USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1100 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 GLN : amide:sc= -0.462 K(o=0.045,f=-3.4!) USER MOD Set 1.2: B 210 THR OG1 : rot 81:sc= 0.507 USER MOD Set 2.1: A 25 LYS NZ :NH3+ 157:sc= 1.21 (180deg=1) USER MOD Set 2.2: A 27 TYR OH : rot 70:sc= -0.0836 USER MOD Single : A 1 VAL N :NH3+ -166:sc= -0.049 (180deg=-0.375) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 49:sc= 0.338 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 110:sc= 0.258 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 46:sc= 0.023 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -12:sc= 1.17 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0.24) USER MOD Single : A 54 THR OG1 : rot -74:sc= 0.424 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -125:sc= 0 (180deg=-1.17) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 SER OG : rot 180:sc= 0 USER MOD Single : B 208 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 213 SER OG : rot 180:sc= 0 USER MOD Single : B 215 THR OG1 : rot 37:sc= 0.0192 USER MOD Single : B 216 THR OG1 : rot 180:sc= 0 USER MOD Single : B 217 GLN : amide:sc= -0.222 K(o=-0.22,f=-4.9!) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 LYS NZ :NH3+ -163:sc= 1.28 (180deg=1.06) USER MOD Single : B 226 THR OG1 : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 30:sc= -0.0857 USER MOD Single : B 228 THR OG1 : rot 180:sc= 0 USER MOD Single : B 230 THR OG1 : rot 48:sc= 0.00328 USER MOD Single : B 233 SER OG : rot 180:sc= 0 USER MOD Single : B 241 THR OG1 : rot -26:sc= 1.13 USER MOD Single : B 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 246 LYS NZ :NH3+ -151:sc= 1.16 (180deg=1.04) USER MOD Single : B 252 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : B 254 THR OG1 : rot -45:sc= 0.4 USER MOD Single : B 262 SER OG : rot 155:sc= 1.27 USER MOD Single : B 263 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 266 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0364) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -19.190 -26.405 3.786 1.00 55.23 N ATOM 2 CA VAL A 1 -17.771 -26.068 3.709 1.00 23.21 C ATOM 3 C VAL A 1 -17.610 -24.727 3.029 1.00 61.31 C ATOM 4 O VAL A 1 -18.131 -24.520 1.933 1.00 54.21 O ATOM 5 CB VAL A 1 -16.974 -27.136 2.911 1.00 24.11 C ATOM 6 CG1 VAL A 1 -15.499 -26.764 2.824 1.00 71.23 C ATOM 7 CG2 VAL A 1 -17.133 -28.503 3.547 1.00 21.21 C ATOM 0 H1 VAL A 1 -19.324 -27.194 4.451 1.00 55.23 H new ATOM 0 H2 VAL A 1 -19.726 -25.578 4.118 1.00 55.23 H new ATOM 0 H3 VAL A 1 -19.532 -26.684 2.844 1.00 55.23 H new ATOM 0 HA VAL A 1 -17.378 -26.033 4.725 1.00 23.21 H new ATOM 0 HB VAL A 1 -17.378 -27.171 1.899 1.00 24.11 H new ATOM 0 HG11 VAL A 1 -14.964 -27.528 2.260 1.00 71.23 H new ATOM 0 HG12 VAL A 1 -15.395 -25.803 2.321 1.00 71.23 H new ATOM 0 HG13 VAL A 1 -15.081 -26.695 3.828 1.00 71.23 H new ATOM 0 HG21 VAL A 1 -16.568 -29.239 2.975 1.00 21.21 H new ATOM 0 HG22 VAL A 1 -16.759 -28.474 4.570 1.00 21.21 H new ATOM 0 HG23 VAL A 1 -18.187 -28.781 3.554 1.00 21.21 H new ATOM 19 N GLY A 2 -16.914 -23.817 3.665 1.00 61.33 N ATOM 20 CA GLY A 2 -16.681 -22.551 3.058 1.00 34.43 C ATOM 21 C GLY A 2 -16.216 -21.513 4.034 1.00 73.44 C ATOM 22 O GLY A 2 -16.386 -21.650 5.244 1.00 70.20 O ATOM 0 H GLY A 2 -16.507 -23.937 4.593 1.00 61.33 H new ATOM 0 HA2 GLY A 2 -15.935 -22.663 2.271 1.00 34.43 H new ATOM 0 HA3 GLY A 2 -17.599 -22.208 2.581 1.00 34.43 H new ATOM 26 N SER A 3 -15.607 -20.506 3.503 1.00 31.02 N ATOM 27 CA SER A 3 -15.141 -19.349 4.233 1.00 11.14 C ATOM 28 C SER A 3 -15.346 -18.196 3.287 1.00 21.34 C ATOM 29 O SER A 3 -14.504 -17.301 3.129 1.00 22.41 O ATOM 30 CB SER A 3 -13.666 -19.529 4.582 1.00 10.02 C ATOM 31 OG SER A 3 -13.483 -20.711 5.360 1.00 5.51 O ATOM 0 H SER A 3 -15.406 -20.454 2.504 1.00 31.02 H new ATOM 0 HA SER A 3 -15.669 -19.190 5.173 1.00 11.14 H new ATOM 0 HB2 SER A 3 -13.074 -19.591 3.669 1.00 10.02 H new ATOM 0 HB3 SER A 3 -13.308 -18.661 5.136 1.00 10.02 H new ATOM 0 HG SER A 3 -12.533 -20.817 5.576 1.00 5.51 H new ATOM 37 N GLU A 4 -16.515 -18.228 2.689 1.00 30.02 N ATOM 38 CA GLU A 4 -16.886 -17.365 1.622 1.00 42.41 C ATOM 39 C GLU A 4 -17.175 -15.958 2.112 1.00 44.20 C ATOM 40 O GLU A 4 -18.237 -15.684 2.699 1.00 73.51 O ATOM 41 CB GLU A 4 -18.110 -17.933 0.904 1.00 12.43 C ATOM 42 CG GLU A 4 -17.977 -19.403 0.509 1.00 63.31 C ATOM 43 CD GLU A 4 -16.760 -19.695 -0.334 1.00 25.44 C ATOM 44 OE1 GLU A 4 -16.812 -19.498 -1.567 1.00 11.13 O ATOM 45 OE2 GLU A 4 -15.737 -20.133 0.220 1.00 30.14 O ATOM 0 H GLU A 4 -17.251 -18.884 2.951 1.00 30.02 H new ATOM 0 HA GLU A 4 -16.047 -17.306 0.929 1.00 42.41 H new ATOM 0 HB2 GLU A 4 -18.981 -17.819 1.549 1.00 12.43 H new ATOM 0 HB3 GLU A 4 -18.298 -17.343 0.007 1.00 12.43 H new ATOM 0 HG2 GLU A 4 -17.937 -20.011 1.413 1.00 63.31 H new ATOM 0 HG3 GLU A 4 -18.869 -19.705 -0.039 1.00 63.31 H new ATOM 52 N VAL A 5 -16.221 -15.099 1.917 1.00 73.11 N ATOM 53 CA VAL A 5 -16.359 -13.704 2.211 1.00 71.14 C ATOM 54 C VAL A 5 -16.100 -12.898 0.949 1.00 24.33 C ATOM 55 O VAL A 5 -14.954 -12.632 0.569 1.00 54.11 O ATOM 56 CB VAL A 5 -15.476 -13.218 3.420 1.00 65.33 C ATOM 57 CG1 VAL A 5 -16.010 -13.773 4.725 1.00 74.24 C ATOM 58 CG2 VAL A 5 -14.024 -13.644 3.256 1.00 62.13 C ATOM 0 H VAL A 5 -15.307 -15.353 1.542 1.00 73.11 H new ATOM 0 HA VAL A 5 -17.384 -13.537 2.542 1.00 71.14 H new ATOM 0 HB VAL A 5 -15.522 -12.129 3.437 1.00 65.33 H new ATOM 0 HG11 VAL A 5 -15.387 -13.427 5.550 1.00 74.24 H new ATOM 0 HG12 VAL A 5 -17.034 -13.430 4.874 1.00 74.24 H new ATOM 0 HG13 VAL A 5 -15.994 -14.862 4.691 1.00 74.24 H new ATOM 0 HG21 VAL A 5 -13.443 -13.292 4.108 1.00 62.13 H new ATOM 0 HG22 VAL A 5 -13.968 -14.731 3.203 1.00 62.13 H new ATOM 0 HG23 VAL A 5 -13.620 -13.214 2.339 1.00 62.13 H new ATOM 68 N SER A 6 -17.167 -12.567 0.268 1.00 12.43 N ATOM 69 CA SER A 6 -17.082 -11.860 -0.984 1.00 44.31 C ATOM 70 C SER A 6 -16.723 -10.388 -0.775 1.00 40.41 C ATOM 71 O SER A 6 -16.250 -9.718 -1.703 1.00 25.54 O ATOM 72 CB SER A 6 -18.393 -12.018 -1.753 1.00 41.02 C ATOM 73 OG SER A 6 -18.677 -13.406 -1.975 1.00 72.21 O ATOM 0 H SER A 6 -18.119 -12.780 0.566 1.00 12.43 H new ATOM 0 HA SER A 6 -16.277 -12.294 -1.577 1.00 44.31 H new ATOM 0 HB2 SER A 6 -19.208 -11.558 -1.194 1.00 41.02 H new ATOM 0 HB3 SER A 6 -18.327 -11.496 -2.708 1.00 41.02 H new ATOM 0 HG SER A 6 -19.520 -13.493 -2.467 1.00 72.21 H new ATOM 79 N ASP A 7 -16.910 -9.893 0.445 1.00 52.01 N ATOM 80 CA ASP A 7 -16.579 -8.512 0.758 1.00 40.32 C ATOM 81 C ASP A 7 -15.112 -8.349 1.082 1.00 32.13 C ATOM 82 O ASP A 7 -14.707 -8.143 2.236 1.00 21.14 O ATOM 83 CB ASP A 7 -17.464 -7.897 1.850 1.00 5.32 C ATOM 84 CG ASP A 7 -18.900 -7.744 1.430 1.00 34.45 C ATOM 85 OD1 ASP A 7 -19.690 -8.691 1.623 1.00 24.10 O ATOM 86 OD2 ASP A 7 -19.267 -6.663 0.913 1.00 61.41 O ATOM 0 H ASP A 7 -17.287 -10.427 1.228 1.00 52.01 H new ATOM 0 HA ASP A 7 -16.792 -7.948 -0.151 1.00 40.32 H new ATOM 0 HB2 ASP A 7 -17.417 -8.522 2.742 1.00 5.32 H new ATOM 0 HB3 ASP A 7 -17.066 -6.920 2.124 1.00 5.32 H new ATOM 91 N LYS A 8 -14.335 -8.524 0.071 1.00 52.45 N ATOM 92 CA LYS A 8 -12.914 -8.352 0.075 1.00 25.40 C ATOM 93 C LYS A 8 -12.548 -7.900 -1.288 1.00 1.24 C ATOM 94 O LYS A 8 -13.366 -7.983 -2.212 1.00 33.43 O ATOM 95 CB LYS A 8 -12.144 -9.666 0.357 1.00 23.24 C ATOM 96 CG LYS A 8 -12.300 -10.264 1.746 1.00 44.13 C ATOM 97 CD LYS A 8 -11.444 -11.529 1.899 1.00 24.10 C ATOM 98 CE LYS A 8 -9.947 -11.244 1.737 1.00 70.45 C ATOM 99 NZ LYS A 8 -9.124 -12.469 1.865 1.00 34.02 N ATOM 0 H LYS A 8 -14.692 -8.809 -0.841 1.00 52.45 H new ATOM 0 HA LYS A 8 -12.650 -7.646 0.863 1.00 25.40 H new ATOM 0 HB2 LYS A 8 -12.463 -10.411 -0.372 1.00 23.24 H new ATOM 0 HB3 LYS A 8 -11.084 -9.483 0.182 1.00 23.24 H new ATOM 0 HG2 LYS A 8 -12.008 -9.530 2.497 1.00 44.13 H new ATOM 0 HG3 LYS A 8 -13.348 -10.505 1.927 1.00 44.13 H new ATOM 0 HD2 LYS A 8 -11.623 -11.969 2.880 1.00 24.10 H new ATOM 0 HD3 LYS A 8 -11.753 -12.266 1.158 1.00 24.10 H new ATOM 0 HE2 LYS A 8 -9.769 -10.790 0.762 1.00 70.45 H new ATOM 0 HE3 LYS A 8 -9.634 -10.519 2.488 1.00 70.45 H new ATOM 0 HZ1 LYS A 8 -8.120 -12.226 1.748 1.00 34.02 H new ATOM 0 HZ2 LYS A 8 -9.272 -12.890 2.805 1.00 34.02 H new ATOM 0 HZ3 LYS A 8 -9.402 -13.152 1.132 1.00 34.02 H new ATOM 113 N ARG A 9 -11.379 -7.425 -1.439 1.00 50.24 N ATOM 114 CA ARG A 9 -10.904 -7.050 -2.720 1.00 33.52 C ATOM 115 C ARG A 9 -9.700 -7.895 -3.007 1.00 74.41 C ATOM 116 O ARG A 9 -8.683 -7.783 -2.317 1.00 13.11 O ATOM 117 CB ARG A 9 -10.555 -5.543 -2.821 1.00 31.44 C ATOM 118 CG ARG A 9 -11.717 -4.552 -2.574 1.00 34.44 C ATOM 119 CD ARG A 9 -12.135 -4.491 -1.108 1.00 33.33 C ATOM 120 NE ARG A 9 -11.019 -4.085 -0.246 1.00 34.32 N ATOM 121 CZ ARG A 9 -10.950 -4.296 1.073 1.00 65.13 C ATOM 122 NH1 ARG A 9 -11.993 -4.815 1.727 1.00 21.12 N ATOM 123 NH2 ARG A 9 -9.855 -3.953 1.741 1.00 43.20 N ATOM 0 H ARG A 9 -10.714 -7.281 -0.679 1.00 50.24 H new ATOM 0 HA ARG A 9 -11.692 -7.213 -3.456 1.00 33.52 H new ATOM 0 HB2 ARG A 9 -9.763 -5.327 -2.104 1.00 31.44 H new ATOM 0 HB3 ARG A 9 -10.148 -5.352 -3.814 1.00 31.44 H new ATOM 0 HG2 ARG A 9 -11.418 -3.557 -2.904 1.00 34.44 H new ATOM 0 HG3 ARG A 9 -12.574 -4.845 -3.180 1.00 34.44 H new ATOM 0 HD2 ARG A 9 -12.959 -3.787 -0.993 1.00 33.33 H new ATOM 0 HD3 ARG A 9 -12.503 -5.467 -0.793 1.00 33.33 H new ATOM 0 HE ARG A 9 -10.235 -3.604 -0.687 1.00 34.32 H new ATOM 0 HH11 ARG A 9 -12.846 -5.052 1.220 1.00 21.12 H new ATOM 0 HH12 ARG A 9 -11.936 -4.974 2.733 1.00 21.12 H new ATOM 0 HH21 ARG A 9 -9.069 -3.530 1.248 1.00 43.20 H new ATOM 0 HH22 ARG A 9 -9.800 -4.113 2.747 1.00 43.20 H new ATOM 137 N THR A 10 -9.819 -8.783 -3.963 1.00 31.03 N ATOM 138 CA THR A 10 -8.736 -9.658 -4.310 1.00 63.42 C ATOM 139 C THR A 10 -7.653 -8.896 -5.050 1.00 12.22 C ATOM 140 O THR A 10 -7.659 -8.798 -6.285 1.00 35.24 O ATOM 141 CB THR A 10 -9.226 -10.861 -5.132 1.00 31.34 C ATOM 142 OG1 THR A 10 -9.984 -10.393 -6.265 1.00 11.10 O ATOM 143 CG2 THR A 10 -10.089 -11.783 -4.284 1.00 41.24 C ATOM 0 H THR A 10 -10.665 -8.916 -4.517 1.00 31.03 H new ATOM 0 HA THR A 10 -8.310 -10.048 -3.386 1.00 63.42 H new ATOM 0 HB THR A 10 -8.357 -11.423 -5.475 1.00 31.34 H new ATOM 0 HG1 THR A 10 -9.479 -9.693 -6.730 1.00 11.10 H new ATOM 0 HG21 THR A 10 -10.423 -12.626 -4.888 1.00 41.24 H new ATOM 0 HG22 THR A 10 -9.507 -12.150 -3.439 1.00 41.24 H new ATOM 0 HG23 THR A 10 -10.956 -11.234 -3.916 1.00 41.24 H new ATOM 151 N CYS A 11 -6.776 -8.310 -4.296 1.00 12.12 N ATOM 152 CA CYS A 11 -5.735 -7.517 -4.835 1.00 62.42 C ATOM 153 C CYS A 11 -4.450 -7.957 -4.187 1.00 45.21 C ATOM 154 O CYS A 11 -4.445 -8.332 -3.012 1.00 5.34 O ATOM 155 CB CYS A 11 -5.969 -6.042 -4.476 1.00 73.11 C ATOM 156 SG CYS A 11 -7.685 -5.400 -4.724 1.00 22.21 S ATOM 0 H CYS A 11 -6.770 -8.374 -3.278 1.00 12.12 H new ATOM 0 HA CYS A 11 -5.700 -7.629 -5.919 1.00 62.42 H new ATOM 0 HB2 CYS A 11 -5.698 -5.897 -3.430 1.00 73.11 H new ATOM 0 HB3 CYS A 11 -5.287 -5.433 -5.070 1.00 73.11 H new ATOM 161 N VAL A 12 -3.385 -7.933 -4.916 1.00 25.32 N ATOM 162 CA VAL A 12 -2.109 -8.267 -4.361 1.00 70.35 C ATOM 163 C VAL A 12 -1.236 -7.029 -4.362 1.00 54.22 C ATOM 164 O VAL A 12 -1.265 -6.236 -5.309 1.00 54.14 O ATOM 165 CB VAL A 12 -1.421 -9.483 -5.067 1.00 25.41 C ATOM 166 CG1 VAL A 12 -2.244 -10.749 -4.873 1.00 62.24 C ATOM 167 CG2 VAL A 12 -1.200 -9.234 -6.553 1.00 31.13 C ATOM 0 H VAL A 12 -3.370 -7.684 -5.905 1.00 25.32 H new ATOM 0 HA VAL A 12 -2.261 -8.602 -3.335 1.00 70.35 H new ATOM 0 HB VAL A 12 -0.444 -9.610 -4.602 1.00 25.41 H new ATOM 0 HG11 VAL A 12 -1.750 -11.584 -5.371 1.00 62.24 H new ATOM 0 HG12 VAL A 12 -2.335 -10.964 -3.808 1.00 62.24 H new ATOM 0 HG13 VAL A 12 -3.236 -10.607 -5.301 1.00 62.24 H new ATOM 0 HG21 VAL A 12 -0.720 -10.105 -7.000 1.00 31.13 H new ATOM 0 HG22 VAL A 12 -2.160 -9.059 -7.039 1.00 31.13 H new ATOM 0 HG23 VAL A 12 -0.562 -8.360 -6.685 1.00 31.13 H new ATOM 177 N SER A 13 -0.495 -6.836 -3.323 1.00 1.15 N ATOM 178 CA SER A 13 0.277 -5.644 -3.190 1.00 62.31 C ATOM 179 C SER A 13 1.760 -5.939 -3.013 1.00 22.32 C ATOM 180 O SER A 13 2.156 -6.814 -2.229 1.00 12.43 O ATOM 181 CB SER A 13 -0.303 -4.785 -2.060 1.00 61.23 C ATOM 182 OG SER A 13 -0.466 -5.545 -0.856 1.00 33.23 O ATOM 0 H SER A 13 -0.407 -7.493 -2.548 1.00 1.15 H new ATOM 0 HA SER A 13 0.210 -5.072 -4.116 1.00 62.31 H new ATOM 0 HB2 SER A 13 0.356 -3.937 -1.871 1.00 61.23 H new ATOM 0 HB3 SER A 13 -1.266 -4.378 -2.368 1.00 61.23 H new ATOM 0 HG SER A 13 -0.836 -4.970 -0.154 1.00 33.23 H new ATOM 188 N LEU A 14 2.562 -5.214 -3.755 1.00 72.41 N ATOM 189 CA LEU A 14 3.985 -5.379 -3.782 1.00 75.05 C ATOM 190 C LEU A 14 4.659 -4.062 -3.483 1.00 70.13 C ATOM 191 O LEU A 14 4.414 -3.056 -4.148 1.00 51.04 O ATOM 192 CB LEU A 14 4.378 -5.893 -5.156 1.00 14.42 C ATOM 193 CG LEU A 14 3.908 -7.309 -5.471 1.00 70.51 C ATOM 194 CD1 LEU A 14 4.043 -7.613 -6.956 1.00 24.55 C ATOM 195 CD2 LEU A 14 4.734 -8.291 -4.659 1.00 74.23 C ATOM 0 H LEU A 14 2.228 -4.474 -4.372 1.00 72.41 H new ATOM 0 HA LEU A 14 4.302 -6.095 -3.024 1.00 75.05 H new ATOM 0 HB2 LEU A 14 3.976 -5.216 -5.910 1.00 14.42 H new ATOM 0 HB3 LEU A 14 5.464 -5.858 -5.244 1.00 14.42 H new ATOM 0 HG LEU A 14 2.854 -7.401 -5.208 1.00 70.51 H new ATOM 0 HD11 LEU A 14 3.701 -8.629 -7.152 1.00 24.55 H new ATOM 0 HD12 LEU A 14 3.438 -6.910 -7.528 1.00 24.55 H new ATOM 0 HD13 LEU A 14 5.087 -7.518 -7.253 1.00 24.55 H new ATOM 0 HD21 LEU A 14 4.407 -9.308 -4.876 1.00 74.23 H new ATOM 0 HD22 LEU A 14 5.787 -8.185 -4.921 1.00 74.23 H new ATOM 0 HD23 LEU A 14 4.602 -8.086 -3.597 1.00 74.23 H new ATOM 207 N THR A 15 5.486 -4.055 -2.492 1.00 44.44 N ATOM 208 CA THR A 15 6.142 -2.851 -2.089 1.00 71.41 C ATOM 209 C THR A 15 7.568 -2.833 -2.629 1.00 52.14 C ATOM 210 O THR A 15 8.341 -3.769 -2.393 1.00 13.21 O ATOM 211 CB THR A 15 6.143 -2.737 -0.558 1.00 1.55 C ATOM 212 OG1 THR A 15 4.790 -2.911 -0.079 1.00 31.41 O ATOM 213 CG2 THR A 15 6.623 -1.368 -0.138 1.00 44.54 C ATOM 0 H THR A 15 5.727 -4.878 -1.939 1.00 44.44 H new ATOM 0 HA THR A 15 5.603 -1.996 -2.497 1.00 71.41 H new ATOM 0 HB THR A 15 6.804 -3.498 -0.143 1.00 1.55 H new ATOM 0 HG1 THR A 15 4.778 -2.842 0.898 1.00 31.41 H new ATOM 0 HG21 THR A 15 6.619 -1.299 0.950 1.00 44.54 H new ATOM 0 HG22 THR A 15 7.636 -1.208 -0.508 1.00 44.54 H new ATOM 0 HG23 THR A 15 5.961 -0.607 -0.552 1.00 44.54 H new ATOM 221 N THR A 16 7.903 -1.805 -3.366 1.00 41.23 N ATOM 222 CA THR A 16 9.203 -1.699 -3.940 1.00 73.14 C ATOM 223 C THR A 16 9.598 -0.223 -4.032 1.00 74.12 C ATOM 224 O THR A 16 8.778 0.620 -4.418 1.00 64.14 O ATOM 225 CB THR A 16 9.241 -2.391 -5.352 1.00 73.35 C ATOM 226 OG1 THR A 16 10.566 -2.374 -5.899 1.00 45.33 O ATOM 227 CG2 THR A 16 8.278 -1.728 -6.340 1.00 75.15 C ATOM 0 H THR A 16 7.280 -1.026 -3.579 1.00 41.23 H new ATOM 0 HA THR A 16 9.924 -2.214 -3.305 1.00 73.14 H new ATOM 0 HB THR A 16 8.925 -3.423 -5.201 1.00 73.35 H new ATOM 0 HG1 THR A 16 10.564 -2.811 -6.776 1.00 45.33 H new ATOM 0 HG21 THR A 16 8.336 -2.237 -7.302 1.00 75.15 H new ATOM 0 HG22 THR A 16 7.260 -1.794 -5.956 1.00 75.15 H new ATOM 0 HG23 THR A 16 8.551 -0.680 -6.467 1.00 75.15 H new ATOM 235 N GLN A 17 10.843 0.074 -3.662 1.00 21.01 N ATOM 236 CA GLN A 17 11.405 1.423 -3.728 1.00 10.25 C ATOM 237 C GLN A 17 10.670 2.421 -2.805 1.00 53.11 C ATOM 238 O GLN A 17 9.872 2.033 -1.932 1.00 53.31 O ATOM 239 CB GLN A 17 11.440 1.909 -5.178 1.00 41.13 C ATOM 240 CG GLN A 17 12.307 1.036 -6.065 1.00 73.54 C ATOM 241 CD GLN A 17 12.295 1.467 -7.502 1.00 51.40 C ATOM 242 OE1 GLN A 17 13.100 2.287 -7.918 1.00 25.45 O ATOM 243 NE2 GLN A 17 11.389 0.918 -8.270 1.00 34.54 N ATOM 0 H GLN