USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 749 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 167:sc=-0.00261 (180deg=-0.0969) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 40:sc= 0.209 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc=-0.00581 K(o=-0.0058,f=-0.6) USER MOD Single : A 63 MET CE :methyl 175:sc= 0 (180deg=-0.0568) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.549 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -1.83 X(o=-1.8,f=-1.6) USER MOD Single : A 88 ASN : amide:sc= 0.202 K(o=0.2,f=-3.3!) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 162:sc= -0.0859 (180deg=-0.43) USER MOD Single : A 106 LYS NZ :NH3+ -161:sc= -0.0276 (180deg=-0.233) USER MOD Single : A 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.0222 X(o=-0.022,f=-0.38) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot -89:sc= 0.456 USER MOD Single : A 121 ASN : amide:sc= -1.96 K(o=-2,f=-0.43) USER MOD Single : A 122 THR OG1 : rot -71:sc= 1.03 USER MOD Single : A 123 THR OG1 : rot 153:sc= 0.158 USER MOD Single : A 125 HIS : no HE2:sc= -1.09 K(o=-1.1,f=-2.5!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 MET CE :methyl 136:sc= -0.739 (180deg=-3.46!) USER MOD Single : A 144 HIS : no HD1:sc= -0.0196 X(o=-0.02,f=-0.017) USER MOD Single : A 169 THR OG1 : rot -24:sc= 0.476 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N TYR A 40 15.077 -13.525 -82.385 1.00 1.54 N ATOM 22 CA TYR A 40 15.032 -14.055 -81.026 1.00 30.40 C ATOM 23 C TYR A 40 16.100 -15.125 -80.824 1.00 32.53 C ATOM 24 O TYR A 40 15.876 -16.303 -81.102 1.00 60.12 O ATOM 25 CB TYR A 40 13.650 -14.636 -80.729 1.00 4.42 C ATOM 26 CG TYR A 40 13.346 -14.752 -79.251 1.00 71.42 C ATOM 27 CD1 TYR A 40 13.138 -13.618 -78.475 1.00 35.25 C ATOM 28 CD2 TYR A 40 13.269 -15.994 -78.633 1.00 25.52 C ATOM 29 CE1 TYR A 40 12.862 -13.719 -77.125 1.00 30.31 C ATOM 30 CE2 TYR A 40 12.993 -16.103 -77.284 1.00 43.43 C ATOM 31 CZ TYR A 40 12.790 -14.963 -76.534 1.00 43.20 C ATOM 32 OH TYR A 40 12.514 -15.068 -75.190 1.00 31.53 O ATOM 0 HA TYR A 40 15.230 -13.235 -80.336 1.00 30.40 H new ATOM 0 HB2 TYR A 40 12.893 -14.008 -81.199 1.00 4.42 H new ATOM 0 HB3 TYR A 40 13.574 -15.623 -81.185 1.00 4.42 H new ATOM 0 HD1 TYR A 40 13.193 -12.642 -78.935 1.00 35.25 H new ATOM 0 HD2 TYR A 40 13.428 -16.889 -79.217 1.00 25.52 H new ATOM 0 HE1 TYR A 40 12.703 -12.828 -76.535 1.00 30.31 H new ATOM 0 HE2 TYR A 40 12.936 -17.076 -76.819 1.00 43.43 H new ATOM 0 HH TYR A 40 12.498 -16.013 -74.932 1.00 31.53 H new ATOM 41 N ARG A 41 17.264 -14.706 -80.337 1.00 25.24 N ATOM 42 CA ARG A 41 18.368 -15.627 -80.096 1.00 41.13 C ATOM 43 C ARG A 41 18.936 -15.439 -78.693 1.00 14.34 C ATOM 44 O ARG A 41 20.089 -15.042 -78.525 1.00 62.21 O ATOM 45 CB ARG A 41 19.469 -15.418 -81.136 1.00 33.45 C ATOM 46 CG ARG A 41 20.300 -16.663 -81.403 1.00 61.31 C ATOM 47 CD ARG A 41 21.455 -16.783 -80.421 1.00 55.32 C ATOM 48 NE ARG A 41 21.079 -17.527 -79.223 1.00 2.23 N ATOM 49 CZ ARG A 41 21.935 -17.852 -78.260 1.00 62.42 C ATOM 50 NH1 ARG A 41 23.210 -17.500 -78.356 1.00 25.42 N ATOM 51 NH2 ARG A 41 21.517 -18.529 -77.199 1.00 11.13 N ATOM 0 H ARG A 41 17.466 -13.734 -80.102 1.00 25.24 H new ATOM 0 HA ARG A 41 17.986 -16.644 -80.181 1.00 41.13 H new ATOM 0 HB2 ARG A 41 19.016 -15.087 -82.070 1.00 33.45 H new ATOM 0 HB3 ARG A 41 20.128 -14.617 -80.799 1.00 33.45 H new ATOM 0 HG2 ARG A 41 19.666 -17.547 -81.331 1.00 61.31 H new ATOM 0 HG3 ARG A 41 20.688 -16.631 -82.421 1.00 61.31 H new ATOM 0 HD2 ARG A 41 22.294 -17.280 -80.908 1.00 55.32 H new ATOM 0 HD3 ARG A 41 21.795 -15.787 -80.137 1.00 55.32 H new ATOM 0 HE ARG A 41 20.106 -17.813 -79.119 1.00 2.23 H new ATOM 0 HH11 ARG A 41 23.535 -16.979 -79.170 1.00 25.42 H new ATOM 0 HH12 ARG A 41 23.865 -17.750 -77.616 1.00 25.42 H new ATOM 0 HH21 ARG A 41 20.537 -18.801 -77.121 1.00 11.13 H new ATOM 0 HH22 ARG A 41 22.175 -18.778 -76.461 1.00 11.13 H new ATOM 62 N LYS A 42 18.120 -15.730 -77.686 1.00 10.22 N ATOM 63 CA LYS A 42 18.539 -15.595 -76.296 1.00 21.22 C ATOM 64 C LYS A 42 18.261 -16.876 -75.517 1.00 14.34 C ATOM 65 O LYS A 42 17.866 -16.833 -74.351 1.00 13.33 O ATOM 66 CB LYS A 42 17.819 -14.417 -75.636 1.00 13.03 C ATOM 67 CG LYS A 42 18.294 -13.061 -76.128 1.00 71.02 C ATOM 68 CD LYS A 42 17.532 -11.928 -75.462 1.00 41.24 C ATOM 69 CE LYS A 42 18.293 -10.614 -75.552 1.00 54.42 C ATOM 70 NZ LYS A 42 17.835 -9.636 -74.527 1.00 72.10 N ATOM 0 H LYS A 42 17.163 -16.061 -77.807 1.00 10.22 H new ATOM 0 HA LYS A 42 19.613 -15.409 -76.283 1.00 21.22 H new ATOM 0 HB2 LYS A 42 16.749 -14.507 -75.821 1.00 13.03 H new ATOM 0 HB3 LYS A 42 17.962 -14.473 -74.557 1.00 13.03 H new ATOM 0 HG2 LYS A 42 19.360 -12.952 -75.926 1.00 71.02 H new ATOM 0 HG3 LYS A 42 18.167 -13.000 -77.209 1.00 71.02 H new ATOM 0 HD2 LYS A 42 16.556 -11.817 -75.935 1.00 41.24 H new ATOM 0 HD3 LYS A 42 17.353 -12.175 -74.416 1.00 41.24 H new ATOM 0 HE2 LYS A 42 19.359 -10.802 -75.423 1.00 54.42 H new ATOM 0 HE3 LYS A 42 18.162 -10.186 -76.546 1.00 54.42 H new ATOM 0 HZ1 LYS A 42 18.378 -8.754 -74.622 1.00 72.10 H new ATOM 0 HZ2 LYS A 42 16.824 -9.437 -74.665 1.00 72.10 H new ATOM 0 HZ3 LYS A 42 17.983 -10.033 -73.577 1.00 72.10 H new ATOM 80 N LYS A 43 18.470 -18.016 -76.167 1.00 1.41 N ATOM 81 CA LYS A 43 18.244 -19.311 -75.535 1.00 22.02 C ATOM 82 C LYS A 43 19.261 -19.559 -74.425 1.00 72.43 C ATOM 83 O LYS A 43 20.464 -19.384 -74.621 1.00 40.14 O ATOM 84 CB LYS A 43 18.325 -20.430 -76.575 1.00 42.44 C ATOM 85 CG LYS A 43 17.496 -21.652 -76.218 1.00 34.21 C ATOM 86 CD LYS A 43 18.278 -22.620 -75.346 1.00 55.14 C ATOM 87 CE LYS A 43 17.680 -24.018 -75.390 1.00 73.13 C ATOM 88 NZ LYS A 43 17.969 -24.705 -76.680 1.00 0.24 N ATOM 0 H LYS A 43 18.796 -18.070 -77.132 1.00 1.41 H new ATOM 0 HA LYS A 43 17.247 -19.304 -75.095 1.00 22.02 H new ATOM 0 HB2 LYS A 43 17.992 -20.044 -77.539 1.00 42.44 H new ATOM 0 HB3 LYS A 43 19.366 -20.730 -76.694 1.00 42.44 H new ATOM 0 HG2 LYS A 43 16.592 -21.340 -75.696 1.00 34.21 H new ATOM 0 HG3 LYS A 43 17.179 -22.157 -77.130 1.00 34.21 H new ATOM 0 HD2 LYS A 43 19.315 -22.656 -75.680 1.00 55.14 H new ATOM 0 HD3 LYS A 43 18.287 -22.259 -74.318 1.00 55.14 H new ATOM 0 HE2 LYS A 43 18.079 -24.610 -74.566 1.00 73.13 H new ATOM 0 HE3 LYS A 43 16.601 -23.956 -75.245 1.00 73.13 H new ATOM 0 HZ1 LYS A 43 17.743 -25.716 -76.593 1.00 0.24 H new ATOM 0 HZ2 LYS A 43 17.390 -24.285 -77.435 1.00 0.24 H new ATOM 0 HZ3 LYS A 43 18.976 -24.594 -76.914 1.00 0.24 H new ATOM 98 N GLY A 44 18.771 -19.969 -73.259 1.00 71.14 N ATOM 99 CA GLY A 44 19.651 -20.237 -72.137 1.00 22.01 C ATOM 100 C GLY A 44 19.157 -19.606 -70.850 1.00 24.45 C ATOM 101 O GLY A 44 19.378 -18.419 -70.607 1.00 43.33 O ATOM 0 H GLY A 44 17.780 -20.120 -73.072 1.00 71.14 H new ATOM 0 HA2 GLY A 44 19.741 -21.314 -71.999 1.00 22.01 H new ATOM 0 HA3 GLY A 44 20.649 -19.860 -72.363 1.00 22.01 H new ATOM 105 N LYS A 45 18.486 -20.400 -70.024 1.00 4.04 N ATOM 106 CA LYS A 45 17.958 -19.913 -68.754 1.00 14.10 C ATOM 107 C LYS A 45 17.873 -21.042 -67.732 1.00 42.13 C ATOM 108 O LYS A 45 17.994 -22.216 -68.078 1.00 41.33 O ATOM 109 CB LYS A 45 16.577 -19.289 -68.958 1.00 45.25 C ATOM 110 CG LYS A 45 15.553 -20.253 -69.534 1.00 21.24 C ATOM 111 CD LYS A 45 14.831 -21.020 -68.438 1.00 62.21 C ATOM 112 CE LYS A 45 13.475 -21.522 -68.909 1.00 65.21 C ATOM 113 NZ LYS A 45 12.855 -22.450 -67.925 1.00 51.42 N ATOM 0 H LYS A 45 18.294 -21.384 -70.210 1.00 4.04 H new ATOM 0 HA LYS A 45 18.640 -19.153 -68.373 1.00 14.10 H new ATOM 0 HB2 LYS A 45 16.212 -18.913 -68.002 1.00 45.25 H new ATOM 0 HB3 LYS A 45 16.670 -18.431 -69.623 1.00 45.25 H new ATOM 0 HG2 LYS A 45 14.828 -19.701 -70.131 1.00 21.24 H new ATOM 0 HG3 LYS A 45 16.049 -20.955 -70.204 1.00 21.24 H new ATOM 0 HD2 LYS A 45 15.442 -21.865 -68.120 1.00 62.21 H new ATOM 0 HD3 LYS A 45 14.700 -20.376 -67.568 1.00 62.21 H new ATOM 0 HE2 LYS A 45 12.812 -20.673 -69.076 1.00 65.21 H new ATOM 0 HE3 LYS A 45 13.589 -22.031 -69.866 1.00 65.21 H new ATOM 0 HZ1 LYS A 45 11.932 -22.770 -68.283 1.00 51.42 H new ATOM 0 HZ2 LYS A 45 13.476 -23.272 -67.785 1.00 51.42 H new ATOM 0 HZ3 LYS A 45 12.723 -21.957 -67.019 1.00 51.42 H new ATOM 123 N GLY A 46 17.661 -20.678 -66.470 1.00 64.11 N ATOM 124 CA GLY A 46 17.561 -21.673 -65.418 1.00 21.22 C ATOM 125 C GLY A 46 18.259 -21.241 -64.144 1.00 31.22 C ATOM 126 O GLY A 46 19.467 -20.998 -64.141 1.00 43.14 O ATOM 0 H GLY A 46 17.557 -19.712 -66.158 1.00 64.11 H new ATOM 0 HA2 GLY A 46 16.510 -21.868 -65.205 1.00 21.22 H new ATOM 0 HA3 GLY A 46 17.994 -22.610 -65.766 1.00 21.22 H new ATOM 130 N LYS A 47 17.501 -21.143 -63.059 1.00 44.32 N ATOM 131 CA LYS A 47 18.053 -20.737 -61.771 1.00 40.12 C ATOM 132 C LYS A 47 17.841 -21.824 -60.722 1.00 63.22 C ATOM 133 O LYS A 47 16.936 -22.648 -60.840 1.00 72.53 O ATOM 134 CB LYS A 47 17.406 -19.430 -61.305 1.00 75.03 C ATOM 135 CG LYS A 47 18.103 -18.186 -61.830 1.00 53.23 C ATOM 136 CD LYS A 47 18.010 -18.093 -63.344 1.00 34.41 C ATOM 137 CE LYS A 47 18.354 -16.697 -63.839 1.00 70.40 C ATOM 138 NZ LYS A 47 18.286 -16.601 -65.323 1.00 62.01 N ATOM 0 H LYS A 47 16.500 -21.339 -63.045 1.00 44.32 H new ATOM 0 HA LYS A 47 19.125 -20.581 -61.896 1.00 40.12 H new ATOM 0 HB2 LYS A 47 16.364 -19.415 -61.626 1.00 75.03 H new ATOM 0 HB3 LYS A 47 17.405 -19.403 -60.215 1.00 75.03 H new ATOM 0 HG2 LYS A 47 17.654 -17.300 -61.382 1.00 53.23 H new ATOM 0 HG3 LYS A 47 19.150 -18.200 -61.529 1.00 53.23 H new ATOM 0 HD2 LYS A 47 18.687 -18.818 -63.796 1.00 34.41 H new ATOM 0 HD3 