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 Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 145:sc= -0.34 (180deg=-1.92!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.323 K(o=-0.32,f=-4.8!) 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= 0.002 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -128:sc= 0.358 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -1.8 K(o=-1.8,f=-1.1) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 88:sc= 0.214 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 -158:sc= -0.43 (180deg=-1.27) USER MOD Single : A 110 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.913 X(o=-0.91,f=-0.61) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -2.11 K(o=-2.1,f=-0.98!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.034 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HE2:sc= -5.28! C(o=-5.3!,f=-9.8!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 91:sc= 0.0309 USER MOD Single : A 135 LYS NZ :NH3+ 143:sc= -0.0523 (180deg=-0.532) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc= -0.0996 X(o=-0.1,f=-0.36) USER MOD Single : A 169 THR OG1 : rot -17:sc= 0.552 USER MOD Single : A 178 LYS NZ :NH3+ -131:sc= -0.0535 (180deg=-0.428) USER MOD ----------------------------------------------------------------- ATOM 21 N TYR A 40 60.858 -34.785 -15.447 1.00 14.21 N ATOM 22 CA TYR A 40 61.255 -33.400 -15.665 1.00 22.01 C ATOM 23 C TYR A 40 61.587 -33.152 -17.133 1.00 52.34 C ATOM 24 O TYR A 40 62.400 -33.862 -17.726 1.00 11.11 O ATOM 25 CB TYR A 40 62.462 -33.049 -14.792 1.00 55.35 C ATOM 26 CG TYR A 40 62.193 -33.169 -13.310 1.00 44.30 C ATOM 27 CD1 TYR A 40 62.503 -34.334 -12.619 1.00 51.44 C ATOM 28 CD2 TYR A 40 61.626 -32.118 -12.599 1.00 10.42 C ATOM 29 CE1 TYR A 40 62.258 -34.449 -11.265 1.00 3.35 C ATOM 30 CE2 TYR A 40 61.378 -32.224 -11.244 1.00 30.11 C ATOM 31 CZ TYR A 40 61.696 -33.390 -10.582 1.00 10.42 C ATOM 32 OH TYR A 40 61.450 -33.500 -9.232 1.00 42.20 O ATOM 0 HA TYR A 40 60.416 -32.762 -15.388 1.00 22.01 H new ATOM 0 HB2 TYR A 40 63.293 -33.703 -15.056 1.00 55.35 H new ATOM 0 HB3 TYR A 40 62.776 -32.029 -15.014 1.00 55.35 H new ATOM 0 HD1 TYR A 40 62.944 -35.165 -13.151 1.00 51.44 H new ATOM 0 HD2 TYR A 40 61.375 -31.203 -13.115 1.00 10.42 H new ATOM 0 HE1 TYR A 40 62.505 -35.362 -10.744 1.00 3.35 H new ATOM 0 HE2 TYR A 40 60.937 -31.397 -10.706 1.00 30.11 H new ATOM 0 HH TYR A 40 61.053 -32.666 -8.903 1.00 42.20 H new ATOM 41 N ARG A 41 60.952 -32.141 -17.714 1.00 63.04 N ATOM 42 CA ARG A 41 61.177 -31.799 -19.114 1.00 64.14 C ATOM 43 C ARG A 41 60.565 -30.442 -19.448 1.00 42.11 C ATOM 44 O ARG A 41 59.482 -30.102 -18.970 1.00 62.40 O ATOM 45 CB ARG A 41 60.586 -32.875 -20.026 1.00 21.30 C ATOM 46 CG ARG A 41 61.269 -32.968 -21.381 1.00 24.14 C ATOM 47 CD ARG A 41 62.463 -33.909 -21.339 1.00 51.20 C ATOM 48 NE ARG A 41 62.060 -35.309 -21.448 1.00 52.54 N ATOM 49 CZ ARG A 41 61.740 -35.894 -22.598 1.00 42.42 C ATOM 50 NH1 ARG A 41 61.775 -35.203 -23.729 1.00 71.11 N ATOM 51 NH2 ARG A 41 61.384 -37.171 -22.616 1.00 52.30 N ATOM 0 H ARG A 41 60.277 -31.543 -17.237 1.00 63.04 H new ATOM 0 HA ARG A 41 62.253 -31.743 -19.279 1.00 64.14 H new ATOM 0 HB2 ARG A 41 60.656 -33.841 -19.526 1.00 21.30 H new ATOM 0 HB3 ARG A 41 59.526 -32.670 -20.176 1.00 21.30 H new ATOM 0 HG2 ARG A 41 60.555 -33.318 -22.127 1.00 24.14 H new ATOM 0 HG3 ARG A 41 61.596 -31.976 -21.694 1.00 24.14 H new ATOM 0 HD2 ARG A 41 63.146 -33.664 -22.152 1.00 51.20 H new ATOM 0 HD3 ARG A 41 63.009 -33.760 -20.408 1.00 51.20 H new ATOM 0 HE ARG A 41 62.022 -35.868 -20.596 1.00 52.54 H new ATOM 0 HH11 ARG A 41 62.048 -34.220 -23.718 1.00 71.11 H new ATOM 0 HH12 ARG A 41 61.529 -35.654 -24.610 1.00 71.11 H new ATOM 0 HH21 ARG A 41 61.356 -37.705 -21.747 1.00 52.30 H new ATOM 0 HH22 ARG A 41 61.138 -37.620 -23.499 1.00 52.30 H new ATOM 62 N LYS A 42 61.264 -29.668 -20.271 1.00 34.41 N ATOM 63 CA LYS A 42 60.791 -28.349 -20.670 1.00 73.40 C ATOM 64 C LYS A 42 59.437 -28.444 -21.365 1.00 45.21 C ATOM 65 O LYS A 42 59.293 -29.130 -22.377 1.00 41.01 O ATOM 66 CB LYS A 42 61.806 -27.679 -21.599 1.00 14.20 C ATOM 67 CG LYS A 42 63.208 -27.606 -21.017 1.00 43.30 C ATOM 68 CD LYS A 42 64.126 -26.759 -21.881 1.00 24.20 C ATOM 69 CE LYS A 42 64.757 -27.580 -22.995 1.00 71.22 C ATOM 70 NZ LYS A 42 63.796 -27.844 -24.102 1.00 63.40 N ATOM 0 H LYS A 42 62.162 -29.933 -20.675 1.00 34.41 H new ATOM 0 HA LYS A 42 60.677 -27.745 -19.770 1.00 73.40 H new ATOM 0 HB2 LYS A 42 61.841 -28.227 -22.541 1.00 14.20 H new ATOM 0 HB3 LYS A 42 61.464 -26.670 -21.829 1.00 14.20 H new ATOM 0 HG2 LYS A 42 63.164 -27.187 -20.012 1.00 43.30 H new ATOM 0 HG3 LYS A 42 63.618 -28.612 -20.926 1.00 43.30 H new ATOM 0 HD2 LYS A 42 63.561 -25.932 -22.312 1.00 24.20 H new ATOM 0 HD3 LYS A 42 64.909 -26.322 -21.262 1.00 24.20 H new ATOM 0 HE2 LYS A 42 65.627 -27.053 -23.387 1.00 71.22 H new ATOM 0 HE3 LYS A 42 65.114 -28.527 -22.591 1.00 71.22 H new ATOM 0 HZ1 LYS A 42 64.303 -27.842 -25.010 1.00 63.40 H new ATOM 0 HZ2 LYS A 42 63.347 -28.771 -23.958 1.00 63.40 H new ATOM 0 HZ3 LYS A 42 63.066 -27.103 -24.112 1.00 63.40 H new ATOM 80 N LYS A 43 58.445 -27.750 -20.816 1.00 1.42 N ATOM 81 CA LYS A 43 57.102 -27.754 -21.383 1.00 60.33 C ATOM 82 C LYS A 43 57.126 -27.308 -22.841 1.00 63.20 C ATOM 83 O LYS A 43 56.936 -28.114 -23.751 1.00 62.31 O ATOM 84 CB LYS A 43 56.182 -26.837 -20.573 1.00 1.41 C ATOM 85 CG LYS A 43 55.624 -27.489 -19.320 1.00 64.10 C ATOM 86 CD LYS A 43 56.620 -27.436 -18.174 1.00 4.31 C ATOM 87 CE LYS A 43 56.105 -28.183 -16.952 1.00 64.23 C ATOM 88 NZ LYS A 43 55.229 -27.325 -16.107 1.00 21.52 N ATOM 0 H LYS A 43 58.547 -27.177 -19.978 1.00 1.42 H new ATOM 0 HA LYS A 43 56.719 -28.774 -21.340 1.00 60.33 H new ATOM 0 HB2 LYS A 43 56.734 -25.940 -20.291 1.00 1.41 H new ATOM 0 HB3 LYS A 43 55.354 -26.516 -21.205 1.00 1.41 H new ATOM 0 HG2 LYS A 43 54.703 -26.986 -19.026 1.00 64.10 H new ATOM 0 HG3 LYS A 43 55.367 -28.527 -19.532 1.00 64.10 H new ATOM 0 HD2 LYS A 43 57.568 -27.869 -18.494 1.00 4.31 H new ATOM 0 HD3 LYS A 43 56.818 -26.397 -17.910 1.00 4.31 H new ATOM 0 HE2 LYS A 43 55.550 -29.065 -17.272 1.00 64.23 H new ATOM 0 HE3 LYS A 43 56.949 -28.536 -16.359 1.00 64.23 H new ATOM 0 HZ1 LYS A 43 54.898 -27.870 -15.285 1.00 21.52 H new ATOM 0 HZ2 LYS A 43 55.766 -26.496 -15.780 1.00 21.52 H new ATOM 0 HZ3 LYS A 43 54.410 -27.009 -16.665 1.00 21.52 H new ATOM 98 N GLY A 44 57.363 -26.016 -23.057 1.00 14.23 N ATOM 99 CA GLY A 44 57.410 -25.487 -24.407 1.00 45.32 C ATOM 100 C GLY A 44 56.718 -24.142 -24.526 1.00 13.33 C ATOM 101 O GLY A 44 56.637 -23.389 -23.556 1.00 11.12 O ATOM 0 H GLY A 44 57.523 -25.328 -22.321 1.00 14.23 H new ATOM 0 HA2 GLY A 44 58.450 -25.386 -24.719 1.00 45.32 H new ATOM 0 HA3 GLY A 44 56.940 -26.196 -25.089 1.00 45.32 H new ATOM 105 N LYS A 45 56.218 -23.840 -25.719 1.00 14.40 N ATOM 106 CA LYS A 45 55.530 -22.578 -25.964 1.00 12.43 C ATOM 107 C LYS A 45 54.906 -22.559 -27.356 1.00 24.43 C ATOM 108 O LYS A 45 55.455 -23.123 -28.301 1.00 12.15 O ATOM 109 CB LYS A 45 56.502 -21.406 -25.813 1.00 70.51 C ATOM 110 CG LYS A 45 57.680 -21.465 -26.771 1.00 60.12 C ATOM 111 CD LYS A 45 58.849 -22.227 -26.171 1.00 24.23 C ATOM 112 CE LYS A 45 60.133 -21.982 -26.949 1.00 4.20 C ATOM 113 NZ LYS A 45 61.311 -22.602 -26.283 1.00 74.10 N ATOM 0 H LYS A 45 56.276 -24.453 -26.532 1.00 14.40 H new ATOM 0 HA LYS A 45 54.733 -22.479 -25.227 1.00 12.43 H new ATOM 0 HB2 LYS A 45 55.961 -20.473 -25.973 1.00 70.51 H new ATOM 0 HB3 LYS A 45 56.877 -21.386 -24.790 1.00 70.51 H new ATOM 0 HG2 LYS A 45 57.371 -21.944 -27.700 1.00 60.12 H new ATOM 0 HG3 LYS A 45 57.996 -20.453 -27.024 1.00 60.12 H new ATOM 0 HD2 LYS A 45 58.988 -21.924 -25.133 1.00 24.23 H new ATOM 0 HD3 LYS A 45 58.624 -23.294 -26.164 1.00 24.23 H new ATOM 0 HE2 LYS A 45 60.030 -22.386 -27.956 1.00 4.20 H new ATOM 0 HE3 LYS A 45 60.297 -20.909 -27.052 1.00 4.20 H new ATOM 0 HZ1 LYS A 45 62.166 -22.413 -26.844 1.00 74.10 H new ATOM 0 HZ2 LYS A 45 61.424 -22.198 -25.331 1.00 74.10 H new ATOM 0 HZ3 LYS A 45 61.167 -23.629 -26.208 1.00 74.10 H new ATOM 123 N GLY A 46 53.755 -21.905 -27.474 1.00 64.24 N ATOM 124 CA GLY A 46 53.076 -21.823 -28.755 1.00 70.31 C ATOM 125 C GLY A 46 52.588 -20.421 -29.064 1.00 33.54 C ATOM 126 O GLY A 46 52.619 -19.541 -28.204 1.00 1.22 O ATOM 0 H GLY A 46 53.280 -21.430 -26.706 1.00 64.24 H new ATOM 0 HA2 GLY A 46 53.754 -22.151 -29.543 1.00 70.31 H new ATOM 0 HA3 GLY A 46 52.228 -22.508 -28.758 1.00 70.31 H new ATOM 130 N LYS A 47 52.138 -20.212 -30.297 1.00 4.31 N ATOM 131 CA LYS A 47 51.640 -18.908 -30.719 1.00 34.11 C ATOM 132 C LYS A 47 50.250 -19.030 -31.335 1.00 73.35 C ATOM 133 O LYS A 47 50.111 -19.329 -32.521 1.00 13.52 O ATOM 134 CB LYS A 47 52.603 -18.275 -31.725 1.00 61.13 C ATOM 135 CG LYS A 47 53.949 -17.903 -31.128 1.00 70.40 C ATOM 136 CD LYS A 47 53.840 -16.693 -30.216 1.00 64.34 C ATOM 137 CE LYS A 47 55.169 -16.377 -29.547 1.00 74.43 C ATOM 138 NZ LYS A 47 55.147 -15.053 -28.867 1.00 61.41 N ATOM 0 H LYS A 47 52.108 -20.929 -31.022 1.00 4.31 H new ATOM 0 HA LYS A 47 51.572 -18.269 -29.839 1.00 34.11 H new ATOM 0 HB2 LYS A 47 52.761 -18.969 -32.551 1.00 61.13 H new ATOM 0 HB3 LYS A 47 52.141 -17.381 -32.144 1.00 61.13 H new ATOM 0 HG2 LYS A 47 54.345 -18.749 -30.566 1.00 70.40 H new ATOM 0 HG3 LYS A 47 54.658 -17.693 -31.929 1.00 70.40 H new ATOM 0 HD2 LYS A 47 53.508 -15.830 -30.793 1.00 64.34 H new ATOM 0 HD3 LYS A 47 53.083 -16.878 -29.454 1.00 64.34 H new ATOM 0 HE2 LYS A 47 55.404 -17.155 -28.820 1.00 74.43 H new ATOM 0 HE3 LYS A 47 55.963 -16.389 -30.294 1.00 74.43 H new ATOM 0 HZ1 LYS A 47 56.071 -14.875 -28.424 1.00 61.41 H new ATOM 0 HZ2 LYS A 47 54.948 -14.308 -29.565 1.00 61.41 H new ATOM 0 HZ3 LYS A 47 54.406 -15.050 -28.137 1.00 61.41 H new ATOM 148 N GLY A 48 49.224 -18.793 -30.523 1.00 13.00 N ATOM 149 CA GLY A 48 47.859 -18.880 -31.008 1.00 32.53 C ATOM 150 C GLY A 48 46.846 -18.450 -29.966 1.00 52.23 C ATOM 151 O GLY A 48 46.840 -18.962 -28.846 1.00 40.24 O ATOM 0 H GLY A 48 49.314 -18.542 -29.538 1.00 13.00 H new ATOM 0 HA2 GLY A 48 47.751 -18.255 -31.895 1.00 32.53 H new ATOM 0 HA3 GLY A 48 47.649 -19.905 -31.313 1.00 32.53 H new ATOM 155 N THR A 49 45.985 -17.505 -30.334 1.00 12.42 N ATOM 156 CA THR A 49 44.965 -17.005 -29.422 1.00 1.32 C ATOM 157 C THR A 49 43.576 -17.113 -30.039 1.00 44.54 C ATOM 158 O THR A 49 43.415 -17.017 -31.256 1.00 14.10 O ATOM 159 CB THR A 49 45.228 -15.539 -29.033 1.00 21.43 C ATOM 160 OG1 THR A 49 46.636 -15.278 -29.032 1.00 73.43 O ATOM 161 CG2 THR A 49 44.650 -15.229 -27.660 1.00 53.52 C ATOM 0 H THR A 49 45.975 -17.071 -31.257 1.00 12.42 H new ATOM 0 HA THR A 49 45.012 -17.624 -28.526 1.00 1.32 H new ATOM 0 HB THR A 49 44.739 -14.899 -29.768 1.00 21.43 H new ATOM 0 HG1 THR A 49 46.795 -14.343 -28.785 1.00 73.43 H new ATOM 0 HG21 THR A 49 44.849 -14.187 -27.408 1.00 53.52 H new ATOM 0 HG22 THR A 49 43.574 -15.400 -27.671 1.00 53.52 H new ATOM 0 HG23 THR A 49 45.113 -15.877 -26.916 1.00 53.52 H new ATOM 169 N THR A 50 42.570 -17.313 -29.192 1.00 62.42 N ATOM 170 CA THR A 50 41.193 -17.434 -29.656 1.00 22.54 C ATOM 171 C THR A 50 40.295 -16.399 -28.986 1.00 14.33 C ATOM 172 O THR A 50 40.702 -15.730 -28.037 1.00 1.12 O ATOM 173 CB THR A 50 40.630 -18.841 -29.380 1.00 2.02 C ATOM 174 OG1 THR A 50 41.145 -19.342 -28.141 1.00 63.34 O ATOM 175 CG2 THR A 50 40.988 -19.797 -30.508 1.00 13.43 C ATOM 0 H THR A 50 42.683 -17.395 -28.182 1.00 62.42 H new ATOM 0 HA THR A 50 41.204 -17.260 -30.732 1.00 22.54 H new ATOM 0 HB THR A 50 39.544 -18.768 -29.317 1.00 2.02 H new ATOM 0 HG1 THR A 50 40.780 -20.236 -27.973 1.00 63.34 H new ATOM 0 HG21 THR A 50 40.580 -20.784 -30.291 1.00 13.43 H new ATOM 0 HG22 THR A 50 40.569 -19.428 -31.444 1.00 13.43 H new ATOM 0 HG23 THR A 50 42.072 -19.864 -30.598 1.00 13.43 H new ATOM 183 N VAL A 51 39.070 -16.275 -29.487 1.00 22.33 N ATOM 184 CA VAL A 51 38.112 -15.322 -28.936 1.00 73.41 C ATOM 185 C VAL A 51 36.858 -16.030 -28.438 1.00 54.20 C ATOM 186 O VAL A 51 36.320 -15.695 -27.384 1.00 33.11 O ATOM 187 CB VAL A 51 37.712 -14.263 -29.979 1.00 62.15 C ATOM 188 CG1 VAL A 51 38.870 -13.315 -30.251 1.00 4.22 C ATOM 189 CG2 VAL A 51 37.245 -14.931 -31.264 1.00 70.45 C ATOM 0 H VAL A 51 38.717 -16.822 -30.273 1.00 22.33 H new ATOM 0 HA VAL A 51 38.603 -14.827 -28.098 1.00 73.41 H new ATOM 0 HB VAL A 51 36.884 -13.679 -29.578 1.00 62.15 H new ATOM 0 HG11 VAL A 51 38.567 -12.574 -30.991 1.00 4.22 H new ATOM 0 HG12 VAL A 51 39.152 -12.811 -29.327 1.00 4.22 H new ATOM 0 HG13 VAL A 51 39.721 -13.880 -30.631 1.00 4.22 H new ATOM 0 HG21 VAL A 51 36.966 -14.168 -31.990 1.00 70.45 H new ATOM 0 HG22 VAL A 51 38.051 -15.541 -31.671 1.00 70.45 H new ATOM 0 HG23 VAL A 51 36.383 -15.563 -31.053 1.00 70.45 H new ATOM 199 N GLY A 52 36.396 -17.013 -29.205 1.00 13.15 N ATOM 200 CA GLY A 52 35.207 -17.754 -28.825 1.00 53.11 C ATOM 201 C GLY A 52 34.189 -17.830 -29.945 1.00 41.22 C ATOM 202 O GLY A 52 34.007 -16.871 -30.694 1.00 35.11 O ATOM 0 H GLY A 52 