A 17 11.497 -0.622 -3.304 1.00 21.01 H new ATOM 0 HA GLN A 17 12.428 1.372 -3.355 1.00 10.25 H new ATOM 0 HB2 GLN A 17 10.425 1.929 -5.575 1.00 41.13 H new ATOM 0 HB3 GLN A 17 11.814 2.933 -5.205 1.00 41.13 H new ATOM 0 HG2 GLN A 17 13.332 1.055 -5.694 1.00 73.54 H new ATOM 0 HG3 GLN A 17 11.963 0.004 -5.998 1.00 73.54 H new ATOM 0 HE21 GLN A 17 10.736 0.237 -7.882 1.00 34.54 H new ATOM 0 HE22 GLN A 17 11.336 1.171 -9.257 1.00 34.54 H new ATOM 252 N ARG A 18 10.981 3.691 -2.961 1.00 24.33 N ATOM 253 CA ARG A 18 10.388 4.728 -2.129 1.00 0.14 C ATOM 254 C ARG A 18 10.170 6.008 -2.920 1.00 71.03 C ATOM 255 O ARG A 18 10.064 7.091 -2.332 1.00 44.31 O ATOM 256 CB ARG A 18 11.301 5.020 -0.935 1.00 23.30 C ATOM 257 CG ARG A 18 12.695 5.463 -1.336 1.00 41.45 C ATOM 258 CD ARG A 18 13.544 5.797 -0.139 1.00 64.21 C ATOM 259 NE ARG A 18 14.912 6.135 -0.527 1.00 32.11 N ATOM 260 CZ ARG A 18 15.863 6.556 0.308 1.00 13.43 C ATOM 261 NH1 ARG A 18 15.567 6.846 1.572 1.00 54.11 N ATOM 262 NH2 ARG A 18 17.096 6.719 -0.127 1.00 10.54 N ATOM 0 H ARG A 18 11.642 4.035 -3.657 1.00 24.33 H new ATOM 0 HA ARG A 18 9.421 4.368 -1.778 1.00 0.14 H new ATOM 0 HB2 ARG A 18 10.845 5.795 -0.319 1.00 23.30 H new ATOM 0 HB3 ARG A 18 11.376 4.125 -0.317 1.00 23.30 H new ATOM 0 HG2 ARG A 18 13.175 4.672 -1.912 1.00 41.45 H new ATOM 0 HG3 ARG A 18 12.626 6.335 -1.987 1.00 41.45 H new ATOM 0 HD2 ARG A 18 13.101 6.634 0.400 1.00 64.21 H new ATOM 0 HD3 ARG A 18 13.558 4.949 0.546 1.00 64.21 H new ATOM 0 HE ARG A 18 15.158 6.042 -1.512 1.00 32.11 H new ATOM 0 HH11 ARG A 18 14.609 6.747 1.907 1.00 54.11 H new ATOM 0 HH12 ARG A 18 16.298 7.168 2.206 1.00 54.11 H new ATOM 0 HH21 ARG A 18 17.323 6.523 -1.102 1.00 10.54 H new ATOM 0 HH22 ARG A 18 17.824 7.041 0.511 1.00 10.54 H new ATOM 276 N LEU A 19 10.060 5.897 -4.229 1.00 13.14 N ATOM 277 CA LEU A 19 9.866 7.084 -5.048 1.00 54.01 C ATOM 278 C LEU A 19 8.430 7.555 -4.990 1.00 65.31 C ATOM 279 O LEU A 19 7.511 6.800 -5.303 1.00 62.14 O ATOM 280 CB LEU A 19 10.311 6.916 -6.514 1.00 50.40 C ATOM 281 CG LEU A 19 11.817 6.778 -6.792 1.00 34.01 C ATOM 282 CD1 LEU A 19 12.383 5.458 -6.293 1.00 42.02 C ATOM 283 CD2 LEU A 19 12.097 6.979 -8.266 1.00 2.32 C ATOM 0 H LEU A 19 10.100 5.017 -4.743 1.00 13.14 H new ATOM 0 HA LEU A 19 10.518 7.842 -4.615 1.00 54.01 H new ATOM 0 HB2 LEU A 19 9.813 6.034 -6.917 1.00 50.40 H new ATOM 0 HB3 LEU A 19 9.943 7.774 -7.077 1.00 50.40 H new ATOM 0 HG LEU A 19 12.328 7.559 -6.230 1.00 34.01 H new ATOM 0 HD11 LEU A 19 13.449 5.412 -6.515 1.00 42.02 H new ATOM 0 HD12 LEU A 19 12.233 5.381 -5.216 1.00 42.02 H new ATOM 0 HD13 LEU A 19 11.873 4.633 -6.790 1.00 42.02 H new ATOM 0 HD21 LEU A 19 13.167 6.879 -8.450 1.00 2.32 H new ATOM 0 HD22 LEU A 19 11.557 6.229 -8.844 1.00 2.32 H new ATOM 0 HD23 LEU A 19 11.769 7.974 -8.566 1.00 2.32 H new ATOM 295 N PRO A 20 8.216 8.805 -4.573 1.00 72.21 N ATOM 296 CA PRO A 20 6.888 9.365 -4.464 1.00 55.51 C ATOM 297 C PRO A 20 6.249 9.601 -5.824 1.00 2.54 C ATOM 298 O PRO A 20 6.908 10.022 -6.789 1.00 32.34 O ATOM 299 CB PRO A 20 7.107 10.696 -3.743 1.00 50.41 C ATOM 300 CG PRO A 20 8.518 11.057 -4.023 1.00 53.25 C ATOM 301 CD PRO A 20 9.262 9.766 -4.175 1.00 3.12 C ATOM 0 HA PRO A 20 6.211 8.692 -3.938 1.00 55.51 H new ATOM 0 HB2 PRO A 20 6.423 11.461 -4.111 1.00 50.41 H new ATOM 0 HB3 PRO A 20 6.930 10.598 -2.672 1.00 50.41 H new ATOM 0 HG2 PRO A 20 8.593 11.658 -4.930 1.00 53.25 H new ATOM 0 HG3 PRO A 20 8.935 11.652 -3.211 1.00 53.25 H new ATOM 0 HD2 PRO A 20 10.045 9.841 -4.930 1.00 3.12 H new ATOM 0 HD3 PRO A 20 9.745 9.470 -3.244 1.00 3.12 H new ATOM 309 N VAL A 21 4.985 9.339 -5.897 1.00 2.10 N ATOM 310 CA VAL A 21 4.245 9.530 -7.100 1.00 50.23 C ATOM 311 C VAL A 21 3.367 10.749 -6.950 1.00 30.03 C ATOM 312 O VAL A 21 2.929 11.069 -5.831 1.00 31.03 O ATOM 313 CB VAL A 21 3.389 8.279 -7.454 1.00 34.41 C ATOM 314 CG1 VAL A 21 4.291 7.084 -7.718 1.00 32.42 C ATOM 315 CG2 VAL A 21 2.404 7.947 -6.333 1.00 22.40 C ATOM 0 H VAL A 21 4.433 8.983 -5.117 1.00 2.10 H new ATOM 0 HA VAL A 21 4.947 9.679 -7.921 1.00 50.23 H new ATOM 0 HB VAL A 21 2.818 8.507 -8.354 1.00 34.41 H new ATOM 0 HG11 VAL A 21 3.681 6.215 -7.965 1.00 32.42 H new ATOM 0 HG12 VAL A 21 4.957 7.308 -8.551 1.00 32.42 H new ATOM 0 HG13 VAL A 21 4.883 6.871 -6.828 1.00 32.42 H new ATOM 0 HG21 VAL A 21 1.821 7.069 -6.610 1.00 22.40 H new ATOM 0 HG22 VAL A 21 2.954 7.743 -5.414 1.00 22.40 H new ATOM 0 HG23 VAL A 21 1.734 8.792 -6.175 1.00 22.40 H new ATOM 325 N SER A 22 3.136 11.444 -8.043 1.00 72.24 N ATOM 326 CA SER A 22 2.304 12.628 -8.042 1.00 23.35 C ATOM 327 C SER A 22 0.918 12.302 -7.490 1.00 54.15 C ATOM 328 O SER A 22 0.416 12.983 -6.600 1.00 31.11 O ATOM 329 CB SER A 22 2.202 13.167 -9.463 1.00 41.44 C ATOM 330 OG SER A 22 3.502 13.370 -10.003 1.00 62.01 O ATOM 0 H SER A 22 3.520 11.204 -8.957 1.00 72.24 H new ATOM 0 HA SER A 22 2.752 13.387 -7.401 1.00 23.35 H new ATOM 0 HB2 SER A 22 1.646 12.467 -10.087 1.00 41.44 H new ATOM 0 HB3 SER A 22 1.648 14.106 -9.465 1.00 41.44 H new ATOM 0 HG SER A 22 3.426 13.715 -10.917 1.00 62.01 H new ATOM 336 N ARG A 23 0.327 11.239 -7.997 1.00 62.03 N ATOM 337 CA ARG A 23 -0.977 10.807 -7.560 1.00 73.13 C ATOM 338 C ARG A 23 -1.002 9.308 -7.518 1.00 73.24 C ATOM 339 O ARG A 23 -0.362 8.662 -8.360 1.00 3.34 O ATOM 340 CB ARG A 23 -2.068 11.274 -8.538 1.00 2.13 C ATOM 341 CG ARG A 23 -2.157 12.768 -8.729 1.00 35.31 C ATOM 342 CD ARG A 23 -3.265 13.137 -9.684 1.00 31.12 C ATOM 343 NE ARG A 23 -3.308 14.575 -9.898 1.00 22.41 N ATOM 344 CZ ARG A 23 -4.208 15.224 -10.624 1.00 72.11 C ATOM 345 NH1 ARG A 23 -5.213 14.571 -11.208 1.00 11.51 N ATOM 346 NH2 ARG A 23 -4.104 16.529 -10.755 1.00 54.23 N ATOM 0 H ARG A 23 0.740 10.653 -8.723 1.00 62.03 H new ATOM 0 HA ARG A 23 -1.170 11.235 -6.576 1.00 73.13 H new ATOM 0 HB2 ARG A 23 -1.889 10.809 -9.507 1.00 2.13 H new ATOM 0 HB3 ARG A 23 -3.032 10.910 -8.183 1.00 2.13 H new ATOM 0 HG2 ARG A 23 -2.329 13.250 -7.766 1.00 35.31 H new ATOM 0 HG3 ARG A 23 -1.207 13.145 -9.109 1.00 35.31 H new ATOM 0 HD2 ARG A 23 -3.115 12.628 -10.636 1.00 31.12 H new ATOM 0 HD3 ARG A 23 -4.221 12.795 -9.287 1.00 31.12 H new ATOM 0 HE ARG A 23 -2.582 15.134 -9.450 1.00 22.41 H new ATOM 0 HH11 ARG A 23 -5.296 13.560 -11.099 1.00 11.51 H new ATOM 0 HH12 ARG A 23 -5.899 15.082 -11.764 1.00 11.51 H new ATOM 0 HH21 ARG A 23 -3.339 17.028 -10.301 1.00 54.23 H new ATOM 0 HH22 ARG A 23 -4.789 17.042 -11.310 1.00 54.23 H new ATOM 360 N ILE A 24 -1.691 8.755 -6.541 1.00 13.11 N ATOM 361 CA ILE A 24 -1.936 7.322 -6.503 1.00 51.23 C ATOM 362 C ILE A 24 -2.949 7.074 -7.602 1.00 3.31 C ATOM 363 O ILE A 24 -4.143 7.364 -7.446 1.00 1.31 O ATOM 364 CB ILE A 24 -2.547 6.868 -5.132 1.00 52.52 C ATOM 365 CG1 ILE A 24 -1.684 7.337 -3.926 1.00 71.31 C ATOM 366 CG2 ILE A 24 -2.737 5.353 -5.096 1.00 4.43 C ATOM 367 CD1 ILE A 24 -0.288 6.795 -3.881 1.00 10.42 C ATOM 0 H ILE A 24 -2.093 9.274 -5.760 1.00 13.11 H new ATOM 0 HA ILE A 24 -1.007 6.766 -6.631 1.00 51.23 H new ATOM 0 HB ILE A 24 -3.523 7.345 -5.042 1.00 52.52 H new ATOM 0 HG12 ILE A 24 -1.632 8.426 -3.941 1.00 71.31 H new ATOM 0 HG13 ILE A 24 -2.194 7.055 -3.005 1.00 71.31 H new ATOM 0 HG21 ILE A 24 -3.162 5.062 -4.135 1.00 4.43 H new ATOM 0 HG22 ILE A 24 -3.412 5.052 -5.897 1.00 4.43 H new ATOM 0 HG23 ILE A 24 -1.773 4.862 -5.230 1.00 4.43 H new ATOM 0 HD11 ILE A 24 0.225 7.184 -3.002 1.00 10.42 H new ATOM 0 HD12 ILE A 24 -0.322 5.707 -3.829 1.00 10.42 H new ATOM 0 HD13 ILE A 24 0.249 7.099 -4.779 1.00 10.42 H new ATOM 379 N LYS A 25 -2.476 6.611 -8.709 1.00 0.31 N ATOM 380 CA LYS A 25 -3.301 6.478 -9.868 1.00 43.21 C ATOM 381 C LYS A 25 -3.646 5.033 -10.087 1.00 62.13 C ATOM 382 O LYS A 25 -2.952 4.137 -9.589 1.00 34.55 O ATOM 383 CB LYS A 25 -2.568 7.044 -11.090 1.00 43.41 C ATOM 384 CG LYS A 25 -1.278 6.310 -11.408 1.00 20.31 C ATOM 385 CD LYS A 25 -0.562 6.875 -12.621 1.00 12.52 C ATOM 386 CE LYS A 25 -0.030 8.260 -12.394 1.00 61.21 C ATOM 387 NZ LYS A 25 0.717 8.738 -13.577 1.00 65.00 N ATOM 0 H LYS A 25 -1.509 6.314 -8.839 1.00 0.31 H new ATOM 0 HA LYS A 25 -4.225 7.037 -9.721 1.00 43.21 H new ATOM 0 HB2 LYS A 25 -3.228 6.996 -11.956 1.00 43.41 H new ATOM 0 HB3 LYS A 25 -2.346 8.097 -10.917 1.00 43.41 H new ATOM 0 HG2 LYS A 25 -0.615 6.360 -10.545 1.00 20.31 H new ATOM 0 HG3 LYS A 25 -1.498 5.256 -11.580 1.00 20.31 H new ATOM 0 HD2 LYS A 25 0.262 6.214 -12.890 1.00 12.52 H new ATOM 0 HD3 LYS A 25 -1.248 6.889 -13.468 1.00 12.52 H new ATOM 0 HE2 LYS A 25 -0.854 8.940 -12.180 1.00 61.21 H new ATOM 0 HE3 LYS A 25 0.622 8.265 -11.521 1.00 61.21 H new ATOM 0 HZ1 LYS A 25 0.738 9.778 -13.577 1.00 65.00 H new ATOM 0 HZ2 LYS A 25 1.690 8.372 -13.544 1.00 65.00 H new ATOM 0 HZ3 LYS A 25 0.249 8.401 -14.442 1.00 65.00 H new ATOM 401 N THR A 26 -4.707 4.804 -10.818 1.00 33.33 N ATOM 402 CA THR A 26 -5.168 3.480 -11.089 1.00 64.20 C ATOM 403 C THR A 26 -5.352 3.225 -12.565 1.00 43.21 C ATOM 404 O THR A 26 -5.990 4.008 -13.276 1.00 4.03 O ATOM 405 CB THR A 26 -6.474 3.187 -10.339 1.00 14.12 C ATOM 406 OG1 THR A 26 -7.338 4.335 -10.399 1.00 32.23 O ATOM 407 CG2 THR A 26 -6.211 2.810 -8.910 1.00 42.52 C ATOM 0 H THR A 26 -5.273 5.539 -11.241 1.00 33.33 H new ATOM 0 HA THR A 26 -4.392 2.803 -10.732 1.00 64.20 H new ATOM 0 HB THR A 26 -6.962 2.341 -10.822 1.00 14.12 H new ATOM 0 HG1 THR A 26 -8.104 4.138 -10.978 1.00 32.23 H new ATOM 0 HG21 THR A 26 -7.157 2.609 -8.407 1.00 42.52 H new ATOM 0 HG22 THR A 26 -5.586 1.917 -8.878 1.00 42.52 H new ATOM 0 HG23 THR A 26 -5.699 3.630 -8.406 1.00 42.52 H new ATOM 415 N TYR A 27 -4.786 2.145 -13.020 1.00 52.24 N ATOM 416 CA TYR A 27 -4.949 1.711 -14.379 1.00 73.10 C ATOM 417 C TYR A 27 -5.828 0.507 -14.418 1.00 34.14 C ATOM 418 O TYR A 27 -5.545 -0.462 -13.771 1.00 41.04 O ATOM 419 CB TYR A 27 -3.584 1.389 -14.977 1.00 12.10 C ATOM 420 CG TYR A 27 -2.772 2.611 -15.192 1.00 71.30 C ATOM 421 CD1 TYR A 27 -2.964 3.372 -16.321 1.00 40.01 C ATOM 422 CD2 TYR A 27 -1.848 3.038 -14.252 1.00 1.12 C ATOM 423 CE1 TYR A 27 -2.261 4.519 -16.530 1.00 73.41 C ATOM 424 CE2 TYR A 27 -1.141 4.204 -14.446 1.00 34.51 C ATOM 425 CZ TYR A 27 -1.358 4.940 -15.600 1.00 11.43 C ATOM 426 OH TYR A 27 -0.679 6.119 -15.814 1.00 35.30 O ATOM 0 H TYR A 27 -4.194 1.536 -12.455 1.00 52.24 H new ATOM 0 HA TYR A 27 -5.414 2.505 -14.964 1.00 73.10 H new ATOM 0 HB2 TYR A 27 -3.049 0.709 -14.314 1.00 12.10 H new ATOM 0 HB3 TYR A 27 -3.717 0.870 -15.926 1.00 12.10 H new ATOM 0 HD1 TYR A 27 -3.687 3.053 -17.057 1.00 40.01 H new ATOM 0 HD2 TYR A 27 -1.681 2.452 -13.360 1.00 1.12 H new ATOM 0 HE1 TYR A 27 -2.418 5.094 -17.431 1.00 73.41 H new ATOM 0 HE2 TYR A 27 -0.427 4.540 -13.709 1.00 34.51 H new ATOM 0 HH TYR A 27 -1.298 6.874 -15.728 1.00 35.30 H new ATOM 436 N THR A 28 -6.901 0.589 -15.149 1.00 64.51 N ATOM 437 CA THR A 28 -7.810 -0.515 -15.279 1.00 60.41 C ATOM 438 C THR A 28 -7.700 -1.080 -16.683 1.00 42.13 C ATOM 439 O THR A 28 -7.913 -0.370 -17.665 1.00 54.35 O ATOM 440 CB THR A 28 -9.250 -0.054 -14.998 1.00 42.54 C ATOM 441 OG1 THR A 28 -9.287 0.571 -13.701 1.00 71.33 O ATOM 442 CG2 THR A 28 -10.222 -1.235 -15.017 1.00 24.31 C ATOM 0 H THR A 28 -7.172 1.422 -15.672 1.00 64.51 H new ATOM 0 HA THR A 28 -7.554 -1.288 -14.555 1.00 60.41 H new ATOM 0 HB THR A 28 -9.553 0.648 -15.775 1.00 42.54 H new ATOM 0 HG1 THR A 28 -10.200 0.872 -13.509 1.00 71.33 H new ATOM 0 HG21 THR A 28 -11.232 -0.878 -14.815 1.00 24.31 H new ATOM 0 HG22 THR A 28 -10.195 -1.713 -15.996 1.00 24.31 H new ATOM 0 HG23 THR A 28 -9.933 -1.957 -14.253 1.00 24.31 H new ATOM 450 N ILE A 29 -7.351 -2.330 -16.765 1.00 63.52 N ATOM 451 CA ILE A 29 -7.138 -2.985 -18.020 1.00 63.03 C ATOM 452 C ILE A 29 -8.215 -4.062 -18.176 1.00 34.21 C ATOM 453 O ILE A 29 -8.739 -4.549 -17.176 1.00 70.40 O ATOM 454 CB ILE A 29 -5.727 -3.646 -18.052 1.00 1.12 C ATOM 455 CG1 ILE A 29 -4.699 -2.736 -17.368 1.00 41.43 C ATOM 456 CG2 ILE A 29 -5.318 -3.789 -19.497 1.00 73.15 C ATOM 457 CD1 ILE A 29 -3.322 -3.300 -17.216 1.00 42.14 C ATOM 0 H ILE A 29 -7.205 -2.929 -15.953 1.00 63.52 H new ATOM 0 HA ILE A 29 -7.195 -2.262 -18.834 1.00 63.03 H new ATOM 0 HB ILE A 29 -5.764 -4.607 -17.540 1.00 1.12 H new ATOM 0 HG12 ILE A 29 -4.629 -1.808 -17.936 1.00 41.43 H new ATOM 0 HG13 ILE A 29 -5.075 -2.476 -16.378 1.00 41.43 H new ATOM 0 HG21 ILE A 29 -4.332 -4.250 -19.552 1.00 73.15 H new ATOM 0 HG22 ILE A 29 -6.041 -4.415 -20.019 1.00 73.15 H new ATOM 0 HG23 ILE A 29 -5.285 -2.805 -19.965 1.00 73.15 H new ATOM 0 HD11 ILE A 29 -2.682 -2.570 -16.720 1.00 42.14 H new ATOM 0 HD12 ILE A 29 -3.366 -4.210 -16.618 1.00 42.14 H new ATOM 0 HD13 ILE A 29 -2.913 -3.532 -18.199 1.00 42.14 H new ATOM 469 N THR A 30 -8.549 -4.406 -19.401 1.00 4.45 N ATOM 470 CA THR A 30 -9.588 -5.382 -19.680 1.00 35.21 C ATOM 471 C THR A 30 -9.161 -6.411 -20.739 1.00 32.04 C ATOM 472 O THR A 30 -9.169 -6.135 -21.956 1.00 72.25 O ATOM 473 CB THR A 30 -10.935 -4.713 -20.066 1.00 13.23 C ATOM 474 OG1 THR A 30 -10.720 -3.689 -21.061 1.00 13.50 O ATOM 475 CG2 THR A 30 -11.635 -4.120 -18.850 1.00 42.34 C ATOM 0 H THR A 30 -8.109 -4.018 -20.235 1.00 4.45 H new ATOM 0 HA THR A 30 -9.745 -5.924 -18.747 1.00 35.21 H new ATOM 0 HB THR A 30 -11.581 -5.487 -20.481 1.00 13.23 H new ATOM 0 HG1 THR A 30 -10.121 -4.030 -21.757 1.00 13.50 H new ATOM 0 HG21 THR A 30 -12.574 -3.661 -19.159 1.00 42.34 H new ATOM 0 HG22 THR A 30 -11.838 -4.909 -18.126 1.00 42.34 H new ATOM 0 HG23 THR A 30 -10.995 -3.365 -18.394 1.00 42.34 H new ATOM 483 N GLU A 31 -8.762 -7.570 -20.272 1.00 5.31 N ATOM 484 CA GLU A 31 -8.311 -8.660 -21.128 1.00 4.51 C ATOM 485 C GLU A 31 -9.418 -9.688 -21.275 1.00 33.21 C ATOM 486 O GLU A 31 -9.630 -10.516 -20.391 1.00 32.32 O ATOM 487 CB GLU A 31 -7.029 -9.324 -20.540 1.00 32.12 C ATOM 488 CG GLU A 31 -5.735 -8.484 -20.618 1.00 64.15 C ATOM 489 CD GLU A 31 -5.914 -7.073 -20.225 1.00 63.21 C ATOM 490 OE1 GLU A 31 -6.058 -6.792 -19.041 1.00 3.43 O ATOM 491 OE2 GLU A 31 -5.909 -6.216 -21.150 1.00 35.51 O ATOM 0 H GLU A 31 -8.738 -7.793 -19.277 1.00 5.31 H new ATOM 0 HA GLU A 31 -8.066 -8.257 -22.111 1.00 4.51 H new ATOM 0 HB2 GLU A 31 -7.217 -9.569 -19.495 1.00 32.12 H new ATOM 0 HB3 GLU A 31 -6.859 -10.266 -21.062 1.00 32.12 H new ATOM 0 HG2 GLU A 31 -4.980 -8.937 -19.975 1.00 64.15 H new ATOM 0 HG3 GLU A 31 -5.350 -8.521 -21.637 1.00 64.15 H new ATOM 498 N GLY A 32 -10.130 -9.630 -22.371 1.00 71.35 N ATOM 499 CA GLY A 32 -11.229 -10.534 -22.577 1.00 50.24 C ATOM 500 C GLY A 32 -12.444 -10.131 -21.749 1.00 13.22 C ATOM 501 O GLY A 32 -13.241 -9.299 -22.174 1.00 14.05 O ATOM 0 H GLY A 32 -9.969 -8.969 -23.131 1.00 71.35 H new ATOM 0 HA2 GLY A 32 -11.496 -10.550 -23.634 1.00 50.24 H new ATOM 0 HA3 GLY A 32 -10.924 -11.546 -22.310 1.00 50.24 H new ATOM 505 N SER A 33 -12.556 -10.703 -20.575 1.00 22.23 N ATOM 506 CA SER A 33 -13.648 -10.428 -19.649 1.00 43.33 C ATOM 507 C SER A 33 -13.041 -10.248 -18.253 1.00 73.31 C ATOM 508 O SER A 33 -13.688 -10.447 -17.221 1.00 63.12 O ATOM 509 CB SER A 33 -14.613 -11.616 -19.667 1.00 63.14 C ATOM 510 OG SER A 33 -15.043 -11.903 -20.999 1.00 22.04 O ATOM 0 H SER A 33 -11.884 -11.385 -20.222 1.00 22.23 H new ATOM 0 HA SER A 33 -14.195 -9.528 -19.929 1.00 43.33 H new ATOM 0 HB2 SER A 33 -14.125 -12.493 -19.241 1.00 63.14 H new ATOM 0 HB3 SER A 33 -15.478 -11.397 -19.041 1.00 63.14 H new ATOM 0 HG SER A 33 -15.658 -12.666 -20.987 1.00 22.04 H new ATOM 516 N LEU A 34 -11.799 -9.847 -18.259 1.00 72.24 N ATOM 517 CA LEU A 34 -10.987 -9.679 -17.082 1.00 40.12 C ATOM 518 C LEU A 34 -10.673 -8.191 -16.867 1.00 61.13 C ATOM 519 O LEU A 34 -10.493 -7.466 -17.828 1.00 21.45 O ATOM 520 CB LEU A 34 -9.704 -10.562 -17.298 1.00 20.51 C ATOM 521 CG LEU A 