LYS A 47 17.002 -18.356 -63.664 1.00 34.41 H new ATOM 0 HE2 LYS A 47 17.667 -15.976 -63.397 1.00 70.40 H new ATOM 0 HE3 LYS A 47 19.356 -16.430 -63.504 1.00 70.40 H new ATOM 0 HZ1 LYS A 47 18.527 -15.634 -65.620 1.00 62.01 H new ATOM 0 HZ2 LYS A 47 18.960 -17.271 -65.745 1.00 62.01 H new ATOM 0 HZ3 LYS A 47 17.323 -16.831 -65.642 1.00 62.01 H new ATOM 148 N GLY A 48 18.683 -21.817 -59.693 1.00 12.20 N ATOM 149 CA GLY A 48 18.570 -22.806 -58.636 1.00 31.40 C ATOM 150 C GLY A 48 19.672 -22.679 -57.603 1.00 63.31 C ATOM 151 O GLY A 48 20.738 -23.282 -57.743 1.00 64.12 O ATOM 0 H GLY A 48 19.441 -21.145 -59.572 1.00 12.20 H new ATOM 0 HA2 GLY A 48 17.602 -22.700 -58.145 1.00 31.40 H new ATOM 0 HA3 GLY A 48 18.599 -23.804 -59.072 1.00 31.40 H new ATOM 155 N THR A 49 19.418 -21.891 -56.563 1.00 13.30 N ATOM 156 CA THR A 49 20.398 -21.685 -55.504 1.00 4.33 C ATOM 157 C THR A 49 19.731 -21.673 -54.133 1.00 22.43 C ATOM 158 O THR A 49 18.799 -20.905 -53.890 1.00 65.14 O ATOM 159 CB THR A 49 21.167 -20.365 -55.699 1.00 35.51 C ATOM 160 OG1 THR A 49 20.247 -19.273 -55.809 1.00 51.25 O ATOM 161 CG2 THR A 49 22.039 -20.426 -56.944 1.00 13.01 C ATOM 0 H THR A 49 18.542 -21.385 -56.432 1.00 13.30 H new ATOM 0 HA THR A 49 21.100 -22.517 -55.557 1.00 4.33 H new ATOM 0 HB THR A 49 21.809 -20.213 -54.831 1.00 35.51 H new ATOM 0 HG1 THR A 49 19.514 -19.397 -55.171 1.00 51.25 H new ATOM 0 HG21 THR A 49 22.572 -19.483 -57.061 1.00 13.01 H new ATOM 0 HG22 THR A 49 22.758 -21.240 -56.845 1.00 13.01 H new ATOM 0 HG23 THR A 49 21.412 -20.600 -57.819 1.00 13.01 H new ATOM 169 N THR A 50 20.214 -22.527 -53.237 1.00 15.54 N ATOM 170 CA THR A 50 19.665 -22.615 -51.890 1.00 2.41 C ATOM 171 C THR A 50 20.750 -22.954 -50.874 1.00 22.20 C ATOM 172 O THR A 50 21.779 -23.535 -51.221 1.00 23.32 O ATOM 173 CB THR A 50 18.550 -23.675 -51.806 1.00 62.42 C ATOM 174 OG1 THR A 50 18.856 -24.778 -52.664 1.00 34.51 O ATOM 175 CG2 THR A 50 17.207 -23.078 -52.199 1.00 3.41 C ATOM 0 H THR A 50 20.986 -23.169 -53.420 1.00 15.54 H new ATOM 0 HA THR A 50 19.245 -21.637 -51.656 1.00 2.41 H new ATOM 0 HB THR A 50 18.488 -24.024 -50.775 1.00 62.42 H new ATOM 0 HG1 THR A 50 18.143 -25.448 -52.603 1.00 34.51 H new ATOM 0 HG21 THR A 50 16.435 -23.844 -52.132 1.00 3.41 H new ATOM 0 HG22 THR A 50 16.963 -22.257 -51.525 1.00 3.41 H new ATOM 0 HG23 THR A 50 17.260 -22.704 -53.222 1.00 3.41 H new ATOM 183 N VAL A 51 20.513 -22.590 -49.618 1.00 71.52 N ATOM 184 CA VAL A 51 21.470 -22.857 -48.551 1.00 71.50 C ATOM 185 C VAL A 51 20.766 -23.015 -47.209 1.00 23.01 C ATOM 186 O VAL A 51 19.541 -22.937 -47.125 1.00 51.43 O ATOM 187 CB VAL A 51 22.516 -21.731 -48.440 1.00 13.22 C ATOM 188 CG1 VAL A 51 23.467 -21.768 -49.626 1.00 51.11 C ATOM 189 CG2 VAL A 51 21.832 -20.377 -48.336 1.00 40.32 C ATOM 0 H VAL A 51 19.666 -22.109 -49.314 1.00 71.52 H new ATOM 0 HA VAL A 51 21.976 -23.789 -48.805 1.00 71.50 H new ATOM 0 HB VAL A 51 23.099 -21.888 -47.532 1.00 13.22 H new ATOM 0 HG11 VAL A 51 24.199 -20.966 -49.531 1.00 51.11 H new ATOM 0 HG12 VAL A 51 23.982 -22.728 -49.649 1.00 51.11 H new ATOM 0 HG13 VAL A 51 22.903 -21.637 -50.549 1.00 51.11 H new ATOM 0 HG21 VAL A 51 22.586 -19.594 -48.258 1.00 40.32 H new ATOM 0 HG22 VAL A 51 21.223 -20.208 -49.224 1.00 40.32 H new ATOM 0 HG23 VAL A 51 21.196 -20.358 -47.451 1.00 40.32 H new ATOM 199 N GLY A 52 21.550 -23.237 -46.158 1.00 52.40 N ATOM 200 CA GLY A 52 20.983 -23.404 -44.832 1.00 23.11 C ATOM 201 C GLY A 52 22.032 -23.329 -43.740 1.00 2.34 C ATOM 202 O GLY A 52 23.229 -23.404 -44.015 1.00 13.32 O ATOM 0 H GLY A 52 22.567 -23.304 -46.201 1.00 52.40 H new ATOM 0 HA2 GLY A 52 20.230 -22.634 -44.662 1.00 23.11 H new ATOM 0 HA3 GLY A 52 20.473 -24.366 -44.777 1.00 23.11 H new ATOM 206 N MET A 53 21.583 -23.181 -42.498 1.00 54.35 N ATOM 207 CA MET A 53 22.491 -23.096 -41.361 1.00 34.13 C ATOM 208 C MET A 53 21.726 -23.189 -40.045 1.00 33.33 C ATOM 209 O MET A 53 20.522 -22.947 -39.998 1.00 63.34 O ATOM 210 CB MET A 53 23.286 -21.789 -41.412 1.00 12.21 C ATOM 211 CG MET A 53 24.653 -21.883 -40.754 1.00 55.30 C ATOM 212 SD MET A 53 25.801 -22.919 -41.683 1.00 23.31 S ATOM 213 CE MET A 53 27.028 -21.710 -42.172 1.00 30.44 C ATOM 0 H MET A 53 20.595 -23.117 -42.254 1.00 54.35 H new ATOM 0 HA MET A 53 23.183 -23.936 -41.418 1.00 34.13 H new ATOM 0 HB2 MET A 53 23.413 -21.491 -42.453 1.00 12.21 H new ATOM 0 HB3 MET A 53 22.710 -21.003 -40.923 1.00 12.21 H new ATOM 0 HG2 MET A 53 25.073 -20.882 -40.653 1.00 55.30 H new ATOM 0 HG3 MET A 53 24.540 -22.285 -39.747 1.00 55.30 H new ATOM 0 HE1 MET A 53 27.808 -22.199 -42.756 1.00 30.44 H new ATOM 0 HE2 MET A 53 26.555 -20.935 -42.775 1.00 30.44 H new ATOM 0 HE3 MET A 53 27.469 -21.259 -41.283 1.00 30.44 H new ATOM 221 N GLY A 54 22.435 -23.542 -38.977 1.00 73.21 N ATOM 222 CA GLY A 54 21.806 -23.661 -37.674 1.00 75.21 C ATOM 223 C GLY A 54 22.319 -24.852 -36.890 1.00 13.52 C ATOM 224 O GLY A 54 22.713 -25.865 -37.468 1.00 51.12 O ATOM 0 H GLY A 54 23.434 -23.748 -38.991 1.00 73.21 H new ATOM 0 HA2 GLY A 54 21.985 -22.750 -37.103 1.00 75.21 H new ATOM 0 HA3 GLY A 54 20.727 -23.751 -37.801 1.00 75.21 H new ATOM 266 N ARG A 58 18.550 -23.147 -26.613 1.00 22.43 N ATOM 267 CA ARG A 58 17.506 -23.337 -25.614 1.00 42.52 C ATOM 268 C ARG A 58 18.017 -22.993 -24.218 1.00 63.33 C ATOM 269 O ARG A 58 19.201 -23.156 -23.923 1.00 63.41 O ATOM 270 CB ARG A 58 17.000 -24.780 -25.642 1.00 0.20 C ATOM 271 CG ARG A 58 15.617 -24.954 -25.034 1.00 32.11 C ATOM 272 CD ARG A 58 15.262 -26.424 -24.870 1.00 65.22 C ATOM 273 NE ARG A 58 14.596 -26.960 -26.053 1.00 44.51 N ATOM 274 CZ ARG A 58 14.370 -28.255 -26.246 1.00 4.44 C ATOM 275 NH1 ARG A 58 14.756 -29.141 -25.337 1.00 51.20 N ATOM 276 NH2 ARG A 58 13.757 -28.667 -27.347 1.00 55.03 N ATOM 0 HA ARG A 58 16.682 -22.665 -25.855 1.00 42.52 H new ATOM 0 HB2 ARG A 58 16.980 -25.129 -26.674 1.00 0.20 H new ATOM 0 HB3 ARG A 58 17.706 -25.414 -25.105 1.00 0.20 H new ATOM 0 HG2 ARG A 58 15.580 -24.459 -24.064 1.00 32.11 H new ATOM 0 HG3 ARG A 58 14.876 -24.468 -25.668 1.00 32.11 H new ATOM 0 HD2 ARG A 58 16.169 -26.996 -24.674 1.00 65.22 H new ATOM 0 HD3 ARG A 58 14.614 -26.546 -24.002 1.00 65.22 H new ATOM 0 HE ARG A 58 14.287 -26.305 -26.771 1.00 44.51 H new ATOM 0 HH11 ARG A 58 15.227 -28.828 -24.488 1.00 51.20 H new ATOM 0 HH12 ARG A 58 14.582 -30.135 -25.487 1.00 51.20 H new ATOM 0 HH21 ARG A 58 13.458 -27.989 -28.048 1.00 55.03 H new ATOM 0 HH22 ARG A 58 13.585 -29.662 -27.493 1.00 55.03 H new ATOM 287 N ARG A 59 17.117 -22.515 -23.365 1.00 23.44 N ATOM 288 CA ARG A 59 17.479 -22.145 -22.002 1.00 42.30 C ATOM 289 C ARG A 59 16.232 -21.930 -21.148 1.00 60.25 C ATOM 290 O ARG A 59 15.195 -21.491 -21.646 1.00 52.14 O ATOM 291 CB ARG A 59 18.334 -20.877 -22.003 1.00 33.24 C ATOM 292 CG ARG A 59 19.189 -20.718 -20.757 1.00 10.14 C ATOM 293 CD ARG A 59 19.857 -19.352 -20.710 1.00 31.10 C ATOM 294 NE ARG A 59 20.431 -19.068 -19.398 1.00 45.12 N ATOM 295 CZ ARG A 59 20.868 -17.869 -19.032 1.00 24.14 C ATOM 296 NH1 ARG A 59 20.798 -16.847 -19.874 1.00 54.21 N ATOM 297 NH2 ARG A 59 21.377 -17.688 -17.819 1.00 3.00 N ATOM 0 H ARG A 59 16.133 -22.375 -23.593 1.00 23.44 H new ATOM 0 HA ARG A 59 18.057 -22.963 -21.572 1.00 42.30 H new ATOM 0 HB2 ARG A 59 18.982 -20.887 -22.879 1.00 33.24 H new ATOM 0 HB3 ARG A 59 17.682 -20.009 -22.099 1.00 33.24 H new ATOM 0 HG2 ARG A 59 18.570 -20.852 -19.870 1.00 10.14 H new ATOM 0 HG3 ARG A 59 19.951 -21.498 -20.735 1.00 10.14 H new ATOM 0 HD2 ARG A 59 20.641 -19.306 -21.466 1.00 31.10 H new ATOM 0 HD3 ARG A 59 19.127 -18.583 -20.960 1.00 31.10 H new ATOM 0 HE ARG A 59 20.500 -19.832 -18.726 1.00 45.12 H new ATOM 0 HH11 ARG A 59 20.407 -16.980 -20.807 1.00 54.21 H new ATOM 0 HH12 ARG A 59 21.135 -15.927 -19.589 1.00 54.21 H new ATOM 0 HH21 ARG A 59 21.433 -18.471 -17.167 1.00 3.00 H new ATOM 0 HH22 ARG A 59 21.712 -16.766 -17.539 1.00 3.00 H new ATOM 308 N PHE A 60 16.342 -22.240 -19.861 1.00 52.44 N ATOM 309 CA PHE A 60 15.223 -22.082 -18.939 1.00 5.41 C ATOM 310 C PHE A 60 15.717 -21.728 -17.540 1.00 11.14 C ATOM 311 O PHE A 60 16.897 -21.893 -17.227 1.00 71.50 O ATOM 312 CB PHE A 60 14.390 -23.365 -18.888 1.00 65.42 C ATOM 313 CG PHE A 60 15.126 -24.535 -18.301 1.00 33.15 C ATOM 314 CD1 PHE A 60 14.922 -24.908 -16.982 1.00 72.34 C ATOM 315 CD2 PHE A 60 16.023 -25.262 -19.068 1.00 3.11 C ATOM 316 CE1 PHE A 60 15.597 -25.984 -16.438 1.00 24.50 C ATOM 317 CE2 PHE A 60 16.701 -26.339 -18.529 1.00 61.11 C ATOM 318 CZ PHE A 60 16.489 -26.700 -17.213 1.00 44.33 C ATOM 0 H PHE A 60 17.194 -22.602 -19.433 1.00 52.44 H new ATOM 0 HA PHE A 60 14.598 -21.266 -19.303 1.00 5.41 H new ATOM 0 HB2 PHE A 60 13.490 -23.181 -18.302 1.00 65.42 H new ATOM 0 HB3 PHE A 60 14.066 -23.619 -19.897 1.00 65.42 H new ATOM 0 HD1 PHE A 60 14.227 -24.351 -16.372 1.00 72.34 H new ATOM 0 HD2 PHE A 60 16.194 -24.984 -20.098 1.00 3.11 H new ATOM 0 HE1 PHE A 60 15.428 -26.265 -15.409 1.00 24.50 H new ATOM 0 HE2 PHE A 60 17.397 -26.898 -19.137 1.00 61.11 H new ATOM 0 HZ PHE A 60 17.019 -27.540 -16.790 1.00 44.33 H new ATOM 327 N ILE A 61 14.808 -21.242 -16.702 1.00 74.23 N ATOM 328 CA ILE A 61 15.151 -20.866 -15.337 1.00 22.12 C ATOM 329 C ILE A 61 14.109 -21.376 -14.348 1.00 3.23 C ATOM 330 O ILE A 61 12.932 -21.506 -14.682 1.00 15.34 O ATOM 331 CB ILE A 61 15.278 -19.338 -15.189 1.00 21.22 C ATOM 332 CG1 ILE A 61 16.165 -18.768 -16.298 1.00 31.03 C ATOM 333 CG2 ILE A 61 15.839 -18.983 -13.820 1.00 65.01 C ATOM 334 CD1 ILE A 61 17.597 -19.255 -16.237 1.00 40.54 C ATOM 0 H