36.824 -17.309 -30.082 1.00 13.15 H new ATOM 0 HA2 GLY A 52 35.491 -18.763 -28.527 1.00 53.11 H new ATOM 0 HA3 GLY A 52 34.751 -17.282 -27.955 1.00 53.11 H new ATOM 206 N MET A 53 33.523 -18.975 -30.061 1.00 53.21 N ATOM 207 CA MET A 53 32.519 -19.172 -31.099 1.00 45.32 C ATOM 208 C MET A 53 31.273 -19.844 -30.529 1.00 70.25 C ATOM 209 O MET A 53 31.348 -20.584 -29.550 1.00 34.45 O ATOM 210 CB MET A 53 33.090 -20.016 -32.239 1.00 74.14 C ATOM 211 CG MET A 53 33.484 -21.422 -31.817 1.00 33.34 C ATOM 212 SD MET A 53 35.198 -21.528 -31.268 1.00 1.01 S ATOM 213 CE MET A 53 35.187 -23.107 -30.424 1.00 25.13 C ATOM 0 H MET A 53 33.661 -19.779 -29.449 1.00 53.21 H new ATOM 0 HA MET A 53 32.238 -18.193 -31.487 1.00 45.32 H new ATOM 0 HB2 MET A 53 32.352 -20.079 -33.038 1.00 74.14 H new ATOM 0 HB3 MET A 53 33.964 -19.511 -32.651 1.00 74.14 H new ATOM 0 HG2 MET A 53 32.828 -21.753 -31.012 1.00 33.34 H new ATOM 0 HG3 MET A 53 33.332 -22.104 -32.653 1.00 33.34 H new ATOM 0 HE1 MET A 53 36.181 -23.314 -30.027 1.00 25.13 H new ATOM 0 HE2 MET A 53 34.468 -23.077 -29.605 1.00 25.13 H new ATOM 0 HE3 MET A 53 34.905 -23.892 -31.125 1.00 25.13 H new ATOM 221 N GLY A 54 30.127 -19.579 -31.149 1.00 40.11 N ATOM 222 CA GLY A 54 28.881 -20.166 -30.689 1.00 64.33 C ATOM 223 C GLY A 54 28.123 -19.250 -29.748 1.00 40.23 C ATOM 224 O GLY A 54 28.572 -18.980 -28.635 1.00 2.32 O ATOM 0 H GLY A 54 30.039 -18.969 -31.961 1.00 40.11 H new ATOM 0 HA2 GLY A 54 28.253 -20.399 -31.549 1.00 64.33 H new ATOM 0 HA3 GLY A 54 29.091 -21.108 -30.183 1.00 64.33 H new ATOM 266 N ARG A 58 19.234 -17.392 -23.393 1.00 14.34 N ATOM 267 CA ARG A 58 18.254 -18.061 -22.546 1.00 52.44 C ATOM 268 C ARG A 58 17.444 -17.045 -21.746 1.00 32.30 C ATOM 269 O ARG A 58 17.981 -16.047 -21.267 1.00 74.15 O ATOM 270 CB ARG A 58 18.950 -19.037 -21.596 1.00 74.21 C ATOM 271 CG ARG A 58 19.851 -20.037 -22.302 1.00 72.55 C ATOM 272 CD ARG A 58 20.280 -21.157 -21.368 1.00 61.41 C ATOM 273 NE ARG A 58 19.171 -22.047 -21.034 1.00 70.25 N ATOM 274 CZ ARG A 58 19.332 -23.268 -20.538 1.00 31.31 C ATOM 275 NH1 ARG A 58 20.551 -23.742 -20.317 1.00 5.54 N ATOM 276 NH2 ARG A 58 18.274 -24.018 -20.260 1.00 25.31 N ATOM 0 HA ARG A 58 17.573 -18.617 -23.191 1.00 52.44 H new ATOM 0 HB2 ARG A 58 19.543 -18.471 -20.878 1.00 74.21 H new ATOM 0 HB3 ARG A 58 18.194 -19.580 -21.028 1.00 74.21 H new ATOM 0 HG2 ARG A 58 19.327 -20.458 -23.160 1.00 72.55 H new ATOM 0 HG3 ARG A 58 20.733 -19.525 -22.687 1.00 72.55 H new ATOM 0 HD2 ARG A 58 21.079 -21.733 -21.836 1.00 61.41 H new ATOM 0 HD3 ARG A 58 20.689 -20.729 -20.453 1.00 61.41 H new ATOM 0 HE ARG A 58 18.220 -21.712 -21.190 1.00 70.25 H new ATOM 0 HH11 ARG A 58 21.367 -23.168 -20.528 1.00 5.54 H new ATOM 0 HH12 ARG A 58 20.672 -24.680 -19.936 1.00 5.54 H new ATOM 0 HH21 ARG A 58 17.335 -23.657 -20.427 1.00 25.31 H new ATOM 0 HH22 ARG A 58 18.400 -24.956 -19.879 1.00 25.31 H new ATOM 287 N ARG A 59 16.148 -17.308 -21.606 1.00 31.31 N ATOM 288 CA ARG A 59 15.264 -16.416 -20.865 1.00 74.31 C ATOM 289 C ARG A 59 14.224 -17.210 -20.082 1.00 5.14 C ATOM 290 O ARG A 59 13.392 -17.907 -20.663 1.00 20.42 O ATOM 291 CB ARG A 59 14.567 -15.445 -21.821 1.00 14.33 C ATOM 292 CG ARG A 59 14.065 -14.180 -21.144 1.00 42.31 C ATOM 293 CD ARG A 59 15.213 -13.345 -20.600 1.00 11.24 C ATOM 294 NE ARG A 59 14.870 -11.928 -20.519 1.00 11.44 N ATOM 295 CZ ARG A 59 15.757 -10.969 -20.280 1.00 21.14 C ATOM 296 NH1 ARG A 59 17.035 -11.274 -20.100 1.00 51.13 N ATOM 297 NH2 ARG A 59 15.366 -9.702 -20.220 1.00 75.23 N ATOM 0 H ARG A 59 15.688 -18.131 -21.996 1.00 31.31 H new ATOM 0 HA ARG A 59 15.870 -15.848 -20.159 1.00 74.31 H new ATOM 0 HB2 ARG A 59 15.260 -15.171 -22.616 1.00 14.33 H new ATOM 0 HB3 ARG A 59 13.726 -15.953 -22.292 1.00 14.33 H new ATOM 0 HG2 ARG A 59 13.490 -13.589 -21.856 1.00 42.31 H new ATOM 0 HG3 ARG A 59 13.389 -14.445 -20.331 1.00 42.31 H new ATOM 0 HD2 ARG A 59 15.488 -13.708 -19.610 1.00 11.24 H new ATOM 0 HD3 ARG A 59 16.087 -13.470 -21.239 1.00 11.24 H new ATOM 0 HE ARG A 59 13.895 -11.660 -20.653 1.00 11.44 H new ATOM 0 HH11 ARG A 59 17.338 -12.247 -20.145 1.00 51.13 H new ATOM 0 HH12 ARG A 59 17.715 -10.536 -19.917 1.00 51.13 H new ATOM 0 HH21 ARG A 59 14.384 -9.464 -20.357 1.00 75.23 H new ATOM 0 HH22 ARG A 59 16.048 -8.966 -20.036 1.00 75.23 H new ATOM 308 N PHE A 60 14.277 -17.100 -18.758 1.00 44.42 N ATOM 309 CA PHE A 60 13.339 -17.808 -17.895 1.00 20.14 C ATOM 310 C PHE A 60 13.221 -17.119 -16.538 1.00 63.42 C ATOM 311 O PHE A 60 14.141 -16.426 -16.100 1.00 54.23 O ATOM 312 CB PHE A 60 13.786 -19.260 -17.703 1.00 72.44 C ATOM 313 CG PHE A 60 15.032 -19.399 -16.877 1.00 23.42 C ATOM 314 CD1 PHE A 60 14.961 -19.829 -15.561 1.00 11.23 C ATOM 315 CD2 PHE A 60 16.273 -19.101 -17.414 1.00 33.22 C ATOM 316 CE1 PHE A 60 16.106 -19.958 -14.798 1.00 2.41 C ATOM 317 CE2 PHE A 60 17.422 -19.228 -16.655 1.00 73.22 C ATOM 318 CZ PHE A 60 17.338 -19.659 -15.346 1.00 2.22 C ATOM 0 H PHE A 60 14.959 -16.528 -18.260 1.00 44.42 H new ATOM 0 HA PHE A 60 12.361 -17.795 -18.377 1.00 20.14 H new ATOM 0 HB2 PHE A 60 12.980 -19.820 -17.228 1.00 72.44 H new ATOM 0 HB3 PHE A 60 13.955 -19.712 -18.680 1.00 72.44 H new ATOM 0 HD1 PHE A 60 14.001 -20.066 -15.127 1.00 11.23 H new ATOM 0 HD2 PHE A 60 16.344 -18.765 -18.438 1.00 33.22 H new ATOM 0 HE1 PHE A 60 16.037 -20.293 -13.773 1.00 2.41 H new ATOM 0 HE2 PHE A 60 18.384 -18.990 -17.086 1.00 73.22 H new ATOM 0 HZ PHE A 60 18.234 -19.762 -14.752 1.00 2.22 H new ATOM 327 N ILE A 61 12.084 -17.311 -15.879 1.00 52.43 N ATOM 328 CA ILE A 61 11.846 -16.709 -14.574 1.00 4.30 C ATOM 329 C ILE A 61 10.772 -17.472 -13.804 1.00 71.35 C ATOM 330 O ILE A 61 9.730 -17.823 -14.356 1.00 21.34 O ATOM 331 CB ILE A 61 11.418 -15.235 -14.704 1.00 71.22 C ATOM 332 CG1 ILE A 61 11.375 -14.571 -13.326 1.00 43.40 C ATOM 333 CG2 ILE A 61 10.064 -15.134 -15.391 1.00 62.41 C ATOM 334 CD1 ILE A 61 11.646 -13.083 -13.364 1.00 12.50 C ATOM 0 H ILE A 61 11.312 -17.879 -16.228 1.00 52.43 H new ATOM 0 HA ILE A 61 12.787 -16.759 -14.027 1.00 4.30 H new ATOM 0 HB ILE A 61 12.152 -14.711 -15.316 1.00 71.22 H new ATOM 0 HG12 ILE A 61 10.396 -14.743 -12.879 1.00 43.40 H new ATOM 0 HG13 ILE A 61 12.109 -15.050 -12.678 1.00 43.40 H new ATOM 0 HG21 ILE A 61 9.776 -14.086 -15.475 1.00 62.41 H new ATOM 0 HG22 ILE A 61 10.127 -15.574 -16.386 1.00 62.41 H new ATOM 0 HG23 ILE A 61 9.318 -15.670 -14.804 1.00 62.41 H new ATOM 0 HD11 ILE A 61 11.600 -12.679 -12.353 1.00 12.50 H new ATOM 0 HD12 ILE A 61 12.637 -12.904 -13.781 1.00 12.50 H new ATOM 0 HD13 ILE A 61 10.897 -12.592 -13.986 1.00 12.50 H new ATOM 345 N ASN A 62 11.035 -17.723 -12.526 1.00 64.21 N ATOM 346 CA ASN A 62 10.090 -18.442 -11.679 1.00 13.02 C ATOM 347 C ASN A 62 10.159 -17.941 -10.240 1.00 23.30 C ATOM 348 O ASN A 62 11.243 -17.730 -9.696 1.00 73.53 O ATOM 349 CB ASN A 62 10.377 -19.944 -11.722 1.00 12.20 C ATOM 350 CG ASN A 62 9.261 -20.764 -11.105 1.00 42.13 C ATOM 351 OD1 ASN A 62 8.246 -20.221 -10.667 1.00 11.30 O ATOM 352 ND2 ASN A 62 9.444 -22.079 -11.068 1.00 45.30 N ATOM 0 H ASN A 62 11.894 -17.440 -12.054 1.00 64.21 H new ATOM 0 HA ASN A 62 9.086 -18.259 -12.061 1.00 13.02 H new ATOM 0 HB2 ASN A 62 10.522 -20.254 -12.757 1.00 12.20 H new ATOM 0 HB3 ASN A 62 11.309 -20.148 -11.194 1.00 12.20 H new ATOM 0 HD21 ASN A 62 8.727 -22.682 -10.665 1.00 45.30 H new ATOM 0 HD22 ASN A 62 10.301 -22.485 -11.443 1.00 45.30 H new ATOM 358 N MET A 63 8.994 -17.753 -9.628 1.00 12.13 N ATOM 359 CA MET A 63 8.922 -17.279 -8.250 1.00 74.12 C ATOM 360 C MET A 63 7.984 -18.152 -7.423 1.00 74.44 C ATOM 361 O MET A 63 6.829 -18.363 -7.793 1.00 64.34 O ATOM 362 CB MET A 63 8.450 -15.825 -8.214 1.00 2.11 C ATOM 363 CG MET A 63 9.553 -14.820 -8.507 1.00 52.34 C ATOM 364 SD MET A 63 10.656 -14.570 -7.104 1.00 70.34 S ATOM 365 CE MET A 63 11.963 -13.612 -7.868 1.00 43.01 C ATOM 0 H MET A 63 8.087 -17.921 -10.064 1.00 12.13 H new ATOM 0 HA MET A 63 9.921 -17.340 -7.818 1.00 74.12 H new ATOM 0 HB2 MET A 63 7.648 -15.694 -8.940 1.00 2.11 H new ATOM 0 HB3 MET A 63 8.028 -15.613 -7.232 1.00 2.11 H new ATOM 0 HG2 MET A 63 10.133 -15.163 -9.364 1.00 52.34 H new ATOM 0 HG3 MET A 63 9.105 -13.866 -8.786 1.00 52.34 H new ATOM 0 HE1 MET A 63 12.725 -13.378 -7.124 1.00 43.01 H new ATOM 0 HE2 MET A 63 12.411 -14.188 -8.677 1.00 43.01 H new ATOM 0 HE3 MET A 63 11.549 -12.686 -8.268 1.00 43.01 H new ATOM 373 N TYR A 64 8.488 -18.657 -6.303 1.00 20.12 N ATOM 374 CA TYR A 64 7.695 -19.509 -5.424 1.00 33.14 C ATOM 375 C TYR A 64 6.467 -18.766 -4.907 1.00 32.41 C ATOM 376 O TYR A 64 6.420 -17.537 -4.921 1.00 64.23 O ATOM 377 CB TYR A 64 8.544 -19.995 -4.247 1.00 62.14 C ATOM 378 CG TYR A 64 9.478 -21.129 -4.602 1.00 55.01 C ATOM 379 CD1 TYR A 64 10.841 -21.039 -4.347 1.00 25.22 C ATOM 380 CD2 TYR A 64 8.999 -22.292 -5.193 1.00 45.14 C ATOM 381 CE1 TYR A 64 11.698 -22.073 -4.670 1.00 62.45 C ATOM 382 CE2 TYR A 64 9.848 -23.331 -5.518 1.00 42.41 C ATOM 383 CZ TYR A 64 11.197 -23.217 -5.255 1.00 45.10 C ATOM 384 OH TYR A 64 12.047 -24.249 -5.578 1.00 14.14 O ATOM 0 H TYR A 64 9.442 -18.491 -5.982 1.00 20.12 H new ATOM 0 HA TYR A 64 7.360 -20.370 -6.002 1.00 33.14 H new ATOM 0 HB2 TYR A 64 9.130 -19.160 -3.863 1.00 62.14 H new ATOM 0 HB3 TYR A 64 7.883 -20.318 -3.442 1.00 62.14 H new ATOM 0 HD1 TYR A 64 11.237 -20.145 -3.888 1.00 25.22 H new ATOM 0 HD2 TYR A 64 7.943 -22.385 -5.402 1.00 45.14 H new ATOM 0 HE1 TYR A 64 12.755 -21.986 -4.465 1.00 62.45 H new ATOM 0 HE2 TYR A 64 9.458 -24.228 -5.976 1.00 42.41 H new ATOM 0 HH TYR A 64 11.535 -24.981 -5.981 1.00 14.14 H new ATOM 393 N GLY A 65 5.474 -19.523 -4.451 1.00 12.33 N ATOM 394 CA GLY A 65 4.259 -18.921 -3.935 1.00 4.34 C ATOM 395 C GLY A 65 3.630 -19.741 -2.826 1.00 52.21 C ATOM 396 O GLY A 65 3.397 -20.939 -2.987 1.00 14.52 O ATOM 0 H GLY A 65 5.489 -20.543 -4.430 1.00 12.33 H new ATOM 0 HA2 GLY A 65 4.483 -17.922 -3.561 1.00 4.34 H new ATOM 0 HA3 GLY A 65 3.542 -18.804 -4.748 1.00 4.34 H new ATOM 400 N PHE A 66 3.357 -19.097 -1.697 1.00 74.31 N ATOM 401 CA PHE A 66 2.755 -19.776 -0.555 1.00 64.54 C ATOM 402 C PHE A 66 1.603 -18.956 0.018 1.00 5.04 C ATOM 403 O PHE A 66 1.719 -17.744 0.201 1.00 71.44 O ATOM 404 CB PHE A 66 3.806 -20.026 0.528 1.00 11.44 C ATOM 405 CG PHE A 66 3.333 -20.944 1.620 1.00 72.31 C ATOM 406 CD1 PHE A 66 3.102 -20.461 2.898 1.00 73.11 C ATOM 407 CD2 PHE A 66 3.122 -22.290 1.368 1.00 44.52 C ATOM 408 CE1 PHE A 66 2.667 -21.302 3.905 1.00 55.24 C ATOM 409 CE2 PHE A 66 2.686 -23.136 2.371 1.00 54.44 C ATOM 410 CZ PHE A 66 2.459 -22.642 3.640 1.00 30.32 C ATOM 0 H PHE A 66 3.543 -18.105 -1.548 1.00 74.31 H new ATOM 0 HA PHE A 66 2.362 -20.733 -0.898 1.00 64.54 H new ATOM 0 HB2 PHE A 66 4.697 -20.451 0.067 1.00 11.44 H new ATOM 0 HB3 PHE A 66 4.098 -19.072 0.967 1.00 11.44 H new ATOM 0 HD1 PHE A 66 3.264 -19.414 3.110 1.00 73.11 H new ATOM 0 HD2 PHE A 66 3.300 -22.683 0.378 1.00 44.52 H new ATOM 0 HE1 PHE A 66 2.490 -20.913 4.897 1.00 55.24 H new ATOM 0 HE2 PHE A 66 2.523 -24.183 2.162 1.00 54.44 H new ATOM 0 HZ PHE A 66 2.119 -23.302 4.424 1.00 30.32 H new ATOM 419 N ASP A 67 0.491 -19.626 0.299 1.00 64.02 N ATOM 420 CA ASP A 67 -0.684 -18.961 0.852 1.00 12.45 C ATOM 421 C ASP A 67 -0.441 -18.546 2.300 1.00 32.11 C ATOM 422 O ASP A 67 0.390 -19.117 3.005 1.00 75.12 O ATOM 423 CB ASP A 67 -1.903 -19.881 0.770 1.00 22.24 C ATOM 424 CG ASP A 67 -2.024 -20.791 1.977 1.00 61.13 C ATOM 425 OD1 ASP A 67 -2.939 -20.569 2.798 1.00 12.10 O ATOM 426 OD2 ASP A 67 -1.205 -21.725 2.101 1.00 61.42 O ATOM 0 H ASP A 67 0.378 -20.629 0.153 1.00 64.02 H new ATOM 0 HA ASP A 67 -0.875 -18.064 0.262 1.00 12.45 H new ATOM 0 HB2 ASP A 67 -2.806 -19.276 0.683 1.00 22.24 H new ATOM 0 HB3 ASP A 67 -1.837 -20.487 -0.133 1.00 22.24 H new ATOM 430 N PRO A 68 -1.184 -17.525 2.755 1.00 13.24 N ATOM 431 CA PRO A 68 -1.067 -17.010 4.123 1.00 72.33 C ATOM 432 C PRO A 68 -1.603 -17.991 5.160 1.00 53.45 C ATOM 433 O PRO A 68 -2.102 -19.063 4.816 1.00 33.05 O ATOM 434 CB PRO A 68 -1.921 -15.740 4.097 1.00 32.13 C ATOM 435 CG PRO A 68 -2.906 -15.968 3.004 1.00 12.41 C ATOM 436 CD PRO A 68 -2.194 -16.797 1.971 1.00 2.40 C ATOM 0 HA PRO A 68 -0.029 -16.837 4.406 1.00 72.33 H new ATOM 0 HB2 PRO A 68 -2.420 -15.579 5.053 1.00 32.13 H new ATOM 0 HB3 PRO A 68 -1.312 -14.857 3.903 1.00 32.13 H new ATOM 0 HG2 PRO A 68 -3.790 -16.485 3.377 1.00 12.41 H new ATOM 0 HG3 PRO A 68 -3.244 -15.023 2.580 1.00 12.41 H new ATOM 0 HD2 PRO A 68 -2.876 -17.479 1.463 1.00 2.40 H new ATOM 0 HD3 PRO A 68 -1.735 -16.175 1.203 1.00 2.40 H new ATOM 441 N THR A 69 -1.497 -17.617 6.431 1.00 1.33 N ATOM 442 CA THR A 69 -1.971 -18.465 7.519 1.00 71.04 C ATOM 443 C THR A 69 -3.172 -17.840 8.220 1.00 52.44 C ATOM 444 O THR A 69 -4.117 -18.536 8.587 1.00 1.34 O ATOM 445 CB THR A 69 -0.861 -18.719 8.557 1.00 54.44 C ATOM 446 OG1 THR A 69 0.013 -17.588 8.627 1.00 2.21 O ATOM 447 CG2 THR A 69 -0.061 -19.964 8.198 1.00 62.52 C ATOM 0 H THR A 69 -1.087 -16.733 6.733 1.00 1.33 H new ATOM 0 HA THR A 69 -2.267 -19.415 7.074 1.00 71.04 H new ATOM 0 HB THR