34 -8.514 -10.461 -16.332 1.00 60.54 C ATOM 522 CD1 LEU A 34 -7.715 -9.187 -16.562 1.00 11.22 C ATOM 523 CD2 LEU A 34 -8.981 -10.546 -14.897 1.00 34.32 C ATOM 0 H LEU A 34 -11.303 -9.618 -19.120 1.00 72.24 H new ATOM 0 HA LEU A 34 -11.496 -10.003 -16.174 1.00 40.12 H new ATOM 0 HB2 LEU A 34 -10.027 -11.603 -17.302 1.00 20.51 H new ATOM 0 HB3 LEU A 34 -9.327 -10.342 -18.297 1.00 20.51 H new ATOM 0 HG LEU A 34 -7.855 -11.306 -16.532 1.00 60.54 H new ATOM 0 HD11 LEU A 34 -6.881 -9.149 -15.861 1.00 11.22 H new ATOM 0 HD12 LEU A 34 -7.332 -9.177 -17.582 1.00 11.22 H new ATOM 0 HD13 LEU A 34 -8.359 -8.321 -16.407 1.00 11.22 H new ATOM 0 HD21 LEU A 34 -8.122 -10.472 -14.230 1.00 34.32 H new ATOM 0 HD22 LEU A 34 -9.672 -9.729 -14.690 1.00 34.32 H new ATOM 0 HD23 LEU A 34 -9.486 -11.498 -14.735 1.00 34.32 H new ATOM 535 N ARG A 35 -10.638 -7.750 -15.606 1.00 53.31 N ATOM 536 CA ARG A 35 -10.290 -6.375 -15.268 1.00 74.55 C ATOM 537 C ARG A 35 -9.075 -6.330 -14.348 1.00 14.12 C ATOM 538 O ARG A 35 -9.152 -6.751 -13.244 1.00 70.13 O ATOM 539 CB ARG A 35 -11.441 -5.682 -14.533 1.00 40.10 C ATOM 540 CG ARG A 35 -12.668 -5.372 -15.345 1.00 4.01 C ATOM 541 CD ARG A 35 -13.691 -4.681 -14.463 1.00 11.52 C ATOM 542 NE ARG A 35 -14.817 -4.148 -15.215 1.00 33.31 N ATOM 543 CZ ARG A 35 -15.715 -3.287 -14.723 1.00 23.25 C ATOM 544 NH1 ARG A 35 -15.688 -2.952 -13.427 1.00 61.21 N ATOM 545 NH2 ARG A 35 -16.648 -2.779 -15.516 1.00 51.04 N ATOM 0 H ARG A 35 -10.849 -8.336 -14.798 1.00 53.31 H new ATOM 0 HA ARG A 35 -10.077 -5.866 -16.208 1.00 74.55 H new ATOM 0 HB2 ARG A 35 -11.738 -6.311 -13.694 1.00 40.10 H new ATOM 0 HB3 ARG A 35 -11.065 -4.749 -14.114 1.00 40.10 H new ATOM 0 HG2 ARG A 35 -12.408 -4.733 -16.189 1.00 4.01 H new ATOM 0 HG3 ARG A 35 -13.087 -6.290 -15.757 1.00 4.01 H new ATOM 0 HD2 ARG A 35 -14.059 -5.388 -13.719 1.00 11.52 H new ATOM 0 HD3 ARG A 35 -13.206 -3.870 -13.920 1.00 11.52 H new ATOM 0 HE ARG A 35 -14.929 -4.451 -16.182 1.00 33.31 H new ATOM 0 HH11 ARG A 35 -14.981 -3.354 -12.811 1.00 61.21 H new ATOM 0 HH12 ARG A 35 -16.374 -2.295 -13.056 1.00 61.21 H new ATOM 0 HH21 ARG A 35 -16.681 -3.045 -16.500 1.00 51.04 H new ATOM 0 HH22 ARG A 35 -17.333 -2.122 -15.142 1.00 51.04 H new ATOM 559 N CYS A 36 -7.994 -5.793 -14.787 1.00 44.22 N ATOM 560 CA CYS A 36 -6.819 -5.649 -13.924 1.00 52.05 C ATOM 561 C CYS A 36 -6.609 -4.170 -13.591 1.00 24.04 C ATOM 562 O CYS A 36 -6.627 -3.340 -14.462 1.00 73.42 O ATOM 563 CB CYS A 36 -5.561 -6.233 -14.591 1.00 44.41 C ATOM 564 SG CYS A 36 -5.274 -8.064 -14.497 1.00 32.22 S ATOM 0 H CYS A 36 -7.873 -5.438 -15.735 1.00 44.22 H new ATOM 0 HA CYS A 36 -6.993 -6.207 -13.004 1.00 52.05 H new ATOM 0 HB2 CYS A 36 -5.586 -5.956 -15.645 1.00 44.41 H new ATOM 0 HB3 CYS A 36 -4.694 -5.739 -14.152 1.00 44.41 H new ATOM 569 N VAL A 37 -6.421 -3.849 -12.319 1.00 72.44 N ATOM 570 CA VAL A 37 -6.308 -2.472 -11.875 1.00 32.21 C ATOM 571 C VAL A 37 -5.014 -2.296 -11.120 1.00 15.44 C ATOM 572 O VAL A 37 -4.694 -3.088 -10.239 1.00 34.23 O ATOM 573 CB VAL A 37 -7.488 -2.058 -10.950 1.00 11.40 C ATOM 574 CG1 VAL A 37 -7.461 -0.563 -10.659 1.00 44.33 C ATOM 575 CG2 VAL A 37 -8.818 -2.485 -11.534 1.00 23.41 C ATOM 0 H VAL A 37 -6.343 -4.536 -11.569 1.00 72.44 H new ATOM 0 HA VAL A 37 -6.332 -1.837 -12.761 1.00 32.21 H new ATOM 0 HB VAL A 37 -7.365 -2.579 -10.001 1.00 11.40 H new ATOM 0 HG11 VAL A 37 -8.298 -0.303 -10.010 1.00 44.33 H new ATOM 0 HG12 VAL A 37 -6.525 -0.306 -10.164 1.00 44.33 H new ATOM 0 HG13 VAL A 37 -7.541 -0.009 -11.594 1.00 44.33 H new ATOM 0 HG21 VAL A 37 -9.623 -2.182 -10.865 1.00 23.41 H new ATOM 0 HG22 VAL A 37 -8.957 -2.013 -12.506 1.00 23.41 H new ATOM 0 HG23 VAL A 37 -8.833 -3.569 -11.652 1.00 23.41 H new ATOM 585 N ILE A 38 -4.273 -1.287 -11.464 1.00 54.13 N ATOM 586 CA ILE A 38 -2.995 -1.059 -10.851 1.00 55.24 C ATOM 587 C ILE A 38 -2.978 0.246 -10.110 1.00 54.32 C ATOM 588 O ILE A 38 -3.248 1.293 -10.682 1.00 32.23 O ATOM 589 CB ILE A 38 -1.839 -1.068 -11.884 1.00 61.54 C ATOM 590 CG1 ILE A 38 -1.880 -2.321 -12.733 1.00 44.40 C ATOM 591 CG2 ILE A 38 -0.486 -0.917 -11.223 1.00 34.44 C ATOM 592 CD1 ILE A 38 -2.726 -2.170 -13.967 1.00 60.14 C ATOM 0 H ILE A 38 -4.533 -0.601 -12.173 1.00 54.13 H new ATOM 0 HA ILE A 38 -2.840 -1.881 -10.152 1.00 55.24 H new ATOM 0 HB ILE A 38 -1.984 -0.204 -12.533 1.00 61.54 H new ATOM 0 HG12 ILE A 38 -0.865 -2.587 -13.026 1.00 44.40 H new ATOM 0 HG13 ILE A 38 -2.266 -3.146 -12.134 1.00 44.40 H new ATOM 0 HG21 ILE A 38 0.294 -0.929 -11.984 1.00 34.44 H new ATOM 0 HG22 ILE A 38 -0.450 0.028 -10.680 1.00 34.44 H new ATOM 0 HG23 ILE A 38 -0.327 -1.741 -10.528 1.00 34.44 H new ATOM 0 HD11 ILE A 38 -2.714 -3.102 -14.532 1.00 60.14 H new ATOM 0 HD12 ILE A 38 -3.750 -1.933 -13.679 1.00 60.14 H new ATOM 0 HD13 ILE A 38 -2.327 -1.366 -14.585 1.00 60.14 H new ATOM 604 N PHE A 39 -2.685 0.156 -8.852 1.00 71.44 N ATOM 605 CA PHE A 39 -2.543 1.277 -7.967 1.00 51.11 C ATOM 606 C PHE A 39 -1.082 1.601 -7.817 1.00 20.44 C ATOM 607 O PHE A 39 -0.332 0.807 -7.226 1.00 53.11 O ATOM 608 CB PHE A 39 -3.072 0.915 -6.586 1.00 30.52 C ATOM 609 CG PHE A 39 -4.543 0.762 -6.482 1.00 2.31 C ATOM 610 CD1 PHE A 39 -5.204 -0.298 -7.085 1.00 24.53 C ATOM 611 CD2 PHE A 39 -5.272 1.688 -5.775 1.00 43.32 C ATOM 612 CE1 PHE A 39 -6.567 -0.421 -6.977 1.00 54.40 C ATOM 613 CE2 PHE A 39 -6.624 1.576 -5.662 1.00 50.45 C ATOM 614 CZ PHE A 39 -7.280 0.518 -6.263 1.00 74.13 C ATOM 0 H PHE A 39 -2.530 -0.740 -8.389 1.00 71.44 H new ATOM 0 HA PHE A 39 -3.095 2.122 -8.378 1.00 51.11 H new ATOM 0 HB2 PHE A 39 -2.605 -0.018 -6.271 1.00 30.52 H new ATOM 0 HB3 PHE A 39 -2.754 1.684 -5.882 1.00 30.52 H new ATOM 0 HD1 PHE A 39 -4.642 -1.032 -7.644 1.00 24.53 H new ATOM 0 HD2 PHE A 39 -4.765 2.516 -5.302 1.00 43.32 H new ATOM 0 HE1 PHE A 39 -7.077 -1.248 -7.448 1.00 54.40 H new ATOM 0 HE2 PHE A 39 -7.183 2.312 -5.104 1.00 50.45 H new ATOM 0 HZ PHE A 39 -8.352 0.427 -6.173 1.00 74.13 H new ATOM 624 N ILE A 40 -0.653 2.713 -8.342 1.00 33.54 N ATOM 625 CA ILE A 40 0.738 3.083 -8.199 1.00 42.05 C ATOM 626 C ILE A 40 0.845 3.938 -6.985 1.00 1.42 C ATOM 627 O ILE A 40 0.218 5.001 -6.917 1.00 4.05 O ATOM 628 CB ILE A 40 1.264 3.892 -9.388 1.00 1.02 C ATOM 629 CG1 ILE A 40 0.794 3.266 -10.678 1.00 33.41 C ATOM 630 CG2 ILE A 40 2.791 3.961 -9.346 1.00 41.20 C ATOM 631 CD1 ILE A 40 1.406 3.863 -11.916 1.00 22.22 C ATOM 0 H ILE A 40 -1.229 3.373 -8.865 1.00 33.54 H new ATOM 0 HA ILE A 40 1.328 2.169 -8.134 1.00 42.05 H new ATOM 0 HB ILE A 40 0.875 4.909 -9.330 1.00 1.02 H new ATOM 0 HG12 ILE A 40 1.019 2.200 -10.654 1.00 33.41 H new ATOM 0 HG13 ILE A 40 -0.290 3.362 -10.741 1.00 33.41 H new ATOM 0 HG21 ILE A 40 3.153 4.539 -10.197 1.00 41.20 H new ATOM 0 HG22 ILE A 40 3.108 4.441 -8.420 1.00 41.20 H new ATOM 0 HG23 ILE A 40 3.202 2.953 -9.391 1.00 41.20 H new ATOM 0 HD11 ILE A 40 1.014 3.355 -12.797 1.00 22.22 H new ATOM 0 HD12 ILE A 40 1.160 4.923 -11.969 1.00 22.22 H new ATOM 0 HD13 ILE A 40 2.489 3.744 -11.880 1.00 22.22 H new ATOM 643 N THR A 41 1.593 3.502 -6.022 1.00 61.34 N ATOM 644 CA THR A 41 1.690 4.243 -4.830 1.00 52.30 C ATOM 645 C THR A 41 3.117 4.712 -4.618 1.00 15.04 C ATOM 646 O THR A 41 4.038 4.233 -5.269 1.00 50.53 O ATOM 647 CB THR A 41 1.194 3.452 -3.594 1.00 14.12 C ATOM 648 OG1 THR A 41 2.069 2.348 -3.320 1.00 73.03 O ATOM 649 CG2 THR A 41 -0.206 2.897 -3.815 1.00 71.53 C ATOM 0 H THR A 41 2.138 2.640 -6.048 1.00 61.34 H new ATOM 0 HA THR A 41 1.035 5.108 -4.937 1.00 52.30 H new ATOM 0 HB THR A 41 1.183 4.147 -2.755 1.00 14.12 H new ATOM 0 HG1 THR A 41 2.675 2.215 -4.078 1.00 73.03 H new ATOM 0 HG21 THR A 41 -0.524 2.348 -2.929 1.00 71.53 H new ATOM 0 HG22 THR A 41 -0.898 3.719 -4.000 1.00 71.53 H new ATOM 0 HG23 THR A 41 -0.200 2.227 -4.675 1.00 71.53 H new ATOM 657 N LYS A 42 3.282 5.622 -3.692 1.00 61.10 N ATOM 658 CA LYS A 42 4.586 6.221 -3.385 1.00 4.34 C ATOM 659 C LYS A 42 5.667 5.250 -2.817 1.00 61.42 C ATOM 660 O LYS A 42 6.795 5.668 -2.573 1.00 3.21 O ATOM 661 CB LYS A 42 4.429 7.515 -2.537 1.00 41.04 C ATOM 662 CG LYS A 42 3.434 7.427 -1.371 1.00 44.14 C ATOM 663 CD LYS A 42 3.779 6.333 -0.399 1.00 20.53 C ATOM 664 CE LYS A 42 2.744 6.235 0.705 1.00 64.31 C ATOM 665 NZ LYS A 42 3.037 5.128 1.629 1.00 2.23 N ATOM 0 H LYS A 42 2.519 5.981 -3.118 1.00 61.10 H new ATOM 0 HA LYS A 42 4.997 6.496 -4.356 1.00 4.34 H new ATOM 0 HB2 LYS A 42 5.406 7.787 -2.138 1.00 41.04 H new ATOM 0 HB3 LYS A 42 4.117 8.325 -3.197 1.00 41.04 H new ATOM 0 HG2 LYS A 42 3.411 8.381 -0.845 1.00 44.14 H new ATOM 0 HG3 LYS A 42 2.432 7.256 -1.765 1.00 44.14 H new ATOM 0 HD2 LYS A 42 3.844 5.381 -0.926 1.00 20.53 H new ATOM 0 HD3 LYS A 42 4.761 6.524 0.035 1.00 20.53 H new ATOM 0 HE2 LYS A 42 2.713 7.173 1.259 1.00 64.31 H new ATOM 0 HE3 LYS A 42 1.757 6.091 0.266 1.00 64.31 H new ATOM 0 HZ1 LYS A 42 2.308 5.092 2.370 1.00 2.23 H new ATOM 0 HZ2 LYS A 42 3.042 4.230 1.104 1.00 2.23 H new ATOM 0 HZ3 LYS A 42 3.968 5.278 2.066 1.00 2.23 H new ATOM 679 N ARG A 43 5.315 3.987 -2.579 1.00 14.51 N ATOM 680 CA ARG A 43 6.311 2.982 -2.168 1.00 13.31 C ATOM 681 C ARG A 43 6.116 1.657 -2.857 1.00 65.11 C ATOM 682 O ARG A 43 6.677 0.653 -2.437 1.00 44.01 O ATOM 683 CB ARG A 43 6.369 2.736 -0.666 1.00 0.01 C ATOM 684 CG ARG A 43 6.937 3.865 0.153 1.00 2.43 C ATOM 685 CD ARG A 43 7.403 3.335 1.486 1.00 0.03 C ATOM 686 NE ARG A 43 8.485 2.335 1.298 1.00 15.24 N ATOM 687 CZ ARG A 43 9.019 1.555 2.259 1.00 4.42 C ATOM 688 NH1 ARG A 43 8.574 1.623 3.510 1.00 31.10 N ATOM 689 NH2 ARG A 43 9.999 0.705 1.952 1.00 21.03 N ATOM 0 H ARG A 43 4.362 3.633 -2.661 1.00 14.51 H new ATOM 0 HA ARG A 43 7.258 3.425 -2.476 1.00 13.31 H new ATOM 0 HB2 ARG A 43 5.361 2.524 -0.311 1.00 0.01 H new ATOM 0 HB3 ARG A 43 6.966 1.842 -0.484 1.00 0.01 H new ATOM 0 HG2 ARG A 43 7.769 4.330 -0.376 1.00 2.43 H new ATOM 0 HG3 ARG A 43 6.182 4.637 0.301 1.00 2.43 H new ATOM 0 HD2 ARG A 43 7.763 4.157 2.105 1.00 0.03 H new ATOM 0 HD3 ARG A 43 6.566 2.879 2.016 1.00 0.03 H new ATOM 0 HE ARG A 43 8.858 2.229 0.355 1.00 15.24 H new ATOM 0 HH11 ARG A 43 7.822 2.269 3.749 1.00 31.10 H new ATOM 0 HH12 ARG A 43 8.984 1.029 4.230 1.00 31.10 H new ATOM 0 HH21 ARG A 43 10.342 0.647 0.993 1.00 21.03 H new ATOM 0 HH22 ARG A 43 10.406 0.113 2.676 1.00 21.03 H new ATOM 703 N GLY A 44 5.361 1.626 -3.904 1.00 31.53 N ATOM 704 CA GLY A 44 5.164 0.377 -4.556 1.00 40.42 C ATOM 705 C GLY A 44 3.875 0.321 -5.267 1.00 74.01 C ATOM 706 O GLY A 44 3.254 1.353 -5.524 1.00 33.31 O ATOM 0 H GLY A 44 4.883 2.427 -4.317 1.00 31.53 H new ATOM 0 HA2 GLY A 44 5.976 0.206 -5.263 1.00 40.42 H new ATOM 0 HA3 GLY A 44 5.207 -0.426 -3.821 1.00 40.42 H new ATOM 710 N LEU A 45 3.428 -0.863 -5.564 1.00 33.42 N ATOM 711 CA LEU A 45 2.232 -1.001 -6.356 1.00 35.31 C ATOM 712 C LEU A 45 1.278 -2.009 -5.781 1.00 0.35 C ATOM 713 O LEU A 45 1.672 -2.989 -5.146 1.00 74.22 O ATOM 714 CB LEU A 45 2.514 -1.386 -7.837 1.00 0.42 C ATOM 715 CG LEU A 45 3.399 -0.451 -8.680 1.00 21.12 C ATOM 716 CD1 LEU A 45 4.872 -0.584 -8.317 1.00 52.51 C ATOM 717 CD2 LEU A 45 3.174 -0.696 -10.158 1.00 71.44 C ATOM 0 H LEU A 45 3.863 -1.740 -5.277 1.00 33.42 H new ATOM 0 HA LEU A 45 1.779 -0.010 -6.333 1.00 35.31 H new ATOM 0 HB2 LEU A 45 2.976 -2.373 -7.841 1.00 0.42 H new ATOM 0 HB3 LEU A 45 1.554 -1.481 -8.344 1.00 0.42 H new ATOM 0 HG LEU A 45 3.107 0.574 -8.453 1.00 21.12 H new ATOM 0 HD11 LEU A 45 5.462 0.093 -8.935 1.00 52.51 H new ATOM 0 HD12 LEU A 45 5.012 -0.331 -7.266 1.00 52.51 H new ATOM 0 HD13 LEU A 45 5.198 -1.610 -8.490 1.00 52.51 H new ATOM 0 HD21 LEU A 45 3.808 -0.026 -10.739 1.00 71.44 H new ATOM 0 HD22 LEU A 45 3.423 -1.730 -10.398 1.00 71.44 H new ATOM 0 HD23 LEU A 45 2.128 -0.509 -10.403 1.00 71.44 H new ATOM 729 N LYS A 46 0.044 -1.747 -5.994 1.00 60.11 N ATOM 730 CA LYS A 46 -1.013 -2.643 -5.680 1.00 12.42 C ATOM 731 C LYS A 46 -1.690 -3.027 -6.979 1.00 53.41 C ATOM 732 O LYS A 46 -2.194 -2.178 -7.695 1.00 53.10 O ATOM 733 CB LYS A 46 -2.004 -1.971 -4.696 1.00 3.21 C ATOM 734 CG LYS A 46 -3.416 -2.543 -4.713 1.00 22.40 C ATOM 735 CD LYS A 46 -4.355 -1.752 -3.808 1.00 1.23 C ATOM 736 CE LYS A 46 -5.803 -2.144 -4.064 1.00 72.55 C ATOM 737 NZ LYS A 46 -6.753 -1.479 -3.136 1.00 62.25 N ATOM 0 H LYS A 46 -0.274 -0.871 -6.407 1.00 60.11 H new ATOM 0 HA LYS A 46 -0.634 -3.539 -5.189 1.00 12.42 H new ATOM 0 HB2 LYS A 46 -1.605 -2.059 -3.686 1.00 3.21 H new ATOM 0 HB3 LYS A 46 -2.056 -0.907 -4.927 1.00 3.21 H new ATOM 0 HG2 LYS A 46 -3.800 -2.534 -5.733 1.00 22.40 H new ATOM 0 HG3 LYS A 46 -3.391 -3.584 -4.391 1.00 22.40 H new ATOM 0 HD2 LYS A 46 -4.102 -1.935 -2.764 1.00 1.23 H new ATOM 0 HD3 LYS A 46 -4.225 -0.684 -3.985 1.00 1.23 H new ATOM 0 HE2 LYS A 46 -6.067 -1.890 -5.090 1.00 72.55 H new ATOM 0 HE3 LYS A 46 -5.904 -3.225 -3.967 1.00 72.55 H new ATOM 0 HZ1 LYS A 46 -7.723 -1.782 -3.356 1.00 62.25 H new ATOM 0 HZ2 LYS A 46 -6.522 -1.741 -2.156 1.00 62.25 H new ATOM 0 HZ3 LYS A 46 -6.680 -0.447 -3.245 1.00 62.25 H new ATOM 751 N VAL A 47 -1.688 -4.278 -7.281 1.00 1.22 N ATOM 752 CA VAL A 47 -2.310 -4.760 -8.478 1.00 71.43 C ATOM 753 C VAL A 47 -3.480 -5.588 -8.114 1.00 74.11 C ATOM 754 O VAL A 47 -3.385 -6.590 -7.398 1.00 22.01 O ATOM 755 CB VAL A 47 -1.335 -5.506 -9.442 1.00 41.01 C ATOM 756 CG1 VAL A 47 -0.310 -4.541 -9.988 1.00 60.13 C ATOM 757 CG2 VAL A 47 -0.633 -6.657 -8.751 1.00 31.20 C ATOM 0 H VAL A 47 -1.256 -5.003 -6.708 1.00 1.22 H new ATOM 0 HA VAL A 47 -2.641 -3.894 -9.051 1.00 71.43 H new ATOM 0 HB VAL A 47 -1.929 -5.916 -10.259 1.00 41.01 H new ATOM 0 HG11 VAL A 47 0.366 -5.070 -10.660 1.00 60.13 H new ATOM 0 HG12 VAL A 47 -0.815 -3.745 -10.535 1.00 60.13 H new ATOM 0 HG13 VAL A 47 0.260 -4.111 -9.164 1.00 60.13 H new ATOM 0 HG21 VAL A 47 0.037 -7.150 -9.455 1.00 31.20 H new ATOM 0 HG22 VAL A 47 -0.056 -6.278 -7.907 1.00 31.20 H new ATOM 0 HG23 VAL A 47 -1.373 -7.372 -8.392 1.00 31.20 H new ATOM 767 N CYS A 48 -4.574 -5.171 -8.556 1.00 12.34 N ATOM 768 CA CYS A 48 -5.770 -5.800 -8.199 1.00 34.44 C ATOM 769 C CYS A 48 -6.414 -6.257 -9.428 1.00 74.41 C ATOM 770 O CYS A 48 -6.731 -5.457 -10.276 1.00 12.44 O ATOM 771 CB CYS A 48 -6.665 -4.819 -7.480 1.00 40.21 C ATOM 772 SG CYS A 48 -8.088 -5.595 -6.698 1.00 43.04 S ATOM 0 H CYS A 48 -4.678 -4.374 -9.184 1.00 12.34 H new ATOM 0 HA CYS A 48 -5.580 -6.643 -7.534 1.00 34.44 H new ATOM 0 HB2 CYS A 48 -6.083 -4.295 -6.722 1.00 40.21 H new ATOM 0 HB3 CYS A 48 -7.013 -4.068 -8.189 1.00 40.21 H new ATOM 777 N CYS A 49 -6.592 -7.513 -9.578 1.00 22.25 N ATOM 778 CA CYS A 49 -7.176 -7.934 -10.772 1.00 30.02 C ATOM 779 C CYS A 49 -8.464 -8.676 -10.497 1.00 32.12 C ATOM 780 O CYS A 49 -8.547 -9.533 -9.597 1.00 24.04 O ATOM 781 CB CYS A 49 -6.190 -8.695 -11.640 1.00 5.12 C ATOM 782 SG CYS A 49 -6.748 -8.861 -13.344 1.00 13.44 S ATOM 0 H CYS A 49 -6.348 -8.242 -8.907 1.00 22.25 H new ATOM 0 HA CYS A 49 -7.450 -7.060 -11.363 1.00 30.02 H new ATOM 0 HB2 CYS A 49 -5.228 -8.182 -11.625 1.00 5.12 H new ATOM 0 HB3 CYS A 49 -6.029 -9.686 -11.216 1.00 5.12 H new ATOM 787 N ASP A 50 -9.441 -8.325 -11.260 1.00 62.42 N ATOM 788 CA ASP A 50 -10.792 -8.731 -11.100 1.00 43.11 C ATOM 789 C ASP A 50 -11.331 -9.426 -12.339 1.00 61.23 C ATOM 790 O ASP A 50 -11.562 -8.806 -13.352 1.00 64.10 O ATOM 791 CB ASP A 50 -11.633 -7.483 -10.824 1.00 13.33 C ATOM 792 CG ASP A 50 -13.109 -7.755 -10.744 1.00 14.22 C ATOM 793 OD1 ASP A 50 -13.555 -8.292 -9.729 1.00 51.41 O ATOM 794 OD2 ASP A 50 -13.845 -7.422 -11.694 1.00 34.00 O ATOM 0 H ASP A 50 -9.308 -7.708 -12.062 1.00 62.42 H new ATOM 0 HA ASP A 50 -10.844 -9.442 -10.275 1.00 43.11 H new ATOM 0 HB2 ASP A 50 -11.304 -7.034 -9.887 1.00 13.33 H new ATOM 0 HB3 ASP A 50 -11.449 -6.751 -11.610 1.00 13.33 H new