089 1.119 2.311 1.00 13.53 H new ATOM 0 HB3 LYS A 138 -11.084 -0.607 2.008 1.00 13.53 H new ATOM 0 HG2 LYS A 138 -13.213 -0.331 0.689 1.00 33.44 H new ATOM 0 HG3 LYS A 138 -13.083 1.403 0.913 1.00 33.44 H new ATOM 0 HD2 LYS A 138 -10.932 1.445 -0.263 1.00 4.43 H new ATOM 0 HD3 LYS A 138 -10.914 -0.304 -0.372 1.00 4.43 H new ATOM 0 HE2 LYS A 138 -12.951 1.548 -1.678 1.00 33.40 H new ATOM 0 HE3 LYS A 138 -11.647 0.713 -2.500 1.00 33.40 H new ATOM 0 HZ1 LYS A 138 -13.552 -0.580 -2.844 1.00 61.20 H new ATOM 0 HZ2 LYS A 138 -12.694 -1.411 -1.637 1.00 61.20 H new ATOM 0 HZ3 LYS A 138 -14.048 -0.473 -1.224 1.00 61.20 H new ATOM 1484 N ILE A 139 -12.940 1.750 5.042 1.00 23.22 N ATOM 1485 CA ILE A 139 -13.441 3.003 5.594 1.00 31.41 C ATOM 1486 C ILE A 139 -12.346 3.748 6.348 1.00 70.53 C ATOM 1487 O ILE A 139 -11.463 3.134 6.949 1.00 53.33 O ATOM 1488 CB ILE A 139 -14.631 2.765 6.543 1.00 73.01 C ATOM 1489 CG1 ILE A 139 -15.285 4.096 6.920 1.00 55.21 C ATOM 1490 CG2 ILE A 139 -14.173 2.021 7.789 1.00 2.54 C ATOM 1491 CD1 ILE A 139 -16.601 3.937 7.650 1.00 73.32 C ATOM 0 H ILE A 139 -12.367 1.204 5.686 1.00 23.22 H new ATOM 0 HA ILE A 139 -13.775 3.608 4.751 1.00 31.41 H new ATOM 0 HB ILE A 139 -15.371 2.152 6.029 1.00 73.01 H new ATOM 0 HG12 ILE A 139 -14.598 4.665 7.546 1.00 55.21 H new ATOM 0 HG13 ILE A 139 -15.449 4.680 6.015 1.00 55.21 H new ATOM 0 HG21 ILE A 139 -15.024 1.860 8.450 1.00 2.54 H new ATOM 0 HG22 ILE A 139 -13.749 1.059 7.503 1.00 2.54 H new ATOM 0 HG23 ILE A 139 -13.417 2.611 8.308 1.00 2.54 H new ATOM 0 HD11 ILE A 139 -17.007 4.921 7.886 1.00 73.32 H new ATOM 0 HD12 ILE A 139 -17.305 3.396 7.018 1.00 73.32 H new ATOM 0 HD13 ILE A 139 -16.440 3.380 8.573 1.00 73.32 H new ATOM 1502 N ASP A 140 -12.409 5.075 6.315 1.00 32.14 N ATOM 1503 CA ASP A 140 -11.424 5.904 6.999 1.00 42.03 C ATOM 1504 C ASP A 140 -11.911 6.290 8.392 1.00 34.25 C ATOM 1505 O ASP A 140 -13.008 6.826 8.552 1.00 71.02 O ATOM 1506 CB ASP A 140 -11.131 7.164 6.181 1.00 1.41 C ATOM 1507 CG ASP A 140 -10.026 6.951 5.166 1.00 74.51 C ATOM 1508 OD1 ASP A 140 -8.841 7.031 5.554 1.00 40.33 O ATOM 1509 OD2 ASP A 140 -10.344 6.705 3.984 1.00 3.02 O ATOM 0 H ASP A 140 -13.132 5.599 5.822 1.00 32.14 H new ATOM 0 HA ASP A 140 -10.507 5.324 7.102 1.00 42.03 H new ATOM 0 HB2 ASP A 140 -12.038 7.478 5.665 1.00 1.41 H new ATOM 