A 69 -1.330 -18.874 9.528 1.00 54.44 H new ATOM 0 HG1 THR A 69 0.714 -17.757 9.290 1.00 2.21 H new ATOM 0 HG21 THR A 69 0.717 -20.124 8.944 1.00 62.52 H new ATOM 0 HG22 THR A 69 -0.724 -20.828 8.174 1.00 62.52 H new ATOM 0 HG23 THR A 69 0.398 -19.832 7.218 1.00 62.52 H new ATOM 468 N TYR A 71 -5.743 -14.665 7.561 1.00 2.43 N ATOM 469 CA TYR A 71 -6.237 -13.558 6.751 1.00 30.41 C ATOM 470 C TYR A 71 -7.468 -12.921 7.389 1.00 33.33 C ATOM 471 O TYR A 71 -8.413 -12.542 6.698 1.00 31.12 O ATOM 472 CB TYR A 71 -6.572 -14.041 5.340 1.00 54.02 C ATOM 473 CG TYR A 71 -7.396 -15.309 5.313 1.00 70.34 C ATOM 474 CD1 TYR A 71 -6.788 -16.553 5.204 1.00 1.13 C ATOM 475 CD2 TYR A 71 -8.783 -15.261 5.396 1.00 32.52 C ATOM 476 CE1 TYR A 71 -7.537 -17.714 5.179 1.00 3.23 C ATOM 477 CE2 TYR A 71 -9.539 -16.417 5.373 1.00 63.04 C ATOM 478 CZ TYR A 71 -8.911 -17.640 5.265 1.00 44.33 C ATOM 479 OH TYR A 71 -9.663 -18.793 5.240 1.00 73.31 O ATOM 0 HA TYR A 71 -5.451 -12.805 6.693 1.00 30.41 H new ATOM 0 HB2 TYR A 71 -7.114 -13.254 4.815 1.00 54.02 H new ATOM 0 HB3 TYR A 71 -5.644 -14.209 4.793 1.00 54.02 H new ATOM 0 HD1 TYR A 71 -5.712 -16.614 5.138 1.00 1.13 H new ATOM 0 HD2 TYR A 71 -9.277 -14.304 5.480 1.00 32.52 H new ATOM 0 HE1 TYR A 71 -7.049 -18.674 5.093 1.00 3.23 H new ATOM 0 HE2 TYR A 71 -10.616 -16.363 5.439 1.00 63.04 H new ATOM 0 HH TYR A 71 -10.613 -18.565 5.311 1.00 73.31 H new ATOM 488 N SER A 72 -7.448 -12.808 8.714 1.00 54.53 N ATOM 489 CA SER A 72 -8.564 -12.222 9.446 1.00 22.34 C ATOM 490 C SER A 72 -8.094 -11.048 10.301 1.00 2.33 C ATOM 491 O SER A 72 -8.270 -11.043 11.521 1.00 74.14 O ATOM 492 CB SER A 72 -9.232 -13.276 10.331 1.00 71.32 C ATOM 493 OG SER A 72 -10.006 -14.175 9.556 1.00 53.11 O ATOM 0 H SER A 72 -6.672 -13.114 9.301 1.00 54.53 H new ATOM 0 HA SER A 72 -9.290 -11.855 8.721 1.00 22.34 H new ATOM 0 HB2 SER A 72 -8.471 -13.828 10.882 1.00 71.32 H new ATOM 0 HB3 SER A 72 -9.868 -12.786 11.069 1.00 71.32 H new ATOM 0 HG SER A 72 -10.910 -14.234 9.930 1.00 53.11 H new ATOM 498 N PHE A 73 -7.496 -10.055 9.653 1.00 25.31 N ATOM 499 CA PHE A 73 -6.999 -8.875 10.352 1.00 1.04 C ATOM 500 C PHE A 73 -7.377 -7.600 9.604 1.00 33.30 C ATOM 501 O PHE A 73 -7.958 -7.653 8.520 1.00 11.23 O ATOM 502 CB PHE A 73 -5.480 -8.954 10.516 1.00 71.23 C ATOM 503 CG PHE A 73 -4.730 -8.783 9.226 1.00 32.23 C ATOM 504 CD1 PHE A 73 -4.170 -7.560 8.892 1.00 44.43 C ATOM 505 CD2 PHE A 73 -4.582 -9.845 8.349 1.00 32.41 C ATOM 506 CE1 PHE A 73 -3.480 -7.400 7.705 1.00 42.13 C ATOM 507 CE2 PHE A 73 -3.892 -9.690 7.161 1.00 35.22 C ATOM 508 CZ PHE A 73 -3.339 -8.467 6.839 1.00 23.14 C ATOM 0 H PHE A 73 -7.343 -10.043 8.645 1.00 25.31 H new ATOM 0 HA PHE A 73 -7.462 -8.847 11.338 1.00 1.04 H new ATOM 0 HB2 PHE A 73 -5.158 -8.186 11.219 1.00 71.23 H new ATOM 0 HB3 PHE A 73 -5.219 -9.917 10.954 1.00 71.23 H new ATOM 0 HD1 PHE A 73 -4.274 -6.723 9.566 1.00 44.43 H new ATOM 0 HD2 PHE A 73 -5.011 -10.805 8.596 1.00 32.41 H new ATOM 0 HE1 PHE A 73 -3.051 -6.441 7.455 1.00 42.13 H new ATOM 0 HE2 PHE A 73 -3.786 -10.526 6.485 1.00 35.22 H new ATOM 0 HZ PHE A 73 -2.798 -8.345 5.913 1.00 23.14 H new ATOM 517 N ILE A 74 -7.041 -6.455 10.190 1.00 14.20 N ATOM 518 CA ILE A 74 -7.343 -5.167 9.579 1.00 31.32 C ATOM 519 C ILE A 74 -6.069 -4.461 9.125 1.00 3.45 C ATOM 520 O ILE A 74 -5.078 -4.421 9.854 1.00 51.33 O ATOM 521 CB ILE A 74 -8.108 -4.249 10.551 1.00 73.43 C ATOM 522 CG1 ILE A 74 -9.397 -4.926 11.019 1.00 43.02 C ATOM 523 CG2 ILE A 74 -8.415 -2.915 9.887 1.00 63.23 C ATOM 524 CD1 ILE A 74 -10.152 -4.132 12.062 1.00 72.01 C ATOM 0 H ILE A 74 -6.560 -6.394 11.087 1.00 14.20 H new ATOM 0 HA ILE A 74 -7.972 -5.368 8.712 1.00 31.32 H new ATOM 0 HB ILE A 74 -7.481 -4.064 11.423 1.00 73.43 H new ATOM 0 HG12 ILE A 74 -10.046 -5.089 10.158 1.00 43.02 H new ATOM 0 HG13 ILE A 74 -9.155 -5.908 11.426 1.00 43.02 H new ATOM 0 HG21 ILE A 74 -8.956 -2.277 10.586 1.00 63.23 H new ATOM 0 HG22 ILE A 74 -7.483 -2.429 9.599 1.00 63.23 H new ATOM 0 HG23 ILE A 74 -9.027 -3.082 9.000 1.00 63.23 H new ATOM 0 HD11 ILE A 74 -11.055 -4.672 12.347 1.00 72.01 H new ATOM 0 HD12 ILE A 74 -9.521 -3.991 12.939 1.00 72.01 H new ATOM 0 HD13 ILE A 74 -10.425 -3.160 11.652 1.00 72.01 H new ATOM 535 N GLN A 75 -6.106 -3.906 7.919 1.00 22.41 N ATOM 536 CA GLN A 75 -4.954 -3.200 7.370 1.00 52.23 C ATOM 537 C GLN A 75 -5.131 -1.690 7.491 1.00 45.34 C ATOM 538 O GLN A 75 -5.932 -1.089 6.773 1.00 13.14 O ATOM 539 CB GLN A 75 -4.745 -3.584 5.904 1.00 53.54 C ATOM 540 CG GLN A 75 -3.535 -2.922 5.267 1.00 34.41 C ATOM 541 CD GLN A 75 -3.175 -3.529 3.925 1.00 63.12 C ATOM 542 OE1 GLN A 75 -3.772 -3.195 2.900 1.00 1.14 O ATOM 543 NE2 GLN A 75 -2.196 -4.426 3.922 1.00 3.03 N ATOM 0 H GLN A 75 -6.919 -3.931 7.304 1.00 22.41 H new ATOM 0 HA GLN A 75 -4.075 -3.491 7.944 1.00 52.23 H new ATOM 0 HB2 GLN A 75 -4.636 -4.666 5.833 1.00 53.54 H new ATOM 0 HB3 GLN A 75 -5.636 -3.316 5.336 1.00 53.54 H new ATOM 0 HG2 GLN A 75 -3.734 -1.858 5.138 1.00 34.41 H new ATOM 0 HG3 GLN A 75 -2.682 -3.008 5.941 1.00 34.41 H new ATOM 0 HE21 GLN A 75 -1.728 -4.673 4.794 1.00 3.03 H new ATOM 0 HE22 GLN A 75 -1.912 -4.868 3.048 1.00 3.03 H new ATOM 550 N PHE A 76 -4.381 -1.083 8.403 1.00 65.31 N ATOM 551 CA PHE A 76 -4.457 0.358 8.619 1.00 32.44 C ATOM 552 C PHE A 76 -3.540 1.102 7.653 1.00 22.52 C ATOM 553 O PHE A 76 -2.366 0.760 7.505 1.00 4.11 O ATOM 554 CB PHE A 76 -4.080 0.699 10.062 1.00 12.14 C ATOM 555 CG PHE A 76 -3.370 2.016 10.202 1.00 1.25 C ATOM 556 CD1 PHE A 76 -2.127 2.087 10.810 1.00 60.25 C ATOM 557 CD2 PHE A 76 -3.946 3.182 9.725 1.00 12.41 C ATOM 558 CE1 PHE A 76 -1.474 3.297 10.940 1.00 34.41 C ATOM 559 CE2 PHE A 76 -3.297 4.395 9.852 1.00 53.13 C ATOM 560 CZ PHE A 76 -2.058 4.453 10.459 1.00 21.22 C ATOM 0 H PHE A 76 -3.713 -1.565 9.005 1.00 65.31 H new ATOM 0 HA PHE A 76 -5.484 0.674 8.434 1.00 32.44 H new ATOM 0 HB2 PHE A 76 -4.984 0.716 10.671 1.00 12.14 H new ATOM 0 HB3 PHE A 76 -3.443 -0.092 10.459 1.00 12.14 H new ATOM 0 HD1 PHE A 76 -1.664 1.187 11.186 1.00 60.25 H new ATOM 0 HD2 PHE A 76 -4.914 3.142 9.248 1.00 12.41 H new ATOM 0 HE1 PHE A 76 -0.506 3.340 11.418 1.00 34.41 H new ATOM 0 HE2 PHE A 76 -3.758 5.297 9.477 1.00 53.13 H new ATOM 0 HZ PHE A 76 -1.547 5.399 10.557 1.00 21.22 H new ATOM 569 N VAL A 77 -4.084 2.122 6.996 1.00 2.32 N ATOM 570 CA VAL A 77 -3.316 2.915 6.045 1.00 43.34 C ATOM 571 C VAL A 77 -3.641 4.399 6.179 1.00 75.33 C ATOM 572 O VAL A 77 -4.788 4.775 6.418 1.00 32.32 O ATOM 573 CB VAL A 77 -3.588 2.470 4.595 1.00 24.13 C ATOM 574 CG1 VAL A 77 -5.084 2.396 4.330 1.00 20.13 C ATOM 575 CG2 VAL A 77 -2.911 3.415 3.613 1.00 43.53 C ATOM 0 H VAL A 77 -5.054 2.418 7.106 1.00 2.32 H new ATOM 0 HA VAL A 77 -2.263 2.754 6.275 1.00 43.34 H new ATOM 0 HB VAL A 77 -3.169 1.474 4.454 1.00 24.13 H new ATOM 0 HG11 VAL A 77 -5.256 2.080 3.301 1.00 20.13 H new ATOM 0 HG12 VAL A 77 -5.539 1.677 5.011 1.00 20.13 H new ATOM 0 HG13 VAL A 77 -5.530 3.378 4.488 1.00 20.13 H new ATOM 0 HG21 VAL A 77 -3.113 3.086 2.594 1.00 43.53 H new ATOM 0 HG22 VAL A 77 -3.299 4.424 3.753 1.00 43.53 H new ATOM 0 HG23 VAL A 77 -1.835 3.412 3.788 1.00 43.53 H new ATOM 585 N ASP A 78 -2.622 5.238 6.021 1.00 32.15 N ATOM 586 CA ASP A 78 -2.798 6.682 6.123 1.00 52.04 C ATOM 587 C ASP A 78 -2.976 7.306 4.743 1.00 43.21 C ATOM 588 O ASP A 78 -2.376 6.876 3.757 1.00 12.44 O ATOM 589 CB ASP A 78 -1.600 7.314 6.832 1.00 60.15 C ATOM 590 CG ASP A 78 -1.976 7.934 8.164 1.00 72.33 C ATOM 591 OD1 ASP A 78 -2.237 9.154 8.197 1.00 65.02 O ATOM 592 OD2 ASP A 78 -2.007 7.199 9.172 1.00 11.05 O ATOM 0 H ASP A 78 -1.666 4.943 5.822 1.00 32.15 H new ATOM 0 HA ASP A 78 -3.698 6.874 6.707 1.00 52.04 H new ATOM 0 HB2 ASP A 78 -0.834 6.555 6.991 1.00 60.15 H new ATOM 0 HB3 ASP A 78 -1.163 8.078 6.189 1.00 60.15 H new ATOM 596 N PRO A 79 -3.822 8.344 4.667 1.00 73.01 N ATOM 597 CA PRO A 79 -4.099 9.049 3.412 1.00 43.14 C ATOM 598 C PRO A 79 -2.903 9.862 2.927 1.00 12.31 C ATOM 599 O PRO A 79 -2.738 10.088 1.727 1.00 0.34 O ATOM 600 CB PRO A 79 -5.263 9.975 3.774 1.00 25.55 C ATOM 601 CG PRO A 79 -5.132 10.190 5.243 1.00 12.33 C ATOM 602 CD PRO A 79 -4.571 8.910 5.800 1.00 4.33 C ATOM 0 HA PRO A 79 -4.322 8.359 2.598 1.00 43.14 H new ATOM 0 HB2 PRO A 79 -5.204 10.917 3.229 1.00 25.55 H new ATOM 0 HB3 PRO A 79 -6.222 9.522 3.524 1.00 25.55 H new ATOM 0 HG2 PRO A 79 -4.472 11.031 5.457 1.00 12.33 H new ATOM 0 HG3 PRO A 79 -6.098 10.420 5.692 1.00 12.33 H new ATOM 0 HD2 PRO A 79 -3.924 9.095 6.657 1.00 4.33 H new ATOM 0 HD3 PRO A 79 -5.361 8.238 6.136 1.00 4.33 H new ATOM 607 N LEU A 80 -2.070 10.298 3.865 1.00 1.25 N ATOM 608 CA LEU A 80 -0.888 11.085 3.534 1.00 62.22 C ATOM 609 C LEU A 80 -0.117 10.449 2.382 1.00 73.55 C ATOM 610 O LEU A 80 -0.034 11.013 1.289 1.00 13.24 O ATOM 611 CB LEU A 80 0.020 11.220 4.758 1.00 40.44 C ATOM 612 CG LEU A 80 0.892 12.474 4.813 1.00 43.13 C ATOM 613 CD1 LEU A 80 1.680 12.520 6.111 1.00 22.34 C ATOM 614 CD2 LEU A 80 1.829 12.525 3.615 1.00 32.50 C ATOM 0 H LEU A 80 -2.192 10.120 4.862 1.00 1.25 H new ATOM 0 HA LEU A 80 -1.217 12.077 3.224 1.00 62.22 H new ATOM 0 HB2 LEU A 80 -0.603 11.196 5.652 1.00 40.44 H new ATOM 0 HB3 LEU A 80 0.671 10.347 4.800 1.00 40.44 H new ATOM 0 HG LEU A 80 0.241 13.348 4.777 1.00 43.13 H new ATOM 0 HD11 LEU A 80 2.295 13.420 6.132 1.00 22.34 H new ATOM 0 HD12 LEU A 80 0.990 12.532 6.955 1.00 22.34 H new ATOM 0 HD13 LEU A 80 2.321 11.641 6.179 1.00 22.34 H new ATOM 0 HD21 LEU A 80 2.442 13.424 3.671 1.00 32.50 H new ATOM 0 HD22 LEU A 80 2.473 11.646 3.619 1.00 32.50 H new ATOM 0 HD23 LEU A 80 1.244 12.541 2.696 1.00 32.50 H new ATOM 625 N THR A 81 0.446 9.271 2.632 1.00 23.54 N ATOM 626 CA THR A 81 1.210 8.559 1.616 1.00 21.14 C ATOM 627 C THR A 81 0.631 7.171 1.366 1.00 70.54 C ATOM 628 O THR A 81 0.551 6.718 0.224 1.00 4.33 O ATOM 629 CB THR A 81 2.691 8.419 2.021 1.00 43.21 C ATOM 630 OG1 THR A 81 3.371 7.559 1.101 1.00 54.03 O ATOM 631 CG2 THR A 81 2.815 7.862 3.431 1.00 24.13 C ATOM 0 H THR A 81 0.387 8.790 3.530 1.00 23.54 H new ATOM 0 HA THR A 81 1.145 9.148 0.701 1.00 21.14 H new ATOM 0 HB THR A 81 3.147 9.409 1.997 1.00 43.21 H new ATOM 0 HG1 THR A 81 4.311 7.476 1.364 1.00 54.03 H new ATOM 0 HG21 THR A 81 3.869 7.772 3.695 1.00 24.13 H new ATOM 0 HG22 THR A 81 2.321 8.534 4.133 1.00 24.13 H new ATOM 0 HG23 THR A 81 2.344 6.880 3.477 1.00 24.13 H new ATOM 639 N GLY A 82 0.227 6.500 2.441 1.00 74.11 N ATOM 640 CA GLY A 82 -0.341 5.171 2.315 1.00 54.11 C ATOM 641 C GLY A 82 0.296 4.176 3.265 1.00 72.04 C ATOM 642 O GLY A 82 0.794 3.133 2.841 1.00 42.21 O ATOM 0 H GLY A 82 0.283 6.853 3.396 1.00 74.11 H new ATOM 0 HA2 GLY A 82 -1.413 5.218 2.508 1.00 54.11 H new ATOM 0 HA3 GLY A 82 -0.216 4.821 1.290 1.00 54.11 H new ATOM 646 N ALA A 83 0.283 4.499 4.554 1.00 63.10 N ATOM 647 CA ALA A 83 0.864 3.626 5.566 1.00 22.21 C ATOM 648 C ALA A 83 0.323 2.207 5.442 1.00 2.54 C ATOM 649 O ALA A 83 -0.702 1.978 4.800 1.00 14.30 O ATOM 650 CB ALA A 83 0.590 4.178 6.958 1.00 42.03 C ATOM 0 H ALA A 83 -0.124 5.359 4.922 1.00 63.10 H new ATOM 0 HA ALA A 83 1.942 3.591 5.406 1.00 22.21 H new ATOM 0 HB1 ALA A 83 1.029 3.517 7.705 1.00 42.03 H new ATOM 0 HB2 ALA A 83 1.030 5.171 7.049 1.00 42.03 H new ATOM 0 HB3 ALA A 83 -0.486 4.242 7.119 1.00 42.03 H new ATOM 656 N GLN A 84 1.017 1.257 6.062 1.00 72.15 N ATOM 657 CA GLN A 84 0.606 -0.141 6.018 1.00 1.43 C ATOM 658 C GLN A 84 0.888 -0.833 7.348 1.00 53.11 C ATOM 659 O GLN A 84 2.044 -0.992 7.743 1.00 52.52 O ATOM 660 CB GLN A 84 1.328 -0.872 4.886 1.00 14.51 C ATOM 661 CG GLN A 84 2.835 -0.669 4.894 1.00 41.41 C ATOM 662 CD GLN A 84 3.246 0.664 4.303 1.00 74.52 C ATOM 663 OE1 GLN A 84 3.156 0.875 3.093 1.00 43.44 O ATOM 664 NE2 GLN A 84 3.704 1.575 5.155 1.00 15.13 N ATOM 0 H GLN A 84 1.866 1.430 6.600 1.00 72.15 H new ATOM 0 HA GLN A 84 -0.468 -0.172 5.833 1.00 1.43 H new ATOM 0 HB2 GLN A 84 1.113 -1.938 4.958 1.00 14.51 H new ATOM 0 HB3 GLN A 84 0.929 -0.530 3.931 1.00 14.51 H new ATOM 0 HG2 GLN A 84 3.202 -0.737 5.918 1.00 41.41 H new ATOM 0 HG3 GLN A 84 3.309 -1.473 4.332 1.00 41.41 H new ATOM 0 HE21 GLN A 84 3.762 1.359 6.150 1.00 15.13 H new ATOM 0 HE22 GLN A 84 3.997 2.490 4.814 1.00 15.13 H new ATOM 671 N ILE A 85 -0.175 -1.241 8.034 1.00 34.22 N ATOM 672 CA ILE A 85 -0.040 -1.917 9.318 1.00 32.53 C ATOM 673 C ILE A 85 -1.182 -2.901 9.544 1.00 62.13 C ATOM 674 O ILE A 85 -2.311 -2.666 9.112 1.00 14.03 O ATOM 675 CB ILE A 85 -0.006 -0.910 10.483 1.00 44.04 C ATOM 676 CG1 ILE A 85 1.162 0.062 10.313 1.00 33.31 C ATOM 677 CG2 ILE A 85 0.095 -1.641 11.813 1.00 13.42 C ATOM 678 CD1 ILE A 85 1.267 1.083 11.424 1.00 33.54 C ATOM 0 H ILE A 85 -1.138 -1.115 7.722 1.00 34.22 H new ATOM 0 HA ILE A 85 0.904 -2.461 9.291 1.00 32.53 H new ATOM 0 HB ILE A 85 -0.934 -0.338 10.475 1.00 44.04 H new ATOM 0 HG12 ILE A 85 2.091 -0.505 10.263 1.00 33.31 H new ATOM 0 HG13 ILE A 85 1.055 0.583 9.361 1.00 33.31 H new ATOM 0 HG21 ILE A 85 0.118 -0.915 12.626 1.00 13.42 H new ATOM 0 HG22 ILE A 85 -0.768 -2.295 11.935 1.00 13.42 H new ATOM 0 HG23 ILE A 85 1.008 -2.237 11.832 1.00 13.42 H new ATOM 0 HD11 ILE A 85 2.118 1.738 11.237 1.00 33.54 H new ATOM 0 HD12 ILE A 85 0.353 1.676 11.461 1.00 33.54 H new ATOM 0 HD13 ILE A 85 1.406 0.571 12.376 1.00 33.54 H new ATOM 689 N GLU A 86 -0.882 -4.002 10.227 1.00 75.22 N ATOM 690 CA GLU A 86 -1.885 -5.021 10.511 1.00 61.24 C ATOM 691 C GLU A 86 -2.354 -4.934 11.960 1.00 54.40 C ATOM 692 O GLU A 86 -1.645 -5.349 12.877 1.00 64.14 O ATOM 693 CB GLU A 86 -1.322 -6.416 10.228 1.00 71.12 C ATOM 694 CG GLU A 86 0.031 -6.667 10.870 1.00 71.30 C ATOM 695 CD GLU A 86 0.123 -8.033 11.523 1.00 64.05 C ATOM 696 OE1 GLU A 86 0.620 -8.972 10.868 1.00 74.23 O ATOM 697 OE2 GLU A 86 -0.303 -8.161 12.690 1.00 44.00 O ATOM 0 H GLU A 86 0.047 -4.210 10.593 1.00 75.22 H new ATOM 0 HA GLU A 86 -2.740 -4.843 9.859 1.00 61.24 H new ATOM 0 HB2 GLU A 86 -2.029 -7.164 10.587 1.00 71.12 H new ATOM 0 HB3 GLU A 86 -1.234 -6.551 9.150 1.00 71.12 H new ATOM 0 HG2 GLU A 86 0.810 -6.577 10.113 1.00 71.30 H new ATOM 0 HG3 GLU A 86 0.222 -5.897 11.618 1.00 71.30 H new ATOM 702 N GLU A 87 -3.551 -4.392 12.158 1.00 42.42 N ATOM 703 CA GLU A 87 -4.113 -4.250 13.495 1.00 63.30 C ATOM 704 C GLU A 87 -5.391 -5.071 13.639 1.00 42.53 C ATOM 705 O GLU A 87 -6.059 -5.377 12.652 1.00 23.52 O ATOM 706 CB GLU A 87 -4.403 -2.777 13.797 1.00 14.13 C ATOM 707 CG GLU A 87 -3.739 -2.274 15.068 1.00 54.43 C ATOM 708 CD GLU A 87 -2.255 -2.582 15.112 1.00 74.34 C ATOM 709 OE1 GLU A 87 -1.573 -2.362 14.088 1.00 33.04 O ATOM 710 OE2 GLU A 87 -1.775 -3.042 16.169 1.00 42.51 O ATOM 0 H GLU A 87 -4.150 -4.044 11.409 1.00 42.42 H new ATOM 0 HA GLU A 87 -3.380 -4.623 14.210 1.00 63.30 H new ATOM 0 HB2 GLU A 87 -4.067 -2.170 12.957 1.00 14.13 H new ATOM 0 HB3 GLU A 87 -5.481 -2.637 13.880 1.00 14.13 H new ATOM 0 HG2 GLU A 87 -3.885 -1.197 15.148 1.00 54.43 H new ATOM 0 HG3 GLU A 87 -4.226 -2.727 15.932 1.00 54.43 H new ATOM 715 N ASN A 88 -5.725 -5.424 14.876 1.00 20.22 N ATOM 716 CA ASN A 88 -6.922 -6.211 15.150 1.00 61.24 C ATOM 717 C ASN A 88 -8.109 -5.305 15.461 1.00 65.35 C ATOM 718 O ASN A 88 -8.010 -4.081 15.375 1.00 74.43 O ATOM 719 CB ASN A 88 -6.674 -7.166 16.320 1.00 43.04 C ATOM 720 CG ASN A 88 -5.443 -8.026 16.112 1.00 22.25 C ATOM 721 OD1 ASN A 88 -5.050 -8.305 14.980 1.00 25.41 O ATOM 722 ND2 ASN A 88 -4.827 -8.452 17.210 1.00 64.55 N ATOM 0 H ASN A 88 -5.184 -5.178 15.705 1.00 20.22 H new ATOM 0 HA ASN A 88 -7.156 -6.793 14.259 1.00 61.24 H new ATOM 0 HB2 ASN A 88 -6.561 -6.590 17.238 1.00 43.04 H new ATOM 0 HB3 ASN A 88 -7.545 -7.808 16.452 1.00 43.04 H new ATOM 0 HD21 ASN A 88 -3.993 -9.035 17.134 1.00 64.55 H new ATOM 0 HD22 ASN A 88 -5.188 -8.196 18.129 1.00 64.55 H new ATOM 728 N VAL A 89 -9.232 -5.915 15.825 1.00 5.23 N ATOM 729 CA VAL A 89 -10.439 -5.164 16.151 1.00 5.13 C ATOM 730 C VAL A 89 -10.192 -4.202 17.308 1.00 23.54 C ATOM 731 O VAL A 89 -10.741 -3.100 17.343 1.00 52.40 O ATOM 732 CB VAL A 89 -11.603 -6.102 16.520 1.00 51.40 C ATOM 733 CG1 VAL A 89 -12.872 -5.305 16.776 1.00 21.24 C ATOM 734 CG2 VAL A 89 -11.823 -7.133 15.421 1.00 24.14 C ATOM 0 H VAL A 89 -9.332 -6.927 15.902 1.00 5.23 H new ATOM 0 HA VAL A 89 -10.708 -4.597 15.260 1.00 5.13 H new ATOM 0 HB VAL A 89 -11.345 -6.630 17.438 1.00 51.40 H new ATOM 0 HG11 VAL A 89 -13.683 -5.986 17.035 1.00 21.24 H new ATOM 0 HG12 VAL A 89 -12.705 -4.609 17.598 1.00 21.24 H new ATOM 0 HG13 VAL A 89 -13.139 -4.748 15.878 1.00 21.24 H new ATOM 0 HG21 VAL A 89 -12.649 -7.788 15.697 1.00 24.14 H new ATOM 0 HG22 VAL A 89 -12.060 -6.624 14.487 1.00 24.14 H new ATOM 0 HG23 VAL A 89 -10.917 -7.726 15.291 1.00 24.14 H new ATOM 744 N TYR A 90 -9.360 -4.625 18.255 1.00 1.23 N ATOM 745 CA TYR A 90 -9.041 -3.802 19.415 1.00 2.22 C ATOM 746 C TYR A 90 -7.762 -3.005 19.182 1.00 64.15 C ATOM 747 O TYR A 90 -6.962 -2.811 20.097 1.00 64.31 O ATOM 748 CB TYR A 90 -8.890 -4.677 20.661 1.00 31.12 C ATOM 749 CG TYR A 90 -10.142 -5.446 21.017 1.00 61.31 C ATOM 750 CD1 TYR A 90 -11.096 -4.901 21.868 1.00 35.34 C ATOM 751 CD2 TYR A 90 -10.371 -6.716 20.505 1.00 72.33 C ATOM 752 CE1 TYR A 90 -12.242 -5.599 22.197 1.00 33.42 C ATOM 753 CE2 TYR A 90 -11.514 -7.422 20.827 1.00 63.04 C ATOM 754 CZ TYR A 90 -12.446 -6.859 21.674 1.00 41.41 C ATOM 755 OH TYR A 90 -13.586 -7.559 21.999 1.00 53.05 O ATOM 0 H TYR A 90 -8.895 -5.533 18.241 1.00 1.23 H new ATOM 0 HA TYR A 90 -9.862 -3.101 19.568 1.00 2.22 H new ATOM 0 HB2 TYR A 90 -8.074 -5.382 20.503 1.00 31.12 H new ATOM 0 HB3 TYR A 90 -8.608 -4.047 21.505 1.00 31.12 H new ATOM 0 HD1 TYR A 90 -10.939 -3.915 22.279 1.00 35.34 H new ATOM 0 HD2 TYR A 90 -9.642 -7.160 19.843 1.00 72.33 H new ATOM 0 HE1 TYR A 90 -12.974 -5.161 22.860 1.00 33.42 H new ATOM 0 HE2 TYR A 90 -11.677 -8.408 20.418 1.00 63.04 H new ATOM 0 HH TYR A 90 -13.576 -8.428 21.547 1.00 53.05 H new ATOM 764 N ALA A 91 -7.577 -2.543 17.950 1.00 61.13 N ATOM 765 CA ALA A 91 -6.398 -1.762 17.595 1.00 11.41 C ATOM 766 C ALA A 91 -6.172 -0.626 18.586 1.00 74.12 C ATOM 767 O ALA A 91 -7.021 0.250 18.744 1.00 44.05 O ATOM 768 CB ALA A 91 -6.533 -1.214 16.182 1.00 54.24 C ATOM 0 H ALA A 91 -8.229 -2.696 17.180 1.00 61.13 H new ATOM 0 HA ALA A 91 -5.531 -2.421 17.636 1.00 11.41 H new ATOM 0 HB1 ALA A 91 -5.646 -0.633 15.931 1.00 54.24 H new ATOM 0 HB2 ALA A 91 -6.636 -2.041 15.479 1.00 54.24 H new ATOM 0 HB3 ALA A 91 -7.414 -0.575 16.122 1.00 54.24 H new ATOM 774 N ASP A 92 -5.023 -0.648 19.252 1.00 32.24 N ATOM 775 CA ASP A 92 -4.686 0.381 20.228 1.00 32.35 C ATOM 776 C ASP A 92 -3.693 1.381 19.643 1.00 4.52 C ATOM 777 O ASP A 92 -2.628 1.000 19.155 1.00 43.34 O ATOM 778 CB ASP A 92 -4.102 -0.256 21.491 1.00 64.13 C ATOM 779 CG ASP A 92 -4.186 0.663 22.695 1.00 51.44 C ATOM 780 OD1 ASP A 92 -3.817 1.848 22.562 1.00 31.54 O ATOM 781 OD2 ASP A 92 -4.620 0.196 23.769 1.00 72.51 O ATOM 0 H ASP A 92 -4.309 -1.367 19.134 1.00 32.24 H new ATOM 0 HA ASP A 92 -5.601 0.914 20.488 1.00 32.35 H new ATOM 0 HB2 ASP A 92 -4.634 -1.182 21.707 1.00 64.13 H new ATOM 0 HB3 ASP A 92 -3.060 -0.521 21.312 1.00 64.13 H new ATOM 785 N ILE A 93 -4.050 2.660 19.695 1.00 0.40 N ATOM 786 CA ILE A 93 -3.191 3.714 19.170 1.00 25.10 C ATOM 787 C ILE A 93 -1.778 3.601 19.730 1.00 31.23 C ATOM 788 O ILE A 93 -0.804 3.943 19.059 1.00 34.42 O ATOM 789 CB ILE A 93 -3.751 5.111 19.496 1.00 4.41 C ATOM 790 CG1 ILE A 93 -5.158 5.270 18.916 1.00 12.50 C ATOM 791 CG2 ILE A 93 -2.826 6.191 18.958 1.00 60.22 C ATOM 792 CD1 ILE A 93 -5.202 5.186 17.406 1.00 34.32 C ATOM 0 H ILE A 93 -4.928 2.991 20.095 1.00 0.40 H new ATOM 0 HA ILE A 93 -3.161 3.587 18.088 1.00 25.10 H new ATOM 0 HB ILE A 93 -3.811 5.218 20.579 1.00 4.41 H new ATOM 0 HG12 ILE A 93 -5.804 4.498 19.334 1.00 12.50 H new ATOM 0 HG13 ILE A 93 -5.565 6.231 19.230 1.00 12.50 H new ATOM 0 HG21 ILE A 93 -3.235 7.173 19.196 1.00 60.22 H new ATOM 0 HG22 ILE A 93 -1.842 6.088 19.415 1.00 60.22 H new ATOM 0 HG23 ILE A 93 -2.737 6.088 17.877 1.00 60.22 H new ATOM 0 HD11 ILE A 93 -6.230 5.307 17.065 1.00 34.32 H new ATOM 0 HD12 ILE A 93 -4.583 5.975 16.979 1.00 34.32 H new ATOM 0 HD13 ILE A 93 -4.825 4.215 17.084 1.00 34.32 H new ATOM 803 N ARG A 94 -1.673 3.119 20.964 1.00 33.33 N ATOM 804 CA ARG A 94 -0.378 2.960 21.615 1.00 72.22 C ATOM 805 C ARG A 94 0.565 2.127 20.753 1.00 33.00 C ATOM 806 O ARG A 94 1.772 2.367 20.725 1.00 33.13 O ATOM 807 CB ARG A 94 -0.550 2.303 22.986 1.00 74.14 C ATOM 808 CG ARG A 94 -0.978 0.846 22.913 1.00 31.21 C ATOM 809 CD ARG A 94 -1.523 0.359 24.246 1.00 1.20 C ATOM 810 NE ARG A 94 -0.467 0.179 25.237 1.00 20.21 N ATOM 811 CZ ARG A 94 -0.690 0.108 26.545 1.00 61.44 C ATOM 812 NH1 ARG A 94 -1.926 0.201 27.016 1.00 53.53 N ATOM 813 NH2 ARG A 94 0.324 -0.056 27.384 1.00 21.32 N ATOM 0 H ARG A 94 -2.469 2.832 21.533 1.00 33.33 H new ATOM 0 HA ARG A 94 0.059 3.950 21.747 1.00 72.22 H new ATOM 0 HB2 ARG A 94 0.391 2.370 23.532 1.00 74.14 H new ATOM 0 HB3 ARG A 94 -1.291 2.862 23.557 1.00 74.14 H new ATOM 0 HG2 ARG A 94 -1.739 0.727 22.142 1.00 31.21 H new ATOM 0 HG3 ARG A 94 -0.128 0.230 22.619 1.00 31.21 H new ATOM 0 HD2 ARG A 94 -2.254 1.075 24.622 1.00 1.20 H new ATOM 0 HD3 ARG A 94 -2.047 -0.585 24.100 1.00 1.20 H new ATOM 0 HE ARG A 94 0.495 0.104 24.907 1.00 20.21 H new ATOM 0 HH11 ARG A 94 -2.708 0.327 26.374 1.00 53.53 H new ATOM 0 HH12 ARG A 94 -2.094 0.146 28.020 1.00 53.53 H new ATOM 0 HH21 ARG A 94 1.276 -0.128 27.025 1.00 21.32 H new ATOM 0 HH22 ARG A 94 0.152 -0.110 28.388 1.00 21.32 H new ATOM 824 N ASP A 95 0.007 1.146 20.052 1.00 23.13 N ATOM 825 CA ASP A 95 0.798 0.277 19.189 1.00 65.12 C ATOM 826 C ASP A 95 1.148 0.982 17.882 1.00 33.13 C ATOM 827 O ASP A 95 2.322 1.133 17.543 1.00 72.43 O ATOM 828 CB ASP A 95 0.036 -1.017 18.896 1.00 21.10 C ATOM 829 CG ASP A 95 0.957 -2.155 18.502 1.00 63.22 C ATOM 830 OD1 ASP A 95 2.187 -1.939 18.472 1.00 33.22 O ATOM 831 OD2 ASP A 95 0.448 -3.260 18.223 1.00 23.13 O ATOM 0 H ASP A 95 -0.990 0.933 20.065 1.00 23.13 H new ATOM 0 HA ASP A 95 1.724 0.034 19.710 1.00 65.12 H new ATOM 0 HB2 ASP A 95 -0.537 -1.306 19.777 1.00 21.10 H new ATOM 0 HB3 ASP A 95 -0.681 -0.839 18.094 1.00 21.10 H new ATOM 835 N ILE A 96 0.123 1.411 17.153 1.00 0.20 N ATOM 836 CA ILE A 96 0.324 2.100 15.884 1.00 12.53 C ATOM 837 C ILE A 96 1.270 3.284 16.045 1.00 64.11 C ATOM 838 O ILE A 96 2.053 3.591 15.147 1.00 2.11 O ATOM 839 CB ILE A 96 -1.011 2.598 15.298 1.00 31.32 C ATOM 840 CG1 ILE A 96 -1.937 1.417 15.006 1.00 62.25 C ATOM 841 CG2 ILE A 96 -0.763 3.410 14.035 1.00 61.20 C ATOM 842 CD1 ILE A 96 -3.256 1.823 14.385 1.00 63.21 C ATOM 0 H ILE A 96 -0.855 1.294 17.419 1.00 0.20 H new ATOM 0 HA ILE A 96 0.766 1.377 15.198 1.00 12.53 H new ATOM 0 HB ILE A 96 -1.496 3.242 16.032 1.00 31.32 H new ATOM 0 HG12 ILE A 96 -1.428 0.723 14.337 1.00 62.25 H new ATOM 0 HG13 ILE A 96 -2.132 0.880 15.934 1.00 62.25 H new ATOM 0 HG21 ILE A 96 -1.715 3.755 13.632 1.00 61.20 H new ATOM 0 HG22 ILE A 96 -0.136 4.270 14.272 1.00 61.20 H new ATOM 0 HG23 ILE A 96 -0.260 2.787 13.295 1.00 61.20 H new ATOM 0 HD11 ILE A 96 -3.862 0.935 14.205 1.00 63.21 H new ATOM 0 HD12 ILE A 96 -3.786 2.493 15.062 1.00 63.21 H new ATOM 0 HD13 ILE A 96 -3.071 2.334 13.440 1.00 63.21 H new ATOM 853 N GLN A 97 1.193 3.943 17.196 1.00 22.44 N ATOM 854 CA GLN A 97 2.044 5.094 17.476 1.00 74.42 C ATOM 855 C GLN A 97 3.515 4.747 17.266 1.00 10.20 C ATOM 856 O GLN A 97 4.296 5.575 16.800 1.00 33.14 O ATOM 857 CB GLN A 97 1.824 5.583 18.909 1.00 43.14 C ATOM 858 CG GLN A 97 2.766 6.704 19.320 1.00 4.54 C ATOM 859 CD GLN A 97 2.377 7.334 20.643 1.00 24.02 C ATOM 860 OE1 GLN A 97 1.310 7.937 20.768 1.00 13.24 O ATOM 861 NE2 GLN A 97 3.243 7.201 21.640 1.00 33.34 N ATOM 0 H GLN A 97 0.550 3.700 17.950 1.00 22.44 H new ATOM 0 HA GLN A 97 1.773 5.890 16.783 1.00 74.42 H new ATOM 0 HB2 GLN A 97 0.795 5.928 19.013 1.00 43.14 H new ATOM 0 HB3 GLN A 97 1.950 4.744 19.594 1.00 43.14 H new ATOM 0 HG2 GLN A 97 3.781 6.313 19.392 1.00 4.54 H new ATOM 0 HG3 GLN A 97 2.774 7.470 18.545 1.00 4.54 H new ATOM 0 HE21 GLN A 97 4.116 6.693 21.493 1.00 33.34 H new ATOM 0 HE22 GLN A 97 3.036 7.606 22.553 1.00 33.34 H new ATOM 868 N GLU A 98 3.884 3.518 17.613 1.00 45.32 N ATOM 869 CA GLU A 98 5.260 3.063 17.463 1.00 33.35 C ATOM 870 C GLU A 98 5.637 2.943 15.989 1.00 41.41 C ATOM 871 O GLU A 98 6.555 3.612 15.515 1.00 61.22 O ATOM 872 CB GLU A 98 5.455 1.715 18.161 1.00 23.33 C ATOM 873 CG GLU A 98 6.911 1.297 18.284 1.00 71.12 C ATOM 874 CD GLU A 98 7.074 -0.070 18.918 1.00 44.20 C ATOM 875 OE1 GLU A 98 6.090 -0.839 18.932 1.00 32.34 O ATOM 876 OE2 GLU A 98 8.186 -0.371 19.399 1.00 74.05 O ATOM 0 H GLU A 98 3.249 2.820 18.000 1.00 45.32 H new ATOM 0 HA GLU A 98 5.912 3.803 17.928 1.00 33.35 H new ATOM 0 HB2 GLU A 98 5.015 1.764 19.157 1.00 23.33 H new ATOM 0 HB3 GLU A 98 4.911 0.948 17.610 1.00 23.33 H new ATOM 0 HG2 GLU A 98 7.368 1.291 17.295 1.00 71.12 H new ATOM 0 HG3 GLU A 98 7.448 2.036 18.879 1.00 71.12 H new ATOM 881 N ARG A 99 4.920 2.085 15.270 1.00 43.10 N ATOM 882 CA ARG A 99 5.179 1.875 13.850 1.00 60.22 C ATOM 883 C ARG A 99 5.144 3.198 13.090 1.00 14.23 C ATOM 884 O ARG A 99 5.892 3.395 12.132 1.00 31.20 O ATOM 885 CB ARG A 99 4.150 0.909 13.260 1.00 53.12 C ATOM 886 CG ARG A 99 4.401 0.570 11.800 1.00 53.23 C ATOM 887 CD ARG A 99 5.790 -0.016 11.594 1.00 4.20 C ATOM 888 NE ARG A 99 5.949 -0.593 10.262 1.00 22.41 N ATOM 889 CZ ARG A 99 5.466 -1.779 9.912 1.00 12.33 C ATOM 890 NH1 ARG A 99 4.796 -2.511 10.792 1.00 52.23 N ATOM 891 NH2 ARG A 99 5.652 -2.236 8.680 1.00 5.11 N ATOM 0 H ARG A 99 4.156 1.524 15.647 1.00 43.10 H new ATOM 0 HA ARG A 99 6.174 1.443 13.748 1.00 60.22 H new ATOM 0 HB2 ARG A 99 4.152 -0.012 13.844 1.00 53.12 H new ATOM 0 HB3 ARG A 99 3.156 1.346 13.357 1.00 53.12 H new ATOM 0 HG2 ARG A 99 3.650 -0.142 11.456 1.00 53.23 H new ATOM 0 HG3 ARG A 99 4.290 1.468 11.193 1.00 53.23 H new ATOM 0 HD2 ARG A 99 6.538 0.763 11.743 1.00 4.20 H new ATOM 0 HD3 ARG A 99 5.975 -0.783 12.346 1.00 4.20 H new ATOM 0 HE ARG A 99 6.459 -0.055 9.562 1.00 22.41 H new ATOM 0 HH11 ARG A 99 4.651 -2.163 11.740 1.00 52.23 H new ATOM 0 HH12 ARG A 99 4.426 -3.422 10.521 1.00 52.23 H new ATOM 0 HH21 ARG A 99 6.167 -1.676 8.001 1.00 5.11 H new ATOM 0 HH22 ARG A 99 5.280 -3.147 8.413 1.00 5.11 H new ATOM 902 N PHE A 100 4.270 4.101 13.523 1.00 21.05 N ATOM 903 CA PHE A 100 4.137 5.404 12.883 1.00 64.03 C ATOM 904 C PHE A 100 5.495 6.086 12.750 1.00 73.34 C ATOM 905 O PHE A 100 5.742 6.823 11.795 1.00 52.41 O ATOM 906 CB PHE A 100 3.183 6.293 13.682 1.00 25.44 C ATOM 907 CG PHE A 100 2.330 7.182 12.823 1.00 42.31 C ATOM 908 CD1 PHE A 100 1.220 6.674 12.167 1.00 73.52 C ATOM 909 CD2 PHE A 100 2.637 8.525 12.674 1.00 52.33 C ATOM 910 CE1 PHE A 100 0.435 7.490 11.374 1.00 4.25 C ATOM 911 CE2 PHE A 100 1.854 9.345 11.882 1.00 4.05 C ATOM 912 CZ PHE A 100 0.750 8.827 11.234 1.00 74.53 C ATOM 0 H PHE A 100 3.644 3.954 14.314 1.00 21.05 H new ATOM 0 HA PHE A 100 3.728 5.250 11.884 1.00 64.03 H new ATOM 0 HB2 PHE A 100 2.537 5.662 14.292 1.00 25.44 H new ATOM 0 HB3 PHE A 100 3.763 6.911 14.367 1.00 25.44 H new ATOM 0 HD1 PHE A 100 0.966 5.630 12.276 1.00 73.52 H new ATOM 0 HD2 PHE A 100 3.497 8.936 13.182 1.00 52.33 H new ATOM 0 HE1 PHE A 100 -0.425 7.082 10.864 1.00 4.25 H new ATOM 0 HE2 PHE A 100 2.106 10.389 11.770 1.00 4.05 H new ATOM 0 HZ PHE A 100 0.134 9.466 10.619 1.00 74.53 H new ATOM 921 N SER A 101 6.374 5.837 13.716 1.00 14.41 N ATOM 922 CA SER A 101 7.706 6.430 13.710 1.00 0.32 C ATOM 923 C SER A 101 8.424 6.139 12.396 1.00 30.11 C ATOM 924 O SER A 101 9.176 6.972 11.891 1.00 70.32 O ATOM 925 CB SER A 101 8.530 5.896 14.884 1.00 15.41 C ATOM 926 OG SER A 101 7.901 6.182 16.121 1.00 44.32 O ATOM 0 H SER A 101 6.187 5.228 14.513 1.00 14.41 H new ATOM 0 HA SER A 101 7.597 7.510 13.813 1.00 0.32 H new ATOM 0 HB2 SER A 101 8.661 4.819 14.780 1.00 15.41 H new ATOM 0 HB3 SER A 101 9.525 6.342 14.867 1.00 15.41 H new ATOM 0 HG SER A 101 7.279 5.459 16.346 1.00 44.32 H new ATOM 931 N GLU A 102 8.185 4.952 11.849 1.00 52.15 N ATOM 932 CA GLU A 102 8.810 4.551 10.593 1.00 71.30 C ATOM 933 C GLU A 102 8.295 5.399 9.434 1.00 35.13 C ATOM 934 O GLU A 102 9.064 6.095 8.770 1.00 1.15 O ATOM 935 CB GLU A 102 8.542 3.070 10.315 1.00 42.03 C ATOM 936 CG GLU A 102 9.527 2.134 10.995 1.00 24.31 C ATOM 937 CD GLU A 102 10.878 2.111 10.307 1.00 14.13 C ATOM 938 OE1 GLU A 102 11.005 1.421 9.274 1.00 73.11 O ATOM 939 OE2 GLU A 102 11.810 2.780 10.803 1.00 41.33 O ATOM 0 H GLU A 102 7.564 4.252 12.254 1.00 52.15 H new ATOM 0 HA GLU A 102 9.885 4.707 10.685 1.00 71.30 H new ATOM 0 HB2 GLU A 102 7.533 2.824 10.646 1.00 42.03 H new ATOM 0 HB3 GLU A 102 8.575 2.899 9.239 1.00 42.03 H new ATOM 0 HG2 GLU A 102 9.657 2.441 12.033 1.00 24.31 H new ATOM 0 HG3 GLU A 102 9.114 1.126 11.010 1.00 24.31 H new ATOM 944 N VAL A 103 6.989 5.334 9.196 1.00 62.34 N ATOM 945 CA VAL A 103 6.370 6.097 8.117 1.00 32.21 C ATOM 946 C VAL A 103 6.641 7.589 8.274 1.00 42.34 C ATOM 947 O VAL A 103 6.844 8.299 7.289 1.00 42.24 O ATOM 948 CB VAL A 103 4.848 5.864 8.068 1.00 54.01 C ATOM 949 CG1 VAL A 103 4.218 6.168 9.418 1.00 2.43 C ATOM 950 CG2 VAL A 103 4.216 6.710 6.973 1.00 74.22 C ATOM 0 H VAL A 103 6.339 4.762 9.735 1.00 62.34 H new ATOM 0 HA VAL A 103 6.814 5.747 7.185 1.00 32.21 H new ATOM 0 HB VAL A 103 4.665 4.815 7.837 1.00 54.01 H new ATOM 0 HG11 VAL A 103 3.143 5.998 9.364 1.00 2.43 H new ATOM 0 HG12 VAL A 103 4.651 5.516 10.177 1.00 2.43 H new ATOM 0 HG13 VAL A 103 4.408 7.208 9.682 1.00 2.43 H new ATOM 0 HG21 VAL A 103 3.141 6.534 6.952 1.00 74.22 H new ATOM 0 HG22 VAL A 103 4.407 7.765 7.172 1.00 74.22 H new ATOM 0 HG23 VAL A 103 4.647 6.439 6.009 1.00 74.22 H new ATOM 960 N ARG A 104 6.642 8.057 9.517 1.00 1.00 N ATOM 961 CA ARG A 104 6.887 9.466 9.803 1.00 51.35 C ATOM 962 C ARG A 104 8.341 9.833 9.522 1.00 11.00 C ATOM 963 O ARG A 104 8.624 10.779 8.787 1.00 64.14 O ATOM 964 CB ARG A 104 6.543 9.781 11.260 1.00 40.43 C ATOM 965 CG ARG A 104 6.378 11.265 11.539 1.00 45.21 C ATOM 966 CD ARG A 104 6.358 11.552 13.032 1.00 23.44 C ATOM 967 NE ARG A 104 7.607 11.160 13.681 1.00 24.41 N ATOM 968 CZ ARG A 104 7.758 11.085 14.998 1.00 33.54 C ATOM 969 NH1 ARG A 104 6.744 11.371 15.804 1.00 72.33 N ATOM 970 NH2 ARG A 104 8.926 10.722 15.513 1.00 12.34 N ATOM 0 H ARG A 104 6.476 7.482 10.343 1.00 1.00 H new ATOM 0 HA ARG A 104 6.247 10.059 9.150 1.00 51.35 H new ATOM 0 HB2 ARG A 104 5.621 9.265 11.526 1.00 40.43 H new ATOM 0 HB3 ARG A 104 7.328 9.384 11.904 1.00 40.43 H new ATOM 0 HG2 ARG A 104 7.194 11.817 11.072 1.00 45.21 H new ATOM 0 HG3 ARG A 104 5.452 11.621 11.087 1.00 45.21 H new ATOM 0 HD2 ARG A 104 6.183 12.616 13.195 1.00 23.44 H new ATOM 0 HD3 ARG A 104 5.527 11.018 13.493 1.00 23.44 H new ATOM 0 HE ARG A 104 8.406 10.932 13.090 1.00 24.41 H new ATOM 0 HH11 ARG A 104 5.844 11.650 15.413 1.00 72.33 H new ATOM 0 HH12 ARG A 104 6.864 11.312 16.815 1.00 72.33 H new ATOM 0 HH21 ARG A 104 9.708 10.500 14.897 1.00 12.34 H new ATOM 0 HH22 ARG A 104 9.041 10.665 16.525 1.00 12.34 H new ATOM 981 N LYS A 105 9.261 9.077 10.113 1.00 64.25 N ATOM 982 CA LYS A 105 10.686 9.321 9.926 1.00 12.03 C ATOM 983 C LYS A 105 11.038 9.389 8.443 1.00 5.25 C ATOM 984 O LYS A 105 11.783 10.269 8.011 1.00 3.04 O ATOM 985 CB LYS A 105 11.505 8.222 10.606 1.00 35.15 C ATOM 986 CG LYS A 105 11.681 8.430 12.100 1.00 12.21 C ATOM 987 CD LYS A 105 12.753 9.465 12.396 1.00 31.02 C ATOM 988 CE LYS A 105 14.149 8.872 12.275 1.00 24.04 C ATOM 989 NZ LYS A 105 15.208 9.895 12.501 1.00 0.33 N ATOM 0 H LYS A 105 9.045 8.290 10.725 1.00 64.25 H new ATOM 0 HA LYS A 105 10.927 10.281 10.382 1.00 12.03 H new ATOM 0 HB2 LYS A 105 11.019 7.261 10.436 1.00 35.15 H new ATOM 0 HB3 LYS A 105 12.487 8.170 10.137 1.00 35.15 H new ATOM 0 HG2 LYS A 105 10.735 8.749 12.538 1.00 12.21 H new ATOM 0 HG3 LYS A 105 11.947 7.484 12.571 1.00 12.21 H new ATOM 0 HD2 LYS A 105 12.651 10.303 11.706 1.00 31.02 H new ATOM 0 HD3 LYS A 105 12.610 9.861 13.402 1.00 31.02 H new ATOM 0 HE2 LYS A 105 14.264 8.064 12.998 1.00 24.04 H new ATOM 0 HE3 LYS A 105 14.273 8.434 11.285 1.00 24.04 H new ATOM 0 HZ1 LYS A 105 16.144 9.451 12.410 1.00 0.33 H new ATOM 0 HZ2 LYS A 105 15.114 10.653 11.796 1.00 0.33 H new ATOM 0 HZ3 LYS A 105 15.106 10.295 13.455 1.00 0.33 H new ATOM 999 N LYS A 106 10.496 8.456 7.668 1.00 21.13 N ATOM 1000 CA LYS A 106 10.750 8.411 6.234 1.00 51.33 C ATOM 1001 C LYS A 106 10.104 9.600 5.529 1.00 13.54 C ATOM 1002 O LYS A 106 10.730 10.253 4.695 1.00 43.43 O ATOM 1003 CB LYS A 106 10.218 7.103 5.642 1.00 42.00 C ATOM 1004 CG LYS A 106 11.216 5.960 5.696 1.00 35.21 C ATOM 1005 CD LYS A 106 10.651 4.695 5.074 1.00 1.43 C ATOM 1006 CE LYS A 106 11.411 3.460 5.532 1.00 70.15 C ATOM 1007 NZ LYS A 106 11.008 2.246 4.770 1.00 13.22 N ATOM 0 H LYS A 106 9.878 7.720 8.010 1.00 21.13 H new ATOM 0 HA LYS A 106 11.828 8.461 6.079 1.00 51.33 H new ATOM 0 HB2 LYS A 106 9.315 6.812 6.179 1.00 42.00 H new ATOM 0 HB3 LYS A 106 9.930 7.274 4.605 1.00 42.00 H new ATOM 0 HG2 LYS A 106 12.128 6.247 5.173 1.00 35.21 H new ATOM 0 HG3 LYS A 106 11.491 5.765 6.733 1.00 35.21 H new ATOM 0 HD2 LYS A 106 9.599 4.596 5.341 1.00 1.43 H new ATOM 0 HD3 LYS A 106 10.698 4.770 3.988 1.00 1.43 H new ATOM 0 HE2 LYS A 106 12.481 3.626 5.410 1.00 70.15 H new ATOM 0 HE3 LYS A 106 11.233 3.297 6.595 1.00 70.15 H new ATOM 0 HZ1 LYS A 106 11.549 1.426 5.112 1.00 13.22 H new ATOM 0 HZ2 LYS A 106 9.992 2.072 4.906 1.00 13.22 H new ATOM 0 HZ3 LYS A 106 11.202 2.391 3.759 1.00 13.22 H new ATOM 1017 N MET A 107 8.849 9.875 5.872 1.00 54.30 N ATOM 1018 CA MET A 107 8.120 10.987 5.273 1.00 13.14 C ATOM 1019 C MET A 107 8.930 12.276 5.359 1.00 31.01 C ATOM 1020 O MET A 107 9.073 12.998 4.373 1.00 33.32 O ATOM 1021 CB MET A 107 6.770 11.171 5.968 1.00 63.33 C ATOM 1022 CG MET A 107 5.897 12.239 5.327 1.00 34.31 C ATOM 1023 SD MET A 107 5.193 11.708 3.754 1.00 5.21 S ATOM 1024 CE MET A 107 5.002 13.282 2.920 1.00 71.31 C ATOM 0 H MET A 107 8.317 9.343 6.561 1.00 54.30 H new ATOM 0 HA MET A 107 7.951 10.755 4.221 1.00 13.14 H new ATOM 0 HB2 MET A 107 6.234 10.222 5.960 1.00 63.33 H new ATOM 0 HB3 MET A 107 6.941 11.432 7.013 1.00 63.33 H new ATOM 0 HG2 MET A 107 5.090 12.502 6.011 1.00 34.31 H new ATOM 0 HG3 MET A 107 6.489 13.141 5.170 1.00 34.31 H new ATOM 0 HE1 MET A 107 4.250 13.190 2.137 1.00 71.31 H new ATOM 0 HE2 MET A 107 4.687 14.039 3.639 1.00 71.31 H new ATOM 0 HE3 MET A 107 5.953 13.577 2.477 1.00 71.31 H new ATOM 1032 N VAL A 108 9.458 12.560 6.545 1.00 25.14 N ATOM 1033 CA VAL A 108 10.254 13.763 6.760 1.00 13.01 C ATOM 1034 C VAL A 108 11.664 13.594 6.205 1.00 62.41 C ATOM 1035 O VAL A 108 12.262 14.547 5.706 1.00 35.42 O ATOM 1036 CB VAL A 108 10.344 14.118 8.256 1.00 3.42 C ATOM 1037 CG1 VAL A 108 11.021 12.998 9.032 1.00 44.35 C ATOM 1038 CG2 VAL A 108 11.082 15.434 8.448 1.00 13.45 C ATOM 0 H VAL A 108 9.349 11.973 7.372 1.00 25.14 H new ATOM 0 HA VAL A 108 9.751 14.573 6.232 1.00 13.01 H new ATOM 0 HB VAL A 108 9.333 14.236 8.645 1.00 3.42 H new ATOM 0 HG11 VAL A 108 11.075 13.267 10.087 1.00 44.35 H new ATOM 0 HG12 VAL A 108 10.445 12.079 8.921 1.00 44.35 H new ATOM 0 HG13 VAL A 108 12.028 12.844 8.645 1.00 44.35 H new ATOM 0 HG21 VAL A 108 11.136 15.669 9.511 1.00 13.45 H new ATOM 0 HG22 VAL A 108 12.091 15.348 8.044 1.00 13.45 H new ATOM 0 HG23 VAL A 108 10.549 16.229 7.927 1.00 13.45 H new ATOM 1048 N GLU A 109 12.188 12.376 6.293 1.00 23.24 N ATOM 1049 CA GLU A 109 13.529 12.084 5.800 1.00 10.33 C ATOM 1050 C GLU A 109 13.651 12.431 4.319 1.00 0.41 C ATOM 1051 O GLU A 109 14.698 12.886 3.862 1.00 50.22 O ATOM 1052 CB GLU A 109 13.866 10.607 6.019 1.00 52.15 C ATOM 1053 CG GLU A 109 15.162 10.174 5.354 1.00 45.23 C ATOM 1054 CD GLU A 109 16.349 11.009 5.792 1.00 72.42 C ATOM 1055 OE1 GLU A 109 17.149 11.405 4.918 1.00 64.12 O ATOM 1056 OE2 GLU A 109 16.479 11.266 7.007 1.00 12.12 O ATOM 0 H GLU A 109 11.705 11.576 6.701 1.00 23.24 H new ATOM 0 HA GLU A 109 14.236 12.697 6.359 1.00 10.33 H new ATOM 0 HB2 GLU A 109 13.934 10.413 7.089 1.00 52.15 H new ATOM 0 HB3 GLU A 109 13.049 9.996 5.636 1.00 52.15 H new ATOM 0 HG2 GLU A 109 15.353 9.127 5.587 1.00 45.23 H new ATOM 0 HG3 GLU A 109 15.052 10.245 4.272 1.00 45.23 H new ATOM 1061 N ASN A 110 12.572 12.210 3.575 1.00 50.13 N ATOM 1062 CA ASN A 110 12.557 12.498 2.146 1.00 71.44 C ATOM 1063 C ASN A 110 13.032 13.922 1.872 1.00 34.34 C ATOM 1064 O ASN A 110 13.610 14.204 0.822 1.00 53.44 O ATOM 1065 CB ASN A 110 11.150 12.301 1.579 1.00 42.35 C ATOM 1066 CG ASN A 110 10.720 10.847 1.591 1.00 51.43 C ATOM 1067 OD1 ASN A 110 11.507 9.958 1.918 1.00 44.53 O ATOM 1068 ND2 ASN A 110 9.464 10.599 1.233 1.00 20.44 N ATOM 0 H ASN A 110 11.697 11.832 3.938 1.00 50.13 H new ATOM 0 HA ASN A 110 13.240 11.805 1.655 1.00 71.44 H new ATOM 0 HB2 ASN A 110 10.441 12.891 2.160 1.00 42.35 H new ATOM 0 HB3 ASN A 110 11.117 12.678 0.557 1.00 42.35 H new ATOM 0 HD21 ASN A 110 9.117 9.640 1.222 1.00 20.44 H new ATOM 0 HD22 ASN A 110 8.847 11.368 0.970 1.00 20.44 H new ATOM 1074 N ASP A 111 12.788 14.815 2.826 1.00 54.54 N ATOM 1075 CA ASP A 111 13.193 16.209 2.689 1.00 52.42 C ATOM 1076 C ASP A 111 12.531 16.851 1.474 1.00 55.14 C ATOM 1077 O ASP A 111 13.208 17.276 0.538 1.00 60.53 O ATOM 1078 CB ASP A 111 14.714 16.311 2.570 1.00 53.31 C ATOM 1079 CG ASP A 111 15.400 16.342 3.922 1.00 50.22 C ATOM 1080 OD1 ASP A 111 16.645 16.256 3.958 1.00 35.31 O ATOM 1081 OD2 ASP A 111 14.690 16.452 4.943 1.00 31.34 O ATOM 0 H ASP A 111 12.312 14.598 3.702 1.00 54.54 H new ATOM 0 HA ASP A 111 12.869 16.745 3.581 1.00 52.42 H new ATOM 0 HB2 ASP A 111 15.088 15.464 1.995 1.00 53.31 H new ATOM 0 HB3 ASP A 111 14.972 17.212 2.014 1.00 53.31 H new ATOM 1085 N ASP A 112 11.204 16.915 1.494 1.00 53.21 N ATOM 1086 CA ASP A 112 10.450 17.504 0.394 1.00 62.32 C ATOM 1087 C ASP A 112 9.445 18.528 0.911 1.00 42.21 C ATOM 1088 O ASP A 112 9.249 19.582 0.304 1.00 32.14 O ATOM 1089 CB ASP A 112 9.726 16.415 -0.398 1.00 2.41 C ATOM 1090 CG ASP A 112 9.351 16.866 -1.796 1.00 71.04 C ATOM 1091 OD1 ASP A 112 8.159 17.159 -2.026 1.00 33.40 O ATOM 1092 OD2 ASP A 112 10.251 16.926 -2.660 1.00 63.31 O ATOM 0 H ASP A 112 10.628 16.566 2.260 1.00 53.21 H new ATOM 0 HA ASP A 112 11.154 18.013 -0.264 1.00 62.32 H new ATOM 0 HB2 ASP A 112 10.363 15.533 -0.463 1.00 2.41 H new ATOM 0 HB3 ASP A 112 8.825 16.118 0.139 1.00 2.41 H new ATOM 1096 N ILE A 113 8.809 18.211 2.034 1.00 55.42 N ATOM 1097 CA ILE A 113 7.824 19.103 2.632 1.00 11.02 C ATOM 1098 C ILE A 113 8.142 19.367 4.100 1.00 1.34 C ATOM 1099 O ILE A 113 9.152 18.895 4.622 1.00 42.54 O ATOM 1100 CB ILE A 113 6.401 18.525 2.522 1.00 45.11 C ATOM 1101 CG1 ILE A 113 6.334 17.146 3.180 1.00 33.22 C ATOM 1102 CG2 ILE A 113 5.973 18.444 1.064 1.00 34.23 C ATOM 1103 CD1 ILE A 113 6.028 17.198 4.661 1.00 32.14 C ATOM 0 H ILE A 113 8.959 17.343 2.548 1.00 55.42 H new ATOM 0 HA ILE A 113 7.870 20.041 2.078 1.00 11.02 H new ATOM 0 HB ILE A 113 5.714 19.190 3.046 1.00 45.11 H new ATOM 0 HG12 ILE A 113 5.570 16.550 2.680 1.00 33.22 H new ATOM 0 HG13 ILE A 113 7.285 16.635 3.031 1.00 33.22 H new ATOM 0 HG21 ILE A 113 4.965 18.033 1.003 1.00 34.23 H new ATOM 0 HG22 ILE