ILE A 61 13.828 -21.099 -16.945 1.00 74.23 H new ATOM 0 HA ILE A 61 16.114 -21.326 -15.116 1.00 22.12 H new ATOM 0 HB ILE A 61 14.286 -18.896 -15.279 1.00 21.22 H new ATOM 0 HG12 ILE A 61 15.740 -19.035 -17.266 1.00 31.03 H new ATOM 0 HG13 ILE A 61 16.157 -17.680 -16.236 1.00 31.03 H new ATOM 0 HG21 ILE A 61 15.923 -17.900 -13.731 1.00 65.01 H new ATOM 0 HG22 ILE A 61 15.172 -19.360 -13.045 1.00 65.01 H new ATOM 0 HG23 ILE A 61 16.824 -19.434 -13.702 1.00 65.01 H new ATOM 0 HD11 ILE A 61 18.167 -18.811 -17.053 1.00 40.54 H new ATOM 0 HD12 ILE A 61 18.040 -18.965 -15.284 1.00 40.54 H new ATOM 0 HD13 ILE A 61 17.616 -20.341 -16.330 1.00 40.54 H new ATOM 345 N ASN A 62 14.550 -21.661 -13.126 1.00 60.21 N ATOM 346 CA ASN A 62 13.655 -22.156 -12.087 1.00 51.51 C ATOM 347 C ASN A 62 12.909 -21.005 -11.417 1.00 33.25 C ATOM 348 O ASN A 62 13.032 -19.852 -11.827 1.00 30.21 O ATOM 349 CB ASN A 62 14.443 -22.946 -11.040 1.00 63.23 C ATOM 350 CG ASN A 62 15.246 -24.076 -11.653 1.00 11.24 C ATOM 351 OD1 ASN A 62 16.280 -23.848 -12.282 1.00 54.31 O ATOM 352 ND2 ASN A 62 14.774 -25.304 -11.471 1.00 31.15 N ATOM 0 H ASN A 62 15.521 -21.557 -12.832 1.00 60.21 H new ATOM 0 HA ASN A 62 12.924 -22.815 -12.556 1.00 51.51 H new ATOM 0 HB2 ASN A 62 15.116 -22.272 -10.510 1.00 63.23 H new ATOM 0 HB3 ASN A 62 13.753 -23.353 -10.301 1.00 63.23 H new ATOM 0 HD21 ASN A 62 15.272 -26.105 -11.859 1.00 31.15 H new ATOM 0 HD22 ASN A 62 13.913 -25.446 -10.943 1.00 31.15 H new ATOM 358 N MET A 63 12.140 -21.329 -10.384 1.00 65.14 N ATOM 359 CA MET A 63 11.376 -20.321 -9.656 1.00 33.12 C ATOM 360 C MET A 63 10.924 -20.856 -8.301 1.00 23.01 C ATOM 361 O MET A 63 10.733 -22.060 -8.130 1.00 54.22 O ATOM 362 CB MET A 63 10.161 -19.881 -10.474 1.00 62.12 C ATOM 363 CG MET A 63 9.310 -18.829 -9.782 1.00 12.52 C ATOM 364 SD MET A 63 8.200 -17.975 -10.917 1.00 73.30 S ATOM 365 CE MET A 63 7.135 -19.321 -11.428 1.00 31.21 C ATOM 0 H MET A 63 12.029 -22.280 -10.032 1.00 65.14 H new ATOM 0 HA MET A 63 12.024 -19.460 -9.490 1.00 33.12 H new ATOM 0 HB2 MET A 63 10.501 -19.488 -11.432 1.00 62.12 H new ATOM 0 HB3 MET A 63 9.543 -20.753 -10.688 1.00 62.12 H new ATOM 0 HG2 MET A 63 8.724 -19.302 -8.994 1.00 12.52 H new ATOM 0 HG3 MET A 63 9.961 -18.100 -9.300 1.00 12.52 H new ATOM 0 HE1 MET A 63 6.339 -18.934 -12.064 1.00 31.21 H new ATOM 0 HE2 MET A 63 7.718 -20.056 -11.983 1.00 31.21 H new ATOM 0 HE3 MET A 63 6.699 -19.794 -10.548 1.00 31.21 H new ATOM 373 N TYR A 64 10.756 -19.954 -7.341 1.00 4.02 N ATOM 374 CA TYR A 64 10.329 -20.336 -5.999 1.00 72.34 C ATOM 375 C TYR A 64 8.988 -19.698 -5.651 1.00 63.53 C ATOM 376 O TYR A 64 8.365 -19.041 -6.485 1.00 61.34 O ATOM 377 CB TYR A 64 11.383 -19.926 -4.969 1.00 73.50 C ATOM 378 CG TYR A 64 12.774 -20.420 -5.298 1.00 53.22 C ATOM 379 CD1 TYR A 64 13.770 -19.536 -5.696 1.00 2.54 C ATOM 380 CD2 TYR A 64 13.092 -21.769 -5.212 1.00 13.41 C ATOM 381 CE1 TYR A 64 15.043 -19.984 -5.997 1.00 64.33 C ATOM 382 CE2 TYR A 64 14.362 -22.225 -5.510 1.00 72.33 C ATOM 383 CZ TYR A 64 15.333 -21.329 -5.902 1.00 62.22 C ATOM 384 OH TYR A 64 16.599 -21.778 -6.202 1.00 72.23 O ATOM 0 H TYR A 64 10.909 -18.953 -7.466 1.00 4.02 H new ATOM 0 HA TYR A 64 10.212 -21.419 -5.978 1.00 72.34 H new ATOM 0 HB2 TYR A 64 11.401 -18.839 -4.893 1.00 73.50 H new ATOM 0 HB3 TYR A 64 11.092 -20.309 -3.991 1.00 73.50 H new ATOM 0 HD1 TYR A 64 13.546 -18.482 -5.771 1.00 2.54 H new ATOM 0 HD2 TYR A 64 12.333 -22.474 -4.907 1.00 13.41 H new ATOM 0 HE1 TYR A 64 15.806 -19.284 -6.305 1.00 64.33 H new ATOM 0 HE2 TYR A 64 14.592 -23.278 -5.436 1.00 72.33 H new ATOM 0 HH TYR A 64 16.638 -22.750 -6.084 1.00 72.23 H new ATOM 393 N GLY A 65 8.549 -19.895 -4.412 1.00 43.42 N ATOM 394 CA GLY A 65 7.284 -19.332 -3.974 1.00 74.23 C ATOM 395 C GLY A 65 7.330 -18.856 -2.536 1.00 1.51 C ATOM 396 O GLY A 65 8.402 -18.578 -1.999 1.00 54.35 O ATOM 0 H GLY A 65 9.046 -20.434 -3.703 1.00 43.42 H new ATOM 0 HA2 GLY A 65 7.017 -18.497 -4.622 1.00 74.23 H new ATOM 0 HA3 GLY A 65 6.500 -20.081 -4.081 1.00 74.23 H new ATOM 400 N PHE A 66 6.161 -18.759 -1.909 1.00 53.14 N ATOM 401 CA PHE A 66 6.071 -18.310 -0.526 1.00 1.15 C ATOM 402 C PHE A 66 5.126 -19.202 0.275 1.00 43.14 C ATOM 403 O PHE A 66 4.629 -20.210 -0.229 1.00 30.50 O ATOM 404 CB PHE A 66 5.591 -16.859 -0.469 1.00 22.35 C ATOM 405 CG PHE A 66 6.538 -15.888 -1.114 1.00 55.10 C ATOM 406 CD1 PHE A 66 7.454 -15.181 -0.351 1.00 73.42 C ATOM 407 CD2 PHE A 66 6.514 -15.683 -2.485 1.00 55.50 C ATOM 408 CE1 PHE A 66 8.327 -14.287 -0.944 1.00 61.03 C ATOM 409 CE2 PHE A 66 7.384 -14.792 -3.083 1.00 22.32 C ATOM 410 CZ PHE A 66 8.292 -14.093 -2.311 1.00 14.32 C ATOM 0 H PHE A 66 5.264 -18.986 -2.338 1.00 53.14 H new ATOM 0 HA PHE A 66 7.065 -18.374 -0.084 1.00 1.15 H new ATOM 0 HB2 PHE A 66 4.620 -16.787 -0.959 1.00 22.35 H new ATOM 0 HB3 PHE A 66 5.445 -16.574 0.573 1.00 22.35 H new ATOM 0 HD1 PHE A 66 7.486 -15.330 0.718 1.00 73.42 H new ATOM 0 HD2 PHE A 66 5.806 -16.227 -3.093 1.00 55.50 H new ATOM 0 HE1 PHE A 66 9.035 -13.741 -0.339 1.00 61.03 H new ATOM 0 HE2 PHE A 66 7.354 -14.642 -4.152 1.00 22.32 H new ATOM 0 HZ PHE A 66 8.973 -13.396 -2.776 1.00 14.32 H new ATOM 419 N ASP A 67 4.882 -18.823 1.524 1.00 10.35 N ATOM 420 CA ASP A 67 3.996 -19.587 2.396 1.00 21.21 C ATOM 421 C ASP A 67 2.721 -18.805 2.694 1.00 1.40 C ATOM 422 O ASP A 67 2.663 -17.584 2.550 1.00 34.53 O ATOM 423 CB ASP A 67 4.711 -19.940 3.702 1.00 50.13 C ATOM 424 CG ASP A 67 5.685 -18.864 4.137 1.00 12.00 C ATOM 425 OD1 ASP A 67 5.307 -18.029 4.985 1.00 34.32 O ATOM 426 OD2 ASP A 67 6.826 -18.856 3.630 1.00 33.13 O ATOM 0 H ASP A 67 5.285 -17.992 1.956 1.00 10.35 H new ATOM 0 HA ASP A 67 3.723 -20.508 1.880 1.00 21.21 H new ATOM 0 HB2 ASP A 67 3.971 -20.096 4.487 1.00 50.13 H new ATOM 0 HB3 ASP A 67 5.246 -20.881 3.577 1.00 50.13 H new ATOM 430 N PRO A 68 1.671 -19.524 3.120 1.00 20.21 N ATOM 431 CA PRO A 68 0.378 -18.918 3.448 1.00 53.35 C ATOM 432 C PRO A 68 0.437 -18.073 4.715 1.00 31.21 C ATOM 433 O PRO A 68 1.492 -17.940 5.337 1.00 40.34 O ATOM 434 CB PRO A 68 -0.538 -20.128 3.654 1.00 61.22 C ATOM 435 CG PRO A 68 0.379 -21.233 4.048 1.00 53.44 C ATOM 436 CD PRO A 68 1.669 -20.984 3.315 1.00 45.55 C ATOM 0 HA PRO A 68 0.039 -18.236 2.668 1.00 53.35 H new ATOM 0 HB2 PRO A 68 -1.281 -19.935 4.428 1.00 61.22 H new ATOM 0 HB3 PRO A 68 -1.083 -20.372 2.742 1.00 61.22 H new ATOM 0 HG2 PRO A 68 0.539 -21.242 5.126 1.00 53.44 H new ATOM 0 HG3 PRO A 68 -0.041 -22.203 3.780 1.00 53.44 H new ATOM 0 HD2 PRO A 68 2.531 -21.314 3.895 1.00 45.55 H new ATOM 0 HD3 PRO A 68 1.701 -21.517 2.365 1.00 45.55 H new ATOM 441 N THR A 69 -0.702 -17.501 5.094 1.00 74.43 N ATOM 442 CA THR A 69 -0.779 -16.667 6.286 1.00 51.55 C ATOM 443 C THR A 69 -2.211 -16.576 6.801 1.00 2.01 C ATOM 444 O THR A 69 -3.154 -16.957 6.109 1.00 4.21 O ATOM 445 CB THR A 69 -0.252 -15.246 6.014 1.00 54.11 C ATOM 446 OG1 THR A 69 0.738 -15.281 4.979 1.00 60.31 O ATOM 447 CG2 THR A 69 0.345 -14.639 7.274 1.00 34.51 C ATOM 0 H THR A 69 -1.584 -17.601 4.592 1.00 74.43 H new ATOM 0 HA THR A 69 -0.152 -17.139 7.043 1.00 51.55 H new ATOM 0 HB THR A 69 -1.090 -14.626 5.694 1.00 54.11 H new ATOM 0 HG1 THR A 69 1.067 -14.374 4.811 1.00 60.31 H new ATOM 0 HG21 THR A 69 0.710 -13.635 7.056 1.00 34.51 H new ATOM 0 HG22 THR A 69 -0.419 -14.587 8.050 1.00 34.51 H new ATOM 0 HG23 THR A 69 1.172 -15.259 7.620 1.00 34.51 H new ATOM 468 N TYR A 71 -5.559 -14.552 7.944 1.00 65.50 N ATOM 469 CA TYR A 71 -6.251 -13.312 7.613 1.00 22.41 C ATOM 470 C TYR A 71 -7.356 -13.019 8.623 1.00 63.22 C ATOM 471 O TYR A 71 -8.481 -12.687 8.250 1.00 63.33 O ATOM 472 CB TYR A 71 -6.839 -13.390 6.204 1.00 54.34 C ATOM 473 CG TYR A 71 -5.875 -13.935 5.174 1.00 22.10 C ATOM 474 CD1 TYR A 71 -5.093 -13.080 4.407 1.00 61.10 C ATOM 475 CD2 TYR A 71 -5.746 -15.302 4.968 1.00 1.30 C ATOM 476 CE1 TYR A 71 -4.210 -13.571 3.465 1.00 30.03 C ATOM 477 CE2 TYR A 71 -4.865 -15.803 4.029 1.00 3.12 C ATOM 478 CZ TYR A 71 -4.100 -14.933 3.280 1.00 11.55 C ATOM 479 OH TYR A 71 -3.222 -15.428 2.343 1.00 52.54 O ATOM 0 HA TYR A 71 -5.525 -12.500 7.650 1.00 22.41 H new ATOM 0 HB2 TYR A 71 -7.729 -14.019 6.225 1.00 54.34 H new ATOM 0 HB3 TYR A 71 -7.160 -12.394 5.898 1.00 54.34 H new ATOM 0 HD1 TYR A 71 -5.177 -12.013 4.550 1.00 61.10 H new ATOM 0 HD2 TYR A 71 -6.345 -15.985 5.552 1.00 1.30 H new ATOM 0 HE1 TYR A 71 -3.610 -12.892 2.877 1.00 30.03 H new ATOM 0 HE2 TYR A 71 -4.776 -16.869 3.882 1.00 3.12 H new ATOM 0 HH TYR A 71 -3.266 -16.407 2.339 1.00 52.54 H new ATOM 488 N SER A 72 -7.028 -13.144 9.905 1.00 33.51 N ATOM 489 CA SER A 72 -7.992 -12.896 10.969 1.00 13.32 C ATOM 490 C SER A 72 -7.620 -11.645 11.760 1.00 71.13 C ATOM 491 O SER A 72 -7.480 -11.688 12.982 1.00 31.11 O ATOM 492 CB SER A 72 -8.069 -14.102 11.907 1.00 0.15 C ATOM 493 OG SER A 72 -8.926 -15.101 11.385 1.00 45.43 O ATOM 0 H SER A 72 -6.101 -13.416 10.232 1.00 33.51 H new ATOM 0 HA SER A 72 -8.968 -12.737 10.511 1.00 13.32 H new ATOM 0 HB2 SER A 72 -7.071 -14.516 12.055 1.00 0.15 H new ATOM 0 HB3 SER A 72 -8.430 -13.783 12.885 1.00 0.15 H new ATOM 0 HG SER A 72 -8.956 -15.861 12.003 1.00 45.43 H new ATOM 498 N PHE A 73 -7.461 -10.531 11.052 1.00 3.40 N ATOM 499 CA PHE A 73 -7.104 -9.267 11.686 1.00 12.21 C ATOM 500 C PHE A 73 -7.573 -8.085 10.844 1.00 14.30 C ATOM 501 O PHE A 73 -8.324 -8.254 9.882 1.00 43.02 O ATOM 502 CB PHE A 73 -5.591 -9.189 11.899 1.00 21.30 C ATOM 503 CG PHE A 73 -4.818 -8.974 10.629 1.00 63.42 C ATOM 504 CD1 PHE A 73 -4.142 -7.785 10.407 1.00 23.51 C ATOM 