0 HB3 ASP A 140 -10.851 7.974 6.854 1.00 1.41 H new ATOM 1513 N LEU A 141 -11.089 6.011 9.398 1.00 31.53 N ATOM 1514 CA LEU A 141 -11.435 6.327 10.780 1.00 5.11 C ATOM 1515 C LEU A 141 -10.850 7.674 11.193 1.00 22.31 C ATOM 1516 O LEU A 141 -9.671 7.944 10.968 1.00 72.12 O ATOM 1517 CB LEU A 141 -10.930 5.229 11.717 1.00 63.23 C ATOM 1518 CG LEU A 141 -11.755 4.996 12.984 1.00 43.04 C ATOM 1519 CD1 LEU A 141 -11.778 6.251 13.844 1.00 15.41 C ATOM 1520 CD2 LEU A 141 -13.170 4.565 12.626 1.00 62.43 C ATOM 0 H LEU A 141 -10.178 5.567 9.283 1.00 31.53 H new ATOM 0 HA LEU A 141 -12.521 6.386 10.853 1.00 5.11 H new ATOM 0 HB2 LEU A 141 -10.887 4.294 11.159 1.00 63.23 H new ATOM 0 HB3 LEU A 141 -9.909 5.472 12.012 1.00 63.23 H new ATOM 0 HG LEU A 141 -11.288 4.196 13.558 1.00 43.04 H new ATOM 0 HD11 LEU A 141 -12.369 6.067 14.741 1.00 15.41 H new ATOM 0 HD12 LEU A 141 -10.760 6.516 14.129 1.00 15.41 H new ATOM 0 HD13 LEU A 141 -12.221 7.071 13.279 1.00 15.41 H new ATOM 0 HD21 LEU A 141 -13.743 4.404 13.539 1.00 62.43 H new ATOM 0 HD22 LEU A 141 -13.648 5.343 12.031 1.00 62.43 H new ATOM 0 HD23 LEU A 141 -13.134 3.639 12.052 1.00 62.43 H new ATOM 1531 N MET A 142 -11.682 8.513 11.801 1.00 70.14 N ATOM 1532 CA MET A 142 -11.245 9.830 12.249 1.00 60.53 C ATOM 1533 C MET A 142 -11.888 10.191 13.585 1.00 12.32 C ATOM 1534 O MET A 142 -12.960 9.700 13.938 1.00 4.55 O ATOM 1535 CB MET A 142 -11.591 10.890 11.202 1.00 44.25 C ATOM 1536 CG MET A 142 -13.064 10.920 10.830 1.00 1.32 C ATOM 1537 SD MET A 142 -14.021 12.037 11.872 1.00 21.24 S ATOM 1538 CE MET A 142 -15.468 11.033 12.206 1.00 60.45 C ATOM 0 H MET A 142 -12.662 8.305 11.995 1.00 70.14 H new ATOM 0 HA MET A 142 -10.164 9.800 12.382 1.00 60.53 H new ATOM 0 HB2 MET A 142 -11.300 11.870 11.580 1.00 44.25 H new ATOM 0 HB3 MET A 142 -11.002 10.707 10.304 1.00 44.25 H new ATOM 0 HG2 MET A 142 -13.165 11.225 9.788 1.00 1.32 H new ATOM 0 HG3 MET A 142 -13.475 9.914 10.909 1.00 1.32 H new ATOM 0 HE1 MET A 142 -16.149 11.582 12.856 1.00 60.45 H new ATOM 0 HE2 MET A 142 -15.972 10.798 11.269 1.00 60.45 H new ATOM 0 HE3 MET A 142 -15.164 10.108 12.697 1.00 60.45 H new ATOM 1546 N PRO A 143 -11.219 11.068 14.348 1.00 62.34 N ATOM 1547 CA PRO A 143 -11.706 11.513 15.656 1.00 3.45 C ATOM 1548 C PRO A 143 -12.940 12.404 15.543 1.00 15.55 C ATOM 1549 O PRO A 