ATOM 799 N PRO A 51 -11.519 -10.722 -12.276 1.00 5.12 N ATOM 800 CA PRO A 51 -12.194 -11.487 -13.334 1.00 4.13 C ATOM 801 C PRO A 51 -13.714 -11.421 -13.108 1.00 40.11 C ATOM 802 O PRO A 51 -14.454 -12.365 -13.416 1.00 25.03 O ATOM 803 CB PRO A 51 -11.692 -12.899 -13.071 1.00 24.20 C ATOM 804 CG PRO A 51 -11.512 -12.949 -11.602 1.00 20.43 C ATOM 805 CD PRO A 51 -11.071 -11.575 -11.188 1.00 51.24 C ATOM 0 HA PRO A 51 -12.000 -11.132 -14.346 1.00 4.13 H new ATOM 0 HB2 PRO A 51 -12.409 -13.647 -13.411 1.00 24.20 H new ATOM 0 HB3 PRO A 51 -10.756 -13.094 -13.594 1.00 24.20 H new ATOM 0 HG2 PRO A 51 -12.442 -13.226 -11.105 1.00 20.43 H new ATOM 0 HG3 PRO A 51 -10.768 -13.696 -11.326 1.00 20.43 H new ATOM 0 HD2 PRO A 51 -11.519 -11.281 -10.239 1.00 51.24 H new ATOM 0 HD3 PRO A 51 -9.990 -11.524 -11.060 1.00 51.24 H new ATOM 813 N GLN A 52 -14.147 -10.273 -12.595 1.00 73.22 N ATOM 814 CA GLN A 52 -15.506 -9.981 -12.211 1.00 11.13 C ATOM 815 C GLN A 52 -15.894 -10.741 -10.946 1.00 23.33 C ATOM 816 O GLN A 52 -16.508 -11.821 -10.992 1.00 60.12 O ATOM 817 CB GLN A 52 -16.495 -10.141 -13.367 1.00 5.24 C ATOM 818 CG GLN A 52 -16.139 -9.263 -14.565 1.00 11.11 C ATOM 819 CD GLN A 52 -17.100 -9.423 -15.714 1.00 21.14 C ATOM 820 OE1 GLN A 52 -18.101 -8.709 -15.816 1.00 31.31 O ATOM 821 NE2 GLN A 52 -16.816 -10.351 -16.585 1.00 42.55 N ATOM 0 H GLN A 52 -13.519 -9.486 -12.431 1.00 73.22 H new ATOM 0 HA GLN A 52 -15.561 -8.922 -11.957 1.00 11.13 H new ATOM 0 HB2 GLN A 52 -16.518 -11.185 -13.680 1.00 5.24 H new ATOM 0 HB3 GLN A 52 -17.498 -9.889 -13.021 1.00 5.24 H new ATOM 0 HG2 GLN A 52 -16.125 -8.219 -14.252 1.00 11.11 H new ATOM 0 HG3 GLN A 52 -15.132 -9.509 -14.903 1.00 11.11 H new ATOM 0 HE21 GLN A 52 -15.979 -10.922 -16.467 1.00 42.55 H new ATOM 0 HE22 GLN A 52 -17.431 -10.506 -17.384 1.00 42.55 H new ATOM 830 N ALA A 53 -15.445 -10.205 -9.819 1.00 45.23 N ATOM 831 CA ALA A 53 -15.679 -10.795 -8.510 1.00 14.14 C ATOM 832 C ALA A 53 -15.738 -9.718 -7.415 1.00 12.34 C ATOM 833 O ALA A 53 -16.545 -9.798 -6.499 1.00 73.55 O ATOM 834 CB ALA A 53 -14.574 -11.791 -8.191 1.00 32.15 C ATOM 0 H ALA A 53 -14.904 -9.341 -9.789 1.00 45.23 H new ATOM 0 HA ALA A 53 -16.641 -11.307 -8.535 1.00 14.14 H new ATOM 0 HB1 ALA A 53 -14.753 -12.231 -7.210 1.00 32.15 H new ATOM 0 HB2 ALA A 53 -14.565 -12.578 -8.945 1.00 32.15 H new ATOM 0 HB3 ALA A 53 -13.612 -11.279 -8.189 1.00 32.15 H new ATOM 840 N THR A 54 -14.910 -8.693 -7.548 1.00 13.20 N ATOM 841 CA THR A 54 -14.804 -7.619 -6.558 1.00 10.30 C ATOM 842 C THR A 54 -15.848 -6.530 -6.811 1.00 21.13 C ATOM 843 O THR A 54 -15.706 -5.377 -6.377 1.00 74.52 O ATOM 844 CB THR A 54 -13.380 -7.001 -6.562 1.00 42.42 C ATOM 845 OG1 THR A 54 -13.053 -6.473 -7.858 1.00 75.12 O ATOM 846 CG2 THR A 54 -12.347 -8.041 -6.170 1.00 45.22 C ATOM 0 H THR A 54 -14.287 -8.577 -8.348 1.00 13.20 H new ATOM 0 HA THR A 54 -14.993 -8.057 -5.578 1.00 10.30 H new ATOM 0 HB THR A 54 -13.370 -6.189 -5.835 1.00 42.42 H new ATOM 0 HG1 THR A 54 -12.866 -7.212 -8.475 1.00 75.12 H new ATOM 0 HG21 THR A 54 -11.355 -7.590 -6.178 1.00 45.22 H new ATOM 0 HG22 THR A 54 -12.568 -8.414 -5.170 1.00 45.22 H new ATOM 0 HG23 THR A 54 -12.375 -8.868 -6.880 1.00 45.22 H new ATOM 854 N TRP A 55 -16.942 -6.929 -7.426 1.00 34.34 N ATOM 855 CA TRP A 55 -18.037 -6.039 -7.780 1.00 64.45 C ATOM 856 C TRP A 55 -18.862 -5.606 -6.568 1.00 32.50 C ATOM 857 O TRP A 55 -19.921 -4.995 -6.706 1.00 70.45 O ATOM 858 CB TRP A 55 -18.892 -6.642 -8.900 1.00 14.00 C ATOM 859 CG TRP A 55 -18.174 -6.649 -10.225 1.00 63.34 C ATOM 860 CD1 TRP A 55 -16.939 -7.159 -10.484 1.00 53.30 C ATOM 861 CD2 TRP A 55 -18.656 -6.135 -11.473 1.00 43.22 C ATOM 862 NE1 TRP A 55 -16.609 -6.964 -11.794 1.00 44.04 N ATOM 863 CE2 TRP A 55 -17.648 -6.350 -12.429 1.00 53.13 C ATOM 864 CE3 TRP A 55 -19.837 -5.508 -11.872 1.00 5.24 C ATOM 865 CZ2 TRP A 55 -17.785 -5.961 -13.758 1.00 1.13 C ATOM 866 CZ3 TRP A 55 -19.973 -5.126 -13.191 1.00 35.11 C ATOM 867 CH2 TRP A 55 -18.953 -5.355 -14.121 1.00 31.55 C ATOM 0 H TRP A 55 -17.102 -7.898 -7.701 1.00 34.34 H new ATOM 0 HA TRP A 55 -17.598 -5.120 -8.169 1.00 64.45 H new ATOM 0 HB2 TRP A 55 -19.169 -7.662 -8.634 1.00 14.00 H new ATOM 0 HB3 TRP A 55 -19.818 -6.074 -8.994 1.00 14.00 H new ATOM 0 HD1 TRP A 55 -16.309 -7.649 -9.756 1.00 53.30 H new ATOM 0 HE1 TRP A 55 -15.727 -7.234 -12.228 1.00 44.04 H new ATOM 0 HE3 TRP A 55 -20.630 -5.325 -11.162 1.00 5.24 H new ATOM 0 HZ2 TRP A 55 -16.996 -6.132 -14.476 1.00 1.13 H new ATOM 0 HZ3 TRP A 55 -20.883 -4.641 -13.511 1.00 35.11 H new ATOM 0 HH2 TRP A 55 -19.093 -5.046 -15.146 1.00 31.55 H new ATOM 878 N VAL A 56 -18.327 -5.885 -5.378 1.00 45.22 N ATOM 879 CA VAL A 56 -18.884 -5.405 -4.119 1.00 1.33 C ATOM 880 C VAL A 56 -18.606 -3.897 -4.018 1.00 74.12 C ATOM 881 O VAL A 56 -19.120 -3.204 -3.139 1.00 70.21 O ATOM 882 CB VAL A 56 -18.267 -6.144 -2.890 1.00 34.44 C ATOM 883 CG1 VAL A 56 -18.552 -7.636 -2.968 1.00 65.33 C ATOM 884 CG2 VAL A 56 -16.761 -5.897 -2.782 1.00 64.21 C ATOM 0 H VAL A 56 -17.489 -6.455 -5.264 1.00 45.22 H new ATOM 0 HA VAL A 56 -19.955 -5.605 -4.107 1.00 1.33 H new ATOM 0 HB VAL A 56 -18.736 -5.740 -1.993 1.00 34.44 H new ATOM 0 HG11 VAL A 56 -18.115 -8.136 -2.104 1.00 65.33 H new ATOM 0 HG12 VAL A 56 -19.629 -7.801 -2.976 1.00 65.33 H new ATOM 0 HG13 VAL A 56 -18.116 -8.042 -3.881 1.00 65.33 H new ATOM 0 HG21 VAL A 56 -16.367 -6.427 -1.915 1.00 64.21 H new ATOM 0 HG22 VAL A 56 -16.267 -6.259 -3.684 1.00 64.21 H new ATOM 0 HG23 VAL A 56 -16.575 -4.829 -2.670 1.00 64.21 H new ATOM 894 N ARG A 57 -17.742 -3.433 -4.940 1.00 32.10 N ATOM 895 CA ARG A 57 -17.423 -2.034 -5.159 1.00 74.11 C ATOM 896 C ARG A 57 -16.544 -1.428 -4.080 1.00 4.14 C ATOM 897 O ARG A 57 -17.021 -1.027 -3.008 1.00 30.51 O ATOM 898 CB ARG A 57 -18.692 -1.204 -5.421 1.00 3.23 C ATOM 899 CG ARG A 57 -18.469 0.283 -5.641 1.00 44.43 C ATOM 900 CD ARG A 57 -19.797 0.978 -5.870 1.00 34.14 C ATOM 901 NE ARG A 57 -20.700 0.788 -4.727 1.00 5.34 N ATOM 902 CZ ARG A 57 -22.021 0.629 -4.805 1.00 51.41 C ATOM 903 NH1 ARG A 57 -22.626 0.590 -5.994 1.00 44.22 N ATOM 904 NH2 ARG A 57 -22.736 0.492 -3.693 1.00 22.32 N ATOM 0 H ARG A 57 -17.235 -4.055 -5.569 1.00 32.10 H new ATOM 0 HA ARG A 57 -16.815 -2.001 -6.063 1.00 74.11 H new ATOM 0 HB2 ARG A 57 -19.197 -1.611 -6.297 1.00 3.23 H new ATOM 0 HB3 ARG A 57 -19.369 -1.331 -4.576 1.00 3.23 H new ATOM 0 HG2 ARG A 57 -17.967 0.716 -4.776 1.00 44.43 H new ATOM 0 HG3 ARG A 57 -17.815 0.438 -6.499 1.00 44.43 H new ATOM 0 HD2 ARG A 57 -19.630 2.043 -6.032 1.00 34.14 H new ATOM 0 HD3 ARG A 57 -20.264 0.588 -6.774 1.00 34.14 H new ATOM 0 HE ARG A 57 -20.281 0.777 -3.797 1.00 5.34 H new ATOM 0 HH11 ARG A 57 -22.077 0.682 -6.849 1.00 44.22 H new ATOM 0 HH12 ARG A 57 -23.637 0.468 -6.048 1.00 44.22 H new ATOM 0 HH21 ARG A 57 -22.274 0.509 -2.784 1.00 22.32 H new ATOM 0 HH22 ARG A 57 -23.747 0.370 -3.749 1.00 22.32 H new ATOM 918 N ASP A 58 -15.258 -1.417 -4.369 1.00 71.51 N ATOM 919 CA ASP A 58 -14.243 -0.762 -3.561 1.00 54.43 C ATOM 920 C ASP A 58 -12.926 -0.832 -4.285 1.00 1.10 C ATOM 921 O ASP A 58 -12.149 -1.771 -4.120 1.00 25.12 O ATOM 922 CB ASP A 58 -14.094 -1.324 -2.139 1.00 21.13 C ATOM 923 CG ASP A 58 -13.106 -0.504 -1.315 1.00 53.41 C ATOM 924 OD1 ASP A 58 -13.524 0.508 -0.717 1.00 70.43 O ATOM 925 OD2 ASP A 58 -11.898 -0.846 -1.261 1.00 42.01 O ATOM 0 H ASP A 58 -14.877 -1.876 -5.196 1.00 71.51 H new ATOM 0 HA ASP A 58 -14.570 0.269 -3.428 1.00 54.43 H new ATOM 0 HB2 ASP A 58 -15.066 -1.329 -1.645 1.00 21.13 H new ATOM 0 HB3 ASP A 58 -13.757 -2.359 -2.189 1.00 21.13 H new ATOM 930 N VAL A 59 -12.724 0.092 -5.152 1.00 44.42 N ATOM 931 CA VAL A 59 -11.496 0.174 -5.898 1.00 0.12 C ATOM 932 C VAL A 59 -11.127 1.633 -6.115 1.00 75.30 C ATOM 933 O VAL A 59 -9.960 2.004 -6.019 1.00 21.34 O ATOM 934 CB VAL A 59 -11.561 -0.627 -7.259 1.00 54.35 C ATOM 935 CG1 VAL A 59 -12.649 -0.114 -8.192 1.00 55.04 C ATOM 936 CG2 VAL A 59 -10.212 -0.643 -7.961 1.00 22.14 C ATOM 0 H VAL A 59 -13.401 0.822 -5.374 1.00 44.42 H new ATOM 0 HA VAL A 59 -10.710 -0.303 -5.313 1.00 0.12 H new ATOM 0 HB VAL A 59 -11.824 -1.652 -6.997 1.00 54.35 H new ATOM 0 HG11 VAL A 59 -12.647 -0.701 -9.110 1.00 55.04 H new ATOM 0 HG12 VAL A 59 -13.620 -0.206 -7.704 1.00 55.04 H new ATOM 0 HG13 VAL A 59 -12.460 0.933 -8.430 1.00 55.04 H new ATOM 0 HG21 VAL A 59 -10.293 -1.202 -8.893 1.00 22.14 H new ATOM 0 HG22 VAL A 59 -9.902 0.379 -8.177 1.00 22.14 H new ATOM 0 HG23 VAL A 59 -9.472 -1.118 -7.317 1.00 22.14 H new ATOM 946 N VAL A 60 -12.152 2.454 -6.343 1.00 24.14 N ATOM 947 CA VAL A 60 -12.005 3.878 -6.573 1.00 53.24 C ATOM 948 C VAL A 60 -11.268 4.134 -7.880 1.00 24.40 C ATOM 949 O VAL A 60 -10.031 4.114 -7.942 1.00 20.42 O ATOM 950 CB VAL A 60 -11.303 4.628 -5.393 1.00 12.52 C ATOM 951 CG1 VAL A 60 -11.239 6.131 -5.657 1.00 4.14 C ATOM 952 CG2 VAL A 60 -12.009 4.349 -4.073 1.00 22.33 C ATOM 0 H VAL A 60 -13.121 2.136 -6.372 1.00 24.14 H new ATOM 0 HA VAL A 60 -13.014 4.284 -6.639 1.00 53.24 H new ATOM 0 HB VAL A 60 -10.283 4.251 -5.322 1.00 12.52 H new ATOM 0 HG11 VAL A 60 -10.746 6.627 -4.821 1.00 4.14 H new ATOM 0 HG12 VAL A 60 -10.676 6.316 -6.572 1.00 4.14 H new ATOM 0 HG13 VAL A 60 -12.250 6.524 -5.768 1.00 4.14 H new ATOM 0 HG21 VAL A 60 -11.501 4.882 -3.269 1.00 22.33 H new ATOM 0 HG22 VAL A 60 -13.044 4.686 -4.135 1.00 22.33 H new ATOM 0 HG23 VAL A 60 -11.988 3.279 -3.868 1.00 22.33 H new ATOM 962 N ARG A 61 -12.025 4.317 -8.926 1.00 40.33 N ATOM 963 CA ARG A 61 -11.466 4.594 -10.220 1.00 23.15 C ATOM 964 C ARG A 61 -10.977 6.027 -10.240 1.00 64.24 C ATOM 965 O ARG A 61 -11.753 6.966 -10.439 1.00 34.11 O ATOM 966 CB ARG A 61 -12.503 4.349 -11.313 1.00 21.01 C ATOM 967 CG ARG A 61 -13.037 2.920 -11.340 1.00 71.21 C ATOM 968 CD ARG A 61 -14.114 2.753 -12.393 1.00 62.43 C ATOM 969 NE ARG A 61 -13.610 2.989 -13.746 1.00 3.33 N ATOM 970 CZ ARG A 61 -14.303 3.552 -14.741 1.00 53.52 C ATOM 971 NH1 ARG A 61 -15.519 4.055 -14.524 1.00 65.33 N ATOM 972 NH2 ARG A 61 -13.765 3.633 -15.941 1.00 44.14 N ATOM 0 H ARG A 61 -13.044 4.279 -8.906 1.00 40.33 H new ATOM 0 HA ARG A 61 -10.626 3.926 -10.413 1.00 23.15 H new ATOM 0 HB2 ARG A 61 -13.337 5.037 -11.172 1.00 21.01 H new ATOM 0 HB3 ARG A 61 -12.059 4.580 -12.281 1.00 21.01 H new ATOM 0 HG2 ARG A 61 -12.219 2.228 -11.541 1.00 71.21 H new ATOM 0 HG3 ARG A 61 -13.440 2.662 -10.361 1.00 71.21 H new ATOM 0 HD2 ARG A 61 -14.526 1.746 -12.332 1.00 62.43 H new ATOM 0 HD3 ARG A 61 -14.931 3.444 -12.186 1.00 62.43 H new ATOM 0 HE ARG A 61 -12.652 2.701 -13.946 1.00 3.33 H new ATOM 0 HH11 ARG A 61 -15.929 4.012 -13.591 1.00 65.33 H new ATOM 0 HH12 ARG A 61 -16.038 4.482 -15.291 1.00 65.33 H new ATOM 0 HH21 ARG A 61 -12.827 3.268 -16.105 1.00 44.14 H new ATOM 0 HH22 ARG A 61 -14.287 4.061 -16.706 1.00 44.14 H new ATOM 986 N SER A 62 -9.711 6.201 -9.974 1.00 70.44 N ATOM 987 CA SER A 62 -9.152 7.506 -9.869 1.00 11.45 C ATOM 988 C SER A 62 -8.696 8.023 -11.221 1.00 35.13 C ATOM 989 O SER A 62 -7.574 7.751 -11.669 1.00 2.44 O ATOM 990 CB SER A 62 -8.018 7.540 -8.833 1.00 2.44 C ATOM 991 OG SER A 62 -7.540 8.864 -8.622 1.00 51.42 O ATOM 0 H SER A 62 -9.047 5.441 -9.826 1.00 70.44 H new ATOM 0 HA SER A 62 -9.935 8.178 -9.517 1.00 11.45 H new ATOM 0 HB2 SER A 62 -8.374 7.127 -7.889 1.00 2.44 H new ATOM 0 HB3 SER A 62 -7.198 6.906 -9.170 1.00 2.44 H new ATOM 0 HG SER A 62 -6.821 8.850 -7.957 1.00 51.42 H new ATOM 997 N MET A 63 -9.611 8.695 -11.882 1.00 54.14 N ATOM 998 CA MET A 63 -9.386 9.379 -13.141 1.00 20.23 C ATOM 999 C MET A 63 -10.259 10.592 -13.177 1.00 33.14 C ATOM 1000 O MET A 63 -11.477 10.488 -13.355 1.00 23.22 O ATOM 1001 CB MET A 63 -9.676 8.494 -14.374 1.00 42.43 C ATOM 1002 CG MET A 63 -8.657 7.406 -14.636 1.00 63.42 C ATOM 1003 SD MET A 63 -7.010 8.075 -14.936 1.00 32.10 S ATOM 1004 CE MET A 63 -6.085 6.575 -15.214 1.00 40.03 C ATOM 0 H MET A 63 -10.570 8.785 -11.547 1.00 54.14 H new ATOM 0 HA MET A 63 -8.330 9.644 -13.193 1.00 20.23 H new ATOM 0 HB2 MET A 63 -10.655 8.031 -14.248 1.00 42.43 H new ATOM 0 HB3 MET A 63 -9.737 9.133 -15.255 1.00 42.43 H new ATOM 0 HG2 MET A 63 -8.623 6.729 -13.782 1.00 63.42 H new ATOM 0 HG3 MET A 63 -8.971 6.816 -15.498 1.00 63.42 H new ATOM 0 HE1 MET A 63 -5.237 6.538 -14.530 1.00 40.03 H new ATOM 0 HE2 MET A 63 -6.729 5.713 -15.040 1.00 40.03 H new ATOM 0 HE3 MET A 63 -5.723 6.556 -16.242 1.00 40.03 H new ATOM 1014 N ASP A 64 -9.671 11.726 -12.947 1.00 4.21 N ATOM 1015 CA ASP A 64 -10.413 12.961 -12.964 1.00 72.20 C ATOM 1016 C ASP A 64 -9.870 13.892 -14.023 1.00 22.01 C ATOM 1017 O ASP A 64 -10.589 14.270 -14.949 1.00 15.23 O ATOM 1018 CB ASP A 64 -10.416 13.629 -11.591 1.00 20.52 C ATOM 1019 CG ASP A 64 -11.171 14.935 -11.596 1.00 72.03 C ATOM 1020 OD1 ASP A 64 -12.416 14.911 -11.674 1.00 4.13 O ATOM 1021 OD2 ASP A 64 -10.530 16.003 -11.541 1.00 65.42 O ATOM 0 H ASP A 64 -8.677 11.828 -12.744 1.00 4.21 H new ATOM 0 HA ASP A 64 -11.448 12.728 -13.213 1.00 72.20 H new ATOM 0 HB2 ASP A 64 -10.864 12.955 -10.861 1.00 20.52 H new ATOM 0 HB3 ASP A 64 -9.389 13.806 -11.272 1.00 20.52 H new ATOM 1026 N ARG A 65 -8.616 14.252 -13.901 1.00 4.50 N ATOM 1027 CA ARG A 65 -7.975 15.079 -14.894 1.00 72.21 C ATOM 1028 C ARG A 65 -6.534 14.639 -15.039 1.00 22.31 C ATOM 1029 O ARG A 65 -5.714 14.861 -14.144 1.00 64.54 O ATOM 1030 CB ARG A 65 -8.049 16.568 -14.522 1.00 23.03 C ATOM 1031 CG ARG A 65 -7.523 17.495 -15.610 1.00 63.00 C ATOM 1032 CD ARG A 65 -7.609 18.958 -15.201 1.00 74.01 C ATOM 1033 NE ARG A 65 -6.741 19.279 -14.058 1.00 20.30 N ATOM 1034 CZ ARG A 65 -6.727 20.455 -13.417 1.00 24.22 C ATOM 1035 NH1 ARG A 65 -7.587 21.401 -13.742 1.00 60.32 N ATOM 1036 NH2 ARG A 65 -5.858 20.669 -12.439 1.00 30.11 N ATOM 0 H ARG A 65 -8.017 13.984 -13.120 1.00 4.50 H new ATOM 0 HA ARG A 65 -8.497 14.960 -15.843 1.00 72.21 H new ATOM 0 HB2 ARG A 65 -9.085 16.828 -14.304 1.00 23.03 H new ATOM 0 HB3 ARG A 65 -7.479 16.734 -13.608 1.00 23.03 H new ATOM 0 HG2 ARG A 65 -6.487 17.241 -15.833 1.00 63.00 H new ATOM 0 HG3 ARG A 65 -8.094 17.340 -16.526 1.00 63.00 H new ATOM 0 HD2 ARG A 65 -7.333 19.585 -16.049 1.00 74.01 H new ATOM 0 HD3 ARG A 65 -8.641 19.200 -14.948 1.00 74.01 H new ATOM 0 HE ARG A 65 -6.104 18.554 -13.730 1.00 20.30 H new ATOM 0 HH11 ARG A 65 -8.267 21.239 -14.485 1.00 60.32 H new ATOM 0 HH12 ARG A 65 -7.572 22.295 -13.251 1.00 60.32 H new ATOM 0 HH21 ARG A 65 -5.199 19.937 -12.174 1.00 30.11 H new ATOM 0 HH22 ARG A 65 -5.849 21.565 -11.952 1.00 30.11 H new ATOM 1050 N LYS A 66 -6.236 14.009 -16.138 1.00 2.02 N ATOM 1051 CA LYS A 66 -4.912 13.465 -16.385 1.00 44.31 C ATOM 1052 C LYS A 66 -4.117 14.355 -17.330 1.00 63.32 C ATOM 1053 O LYS A 66 -4.689 15.019 -18.215 1.00 35.15 O ATOM 1054 CB LYS A 66 -5.012 12.036 -16.945 1.00 10.14 C ATOM 1055 CG LYS A 66 -5.855 11.923 -18.217 1.00 23.34 C ATOM 1056 CD LYS A 66 -5.900 10.498 -18.760 1.00 52.33 C ATOM 1057 CE LYS A 66 -4.526 10.016 -19.206 1.00 34.14 C ATOM 1058 NZ LYS A 66 -4.581 8.655 -19.759 1.00 13.12 N ATOM 0 H LYS A 66 -6.899 13.852 -16.897 1.00 2.02 H new ATOM 0 HA LYS A 66 -4.382 13.430 -15.433 1.00 44.31 H new ATOM 0 HB2 LYS A 66 -4.008 11.667 -17.153 1.00 10.14 H new ATOM 0 HB3 LYS A 66 -5.438 11.386 -16.180 1.00 10.14 H new ATOM 0 HG2 LYS A 66 -6.870 12.262 -18.008 1.00 23.34 H new ATOM 0 HG3 LYS A 66 -5.448 12.587 -18.980 1.00 23.34 H new ATOM 0 HD2 LYS A 66 -6.288 9.829 -17.992 1.00 52.33 H new ATOM 0 HD3 LYS A 66 -6.592 10.452 -19.601 1.00 52.33 H new ATOM 0 HE2 LYS A 66 -4.127 10.698 -19.957 1.00 34.14 H new ATOM 0 HE3 LYS A 66 -3.840 10.037 -18.359 1.00 34.14 H new ATOM 0 HZ1 LYS A 66 -3.628 8.361 -20.052 1.00 13.12 H new ATOM 0 HZ2 LYS A 66 -4.938 8.000 -19.034 1.00 13.12 H new ATOM 0 HZ3 LYS A 66 -5.216 8.640 -20.582 1.00 13.12 H new TER 1072 LYS A 66 ATOM 1073 N VAL B 201 32.427 -8.269 0.384 1.00 43.14 N ATOM 1074 CA VAL B 201 31.242 -8.996 -0.034 1.00 42.01 C ATOM 1075 C VAL B 201 29.991 -8.151 0.215 1.00 3.45 C ATOM 1076 O VAL B 201 29.737 -7.703 1.346 1.00 12.54 O ATOM 1077 CB VAL B 201 31.121 -10.360 0.703 1.00 24.20 C ATOM 1078 CG1 VAL B 201 29.878 -11.125 0.251 1.00 12.44 C ATOM 1079 CG2 VAL B 201 32.372 -11.200 0.478 1.00 45.55 C ATOM 0 HA VAL B 201 31.333 -9.199 -1.101 1.00 42.01 H new ATOM 0 HB VAL B 201 31.022 -10.157 1.769 1.00 24.20 H new ATOM 0 HG11 VAL B 201 29.821 -12.074 0.784 1.00 12.44 H new ATOM 0 HG12 VAL B 201 28.988 -10.534 0.467 1.00 12.44 H new ATOM 0 HG13 VAL B 201 29.937 -11.314 -0.821 1.00 12.44 H new ATOM 0 HG21 VAL B 201 32.271 -12.151 1.001 1.00 45.55 H new ATOM 0 HG22 VAL B 201 32.500 -11.384 -0.589 1.00 45.55 H new ATOM 0 HG23 VAL B 201 33.242 -10.667 0.861 1.00 45.55 H new ATOM 1089 N GLY B 202 29.243 -7.923 -0.830 1.00 14.43 N ATOM 1090 CA GLY B 202 28.036 -7.154 -0.748 1.00 33.34 C ATOM 1091 C GLY B 202 27.497 -6.910 -2.123 1.00 44.53 C ATOM 1092 O GLY B 202 28.025 -7.458 -3.094 1.00 72.44 O ATOM 0 H GLY B 202 29.457 -8.268 -1.766 1.00 14.43 H new ATOM 0 HA2 GLY B 202 27.297 -7.683 -0.146 1.00 33.34 H new ATOM 0 HA3 GLY B 202 28.232 -6.204 -0.250 1.00 33.34 H new ATOM 1096 N SER B 203 26.482 -6.112 -2.236 1.00 32.42 N ATOM 1097 CA SER B 203 25.907 -5.835 -3.518 1.00 34.33 C ATOM 1098 C SER B 203 26.486 -4.550 -4.107 1.00 23.43 C ATOM 1099 O SER B 203 26.003 -3.448 -3.840 1.00 24.24 O ATOM 1100 CB SER B 203 24.379 -5.784 -3.437 1.00 12.40 C ATOM 1101 OG SER B 203 23.858 -7.025 -2.961 1.00 2.43 O ATOM 0 H SER B 203 26.032 -5.638 -1.453 1.00 32.42 H new ATOM 0 HA SER B 203 26.168 -6.651 -4.192 1.00 34.33 H new ATOM 0 HB2 SER B 203 24.072 -4.976 -2.773 1.00 12.40 H new ATOM 0 HB3 SER B 203 23.965 -5.563 -4.421 1.00 12.40 H new ATOM 0 HG SER B 203 22.880 -6.973 -2.914 1.00 2.43 H new ATOM 1107 N GLU B 204 27.556 -4.701 -4.868 1.00 30.03 N ATOM 1108 CA GLU B 204 28.207 -3.571 -5.516 1.00 34.31 C ATOM 1109 C GLU B 204 27.670 -3.378 -6.924 1.00 54.34 C ATOM 1110 O GLU B 204 28.115 -2.490 -7.662 1.00 23.22 O ATOM 1111 CB GLU B 204 29.724 -3.764 -5.545 1.00 34.31 C ATOM 1112 CG GLU B 204 30.375 -3.813 -4.173 1.00 53.20 C ATOM 1113 CD GLU B 204 30.125 -2.562 -3.363 1.00 13.20 C ATOM 1114 OE1 GLU B 204 30.823 -1.546 -3.584 1.00 31.53 O ATOM 1115 OE2 GLU B 204 29.234 -2.582 -2.477 1.00 63.45 O ATOM 0 H GLU B 204 27.997 -5.602 -5.054 1.00 30.03 H new ATOM 0 HA GLU B 204 27.986 -2.675 -4.937 1.00 34.31 H new ATOM 0 HB2 GLU B 204 29.951 -4.689 -6.075 1.00 34.31 H new ATOM 0 HB3 GLU B 204 30.171 -2.951 -6.117 1.00 34.31 H new ATOM 0 HG2 GLU B 204 29.996 -4.676 -3.626 1.00 53.20 H new ATOM 0 HG3 GLU B 204 31.449 -3.956 -4.290 1.00 53.20 H new ATOM 1122 N VAL B 205 26.709 -4.203 -7.282 1.00 13.32 N ATOM 1123 CA VAL B 205 26.076 -4.139 -8.579 1.00 62.13 C ATOM 1124 C VAL B 205 25.138 -2.937 -8.666 1.00 1.51 C ATOM 1125 O VAL B 205 24.291 -2.721 -7.789 1.00 62.24 O ATOM 1126 CB VAL B 205 25.315 -5.460 -8.936 1.00 1.41 C ATOM 1127 CG1 VAL B 205 26.291 -6.619 -9.061 1.00 1.03 C ATOM 1128 CG2 VAL B 205 24.251 -5.793 -7.888 1.00 65.04 C ATOM 0 H VAL B 205 26.344 -4.940 -6.678 1.00 13.32 H new ATOM 0 HA VAL B 205 26.871 -4.018 -9.315 1.00 62.13 H new ATOM 0 HB VAL B 205 24.817 -5.303 -9.893 1.00 1.41 H new ATOM 0 HG11 VAL B 205 25.745 -7.529 -9.309 1.00 1.03 H new ATOM 0 HG12 VAL B 205 27.014 -6.403 -9.848 1.00 1.03 H new ATOM 0 HG13 VAL B 205 26.815 -6.757 -8.115 1.00 1.03 H new ATOM 0 HG21 VAL B 205 23.742 -6.716 -8.167 1.00 65.04 H new ATOM 0 HG22 VAL B 205 24.726 -5.920 -6.915 1.00 65.04 H new ATOM 0 HG23 VAL B 205 23.526 -4.981 -7.835 1.00 65.04 H new ATOM 1138 N SER B 206 25.314 -2.146 -9.688 1.00 55.02 N ATOM 1139 CA SER B 206 24.484 -0.988 -9.893 1.00 74.25 C ATOM 1140 C SER B 206 23.270 -1.338 -10.743 1.00 71.03 C ATOM 1141 O SER B 206 22.251 -0.633 -10.725 1.00 15.44 O ATOM 1142 CB SER B 206 25.299 0.119 -10.548 1.00 71.33 C ATOM 1143 OG SER B 206 26.406 0.477 -9.728 1.00 62.04 O ATOM 0 H SER B 206 26.032 -2.283 -10.399 1.00 55.02 H new ATOM 0 HA SER B 206 24.124 -0.637 -8.926 1.00 74.25 H new ATOM 0 HB2 SER B 206 25.654 -0.212 -11.524 1.00 71.33 H new ATOM 0 HB3 SER B 206 24.668 0.991 -10.718 1.00 71.33 H new ATOM 0 HG SER B 206 26.920 1.188 -10.164 1.00 62.04 H new ATOM 1149 N ASP B 207 23.367 -2.430 -11.470 1.00 64.22 N ATOM 1150 CA ASP B 207 22.287 -2.841 -12.325 1.00 32.11 C ATOM 1151 C ASP B 207 21.370 -3.802 -11.650 1.00 15.30 C ATOM 1152 O ASP B 207 21.647 -4.995 -11.551 1.00 75.34 O ATOM 1153 CB ASP B 207 22.764 -3.355 -13.681 1.00 72.35 C ATOM 1154 CG ASP B 207 23.306 -2.238 -14.530 1.00 42.12 C ATOM 1155 OD1 ASP B 207 22.496 -1.517 -15.159 1.00 0.12 O ATOM 1156 OD2 ASP B 207 24.542 -2.044 -14.572 1.00 13.20 O ATOM 0 H ASP B 207 24.182 -3.044 -11.483 1.00 64.22 H new ATOM 0 HA ASP B 207 21.707 -1.941 -12.531 1.00 32.11 H new ATOM 0 HB2 ASP B 207 23.536 -4.111 -13.535 1.00 72.35 H new ATOM 0 HB3 ASP B 207 21.937 -3.840 -14.200 1.00 72.35 H new ATOM 1161 N LYS B 208 20.288 -3.267 -11.166 1.00 55.51 N ATOM 1162 CA LYS B 208 19.274 -4.012 -10.478 1.00 2.14 C ATOM 1163 C LYS B 208 17.940 -3.684 -11.102 1.00 75.35 C ATOM 1164 O LYS B 208 17.592 -2.513 -11.233 1.00 33.15 O ATOM 1165 CB LYS B 208 19.241 -3.601 -8.999 1.00 51.55 C ATOM 1166 CG LYS B 208 20.523 -3.886 -8.219 1.00 1.42 C ATOM 1167 CD LYS B 208 20.470 -3.292 -6.811 1.00 71.01 C ATOM 1168 CE LYS B 208 19.298 -3.831 -5.994 1.00 31.11 C ATOM 1169 NZ LYS B 208 19.238 -3.222 -4.647 1.00 62.41 N ATOM 0 H LYS B 208 20.080 -2.271 -11.241 1.00 55.51 H new ATOM 0 HA LYS B 208 19.485 -5.079 -10.552 1.00 2.14 H new ATOM 0 HB2 LYS B 208 19.027 -2.534 -8.939 1.00 51.55 H new ATOM 0 HB3 LYS B 208 18.415 -4.119 -8.512 1.00 51.55 H new ATOM 0 HG2 LYS B 208 20.678 -4.963 -8.154 1.00 1.42 H new ATOM 0 HG3 LYS B 208 21.376 -3.473 -8.757 1.00 1.42 H new ATOM 0 HD2 LYS B 208 21.403 -3.512 -6.292 1.00 71.01 H new ATOM 0 HD3 LYS B 208 20.392 -2.207 -6.880 1.00 71.01 H new ATOM 0 HE2 LYS B 208 18.366 -3.634 -6.523 1.00 31.11 H new ATOM 0 HE3 LYS B 208 19.389 -4.913 -5.899 1.00 31.11 H new ATOM 0 HZ1 LYS B 208 18.429 -3.614 -4.124 1.00 62.41 H new ATOM 0 HZ2 LYS B 208 20.117 -3.431 -4.132 1.00 62.41 H new ATOM 0 HZ3 LYS B 208 19.126 -2.192 -4.736 1.00 62.41 H new ATOM 1183 N ARG B 209 17.211 -4.687 -11.511 1.00 44.43 N ATOM 1184 CA ARG B 209 15.890 -4.464 -12.054 1.00 21.12 C ATOM 1185 C ARG B 209 14.881 -4.578 -10.952 1.00 62.51 C ATOM 1186 O ARG B 209 14.610 -5.678 -10.451 1.00 2.24 O ATOM 1187 CB ARG B 209 15.528 -5.415 -13.228 1.00 1.43 C ATOM 1188 CG ARG B 209 16.325 -5.204 -14.523 1.00 44.04 C ATOM 1189 CD ARG B 209 17.791 -5.549 -14.370 1.00 3.44 C ATOM 1190 NE ARG B 209 17.984 -6.967 -14.085 1.00 20.43 N ATOM 1191 CZ ARG B 209 19.127 -7.524 -13.696 1.00 31.03 C ATOM 1192 NH1 ARG B 209 20.199 -6.770 -13.462 1.00 11.30 N ATOM 1193 NH2 ARG B 209 19.188 -8.838 -13.528 1.00 0.02 N ATOM 0 H ARG B 209 17.504 -5.664 -11.481 1.00 44.43 H new ATOM 0 HA ARG B 209 15.881 -3.460 -12.478 1.00 21.12 H new ATOM 0 HB2 ARG B 209 15.673 -6.443 -12.897 1.00 1.43 H new ATOM 0 HB3 ARG B 209 14.468 -5.299 -13.452 1.00 1.43 H new ATOM 0 HG2 ARG B 209 15.893 -5.816 -15.315 1.00 44.04 H new ATOM 0 HG3 ARG B 209 16.232 -4.164 -14.837 1.00 44.04 H new ATOM 0 HD2 ARG B 209 18.324 -5.285 -15.283 1.00 3.44 H new ATOM 0 HD3 ARG B 209 18.223 -4.954 -13.566 1.00 3.44 H new ATOM 0 HE ARG B 209 17.177 -7.581 -14.193 1.00 20.43 H new ATOM 0 HH11 ARG B 209 20.147 -5.758 -13.581 1.00 11.30 H new ATOM 0 HH12 ARG B 209 21.073 -7.204 -13.164 1.00 11.30 H new ATOM 0 HH21 ARG B 209 18.362 -9.413 -13.697 1.00 0.02 H new ATOM 0 HH22 ARG B 209 20.061 -9.274 -13.230 1.00 0.02 H new ATOM 1207 N THR B 210 14.369 -3.463 -10.517 1.00 54.13 N ATOM 1208 CA THR B 210 13.403 -3.461 -9.480 1.00 12.04 C ATOM 1209 C THR B 210 12.025 -3.812 -10.021 1.00 12.23 C ATOM 1210 O THR B 210 11.220 -2.940 -10.368 1.00 13.33 O ATOM 1211 CB THR B 210 13.400 -2.110 -8.742 1.00 3.54 C ATOM 1212 OG1 THR B 210 13.413 -1.041 -9.711 1.00 33.41 O ATOM 1213 CG2 THR B 210 14.617 -1.988 -7.834 1.00 23.22 C ATOM 0 H THR B 210 14.614 -2.540 -10.875 1.00 54.13 H new ATOM 0 HA THR B 210 13.672 -4.230 -8.756 1.00 12.04 H new ATOM 0 HB THR B 210 12.502 -2.047 -8.127 1.00 3.54 H new ATOM 0 HG1 THR B 210 12.505 -0.895 -10.050 1.00 33.41 H new ATOM 0 HG21 THR B 210 14.594 -1.026 -7.323 1.00 23.22 H new ATOM 0 HG22 THR B 210 14.603 -2.791 -7.097 1.00 23.22 H new ATOM 0 HG23 THR B 210 15.526 -2.060 -8.432 1.00 23.22 H new ATOM 1221 N CYS B 211 11.781 -5.093 -10.125 1.00 74.00 N ATOM 1222 CA CYS B 211 10.535 -5.585 -10.617 1.00 50.41 C ATOM 1223 C CYS B 211 9.976 -6.520 -9.585 1.00 0.45 C ATOM 1224 O CYS B 211 10.737 -7.225 -8.904 1.00 75.30 O ATOM 1225 CB CYS B 211 10.722 -6.372 -11.925 1.00 71.40 C ATOM 1226 SG CYS B 211 11.767 -5.585 -13.224 1.00 23.11 S ATOM 0 H CYS B 211 12.448 -5.821 -9.868 1.00 74.00 H new ATOM 0 HA CYS B 211 9.871 -4.742 -10.811 1.00 50.41 H new ATOM 0 HB2 CYS B 211 11.157 -7.341 -11.680 1.00 71.40 H new ATOM 0 HB3 CYS B 211 9.737 -6.563 -12.351 1.00 71.40 H new ATOM 1231 N VAL B 212 8.693 -6.531 -9.452 1.00 51.53 N ATOM 1232 CA VAL B 212 8.019 -7.397 -8.523 1.00 72.22 C ATOM 1233 C VAL B 212 6.872 -8.113 -9.239 1.00 74.12 C ATOM 1234 O VAL B 212 6.133 -7.499 -10.015 1.00 41.02 O ATOM 1235 CB VAL B 212 7.533 -6.621 -7.250 1.00 32.10 C ATOM 1236 CG1 VAL B 212 8.720 -6.185 -6.404 1.00 54.14 C ATOM 1237 CG2 VAL B 212 6.726 -5.390 -7.640 1.00 23.30 C ATOM 0 H VAL B 212 8.066 -5.933 -9.990 1.00 51.53 H new ATOM 0 HA VAL B 212 8.723 -8.147 -8.163 1.00 72.22 H new ATOM 0 HB VAL B 212 6.902 -7.297 -6.673 1.00 32.10 H new ATOM 0 HG11 VAL B 212 8.363 -5.648 -5.525 1.00 54.14 H new ATOM 0 HG12 VAL B 212 9.284 -7.063 -6.089 1.00 54.14 H new ATOM 0 HG13 VAL B 212 9.365 -5.531 -6.991 1.00 54.14 H new ATOM 0 HG21 VAL B 212 6.400 -4.869 -6.740 1.00 23.30 H new ATOM 0 HG22 VAL B 212 7.345 -4.724 -8.241 1.00 23.30 H new ATOM 0 HG23 VAL B 212 5.854 -5.695 -8.219 1.00 23.30 H new ATOM 1247 N SER B 213 6.741 -9.390 -9.023 1.00 20.23 N ATOM 1248 CA SER B 213 5.756 -10.160 -9.741 1.00 51.05 C ATOM 1249 C SER B 213 4.989 -11.126 -8.847 1.00 74.20 C ATOM 1250 O SER B 213 5.565 -11.787 -7.976 1.00 0.25 O ATOM 1251 CB SER B 213 6.440 -10.896 -10.905 1.00 53.22 C ATOM 1252 OG SER B 213 7.576 -11.640 -10.458 1.00 31.24 O ATOM 0 H SER B 213 7.301 -9.923 -8.358 1.00 20.23 H new ATOM 0 HA SER B 213 5.010 -9.469 -10.133 1.00 51.05 H new ATOM 0 HB2 SER B 213 5.727 -11.569 -11.381 1.00 53.22 H new ATOM 0 HB3 SER B 213 6.750 -10.175 -11.661 1.00 53.22 H new ATOM 0 HG SER B 213 7.988 -12.098 -11.220 1.00 31.24 H new ATOM 1258 N LEU B 214 3.689 -11.183 -9.048 1.00 31.21 N ATOM 1259 CA LEU B 214 2.836 -12.125 -8.314 1.00 4.32 C ATOM 1260 C LEU B 214 1.877 -12.851 -9.208 1.00 12.45 C ATOM 1261 O LEU B 214 1.357 -12.295 -10.186 1.00 71.45 O ATOM 1262 CB LEU B 214 2.063 -11.482 -7.162 1.00 12.14 C ATOM 1263 CG LEU B 214 2.869 -11.083 -5.928 1.00 73.13 C ATOM 1264 CD1 LEU B 214 1.961 -10.436 -4.900 1.00 1.35 C ATOM 1265 CD2 LEU B 214 3.554 -12.299 -5.316 1.00 4.55 C ATOM 0 H LEU B 214 3.189 -10.592 -9.712 1.00 31.21 H new ATOM 0 HA LEU B 214 3.537 -12.843 -7.888 1.00 4.32 H new ATOM 0 HB2 LEU B 214 1.564 -10.592 -7.544 1.00 12.14 H new ATOM 0 HB3 LEU B 214 1.283 -12.175 -6.848 1.00 12.14 H new ATOM 0 HG LEU B 214 3.633 -10.369 -6.234 1.00 73.13 H new ATOM 0 HD11 LEU B 214 2.545 -10.155 -4.024 1.00 1.35 H new ATOM 0 HD12 LEU B 214 1.501 -9.546 -5.330 1.00 1.35 H new ATOM 0 HD13 LEU B 214 1.183 -11.141 -4.607 1.00 1.35 H new ATOM 0 HD21 LEU B 214 4.123 -11.993 -4.438 1.00 4.55 H new ATOM 0 HD22 LEU B 214 2.802 -13.032 -5.023 1.00 4.55 H new ATOM 0 HD23 LEU B 214 4.228 -12.744 -6.048 1.00 4.55 H new ATOM 1277 N THR B 215 1.650 -14.091 -8.879 1.00 60.23 N ATOM 1278 CA THR B 215 0.718 -14.901 -9.570 1.00 62.03 C ATOM 1279 C THR B 215 -0.628 -14.904 -8.856 1.00 32.25 C ATOM 1280 O THR B 215 -0.713 -15.151 -7.644 1.00 75.15 O ATOM 1281 CB THR B 215 1.261 -16.326 -9.762 1.00 14.01 C ATOM 1282 OG1 THR B 215 1.789 -16.820 -8.509 1.00 33.42 O ATOM 1283 CG2 THR B 215 2.348 -16.340 -10.828 1.00 51.43 C ATOM 0 H THR B 215 2.121 -14.565 -8.108 1.00 60.23 H new ATOM 0 HA THR B 215 0.565 -14.476 -10.562 1.00 62.03 H new ATOM 0 HB THR B 215 0.447 -16.973 -10.088 1.00 14.01 H new ATOM 0 HG1 THR B 215 1.231 -16.500 -7.770 1.00 33.42 H new ATOM 0 HG21 THR B 215 2.723 -17.356 -10.952 1.00 51.43 H new ATOM 0 HG22 THR B 215 1.935 -15.987 -11.773 1.00 51.43 H new ATOM 0 HG23 THR B 215 3.165 -15.687 -10.523 1.00 51.43 H new ATOM 1291 N THR B 216 -1.646 -14.615 -9.598 1.00 12.44 N ATOM 1292 CA THR B 216 -2.984 -14.531 -9.112 1.00 23.10 C ATOM 1293 C THR B 216 -3.902 -14.976 -10.232 1.00 72.40 C ATOM 1294 O THR B 216 -3.601 -14.714 -11.407 1.00 42.53 O ATOM 1295 CB THR B 216 -3.333 -13.074 -8.639 1.00 2.32 C ATOM 1296 OG1 THR B 216 -4.703 -12.983 -8.232 1.00 70.45 O ATOM 1297 CG2 THR B 216 -3.056 -12.038 -9.731 1.00 3.44 C ATOM 0 H THR B 216 -1.566 -14.424 -10.597 1.00 12.44 H new ATOM 0 HA THR B 216 -3.107 -15.174 -8.240 1.00 23.10 H new ATOM 0 HB THR B 216 -2.688 -12.856 -7.788 1.00 2.32 H new ATOM 0 HG1 THR B 216 -4.897 -12.068 -7.940 1.00 70.45 H new ATOM 0 HG21 THR B 216 -3.311 -11.044 -9.363 1.00 3.44 H new ATOM 0 HG22 THR B 216 -2.000 -12.066 -9.999 1.00 3.44 H new ATOM 0 HG23 THR B 216 -3.660 -12.265 -10.610 1.00 3.44 H new ATOM 1305 N GLN B 217 -4.997 -15.675 -9.874 1.00 32.35 N ATOM 1306 CA GLN B 217 -5.961 -16.221 -10.842 1.00 63.20 C ATOM 1307 C GLN B 217 -5.323 -17.349 -11.654 1.00 2.14 C ATOM 1308 O GLN B 217 -4.172 -17.731 -11.421 1.00 72.43 O ATOM 1309 CB GLN B 217 -6.463 -15.139 -11.803 1.00 43.05 C ATOM 1310 CG GLN B 217 -7.133 -13.957 -11.155 1.00 72.00 C ATOM 1311 CD GLN B 217 -7.476 -12.914 -12.179 1.00 63.12 C ATOM 1312 OE1 GLN B 217 -8.540 -12.928 -12.749 1.00 5.13 O ATOM 1313 NE2 GLN B 217 -6.562 -12.017 -12.429 1.00 30.41 N ATOM 0 H GLN B 217 -5.236 -15.876 -8.903 1.00 32.35 H new ATOM 0 HA GLN B 217 -6.807 -16.607 -10.274 1.00 63.20 H new ATOM 0 HB2 GLN B 217 -5.618 -14.779 -12.390 1.00 43.05 H new ATOM 0 HB3 GLN B 217 -7.165 -15.595 -12.501 1.00 43.05 H new ATOM 0 HG2 GLN B 217 -8.038 -14.282 -10.642 1.00 72.00 H new ATOM 0 HG3 GLN B 217 -6.475 -13.529 -10.399 1.00 72.00 H new ATOM 0 HE21 GLN B 217 -5.675 -12.039 -11.926 1.00 30.41 H new ATOM 0 HE22 GLN B 217 -6.735 -11.294 -13.128 1.00 30.41 H new ATOM 1322 N ARG B 218 -6.079 -17.896 -12.569 1.00 53.24 N ATOM 1323 CA ARG B 218 -5.575 -18.911 -13.471 1.00 70.21 C ATOM 1324 C ARG B 218 -6.231 -18.773 -14.837 1.00 54.24 C ATOM 1325 O ARG B 218 -6.213 -19.694 -15.655 1.00 50.45 O ATOM 1326 CB ARG B 218 -5.748 -20.322 -12.868 1.00 62.42 C ATOM 1327 CG ARG B 218 -7.159 -20.665 -12.442 1.00 11.11 C ATOM 1328 CD ARG B 218 -7.214 -22.022 -11.763 1.00 72.41 C ATOM 1329 NE ARG B 218 -8.553 -22.315 -11.257 1.00 63.31 N ATOM 1330 CZ ARG B 218 -8.832 -23.132 -10.235 1.00 51.41 C ATOM 1331 NH1 ARG B 218 -7.860 -23.822 -9.626 1.00 52.53 N ATOM 1332 NH2 ARG B 218 -10.088 -23.263 -9.832 1.00 11.12 N ATOM 0 H ARG B 218 -7.059 -17.655 -12.714 1.00 53.24 H new ATOM 0 HA ARG B 218 -4.504 -18.764 -13.610 1.00 70.21 H new ATOM 0 HB2 ARG B 218 -5.417 -21.057 -13.601 1.00 62.42 H new ATOM 0 HB3 ARG B 218 -5.090 -20.415 -12.004 1.00 62.42 H new ATOM 0 HG2 ARG B 218 -7.532 -19.900 -11.761 1.00 11.11 H new ATOM 0 HG3 ARG B 218 -7.815 -20.664 -13.313 1.00 11.11 H new ATOM 0 HD2 ARG B 218 -6.914 -22.796 -12.470 1.00 72.41 H new ATOM 0 HD3 ARG B 218 -6.500 -22.047 -10.940 1.00 72.41 H new ATOM 0 HE ARG B 218 -9.339 -21.860 -11.721 1.00 63.31 H new ATOM 0 HH11 ARG B 218 -6.894 -23.728 -9.940 1.00 52.53 H new ATOM 0 HH12 ARG B 218 -8.085 -24.442 -8.848 1.00 52.53 H new ATOM 0 HH21 ARG B 218 -10.831 -22.744 -10.300 1.00 11.12 H new ATOM 0 HH22 ARG B 218 -10.312 -23.883 -9.054 1.00 11.12 H new ATOM 1346 N LEU B 219 -6.760 -17.584 -15.101 1.00 63.15 N ATOM 1347 CA LEU B 219 -7.388 -17.293 -16.380 1.00 41.54 C ATOM 1348 C LEU B 219 -6.322 -16.886 -17.370 1.00 74.44 C ATOM 1349 O LEU B 219 -5.540 -15.976 -17.093 1.00 1.02 O ATOM 1350 CB LEU B 219 -8.427 -16.140 -16.304 1.00 31.34 C ATOM 1351 CG LEU B 219 -9.677 -16.314 -15.425 1.00 45.23 C ATOM 1352 CD1 LEU B 219 -9.337 -16.308 -13.952 1.00 31.20 C ATOM 1353 CD2 LEU B 219 -10.683 -15.227 -15.743 1.00 30.23 C ATOM 0 H LEU B 219 -6.765 -16.805 -14.443 1.00 63.15 H new ATOM 0 HA LEU B 219 -7.912 -18.199 -16.685 1.00 41.54 H new ATOM 0 HB2 LEU B 219 -7.904 -15.249 -15.958 1.00 31.34 H new ATOM 0 HB3 LEU B 219 -8.766 -15.936 -17.320 1.00 31.34 H new ATOM 0 HG LEU B 219 -10.113 -17.287 -15.650 1.00 45.23 H new ATOM 0 HD11 LEU B 219 -10.249 -16.433 -13.368 1.00 31.20 H new ATOM 0 HD12 LEU B 219 -8.651 -17.126 -13.734 1.00 31.20 H new ATOM 0 HD13 LEU B 219 -8.866 -15.360 -13.691 1.00 31.20 H new ATOM 0 HD21 LEU B 219 -11.567 -15.355 -15.118 1.00 30.23 H new ATOM 0 HD22 LEU B 219 -10.238 -14.251 -15.548 1.00 30.23 H new ATOM 0 HD23 LEU B 219 -10.969 -15.292 -16.793 1.00 30.23 H new ATOM 1365 N PRO B 220 -6.250 -17.543 -18.523 1.00 74.23 N ATOM 1366 CA PRO B 220 -5.283 -17.189 -19.529 1.00 51.04 C ATOM 1367 C PRO B 220 -5.635 -15.862 -20.196 1.00 31.11 C ATOM 1368 O PRO B 220 -6.814 -15.564 -20.463 1.00 1.51 O ATOM 1369 CB PRO B 220 -5.355 -18.336 -20.538 1.00 23.24 C ATOM 1370 CG PRO B 220 -6.712 -18.920 -20.362 1.00 61.05 C ATOM 1371 CD PRO B 220 -7.099 -18.681 -18.929 1.00 55.10 C ATOM 0 HA PRO B 220 -4.285 -17.056 -19.111 1.00 51.04 H new ATOM 0 HB2 PRO B 220 -5.210 -17.975 -21.556 1.00 23.24 H new ATOM 0 HB3 PRO B 220 -4.579 -19.077 -20.349 1.00 23.24 H new ATOM 0 HG2 PRO B 220 -7.426 -18.452 -21.040 1.00 61.05 H new ATOM 0 HG3 PRO B 220 -6.708 -19.986 -20.590 1.00 61.05 H new ATOM 0 HD2 PRO B 220 -8.159 -18.444 -18.834 1.00 55.10 H new ATOM 0 HD3 PRO B 220 -6.913 -19.560 -18.312 1.00 55.10 H new ATOM 1379 N VAL B 221 -4.632 -15.080 -20.464 1.00 64.44 N ATOM 1380 CA VAL B 221 -4.814 -13.801 -21.096 1.00 55.24 C ATOM 1381 C VAL B 221 -4.617 -13.938 -22.592 1.00 15.14 C ATOM 1382 O VAL B 221 -4.002 -14.904 -23.049 1.00 35.32 O ATOM 1383 CB VAL B 221 -3.841 -12.729 -20.525 1.00 52.22 C ATOM 1384 CG1 VAL B 221 -4.113 -12.506 -19.047 1.00 14.10 C ATOM 1385 CG2 VAL B 221 -2.384 -13.139 -20.738 1.00 30.42 C ATOM 0 H VAL B 221 -3.661 -15.309 -20.251 1.00 64.44 H new ATOM 0 HA VAL B 221 -5.830 -13.466 -20.887 1.00 55.24 H new ATOM 0 HB VAL B 221 -4.013 -11.796 -21.062 1.00 52.22 H new ATOM 0 HG11 VAL B 221 -3.426 -11.754 -18.660 1.00 14.10 H new ATOM 0 HG12 VAL B 221 -5.139 -12.163 -18.914 1.00 14.10 H new ATOM 0 HG13 VAL B 221 -3.970 -13.441 -18.506 1.00 14.10 H new ATOM 0 HG21 VAL B 221 -1.727 -12.372 -20.329 1.00 30.42 H new ATOM 0 HG22 VAL B 221 -2.195 -14.086 -20.232 1.00 30.42 H new ATOM 0 HG23 VAL B 221 -2.190 -13.252 -21.805 1.00 30.42 H new ATOM 1395 N SER B 222 -5.153 -13.005 -23.340 1.00 11.10 N ATOM 1396 CA SER B 222 -5.024 -13.003 -24.787 1.00 24.53 C ATOM 1397 C SER B 222 -3.560 -12.819 -25.235 1.00 3.22 C ATOM 1398 O SER B 222 -3.156 -13.323 -26.288 1.00 44.31 O ATOM 1399 CB SER B 222 -5.890 -11.888 -25.363 1.00 63.22 C ATOM 1400 OG SER B 222 -7.233 -12.017 -24.923 1.00 25.22 O ATOM 0 H SER B 222 -5.692 -12.223 -22.968 1.00 11.10 H new ATOM 0 HA SER B 222 -5.358 -13.971 -25.161 1.00 24.53 H new ATOM 0 HB2 SER B 222 -5.494 -10.919 -25.059 1.00 63.22 H new ATOM 0 HB3 SER B 222 -5.854 -11.919 -26.452 1.00 63.22 H new ATOM 0 HG SER B 222 -7.772 -11.292 -25.302 1.00 25.22 H new ATOM 1406 N ARG B 223 -2.776 -12.109 -24.432 1.00 52.20 N ATOM 1407 CA ARG B 223 -1.394 -11.814 -24.768 1.00 34.22 C ATOM 1408 C ARG B 223 -0.698 -11.202 -23.558 1.00 34.23 C ATOM 1409 O ARG B 223 -1.338 -10.492 -22.774 1.00 11.31 O ATOM 1410 CB ARG B 223 -1.372 -10.818 -25.944 1.00 53.24 C ATOM 1411 CG ARG B 223 0.002 -10.389 -26.408 1.00 34.52 C ATOM 1412 CD ARG B 223 -0.109 -9.403 -27.551 1.00 75.20 C ATOM 1413 NE ARG B 223 1.194 -8.898 -27.976 1.00 32.35 N ATOM 1414 CZ ARG B 223 1.375 -7.936 -28.884 1.00 72.02 C ATOM 1415 NH1 ARG B 223 0.335 -7.403 -29.521 1.00 13.54 N ATOM 1416 NH2 ARG B 223 2.592 -7.514 -29.167 1.00 11.43 N ATOM 0 H ARG B 223 -3.080 -11.726 -23.537 1.00 52.20 H new ATOM 0 HA ARG B 223 -0.874 -12.729 -25.052 1.00 34.22 H new ATOM 0 HB2 ARG B 223 -1.898 -11.266 -26.787 1.00 53.24 H new ATOM 0 HB3 ARG B 223 -1.933 -9.929 -25.655 1.00 53.24 H new ATOM 0 HG2 ARG B 223 0.547 -9.935 -25.580 1.00 34.52 H new ATOM 0 HG3 ARG B 223 0.574 -11.261 -26.726 1.00 34.52 H new ATOM 0 HD2 ARG B 223 -0.603 -9.883 -28.396 1.00 75.20 H new ATOM 0 HD3 ARG B 223 -0.739 -8.567 -27.247 1.00 75.20 H new ATOM 0 HE ARG B 223 2.024 -9.309 -27.549 1.00 32.35 H new ATOM 0 HH11 ARG B 223 -0.610 -7.729 -29.317 1.00 13.54 H new ATOM 0 HH12 ARG B 223 0.483 -6.668 -30.213 1.00 13.54 H new ATOM 0 HH21 ARG B 223 3.397 -7.923 -28.692 1.00 11.43 H new ATOM 0 HH22 ARG B 223 2.728 -6.779 -29.861 1.00 11.43 H new ATOM 1430 N ILE B 224 0.588 -11.495 -23.394 1.00 13.52 N ATOM 1431 CA ILE B 224 1.396 -10.887 -22.344 1.00 54.51 C ATOM 1432 C ILE B 224 1.705 -9.491 -22.826 1.00 74.53 C ATOM 1433 O ILE B 224 2.571 -9.287 -23.693 1.00 14.11 O ATOM 1434 CB ILE B 224 2.752 -11.648 -22.115 1.00 22.42 C ATOM 1435 CG1 ILE B 224 2.538 -13.177 -21.902 1.00 21.43 C ATOM 1436 CG2 ILE B 224 3.525 -11.047 -20.931 1.00 60.32 C ATOM 1437 CD1 ILE B 224 1.706 -13.554 -20.720 1.00 30.43 C ATOM 0 H ILE B 224 1.096 -12.156 -23.981 1.00 13.52 H new ATOM 0 HA ILE B 224 0.853 -10.912 -21.399 1.00 54.51 H new ATOM 0 HB ILE B 224 3.344 -11.522 -23.022 1.00 22.42 H new ATOM 0 HG12 ILE B 224 2.073 -13.589 -22.798 1.00 21.43 H new ATOM 0 HG13 ILE B 224 3.514 -13.652 -21.803 1.00 21.43 H new ATOM 0 HG21 ILE B 224 4.459 -11.591 -20.793 1.00 60.32 H new ATOM 0 HG22 ILE B 224 3.742 -9.998 -21.133 1.00 60.32 H new ATOM 0 HG23 ILE B 224 2.923 -11.125 -20.026 1.00 60.32 H new ATOM 0 HD11 ILE B 224 1.621 -14.639 -20.666 1.00 30.43 H new ATOM 0 HD12 ILE B 224 2.176 -13.181 -19.810 1.00 30.43 H new ATOM 0 HD13 ILE B 224 0.712 -13.117 -20.820 1.00 30.43 H new ATOM 1449 N LYS B 225 0.973 -8.566 -22.333 1.00 11.02 N ATOM 1450 CA LYS B 225 1.075 -7.219 -22.775 1.00 4.34 C ATOM 1451 C LYS B 225 1.769 -6.374 -21.741 1.00 10.25 C ATOM 1452 O LYS B 225 1.652 -6.632 -20.534 1.00 20.34 O ATOM 1453 CB LYS B 225 -0.319 -6.680 -23.079 1.00 4.45 C ATOM 1454 CG LYS B 225 -1.252 -6.698 -21.882 1.00 52.23 C ATOM 1455 CD LYS B 225 -2.637 -6.210 -22.229 1.00 64.43 C ATOM 1456 CE LYS B 225 -3.345 -7.134 -23.177 1.00 42.41 C ATOM 1457 NZ LYS B 225 -4.698 -6.644 -23.498 1.00 75.10 N ATOM 0 H LYS B 225 0.277 -8.719 -21.603 1.00 11.02 H new ATOM 0 HA LYS B 225 1.673 -7.182 -23.686 1.00 4.34 H new ATOM 0 HB2 LYS B 225 -0.232 -5.657 -23.446 1.00 4.45 H new ATOM 0 HB3 LYS B 225 -0.760 -7.270 -23.882 1.00 4.45 H new ATOM 0 HG2 LYS B 225 -1.315 -7.712 -21.488 1.00 52.23 H new ATOM 0 HG3 LYS B 225 -0.837 -6.074 -21.091 1.00 52.23 H new ATOM 0 HD2 LYS B 225 -3.224 -6.110 -21.316 1.00 64.43 H new ATOM 0 HD3 LYS B 225 -2.569 -5.218 -22.675 1.00 64.43 H new ATOM 0 HE2 LYS B 225 -2.764 -7.231 -24.094 1.00 42.41 H new ATOM 0 HE3 LYS B 225 -3.412 -8.128 -22.736 1.00 42.41 H new ATOM 0 HZ1 LYS B 225 -5.259 -7.418 -23.907 1.00 75.10 H new ATOM 0 HZ2 LYS B 225 -5.159 -6.303 -22.630 1.00 75.10 H new ATOM 0 HZ3 LYS B 225 -4.631 -5.865 -24.183 1.00 75.10 H new ATOM 1471 N THR B 226 2.498 -5.399 -22.203 1.00 22.24 N ATOM 1472 CA THR B 226 3.188 -4.502 -21.344 1.00 34.22 C ATOM 1473 C THR B 226 2.663 -3.087 -21.478 1.00 4.04 C ATOM 1474 O THR B 226 2.436 -2.595 -22.583 1.00 74.04 O ATOM 1475 CB THR B 226 4.708 -4.544 -21.586 1.00 54.21 C ATOM 1476 OG1 THR B 226 4.995 -4.501 -23.002 1.00 4.22 O ATOM 1477 CG2 THR B 226 5.324 -5.779 -20.965 1.00 54.20 C ATOM 0 H THR B 226 2.626 -5.209 -23.197 1.00 22.24 H new ATOM 0 HA THR B 226 3.002 -4.833 -20.322 1.00 34.22 H new ATOM 0 HB THR B 226 5.149 -3.668 -21.110 1.00 54.21 H new ATOM 0 HG1 THR B 226 5.965 -4.527 -23.140 1.00 4.22 H new ATOM 0 HG21 THR B 226 6.398 -5.783 -21.151 1.00 54.20 H new ATOM 0 HG22 THR B 226 5.142 -5.775 -19.890 1.00 54.20 H new ATOM 0 HG23 THR B 226 4.876 -6.670 -21.406 1.00 54.20 H new ATOM 1485 N TYR B 227 2.414 -2.472 -20.360 1.00 65.13 N ATOM 1486 CA TYR B 227 2.002 -1.089 -20.303 1.00 65.24 C ATOM 1487 C TYR B 227 3.082 -0.292 -19.616 1.00 32.11 C ATOM 1488 O TYR B 227 3.577 -0.712 -18.580 1.00 44.22 O ATOM 1489 CB TYR B 227 0.657 -0.943 -19.570 1.00 1.24 C ATOM 1490 CG TYR B 227 -0.518 -1.521 -20.318 1.00 74.32 C ATOM 1491 CD1 TYR B 227 -1.162 -0.776 -21.295 1.00 10.44 C ATOM 1492 CD2 TYR B 227 -0.981 -2.807 -20.059 1.00 30.43 C ATOM 1493 CE1 TYR B 227 -2.235 -1.284 -21.989 1.00 71.33 C ATOM 1494 CE2 TYR B 227 -2.057 -3.324 -20.752 1.00 73.43 C ATOM 1495 CZ TYR B 227 -2.678 -2.554 -21.718 1.00 24.51 C ATOM 1496 OH TYR B 227 -3.744 -3.060 -22.416 1.00 73.40 O ATOM 0 H TYR B 227 2.491 -2.918 -19.446 1.00 65.13 H new ATOM 0 HA TYR B 227 1.858 -0.710 -21.315 1.00 65.24 H new ATOM 0 HB2 TYR B 227 0.730 -1.431 -18.598 1.00 1.24 H new ATOM 0 HB3 TYR B 227 0.470 0.114 -19.383 1.00 1.24 H new ATOM 0 HD1 TYR B 227 -0.814 0.222 -21.515 1.00 10.44 H new ATOM 0 HD2 TYR B 227 -0.493 -3.408 -19.306 1.00 30.43 H new ATOM 0 HE1 TYR B 227 -2.726 -0.687 -22.743 1.00 71.33 H new ATOM 0 HE2 TYR B 227 -2.411 -4.322 -20.541 1.00 73.43 H new ATOM 0 HH TYR B 227 -3.765 -2.665 -23.313 1.00 73.40 H new ATOM 1506 N THR B 228 3.468 0.822 -20.187 1.00 50.41 N ATOM 1507 CA THR B 228 4.528 1.607 -19.609 1.00 61.34 C ATOM 1508 C THR B 228 3.969 2.901 -19.019 1.00 34.30 C ATOM 1509 O THR B 228 3.240 3.649 -19.685 1.00 33.44 O ATOM 1510 CB THR B 228 5.633 1.903 -20.637 1.00 12.15 C ATOM 1511 OG1 THR B 228 6.007 0.664 -21.256 1.00 20.25 O ATOM 1512 CG2 THR B 228 6.863 2.472 -19.940 1.00 73.03 C ATOM 0 H THR B 228 3.068 1.203 -21.044 1.00 50.41 H new ATOM 0 HA THR B 228 4.979 1.026 -18.805 1.00 61.34 H new ATOM 0 HB THR B 228 5.265 2.622 -21.369 1.00 12.15 H new ATOM 0 HG1 THR B 228 6.711 0.828 -21.918 1.00 20.25 H new ATOM 0 HG21 THR B 228 7.638 2.677 -20.679 1.00 73.03 H new ATOM 0 HG22 THR B 228 6.596 3.396 -19.428 1.00 73.03 H new ATOM 0 HG23 THR B 228 7.236 1.750 -19.214 1.00 73.03 H new ATOM 1520 N ILE B 229 4.288 3.136 -17.783 1.00 54.21 N ATOM 1521 CA ILE B 229 3.781 4.256 -17.049 1.00 5.15 C ATOM 1522 C ILE B 229 4.951 5.213 -16.774 1.00 10.30 C ATOM 1523 O ILE B 229 6.097 4.784 -16.786 1.00 33.34 O ATOM 1524 CB ILE B 229 3.208 3.793 -15.689 1.00 43.02 C ATOM 1525 CG1 ILE B 229 2.592 2.394 -15.791 1.00 4.42 C ATOM 1526 CG2 ILE B 229 2.118 4.739 -15.325 1.00 4.22 C ATOM 1527 CD1 ILE B 229 2.045 1.825 -14.512 1.00 64.15 C ATOM 0 H ILE B 229 4.920 2.543 -17.245 1.00 54.21 H new ATOM 0 HA ILE B 229 2.993 4.741 -17.626 1.00 5.15 H new ATOM 0 HB ILE B 229 4.011 3.770 -14.952 1.00 43.02 H new ATOM 0 HG12 ILE B 229 1.788 2.424 -16.526 1.00 4.42 H new ATOM 0 HG13 ILE B 229 3.350 1.711 -16.176 1.00 4.42 H new ATOM 0 HG21 ILE B 229 1.686 4.446 -14.368 1.00 4.22 H new ATOM 0 HG22 ILE B 229 2.523 5.748 -15.246 1.00 4.22 H new ATOM 0 HG23 ILE B 229 1.345 4.717 -16.094 1.00 4.22 H new ATOM 0 HD11 ILE B 229 1.635 0.833 -14.701 1.00 64.15 H new ATOM 0 HD12 ILE B 229 2.845 1.752 -13.775 1.00 64.15 H new ATOM 0 HD13 ILE B 229 1.259 2.476 -14.131 1.00 64.15 H new ATOM 1539 N THR B 230 4.671 6.481 -16.592 1.00 42.12 N ATOM 1540 CA THR B 230 5.700 7.474 -16.291 1.00 61.24 C ATOM 1541 C THR B 230 5.270 8.461 -15.173 1.00 73.04 C ATOM 1542 O THR B 230 4.538 9.437 -15.427 1.00 75.13 O ATOM 1543 CB THR B 230 6.218 8.224 -17.560 1.00 41.51 C ATOM 1544 OG1 THR B 230 5.116 8.700 -18.357 1.00 4.10 O ATOM 1545 CG2 THR B 230 7.114 7.332 -18.412 1.00 14.30 C ATOM 0 H THR B 230 3.727 6.864 -16.646 1.00 42.12 H new ATOM 0 HA THR B 230 6.546 6.906 -15.903 1.00 61.24 H new ATOM 0 HB THR B 230 6.806 9.074 -17.213 1.00 41.51 H new ATOM 0 HG1 THR B 230 4.465 9.150 -17.779 1.00 4.10 H new ATOM 0 HG21 THR B 230 7.455 7.887 -19.286 1.00 14.30 H new ATOM 0 HG22 THR B 230 7.976 7.014 -17.825 1.00 14.30 H new ATOM 0 HG23 THR B 230 6.553 6.456 -18.736 1.00 14.30 H new ATOM 1553 N GLU B 231 5.699 8.212 -13.954 1.00 51.24 N ATOM 1554 CA GLU B 231 5.354 9.068 -12.841 1.00 15.00 C ATOM 1555 C GLU B 231 6.547 9.942 -12.517 1.00 60.21 C ATOM 1556 O GLU B 231 7.462 9.519 -11.820 1.00 70.15 O ATOM 1557 CB GLU B 231 4.949 8.217 -11.588 1.00 64.34 C ATOM 1558 CG GLU B 231 3.614 7.440 -11.695 1.00 5.01 C ATOM 1559 CD GLU B 231 3.488 6.672 -12.944 1.00 62.44 C ATOM 1560 OE1 GLU B 231 4.126 5.624 -13.079 1.00 51.31 O ATOM 1561 OE2 GLU B 231 2.756 7.160 -13.831 1.00 61.43 O ATOM 0 H GLU B 231 6.291 7.418 -13.709 1.00 51.24 H new ATOM 0 HA GLU B 231 4.499 9.688 -13.112 1.00 15.00 H new ATOM 0 HB2 GLU B 231 5.747 7.502 -11.386 1.00 64.34 H new ATOM 0 HB3 GLU B 231 4.891 8.882 -10.726 1.00 64.34 H new ATOM 0 HG2 GLU B 231 3.528 6.760 -10.848 1.00 5.01 H new ATOM 0 HG3 GLU B 231 2.785 8.144 -11.624 1.00 5.01 H new ATOM 1568 N GLY B 232 6.534 11.160 -13.025 1.00 10.34 N ATOM 1569 CA GLY B 232 7.645 12.068 -12.820 1.00 41.45 C ATOM 1570 C GLY B 232 8.943 11.531 -13.412 1.00 52.53 C ATOM 1571 O GLY B 232 9.090 11.419 -14.640 1.00 64.24 O ATOM 0 H GLY B 232 5.769 11.542 -13.581 1.00 10.34 H new ATOM 0 HA2 GLY B 232 7.413 13.032 -13.272 1.00 41.45 H new ATOM 0 HA3 GLY B 232 7.779 12.241 -11.752 1.00 41.45 H new ATOM 1575 N SER B 233 9.861 11.171 -12.546 1.00 72.31 N ATOM 1576 CA SER B 233 11.151 10.646 -12.948 1.00 23.55 C ATOM 1577 C SER B 233 11.148 9.111 -12.860 1.00 11.41 C ATOM 1578 O SER B 233 12.197 8.455 -12.945 1.00 14.32 O ATOM 1579 CB SER B 233 12.214 11.219 -12.021 1.00 20.50 C ATOM 1580 OG SER B 233 12.164 12.645 -12.015 1.00 12.24 O ATOM 0 H SER B 233 9.736 11.233 -11.536 1.00 72.31 H new ATOM 0 HA SER B 233 11.363 10.930 -13.979 1.00 23.55 H new ATOM 0 HB2 SER B 233 12.064 10.841 -11.010 1.00 20.50 H new ATOM 0 HB3 SER B 233 13.201 10.886 -12.342 1.00 20.50 H new ATOM 0 HG SER B 233 12.853 12.994 -11.412 1.00 12.24 H new ATOM 1586 N LEU B 234 9.975 8.559 -12.713 1.00 2.41 N ATOM 1587 CA LEU B 234 9.787 7.143 -12.564 1.00 42.32 C ATOM 1588 C LEU B 234 9.061 6.600 -13.791 1.00 23.24 C ATOM 1589 O LEU B 234 8.174 7.234 -14.315 1.00 60.55 O ATOM 1590 CB LEU B 234 8.986 6.908 -11.242 1.00 44.11 C ATOM 1591 CG LEU B 234 8.662 5.466 -10.761 1.00 35.23 C ATOM 1592 CD1 LEU B 234 7.544 4.831 -11.580 1.00 72.03 C ATOM 1593 CD2 LEU B 234 9.917 4.592 -10.792 1.00 24.12 C ATOM 0 H LEU B 234 9.106 9.092 -12.693 1.00 2.41 H new ATOM 0 HA LEU B 234 10.736 6.612 -12.495 1.00 42.32 H new ATOM 0 HB2 LEU B 234 9.538 7.398 -10.440 1.00 44.11 H new ATOM 0 HB3 LEU B 234 8.037 7.434 -11.343 1.00 44.11 H new ATOM 0 HG LEU B 234 8.311 5.537 -9.732 1.00 35.23 H new ATOM 0 HD11 LEU B 234 7.349 3.824 -11.211 1.00 72.03 H new ATOM 0 HD12 LEU B 234 6.639 5.432 -11.489 1.00 72.03 H new ATOM 0 HD13 LEU B 234 7.843 4.782 -12.627 1.00 72.03 H new ATOM 0 HD21 LEU B 234 9.669 3.587 -10.452 1.00 24.12 H new ATOM 0 HD22 LEU B 234 10.303 4.545 -11.810 1.00 24.12 H new ATOM 0 HD23 LEU B 234 10.675 5.020 -10.136 1.00 24.12 H new ATOM 1605 N ARG B 235 9.487 5.465 -14.257 1.00 51.05 N ATOM 1606 CA ARG B 235 8.838 4.771 -15.353 1.00 64.01 C ATOM 1607 C ARG B 235 8.319 3.483 -14.781 1.00 75.40 C ATOM 1608 O ARG B 235 8.876 2.998 -13.842 1.00 14.33 O ATOM 1609 CB ARG B 235 9.857 4.428 -16.436 1.00 70.21 C ATOM 1610 CG ARG B 235 10.566 5.605 -17.072 1.00 32.21 C ATOM 1611 CD ARG B 235 11.674 5.097 -17.969 1.00 60.10 C ATOM 1612 NE ARG B 235 12.452 6.168 -18.596 1.00 42.44 N ATOM 1613 CZ ARG B 235 13.769 6.080 -18.854 1.00 62.12 C ATOM 1614 NH1 ARG B 235 14.469 5.039 -18.406 1.00 74.44 N ATOM 1615 NH2 ARG B 235 14.384 7.046 -19.512 1.00 63.11 N ATOM 0 H ARG B 235 10.305 4.980 -13.889 1.00 51.05 H new ATOM 0 HA ARG B 235 8.052 5.388 -15.789 1.00 64.01 H new ATOM 0 HB2 ARG B 235 10.608 3.766 -16.005 1.00 70.21 H new ATOM 0 HB3 ARG B 235 9.350 3.867 -17.221 1.00 70.21 H new ATOM 0 HG2 ARG B 235 9.859 6.201 -17.650 1.00 32.21 H new ATOM 0 HG3 ARG B 235 10.977 6.257 -16.301 1.00 32.21 H new ATOM 0 HD2 ARG B 235 12.344 4.466 -17.385 1.00 60.10 H new ATOM 0 HD3 ARG B 235 11.242 4.468 -18.748 1.00 60.10 H new ATOM 0 HE ARG B 235 11.968 7.029 -18.851 1.00 42.44 H new ATOM 0 HH11 ARG B 235 14.006 4.307 -17.867 1.00 74.44 H new ATOM 0 HH12 ARG B 235 15.468 4.973 -18.602 1.00 74.44 H new ATOM 0 HH21 ARG B 235 13.860 7.863 -19.827 1.00 63.11 H new ATOM 0 HH22 ARG B 235 15.383 6.975 -19.706 1.00 63.11 H new ATOM 1629 N CYS B 236 7.269 2.952 -15.276 1.00 22.52 N ATOM 1630 CA CYS B 236 6.843 1.669 -14.783 1.00 41.12 C ATOM 1631 C CYS B 236 6.389 0.812 -15.936 1.00 22.42 C ATOM 1632 O CYS B 236 6.024 1.329 -16.965 1.00 32.51 O ATOM 1633 CB CYS B 236 5.743 1.789 -13.744 1.00 35.53 C ATOM 1634 SG CYS B 236 5.743 0.363 -12.572 1.00 63.24 S ATOM 0 H CYS B 236 6.688 3.362 -16.007 1.00 22.52 H new ATOM 0 HA CYS B 236 7.694 1.200 -14.289 1.00 41.12 H new ATOM 0 HB2 CYS B 236 5.870 2.717 -13.186 1.00 35.53 H new ATOM 0 HB3 CYS B 236 4.776 1.848 -14.244 1.00 35.53 H new ATOM 1639 N VAL B 237 6.442 -0.486 -15.785 1.00 13.25 N ATOM 1640 CA VAL B 237 6.015 -1.380 -16.825 1.00 32.45 C ATOM 1641 C VAL B 237 5.161 -2.462 -16.198 1.00 10.03 C ATOM 1642 O VAL B 237 5.510 -3.003 -15.146 1.00 52.45 O ATOM 1643 CB VAL B 237 7.214 -2.032 -17.581 1.00 25.31 C ATOM 1644 CG1 VAL B 237 6.737 -2.836 -18.776 1.00 70.52 C ATOM 1645 CG2 VAL B 237 8.244 -0.993 -18.003 1.00 75.13 C ATOM 0 H VAL B 237 6.781 -0.949 -14.942 1.00 13.25 H new ATOM 0 HA VAL B 237 5.451 -0.806 -17.560 1.00 32.45 H new ATOM 0 HB VAL B 237 7.701 -2.716 -16.886 1.00 25.31 H new ATOM 0 HG11 VAL B 237 7.595 -3.278 -19.283 1.00 70.52 H new ATOM 0 HG12 VAL B 237 6.067 -3.627 -18.438 1.00 70.52 H new ATOM 0 HG13 VAL B 237 6.206 -2.181 -19.466 1.00 70.52 H new ATOM 0 HG21 VAL B 237 9.064 -1.485 -18.526 1.00 75.13 H new ATOM 0 HG22 VAL B 237 7.776 -0.265 -18.665 1.00 75.13 H new ATOM 0 HG23 VAL B 237 8.631 -0.484 -17.120 1.00 75.13 H new ATOM 1655 N ILE B 238 4.059 -2.753 -16.819 1.00 71.13 N ATOM 1656 CA ILE B 238 3.133 -3.737 -16.327 1.00 60.12 C ATOM 1657 C ILE B 238 3.053 -4.878 -17.302 1.00 11.15 C ATOM 1658 O ILE B 238 2.773 -4.675 -18.473 1.00 10.31 O ATOM 1659 CB ILE B 238 1.719 -3.140 -16.181 1.00 22.43 C ATOM 1660 CG1 ILE B 238 1.741 -1.931 -15.254 1.00 21.42 C ATOM 1661 CG2 ILE B 238 0.737 -4.199 -15.654 1.00 11.45 C ATOM 1662 CD1 ILE B 238 0.415 -1.240 -15.160 1.00 11.24 C ATOM 0 H ILE B 238 3.771 -2.311 -17.692 1.00 71.13 H new ATOM 0 HA ILE B 238 3.487 -4.076 -15.354 1.00 60.12 H new ATOM 0 HB ILE B 238 1.382 -2.815 -17.166 1.00 22.43 H new ATOM 0 HG12 ILE B 238 2.050 -2.249 -14.258 1.00 21.42 H new ATOM 0 HG13 ILE B 238 2.489 -1.222 -15.608 1.00 21.42 H new ATOM 0 HG21 ILE B 238 -0.256 -3.759 -15.558 1.00 11.45 H new ATOM 0 HG22 ILE B 238 0.697 -5.036 -16.351 1.00 11.45 H new ATOM 0 HG23 ILE B 238 1.073 -4.554 -14.680 1.00 11.45 H new ATOM 0 HD11 ILE B 238 0.496 -0.388 -14.485 1.00 11.24 H new ATOM 0 HD12 ILE B 238 0.115 -0.893 -16.149 1.00 11.24 H new ATOM 0 HD13 ILE B 238 -0.332 -1.936 -14.778 1.00 11.24 H new ATOM 1674 N PHE B 239 3.323 -6.041 -16.812 1.00 14.34 N ATOM 1675 CA PHE B 239 3.271 -7.259 -17.558 1.00 24.34 C ATOM 1676 C PHE B 239 2.050 -8.039 -17.149 1.00 22.14 C ATOM 1677 O PHE B 239 1.984 -8.528 -16.010 1.00 64.50 O ATOM 1678 CB PHE B 239 4.482 -8.106 -17.229 1.00 71.12 C ATOM 1679 CG PHE B 239 5.778 -7.556 -17.686 1.00 73.41 C ATOM 1680 CD1 PHE B 239 6.370 -6.479 -17.041 1.00 53.11 C ATOM 1681 CD2 PHE B 239 6.409 -8.116 -18.760 1.00 44.03 C ATOM 1682 CE1 PHE B 239 7.566 -5.978 -17.473 1.00 54.32 C ATOM 1683 CE2 PHE B 239 7.600 -7.629 -19.202 1.00 22.01 C ATOM 1684 CZ PHE B 239 8.189 -6.549 -18.551 1.00 15.12 C ATOM 0 H PHE B 239 3.598 -6.177 -15.839 1.00 14.34 H new ATOM 0 HA PHE B 239 3.244 -7.022 -18.622 1.00 24.34 H new ATOM 0 HB2 PHE B 239 4.525 -8.246 -16.149 1.00 71.12 H new ATOM 0 HB3 PHE B 239 4.347 -9.092 -17.673 1.00 71.12 H new ATOM 0 HD1 PHE B 239 5.880 -6.032 -16.189 1.00 53.11 H new ATOM 0 HD2 PHE B 239 5.957 -8.957 -19.265 1.00 44.03 H new ATOM 0 HE1 PHE B 239 8.017 -5.137 -16.967 1.00 54.32 H new ATOM 0 HE2 PHE B 239 8.087 -8.079 -20.055 1.00 22.01 H new ATOM 0 HZ PHE B 239 9.136 -6.162 -18.895 1.00 15.12 H new ATOM 1694 N ILE B 240 1.083 -8.148 -18.014 1.00 30.32 N ATOM 1695 CA ILE B 240 -0.072 -8.946 -17.681 1.00 73.34 C ATOM 1696 C ILE B 240 0.192 -10.320 -18.203 1.00 25.01 C ATOM 1697 O ILE B 240 0.381 -10.497 -19.409 1.00 44.30 O ATOM 1698 CB ILE B 240 -1.368 -8.425 -18.321 1.00 22.31 C ATOM 1699 CG1 ILE B 240 -1.441 -6.917 -18.166 1.00 62.42 C ATOM 1700 CG2 ILE B 240 -2.579 -9.099 -17.673 1.00 53.11 C ATOM 1701 CD1 ILE B 240 -2.758 -6.304 -18.571 1.00 44.42 C ATOM 0 H ILE B 240 1.064 -7.708 -18.934 1.00 30.32 H new ATOM 0 HA ILE B 240 -0.217 -8.916 -16.601 1.00 73.34 H new ATOM 0 HB ILE B 240 -1.372 -8.666 -19.384 1.00 22.31 H new ATOM 0 HG12 ILE B 240 -1.242 -6.663 -17.125 1.00 62.42 H new ATOM 0 HG13 ILE B 240 -0.647 -6.466 -18.761 1.00 62.42 H new ATOM 0 HG21 ILE B 240 -3.493 -8.724 -18.133 1.00 53.11 H new ATOM 0 HG22 ILE B 240 -2.516 -10.177 -17.818 1.00 53.11 H new ATOM 0 HG23 ILE B 240 -2.592 -8.877 -16.606 1.00 53.11 H new ATOM 0 HD11 ILE B 240 -2.717 -5.224 -18.426 1.00 44.42 H new ATOM 0 HD12 ILE B 240 -2.953 -6.522 -19.621 1.00 44.42 H new ATOM 0 HD13 ILE B 240 -3.557 -6.722 -17.959 1.00 44.42 H new ATOM 1713 N THR B 241 0.235 -11.283 -17.337 1.00 61.44 N ATOM 1714 CA THR B 241 0.554 -12.594 -17.761 1.00 21.11 C ATOM 1715 C THR B 241 -0.615 -13.532 -17.512 1.00 65.32 C ATOM 1716 O THR B 241 -1.531 -13.201 -16.766 1.00 4.41 O ATOM 1717 CB THR B 241 1.841 -13.131 -17.091 1.00 63.31 C ATOM 1718 OG1 THR B 241 1.638 -13.290 -15.678 1.00 72.42 O ATOM 1719 CG2 THR B 241 3.008 -12.175 -17.294 1.00 60.24 C ATOM 0 H THR B 241 0.053 -11.179 -16.339 1.00 61.44 H new ATOM 0 HA THR B 241 0.749 -12.549 -18.832 1.00 21.11 H new ATOM 0 HB THR B 241 2.070 -14.091 -17.554 1.00 63.31 H new ATOM 0 HG1 THR B 241 0.944 -12.668 -15.375 1.00 72.42 H new ATOM 0 HG21 THR B 241 3.898 -12.580 -16.812 1.00 60.24 H new ATOM 0 HG22 THR B 241 3.197 -12.053 -18.361 1.00 60.24 H new ATOM 0 HG23 THR B 241 2.766 -11.207 -16.855 1.00 60.24 H new ATOM 1727 N LYS B 242 -0.562 -14.709 -18.107 1.00 21.22 N ATOM 1728 CA LYS B 242 -1.666 -15.676 -18.024 1.00 21.03 C ATOM 1729 C LYS B 242 -1.884 -16.311 -16.625 1.00 62.11 C ATOM 1730 O LYS B 242 -2.801 -17.112 -16.441 1.00 41.14 O ATOM 1731 CB LYS B 242 -1.616 -16.714 -19.186 1.00 34.42 C ATOM 1732 CG LYS B 242 -0.310 -17.493 -19.380 1.00 44.33 C ATOM 1733 CD LYS B 242 -0.014 -18.435 -18.233 1.00 42.31 C ATOM 1734 CE LYS B 242 1.239 -19.259 -18.512 1.00 11.53 C ATOM 1735 NZ LYS B 242 1.556 -20.198 -17.414 1.00 15.03 N ATOM 0 H LYS B 242 0.234 -15.029 -18.658 1.00 21.22 H new ATOM 0 HA LYS B 242 -2.573 -15.087 -18.165 1.00 21.03 H new ATOM 0 HB2 LYS B 242 -2.418 -17.435 -19.028 1.00 34.42 H new ATOM 0 HB3 LYS B 242 -1.837 -16.190 -20.116 1.00 34.42 H new ATOM 0 HG2 LYS B 242 -0.367 -18.063 -20.307 1.00 44.33 H new ATOM 0 HG3 LYS B 242 0.515 -16.789 -19.488 1.00 44.33 H new ATOM 0 HD2 LYS B 242 0.119 -17.864 -17.314 1.00 42.31 H new ATOM 0 HD3 LYS B 242 -0.863 -19.100 -18.075 1.00 42.31 H new ATOM 0 HE2 LYS B 242 1.103 -19.819 -19.437 1.00 11.53 H new ATOM 0 HE3 LYS B 242 2.084 -18.588 -18.667 1.00 11.53 H new ATOM 0 HZ1 LYS B 242 2.415 -20.734 -17.652 1.00 15.03 H new ATOM 0 HZ2 LYS B 242 1.713 -19.664 -16.535 1.00 15.03 H new ATOM 0 HZ3 LYS B 242 0.763 -20.857 -17.281 1.00 15.03 H new ATOM 1749 N ARG B 243 -1.040 -15.960 -15.671 1.00 1.02 N ATOM 1750 CA ARG B 243 -1.202 -16.399 -14.279 1.00 40.11 C ATOM 1751 C ARG B 243 -0.986 -15.273 -13.284 1.00 22.54 C ATOM 1752 O ARG B 243 -0.817 -15.527 -12.103 1.00 15.22 O ATOM 1753 CB ARG B 243 -0.296 -17.583 -13.910 1.00 3.22 C ATOM 1754 CG ARG B 243 -0.746 -18.924 -14.439 1.00 62.43 C ATOM 1755 CD ARG B 243 0.157 -20.026 -13.920 1.00 63.32 C ATOM 1756 NE ARG B 243 -0.338 -21.360 -14.267 1.00 24.33 N ATOM 1757 CZ ARG B 243 0.184 -22.511 -13.828 1.00 14.45 C ATOM 1758 NH1 ARG B 243 1.292 -22.505 -13.080 1.00 75.31 N ATOM 1759 NH2 ARG B 243 -0.404 -23.664 -14.138 1.00 42.42 N ATOM 0 H ARG B 243 -0.225 -15.367 -15.828 1.00 1.02 H new ATOM 0 HA ARG B 243 -2.238 -16.731 -14.215 1.00 40.11 H new ATOM 0 HB2 ARG B 243 0.708 -17.382 -14.282 1.00 3.22 H new ATOM 0 HB3 ARG B 243 -0.227 -17.643 -12.824 1.00 3.22 H new ATOM 0 HG2 ARG B 243 -1.775 -19.115 -14.136 1.00 62.43 H new ATOM 0 HG3 ARG B 243 -0.731 -18.916 -15.529 1.00 62.43 H new ATOM 0 HD2 ARG B 243 1.159 -19.895 -14.329 1.00 63.32 H new ATOM 0 HD3 ARG B 243 0.242 -19.943 -12.836 1.00 63.32 H new ATOM 0 HE ARG B 243 -1.143 -21.416 -14.891 1.00 24.33 H new ATOM 0 HH11 ARG B 243 1.742 -21.621 -12.842 1.00 75.31 H new ATOM 0 HH12 ARG B 243 1.687 -23.384 -12.747 1.00 75.31 H new ATOM 0 HH21 ARG B 243 -1.250 -23.668 -14.708 1.00 42.42 H new ATOM 0 HH22 ARG B 243 -0.009 -24.544 -13.805 1.00 42.42 H new ATOM 1773 N GLY B 244 -1.007 -14.042 -13.732 1.00 75.53 N ATOM 1774 CA GLY B 244 -0.841 -12.961 -12.791 1.00 61.21 C ATOM 1775 C GLY B 244 -0.208 -11.759 -13.400 1.00 30.14 C ATOM 1776 O GLY B 244 -0.164 -11.629 -14.622 1.00 60.44 O ATOM 0 H GLY B 244 -1.133 -13.768 -14.706 1.00 75.53 H new ATOM 0 HA2 GLY B 244 -1.814 -12.687 -12.384 1.00 61.21 H new ATOM 0 HA3 GLY B 244 -0.231 -13.303 -11.955 1.00 61.21 H new ATOM 1780 N LEU B 245 0.312 -10.882 -12.577 1.00 40.03 N ATOM 1781 CA LEU B 245 0.893 -9.663 -13.081 1.00 44.30 C ATOM 1782 C LEU B 245 2.293 -9.463 -12.579 1.00 73.13 C ATOM 1783 O LEU B 245 2.634 -9.827 -11.447 1.00 63.03 O ATOM 1784 CB LEU B 245 0.048 -8.394 -12.770 1.00 1.15 C ATOM 1785 CG LEU B 245 -1.356 -8.269 -13.401 1.00 31.14 C ATOM 1786 CD1 LEU B 245 -2.363 -9.224 -12.772 1.00 73.12 C ATOM 1787 CD2 LEU B 245 -1.848 -6.834 -13.332 1.00 54.03 C ATOM 0 H LEU B 245 0.345 -10.988 -11.563 1.00 40.03 H new ATOM 0 HA LEU B 245 0.909 -9.789 -14.164 1.00 44.30 H new ATOM 0 HB2 LEU B 245 -0.068 -8.331 -11.688 1.00 1.15 H new ATOM 0 HB3 LEU B 245 0.629 -7.525 -13.080 1.00 1.15 H new ATOM 0 HG LEU B 245 -1.264 -8.556 -14.449 1.00 31.14 H new ATOM 0 HD11 LEU B 245 -3.334 -9.096 -13.251 1.00 73.12 H new ATOM 0 HD12 LEU B 245 -2.024 -10.251 -12.907 1.00 73.12 H new ATOM 0 HD13 LEU B 245 -2.453 -9.009 -11.707 1.00 73.12 H new ATOM 0 HD21 LEU B 245 -2.839 -6.767 -13.782 1.00 54.03 H new ATOM 0 HD22 LEU B 245 -1.900 -6.517 -12.290 1.00 54.03 H new ATOM 0 HD23 LEU B 245 -1.159 -6.187 -13.874 1.00 54.03 H new ATOM 1799 N LYS B 246 3.088 -8.916 -13.426 1.00 75.32 N ATOM 1800 CA LYS B 246 4.426 -8.531 -13.119 1.00 70.32 C ATOM 1801 C LYS B 246 4.555 -7.038 -13.323 1.00 43.02 C ATOM 1802 O LYS B 246 4.313 -6.538 -14.401 1.00 52.30 O ATOM 1803 CB LYS B 246 5.432 -9.293 -14.008 1.00 5.14 C ATOM 1804 CG LYS B 246 6.793 -8.615 -14.112 1.00 23.40 C ATOM 1805 CD LYS B 246 7.705 -9.300 -15.107 1.00 22.13 C ATOM 1806 CE LYS B 246 8.914 -8.435 -15.375 1.00 0.11 C ATOM 1807 NZ LYS B 246 9.901 -9.092 -16.249 1.00 53.33 N ATOM 0 H LYS B 246 2.819 -8.715 -14.389 1.00 75.32 H new ATOM 0 HA LYS B 246 4.652 -8.781 -12.082 1.00 70.32 H new ATOM 0 HB2 LYS B 246 5.566 -10.299 -13.610 1.00 5.14 H new ATOM 0 HB3 LYS B 246 5.012 -9.400 -15.008 1.00 5.14 H new ATOM 0 HG2 LYS B 246 6.656 -7.574 -14.406 1.00 23.40 H new ATOM 0 HG3 LYS B 246 7.269 -8.609 -13.131 1.00 23.40 H new ATOM 0 HD2 LYS B 246 8.019 -10.269 -14.719 1.00 22.13 H new ATOM 0 HD3 LYS B 246 7.168 -9.488 -16.037 1.00 22.13 H new ATOM 0 HE2 LYS B 246 8.592 -7.501 -15.835 1.00 0.11 H new ATOM 0 HE3 LYS B 246 9.388 -8.177 -14.428 1.00 0.11 H new ATOM 0 HZ1 LYS B 246 10.853 -8.738 -16.025 1.00 53.33 H new ATOM 0 HZ2 LYS B 246 9.869 -10.120 -16.097 1.00 53.33 H new ATOM 0 HZ3 LYS B 246 9.678 -8.882 -17.243 1.00 53.33 H new ATOM 1821 N VAL B 247 4.907 -6.345 -12.306 1.00 51.11 N ATOM 1822 CA VAL B 247 5.090 -4.901 -12.406 1.00 64.54 C ATOM 1823 C VAL B 247 6.522 -4.527 -12.142 1.00 10.41 C ATOM 1824 O VAL B 247 7.171 -5.076 -11.246 1.00 71.03 O ATOM 1825 CB VAL B 247 4.145 -4.110 -11.477 1.00 1.13 C ATOM 1826 CG1 VAL B 247 2.703 -4.314 -11.894 1.00 22.12 C ATOM 1827 CG2 VAL B 247 4.342 -4.523 -10.035 1.00 12.10 C ATOM 0 H VAL B 247 5.081 -6.733 -11.379 1.00 51.11 H new ATOM 0 HA VAL B 247 4.831 -4.625 -13.428 1.00 64.54 H new ATOM 0 HB VAL B 247 4.386 -3.051 -11.564 1.00 1.13 H new ATOM 0 HG11 VAL B 247 2.049 -3.750 -11.229 1.00 22.12 H new ATOM 0 HG12 VAL B 247 2.568 -3.966 -12.918 1.00 22.12 H new ATOM 0 HG13 VAL B 247 2.454 -5.373 -11.835 1.00 22.12 H new ATOM 0 HG21 VAL B 247 3.666 -3.953 -9.398 1.00 12.10 H new ATOM 0 HG22 VAL B 247 4.130 -5.587 -9.929 1.00 12.10 H new ATOM 0 HG23 VAL B 247 5.372 -4.327 -9.738 1.00 12.10 H new ATOM 1837 N CYS B 248 7.040 -3.653 -12.927 1.00 45.15 N ATOM 1838 CA CYS B 248 8.392 -3.251 -12.755 1.00 32.14 C ATOM 1839 C CYS B 248 8.495 -1.764 -12.888 1.00 63.14 C ATOM 1840 O CYS B 248 8.308 -1.227 -13.972 1.00 51.03 O ATOM 1841 CB CYS B 248 9.285 -3.924 -13.792 1.00 11.24 C ATOM 1842 SG CYS B 248 11.057 -3.699 -13.473 1.00 24.25 S ATOM 0 H CYS B 248 6.548 -3.200 -13.697 1.00 45.15 H new ATOM 0 HA CYS B 248 8.724 -3.552 -11.761 1.00 32.14 H new ATOM 0 HB2 CYS B 248 9.060 -4.990 -13.817 1.00 11.24 H new ATOM 0 HB3 CYS B 248 9.048 -3.525 -14.778 1.00 11.24 H new ATOM 1847 N CYS B 249 8.738 -1.079 -11.804 1.00 73.11 N ATOM 1848 CA CYS B 249 8.926 0.333 -11.903 1.00 71.13 C ATOM 1849 C CYS B 249 10.410 0.663 -11.984 1.00 61.44 C ATOM 1850 O CYS B 249 11.223 0.169 -11.196 1.00 25.22 O ATOM 1851 CB CYS B 249 8.224 1.120 -10.787 1.00 23.12 C ATOM 1852 SG CYS B 249 6.375 1.114 -10.780 1.00 51.11 S ATOM 0 H CYS B 249 8.808 -1.469 -10.864 1.00 73.11 H new ATOM 0 HA CYS B 249 8.446 0.656 -12.827 1.00 71.13 H new ATOM 0 HB2 CYS B 249 8.566 0.726 -9.830 1.00 23.12 H new ATOM 0 HB3 CYS B 249 8.558 2.156 -10.843 1.00 23.12 H new ATOM 1857 N ASP B 250 10.724 1.515 -12.909 1.00 2.42 N ATOM 1858 CA ASP B 250 12.061 1.903 -13.249 1.00 1.51 C ATOM 1859 C ASP B 250 12.308 3.384 -13.007 1.00 34.35 C ATOM 1860 O ASP B 250 11.733 4.232 -13.651 1.00 12.44 O ATOM 1861 CB ASP B 250 12.337 1.595 -14.721 1.00 72.44 C ATOM 1862 CG ASP B 250 13.612 2.250 -15.214 1.00 60.05 C ATOM 1863 OD1 ASP B 250 14.710 1.852 -14.772 1.00 42.12 O ATOM 1864 OD2 ASP B 250 13.529 3.203 -16.026 1.00 21.12 O ATOM 0 H ASP B 250 10.019 1.984 -13.478 1.00 2.42 H new ATOM 0 HA ASP B 250 12.731 1.333 -12.606 1.00 1.51 H new ATOM 0 HB2 ASP B 250 12.409 0.516 -14.857 1.00 72.44 H new ATOM 0 HB3 ASP B 250 11.497 1.938 -15.326 1.00 72.44 H new ATOM 1869 N PRO B 251 13.160 3.698 -12.073 1.00 12.32 N ATOM 1870 CA PRO B 251 13.586 5.067 -11.793 1.00 52.10 C ATOM 1871 C PRO B 251 14.750 5.475 -12.723 1.00 51.23 C ATOM 1872 O PRO B 251 15.627 6.259 -12.330 1.00 60.23 O ATOM 1873 CB PRO B 251 14.078 4.947 -10.362 1.00 72.11 C ATOM 1874 CG PRO B 251 14.666 3.598 -10.317 1.00 23.31 C