505 CD2 PHE A 73 -4.768 -9.959 9.657 1.00 32.21 C ATOM 506 CE1 PHE A 73 -3.429 -7.583 9.240 1.00 3.12 C ATOM 507 CE2 PHE A 73 -4.057 -9.763 8.488 1.00 33.44 C ATOM 508 CZ PHE A 73 -3.387 -8.574 8.279 1.00 64.34 C ATOM 0 H PHE A 73 -7.574 -10.478 10.040 1.00 3.40 H new ATOM 0 HA PHE A 73 -7.603 -9.221 12.654 1.00 12.21 H new ATOM 0 HB2 PHE A 73 -5.371 -8.376 12.591 1.00 21.30 H new ATOM 0 HB3 PHE A 73 -5.250 -10.111 12.371 1.00 21.30 H new ATOM 0 HD1 PHE A 73 -4.173 -7.006 11.155 1.00 23.51 H new ATOM 0 HD2 PHE A 73 -5.291 -10.891 9.814 1.00 32.21 H new ATOM 0 HE1 PHE A 73 -2.906 -6.652 9.080 1.00 3.12 H new ATOM 0 HE2 PHE A 73 -4.026 -10.540 7.738 1.00 33.44 H new ATOM 0 HZ PHE A 73 -2.831 -8.419 7.366 1.00 64.34 H new ATOM 517 N ILE A 74 -7.125 -6.889 11.212 1.00 54.34 N ATOM 518 CA ILE A 74 -7.498 -5.679 10.491 1.00 75.32 C ATOM 519 C ILE A 74 -6.272 -4.989 9.902 1.00 53.40 C ATOM 520 O ILE A 74 -5.205 -4.972 10.515 1.00 75.32 O ATOM 521 CB ILE A 74 -8.242 -4.686 11.403 1.00 41.52 C ATOM 522 CG1 ILE A 74 -9.495 -5.340 11.990 1.00 35.21 C ATOM 523 CG2 ILE A 74 -8.608 -3.428 10.630 1.00 50.13 C ATOM 524 CD1 ILE A 74 -10.273 -4.432 12.917 1.00 53.14 C ATOM 0 H ILE A 74 -6.503 -6.733 12.005 1.00 54.34 H new ATOM 0 HA ILE A 74 -8.162 -5.986 9.683 1.00 75.32 H new ATOM 0 HB ILE A 74 -7.582 -4.405 12.224 1.00 41.52 H new ATOM 0 HG12 ILE A 74 -10.145 -5.657 11.175 1.00 35.21 H new ATOM 0 HG13 ILE A 74 -9.205 -6.239 12.534 1.00 35.21 H new ATOM 0 HG21 ILE A 74 -9.133 -2.736 11.289 1.00 50.13 H new ATOM 0 HG22 ILE A 74 -7.701 -2.954 10.255 1.00 50.13 H new ATOM 0 HG23 ILE A 74 -9.253 -3.691 9.791 1.00 50.13 H new ATOM 0 HD11 ILE A 74 -11.147 -4.961 13.295 1.00 53.14 H new ATOM 0 HD12 ILE A 74 -9.639 -4.135 13.752 1.00 53.14 H new ATOM 0 HD13 ILE A 74 -10.594 -3.544 12.372 1.00 53.14 H new ATOM 535 N GLN A 75 -6.434 -4.423 8.711 1.00 33.53 N ATOM 536 CA GLN A 75 -5.339 -3.731 8.040 1.00 10.04 C ATOM 537 C GLN A 75 -5.503 -2.218 8.147 1.00 4.54 C ATOM 538 O GLN A 75 -6.466 -1.650 7.632 1.00 63.24 O ATOM 539 CB GLN A 75 -5.271 -4.145 6.569 1.00 41.12 C ATOM 540 CG GLN A 75 -4.151 -3.466 5.798 1.00 14.31 C ATOM 541 CD GLN A 75 -4.091 -3.906 4.349 1.00 73.13 C ATOM 542 OE1 GLN A 75 -3.298 -4.776 3.984 1.00 41.04 O ATOM 543 NE2 GLN A 75 -4.930 -3.307 3.512 1.00 11.31 N ATOM 0 H GLN A 75 -7.311 -4.430 8.191 1.00 33.53 H new ATOM 0 HA GLN A 75 -4.409 -4.013 8.533 1.00 10.04 H new ATOM 0 HB2 GLN A 75 -5.139 -5.225 6.510 1.00 41.12 H new ATOM 0 HB3 GLN A 75 -6.223 -3.914 6.091 1.00 41.12 H new ATOM 0 HG2 GLN A 75 -4.289 -2.386 5.840 1.00 14.31 H new ATOM 0 HG3 GLN A 75 -3.198 -3.685 6.280 1.00 14.31 H new ATOM 0 HE21 GLN A 75 -5.570 -2.592 3.857 1.00 11.31 H new ATOM 0 HE22 GLN A 75 -4.934 -3.562 2.524 1.00 11.31 H new ATOM 550 N PHE A 76 -4.558 -1.571 8.823 1.00 41.35 N ATOM 551 CA PHE A 76 -4.600 -0.125 8.999 1.00 43.43 C ATOM 552 C PHE A 76 -3.870 0.583 7.862 1.00 62.55 C ATOM 553 O PHE A 76 -2.769 0.190 7.476 1.00 42.05 O ATOM 554 CB PHE A 76 -3.975 0.265 10.341 1.00 51.45 C ATOM 555 CG PHE A 76 -3.821 1.747 10.522 1.00 63.21 C ATOM 556 CD1 PHE A 76 -2.721 2.411 10.002 1.00 61.15 C ATOM 557 CD2 PHE A 76 -4.775 2.477 11.213 1.00 22.44 C ATOM 558 CE1 PHE A 76 -2.576 3.776 10.169 1.00 74.02 C ATOM 559 CE2 PHE A 76 -4.635 3.842 11.382 1.00 24.42 C ATOM 560 CZ PHE A 76 -3.535 4.492 10.858 1.00 23.13 C ATOM 0 H PHE A 76 -3.755 -2.026 9.257 1.00 41.35 H new ATOM 0 HA PHE A 76 -5.644 0.187 8.987 1.00 43.43 H new ATOM 0 HB2 PHE A 76 -4.592 -0.129 11.148 1.00 51.45 H new ATOM 0 HB3 PHE A 76 -2.996 -0.207 10.428 1.00 51.45 H new ATOM 0 HD1 PHE A 76 -1.969 1.856 9.461 1.00 61.15 H new ATOM 0 HD2 PHE A 76 -5.638 1.974 11.624 1.00 22.44 H new ATOM 0 HE1 PHE A 76 -1.713 4.282 9.761 1.00 74.02 H new ATOM 0 HE2 PHE A 76 -5.385 4.399 11.923 1.00 24.42 H new ATOM 0 HZ PHE A 76 -3.425 5.559 10.987 1.00 23.13 H new ATOM 569 N VAL A 77 -4.493 1.630 7.329 1.00 73.42 N ATOM 570 CA VAL A 77 -3.903 2.394 6.235 1.00 3.53 C ATOM 571 C VAL A 77 -4.219 3.879 6.370 1.00 1.10 C ATOM 572 O VAL A 77 -5.298 4.256 6.830 1.00 74.51 O ATOM 573 CB VAL A 77 -4.406 1.896 4.868 1.00 54.34 C ATOM 574 CG1 VAL A 77 -5.913 2.070 4.756 1.00 70.24 C ATOM 575 CG2 VAL A 77 -3.692 2.625 3.740 1.00 35.42 C ATOM 0 H VAL A 77 -5.405 1.968 7.636 1.00 73.42 H new ATOM 0 HA VAL A 77 -2.824 2.248 6.292 1.00 3.53 H new ATOM 0 HB VAL A 77 -4.181 0.833 4.784 1.00 54.34 H new ATOM 0 HG11 VAL A 77 -6.249 1.712 3.783 1.00 70.24 H new ATOM 0 HG12 VAL A 77 -6.405 1.498 5.543 1.00 70.24 H new ATOM 0 HG13 VAL A 77 -6.166 3.125 4.862 1.00 70.24 H new ATOM 0 HG21 VAL A 77 -4.060 2.260 2.781 1.00 35.42 H new ATOM 0 HG22 VAL A 77 -3.884 3.695 3.819 1.00 35.42 H new ATOM 0 HG23 VAL A 77 -2.620 2.443 3.810 1.00 35.42 H new ATOM 585 N ASP A 78 -3.272 4.719 5.966 1.00 54.32 N ATOM 586 CA ASP A 78 -3.450 6.164 6.040 1.00 22.45 C ATOM 587 C ASP A 78 -3.944 6.720 4.708 1.00 13.04 C ATOM 588 O ASP A 78 -3.499 6.314 3.634 1.00 13.24 O ATOM 589 CB ASP A 78 -2.136 6.842 6.434 1.00 52.25 C ATOM 590 CG ASP A 78 -2.342 7.986 7.406 1.00 44.04 C ATOM 591 OD1 ASP A 78 -1.808 9.085 7.151 1.00 4.25 O ATOM 592 OD2 ASP A 78 -3.040 7.782 8.421 1.00 44.31 O ATOM 0 H ASP A 78 -2.373 4.424 5.584 1.00 54.32 H new ATOM 0 HA ASP A 78 -4.201 6.374 6.802 1.00 22.45 H new ATOM 0 HB2 ASP A 78 -1.470 6.104 6.882 1.00 52.25 H new ATOM 0 HB3 ASP A 78 -1.641 7.216 5.538 1.00 52.25 H new ATOM 596 N PRO A 79 -4.888 7.670 4.777 1.00 60.33 N ATOM 597 CA PRO A 79 -5.464 8.301 3.586 1.00 62.41 C ATOM 598 C PRO A 79 -4.466 9.206 2.869 1.00 23.40 C ATOM 599 O PRO A 79 -4.538 9.386 1.653 1.00 23.21 O ATOM 600 CB PRO A 79 -6.625 9.125 4.147 1.00 22.31 C ATOM 601 CG PRO A 79 -6.245 9.403 5.561 1.00 31.30 C ATOM 602 CD PRO A 79 -5.466 8.203 6.022 1.00 13.13 C ATOM 0 HA PRO A 79 -5.767 7.565 2.841 1.00 62.41 H new ATOM 0 HB2 PRO A 79 -6.762 10.049 3.585 1.00 22.31 H new ATOM 0 HB3 PRO A 79 -7.564 8.575 4.090 1.00 22.31 H new ATOM 0 HG2 PRO A 79 -5.644 10.310 5.633 1.00 31.30 H new ATOM 0 HG3 PRO A 79 -7.129 9.556 6.180 1.00 31.30 H new ATOM 0 HD2 PRO A 79 -4.692 8.478 6.738 1.00 13.13 H new ATOM 0 HD3 PRO A 79 -6.108 7.471 6.512 1.00 13.13 H new ATOM 607 N LEU A 80 -3.537 9.773 3.630 1.00 13.22 N ATOM 608 CA LEU A 80 -2.523 10.659 3.067 1.00 10.23 C ATOM 609 C LEU A 80 -1.865 10.027 1.845 1.00 42.22 C ATOM 610 O LEU A 80 -2.094 10.454 0.712 1.00 25.11 O ATOM 611 CB LEU A 80 -1.461 10.985 4.120 1.00 50.24 C ATOM 612 CG LEU A 80 -1.671 12.280 4.906 1.00 41.03 C ATOM 613 CD1 LEU A 80 -2.917 12.182 5.773 1.00 2.01 C ATOM 614 CD2 LEU A 80 -0.450 12.590 5.757 1.00 23.44 C ATOM 0 H LEU A 80 -3.464 9.636 4.638 1.00 13.22 H new ATOM 0 HA LEU A 80 -3.014 11.581 2.756 1.00 10.23 H new ATOM 0 HB2 LEU A 80 -1.414 10.157 4.828 1.00 50.24 H new ATOM 0 HB3 LEU A 80 -0.491 11.037 3.625 1.00 50.24 H new ATOM 0 HG LEU A 80 -1.811 13.095 4.196 1.00 41.03 H new ATOM 0 HD11 LEU A 80 -3.050 13.112 6.325 1.00 2.01 H new ATOM 0 HD12 LEU A 80 -3.787 12.007 5.141 1.00 2.01 H new ATOM 0 HD13 LEU A 80 -2.807 11.356 6.476 1.00 2.01 H new ATOM 0 HD21 LEU A 80 -0.617 13.515 6.309 1.00 23.44 H new ATOM 0 HD22 LEU A 80 -0.279 11.774 6.459 1.00 23.44 H new ATOM 0 HD23 LEU A 80 0.422 12.704 5.114 1.00 23.44 H new ATOM 625 N THR A 81 -1.049 9.004 2.080 1.00 42.12 N ATOM 626 CA THR A 81 -0.359 8.313 0.998 1.00 1.21 C ATOM 627 C THR A 81 -0.811 6.861 0.898 1.00 50.41 C ATOM 628 O THR A 81 -1.059 6.351 -0.194 1.00 3.24 O ATOM 629 CB THR A 81 1.168 8.351 1.191 1.00 21.22 C ATOM 630 OG1 THR A 81 1.800 7.449 0.276 1.00 72.23 O ATOM 631 CG2 THR A 81 1.543 7.978 2.618 1.00 60.42 C ATOM 0 H THR A 81 -0.850 8.636 3.010 1.00 42.12 H new ATOM 0 HA THR A 81 -0.614 8.835 0.076 1.00 1.21 H new ATOM 0 HB THR A 81 1.511 9.367 0.995 1.00 21.22 H new ATOM 0 HG1 THR A 81 2.771 7.480 0.404 1.00 72.23 H new ATOM 0 HG21 THR A 81 2.627 8.012 2.730 1.00 60.42 H new ATOM 0 HG22 THR A 81 1.084 8.683 3.311 1.00 60.42 H new ATOM 0 HG23 THR A 81 1.187 6.971 2.836 1.00 60.42 H new ATOM 639 N GLY A 82 -0.917 6.198 2.046 1.00 32.05 N ATOM 640 CA GLY A 82 -1.340 4.809 2.065 1.00 32.41 C ATOM 641 C GLY A 82 -0.483 3.955 2.977 1.00 44.50 C ATOM 642 O GLY A 82 -0.087 2.848 2.613 1.00 73.13 O ATOM 0 H GLY A 82 -0.718 6.598 2.963 1.00 32.05 H new ATOM 0 HA2 GLY A 82 -2.379 4.753 2.390 1.00 32.41 H new ATOM 0 HA3 GLY A 82 -1.301 4.407 1.053 1.00 32.41 H new ATOM 646 N ALA A 83 -0.194 4.469 4.169 1.00 53.24 N ATOM 647 CA ALA A 83 0.620 3.746 5.136 1.00 15.32 C ATOM 648 C ALA A 83 0.089 2.333 5.354 1.00 41.23 C ATOM 649 O ALA A 83 -1.008 1.997 4.908 1.00 61.33 O ATOM 650 CB ALA A 83 0.670 4.502 6.456 1.00 61.10 C ATOM 0 H ALA A 83 -0.513 5.384 4.487 1.00 53.24 H new ATOM 0 HA ALA A 83 1.631 3.669 4.736 1.00 15.32 H new ATOM 0 HB1 ALA A 83 1.282 3.949 7.169 1.00 61.10 H new ATOM 0 HB2 ALA A 83 1.104 5.489 6.294 1.00 61.10 H new ATOM 0 HB3 ALA A 83 -0.340 4.610 6.852 1.00 61.10 H new ATOM 656 N GLN A 84 0.875 1.510 6.042 1.00 41.24 N ATOM 657 CA GLN A 84 0.482 0.133 6.316 1.00 11.34 C ATOM 658 C GLN A 84 0.808 -0.249 7.757 1.00 10.11 C ATOM 659 O GLN A 84 1.941 -0.086 8.211 1.00 32.11 O ATOM 660 CB GLN A 84 1.186 -0.823 5.352 1.00 52.15 C ATOM 661 CG GLN A 84 2.657 -1.034 5.669 1.00 63.42 C ATOM 662 CD GLN A 84 3.452 0.258 5.637 1.00 14.54 C ATOM 663 OE1 GLN A 84 3.426 0.992 4.649 1.00 3.55 O ATOM 664 NE2 GLN A 84 4.164 0.540 6.722 1.00 60.33 N ATOM 0 H GLN A 84 1.786 1.773 6.419 1.00 41.24 H new ATOM 0 HA GLN A 84 -0.596 0.054 6.172 1.00 11.34 H new ATOM 0 HB2 GLN A 84 0.677 -1.787 5.373 1.00 52.15 H new ATOM 0 HB3 