143 -13.045 13.222 14.630 1.00 1.14 O ATOM 1550 CB PRO A 143 -10.526 12.305 16.224 1.00 63.42 C ATOM 1551 CG PRO A 143 -9.771 12.771 15.028 1.00 54.10 C ATOM 1552 CD PRO A 143 -9.934 11.693 13.991 1.00 44.13 C ATOM 0 HA PRO A 143 -12.016 10.676 16.281 1.00 3.45 H new ATOM 0 HB2 PRO A 143 -10.868 13.145 16.828 1.00 63.42 H new ATOM 0 HB3 PRO A 143 -9.904 11.682 16.867 1.00 63.42 H new ATOM 0 HG2 PRO A 143 -10.161 13.723 14.667 1.00 54.10 H new ATOM 0 HG3 PRO A 143 -8.719 12.927 15.267 1.00 54.10 H new ATOM 0 HD2 PRO A 143 -9.954 12.105 12.982 1.00 44.13 H new ATOM 0 HD3 PRO A 143 -9.115 10.975 14.025 1.00 44.13 H new ATOM 1557 N HIS A 144 -13.871 12.237 16.477 1.00 21.11 N ATOM 1558 CA HIS A 144 -15.097 13.026 16.482 1.00 23.33 C ATOM 1559 C HIS A 144 -14.783 14.519 16.424 1.00 0.03 C ATOM 1560 O HIS A 144 -13.832 14.986 17.046 1.00 74.34 O ATOM 1561 CB HIS A 144 -15.924 12.716 17.730 1.00 13.22 C ATOM 1562 CG HIS A 144 -15.170 12.906 19.011 1.00 2.33 C ATOM 1563 ND1 HIS A 144 -14.769 11.857 19.811 1.00 55.23 N ATOM 1564 CD2 HIS A 144 -14.742 14.032 19.627 1.00 5.15 C ATOM 1565 CE1 HIS A 144 -14.129 12.330 20.865 1.00 53.35 C ATOM 1566 NE2 HIS A 144 -14.099 13.647 20.777 1.00 24.45 N ATOM 0 H HIS A 144 -13.800 11.563 17.239 1.00 21.11 H new ATOM 0 HA HIS A 144 -15.675 12.759 15.597 1.00 23.33 H new ATOM 0 HB2 HIS A 144 -16.807 13.356 17.739 1.00 13.22 H new ATOM 0 HB3 HIS A 144 -16.277 11.686 17.675 1.00 13.22 H new ATOM 0 HD2 HIS A 144 -14.880 15.045 19.279 1.00 5.15 H new ATOM 0 HE1 HIS A 144 -13.703 11.740 21.663 1.00 53.35 H new ATOM 0 HE2 HIS A 144 -13.668 14.276 21.454 1.00 24.45 H new ATOM 1930 N THR A 169 -14.788 11.988 7.159 1.00 10.53 N ATOM 1931 CA THR A 169 -14.329 11.431 5.893 1.00 2.11 C ATOM 1932 C THR A 169 -15.458 10.702 5.172 1.00 14.30 C ATOM 1933 O THR A 169 -16.552 10.544 5.711 1.00 13.03 O ATOM 1934 CB THR A 169 -13.154 10.457 6.100 1.00 62.22 C ATOM 1935 OG1 THR A 169 -12.587 10.097 4.835 1.00 1.21 O ATOM 1936 CG2 THR A 169 -13.612 9.204 6.832 1.00 52.51 C ATOM 0 HA THR A 169 -13.993 12.269 5.283 1.00 2.11 H new ATOM 0 HB THR A 169 -12.399 10.957 6.707 1.00 62.22 H new ATOM 0 HG1 THR A 169 -11.748 9.611 4.979 1.00 1.21 H new ATOM 0 HG21 THR A 169 -12.765 8.531 6.967 1.00 52.51 H new ATOM 0 HG22 THR A 169 -14.016 9.479 7.807 1.00 52.51 H new ATOM 0 HG23 THR A 169 -14.384 8.703 6.248 1.00 52.51 H new ATOM 1944 N GLY A 170 -15.183 10.256 3.950 1.00 62.11 N ATOM 1945 CA GLY A 170 -16.185 9.547 3.176 1.00 42.02 C ATOM 1946 C GLY A 170 -16.678 8.295 3.874 1.00 54.53 C ATOM 1947 O GLY A 170 -16.080 7.821 4.839 1.00 24.24 O ATOM 0 H GLY A 170 -14.284 10.373 3.482 1.00 62.11 H new ATOM 0 HA2 GLY A 170 -17.029 10.210 2.986 1.00 42.02 H new ATOM 0 HA3 GLY A 170 -15.767 9.278 2.206 1.00 42.02 H new ATOM 1951 N PRO A 171 -17.795 7.738 3.380 1.00 63.55 N ATOM 1952 CA PRO A 171 -18.393 6.528 3.949 1.00 15.41 C ATOM 1953 C PRO A 171 -17.545 5.287 3.691 1.00 12.23 C ATOM 1954 O PRO A 171 -16.415 5.384 3.213 1.00 43.44 O ATOM 1955 CB PRO A 171 -19.735 6.419 3.219 1.00 33.23 C ATOM 1956 CG PRO A 171 -19.525 7.137 1.931 1.00 71.45 C ATOM 1957 CD PRO A 171 -18.559 8.250 2.230 1.00 24.52 C ATOM 0 HA PRO A 171 -18.485 6.590 5.033 1.00 15.41 H new ATOM 0 HB2 PRO A 171 -20.011 5.378 3.051 1.00 33.23 H new ATOM 0 HB3 PRO A 171 -20.539 6.873 3.799 1.00 33.23 H new ATOM 0 HG2 PRO A 171 -19.124 6.466 1.171 1.00 71.45 H new ATOM 0 HG3 PRO A 171 -20.466 7.530 1.545 1.00 71.45 H new ATOM 0 HD2 PRO A 171 -17.912 8.460 1.379 1.00 24.52 H new ATOM 0 HD3 PRO A 171 -19.077 9.178 2.473 1.00 24.52 H new ATOM 1962 N ALA A 172 -18.097 4.121 4.011 1.00 60.53 N ATOM 1963 CA ALA A 172 -17.391 2.861 3.813 1.00 44.12 C ATOM 1964 C ALA A 172 -17.670 2.289 2.427 1.00 51.41 C ATOM 1965 O ALA A 172 -18.806 2.309 1.952 1.00 35.54 O ATOM 1966 CB ALA A 172 -17.787 1.860 4.888 1.00 72.22 C ATOM 0 H ALA A 172 -19.031 4.023 4.409 1.00 60.53 H new ATOM 0 HA ALA A 172 -16.321 3.056 3.890 1.00 44.12 H new ATOM 0 HB1 ALA A 172 -17.252 0.924 4.728 1.00 72.22 H new ATOM 0 HB2 ALA A 172 -17.532 2.260 5.869 1.00 72.22 H new ATOM 0 HB3 ALA A 172 -18.861 1.678 4.838 1.00 72.22 H new ATOM 1972 N VAL A 173 -16.626 1.781 1.780 1.00 72.43 N ATOM 1973 CA VAL A 173 -16.757 1.203 0.448 1.00 60.14 C ATOM 1974 C VAL A 173 -16.660 -0.318 0.497 1.00 64.32 C ATOM 1975 O VAL A 173 -15.609 -0.872 0.815 1.00 55.12 O ATOM 1976 CB VAL A 173 -15.678 1.745 -0.508 1.00 21.11 C ATOM 1977 CG1 VAL A 173 -15.949 1.288 -1.934 1.00 23.22 C ATOM 1978 CG2 VAL A 173 -15.611 3.262 -0.430 1.00 24.12 C ATOM 0 H VAL A 173 -15.679 1.758 2.158 1.00 72.43 H new ATOM 0 HA VAL A 173 -17.740 1.490 0.074 1.00 60.14 H new ATOM 0 HB VAL A 173 -14.712 1.345 -0.201 1.00 21.11 H new ATOM 0 HG11 VAL A 173 -15.176 1.681 -2.595 1.00 23.22 H new ATOM 0 HG12 VAL A 173 -15.942 0.199 -1.975 1.00 23.22 H new ATOM 0 HG13 VAL A 173 -16.923 1.657 -2.255 1.00 23.22 H new ATOM 0 HG21 VAL A 173 -14.843 3.628 -1.112 1.00 24.12 H new ATOM 0 HG22 VAL A 173 -16.576 3.684 -0.710 1.00 24.12 H new ATOM 0 HG23 VAL A 173 -15.365 3.563 0.588 1.00 24.12 H new ATOM 1988 N GLU A 174 -17.765 -0.986 0.180 1.00 55.44 N ATOM 1989 CA GLU A 174 -17.803 -2.444 0.187 1.00 2.23 C ATOM 1990 C GLU A 174 -17.616 -3.000 -1.221 1.00 34.34 C ATOM 1991 O GLU A 174 -18.319 -2.612 -2.154 1.00 21.24 O ATOM 1992 CB GLU A 174 -19.129 -2.937 0.771 1.00 53.55 C ATOM 1993 CG GLU A 174 -20.351 -2.299 0.131 1.00 32.31 C ATOM 1994 CD GLU A 174 -21.504 -3.271 -0.022 1.00 40.00 C ATOM 1995 OE1 GLU A 174 -22.365 -3.317 0.882 1.00 11.42 O ATOM 1996 OE2 GLU A 174 -21.547 -3.986 -1.045 1.00 51.14 O ATOM 0 H GLU A 174 -18.644 -0.542 -0.084 1.00 55.44 H new ATOM 0 HA GLU A 174 -16.984 -2.801 0.811 1.00 2.23 H new ATOM 0 HB2 GLU A 174 -19.189 -4.019 0.651 1.00 53.55 H new ATOM 0 HB3 GLU A 174 -19.142 -2.734 1.842 1.00 53.55 H new ATOM 0 HG2 GLU A 174 -20.673 -1.452 0.737 1.00 32.31 H new ATOM 0 HG3 GLU A 174 -20.080 -1.906 -0.849 1.00 32.31 H new ATOM 2001 N VAL A 175 -16.661 -3.915 -1.368 1.00 64.41 N ATOM 2002 CA VAL A 175 -16.381 -4.526 -2.661 1.00 72.14 C ATOM 2003 C VAL A 175 -15.795 -5.923 -2.493 1.00 24.42 C ATOM 2004 O VAL A 175 -14.903 -6.138 -1.671 1.00 12.42 O ATOM 2005 CB VAL A 175 -15.404 -3.668 -3.487 1.00 53.25 C ATOM 2006 CG1 VAL A 175 -14.084 -3.501 -2.750 1.00 31.32 C ATOM 2007 CG2 VAL A 175 -15.183 -4.286 -4.860 1.00 71.31 C ATOM 0 H VAL A 175 -16.069 -4.248 -0.607 1.00 64.41 H new ATOM 0 HA VAL A 175 -17.331 -4.595 -3.191 1.00 72.14 H new ATOM 0 HB VAL A 175 -15.843 -2.680 -3.624 1.00 53.25 H new ATOM 0 HG11 VAL A 175 -13.407 -2.892 -3.349 1.00 31.32 H new ATOM 0 HG12 VAL A 175 -14.261 -3.011 -1.793 1.00 31.32 H new ATOM 0 HG13 VAL A 175 -13.636 -4.480 -2.579 1.00 31.32 H new ATOM 0 HG21 VAL A 175 -14.490 -3.667 -5.430 1.00 71.31 H new ATOM 0 HG22 VAL A 175 -14.766 -5.287 -4.746 1.00 71.31 H new ATOM 0 HG23 VAL A 175 -16.134 -4.348 -5.389 1.00 71.31 H new ATOM 2017 N ASP A 176 -16.301 -6.869 -3.275 1.00 71.13 N ATOM 2018 CA ASP A 176 -15.827 -8.247 -3.215 1.00 43.11 C ATOM 2019 C ASP