A 113 5.986 19.442 0.625 1.00 34.23 H new ATOM 0 HG23 ILE A 113 6.661 17.799 0.518 1.00 34.23 H new ATOM 0 HD11 ILE A 113 5.996 16.185 5.062 1.00 32.14 H new ATOM 0 HD12 ILE A 113 6.804 17.766 5.173 1.00 32.14 H new ATOM 0 HD13 ILE A 113 5.063 17.681 4.816 1.00 32.14 H new ATOM 1114 N GLU A 114 7.271 20.123 4.762 1.00 0.34 N ATOM 1115 CA GLU A 114 7.458 20.448 6.171 1.00 71.31 C ATOM 1116 C GLU A 114 6.127 20.424 6.916 1.00 22.21 C ATOM 1117 O GLU A 114 6.051 19.971 8.058 1.00 14.14 O ATOM 1118 CB GLU A 114 8.113 21.823 6.317 1.00 21.04 C ATOM 1119 CG GLU A 114 9.368 21.992 5.478 1.00 70.42 C ATOM 1120 CD GLU A 114 10.022 23.346 5.672 1.00 13.10 C ATOM 1121 OE1 GLU A 114 9.294 24.360 5.691 1.00 10.24 O ATOM 1122 OE2 GLU A 114 11.263 23.390 5.806 1.00 72.42 O ATOM 0 H GLU A 114 6.430 20.521 4.345 1.00 0.34 H new ATOM 0 HA GLU A 114 8.112 19.694 6.608 1.00 71.31 H new ATOM 0 HB2 GLU A 114 7.392 22.591 6.036 1.00 21.04 H new ATOM 0 HB3 GLU A 114 8.362 21.988 7.365 1.00 21.04 H new ATOM 0 HG2 GLU A 114 10.081 21.208 5.735 1.00 70.42 H new ATOM 0 HG3 GLU A 114 9.117 21.862 4.425 1.00 70.42 H new ATOM 1127 N MET A 115 5.080 20.918 6.263 1.00 11.11 N ATOM 1128 CA MET A 115 3.751 20.953 6.863 1.00 32.45 C ATOM 1129 C MET A 115 2.783 20.063 6.092 1.00 13.34 C ATOM 1130 O MET A 115 1.783 19.599 6.640 1.00 31.11 O ATOM 1131 CB MET A 115 3.224 22.388 6.901 1.00 45.42 C ATOM 1132 CG MET A 115 3.713 23.184 8.100 1.00 63.02 C ATOM 1133 SD MET A 115 3.172 24.904 8.059 1.00 73.22 S ATOM 1134 CE MET A 115 2.884 25.210 9.800 1.00 70.54 C ATOM 0 H MET A 115 5.126 21.300 5.318 1.00 11.11 H new ATOM 0 HA MET A 115 3.829 20.575 7.882 1.00 32.45 H new ATOM 0 HB2 MET A 115 3.525 22.901 5.988 1.00 45.42 H new ATOM 0 HB3 MET A 115 2.134 22.366 6.910 1.00 45.42 H new ATOM 0 HG2 MET A 115 3.351 22.715 9.015 1.00 63.02 H new ATOM 0 HG3 MET A 115 4.802 23.150 8.134 1.00 63.02 H new ATOM 0 HE1 MET A 115 2.543 26.236 9.938 1.00 70.54 H new ATOM 0 HE2 MET A 115 2.123 24.523 10.169 1.00 70.54 H new ATOM 0 HE3 MET A 115 3.810 25.058 10.354 1.00 70.54 H new ATOM 1142 N GLN A 116 3.086 19.828 4.820 1.00 32.41 N ATOM 1143 CA GLN A 116 2.241 18.994 3.974 1.00 42.30 C ATOM 1144 C GLN A 116 1.894 17.685 4.675 1.00 0.41 C ATOM 1145 O GLN A 116 0.800 17.148 4.502 1.00 11.04 O ATOM 1146 CB GLN A 116 2.940 18.704 2.645 1.00 62.22 C ATOM 1147 CG GLN A 116 2.048 18.914 1.431 1.00 12.12 C ATOM 1148 CD GLN A 116 2.826 19.345 0.204 1.00 55.14 C ATOM 1149 OE1 GLN A 116 3.127 20.526 0.028 1.00 43.12 O ATOM 1150 NE2 GLN A 116 3.157 18.387 -0.655 1.00 22.22 N ATOM 0 H GLN A 116 3.911 20.204 4.352 1.00 32.41 H new ATOM 0 HA GLN A 116 1.317 19.538 3.779 1.00 42.30 H new ATOM 0 HB2 GLN A 116 3.817 19.346 2.557 1.00 62.22 H new ATOM 0 HB3 GLN A 116 3.298 17.674 2.649 1.00 62.22 H new ATOM 0 HG2 GLN A 116 1.515 17.989 1.212 1.00 12.12 H new ATOM 0 HG3 GLN A 116 1.296 19.668 1.663 1.00 12.12 H new ATOM 0 HE21 GLN A 116 2.887 17.421 -0.470 1.00 22.22 H new ATOM 0 HE22 GLN A 116 3.681 18.618 -1.499 1.00 22.22 H new ATOM 1157 N ALA A 117 2.833 17.175 5.466 1.00 70.12 N ATOM 1158 CA ALA A 117 2.625 15.929 6.194 1.00 62.22 C ATOM 1159 C ALA A 117 1.520 16.078 7.233 1.00 43.54 C ATOM 1160 O ALA A 117 0.542 15.330 7.225 1.00 2.43 O ATOM 1161 CB ALA A 117 3.920 15.485 6.859 1.00 41.52 C ATOM 0 H ALA A 117 3.745 17.606 5.619 1.00 70.12 H new ATOM 0 HA ALA A 117 2.315 15.167 5.479 1.00 62.22 H new ATOM 0 HB1 ALA A 117 3.751 14.554 7.399 1.00 41.52 H new ATOM 0 HB2 ALA A 117 4.685 15.330 6.098 1.00 41.52 H new ATOM 0 HB3 ALA A 117 4.253 16.254 7.557 1.00 41.52 H new ATOM 1167 N LEU A 118 1.680 17.049 8.126 1.00 13.31 N ATOM 1168 CA LEU A 118 0.694 17.296 9.173 1.00 71.31 C ATOM 1169 C LEU A 118 -0.670 17.620 8.572 1.00 74.13 C ATOM 1170 O LEU A 118 -1.706 17.259 9.126 1.00 12.34 O ATOM 1171 CB LEU A 118 1.154 18.444 10.072 1.00 3.41 C ATOM 1172 CG LEU A 118 1.214 18.141 11.569 1.00 32.44 C ATOM 1173 CD1 LEU A 118 2.352 18.910 12.224 1.00 5.43 C ATOM 1174 CD2 LEU A 118 -0.112 18.474 12.237 1.00 61.23 C ATOM 0 H LEU A 118 2.483 17.678 8.146 1.00 13.31 H new ATOM 0 HA LEU A 118 0.600 16.389 9.771 1.00 71.31 H new ATOM 0 HB2 LEU A 118 2.145 18.760 9.746 1.00 3.41 H new ATOM 0 HB3 LEU A 118 0.483 19.290 9.919 1.00 3.41 H new ATOM 0 HG LEU A 118 1.402 17.075 11.696 1.00 32.44 H new ATOM 0 HD11 LEU A 118 2.379 18.682 13.290 1.00 5.43 H new ATOM 0 HD12 LEU A 118 3.298 18.620 11.766 1.00 5.43 H new ATOM 0 HD13 LEU A 118 2.195 19.980 12.086 1.00 5.43 H new ATOM 0 HD21 LEU A 118 -0.049 18.251 13.302 1.00 61.23 H new ATOM 0 HD22 LEU A 118 -0.333 19.533 12.100 1.00 61.23 H new ATOM 0 HD23 LEU A 118 -0.906 17.877 11.788 1.00 61.23 H new ATOM 1185 N GLY A 119 -0.660 18.303 7.430 1.00 44.20 N ATOM 1186 CA GLY A 119 -1.902 18.663 6.771 1.00 73.15 C ATOM 1187 C GLY A 119 -2.828 17.477 6.592 1.00 53.33 C ATOM 1188 O GLY A 119 -4.050 17.628 6.601 1.00 12.53 O ATOM 0 H GLY A 119 0.185 18.613 6.951 1.00 44.20 H new ATOM 0 HA2 GLY A 119 -2.410 19.432 7.354 1.00 73.15 H new ATOM 0 HA3 GLY A 119 -1.680 19.097 5.796 1.00 73.15 H new ATOM 1192 N SER A 120 -2.246 16.293 6.427 1.00 23.31 N ATOM 1193 CA SER A 120 -3.028 15.077 6.239 1.00 44.51 C ATOM 1194 C SER A 120 -2.379 13.897 6.957 1.00 61.22 C ATOM 1195 O SER A 120 -1.975 12.920 6.328 1.00 40.04 O ATOM 1196 CB SER A 120 -3.174 14.764 4.749 1.00 53.10 C ATOM 1197 OG SER A 120 -1.956 14.985 4.060 1.00 12.20 O ATOM 0 H SER A 120 -1.236 16.150 6.420 1.00 23.31 H new ATOM 0 HA SER A 120 -4.017 15.241 6.667 1.00 44.51 H new ATOM 0 HB2 SER A 120 -3.485 13.727 4.621 1.00 53.10 H new ATOM 0 HB3 SER A 120 -3.957 15.387 4.318 1.00 53.10 H new ATOM 0 HG SER A 120 -2.075 14.776 3.110 1.00 12.20 H new ATOM 1202 N ASN A 121 -2.281 13.997 8.279 1.00 63.42 N ATOM 1203 CA ASN A 121 -1.680 12.940 9.083 1.00 72.24 C ATOM 1204 C ASN A 121 -2.675 12.405 10.109 1.00 73.13 C ATOM 1205 O ASN A 121 -2.718 11.204 10.381 1.00 32.21 O ATOM 1206 CB ASN A 121 -0.428 13.460 9.793 1.00 53.41 C ATOM 1207 CG ASN A 121 0.493 12.339 10.235 1.00 23.32 C ATOM 1208 OD1 ASN A 121 0.247 11.680 11.244 1.00 2.44 O ATOM 1209 ND2 ASN A 121 1.562 12.119 9.479 1.00 72.54 N ATOM 0 H ASN A 121 -2.610 14.800 8.816 1.00 63.42 H new ATOM 0 HA ASN A 121 -1.399 12.125 8.416 1.00 72.24 H new ATOM 0 HB2 ASN A 121 0.114 14.130 9.125 1.00 53.41 H new ATOM 0 HB3 ASN A 121 -0.724 14.048 10.662 1.00 53.41 H new ATOM 0 HD21 ASN A 121 2.218 11.379 9.727 1.00 72.54 H new ATOM 0 HD22 ASN A 121 1.727 12.690 8.650 1.00 72.54 H new ATOM 1215 N THR A 122 -3.475 13.303 10.674 1.00 33.21 N ATOM 1216 CA THR A 122 -4.468 12.922 11.669 1.00 24.03 C ATOM 1217 C THR A 122 -5.442 11.892 11.109 1.00 62.22 C ATOM 1218 O THR A 122 -5.568 10.787 11.639 1.00 65.25 O ATOM 1219 CB THR A 122 -5.263 14.144 12.167 1.00 62.51 C ATOM 1220 OG1 THR A 122 -5.465 15.068 11.091 1.00 44.11 O ATOM 1221 CG2 THR A 122 -4.532 14.837 13.307 1.00 63.03 C ATOM 0 H THR A 122 -3.454 14.300 10.459 1.00 33.21 H new ATOM 0 HA THR A 122 -3.923 12.486 12.506 1.00 24.03 H new ATOM 0 HB THR A 122 -6.229 13.797 12.534 1.00 62.51 H new ATOM 0 HG1 THR A 122 -5.973 15.841 11.415 1.00 44.11 H new ATOM 0 HG21 THR A 122 -5.112 15.697 13.642 1.00 63.03 H new ATOM 0 HG22 THR A 122 -4.405 14.140 14.135 1.00 63.03 H new ATOM 0 HG23 THR A 122 -3.554 15.172 12.962 1.00 63.03 H new ATOM 1229 N THR A 123 -6.129 12.259 10.031 1.00 0.04 N ATOM 1230 CA THR A 123 -7.092 11.367 9.398 1.00 23.02 C ATOM 1231 C THR A 123 -6.438 10.050 8.994 1.00 63.41 C ATOM 1232 O THR A 123 -5.353 10.039 8.410 1.00 10.54 O ATOM 1233 CB THR A 123 -7.725 12.016 8.153 1.00 5.53 C ATOM 1234 OG1 THR A 123 -8.557 11.067 7.475 1.00 22.35 O ATOM 1235 CG2 THR A 123 -6.652 12.527 7.204 1.00 32.51 C ATOM 0 H THR A 123 -6.036 13.168 9.578 1.00 0.04 H new ATOM 0 HA THR A 123 -7.873 11.172 10.133 1.00 23.02 H new ATOM 0 HB THR A 123 -8.331 12.861 8.480 1.00 5.53 H new ATOM 0 HG1 THR A 123 -8.957 11.488 6.686 1.00 22.35 H new ATOM 0 HG21 THR A 123 -7.123 12.981 6.332 1.00 32.51 H new ATOM 0 HG22 THR A 123 -6.039 13.271 7.714 1.00 32.51 H new ATOM 0 HG23 THR A 123 -6.023 11.696 6.885 1.00 32.51 H new ATOM 1243 N ILE A 124 -7.105 8.944 9.306 1.00 71.22 N ATOM 1244 CA ILE A 124 -6.588 7.622 8.973 1.00 61.25 C ATOM 1245 C ILE A 124 -7.716 6.674 8.581 1.00 52.13 C ATOM 1246 O ILE A 124 -8.847 6.811 9.048 1.00 3.23 O ATOM 1247 CB ILE A 124 -5.805 7.011 10.149 1.00 24.34 C ATOM 1248 CG1 ILE A 124 -6.685 6.948 11.399 1.00 21.34 C ATOM 1249 CG2 ILE A 124 -4.544 7.818 10.423 1.00 61.13 C ATOM 1250 CD1 ILE A 124 -7.415 5.633 11.558 1.00 40.04 C ATOM 0 H ILE A 124 -8.004 8.937 9.788 1.00 71.22 H new ATOM 0 HA ILE A 124 -5.914 7.751 8.126 1.00 61.25 H new ATOM 0 HB ILE A 124 -5.512 5.996 9.882 1.00 24.34 H new ATOM 0 HG12 ILE A 124 -6.065 7.119 12.279 1.00 21.34 H new ATOM 0 HG13 ILE A 124 -7.414 7.757 11.361 1.00 21.34 H new ATOM 0 HG21 ILE A 124 -4.001 7.373 11.257 1.00 61.13 H new ATOM 0 HG22 ILE A 124 -3.911 7.816 9.536 1.00 61.13 H new ATOM 0 HG23 ILE A 124 -4.816 8.844 10.672 1.00 61.13 H new ATOM 0 HD11 ILE A 124 -8.019 5.660 12.465 1.00 40.04 H new ATOM 0 HD12 ILE A 124 -8.062 5.469 10.696 1.00 40.04 H new ATOM 0 HD13 ILE A 124 -6.691 4.821 11.628 1.00 40.04 H new ATOM 1261 N HIS A 125 -7.400 5.711 7.720 1.00 64.21 N ATOM 1262 CA HIS A 125 -8.387 4.737 7.267 1.00 4.11 C ATOM 1263 C HIS A 125 -7.831 3.319 7.357 1.00 63.05 C ATOM 1264 O HIS A 125 -6.653 3.086 7.089 1.00 45.50 O ATOM 1265 CB HIS A 125 -8.812 5.041 5.830 1.00 23.10 C ATOM 1266 CG HIS A 125 -7.690 5.525 4.963 1.00 1.55 C ATOM 1267 ND1 HIS A 125 -7.066 4.727 4.026 1.00 22.13 N ATOM 1268 CD2 HIS A 125 -7.081 6.731 4.894 1.00 3.22 C ATOM 1269 CE1 HIS A 125 -6.122 5.423 3.419 1.00 34.44 C ATOM 1270 NE2 HIS A 125 -6.109 6.642 3.928 1.00 42.45 N ATOM 0 H HIS A 125 -6.469 5.585 7.323 1.00 64.21 H new ATOM 0 HA HIS A 125 -9.258 4.809 7.918 1.00 4.11 H new ATOM 0 HB2 HIS A 125 -9.239 4.141 5.388 1.00 23.10 H new ATOM 0 HB3 HIS A 125 -9.600 5.794 5.844 1.00 23.10 H new ATOM 0 HD1 HIS A 125 -7.298 3.753 3.833 1.00 22.13 H new ATOM 0 HD2 HIS A 125 -7.316 7.602 5.488 1.00 3.22 H new ATOM 0 HE1 HIS A 125 -5.471 5.058 2.639 1.00 34.44 H new ATOM 1277 N ALA A 126 -8.688 2.376 7.734 1.00 22.11 N ATOM 1278 CA ALA A 126 -8.283 0.981 7.858 1.00 2.30 C ATOM 1279 C ALA A 126 -9.175 0.075 7.015 1.00 15.15 C ATOM 1280 O ALA A 126 -10.401 0.126 7.116 1.00 72.12 O ATOM 1281 CB ALA A 126 -8.316 0.549 9.316 1.00 5.45 C ATOM 0 H ALA A 126 -9.667 2.553 7.959 1.00 22.11 H new ATOM 0 HA ALA A 126 -7.262 0.890 7.487 1.00 2.30 H new ATOM 0 HB1 ALA A 126 -8.011 -0.495 9.393 1.00 5.45 H new ATOM 0 HB2 ALA A 126 -7.633 1.170 9.895 1.00 5.45 H new ATOM 0 HB3 ALA A 126 -9.328 0.661 9.706 1.00 5.45 H new ATOM 1287 N TYR A 127 -8.550 -0.754 6.185 1.00 3.11 N ATOM 1288 CA TYR A 127 -9.288 -1.669 5.322 1.00 13.35 C ATOM 1289 C TYR A 127 -9.603 -2.972 6.054 1.00 64.14 C ATOM 1290 O TYR A 127 -8.704 -3.743 6.389 1.00 43.03 O ATOM 1291 CB TYR A 127 -8.485 -1.966 4.054 1.00 42.54 C ATOM 1292 CG TYR A 127 -8.572 -0.872 3.014 1.00 41.43 C ATOM 1293 CD1 TYR A 127 -9.275 -1.065 1.831 1.00 45.51 C ATOM 1294 CD2 TYR A 127 -7.950 0.354 3.213 1.00 62.31 C ATOM 1295 CE1 TYR A 127 -9.357 -0.069 0.878 1.00 71.24 C ATOM 1296 CE2 TYR A 127 -8.028 1.357 2.266 1.00 51.34 C ATOM 1297 CZ TYR A 127 -8.732 1.140 1.100 1.00 72.22 C ATOM 1298 OH TYR A 127 -8.810 2.136 0.153 1.00 52.34 O ATOM 0 H TYR A 127 -7.536 -0.811 6.092 1.00 3.11 H new ATOM 0 HA TYR A 127 -10.228 -1.191 5.046 1.00 13.35 H new ATOM 0 HB2 TYR A 127 -7.440 -2.118 4.323 1.00 42.54 H new ATOM 0 HB3 TYR A 127 -8.841 -2.899 3.618 1.00 42.54 H new ATOM 0 HD1 TYR A 127 -9.766 -2.011 1.654 1.00 45.51 H new ATOM 0 HD2 TYR A 127 -7.396 0.526 4.124 1.00 62.31 H new ATOM 0 HE1 TYR A 127 -9.908 -0.236 -0.036 1.00 71.24 H new ATOM 0 HE2 TYR A 127 -7.541 2.305 2.438 1.00 51.34 H new ATOM 0 HH TYR A 127 -8.317 2.923 0.465 1.00 52.34 H new ATOM 1307 N PHE A 128 -10.888 -3.209 6.297 1.00 54.34 N ATOM 1308 CA PHE A 128 -11.324 -4.416 6.987 1.00 2.41 C ATOM 1309 C PHE A 128 -11.579 -5.549 5.997 1.00 71.34 C ATOM 1310 O PHE A 128 -12.214 -5.351 4.961 1.00 60.31 O ATOM 1311 CB PHE A 128 -12.593 -4.137 7.795 1.00 31.13 C ATOM 1312 CG PHE A 128 -12.906 -5.201 8.808 1.00 30.52 C ATOM 1313 CD1 PHE A 128 -12.642 -4.994 10.153 1.00 24.04 C ATOM 1314 CD2 PHE A 128 -13.463 -6.407 8.417 1.00 70.24 C ATOM 1315 CE1 PHE A 128 -12.928 -5.972 11.087 1.00 1.54 C ATOM 1316 CE2 PHE A 128 -13.751 -7.389 9.346 1.00 50.14 C ATOM 1317 CZ PHE A 128 -13.485 -7.170 10.683 1.00 13.13 C ATOM 0 H PHE A 128 -11.645 -2.581 6.026 1.00 54.34 H new ATOM 0 HA PHE A 128 -10.528 -4.722 7.666 1.00 2.41 H new ATOM 0 HB2 PHE A 128 -12.485 -3.180 8.306 1.00 31.13 H new ATOM 0 HB3 PHE A 128 -13.436 -4.039 7.110 1.00 31.13 H new ATOM 0 HD1 PHE A 128 -12.208 -4.059 10.475 1.00 24.04 H new ATOM 0 HD2 PHE A 128 -13.675 -6.583 7.373 1.00 70.24 H new ATOM 0 HE1 PHE A 128 -12.716 -5.800 12.132 1.00 1.54 H new ATOM 0 HE2 PHE A 128 -14.183 -8.326 9.027 1.00 50.14 H new ATOM 0 HZ PHE A 128 -13.712 -7.934 11.412 1.00 13.13 H new ATOM 1326 N ARG