GLN A 84 1.094 -0.436 4.337 1.00 52.15 H new ATOM 0 HG2 GLN A 84 2.751 -1.490 6.655 1.00 63.42 H new ATOM 0 HG3 GLN A 84 3.082 -1.736 4.952 1.00 63.42 H new ATOM 0 HE21 GLN A 84 4.155 -0.098 7.518 1.00 60.33 H new ATOM 0 HE22 GLN A 84 4.719 1.395 6.760 1.00 60.33 H new ATOM 671 N ILE A 85 -0.191 -0.758 8.470 1.00 45.04 N ATOM 672 CA ILE A 85 -0.009 -1.162 9.858 1.00 1.51 C ATOM 673 C ILE A 85 -0.988 -2.269 10.240 1.00 33.35 C ATOM 674 O ILE A 85 -2.121 -2.301 9.762 1.00 34.23 O ATOM 675 CB ILE A 85 -0.194 0.026 10.821 1.00 42.14 C ATOM 676 CG1 ILE A 85 0.926 1.049 10.624 1.00 11.32 C ATOM 677 CG2 ILE A 85 -0.229 -0.461 12.262 1.00 64.42 C ATOM 678 CD1 ILE A 85 0.811 2.253 11.532 1.00 1.20 C ATOM 0 H ILE A 85 -1.134 -0.900 8.109 1.00 45.04 H new ATOM 0 HA ILE A 85 1.012 -1.534 9.947 1.00 1.51 H new ATOM 0 HB ILE A 85 -1.145 0.510 10.599 1.00 42.14 H new ATOM 0 HG12 ILE A 85 1.886 0.563 10.798 1.00 11.32 H new ATOM 0 HG13 ILE A 85 0.922 1.384 9.587 1.00 11.32 H new ATOM 0 HG21 ILE A 85 -0.360 0.390 12.931 1.00 64.42 H new ATOM 0 HG22 ILE A 85 -1.059 -1.155 12.391 1.00 64.42 H new ATOM 0 HG23 ILE A 85 0.707 -0.967 12.498 1.00 64.42 H new ATOM 0 HD11 ILE A 85 1.638 2.936 11.337 1.00 1.20 H new ATOM 0 HD12 ILE A 85 -0.133 2.763 11.342 1.00 1.20 H new ATOM 0 HD13 ILE A 85 0.845 1.929 12.572 1.00 1.20 H new ATOM 689 N GLU A 86 -0.540 -3.172 11.108 1.00 40.25 N ATOM 690 CA GLU A 86 -1.377 -4.280 11.554 1.00 44.53 C ATOM 691 C GLU A 86 -2.262 -3.856 12.723 1.00 10.22 C ATOM 692 O GLU A 86 -1.783 -3.671 13.842 1.00 60.42 O ATOM 693 CB GLU A 86 -0.510 -5.471 11.964 1.00 34.32 C ATOM 694 CG GLU A 86 0.345 -6.019 10.833 1.00 72.22 C ATOM 695 CD GLU A 86 -0.135 -7.371 10.341 1.00 34.11 C ATOM 696 OE1 GLU A 86 -0.140 -7.586 9.110 1.00 12.43 O ATOM 697 OE2 GLU A 86 -0.504 -8.213 11.186 1.00 63.42 O ATOM 0 H GLU A 86 0.395 -3.158 11.515 1.00 40.25 H new ATOM 0 HA GLU A 86 -2.017 -4.575 10.723 1.00 44.53 H new ATOM 0 HB2 GLU A 86 0.139 -5.171 12.787 1.00 34.32 H new ATOM 0 HB3 GLU A 86 -1.154 -6.266 12.340 1.00 34.32 H new ATOM 0 HG2 GLU A 86 0.340 -5.312 10.003 1.00 72.22 H new ATOM 0 HG3 GLU A 86 1.377 -6.105 11.172 1.00 72.22 H new ATOM 702 N GLU A 87 -3.555 -3.704 12.455 1.00 4.30 N ATOM 703 CA GLU A 87 -4.506 -3.300 13.484 1.00 52.42 C ATOM 704 C GLU A 87 -5.437 -4.453 13.847 1.00 53.23 C ATOM 705 O GLU A 87 -5.670 -5.354 13.041 1.00 75.51 O ATOM 706 CB GLU A 87 -5.325 -2.098 13.010 1.00 13.23 C ATOM 707 CG GLU A 87 -4.982 -0.805 13.730 1.00 1.23 C ATOM 708 CD GLU A 87 -6.202 0.050 14.007 1.00 41.11 C ATOM 709 OE1 GLU A 87 -7.231 -0.508 14.442 1.00 42.25 O ATOM 710 OE2 GLU A 87 -6.130 1.278 13.788 1.00 0.01 O ATOM 0 H GLU A 87 -3.968 -3.854 11.535 1.00 4.30 H new ATOM 0 HA GLU A 87 -3.942 -3.018 14.373 1.00 52.42 H new ATOM 0 HB2 GLU A 87 -5.167 -1.961 11.940 1.00 13.23 H new ATOM 0 HB3 GLU A 87 -6.384 -2.313 13.151 1.00 13.23 H new ATOM 0 HG2 GLU A 87 -4.486 -1.039 14.672 1.00 1.23 H new ATOM 0 HG3 GLU A 87 -4.273 -0.236 13.129 1.00 1.23 H new ATOM 715 N ASN A 88 -5.968 -4.418 15.065 1.00 33.44 N ATOM 716 CA ASN A 88 -6.873 -5.460 15.535 1.00 20.21 C ATOM 717 C ASN A 88 -8.105 -4.852 16.197 1.00 51.55 C ATOM 718 O ASN A 88 -8.293 -3.636 16.185 1.00 23.42 O ATOM 719 CB ASN A 88 -6.154 -6.383 16.521 1.00 34.32 C ATOM 720 CG ASN A 88 -5.600 -5.632 17.716 1.00 1.33 C ATOM 721 OD1 ASN A 88 -6.161 -5.686 18.811 1.00 63.11 O ATOM 722 ND2 ASN A 88 -4.492 -4.929 17.512 1.00 43.33 N ATOM 0 H ASN A 88 -5.787 -3.679 15.744 1.00 33.44 H new ATOM 0 HA ASN A 88 -7.196 -6.042 14.672 1.00 20.21 H new ATOM 0 HB2 ASN A 88 -6.846 -7.151 16.867 1.00 34.32 H new ATOM 0 HB3 ASN A 88 -5.340 -6.895 16.008 1.00 34.32 H new ATOM 0 HD21 ASN A 88 -4.072 -4.405 18.280 1.00 43.33 H new ATOM 0 HD22 ASN A 88 -4.061 -4.913 16.588 1.00 43.33 H new ATOM 728 N VAL A 89 -8.943 -5.707 16.775 1.00 55.41 N ATOM 729 CA VAL A 89 -10.156 -5.255 17.445 1.00 65.43 C ATOM 730 C VAL A 89 -9.829 -4.317 18.601 1.00 53.31 C ATOM 731 O VAL A 89 -10.565 -3.367 18.870 1.00 31.34 O ATOM 732 CB VAL A 89 -10.980 -6.443 17.977 1.00 4.35 C ATOM 733 CG1 VAL A 89 -12.301 -5.960 18.558 1.00 75.44 C ATOM 734 CG2 VAL A 89 -11.214 -7.465 16.876 1.00 13.21 C ATOM 0 H VAL A 89 -8.804 -6.717 16.792 1.00 55.41 H new ATOM 0 HA VAL A 89 -10.746 -4.718 16.702 1.00 65.43 H new ATOM 0 HB VAL A 89 -10.415 -6.926 18.774 1.00 4.35 H new ATOM 0 HG11 VAL A 89 -12.869 -6.813 18.929 1.00 75.44 H new ATOM 0 HG12 VAL A 89 -12.107 -5.269 19.379 1.00 75.44 H new ATOM 0 HG13 VAL A 89 -12.875 -5.451 17.783 1.00 75.44 H new ATOM 0 HG21 VAL A 89 -11.798 -8.297 17.270 1.00 13.21 H new ATOM 0 HG22 VAL A 89 -11.757 -6.997 16.055 1.00 13.21 H new ATOM 0 HG23 VAL A 89 -10.255 -7.834 16.513 1.00 13.21 H new ATOM 744 N TYR A 90 -8.722 -4.591 19.282 1.00 72.30 N ATOM 745 CA TYR A 90 -8.298 -3.773 20.412 1.00 33.34 C ATOM 746 C TYR A 90 -7.030 -2.994 20.075 1.00 12.13 C ATOM 747 O TYR A 90 -6.168 -2.790 20.930 1.00 74.13 O ATOM 748 CB TYR A 90 -8.060 -4.650 21.642 1.00 32.51 C ATOM 749 CG TYR A 90 -9.154 -5.663 21.884 1.00 3.44 C ATOM 750 CD1 TYR A 90 -10.237 -5.363 22.701 1.00 44.44 C ATOM 751 CD2 TYR A 90 -9.106 -6.922 21.298 1.00 31.34 C ATOM 752 CE1 TYR A 90 -11.241 -6.286 22.926 1.00 4.11 C ATOM 753 CE2 TYR A 90 -10.105 -7.850 21.516 1.00 14.44 C ATOM 754 CZ TYR A 90 -11.170 -7.529 22.331 1.00 21.02 C ATOM 755 OH TYR A 90 -12.166 -8.451 22.553 1.00 52.32 O ATOM 0 H TYR A 90 -8.102 -5.373 19.071 1.00 72.30 H new ATOM 0 HA TYR A 90 -9.093 -3.060 20.631 1.00 33.34 H new ATOM 0 HB2 TYR A 90 -7.111 -5.173 21.526 1.00 32.51 H new ATOM 0 HB3 TYR A 90 -7.967 -4.011 22.520 1.00 32.51 H new ATOM 0 HD1 TYR A 90 -10.295 -4.391 23.169 1.00 44.44 H new ATOM 0 HD2 TYR A 90 -8.273 -7.179 20.661 1.00 31.34 H new ATOM 0 HE1 TYR A 90 -12.076 -6.036 23.564 1.00 4.11 H new ATOM 0 HE2 TYR A 90 -10.052 -8.823 21.050 1.00 14.44 H new ATOM 0 HH TYR A 90 -11.965 -9.274 22.060 1.00 52.32 H new ATOM 764 N ALA A 91 -6.925 -2.561 18.823 1.00 21.44 N ATOM 765 CA ALA A 91 -5.765 -1.802 18.373 1.00 61.44 C ATOM 766 C ALA A 91 -5.585 -0.533 19.197 1.00 31.24 C ATOM 767 O ALA A 91 -6.511 0.265 19.337 1.00 40.24 O ATOM 768 CB ALA A 91 -5.900 -1.460 16.896 1.00 32.41 C ATOM 0 H ALA A 91 -7.629 -2.723 18.103 1.00 21.44 H new ATOM 0 HA ALA A 91 -4.880 -2.422 18.513 1.00 61.44 H new ATOM 0 HB1 ALA A 91 -5.027 -0.893 16.573 1.00 32.41 H new ATOM 0 HB2 ALA A 91 -5.971 -2.379 16.315 1.00 32.41 H new ATOM 0 HB3 ALA A 91 -6.798 -0.862 16.742 1.00 32.41 H new ATOM 774 N ASP A 92 -4.387 -0.351 19.742 1.00 11.52 N ATOM 775 CA ASP A 92 -4.085 0.822 20.554 1.00 11.42 C ATOM 776 C ASP A 92 -3.259 1.832 19.763 1.00 44.44 C ATOM 777 O ASP A 92 -2.306 1.466 19.076 1.00 60.40 O ATOM 778 CB ASP A 92 -3.334 0.412 21.821 1.00 0.33 C ATOM 779 CG ASP A 92 -4.192 -0.411 22.762 1.00 2.14 C ATOM 780 OD1 ASP A 92 -5.005 0.186 23.499 1.00 53.12 O ATOM 781 OD2 ASP A 92 -4.049 -1.651 22.763 1.00 41.24 O ATOM 0 H ASP A 92 -3.609 -1.002 19.636 1.00 11.52 H new ATOM 0 HA ASP A 92 -5.028 1.291 20.836 1.00 11.42 H new ATOM 0 HB2 ASP A 92 -2.449 -0.162 21.546 1.00 0.33 H new ATOM 0 HB3 ASP A 92 -2.986 1.306 22.339 1.00 0.33 H new ATOM 785 N ILE A 93 -3.634 3.102 19.865 1.00 64.03 N ATOM 786 CA ILE A 93 -2.929 4.165 19.158 1.00 3.53 C ATOM 787 C ILE A 93 -1.429 4.102 19.428 1.00 74.02 C ATOM 788 O ILE A 93 -0.617 4.362 18.539 1.00 42.35 O ATOM 789 CB ILE A 93 -3.454 5.555 19.564 1.00 33.55 C ATOM 790 CG1 ILE A 93 -4.951 5.665 19.270 1.00 74.44 C ATOM 791 CG2 ILE A 93 -2.683 6.646 18.835 1.00 14.44 C ATOM 792 CD1 ILE A 93 -5.286 5.562 17.798 1.00 0.42 C ATOM 0 H ILE A 93 -4.421 3.421 20.430 1.00 64.03 H new ATOM 0 HA ILE A 93 -3.112 4.013 18.094 1.00 3.53 H new ATOM 0 HB ILE A 93 -3.304 5.685 20.636 1.00 33.55 H new ATOM 0 HG12 ILE A 93 -5.478 4.879 19.810 1.00 74.44 H new ATOM 0 HG13 ILE A 93 -5.319 6.617 19.653 1.00 74.44 H new ATOM 0 HG21 ILE A 93 -3.065 7.622 19.132 1.00 14.44 H new ATOM 0 HG22 ILE A 93 -1.626 6.577 19.091 1.00 14.44 H new ATOM 0 HG23 ILE A 93 -2.805 6.521 17.759 1.00 14.44 H new ATOM 0 HD11 ILE A 93 -6.364 5.648 17.663 1.00 0.42 H new ATOM 0 HD12 ILE A 93 -4.787 6.364 17.254 1.00 0.42 H new ATOM 0 HD13 ILE A 93 -4.948 4.599 17.415 1.00 0.42 H new ATOM 803 N ARG A 94 -1.068 3.753 20.658 1.00 63.55 N ATOM 804 CA ARG A 94 0.335 3.656 21.044 1.00 52.14 C ATOM 805 C ARG A 94 1.063 2.627 20.185 1.00 35.32 C ATOM 806 O ARG A 94 2.227 2.813 19.828 1.00 20.24 O ATOM 807 CB ARG A 94 0.454 3.279 22.522 1.00 63.32 C ATOM 808 CG ARG A 94 0.503 4.478 23.454 1.00 45.43 C ATOM 809 CD ARG A 94 1.860 5.163 23.410 1.00 51.01 C ATOM 810 NE ARG A 94 2.847 4.478 24.241 1.00 43.24 N ATOM 811 CZ ARG A 94 4.046 4.975 24.519 1.00 44.14 C ATOM 812 NH1 ARG A 94 4.405 6.157 24.036 1.00 4.24 N ATOM 813 NH2 ARG A 94 4.888 4.291 25.283 1.00 31.41 N ATOM 0 H ARG A 94 -1.727 3.533 21.405 1.00 63.55 H new ATOM 0 HA ARG A 94 0.799 4.630 20.887 1.00 52.14 H new ATOM 0 HB2 ARG A 94 -0.393 2.650 22.797 1.00 63.32 H new ATOM 0 HB3 ARG A 94 1.355 2.682 22.665 1.00 63.32 H new ATOM 0 HG2 ARG A 94 -0.274 5.189 23.174 1.00 45.43 H new ATOM 0 HG3 ARG A 94 0.289 4.157 24.473 1.00 45.43 H new ATOM 0 HD2 ARG A 94 2.215 5.198 22.380 1.00 51.01 H new ATOM 0 HD3 ARG A 94 1.756 6.195 23.747 1.00 51.01 H new ATOM 0 HE ARG A 94 2.601 3.567 24.629 1.00 43.24 H new ATOM 0 HH11 ARG A 94 3.759 6.686 23.450 1.00 4.24 H new ATOM 0 HH12 ARG A 94 5.327 6.537 24.251 1.00 4.24 H new ATOM 0 HH21 ARG A 94 4.614 3.382 25.657 1.00 31.41 H new ATOM 0 HH22 ARG A 94 5.809 4.674 25.496 1.00 31.41 H new ATOM 824 N ASP A 95 0.373 1.541 