A 176 -14.329 -8.319 -3.495 1.00 44.25 C ATOM 2020 O ASP A 176 -13.840 -7.740 -4.466 1.00 21.23 O ATOM 2021 CB ASP A 176 -16.589 -9.116 -4.217 1.00 23.32 C ATOM 2022 CG ASP A 176 -17.882 -9.661 -3.645 1.00 20.23 C ATOM 2023 OD1 ASP A 176 -18.883 -8.914 -3.621 1.00 52.21 O ATOM 2024 OD2 ASP A 176 -17.894 -10.835 -3.220 1.00 21.01 O ATOM 0 H ASP A 176 -17.040 -6.707 -3.959 1.00 71.13 H new ATOM 0 HA ASP A 176 -16.009 -8.624 -2.209 1.00 43.11 H new ATOM 0 HB2 ASP A 176 -16.809 -8.529 -5.109 1.00 23.32 H new ATOM 0 HB3 ASP A 176 -15.955 -9.946 -4.529 1.00 23.32 H new ATOM 2028 N VAL A 177 -13.606 -9.033 -2.639 1.00 62.24 N ATOM 2029 CA VAL A 177 -12.163 -9.180 -2.795 1.00 34.24 C ATOM 2030 C VAL A 177 -11.810 -9.675 -4.193 1.00 73.32 C ATOM 2031 O VAL A 177 -10.735 -9.377 -4.715 1.00 11.14 O ATOM 2032 CB VAL A 177 -11.584 -10.159 -1.755 1.00 62.33 C ATOM 2033 CG1 VAL A 177 -11.816 -9.637 -0.344 1.00 55.23 C ATOM 2034 CG2 VAL A 177 -12.192 -11.542 -1.927 1.00 3.44 C ATOM 0 H VAL A 177 -13.995 -9.519 -1.831 1.00 62.24 H new ATOM 0 HA VAL A 177 -11.725 -8.194 -2.640 1.00 34.24 H new ATOM 0 HB VAL A 177 -10.509 -10.238 -1.916 1.00 62.33 H new ATOM 0 HG11 VAL A 177 -11.401 -10.341 0.377 1.00 55.23 H new ATOM 0 HG12 VAL A 177 -11.328 -8.669 -0.229 1.00 55.23 H new ATOM 0 HG13 VAL A 177 -12.886 -9.526 -0.168 1.00 55.23 H new ATOM 0 HG21 VAL A 177 -11.771 -12.219 -1.184 1.00 3.44 H new ATOM 0 HG22 VAL A 177 -13.272 -11.484 -1.794 1.00 3.44 H new ATOM 0 HG23 VAL A 177 -11.969 -11.916 -2.926 1.00 3.44 H new ATOM 2044 N LYS A 178 -12.720 -10.432 -4.795 1.00 43.35 N ATOM 2045 CA LYS A 178 -12.507 -10.968 -6.134 1.00 43.23 C ATOM 2046 C LYS A 178 -12.917 -9.954 -7.198 1.00 25.31 C ATOM 2047 O LYS A 178 -12.312 -9.882 -8.267 1.00 13.31 O ATOM 2048 CB LYS A 178 -13.297 -12.264 -6.320 1.00 32.34 C ATOM 2049 CG LYS A 178 -14.797 -12.090 -6.157 1.00 11.32 C ATOM 2050 CD LYS A 178 -15.527 -13.419 -6.262 1.00 4.13 C ATOM 2051 CE LYS A 178 -15.731 -14.053 -4.893 1.00 44.55 C ATOM 2052 NZ LYS A 178 -16.382 -15.388 -4.992 1.00 35.11 N ATOM 0 H LYS A 178 -13.614 -10.689 -4.376 1.00 43.35 H new ATOM 0 HA LYS A 178 -11.444 -11.179 -6.248 1.00 43.23 H new ATOM 0 HB2 LYS A 178 -13.092 -12.666 -7.312 1.00 32.34 H new ATOM 0 HB3 LYS A 178 -12.945 -13.001 -5.599 1.00 32.34 H new ATOM 0 HG2 LYS A 178 -15.008 -11.633 -5.190 