A 129 -11.077 -6.735 6.323 1.00 55.02 N ATOM 1327 CA ARG A 129 -11.247 -7.900 5.461 1.00 63.24 C ATOM 1328 C ARG A 129 -12.242 -8.885 6.069 1.00 73.41 C ATOM 1329 O ARG A 129 -12.231 -9.130 7.275 1.00 74.10 O ATOM 1330 CB ARG A 129 -9.902 -8.592 5.231 1.00 5.04 C ATOM 1331 CG ARG A 129 -9.863 -9.444 3.972 1.00 23.14 C ATOM 1332 CD ARG A 129 -8.441 -9.628 3.470 1.00 74.54 C ATOM 1333 NE ARG A 129 -8.024 -8.536 2.593 1.00 44.22 N ATOM 1334 CZ ARG A 129 -6.763 -8.322 2.233 1.00 10.30 C ATOM 1335 NH1 ARG A 129 -5.801 -9.122 2.672 1.00 75.23 N ATOM 1336 NH2 ARG A 129 -6.463 -7.308 1.433 1.00 21.12 N ATOM 0 H ARG A 129 -10.549 -6.915 7.177 1.00 55.02 H new ATOM 0 HA ARG A 129 -11.640 -7.558 4.503 1.00 63.24 H new ATOM 0 HB2 ARG A 129 -9.119 -7.836 5.172 1.00 5.04 H new ATOM 0 HB3 ARG A 129 -9.674 -9.220 6.092 1.00 5.04 H new ATOM 0 HG2 ARG A 129 -10.307 -10.418 4.176 1.00 23.14 H new ATOM 0 HG3 ARG A 129 -10.467 -8.975 3.195 1.00 23.14 H new ATOM 0 HD2 ARG A 129 -7.762 -9.690 4.320 1.00 74.54 H new ATOM 0 HD3 ARG A 129 -8.366 -10.573 2.933 1.00 74.54 H new ATOM 0 HE ARG A 129 -8.741 -7.903 2.238 1.00 44.22 H new ATOM 0 HH11 ARG A 129 -6.028 -9.903 3.287 1.00 75.23 H new ATOM 0 HH12 ARG A 129 -4.834 -8.956 2.395 1.00 75.23 H new ATOM 0 HH21 ARG A 129 -7.201 -6.691 1.093 1.00 21.12 H new ATOM 0 HH22 ARG A 129 -5.495 -7.145 1.158 1.00 21.12 H new ATOM 1347 N LYS A 130 -13.101 -9.446 5.224 1.00 23.04 N ATOM 1348 CA LYS A 130 -14.102 -10.405 5.677 1.00 42.31 C ATOM 1349 C LYS A 130 -13.442 -11.607 6.345 1.00 23.41 C ATOM 1350 O LYS A 130 -12.229 -11.622 6.557 1.00 70.01 O ATOM 1351 CB LYS A 130 -14.961 -10.871 4.499 1.00 73.25 C ATOM 1352 CG LYS A 130 -14.325 -11.987 3.687 1.00 43.12 C ATOM 1353 CD LYS A 130 -12.910 -11.632 3.263 1.00 13.13 C ATOM 1354 CE LYS A 130 -12.290 -12.734 2.418 1.00 72.33 C ATOM 1355 NZ LYS A 130 -10.812 -12.802 2.593 1.00 63.44 N ATOM 0 H LYS A 130 -13.124 -9.253 4.223 1.00 23.04 H new ATOM 0 HA LYS A 130 -14.738 -9.909 6.410 1.00 42.31 H new ATOM 0 HB2 LYS A 130 -15.926 -11.211 4.876 1.00 73.25 H new ATOM 0 HB3 LYS A 130 -15.156 -10.022 3.844 1.00 73.25 H new ATOM 0 HG2 LYS A 130 -14.310 -12.904 4.276 1.00 43.12 H new ATOM 0 HG3 LYS A 130 -14.931 -12.186 2.803 1.00 43.12 H new ATOM 0 HD2 LYS A 130 -12.921 -10.700 2.697 1.00 13.13 H new ATOM 0 HD3 LYS A 130 -12.296 -11.461 4.147 1.00 13.13 H new ATOM 0 HE2 LYS A 130 -12.732 -13.692 2.690 1.00 72.33 H new ATOM 0 HE3 LYS A 130 -12.524 -12.561 1.367 1.00 72.33 H new ATOM 0 HZ1 LYS A 130 -10.427 -13.565 2.001 1.00 63.44 H new ATOM 0 HZ2 LYS A 130 -10.387 -11.896 2.310 1.00 63.44 H new ATOM 0 HZ3 LYS A 130 -10.589 -12.992 3.591 1.00 63.44 H new ATOM 1365 N ASP A 131 -14.247 -12.611 6.673 1.00 54.51 N ATOM 1366 CA ASP A 131 -13.740 -13.819 7.314 1.00 42.12 C ATOM 1367 C ASP A 131 -13.955 -15.039 6.424 1.00 3.22 C ATOM 1368 O ASP A 131 -12.997 -15.655 5.957 1.00 52.32 O ATOM 1369 CB ASP A 131 -14.425 -14.030 8.665 1.00 2.22 C ATOM 1370 CG ASP A 131 -13.744 -15.097 9.499 1.00 0.15 C ATOM 1371 OD1 ASP A 131 -14.073 -16.289 9.322 1.00 0.42 O ATOM 1372 OD2 ASP A 131 -12.882 -14.741 10.328 1.00 25.13 O ATOM 0 H ASP A 131 -15.253 -12.613 6.506 1.00 54.51 H new ATOM 0 HA ASP A 131 -12.669 -13.694 7.474 1.00 42.12 H new ATOM 0 HB2 ASP A 131 -14.431 -13.090 9.217 1.00 2.22 H new ATOM 0 HB3 ASP A 131 -15.466 -14.310 8.502 1.00 2.22 H new ATOM 1376 N TRP A 132 -15.217 -15.382 6.195 1.00 62.20 N ATOM 1377 CA TRP A 132 -15.558 -16.529 5.362 1.00 40.34 C ATOM 1378 C TRP A 132 -15.911 -16.088 3.945 1.00 33.24 C ATOM 1379 O TRP A 132 -15.424 -16.658 2.969 1.00 52.44 O ATOM 1380 CB TRP A 132 -16.728 -17.302 5.974 1.00 25.41 C ATOM 1381 CG TRP A 132 -16.790 -18.733 5.534 1.00 52.23 C ATOM 1382 CD1 TRP A 132 -15.910 -19.727 5.851 1.00 34.43 C ATOM 1383 CD2 TRP A 132 -17.786 -19.329 4.695 1.00 20.15 C ATOM 1384 NE1 TRP A 132 -16.297 -20.905 5.260 1.00 10.53 N ATOM 1385 CE2 TRP A 132 -17.446 -20.688 4.547 1.00 40.22 C ATOM 1386 CE3 TRP A 132 -18.933 -18.847 4.059 1.00 55.51 C ATOM 1387 CZ2 TRP A 132 -18.211 -21.567 3.785 1.00 22.13 C ATOM 1388 CZ3 TRP A 132 -19.691 -19.723 3.303 1.00 64.32 C ATOM 1389 CH2 TRP A 132 -19.328 -21.069 3.172 1.00 3.55 C ATOM 0 H TRP A 132 -16.021 -14.882 6.574 1.00 62.20 H new ATOM 0 HA TRP A 132 -14.686 -17.182 5.313 1.00 40.34 H new ATOM 0 HB2 TRP A 132 -16.649 -17.267 7.061 1.00 25.41 H new ATOM 0 HB3 TRP A 132 -17.661 -16.806 5.706 1.00 25.41 H new ATOM 0 HD1 TRP A 132 -15.037 -19.605 6.475 1.00 34.43 H new ATOM 0 HE1 TRP A 132 -15.808 -21.797 5.339 1.00 10.53 H new ATOM 0 HE3 TRP A 132 -19.222 -17.811 4.156 1.00 55.51 H new ATOM 0 HZ2 TRP A 132 -17.932 -22.605 3.682 1.00 22.13 H new ATOM 0 HZ3 TRP A 132 -20.579 -19.362 2.805 1.00 64.32 H new ATOM 0 HH2 TRP A 132 -19.942 -21.727 2.575 1.00 3.55 H new ATOM 1399 N SER A 133 -16.758 -15.069 3.840 1.00 12.34 N ATOM 1400 CA SER A 133 -17.177 -14.554 2.542 1.00 2.24 C ATOM 1401 C SER A 133 -15.984 -14.015 1.761 1.00 21.11 C ATOM 1402 O SER A 133 -14.833 -14.325 2.070 1.00 61.42 O ATOM 1403 CB SER A 133 -18.224 -13.453 2.722 1.00 52.42 C ATOM 1404 OG SER A 133 -19.001 -13.672 3.886 1.00 22.43 O ATOM 0 H SER A 133 -17.167 -14.584 4.638 1.00 12.34 H new ATOM 0 HA SER A 133 -17.617 -15.375 1.977 1.00 2.24 H new ATOM 0 HB2 SER A 133 -17.729 -12.484 2.789 1.00 52.42 H new ATOM 0 HB3 SER A 133 -18.875 -13.419 1.848 1.00 52.42 H new ATOM 0 HG SER A 133 -18.584 -13.218 4.648 1.00 22.43 H new ATOM 1409 N ASP A 134 -16.267 -13.205 0.746 1.00 21.41 N ATOM 1410 CA ASP A 134 -15.218 -12.620 -0.081 1.00 22.42 C ATOM 1411 C ASP A 134 -15.484 -11.138 -0.330 1.00 14.52 C ATOM 1412 O ASP A 134 -15.814 -10.735 -1.445 1.00 30.22 O ATOM 1413 CB ASP A 134 -15.114 -13.364 -1.414 1.00 5.10 C ATOM 1414 CG ASP A 134 -16.474 -13.698 -1.995 1.00 53.41 C ATOM 1415 OD1 ASP A 134 -17.275 -12.765 -2.207 1.00 71.25 O ATOM 1416 OD2 ASP A 134 -16.738 -14.895 -2.238 1.00 33.43 O ATOM 0 H ASP A 134 -17.214 -12.939 0.476 1.00 21.41 H new ATOM 0 HA ASP A 134 -14.273 -12.716 0.454 1.00 22.42 H new ATOM 0 HB2 ASP A 134 -14.557 -12.754 -2.125 1.00 5.10 H new ATOM 0 HB3 ASP A 134 -14.547 -14.284 -1.271 1.00 5.10 H new ATOM 1420 N LYS A 135 -15.340 -10.333 0.717 1.00 45.23 N ATOM 1421 CA LYS A 135 -15.565 -8.897 0.613 1.00 64.42 C ATOM 1422 C LYS A 135 -14.639 -8.131 1.554 1.00 53.20 C ATOM 1423 O LYS A 135 -13.974 -8.724 2.404 1.00 41.42 O ATOM 1424 CB LYS A 135 -17.023 -8.563 0.935 1.00 64.14 C ATOM 1425 CG LYS A 135 -17.422 -8.895 2.362 1.00 43.44 C ATOM 1426 CD LYS A 135 -18.928 -9.056 2.497 1.00 72.43 C ATOM 1427 CE LYS A 135 -19.421 -10.303 1.780 1.00 63.44 C ATOM 1428 NZ LYS A 135 -20.147 -9.970 0.523 1.00 63.43 N ATOM 0 H LYS A 135 -15.068 -10.651 1.647 1.00 45.23 H new ATOM 0 HA LYS A 135 -15.346 -8.595 -0.411 1.00 64.42 H new ATOM 0 HB2 LYS A 135 -17.191 -7.501 0.757 1.00 64.14 H new ATOM 0 HB3 LYS A 135 -17.672 -9.108 0.249 1.00 64.14 H new ATOM 0 HG2 LYS A 135 -16.927 -9.815 2.674 1.00 43.44 H new ATOM 0 HG3 LYS A 135 -17.078 -8.105 3.030 1.00 43.44 H new ATOM 0 HD2 LYS A 135 -19.196 -9.112 3.552 1.00 72.43 H new ATOM 0 HD3 LYS A 135 -19.427 -8.178 2.087 1.00 72.43 H new ATOM 0 HE2 LYS A 135 -18.573 -10.948 1.550 1.00 63.44 H new ATOM 0 HE3 LYS A 135 -20.080 -10.866 2.442 1.00 63.44 H new ATOM 0 HZ1 LYS A 135 -19.929 -10.682 -0.203 1.00 63.43 H new ATOM 0 HZ2 LYS A 135 -21.171 -9.963 0.705 1.00 63.43 H new ATOM 0 HZ3 LYS A 135 -19.848 -9.032 0.188 1.00 63.43 H new ATOM 1438 N ALA A 136 -14.600 -6.812 1.395 1.00 1.21 N ATOM 1439 CA ALA A 136 -13.757 -5.967 2.232 1.00 45.22 C ATOM 1440 C ALA A 136 -14.457 -4.653 2.564 1.00 4.15 C ATOM 1441 O ALA A 136 -14.931 -3.947 1.673 1.00 71.14 O ATOM 1442 CB ALA A 136 -12.428 -5.700 1.544 1.00 21.43 C ATOM 0 H ALA A 136 -15.142 -6.306 0.695 1.00 1.21 H new ATOM 0 HA ALA A 136 -13.569 -6.495 3.167 1.00 45.22 H new ATOM 0 HB1 ALA A 136 -11.809 -5.068 2.181 1.00 21.43 H new ATOM 0 HB2 ALA A 136 -11.916 -6.645 1.363 1.00 21.43 H new ATOM 0 HB3 ALA A 136 -12.605 -5.196 0.594 1.00 21.43 H new ATOM 1448 N LEU A 137 -14.519 -4.330 3.852 1.00 74.13 N ATOM 1449 CA LEU A 137 -15.162 -3.100 4.302 1.00 20.32 C ATOM 1450 C LEU A 137 -14.123 -2.068 4.729 1.00 33.45 C ATOM 1451 O LEU A 137 -13.369 -2.285 5.679 1.00 41.33 O ATOM 1452 CB LEU A 137 -16.112 -3.394 5.463 1.00 53.30 C ATOM 1453 CG LEU A 137 -17.416 -2.595 5.482 1.00 70.30 C ATOM 1454 CD1 LEU A 137 -17.134 -1.110 5.313 1.00 45.21 C ATOM 1455 CD2 LEU A 137 -18.359 -3.088 4.393 1.00 44.21 C ATOM 0 H LEU A 137 -14.132 -4.902 4.602 1.00 74.13 H new ATOM 0 HA LEU A 137 -15.733 -2.691 3.468 1.00 20.32 H new ATOM 0 HB2 LEU A 137 -16.360 -4.455 5.444 1.00 53.30 H new ATOM 0 HB3 LEU A 137 -15.581 -3.208 6.397 1.00 53.30 H new ATOM 0 HG LEU A 137 -17.898 -2.745 6.448 1.00 70.30 H new ATOM 0 HD11 LEU A 137 -18.073 -0.557 5.329 1.00 45.21 H new ATOM 0 HD12 LEU A 137 -16.496 -0.766 6.127 1.00 45.21 H new ATOM 0 HD13 LEU A 137 -16.630 -0.941 4.361 1.00 45.21 H new ATOM 0 HD21 LEU A 137 -19.282 -2.508 4.421 1.00 44.21 H new ATOM 0 HD22 LEU A 137 -17.885 -2.968 3.419 1.00 44.21 H new ATOM 0 HD23 LEU A 137 -18.587 -4.141 4.558 1.00 44.21 H new ATOM 1466 N LYS A 138 -14.088 -0.943 4.023 1.00 50.15 N ATOM 1467 CA LYS A 138 -13.145 0.125 4.330 1.00 41.25 C ATOM 1468 C LYS A 138 -13.746 1.112 5.325 1.00 3.32 C ATOM 1469 O LYS A 138 -14.745 1.771 5.035 1.00 72.34 O ATOM 1470 CB LYS A 138 -12.740 0.859 3.050 1.00 40.11 C ATOM 1471 CG LYS A 138 -11.415 1.594 3.163 1.00 50.44 C ATOM 1472 CD LYS A 138 -11.319 2.727 2.155 1.00 33.42 C ATOM 1473 CE LYS A 138 -12.143 3.930 2.588 1.00 41.42 C ATOM 1474 NZ LYS A 138 -11.414 4.779 3.568 1.00 25.21 N ATOM 0 H LYS A 138 -14.703 -0.747 3.233 1.00 50.15 H new ATOM 0 HA LYS A 138 -12.260 -0.324 4.780 1.00 41.25 H new ATOM 0 HB2 LYS A 138 -12.679 0.140 2.233 1.00 40.11 H new ATOM 0 HB3 LYS A 138 -13.521 1.573 2.788 1.00 40.11 H new ATOM 0 HG2 LYS A 138 -11.304 1.992 4.171 1.00 50.44 H new ATOM 0 HG3 LYS A 138 -10.595 0.894 3.004 1.00 50.44 H new ATOM 0 HD2 LYS A 138 -10.277 3.022 2.036 1.00 33.42 H new ATOM 0 HD3 LYS A 138 -11.665 2.379 1.181 1.00 33.42 H new ATOM 0 HE2 LYS A 138 -12.402 4.526 1.713 1.00 41.42 H new ATOM 0 HE3 LYS A 138 -13.079 3.589 3.029 1.00 41.42 H new ATOM 0 HZ1 LYS A 138 -12.010 5.588 3.838 1.00 25.21 H new ATOM 0 HZ2 LYS A 138 -11.189 4.218 4.414 1.00 25.21 H new ATOM 0 HZ3 LYS A 138 -10.533 5.126 3.139 1.00 25.21 H new ATOM 1484 N ILE A 139 -13.132 1.210 6.500 1.00 12.22 N ATOM 1485 CA ILE A 139 -13.605 2.118 7.537 1.00 72.33 C ATOM 1486 C ILE A 139 -12.635 3.277 7.736 1.00 21.25 C ATOM 1487 O ILE A 139 -11.424 3.119 7.582 1.00 71.44 O ATOM 1488 CB ILE A 139 -13.800 1.388 8.879 1.00 75.35 C ATOM 1489 CG1 ILE A 139 -14.399 2.338 9.918 1.00 70.41 C ATOM 1490 CG2 ILE A 139 -12.476 0.822 9.370 1.00 5.12 C ATOM 1491 CD1 ILE A 139 -15.248 1.639 10.957 1.00 32.54 C ATOM 0 H ILE A 139 -12.305 0.671 6.757 1.00 12.22 H new ATOM 0 HA ILE A 139 -14.567 2.506 7.202 1.00 72.33 H new ATOM 0 HB ILE A 139 -14.493 0.560 8.730 1.00 75.35 H new ATOM 0 HG12 ILE A 139 -13.591 2.871 10.419 1.00 70.41 H new ATOM 0 HG13 ILE A 139 -15.006 3.086 9.408 1.00 70.41 H new ATOM 0 HG21 ILE A 139 -12.629 0.309 10.319 1.00 5.12 H new ATOM 0 HG22 ILE A 139 -12.087 0.117 8.635 1.00 5.12 H new ATOM 0 HG23 ILE A 139 -11.762 1.634 9.508 1.00 5.12 H new ATOM 0 HD11 ILE A 139 -15.640 2.373 11.661 1.00 32.54 H new ATOM 0 HD12 ILE A 139 -16.077 1.129 10.466 1.00 32.54 H new ATOM 0 HD13 ILE A 139 -14.640 0.911 11.494 1.00 32.54 H new ATOM 1502 N ASP A 140 -13.175 4.440 8.083 1.00 64.51 N ATOM 1503 CA ASP A 140 -12.356 5.626 8.308 1.00 1.31 C ATOM 1504 C ASP A 140 -12.408 6.052 9.772 1.00 63.42 C ATOM 1505 O ASP A 140 -13.464 6.011 10.405 1.00 32.03 O ATOM 1506 CB ASP A 140 -12.828 6.774 7.414 1.00 72.12 C ATOM 1507 CG ASP A 140 -14.335 6.803 7.254 1.00 23.23 C ATOM 1508 OD1 ASP A 140 -15.040 6.457 8.224 1.00 13.34 O ATOM 1509 OD2 ASP A 140 -14.809 7.171 6.158 1.00 22.45 O ATOM 0 H ASP A 140 -14.176 4.587 8.215 1.00 64.51 H new ATOM 0 HA ASP A 140 -11.325 5.379 8.056 1.00 1.31 H new ATOM 0 HB2 ASP A 140 -12.492 7.721 7.837 1.00 72.12 H new ATOM 0 HB3 ASP A 140 -12.363 6.681 6.432 1.00 72.12 H new ATOM 1513 N LEU A 141 -11.262 6.461 10.304 1.00 14.13 N ATOM 1514 CA LEU A 141 -11.175 6.893 11.695 1.00 62.45 C ATOM 1515 C LEU A 141 -10.361 8.178 11.816 1.00 12.00 C ATOM 1516 O LEU A 141 -9.552 8.496 10.945 1.00 13.14 O ATOM 1517 CB LEU A 141 -10.545 5.795 12.554 1.00 52.23 C ATOM 1518 CG LEU A 141 -11.378 5.310 13.741 1.00 44.15 C ATOM 1519 CD1 LEU A 141 -12.733 4.805 13.272 1.00 50.22 C ATOM 1520 CD2 LEU A 141 -10.636 4.224 14.505 1.00 10.24 C ATOM 0 H LEU A 141 -10.380 6.503 9.794 1.00 14.13 H new ATOM 0 HA LEU A 141 -12.186 7.089 12.052 1.00 62.45 H new ATOM 0 HB2 LEU A 141 -10.329 4.940 11.914 1.00 52.23 H new ATOM 0 HB3 LEU A 141 -9.590 6.160 12.931 1.00 52.23 H new ATOM 0 HG LEU A 141 -11.541 6.152 14.414 1.00 44.15 H new ATOM 0 HD11 LEU A 141 -13.311 4.464 14.131 1.00 50.22 H new ATOM 0 HD12 LEU A 141 -13.268 5.611 12.771 1.00 50.22 H new ATOM 0 HD13 LEU A 141 -12.592 