19.858 1.00 42.15 N ATOM 825 CA ASP A 95 0.954 0.482 19.040 1.00 52.31 C ATOM 826 C ASP A 95 1.056 0.916 17.582 1.00 74.04 C ATOM 827 O ASP A 95 2.010 0.569 16.886 1.00 35.44 O ATOM 828 CB ASP A 95 0.116 -0.793 19.148 1.00 1.43 C ATOM 829 CG ASP A 95 0.587 -1.702 20.267 1.00 42.54 C ATOM 830 OD1 ASP A 95 1.815 -1.872 20.415 1.00 22.20 O ATOM 831 OD2 ASP A 95 -0.273 -2.244 20.993 1.00 21.41 O ATOM 0 H ASP A 95 -0.590 1.370 20.147 1.00 42.15 H new ATOM 0 HA ASP A 95 1.959 0.280 19.411 1.00 52.31 H new ATOM 0 HB2 ASP A 95 -0.927 -0.526 19.316 1.00 1.43 H new ATOM 0 HB3 ASP A 95 0.158 -1.334 18.202 1.00 1.43 H new ATOM 835 N ILE A 96 0.066 1.674 17.125 1.00 71.25 N ATOM 836 CA ILE A 96 0.045 2.155 15.748 1.00 64.23 C ATOM 837 C ILE A 96 1.131 3.200 15.514 1.00 44.33 C ATOM 838 O ILE A 96 1.715 3.271 14.433 1.00 42.32 O ATOM 839 CB ILE A 96 -1.323 2.763 15.385 1.00 11.21 C ATOM 840 CG1 ILE A 96 -2.432 1.726 15.574 1.00 70.45 C ATOM 841 CG2 ILE A 96 -1.311 3.278 13.953 1.00 11.44 C ATOM 842 CD1 ILE A 96 -3.811 2.246 15.232 1.00 70.42 C ATOM 0 H ILE A 96 -0.732 1.969 17.687 1.00 71.25 H new ATOM 0 HA ILE A 96 0.231 1.292 15.109 1.00 64.23 H new ATOM 0 HB ILE A 96 -1.519 3.603 16.051 1.00 11.21 H new ATOM 0 HG12 ILE A 96 -2.216 0.857 14.952 1.00 70.45 H new ATOM 0 HG13 ILE A 96 -2.427 1.386 16.610 1.00 70.45 H new ATOM 0 HG21 ILE A 96 -2.285 3.705 13.712 1.00 11.44 H new ATOM 0 HG22 ILE A 96 -0.543 4.044 13.848 1.00 11.44 H new ATOM 0 HG23 ILE A 96 -1.097 2.454 13.272 1.00 11.44 H new ATOM 0 HD11 ILE A 96 -4.547 1.457 15.389 1.00 70.42 H new ATOM 0 HD12 ILE A 96 -4.048 3.096 15.871 1.00 70.42 H new ATOM 0 HD13 ILE A 96 -3.833 2.560 14.188 1.00 70.42 H new ATOM 853 N GLN A 97 1.397 4.007 16.536 1.00 64.45 N ATOM 854 CA GLN A 97 2.414 5.048 16.441 1.00 24.21 C ATOM 855 C GLN A 97 3.788 4.443 16.179 1.00 34.43 C ATOM 856 O GLN A 97 4.603 5.019 15.458 1.00 60.11 O ATOM 857 CB GLN A 97 2.446 5.878 17.726 1.00 0.33 C ATOM 858 CG GLN A 97 3.358 7.091 17.644 1.00 63.22 C ATOM 859 CD GLN A 97 3.768 7.606 19.009 1.00 2.24 C ATOM 860 OE1 GLN A 97 4.644 7.037 19.663 1.00 43.03 O ATOM 861 NE2 GLN A 97 3.137 8.688 19.449 1.00 5.10 N ATOM 0 H GLN A 97 0.923 3.960 17.438 1.00 64.45 H new ATOM 0 HA GLN A 97 2.157 5.697 15.604 1.00 24.21 H new ATOM 0 HB2 GLN A 97 1.434 6.210 17.960 1.00 0.33 H new ATOM 0 HB3 GLN A 97 2.772 5.244 18.550 1.00 0.33 H new ATOM 0 HG2 GLN A 97 4.251 6.832 17.075 1.00 63.22 H new ATOM 0 HG3 GLN A 97 2.851 7.886 17.097 1.00 63.22 H new ATOM 0 HE21 GLN A 97 2.418 9.128 18.875 1.00 5.10 H new ATOM 0 HE22 GLN A 97 3.371 9.080 20.361 1.00 5.10 H new ATOM 868 N GLU A 98 4.041 3.279 16.769 1.00 41.23 N ATOM 869 CA GLU A 98 5.318 2.597 16.600 1.00 32.31 C ATOM 870 C GLU A 98 5.666 2.454 15.120 1.00 4.04 C ATOM 871 O GLU A 98 6.684 2.970 14.658 1.00 24.13 O ATOM 872 CB GLU A 98 5.277 1.217 17.260 1.00 31.25 C ATOM 873 CG GLU A 98 5.845 1.201 18.670 1.00 32.52 C ATOM 874 CD GLU A 98 4.984 1.966 19.655 1.00 63.42 C ATOM 875 OE1 GLU A 98 4.460 1.337 20.598 1.00 14.11 O ATOM 876 OE2 GLU A 98 4.834 3.194 19.484 1.00 23.21 O ATOM 0 H GLU A 98 3.378 2.789 17.369 1.00 41.23 H new ATOM 0 HA GLU A 98 6.088 3.199 17.082 1.00 32.31 H new ATOM 0 HB2 GLU A 98 4.245 0.868 17.289 1.00 31.25 H new ATOM 0 HB3 GLU A 98 5.835 0.512 16.644 1.00 31.25 H new ATOM 0 HG2 GLU A 98 5.945 0.169 19.006 1.00 32.52 H new ATOM 0 HG3 GLU A 98 6.847 1.631 18.659 1.00 32.52 H new ATOM 881 N ARG A 99 4.814 1.748 14.383 1.00 23.24 N ATOM 882 CA ARG A 99 5.032 1.536 12.958 1.00 3.22 C ATOM 883 C ARG A 99 5.038 2.863 12.205 1.00 74.35 C ATOM 884 O ARG A 99 5.788 3.039 11.244 1.00 64.31 O ATOM 885 CB ARG A 99 3.949 0.618 12.386 1.00 0.42 C ATOM 886 CG ARG A 99 4.009 -0.803 12.924 1.00 21.24 C ATOM 887 CD ARG A 99 3.348 -1.787 11.971 1.00 3.23 C ATOM 888 NE ARG A 99 4.219 -2.133 10.852 1.00 75.54 N ATOM 889 CZ ARG A 99 4.040 -3.204 10.086 1.00 62.42 C ATOM 890 NH1 ARG A 99 3.027 -4.027 10.318 1.00 35.42 N ATOM 891 NH2 ARG A 99 4.874 -3.451 9.084 1.00 72.31 N ATOM 0 H ARG A 99 3.967 1.314 14.750 1.00 23.24 H new ATOM 0 HA ARG A 99 6.005 1.062 12.832 1.00 3.22 H new ATOM 0 HB2 ARG A 99 2.970 1.041 12.610 1.00 0.42 H new ATOM 0 HB3 ARG A 99 4.044 0.591 11.300 1.00 0.42 H new ATOM 0 HG2 ARG A 99 5.049 -1.090 13.082 1.00 21.24 H new ATOM 0 HG3 ARG A 99 3.515 -0.847 13.895 1.00 21.24 H new ATOM 0 HD2 ARG A 99 3.079 -2.693 12.514 1.00 3.23 H new ATOM 0 HD3 ARG A 99 2.422 -1.356 11.590 1.00 3.23 H new ATOM 0 HE ARG A 99 5.008 -1.520 10.647 1.00 75.54 H new ATOM 0 HH11 ARG A 99 2.383 -3.839 11.086 1.00 35.42 H new ATOM 0 HH12 ARG A 99 2.892 -4.848 9.728 1.00 35.42 H new ATOM 0 HH21 ARG A 99 5.653 -2.819 8.901 1.00 72.31 H new ATOM 0 HH22 ARG A 99 4.736 -4.273 8.496 1.00 72.31 H new ATOM 902 N PHE A 100 4.197 3.791 12.647 1.00 64.44 N ATOM 903 CA PHE A 100 4.104 5.102 12.014 1.00 62.02 C ATOM 904 C PHE A 100 5.466 5.790 11.984 1.00 12.22 C ATOM 905 O PHE A 100 5.786 6.519 11.045 1.00 5.54 O ATOM 906 CB PHE A 100 3.093 5.980 12.755 1.00 32.03 C ATOM 907 CG PHE A 100 2.883 7.323 12.116 1.00 14.14 C ATOM 908 CD1 PHE A 100 2.353 7.422 10.839 1.00 1.13 C ATOM 909 CD2 PHE A 100 3.216 8.486 12.791 1.00 21.44 C ATOM 910 CE1 PHE A 100 2.158 8.657 10.249 1.00 14.21 C ATOM 911 CE2 PHE A 100 3.022 9.723 12.206 1.00 20.04 C ATOM 912 CZ PHE A 100 2.494 9.808 10.933 1.00 34.40 C ATOM 0 H PHE A 100 3.570 3.660 13.441 1.00 64.44 H new ATOM 0 HA PHE A 100 3.766 4.958 10.988 1.00 62.02 H new ATOM 0 HB2 PHE A 100 2.138 5.457 12.805 1.00 32.03 H new ATOM 0 HB3 PHE A 100 3.432 6.124 13.781 1.00 32.03 H new ATOM 0 HD1 PHE A 100 2.090 6.525 10.299 1.00 1.13 H new ATOM 0 HD2 PHE A 100 3.632 8.425 13.786 1.00 21.44 H new ATOM 0 HE1 PHE A 100 1.743 8.721 9.254 1.00 14.21 H new ATOM 0 HE2 PHE A 100 3.283 10.622 12.744 1.00 20.04 H new ATOM 0 HZ PHE A 100 2.344 10.774 10.473 1.00 34.40 H new ATOM 921 N SER A 101 6.265 5.552 13.020 1.00 51.33 N ATOM 922 CA SER A 101 7.592 6.151 13.116 1.00 44.44 C ATOM 923 C SER A 101 8.389 5.912 11.837 1.00 23.13 C ATOM 924 O SER A 101 9.083 6.805 11.352 1.00 13.31 O ATOM 925 CB SER A 101 8.347 5.578 14.316 1.00 51.41 C ATOM 926 OG SER A 101 9.512 6.335 14.595 1.00 62.34 O ATOM 0 H SER A 101 6.017 4.949 13.804 1.00 51.33 H new ATOM 0 HA SER A 101 7.470 7.226 13.252 1.00 44.44 H new ATOM 0 HB2 SER A 101 7.696 5.572 15.190 1.00 51.41 H new ATOM 0 HB3 SER A 101 8.622 4.542 14.116 1.00 51.41 H new ATOM 0 HG SER A 101 9.976 5.949 15.367 1.00 62.34 H new ATOM 931 N GLU A 102 8.283 4.702 11.298 1.00 52.41 N ATOM 932 CA GLU A 102 8.995 4.345 10.077 1.00 1.11 C ATOM 933 C GLU A 102 8.617 5.283 8.933 1.00 51.41 C ATOM 934 O GLU A 102 9.469 5.974 8.375 1.00 22.31 O ATOM 935 CB GLU A 102 8.690 2.897 9.686 1.00 64.52 C ATOM 936 CG GLU A 102 9.666 1.891 10.270 1.00 20.25 C ATOM 937 CD GLU A 102 11.033 1.957 9.618 1.00 75.30 C ATOM 938 OE1 GLU A 102 11.175 2.685 8.612 1.00 54.54 O ATOM 939 OE2 GLU A 102 11.960 1.283 10.111 1.00 74.42 O ATOM 0 H GLU A 102 7.711 3.953 11.687 1.00 52.41 H new ATOM 0 HA GLU A 102 10.064 4.444 10.268 1.00 1.11 H new ATOM 0 HB2 GLU A 102 7.682 2.645 10.015 1.00 64.52 H new ATOM 0 HB3 GLU A 102 8.701 2.813 8.599 1.00 64.52 H new ATOM 0 HG2 GLU A 102 9.769 2.070 11.340 1.00 20.25 H new ATOM 0 HG3 GLU A 102 9.260 0.886 10.153 1.00 20.25 H new ATOM 944 N VAL A 103 7.333 5.300 8.590 1.00 41.11 N ATOM 945 CA VAL A 103 6.840 6.152 7.514 1.00 22.13 C ATOM 946 C VAL A 103 7.217 7.610 7.752 1.00 44.31 C ATOM 947 O VAL A 103 7.882 8.233 6.925 1.00 20.21 O ATOM 948 CB VAL A 103 5.311 6.045 7.369 1.00 50.24 C ATOM 949 CG1 VAL A 103 4.811 6.978 6.277 1.00 62.21 C ATOM 950 CG2 VAL A 103 4.902 4.608 7.081 1.00 20.53 C ATOM 0 H VAL A 103 6.615 4.733 9.042 1.00 41.11 H new ATOM 0 HA VAL A 103 7.309 5.804 6.594 1.00 22.13 H new ATOM 0 HB VAL A 103 4.853 6.348 8.311 1.00 50.24 H new ATOM 0 HG11 VAL A 103 3.728 6.888 6.189 1.00 62.21 H new ATOM 0 HG12 VAL A 103 5.071 8.006 6.530 1.00 62.21 H new ATOM 0 HG13 VAL A 103 5.275 6.709 5.328 1.00 62.21 H new ATOM 0 HG21 VAL A 103 3.818 4.551 6.982 1.00 20.53 H new ATOM 0 HG22 VAL A 103 5.369 4.275 6.154 1.00 20.53 H new ATOM 0 HG23 VAL A 103 5.225 3.966 7.901 1.00 20.53 H new ATOM 960 N ARG A 104 6.785 8.149 8.889 1.00 75.44 N ATOM 961 CA ARG A 104 7.076 9.535 9.235 1.00 72.02 C ATOM 962 C ARG A 104 8.570 9.821 9.122 1.00 74.42 C ATOM 963 O ARG A 104 8.976 10.883 8.647 1.00 50.21 O ATOM 964 CB ARG A 104 6.594 9.839 10.654 1.00 3.20 C ATOM 965 CG ARG A 104 6.899 11.257 11.110 1.00 0.13 C ATOM 966 CD ARG A 104 6.652 11.428 12.601 1.00 30.31 C ATOM 967 NE ARG A 104 7.622 10.689 13.405 1.00 45.41 N ATOM 968 CZ ARG A 104 7.491 10.486 14.711 1.00 65.24 C ATOM 969 NH1 ARG A 104 6.436 10.965 15.357 1.00 31.31 N ATOM 970 NH2 ARG A 104 8.416 9.803 15.374 1.00 62.14 N ATOM 0 H ARG A 104 6.233 7.647 9.585 1.00 75.44 H new ATOM 0 HA ARG A 104 6.546 10.178 8.532 1.00 72.02 H new ATOM 0 HB2 ARG A 104 5.518 9.673 10.707 1.00 3.20 H new ATOM 0 HB3 ARG A 104 7.059 9.136 11.345 1.00 3.20 H new ATOM 0 HG2 ARG A 104 7.937 11.498 10.882 1.00 0.13 H new ATOM 0 HG3 ARG A 104 6.279 11.960 10.554 1.00 0.13 H new ATOM 0 HD2 ARG A 104 6.700 12.486 12.857 1.00 30.31 H new ATOM 0 HD3 ARG A 104 5.646 11.087 12.843 1.00 30.31 H new ATOM 0 HE ARG A 104 8.445 10.308 12.938 1.00 45.41 H new ATOM 0 HH11 ARG A 104 5.723 11.490 14.851 1.00 31.31 H new ATOM 0 HH12 ARG A 104 6.338 10.808 16.360 1.00 31.31 H new ATOM 0 HH21 ARG A 104 9.229 9.433 14.881 1.00 62.14 H new ATOM 0 HH22 ARG A 104 8.314 9.648 16.377 1.00 62.14 H new ATOM 981 N LYS A 105 9.386 8.869 