1.00 11.32 H new ATOM 0 HG3 LYS A 178 -15.170 -11.407 -6.921 1.00 11.32 H new ATOM 0 HD2 LYS A 178 -16.494 -13.267 -6.742 1.00 4.13 H new ATOM 0 HD3 LYS A 178 -14.959 -14.098 -6.898 1.00 4.13 H new ATOM 0 HE2 LYS A 178 -14.768 -14.155 -4.393 1.00 44.55 H new ATOM 0 HE3 LYS A 178 -16.343 -13.395 -4.276 1.00 44.55 H new ATOM 0 HZ1 LYS A 178 -16.503 -15.787 -4.039 1.00 35.11 H new ATOM 0 HZ2 LYS A 178 -17.312 -15.288 -5.446 1.00 35.11 H new ATOM 0 HZ3 LYS A 178 -15.786 -16.024 -5.560 1.00 35.11 H new ATOM 2062 N ASP A 179 -13.947 -9.170 -6.896 1.00 73.31 N ATOM 2063 CA ASP A 179 -14.436 -8.158 -7.824 1.00 12.42 C ATOM 2064 C ASP A 179 -13.359 -7.116 -8.108 1.00 63.24 C ATOM 2065 O ASP A 179 -13.079 -6.799 -9.265 1.00 60.34 O ATOM 2066 CB ASP A 179 -15.685 -7.478 -7.260 1.00 10.53 C ATOM 2067 CG ASP A 179 -16.952 -8.251 -7.567 1.00 1.21 C ATOM 2068 OD1 ASP A 179 -16.849 -9.370 -8.114 1.00 65.03 O ATOM 2069 OD2 ASP A 179 -18.049 -7.739 -7.259 1.00 62.23 O ATOM 0 H ASP A 179 -14.459 -9.217 -6.015 1.00 73.31 H new ATOM 0 HA ASP A 179 -14.693 -8.653 -8.760 1.00 12.42 H new ATOM 0 HB2 ASP A 179 -15.581 -7.371 -6.180 1.00 10.53 H new ATOM 0 HB3 ASP A 179 -15.766 -6.473 -7.674 1.00 10.53 H new ATOM 2073 N ILE A 180 -12.761 -6.586 -7.047 1.00 22.43 N ATOM 2074 CA ILE A 180 -11.716 -5.579 -7.183 1.00 25.31 C ATOM 2075 C ILE A 180 -10.625 -6.045 -8.141 1.00 11.24 C ATOM 2076 O ILE A 180 -10.421 -7.241 -8.354 1.00 63.53 O ATOM 2077 CB ILE A 180 -11.079 -5.242 -5.822 1.00 62.22 C ATOM 2078 CG1 ILE A 180 -10.773 -6.525 -5.045 1.00 64.33 C ATOM 2079 CG2 ILE A 180 -11.997 -4.335 -5.017 1.00 44.42 C ATOM 2080 CD1 ILE A 180 -9.863 -6.308 -3.856 1.00 15.20 C ATOM 0 H ILE A 180 -12.982 -6.837 -6.083 1.00 22.43 H new ATOM 0 HA ILE A 180 -12.191 -4.684 -7.585 1.00 25.31 H new ATOM 0 HB ILE A 180 -10.142 -4.714 -5.998 1.00 62.22 H new ATOM 0 HG12 ILE A 180 -11.709 -6.964 -4.700 1.00 64.33 H new ATOM 0 HG13 ILE A 180 -10.312 -7.247 -5.719 1.00 64.33 H new ATOM 0 HG21 ILE A 180 -11.533 -4.106 -4.058 1.00 44.42 H new ATOM 0 HG22 ILE A 180 -12.168 -3.410 -5.567 1.00 44.42 H new ATOM 0 HG23 ILE A 180 -12.949 -4.838 -4.848 1.00 44.42 H new ATOM 0 HD11 ILE A 180 -9.689 -7.259 -3.353 1.00 15.20 H new ATOM 0 HD12 ILE A 180 -8.912 -5.898 -4.196 1.00 15.20 H new ATOM 0 HD13 ILE A 180 -10.332 -5.610 -3.162 1.00 15.20 H new