3.977 12.578 1.00 50.22 H new ATOM 0 HD21 LEU A 141 -11.244 3.891 15.346 1.00 10.24 H new ATOM 0 HD22 LEU A 141 -10.441 3.381 13.842 1.00 10.24 H new ATOM 0 HD23 LEU A 141 -9.691 4.621 14.875 1.00 10.24 H new ATOM 1531 N MET A 142 -10.581 8.911 12.902 1.00 71.43 N ATOM 1532 CA MET A 142 -9.865 10.160 13.138 1.00 54.00 C ATOM 1533 C MET A 142 -9.607 10.365 14.628 1.00 44.13 C ATOM 1534 O MET A 142 -10.289 9.801 15.483 1.00 5.21 O ATOM 1535 CB MET A 142 -10.659 11.341 12.579 1.00 63.53 C ATOM 1536 CG MET A 142 -12.155 11.244 12.834 1.00 60.25 C ATOM 1537 SD MET A 142 -13.061 12.668 12.201 1.00 44.44 S ATOM 1538 CE MET A 142 -13.706 13.362 13.721 1.00 51.51 C ATOM 0 H MET A 142 -11.248 8.663 13.632 1.00 71.43 H new ATOM 0 HA MET A 142 -8.905 10.102 12.625 1.00 54.00 H new ATOM 0 HB2 MET A 142 -10.282 12.263 13.022 1.00 63.53 H new ATOM 0 HB3 MET A 142 -10.486 11.409 11.505 1.00 63.53 H new ATOM 0 HG2 MET A 142 -12.541 10.337 12.369 1.00 60.25 H new ATOM 0 HG3 MET A 142 -12.332 11.153 13.906 1.00 60.25 H new ATOM 0 HE1 MET A 142 -14.292 14.253 13.494 1.00 51.51 H new ATOM 0 HE2 MET A 142 -14.340 12.627 14.216 1.00 51.51 H new ATOM 0 HE3 MET A 142 -12.879 13.629 14.379 1.00 51.51 H new ATOM 1546 N PRO A 143 -8.599 11.190 14.946 1.00 3.12 N ATOM 1547 CA PRO A 143 -8.228 11.489 16.332 1.00 12.15 C ATOM 1548 C PRO A 143 -9.278 12.337 17.043 1.00 33.50 C ATOM 1549 O PRO A 143 -10.342 12.617 16.491 1.00 1.24 O ATOM 1550 CB PRO A 143 -6.918 12.268 16.190 1.00 14.10 C ATOM 1551 CG PRO A 143 -6.984 12.874 14.831 1.00 32.21 C ATOM 1552 CD PRO A 143 -7.744 11.896 13.978 1.00 74.51 C ATOM 0 HA PRO A 143 -8.138 10.584 16.933 1.00 12.15 H new ATOM 0 HB2 PRO A 143 -6.827 13.033 16.961 1.00 14.10 H new ATOM 0 HB3 PRO A 143 -6.054 11.611 16.289 1.00 14.10 H new ATOM 0 HG2 PRO A 143 -7.487 13.841 14.859 1.00 32.21 H new ATOM 0 HG3 PRO A 143 -5.985 13.046 14.431 1.00 32.21 H new ATOM 0 HD2 PRO A 143 -8.335 12.403 13.215 1.00 74.51 H new ATOM 0 HD3 PRO A 143 -7.074 11.210 13.459 1.00 74.51 H new ATOM 1557 N HIS A 144 -8.970 12.744 18.271 1.00 63.43 N ATOM 1558 CA HIS A 144 -9.887 13.563 19.057 1.00 14.13 C ATOM 1559 C HIS A 144 -10.334 14.789 18.267 1.00 40.12 C ATOM 1560 O HIS A 144 -9.516 15.482 17.663 1.00 41.04 O ATOM 1561 CB HIS A 144 -9.224 13.997 20.364 1.00 72.51 C ATOM 1562 CG HIS A 144 -9.264 12.950 21.434 1.00 54.33 C ATOM 1563 ND1 HIS A 144 -10.374 12.170 21.681 1.00 73.31 N ATOM 1564 CD2 HIS A 144 -8.322 12.554 22.322 1.00 32.41 C ATOM 1565 CE1 HIS A 144 -10.113 11.340 22.676 1.00 64.41 C ATOM 1566 NE2 HIS A 144 -8.875 11.553 23.083 1.00 71.40 N ATOM 0 H HIS A 144 -8.094 12.520 18.743 1.00 63.43 H new ATOM 0 HA HIS A 144 -10.766 12.961 19.287 1.00 14.13 H new ATOM 0 HB2 HIS A 144 -8.185 14.261 20.164 1.00 72.51 H new ATOM 0 HB3 HIS A 144 -9.717 14.898 20.730 1.00 72.51 H new ATOM 0 HD2 HIS A 144 -7.322 12.951 22.415 1.00 32.41 H new ATOM 0 HE1 HIS A 144 -10.796 10.611 23.086 1.00 64.41 H new ATOM 0 HE2 HIS A 144 -8.406 11.055 23.839 1.00 71.40 H new ATOM 1930 N THR A 169 -15.661 11.941 9.810 1.00 35.32 N ATOM 1931 CA THR A 169 -15.306 10.876 8.880 1.00 2.13 C ATOM 1932 C THR A 169 -16.355 10.731 7.784 1.00 73.43 C ATOM 1933 O THR A 169 -17.379 11.412 7.798 1.00 24.00 O ATOM 1934 CB THR A 169 -15.149 9.527 9.605 1.00 31.25 C ATOM 1935 OG1 THR A 169 -16.020 9.476 10.741 1.00 3.01 O ATOM 1936 CG2 THR A 169 -13.710 9.317 10.054 1.00 61.43 C ATOM 0 HA THR A 169 -14.352 11.153 8.432 1.00 2.13 H new ATOM 0 HB THR A 169 -15.415 8.733 8.907 1.00 31.25 H new ATOM 0 HG1 THR A 169 -16.310 10.383 10.972 1.00 3.01 H new ATOM 0 HG21 THR A 169 -13.624 8.357 10.564 1.00 61.43 H new ATOM 0 HG22 THR A 169 -13.053 9.326 9.185 1.00 61.43 H new ATOM 0 HG23 THR A 169 -13.421 10.117 10.736 1.00 61.43 H new ATOM 1944 N GLY A 170 -16.092 9.839 6.833 1.00 22.10 N ATOM 1945 CA GLY A 170 -17.024 9.621 5.743 1.00 72.43 C ATOM 1946 C GLY A 170 -17.640 8.237 5.774 1.00 3.43 C ATOM 1947 O GLY A 170 -17.360 7.430 6.660 1.00 10.55 O ATOM 0 H GLY A 170 -15.250 9.264 6.799 1.00 22.10 H new ATOM 0 HA2 GLY A 170 -17.816 10.369 5.791 1.00 72.43 H new ATOM 0 HA3 GLY A 170 -16.508 9.764 4.794 1.00 72.43 H new ATOM 1951 N PRO A 171 -18.502 7.947 4.789 1.00 51.44 N ATOM 1952 CA PRO A 171 -19.179 6.651 4.685 1.00 13.35 C ATOM 1953 C PRO A 171 -18.221 5.524 4.313 1.00 40.12 C ATOM 1954 O PRO A 171 -17.342 5.698 3.469 1.00 40.31 O ATOM 1955 CB PRO A 171 -20.203 6.872 3.570 1.00 11.02 C ATOM 1956 CG PRO A 171 -19.631 7.972 2.744 1.00 2.42 C ATOM 1957 CD PRO A 171 -18.883 8.861 3.698 1.00 12.24 C ATOM 0 HA PRO A 171 -19.621 6.346 5.633 1.00 13.35 H new ATOM 0 HB2 PRO A 171 -20.347 5.967 2.980 1.00 11.02 H new ATOM 0 HB3 PRO A 171 -21.177 7.146 3.975 1.00 11.02 H new ATOM 0 HG2 PRO A 171 -18.966 7.578 1.976 1.00 2.42 H new ATOM 0 HG3 PRO A 171 -20.418 8.525 2.231 1.00 2.42 H new ATOM 0 HD2 PRO A 171 -18.009 9.311 3.227 1.00 12.24 H new ATOM 0 HD3 PRO A 171 -19.507 9.679 4.058 1.00 12.24 H new ATOM 1962 N ALA A 172 -18.396 4.369 4.947 1.00 63.23 N ATOM 1963 CA ALA A 172 -17.549 3.214 4.679 1.00 74.24 C ATOM 1964 C ALA A 172 -17.605 2.822 3.206 1.00 12.44 C ATOM 1965 O ALA A 172 -18.546 3.174 2.495 1.00 31.10 O ATOM 1966 CB ALA A 172 -17.962 2.042 5.557 1.00 71.01 C ATOM 0 H ALA A 172 -19.117 4.209 5.650 1.00 63.23 H new ATOM 0 HA ALA A 172 -16.520 3.485 4.916 1.00 74.24 H new ATOM 0 HB1 ALA A 172 -17.321 1.186 5.346 1.00 71.01 H new ATOM 0 HB2 ALA A 172 -17.862 2.320 6.606 1.00 71.01 H new ATOM 0 HB3 ALA A 172 -18.999 1.779 5.348 1.00 71.01 H new ATOM 1972 N VAL A 173 -16.592 2.089 2.755 1.00 32.41 N ATOM 1973 CA VAL A 173 -16.527 1.648 1.367 1.00 32.32 C ATOM 1974 C VAL A 173 -16.456 0.127 1.276 1.00 23.42 C ATOM 1975 O VAL A 173 -15.456 -0.481 1.657 1.00 40.04 O ATOM 1976 CB VAL A 173 -15.308 2.251 0.643 1.00 4.30 C ATOM 1977 CG1 VAL A 173 -15.372 1.955 -0.847 1.00 74.20 C ATOM 1978 CG2 VAL A 173 -15.227 3.749 0.894 1.00 44.22 C ATOM 0 H VAL A 173 -15.805 1.788 3.331 1.00 32.41 H new ATOM 0 HA VAL A 173 -17.439 1.996 0.881 1.00 32.32 H new ATOM 0 HB VAL A 173 -14.405 1.789 1.042 1.00 4.30 H new ATOM 0 HG11 VAL A 173 -14.503 2.389 -1.342 1.00 74.20 H new ATOM 0 HG12 VAL A 173 -15.378 0.876 -1.004 1.00 74.20 H new ATOM 0 HG13 VAL A 173 -16.281 2.388 -1.265 1.00 74.20 H new ATOM 0 HG21 VAL A 173 -14.360 4.158 0.375 1.00 44.22 H new ATOM 0 HG22 VAL A 173 -16.132 4.230 0.523 1.00 44.22 H new ATOM 0 HG23 VAL A 173 -15.130 3.934 1.964 1.00 44.22 H new ATOM 1988 N GLU A 174 -17.525 -0.480 0.770 1.00 52.12 N ATOM 1989 CA GLU A 174 -17.584 -1.930 0.629 1.00 3.23 C ATOM 1990 C GLU A 174 -17.214 -2.355 -0.788 1.00 74.42 C ATOM 1991 O GLU A 174 -17.776 -1.859 -1.764 1.00 61.42 O ATOM 1992 CB GLU A 174 -18.983 -2.441 0.979 1.00 11.40 C ATOM 1993 CG GLU A 174 -20.097 -1.717 0.241 1.00 2.32 C ATOM 1994 CD GLU A 174 -21.210 -2.650 -0.196 1.00 11.30 C ATOM 1995 OE1 GLU A 174 -22.126 -2.903 0.615 1.00 60.44 O ATOM 1996 OE2 GLU A 174 -21.164 -3.127 -1.349 1.00 34.13 O ATOM 0 H GLU A 174 -18.361 0.010 0.451 1.00 52.12 H new ATOM 0 HA GLU A 174 -16.862 -2.367 1.319 1.00 3.23 H new ATOM 0 HB2 GLU A 174 -19.039 -3.505 0.751 1.00 11.40 H new ATOM 0 HB3 GLU A 174 -19.141 -2.336 2.052 1.00 11.40 H new ATOM 0 HG2 GLU A 174 -20.510 -0.941 0.886 1.00 2.32 H new ATOM 0 HG3 GLU A 174 -19.683 -1.217 -0.634 1.00 2.32 H new ATOM 2001 N VAL A 175 -16.262 -3.278 -0.893 1.00 50.44 N ATOM 2002 CA VAL A 175 -15.816 -3.771 -2.192 1.00 24.43 C ATOM 2003 C VAL A 175 -15.288 -5.197 -2.085 1.00 62.04 C ATOM 2004 O VAL A 175 -14.698 -5.578 -1.074 1.00 2.10 O ATOM 2005 CB VAL A 175 -14.717 -2.871 -2.786 1.00 42.04 C ATOM 2006 CG1 VAL A 175 -13.449 -2.952 -1.950 1.00 14.01 C ATOM 2007 CG2 VAL A 175 -14.438 -3.255 -4.231 1.00 40.33 C ATOM 0 H VAL A 175 -15.785 -3.699 -0.095 1.00 50.44 H new ATOM 0 HA VAL A 175 -16.683 -3.756 -2.852 1.00 24.43 H new ATOM 0 HB VAL A 175 -15.069 -1.839 -2.769 1.00 42.04 H new ATOM 0 HG11 VAL A 175 -12.684 -2.309 -2.386 1.00 14.01 H new ATOM 0 HG12 VAL A 175 -13.662 -2.624 -0.933 1.00 14.01 H new ATOM 0 HG13 VAL A 175 -13.091 -3.981 -1.932 1.00 14.01 H new ATOM 0 HG21 VAL A 175 -13.659 -2.609 -4.635 1.00 40.33 H new ATOM 0 HG22 VAL A 175 -14.108 -4.293 -4.274 1.00 40.33 H new ATOM 0 HG23 VAL A 175 -15.348 -3.139 -4.820 1.00 40.33 H new ATOM 2017 N ASP A 176 -15.503 -5.981 -3.135 1.00 73.13 N ATOM 2018 CA ASP A 176 -15.046 -7.366 -3.161 1.00 45.44 C ATOM 2019 C ASP A 176 -13.524 -7.436 -3.242 1.00 3.32 C ATOM 2020 O ASP A 176 -12.917 -6.917 -4.179 1.00 3.43 O ATOM 2021 CB ASP A 176 -15.667 -8.107 -4.347 1.00 74.31 C ATOM 2022 CG ASP A 176 -17.181 -8.133 -4.285 1.00 14.53 C ATOM 2023 OD1 ASP A 176 -17.821 -7.605 -5.217 1.00 41.15 O ATOM 2024 OD2 ASP A 176 -17.726 -8.682 -3.304 1.00 64.21 O ATOM 0 H ASP A 176 -15.991 -5.682 -3.979 1.00 73.13 H new ATOM 0 HA ASP A 176 -15.364 -7.845 -2.235 1.00 45.44 H new ATOM 0 HB2 ASP A 176 -15.352 -7.629 -5.275 1.00 74.31 H new ATOM 0 HB3 ASP A 176 -15.290 -9.129 -4.371 1.00 74.31 H new ATOM 2028 N VAL A 177 -12.914 -8.079 -2.253 1.00 21.13 N ATOM 2029 CA VAL A 177 -11.462 -8.217 -2.211 1.00 62.11 C ATOM 2030 C VAL A 177 -10.924 -8.758 -3.531 1.00 4.11 C ATOM 2031 O VAL A 177 -9.840 -8.378 -3.974 1.00 54.20 O ATOM 2032 CB VAL A 177 -11.019 -9.149 -1.067 1.00 44.43 C ATOM 2033 CG1 VAL A 177 -11.391 -8.553 0.282 1.00 61.04 C ATOM 2034 CG2 VAL A 177 -11.634 -10.529 -1.237 1.00 13.34 C ATOM 0 H VAL A 177 -13.402 -8.513 -1.469 1.00 21.13 H new ATOM 0 HA VAL A 177 -11.054 -7.222 -2.036 1.00 62.11 H new ATOM 0 HB VAL A 177 -9.935 -9.252 -1.105 1.00 44.43 H new ATOM 0 HG11 VAL A 177 -11.070 -9.225 1.078 1.00 61.04 H new ATOM 0 HG12 VAL A 177 -10.898 -7.588 0.402 1.00 61.04 H new ATOM 0 HG13 VAL A 177 -12.471 -8.418 0.335 1.00 61.04 H new ATOM 0 HG21 VAL A 177 -11.311 -11.175 -0.420 1.00 13.34 H new ATOM 0 HG22 VAL A 177 -12.721 -10.447 -1.226 1.00 13.34 H new ATOM 0 HG23 VAL A 177 -11.312 -10.956 -2.187 1.00 13.34 H new ATOM 2044 N LYS A 178 -11.689 -9.648 -4.155 1.00 32.40 N ATOM 2045 CA LYS A 178 -11.291 -10.242 -5.426 1.00 35.55 C ATOM 2046 C LYS A 178 -11.391 -9.223 -6.557 1.00 53.21 C ATOM 2047 O LYS A 178 -10.583 -9.233 -7.487 1.00 24.41 O ATOM 2048 CB LYS A 178 -12.164 -11.458 -5.740 1.00 1.12 C ATOM 2049 CG LYS A 178 -11.467 -12.505 -6.589 1.00 53.10 C ATOM 2050 CD LYS A 178 -10.893 -13.623 -5.735 1.00 55.03 C ATOM 2051 CE LYS A 178 -9.687 -13.152 -4.937 1.00 12.33 C ATOM 2052 NZ LYS A 178 -8.566 -12.730 -5.822 1.00 12.41 N ATOM 0 H LYS A 178 -12.588 -9.974 -3.801 1.00 32.40 H new ATOM 0 HA LYS A 178 -10.253 -10.562 -5.340 1.00 35.55 H new ATOM 0 HB2 LYS A 178 -12.484 -11.916 -4.804 1.00 1.12 H new ATOM 0 HB3 LYS A 178 -13.064 -11.125 -6.256 1.00 1.12 H new ATOM 0 HG2 LYS A 178 -12.173 -12.921 -7.308 1.00 53.10 H new ATOM 0 HG3 LYS A 178 -10.667 -12.036 -7.162 1.00 53.10 H new ATOM 0 HD2 LYS A 178 -11.660 -13.992 -5.054 1.00 55.03 H new ATOM 0 HD3 LYS A 178 -10.605 -14.458 -6.373 1.00 55.03 H new ATOM 0 HE2 LYS A 178 -9.978 -12.319 -4.297 1.00 12.33 H new ATOM 0 HE3 LYS A 178 -9.350 -13.955 -4.281 1.00 12.33 H new ATOM 0 HZ1 LYS A 178 -7.684 -13.181 -5.504 1.00 12.41 H new ATOM 0 HZ2 LYS A 178 -8.769 -13.018 -6.801 1.00 12.41 H new ATOM 0 HZ3 LYS A 178 -8.461 -11.696 -5.780 1.00 12.41 H new ATOM 2062 N ASP A 179 -12.385 -8.347 -6.472 1.00 23.23 N ATOM 2063 CA ASP A 179 -12.589 -7.321 -7.487 1.00 44.31 C ATOM 2064 C ASP A 179 -11.448 -6.309 -7.474 1.00 14.31 C ATOM 2065 O ASP A 179 -10.849 -6.021 -8.511 1.00 4.12 O ATOM 2066 CB ASP A 179 -13.922 -6.607 -7.260 1.00 24.03 C ATOM 2067 CG ASP A 179 -14.194 -5.540 -8.303 1.00 73.42 C ATOM 2068 OD1 ASP A 179 -13.587 -5.609 -9.393 1.00 71.31 O ATOM 2069 OD2 ASP A 179 -15.011 -4.638 -8.029 1.00 42.13 O ATOM 0 H ASP A 179 -13.063 -8.327 -5.710 1.00 23.23 H new ATOM 0 HA ASP A 179 -12.608 -7.808 -8.462 1.00 44.31 H new ATOM 0 HB2 ASP A 179 -14.730 -7.339 -7.274 1.00 24.03 H new ATOM 0 HB3 ASP A 179 -13.922 -6.151 -6.270 1.00 24.03 H new ATOM 2073 N ILE A 180 -11.153 -5.773 -6.295 1.00 31.54 N ATOM 2074 CA ILE A 180 -10.082 -4.793 -6.148 1.00 51.41 C ATOM 2075 C ILE A 180 -8.742 -5.374 -6.587 1.00 43.24 C ATOM 2076 O ILE A 180 -8.524 -6.585 -6.564 1.00 2.35 O ATOM 2077 CB ILE A 180 -9.965 -4.302 -4.693 1.00 14.44 C ATOM 2078 CG1 ILE A 180 -9.911 -5.492 -3.733 1.00 42.40 C ATOM 2079 CG2 ILE A 180 -11.130 -3.387 -4.347 1.00 1.32 C ATOM 2080 CD1 ILE A 180 -9.572 -5.106 -2.310 1.00 51.24 C ATOM 0 H ILE A 180 -11.640 -6.000 -5.428 1.00 31.54 H new ATOM 0 HA ILE A 180 -10.336 -3.948 -6.788 1.00 51.41 H new ATOM 0 HB ILE A 180 -9.040 -3.734 -4.590 1.00 14.44 H new ATOM 0 HG12 ILE A 180 -10.875 -6.000 -3.743 1.00 42.40 H new ATOM 0 HG13 ILE A 180 -9.170 -6.206 -4.093 1.00 42.40 H new ATOM 0 HG21 ILE A 180 -11.033 -3.048 -3.315 1.00 1.32 H new ATOM 0 HG22 ILE A 180 -11.126 -2.525 -5.014 1.00 1.32 H new ATOM 0 HG23 ILE A 180 -12.067 -3.931 -4.463 1.00 1.32 H new ATOM 0 HD11 ILE A 180 -9.551 -5.999 -1.686 1.00 51.24 H new ATOM 0 HD12 ILE A 180 -8.594 -4.624 -2.287 1.00 51.24 H new ATOM 0 HD13 ILE A 180 -10.326 -4.416 -1.931 1.00 51.24 H new