9.562 1.00 72.14 N ATOM 982 CA LYS A 105 10.836 9.017 9.509 1.00 42.35 C ATOM 983 C LYS A 105 11.312 9.205 8.072 1.00 13.21 C ATOM 984 O LYS A 105 12.054 10.140 7.770 1.00 11.02 O ATOM 985 CB LYS A 105 11.517 7.794 10.127 1.00 43.21 C ATOM 986 CG LYS A 105 13.031 7.821 10.020 1.00 61.41 C ATOM 987 CD LYS A 105 13.630 8.929 10.871 1.00 63.43 C ATOM 988 CE LYS A 105 13.513 8.617 12.355 1.00 2.22 C ATOM 989 NZ LYS A 105 14.277 7.394 12.726 1.00 33.34 N ATOM 0 H LYS A 105 9.067 7.985 9.960 1.00 72.14 H new ATOM 0 HA LYS A 105 11.107 9.904 10.082 1.00 42.35 H new ATOM 0 HB2 LYS A 105 11.237 7.725 11.178 1.00 43.21 H new ATOM 0 HB3 LYS A 105 11.143 6.895 9.638 1.00 43.21 H new ATOM 0 HG2 LYS A 105 13.436 6.859 10.335 1.00 61.41 H new ATOM 0 HG3 LYS A 105 13.321 7.963 8.979 1.00 61.41 H new ATOM 0 HD2 LYS A 105 14.679 9.064 10.608 1.00 63.43 H new ATOM 0 HD3 LYS A 105 13.123 9.870 10.655 1.00 63.43 H new ATOM 0 HE2 LYS A 105 13.880 9.464 12.934 1.00 2.22 H new ATOM 0 HE3 LYS A 105 12.463 8.483 12.616 1.00 2.22 H new ATOM 0 HZ1 LYS A 105 14.431 7.379 13.754 1.00 33.34 H new ATOM 0 HZ2 LYS A 105 13.739 6.550 12.445 1.00 33.34 H new ATOM 0 HZ3 LYS A 105 15.196 7.397 12.239 1.00 33.34 H new ATOM 999 N LYS A 106 10.879 8.311 7.188 1.00 25.34 N ATOM 1000 CA LYS A 106 11.259 8.380 5.782 1.00 24.11 C ATOM 1001 C LYS A 106 10.788 9.689 5.155 1.00 30.12 C ATOM 1002 O LYS A 106 11.468 10.257 4.301 1.00 24.44 O ATOM 1003 CB LYS A 106 10.669 7.194 5.015 1.00 2.44 C ATOM 1004 CG LYS A 106 11.361 5.875 5.311 1.00 72.30 C ATOM 1005 CD LYS A 106 12.566 5.663 4.410 1.00 54.31 C ATOM 1006 CE LYS A 106 12.167 5.033 3.085 1.00 52.24 C ATOM 1007 NZ LYS A 106 11.760 3.610 3.247 1.00 35.31 N ATOM 0 H LYS A 106 10.265 7.531 7.421 1.00 25.34 H new ATOM 0 HA LYS A 106 12.347 8.339 5.722 1.00 24.11 H new ATOM 0 HB2 LYS A 106 9.611 7.103 5.261 1.00 2.44 H new ATOM 0 HB3 LYS A 106 10.732 7.396 3.946 1.00 2.44 H new ATOM 0 HG2 LYS A 106 11.677 5.855 6.354 1.00 72.30 H new ATOM 0 HG3 LYS A 106 10.656 5.055 5.176 1.00 72.30 H new ATOM 0 HD2 LYS A 106 13.057 6.619 4.226 1.00 54.31 H new ATOM 0 HD3 LYS A 106 13.291 5.024 4.914 1.00 54.31 H new ATOM 0 HE2 LYS A 106 11.344 5.598 2.647 1.00 52.24 H new ATOM 0 HE3 LYS A 106 13.002 5.095 2.388 1.00 52.24 H new ATOM 0 HZ1 LYS A 106 11.807 3.129 2.326 1.00 35.31 H new ATOM 0 HZ2 LYS A 106 12.402 3.140 3.917 1.00 35.31 H new ATOM 0 HZ3 LYS A 106 10.787 3.567 3.611 1.00 35.31 H new ATOM 1017 N MET A 107 9.623 10.161 5.585 1.00 3.13 N ATOM 1018 CA MET A 107 9.064 11.404 5.066 1.00 33.24 C ATOM 1019 C MET A 107 9.964 12.588 5.407 1.00 23.11 C ATOM 1020 O MET A 107 10.425 13.306 4.519 1.00 54.43 O ATOM 1021 CB MET A 107 7.663 11.634 5.634 1.00 63.00 C ATOM 1022 CG MET A 107 6.626 10.652 5.111 1.00 62.41 C ATOM 1023 SD MET A 107 5.977 11.124 3.496 1.00 2.44 S ATOM 1024 CE MET A 107 5.606 9.516 2.799 1.00 21.14 C ATOM 0 H MET A 107 9.048 9.702 6.291 1.00 3.13 H new ATOM 0 HA MET A 107 8.999 11.319 3.981 1.00 33.24 H new ATOM 0 HB2 MET A 107 7.704 11.562 6.721 1.00 63.00 H new ATOM 0 HB3 MET A 107 7.344 12.648 5.394 1.00 63.00 H new ATOM 0 HG2 MET A 107 7.072 9.660 5.043 1.00 62.41 H new ATOM 0 HG3 MET A 107 5.804 10.584 5.823 1.00 62.41 H new ATOM 0 HE1 MET A 107 5.195 9.640 1.797 1.00 21.14 H new ATOM 0 HE2 MET A 107 6.519 8.923 2.746 1.00 21.14 H new ATOM 0 HE3 MET A 107 4.878 9.005 3.429 1.00 21.14 H new ATOM 1032 N VAL A 108 10.209 12.787 6.698 1.00 34.35 N ATOM 1033 CA VAL A 108 11.055 13.884 7.155 1.00 15.41 C ATOM 1034 C VAL A 108 12.479 13.734 6.633 1.00 14.44 C ATOM 1035 O VAL A 108 13.145 14.721 6.327 1.00 61.13 O ATOM 1036 CB VAL A 108 11.089 13.963 8.693 1.00 41.14 C ATOM 1037 CG1 VAL A 108 11.636 12.672 9.282 1.00 14.20 C ATOM 1038 CG2 VAL A 108 11.914 15.158 9.147 1.00 53.03 C ATOM 0 H VAL A 108 9.834 12.203 7.446 1.00 34.35 H new ATOM 0 HA VAL A 108 10.622 14.803 6.761 1.00 15.41 H new ATOM 0 HB VAL A 108 10.070 14.096 9.055 1.00 41.14 H new ATOM 0 HG11 VAL A 108 11.653 12.746 10.369 1.00 14.20 H new ATOM 0 HG12 VAL A 108 11.000 11.838 8.985 1.00 14.20 H new ATOM 0 HG13 VAL A 108 12.648 12.505 8.914 1.00 14.20 H new ATOM 0 HG21 VAL A 108 11.927 15.198 10.236 1.00 53.03 H new ATOM 0 HG22 VAL A 108 12.934 15.058 8.775 1.00 53.03 H new ATOM 0 HG23 VAL A 108 11.473 16.075 8.755 1.00 53.03 H new ATOM 1048 N GLU A 109 12.940 12.490 6.536 1.00 24.42 N ATOM 1049 CA GLU A 109 14.286 12.212 6.051 1.00 35.02 C ATOM 1050 C GLU A 109 14.430 12.607 4.584 1.00 63.31 C ATOM 1051 O GLU A 109 15.457 13.145 4.174 1.00 72.43 O ATOM 1052 CB GLU A 109 14.619 10.728 6.226 1.00 70.04 C ATOM 1053 CG GLU A 109 15.918 10.312 5.557 1.00 71.32 C ATOM 1054 CD GLU A 109 16.389 8.940 5.999 1.00 61.14 C ATOM 1055 OE1 GLU A 109 16.992 8.841 7.087 1.00 73.13 O ATOM 1056 OE2 GLU A 109 16.151 7.965 5.254 1.00 24.05 O ATOM 0 H GLU A 109 12.402 11.661 6.787 1.00 24.42 H new ATOM 0 HA GLU A 109 14.985 12.806 6.639 1.00 35.02 H new ATOM 0 HB2 GLU A 109 14.680 10.501 7.290 1.00 70.04 H new ATOM 0 HB3 GLU A 109 13.803 10.131 5.819 1.00 70.04 H new ATOM 0 HG2 GLU A 109 15.782 10.314 4.475 1.00 71.32 H new ATOM 0 HG3 GLU A 109 16.690 11.047 5.783 1.00 71.32 H new ATOM 1061 N ASN A 110 13.392 12.335 3.800 1.00 22.53 N ATOM 1062 CA ASN A 110 13.402 12.662 2.379 1.00 53.33 C ATOM 1063 C ASN A 110 13.715 14.139 2.162 1.00 11.14 C ATOM 1064 O ASN A 110 14.306 14.516 1.149 1.00 64.43 O ATOM 1065 CB ASN A 110 12.052 12.318 1.746 1.00 1.31 C ATOM 1066 CG ASN A 110 12.143 12.158 0.240 1.00 3.04 C ATOM 1067 OD1 ASN A 110 12.568 13.071 -0.467 1.00 64.02 O ATOM 1068 ND2 ASN A 110 11.743 10.993 -0.256 1.00 43.41 N ATOM 0 H ASN A 110 12.534 11.889 4.124 1.00 22.53 H new ATOM 0 HA ASN A 110 14.182 12.069 1.901 1.00 53.33 H new ATOM 0 HB2 ASN A 110 11.673 11.395 2.184 1.00 1.31 H new ATOM 0 HB3 ASN A 110 11.333 13.102 1.982 1.00 1.31 H new ATOM 0 HD21 ASN A 110 11.781 10.827 -1.262 1.00 43.41 H new ATOM 0 HD22 ASN A 110 11.398 10.264 0.369 1.00 43.41 H new ATOM 1074 N ASP A 111 13.318 14.970 3.120 1.00 53.12 N ATOM 1075 CA ASP A 111 13.558 16.406 3.035 1.00 52.11 C ATOM 1076 C ASP A 111 12.815 17.011 1.848 1.00 5.12 C ATOM 1077 O ASP A 111 13.431 17.529 0.916 1.00 73.23 O ATOM 1078 CB ASP A 111 15.057 16.687 2.911 1.00 2.22 C ATOM 1079 CG ASP A 111 15.869 15.978 3.978 1.00 53.43 C ATOM 1080 OD1 ASP A 111 16.908 15.378 3.631 1.00 33.32 O ATOM 1081 OD2 ASP A 111 15.466 16.023 5.158 1.00 44.04 O ATOM 0 H ASP A 111 12.829 14.674 3.964 1.00 53.12 H new ATOM 0 HA ASP A 111 13.184 16.867 3.949 1.00 52.11 H new ATOM 0 HB2 ASP A 111 15.403 16.372 1.926 1.00 2.22 H new ATOM 0 HB3 ASP A 111 15.229 17.761 2.981 1.00 2.22 H new ATOM 1085 N ASP A 112 11.489 16.943 1.890 1.00 11.54 N ATOM 1086 CA ASP A 112 10.661 17.485 0.819 1.00 71.31 C ATOM 1087 C ASP A 112 9.664 18.503 1.365 1.00 54.33 C ATOM 1088 O ASP A 112 9.389 19.520 0.727 1.00 12.13 O ATOM 1089 CB ASP A 112 9.918 16.358 0.099 1.00 1.34 C ATOM 1090 CG ASP A 112 9.379 16.789 -1.250 1.00 72.44 C ATOM 1091 OD1 ASP A 112 8.322 17.453 -1.282 1.00 51.13 O ATOM 1092 OD2 ASP A 112 10.015 16.463 -2.273 1.00 74.33 O ATOM 0 H ASP A 112 10.964 16.518 2.654 1.00 11.54 H new ATOM 0 HA ASP A 112 11.315 17.990 0.108 1.00 71.31 H new ATOM 0 HB2 ASP A 112 10.591 15.511 -0.036 1.00 1.34 H new ATOM 0 HB3 ASP A 112 9.093 16.014 0.723 1.00 1.34 H new ATOM 1096 N ILE A 113 9.125 18.220 2.546 1.00 40.12 N ATOM 1097 CA ILE A 113 8.158 19.110 3.176 1.00 34.11 C ATOM 1098 C ILE A 113 8.580 19.459 4.599 1.00 64.30 C ATOM 1099 O ILE A 113 9.645 19.051 5.059 1.00 24.13 O ATOM 1100 CB ILE A 113 6.752 18.482 3.209 1.00 53.30 C ATOM 1101 CG1 ILE A 113 6.791 17.130 3.926 1.00 74.43 C ATOM 1102 CG2 ILE A 113 6.209 18.323 1.797 1.00 31.11 C ATOM 1103 CD1 ILE A 113 6.613 17.235 5.424 1.00 32.51 C ATOM 0 H ILE A 113 9.341 17.382 3.086 1.00 40.12 H new ATOM 0 HA ILE A 113 8.126 20.019 2.575 1.00 34.11 H new ATOM 0 HB ILE A 113 6.086 19.146 3.760 1.00 53.30 H new ATOM 0 HG12 ILE A 113 6.008 16.490 3.519 1.00 74.43 H new ATOM 0 HG13 ILE A 113 7.743 16.643 3.715 1.00 74.43 H new ATOM 0 HG21 ILE A 113 5.215 17.878 1.837 1.00 31.11 H new ATOM 0 HG22 ILE A 113 6.150 19.300 1.318 1.00 31.11 H new ATOM 0 HG23 ILE A 113 6.873 17.677 1.223 1.00 31.11 H new ATOM 0 HD11 ILE A 113 6.651 16.239 5.866 1.00 32.51 H new ATOM 0 HD12 ILE A 113 7.410 17.849 5.843 1.00 32.51 H new ATOM 0 HD13 ILE A 113 5.649 17.693 5.645 1.00 32.51 H new ATOM 1114 N GLU A 114 7.735 20.218 5.291 1.00 21.24 N ATOM 1115 CA GLU A 114 8.020 20.622 6.663 1.00 74.41 C ATOM 1116 C GLU A 114 6.880 20.227 7.595 1.00 42.40 C ATOM 1117 O GLU A 114 7.091 19.550 8.600 1.00 0.34 O ATOM 1118 CB GLU A 114 8.253 22.133 6.735 1.00 24.43 C ATOM 1119 CG GLU A 114 9.321 22.631 5.775 1.00 71.13 C ATOM 1120 CD GLU A 114 9.822 24.018 6.129 1.00 54.41 C ATOM 1121 OE1 GLU A 114 8.986 24.936 6.263 1.00 10.24 O ATOM 1122 OE2 GLU A 114 11.051 24.185 6.272 1.00 61.11 O ATOM 0 H GLU A 114 6.849 20.565 4.924 1.00 21.24 H new ATOM 0 HA GLU A 114 8.924 20.106 6.986 1.00 74.41 H new ATOM 0 HB2 GLU A 114 7.316 22.647 6.521 1.00 24.43 H new ATOM 0 HB3 GLU A 114 8.538 22.400 7.753 1.00 24.43 H new ATOM 0 HG2 GLU A 114 10.159 21.934 5.777 1.00 71.13 H new ATOM 0 HG3 GLU A 114 8.918 22.642 4.762 1.00 71.13 H new ATOM 1127 N MET A 115 5.668 20.656 7.254 1.00 20.22 N ATOM 1128 CA MET A 115 4.493 20.347 8.060 1.00 71.14 C ATOM 1129 C MET A 115 3.308 19.980 7.173 1.00 5.42 C ATOM 1130 O MET A 115 2.153 20.142 7.568 1.00 12.33 O ATOM 1131 CB MET A 115 4.131 21.538 8.950 1.00 52.24 C ATOM 1132 CG MET A 115 3.747 22.785 8.169 1.00 