ATOM 1875 CD PRO B 251 13.791 2.744 -11.177 1.00 70.30 C ATOM 0 HA PRO B 251 12.806 5.814 -11.941 1.00 52.10 H new ATOM 0 HB2 PRO B 251 14.814 5.715 -10.124 1.00 72.11 H new ATOM 0 HB3 PRO B 251 13.263 5.054 -9.646 1.00 72.11 H new ATOM 0 HG2 PRO B 251 15.691 3.606 -10.688 1.00 23.31 H new ATOM 0 HG3 PRO B 251 14.699 3.220 -9.295 1.00 23.31 H new ATOM 0 HD2 PRO B 251 14.370 2.001 -11.725 1.00 70.30 H new ATOM 0 HD3 PRO B 251 13.054 2.201 -10.585 1.00 70.30 H new ATOM 1883 N GLN B 252 14.715 4.951 -13.963 1.00 52.22 N ATOM 1884 CA GLN B 252 15.718 5.193 -15.010 1.00 60.44 C ATOM 1885 C GLN B 252 17.042 4.526 -14.637 1.00 11.14 C ATOM 1886 O GLN B 252 18.121 5.116 -14.786 1.00 33.31 O ATOM 1887 CB GLN B 252 15.893 6.705 -15.263 1.00 21.43 C ATOM 1888 CG GLN B 252 14.590 7.412 -15.613 1.00 42.51 C ATOM 1889 CD GLN B 252 14.767 8.890 -15.871 1.00 14.14 C ATOM 1890 OE1 GLN B 252 14.988 9.319 -17.005 1.00 33.24 O ATOM 1891 NE2 GLN B 252 14.678 9.680 -14.836 1.00 4.24 N ATOM 0 H GLN B 252 13.966 4.331 -14.270 1.00 52.22 H new ATOM 0 HA GLN B 252 15.369 4.747 -15.941 1.00 60.44 H new ATOM 0 HB2 GLN B 252 16.322 7.168 -14.374 1.00 21.43 H new ATOM 0 HB3 GLN B 252 16.606 6.850 -16.074 1.00 21.43 H new ATOM 0 HG2 GLN B 252 14.156 6.945 -16.497 1.00 42.51 H new ATOM 0 HG3 GLN B 252 13.879 7.274 -14.798 1.00 42.51 H new ATOM 0 HE21 GLN B 252 14.494 9.290 -13.911 1.00 4.24 H new ATOM 0 HE22 GLN B 252 14.792 10.687 -14.952 1.00 4.24 H new ATOM 1900 N ALA B 253 16.966 3.269 -14.204 1.00 33.52 N ATOM 1901 CA ALA B 253 18.158 2.556 -13.744 1.00 42.43 C ATOM 1902 C ALA B 253 18.130 1.043 -14.046 1.00 25.43 C ATOM 1903 O ALA B 253 19.147 0.358 -13.881 1.00 44.31 O ATOM 1904 CB ALA B 253 18.344 2.777 -12.249 1.00 4.41 C ATOM 0 H ALA B 253 16.103 2.727 -14.162 1.00 33.52 H new ATOM 0 HA ALA B 253 18.999 2.968 -14.302 1.00 42.43 H new ATOM 0 HB1 ALA B 253 19.233 2.244 -11.910 1.00 4.41 H new ATOM 0 HB2 ALA B 253 18.462 3.842 -12.051 1.00 4.41 H new ATOM 0 HB3 ALA B 253 17.471 2.403 -11.714 1.00 4.41 H new ATOM 1910 N THR B 254 17.009 0.526 -14.494 1.00 25.55 N ATOM 1911 CA THR B 254 16.872 -0.920 -14.691 1.00 5.43 C ATOM 1912 C THR B 254 17.156 -1.332 -16.148 1.00 72.14 C ATOM 1913 O THR B 254 17.050 -2.516 -16.516 1.00 12.21 O ATOM 1914 CB THR B 254 15.441 -1.381 -14.311 1.00 22.32 C ATOM 1915 OG1 THR B 254 14.502 -0.763 -15.181 1.00 2.04 O ATOM 1916 CG2 THR B 254 15.110 -0.981 -12.877 1.00 73.30 C ATOM 0 H THR B 254 16.179 1.070 -14.730 1.00 25.55 H new ATOM 0 HA THR B 254 17.607 -1.401 -14.046 1.00 5.43 H new ATOM 0 HB THR B 254 15.392 -2.466 -14.402 1.00 22.32 H new ATOM 0 HG1 THR B 254 14.718 0.189 -15.272 1.00 2.04 H new ATOM 0 HG21 THR B 254 14.102 -1.314 -12.630 1.00 73.30 H new ATOM 0 HG22 THR B 254 15.823 -1.446 -12.196 1.00 73.30 H new ATOM 0 HG23 THR B 254 15.169 0.103 -12.779 1.00 73.30 H new ATOM 1924 N TRP B 255 17.557 -0.374 -16.960 1.00 45.51 N ATOM 1925 CA TRP B 255 17.691 -0.607 -18.384 1.00 45.43 C ATOM 1926 C TRP B 255 18.930 -1.346 -18.833 1.00 2.14 C ATOM 1927 O TRP B 255 19.953 -0.744 -19.174 1.00 53.31 O ATOM 1928 CB TRP B 255 17.448 0.649 -19.208 1.00 25.32 C ATOM 1929 CG TRP B 255 16.042 1.113 -19.115 1.00 25.42 C ATOM 1930 CD1 TRP B 255 15.483 1.769 -18.079 1.00 35.54 C ATOM 1931 CD2 TRP B 255 15.011 0.953 -20.096 1.00 10.31 C ATOM 1932 NE1 TRP B 255 14.168 2.011 -18.328 1.00 53.12 N ATOM 1933 CE2 TRP B 255 13.846 1.530 -19.564 1.00 21.14 C ATOM 1934 CE3 TRP B 255 14.956 0.373 -21.368 1.00 1.11 C ATOM 1935 CZ2 TRP B 255 12.638 1.552 -20.255 1.00 23.01 C ATOM 1936 CZ3 TRP B 255 13.756 0.397 -22.056 1.00 34.44 C ATOM 1937 CH2 TRP B 255 12.613 0.982 -21.497 1.00 71.40 C ATOM 0 H TRP B 255 17.795 0.571 -16.659 1.00 45.51 H new ATOM 0 HA TRP B 255 16.885 -1.312 -18.588 1.00 45.43 H new ATOM 0 HB2 TRP B 255 18.114 1.441 -18.866 1.00 25.32 H new ATOM 0 HB3 TRP B 255 17.696 0.452 -20.251 1.00 25.32 H new ATOM 0 HD1 TRP B 255 16.005 2.061 -17.180 1.00 35.54 H new ATOM 0 HE1 TRP B 255 13.523 2.479 -17.691 1.00 53.12 H new ATOM 0 HE3 TRP B 255 15.832 -0.084 -21.804 1.00 1.11 H new ATOM 0 HZ2 TRP B 255 11.755 2.002 -19.826 1.00 23.01 H new ATOM 0 HZ3 TRP B 255 13.700 -0.043 -23.041 1.00 34.44 H new ATOM 0 HH2 TRP B 255 11.691 0.983 -22.060 1.00 71.40 H new ATOM 1948 N VAL B 256 18.841 -2.646 -18.764 1.00 11.32 N ATOM 1949 CA VAL B 256 19.775 -3.535 -19.392 1.00 3.33 C ATOM 1950 C VAL B 256 18.992 -4.361 -20.414 1.00 22.33 C ATOM 1951 O VAL B 256 19.306 -4.355 -21.606 1.00 31.55 O ATOM 1952 CB VAL B 256 20.582 -4.429 -18.385 1.00 72.23 C ATOM 1953 CG1 VAL B 256 21.544 -3.575 -17.584 1.00 72.41 C ATOM 1954 CG2 VAL B 256 19.669 -5.188 -17.428 1.00 64.13 C ATOM 0 H VAL B 256 18.098 -3.127 -18.257 1.00 11.32 H new ATOM 0 HA VAL B 256 20.552 -2.949 -19.884 1.00 3.33 H new ATOM 0 HB VAL B 256 21.132 -5.160 -18.977 1.00 72.23 H new ATOM 0 HG11 VAL B 256 22.098 -4.206 -16.889 1.00 72.41 H new ATOM 0 HG12 VAL B 256 22.241 -3.080 -18.260 1.00 72.41 H new ATOM 0 HG13 VAL B 256 20.985 -2.824 -17.026 1.00 72.41 H new ATOM 0 HG21 VAL B 256 20.273 -5.792 -16.751 1.00 64.13 H new ATOM 0 HG22 VAL B 256 19.077 -4.478 -16.850 1.00 64.13 H new ATOM 0 HG23 VAL B 256 19.004 -5.837 -17.998 1.00 64.13 H new ATOM 1964 N ARG B 257 17.930 -5.018 -19.919 1.00 14.42 N ATOM 1965 CA ARG B 257 16.943 -5.739 -20.709 1.00 62.22 C ATOM 1966 C ARG B 257 16.108 -6.590 -19.779 1.00 11.23 C ATOM 1967 O ARG B 257 16.592 -7.584 -19.246 1.00 34.34 O ATOM 1968 CB ARG B 257 17.552 -6.679 -21.751 1.00 10.13 C ATOM 1969 CG ARG B 257 16.511 -7.252 -22.704 1.00 73.10 C ATOM 1970 CD ARG B 257 17.099 -8.303 -23.609 1.00 25.12 C ATOM 1971 NE ARG B 257 17.471 -9.506 -22.867 1.00 41.14 N ATOM 1972 CZ ARG B 257 18.265 -10.465 -23.331 1.00 51.41 C ATOM 1973 NH1 ARG B 257 18.880 -10.311 -24.496 1.00 71.10 N ATOM 1974 NH2 ARG B 257 18.460 -11.572 -22.612 1.00 61.01 N ATOM 0 H ARG B 257 17.737 -5.057 -18.918 1.00 14.42 H new ATOM 0 HA ARG B 257 16.362 -4.983 -21.237 1.00 62.22 H new ATOM 0 HB2 ARG B 257 18.306 -6.140 -22.324 1.00 10.13 H new ATOM 0 HB3 ARG B 257 18.063 -7.497 -21.243 1.00 10.13 H new ATOM 0 HG2 ARG B 257 15.691 -7.684 -22.130 1.00 73.10 H new ATOM 0 HG3 ARG B 257 16.089 -6.448 -23.307 1.00 73.10 H new ATOM 0 HD2 ARG B 257 16.377 -8.562 -24.384 1.00 25.12 H new ATOM 0 HD3 ARG B 257 17.977 -7.900 -24.113 1.00 25.12 H new ATOM 0 HE ARG B 257 17.094 -9.617 -21.926 1.00 41.14 H new ATOM 0 HH11 ARG B 257 18.743 -9.456 -25.036 1.00 71.10 H new ATOM 0 HH12 ARG B 257 19.490 -11.047 -24.852 1.00 71.10 H new ATOM 0 HH21 ARG B 257 18.000 -11.681 -21.708 1.00 61.01 H new ATOM 0 HH22 ARG B 257 19.069 -12.310 -22.966 1.00 61.01 H new ATOM 1988 N ASP B 258 14.898 -6.192 -19.542 1.00 33.03 N ATOM 1989 CA ASP B 258 13.975 -7.011 -18.781 1.00 52.41 C ATOM 1990 C ASP B 258 12.590 -6.651 -19.215 1.00 23.14 C ATOM 1991 O ASP B 258 12.025 -5.671 -18.746 1.00 4.22 O ATOM 1992 CB ASP B 258 14.126 -6.822 -17.263 1.00 4.35 C ATOM 1993 CG ASP B 258 13.334 -7.854 -16.478 1.00 12.24 C ATOM 1994 OD1 ASP B 258 12.114 -7.755 -16.388 1.00 73.41 O ATOM 1995 OD2 ASP B 258 13.951 -8.820 -15.963 1.00 35.32 O ATOM 0 H ASP B 258 14.514 -5.303 -19.861 1.00 33.03 H new ATOM 0 HA ASP B 258 14.191 -8.061 -18.976 1.00 52.41 H new ATOM 0 HB2 ASP B 258 15.180 -6.891 -16.992 1.00 4.35 H new ATOM 0 HB3 ASP B 258 13.791 -5.822 -16.987 1.00 4.35 H new ATOM 2000 N VAL B 259 12.078 -7.397 -20.176 1.00 23.30 N ATOM 2001 CA VAL B 259 10.778 -7.111 -20.767 1.00 52.42 C ATOM 2002 C VAL B 259 10.476 -8.053 -21.916 1.00 32.34 C ATOM 2003 O VAL B 259 9.352 -8.538 -22.038 1.00 12.43 O ATOM 2004 CB VAL B 259 10.640 -5.603 -21.261 1.00 14.45 C ATOM 2005 CG1 VAL B 259 11.692 -5.231 -22.312 1.00 13.32 C ATOM 2006 CG2 VAL B 259 9.235 -5.306 -21.777 1.00 13.52 C ATOM 0 H VAL B 259 12.546 -8.214 -20.569 1.00 23.30 H new ATOM 0 HA VAL B 259 10.049 -7.266 -19.972 1.00 52.42 H new ATOM 0 HB VAL B 259 10.821 -4.979 -20.386 1.00 14.45 H new ATOM 0 HG11 VAL B 259 11.553 -4.193 -22.614 1.00 13.32 H new ATOM 0 HG12 VAL B 259 12.689 -5.355 -21.889 1.00 13.32 H new ATOM 0 HG13 VAL B 259 11.583 -5.880 -23.181 1.00 13.32 H new ATOM 0 HG21 VAL B 259 9.180 -4.268 -22.105 1.00 13.52 H new ATOM 0 HG22 VAL B 259 9.009 -5.964 -22.616 1.00 13.52 H new ATOM 0 HG23 VAL B 259 8.511 -5.473 -20.979 1.00 13.52 H new ATOM 2016 N VAL B 260 11.505 -8.341 -22.722 1.00 71.12 N ATOM 2017 CA VAL B 260 11.353 -9.089 -23.961 1.00 61.55 C ATOM 2018 C VAL B 260 10.505 -8.241 -24.913 1.00 33.51 C ATOM 2019 O VAL B 260 9.267 -8.212 -24.829 1.00 2.20 O ATOM 2020 CB VAL B 260 10.736 -10.511 -23.769 1.00 60.31 C ATOM 2021 CG1 VAL B 260 10.673 -11.251 -25.094 1.00 62.40 C ATOM 2022 CG2 VAL B 260 11.536 -11.317 -22.750 1.00 4.43 C ATOM 0 H VAL B 260 12.465 -8.058 -22.527 1.00 71.12 H new ATOM 0 HA VAL B 260 12.344 -9.274 -24.375 1.00 61.55 H new ATOM 0 HB VAL B 260 9.721 -10.390 -23.390 1.00 60.31 H new ATOM 0 HG11 VAL B 260 10.240 -12.239 -24.939 1.00 62.40 H new ATOM 0 HG12 VAL B 260 10.055 -10.690 -25.795 1.00 62.40 H new ATOM 0 HG13 VAL B 260 11.679 -11.355 -25.501 1.00 62.40 H new ATOM 0 HG21 VAL B 260 11.087 -12.303 -22.633 1.00 4.43 H new ATOM 0 HG22 VAL B 260 12.564 -11.425 -23.097 1.00 4.43 H new ATOM 0 HG23 VAL B 260 11.529 -10.800 -21.791 1.00 4.43 H new ATOM 2032 N ARG B 261 11.186 -7.497 -25.763 1.00 62.34 N ATOM 2033 CA ARG B 261 10.543 -6.539 -26.642 1.00 12.42 C ATOM 2034 C ARG B 261 9.540 -7.154 -27.580 1.00 52.33 C ATOM 2035 O ARG B 261 9.880 -7.931 -28.476 1.00 31.13 O ATOM 2036 CB ARG B 261 11.553 -5.683 -27.401 1.00 62.41 C ATOM 2037 CG ARG B 261 12.357 -4.760 -26.507 1.00 71.33 C ATOM 2038 CD ARG B 261 13.335 -3.916 -27.303 1.00 54.11 C ATOM 2039 NE ARG B 261 12.665 -3.060 -28.297 1.00 14.42 N ATOM 2040 CZ ARG B 261 13.173 -1.916 -28.784 1.00 54.34 C ATOM 2041 NH1 ARG B 261 14.304 -1.412 -28.285 1.00 14.24 N ATOM 2042 NH2 ARG B 261 12.531 -1.268 -29.747 1.00 42.50 N ATOM 0 H ARG B 261 12.200 -7.539 -25.864 1.00 62.34 H new ATOM 0 HA ARG B 261 9.978 -5.884 -25.979 1.00 12.42 H new ATOM 0 HB2 ARG B 261 12.236 -6.337 -27.943 1.00 62.41 H new ATOM 0 HB3 ARG B 261 11.025 -5.086 -28.145 1.00 62.41 H new ATOM 0 HG2 ARG B 261 11.680 -4.108 -25.955 1.00 71.33 H new ATOM 0 HG3 ARG B 261 12.902 -5.351 -25.771 1.00 71.33 H new ATOM 0 HD2 ARG B 261 13.910 -3.291 -26.620 1.00 54.11 H new ATOM 0 HD3 ARG B 261 14.044 -4.570 -27.811 1.00 54.11 H new ATOM 0 HE ARG B 261 11.751 -3.357 -28.639 1.00 14.42 H new ATOM 0 HH11 ARG B 261 14.788 -1.896 -27.529 1.00 14.24 H new ATOM 0 HH12 ARG B 261 14.684 -0.543 -28.660 1.00 14.24 H new ATOM 0 HH21 ARG B 261 11.655 -1.639 -30.115 1.00 42.50 H new ATOM 0 HH22 ARG B 261 12.913 -0.399 -30.120 1.00 42.50 H new ATOM 2056 N SER B 262 8.315 -6.800 -27.359 1.00 30.42 N ATOM 2057 CA SER B 262 7.232 -7.208 -28.175 1.00 13.51 C ATOM 2058 C SER B 262 6.900 -6.009 -29.068 1.00 40.23 C ATOM 2059 O SER B 262 7.750 -5.106 -29.229 1.00 14.34 O ATOM 2060 CB SER B 262 6.038 -7.584 -27.267 1.00 11.33 C ATOM 2061 OG SER B 262 4.960 -8.147 -28.010 1.00 73.23 O ATOM 0 H SER B 262 8.039 -6.201 -26.581 1.00 30.42 H new ATOM 0 HA SER B 262 7.468 -8.079 -28.786 1.00 13.51 H new ATOM 0 HB2 SER B 262 6.368 -8.296 -26.510 1.00 11.33 H new ATOM 0 HB3 SER B 262 5.690 -6.696 -26.739 1.00 11.33 H new ATOM 0 HG SER B 262 4.423 -8.720 -27.424 1.00 73.23 H new ATOM 2067 N MET B 263 5.712 -6.005 -29.663 1.00 55.12 N ATOM 2068 CA MET B 263 5.247 -4.909 -30.532 1.00 40.40 C ATOM 2069 C MET B 263 6.124 -4.809 -31.755 1.00 52.45 C ATOM 2070 O MET B 263 6.372 -3.717 -32.290 1.00 63.31 O ATOM 2071 CB MET B 263 5.179 -3.570 -29.776 1.00 22.34 C ATOM 2072 CG MET B 263 4.181 -3.565 -28.637 1.00 15.52 C ATOM 2073 SD MET B 263 4.087 -1.979 -27.796 1.00 31.34 S ATOM 2074 CE MET B 263 2.844 -2.345 -26.563 1.00 2.33 C ATOM 0 H MET B 263 5.035 -6.761 -29.561 1.00 55.12 H new ATOM 0 HA MET B 263 4.231 -5.139 -30.853 1.00 40.40 H new ATOM 0 HB2 MET B 263 6.168 -3.334 -29.382 1.00 22.34 H new ATOM 0 HB3 MET B 263 4.919 -2.779 -30.479 1.00 22.34 H new ATOM 0 HG2 MET B 263 3.195 -3.825 -29.023 1.00 15.52 H new ATOM 0 HG3 MET B 263 4.455 -4.336 -27.917 1.00 15.52 H new ATOM 0 HE1 MET B 263 2.666 -1.460 -25.952 1.00 2.33 H new ATOM 0 HE2 MET B 263 1.917 -2.638 -27.056 1.00 2.33 H new ATOM 0 HE3 MET B 263 3.190 -3.161 -25.928 1.00 2.33 H new ATOM 2084 N ASP B 264 6.543 -5.961 -32.216 1.00 43.50 N ATOM 2085 CA ASP B 264 7.372 -6.096 -33.391 1.00 44.40 C ATOM 2086 C ASP B 264 6.600 -5.633 -34.618 1.00 2.34 C ATOM 2087 O ASP B 264 5.377 -5.851 -34.712 1.00 73.40 O ATOM 2088 CB ASP B 264 7.810 -7.559 -33.545 1.00 2.54 C ATOM 2089 CG ASP B 264 8.664 -7.806 -34.765 1.00 64.40 C ATOM 2090 OD1 ASP B 264 9.867 -7.487 -34.727 1.00 55.35 O ATOM 2091 OD2 ASP B 264 8.143 -8.331 -35.773 1.00 25.12 O ATOM 0 H ASP B 264 6.313 -6.852 -31.776 1.00 43.50 H new ATOM 0 HA ASP B 264 8.262 -5.475 -33.287 1.00 44.40 H new ATOM 0 HB2 ASP B 264 8.365 -7.860 -32.656 1.00 2.54 H new ATOM 0 HB3 ASP B 264 6.924 -8.192 -33.597 1.00 2.54 H new ATOM 2096 N ARG B 265 7.286 -4.971 -35.519 1.00 11.41 N ATOM 2097 CA ARG B 265 6.689 -4.447 -36.738 1.00 70.25 C ATOM 2098 C ARG B 265 6.050 -5.575 -37.536 1.00 63.45 C ATOM 2099 O ARG B 265 6.719 -6.539 -37.902 1.00 54.12 O ATOM 2100 CB ARG B 265 7.760 -3.802 -37.596 1.00 74.33 C ATOM 2101 CG ARG B 265 7.227 -3.164 -38.860 1.00 34.15 C ATOM 2102 CD ARG B 265 8.349 -2.763 -39.785 1.00 14.41 C ATOM 2103 NE ARG B 265 9.082 -3.945 -40.264 1.00 2.03 N ATOM 2104 CZ ARG B 265 9.539 -4.104 -41.502 1.00 14.20 C ATOM 2105 NH1 ARG B 265 9.448 -3.112 -42.379 1.00 42.50 N ATOM 2106 NH2 ARG B 265 10.104 -5.250 -41.855 1.00 12.03 N ATOM 0 H ARG B 265 8.283 -4.776 -35.432 1.00 11.41 H new ATOM 0 HA ARG B 265 5.932 -3.713 -36.464 1.00 70.25 H new ATOM 0 HB2 ARG B 265 8.276 -3.044 -37.007 1.00 74.33 H new ATOM 0 HB3 ARG B 265 8.500 -4.556 -37.865 1.00 74.33 H new ATOM 0 HG2 ARG B 265 6.563 -3.862 -39.371 1.00 34.15 H new ATOM 0 HG3 ARG B 265 6.632 -2.287 -38.605 1.00 34.15 H new ATOM 0 HD2 ARG B 265 7.946 -2.211 -40.634 1.00 14.41 H new ATOM 0 HD3 ARG B 265 9.033 -2.092 -39.265 1.00 14.41 H new ATOM 0 HE ARG B 265 9.252 -4.698 -39.597 1.00 2.03 H new ATOM 0 HH11 ARG B 265 9.027 -2.225 -42.104 1.00 42.50 H new ATOM 0 HH12 ARG B 265 9.800 -3.237 -43.328 1.00 42.50 H new ATOM 0 HH21 ARG B 265 10.187 -6.008 -41.177 1.00 12.03 H new ATOM 0 HH22 ARG B 265 10.455 -5.374 -42.804 1.00 12.03 H new ATOM 2120 N LYS B 266 4.780 -5.464 -37.796 1.00 40.01 N ATOM 2121 CA LYS B 266 4.093 -6.467 -38.550 1.00 64.22 C ATOM 2122 C LYS B 266 3.880 -6.017 -39.994 1.00 14.44 C ATOM 2123 O LYS B 266 2.943 -5.233 -40.269 1.00 38.09 O ATOM 2124 CB LYS B 266 2.788 -6.939 -37.860 1.00 53.52 C ATOM 2125 CG LYS B 266 1.763 -5.848 -37.560 1.00 50.25 C ATOM 2126 CD LYS B 266 0.496 -6.418 -36.925 1.00 33.11 C ATOM 2127 CE LYS B 266 -0.196 -7.450 -37.824 1.00 43.31 C ATOM 2128 NZ LYS B 266 -0.622 -6.884 -39.125 1.00 41.23 N ATOM 0 H LYS B 266 4.197 -4.683 -37.494 1.00 40.01 H new ATOM 0 HA LYS B 266 4.733 -7.349 -38.584 1.00 64.22 H new ATOM 0 HB2 LYS B 266 2.316 -7.691 -38.493 1.00 53.52 H new ATOM 0 HB3 LYS B 266 3.052 -7.431 -36.924 1.00 53.52 H new ATOM 0 HG2 LYS B 266 2.204 -5.109 -36.891 1.00 50.25 H new ATOM 0 HG3 LYS B 266 1.505 -5.328 -38.483 1.00 50.25 H new ATOM 0 HD2 LYS B 266 0.748 -6.882 -35.971 1.00 33.11 H new ATOM 0 HD3 LYS B 266 -0.197 -5.605 -36.710 1.00 33.11 H new ATOM 0 HE2 LYS B 266 0.483 -8.284 -38.001 1.00 43.31 H new ATOM 0 HE3 LYS B 266 -1.066 -7.852 -37.305 1.00 43.31 H new ATOM 0 HZ1 LYS B 266 -1.157 -7.600 -39.656 1.00 41.23 H new ATOM 0 HZ2 LYS B 266 -1.224 -6.052 -38.961 1.00 41.23 H new ATOM 0 HZ3 LYS B 266 0.216 -6.602 -39.672 1.00 41.23 H new TER 2142 LYS B 266