14.41 C ATOM 1133 SD MET A 115 5.151 23.878 7.875 1.00 60.41 S ATOM 1134 CE MET A 115 4.879 25.124 9.132 1.00 45.23 C ATOM 0 H MET A 115 5.475 21.218 6.425 1.00 20.22 H new ATOM 0 HA MET A 115 4.730 19.491 8.691 1.00 71.14 H new ATOM 0 HB2 MET A 115 3.303 21.257 9.600 1.00 52.24 H new ATOM 0 HB3 MET A 115 4.978 21.770 9.595 1.00 52.24 H new ATOM 0 HG2 MET A 115 3.313 22.491 7.213 1.00 14.41 H new ATOM 0 HG3 MET A 115 2.976 23.329 8.715 1.00 14.41 H new ATOM 0 HE1 MET A 115 5.668 25.874 9.078 1.00 45.23 H new ATOM 0 HE2 MET A 115 3.913 25.602 8.968 1.00 45.23 H new ATOM 0 HE3 MET A 115 4.890 24.656 10.116 1.00 45.23 H new ATOM 1142 N GLN A 116 3.601 19.486 5.975 1.00 31.40 N ATOM 1143 CA GLN A 116 2.557 19.098 5.033 1.00 75.31 C ATOM 1144 C GLN A 116 2.041 17.697 5.341 1.00 54.11 C ATOM 1145 O GLN A 116 0.835 17.451 5.321 1.00 10.25 O ATOM 1146 CB GLN A 116 3.089 19.155 3.599 1.00 3.43 C ATOM 1147 CG GLN A 116 2.076 19.683 2.596 1.00 0.04 C ATOM 1148 CD GLN A 116 2.592 19.647 1.172 1.00 74.42 C ATOM 1149 OE1 GLN A 116 2.545 18.611 0.508 1.00 50.14 O ATOM 1150 NE2 GLN A 116 3.090 20.780 0.693 1.00 65.42 N ATOM 0 H GLN A 116 4.552 19.345 5.633 1.00 31.40 H new ATOM 0 HA GLN A 116 1.730 19.801 5.135 1.00 75.31 H new ATOM 0 HB2 GLN A 116 3.976 19.788 3.574 1.00 3.43 H new ATOM 0 HB3 GLN A 116 3.401 18.156 3.296 1.00 3.43 H new ATOM 0 HG2 GLN A 116 1.163 19.092 2.662 1.00 0.04 H new ATOM 0 HG3 GLN A 116 1.812 20.708 2.857 1.00 0.04 H new ATOM 0 HE21 GLN A 116 3.110 21.616 1.277 1.00 65.42 H new ATOM 0 HE22 GLN A 116 3.453 20.815 -0.260 1.00 65.42 H new ATOM 1157 N ALA A 117 2.961 16.780 5.624 1.00 44.01 N ATOM 1158 CA ALA A 117 2.598 15.404 5.938 1.00 43.11 C ATOM 1159 C ALA A 117 1.862 15.321 7.271 1.00 15.14 C ATOM 1160 O ALA A 117 0.949 14.512 7.438 1.00 43.01 O ATOM 1161 CB ALA A 117 3.838 14.524 5.962 1.00 13.30 C ATOM 0 H ALA A 117 3.964 16.966 5.642 1.00 44.01 H new ATOM 0 HA ALA A 117 1.926 15.045 5.159 1.00 43.11 H new ATOM 0 HB1 ALA A 117 3.552 13.499 6.198 1.00 13.30 H new ATOM 0 HB2 ALA A 117 4.322 14.550 4.986 1.00 13.30 H new ATOM 0 HB3 ALA A 117 4.530 14.891 6.720 1.00 13.30 H new ATOM 1167 N LEU A 118 2.265 16.161 8.218 1.00 35.53 N ATOM 1168 CA LEU A 118 1.645 16.182 9.538 1.00 12.11 C ATOM 1169 C LEU A 118 0.425 17.098 9.552 1.00 34.14 C ATOM 1170 O LEU A 118 -0.623 16.744 10.090 1.00 72.15 O ATOM 1171 CB LEU A 118 2.654 16.642 10.591 1.00 31.43 C ATOM 1172 CG LEU A 118 3.418 15.534 11.318 1.00 10.24 C ATOM 1173 CD1 LEU A 118 4.751 15.268 10.635 1.00 22.13 C ATOM 1174 CD2 LEU A 118 3.629 15.903 12.779 1.00 14.23 C ATOM 0 H LEU A 118 3.019 16.837 8.096 1.00 35.53 H new ATOM 0 HA LEU A 118 1.319 15.169 9.775 1.00 12.11 H new ATOM 0 HB2 LEU A 118 3.378 17.299 10.109 1.00 31.43 H new ATOM 0 HB3 LEU A 118 2.126 17.240 11.334 1.00 31.43 H new ATOM 0 HG LEU A 118 2.824 14.621 11.277 1.00 10.24 H new ATOM 0 HD11 LEU A 118 5.280 14.477 11.166 1.00 22.13 H new ATOM 0 HD12 LEU A 118 4.577 14.959 9.604 1.00 22.13 H new ATOM 0 HD13 LEU A 118 5.353 16.177 10.645 1.00 22.13 H new ATOM 0 HD21 LEU A 118 4.174 15.104 13.281 1.00 14.23 H new ATOM 0 HD22 LEU A 118 4.202 16.828 12.842 1.00 14.23 H new ATOM 0 HD23 LEU A 118 2.662 16.042 13.262 1.00 14.23 H new ATOM 1185 N GLY A 119 0.571 18.277 8.954 1.00 43.42 N ATOM 1186 CA GLY A 119 -0.528 19.224 8.907 1.00 23.55 C ATOM 1187 C GLY A 119 -1.796 18.615 8.342 1.00 31.21 C ATOM 1188 O GLY A 119 -2.900 18.977 8.747 1.00 13.14 O ATOM 0 H GLY A 119 1.429 18.593 8.502 1.00 43.42 H new ATOM 0 HA2 GLY A 119 -0.725 19.597 9.912 1.00 23.55 H new ATOM 0 HA3 GLY A 119 -0.239 20.081 8.299 1.00 23.55 H new ATOM 1192 N SER A 120 -1.637 17.688 7.402 1.00 65.00 N ATOM 1193 CA SER A 120 -2.779 17.032 6.777 1.00 50.31 C ATOM 1194 C SER A 120 -3.227 15.824 7.595 1.00 23.34 C ATOM 1195 O SER A 120 -4.419 15.546 7.708 1.00 52.33 O ATOM 1196 CB SER A 120 -2.427 16.595 5.354 1.00 34.34 C ATOM 1197 OG SER A 120 -1.409 15.607 5.361 1.00 24.15 O ATOM 0 H SER A 120 -0.729 17.375 7.057 1.00 65.00 H new ATOM 0 HA SER A 120 -3.600 17.748 6.738 1.00 50.31 H new ATOM 0 HB2 SER A 120 -3.316 16.202 4.860 1.00 34.34 H new ATOM 0 HB3 SER A 120 -2.097 17.458 4.776 1.00 34.34 H new ATOM 0 HG SER A 120 -0.531 16.042 5.332 1.00 24.15 H new ATOM 1202 N ASN A 121 -2.260 15.112 8.165 1.00 24.24 N ATOM 1203 CA ASN A 121 -2.554 13.935 8.974 1.00 23.10 C ATOM 1204 C ASN A 121 -3.595 14.254 10.042 1.00 40.13 C ATOM 1205 O ASN A 121 -3.311 14.956 11.013 1.00 43.33 O ATOM 1206 CB ASN A 121 -1.276 13.411 9.632 1.00 1.35 C ATOM 1207 CG ASN A 121 -0.795 12.114 9.011 1.00 71.50 C ATOM 1208 OD1 ASN A 121 -1.556 11.157 8.875 1.00 62.13 O ATOM 1209 ND2 ASN A 121 0.477 12.079 8.629 1.00 73.25 N ATOM 0 H ASN A 121 -1.267 15.330 8.082 1.00 24.24 H new ATOM 0 HA ASN A 121 -2.959 13.165 8.317 1.00 23.10 H new ATOM 0 HB2 ASN A 121 -0.492 14.164 9.547 1.00 1.35 H new ATOM 0 HB3 ASN A 121 -1.456 13.256 10.696 1.00 1.35 H new ATOM 0 HD21 ASN A 121 0.859 11.234 8.203 1.00 73.25 H new ATOM 0 HD22 ASN A 121 1.072 12.897 8.761 1.00 73.25 H new ATOM 1215 N THR A 122 -4.804 13.732 9.857 1.00 42.33 N ATOM 1216 CA THR A 122 -5.889 13.961 10.802 1.00 10.05 C ATOM 1217 C THR A 122 -6.723 12.700 10.999 1.00 51.21 C ATOM 1218 O THR A 122 -6.900 12.228 12.123 1.00 44.01 O ATOM 1219 CB THR A 122 -6.810 15.104 10.336 1.00 70.03 C ATOM 1220 OG1 THR A 122 -6.899 15.108 8.907 1.00 32.40 O ATOM 1221 CG2 THR A 122 -6.292 16.449 10.821 1.00 12.23 C ATOM 0 H THR A 122 -5.056 13.147 9.060 1.00 42.33 H new ATOM 0 HA THR A 122 -5.428 14.240 11.749 1.00 10.05 H new ATOM 0 HB THR A 122 -7.800 14.940 10.761 1.00 70.03 H new ATOM 0 HG1 THR A 122 -6.046 15.406 8.527 1.00 32.40 H new ATOM 0 HG21 THR A 122 -6.959 17.240 10.479 1.00 12.23 H new ATOM 0 HG22 THR A 122 -6.253 16.452 11.910 1.00 12.23 H new ATOM 0 HG23 THR A 122 -5.292 16.619 10.421 1.00 12.23 H new ATOM 1229 N THR A 123 -7.233 12.156 9.899 1.00 73.14 N ATOM 1230 CA THR A 123 -8.048 10.949 9.949 1.00 2.23 C ATOM 1231 C THR A 123 -7.296 9.752 9.378 1.00 4.10 C ATOM 1232 O THR A 123 -6.378 9.911 8.574 1.00 72.01 O ATOM 1233 CB THR A 123 -9.368 11.129 9.175 1.00 31.42 C ATOM 1234 OG1 THR A 123 -9.115 11.104 7.766 1.00 62.14 O ATOM 1235 CG2 THR A 123 -10.041 12.439 9.552 1.00 44.23 C ATOM 0 H THR A 123 -7.096 12.533 8.961 1.00 73.14 H new ATOM 0 HA THR A 123 -8.274 10.765 10.999 1.00 2.23 H new ATOM 0 HB THR A 123 -10.035 10.308 9.439 1.00 31.42 H new ATOM 0 HG1 THR A 123 -9.917 10.794 7.295 1.00 62.14 H new ATOM 0 HG21 THR A 123 -10.971 12.544 8.993 1.00 44.23 H new ATOM 0 HG22 THR A 123 -10.257 12.443 10.620 1.00 44.23 H new ATOM 0 HG23 THR A 123 -9.378 13.271 9.313 1.00 44.23 H new ATOM 1243 N ILE A 124 -7.691 8.555 9.798 1.00 3.13 N ATOM 1244 CA ILE A 124 -7.054 7.332 9.327 1.00 44.55 C ATOM 1245 C ILE A 124 -8.049 6.446 8.584 1.00 4.41 C ATOM 1246 O ILE A 124 -9.260 6.545 8.790 1.00 12.13 O ATOM 1247 CB ILE A 124 -6.441 6.532 10.491 1.00 0.31 C ATOM 1248 CG1 ILE A 124 -7.543 5.987 11.402 1.00 72.22 C ATOM 1249 CG2 ILE A 124 -5.475 7.403 11.281 1.00 60.14 C ATOM 1250 CD1 ILE A 124 -7.966 4.575 11.059 1.00 22.03 C ATOM 0 H ILE A 124 -8.449 8.406 10.464 1.00 3.13 H new ATOM 0 HA ILE A 124 -6.258 7.633 8.645 1.00 44.55 H new ATOM 0 HB ILE A 124 -5.887 5.688 10.080 1.00 0.31 H new ATOM 0 HG12 ILE A 124 -7.196 6.013 12.435 1.00 72.22 H new ATOM 0 HG13 ILE A 124 -8.411 6.643 11.341 1.00 72.22 H new ATOM 0 HG21 ILE A 124 -5.050 6.824 12.101 1.00 60.14 H new ATOM 0 HG22 ILE A 124 -4.675 7.746 10.625 1.00 60.14 H new ATOM 0 HG23 ILE A 124 -6.008 8.264 11.684 1.00 60.14 H new ATOM 0 HD11 ILE A 124 -8.750 4.253 11.745 1.00 22.03 H new ATOM 0 HD12 ILE A 124 -8.344 4.547 10.037 1.00 22.03 H new ATOM 0 HD13 ILE A 124 -7.109 3.907 11.148 1.00 22.03 H new ATOM 1261 N HIS A 125 -7.531 5.577 7.722 1.00 45.34 N ATOM 1262 CA HIS A 125 -8.374 4.671 6.950 1.00 73.11 C ATOM 1263 C HIS A 125 -8.287 3.249 7.498 1.00 71.34 C ATOM 1264 O HIS A 125 -7.196 2.720 7.705 1.00 24.15 O ATOM 1265 CB HIS A 125 -7.963 4.688 5.477 1.00 23.33 C ATOM 1266 CG HIS A 125 -8.793 5.608 4.635 1.00 55.41 C ATOM 1267 ND1 HIS A 125 -9.429 6.722 5.140 1.00 23.10 N ATOM 1268 CD2 HIS A 125 -9.088 5.574 3.315 1.00 60.12 C ATOM 1269 CE1 HIS A 125 -10.081 7.333 4.167 1.00 52.34 C ATOM 1270 NE2 HIS A 125 -9.889 6.657 3.048 1.00 44.25 N ATOM 0 H HIS A 125 -6.532 5.481 7.541 1.00 45.34 H new ATOM 0 HA HIS A 125 -9.406 5.013 7.035 1.00 73.11 H new ATOM 0 HB2 HIS A 125 -6.917 4.986 5.403 1.00 23.33 H new ATOM 0 HB3 HIS A 125 -8.036 3.677 5.076 1.00 23.33 H new ATOM 0 HD1 HIS A 125 -9.401 7.027 6.113 1.00 23.10 H new ATOM 0 HD2 HIS A 125 -8.755 4.833 2.603 1.00 60.12 H new ATOM 0 HE1 HIS A 125 -10.671 8.232 4.269 1.00 52.34 H new ATOM 1277 N ALA A 126 -9.444 2.639 7.730 1.00 14.44 N ATOM 1278 CA ALA A 126 -9.498 1.279 8.253 1.00 41.42 C ATOM 1279 C ALA A 126 -9.911 0.290 7.168 1.00 75.14 C ATOM 1280 O ALA A 126 -10.950 0.453 6.527 1.00 4.01 O ATOM 1281 CB ALA A 126 -10.458 1.204 9.431 1.00 53.11 C ATOM 0 H ALA A 126 -10.356 3.064 7.564 1.00 14.44 H new ATOM 0 HA ALA A 126 -8.499 1.008 8.595 1.00 41.42 H new ATOM 0 HB1 ALA A 126 -10.488 0.183 9.811 1.00 53.11 H new ATOM 0 HB2 ALA A 126 -10.119 1.875 10.220 1.00 53.11 H new ATOM 0 HB3 ALA A 126 -11.456 1.500 9.107 1.00 53.11 H new ATOM 1287 N TYR A 127 -9.091 -0.736 6.965 1.00 4.11 N ATOM 1288 CA TYR A 127 -9.370 -1.750 5.956 1.00 73.33 C ATOM 1289 C TYR A 127 -9.639 -3.104 6.603 1.00 51.32 C ATOM 1290 O TYR A 127 -8.711 -3.828 6.965 1.00 45.32 O ATOM 1291 CB TYR A 127 -8.198 -1.863 4.979 1.00 63.41 C ATOM 1292 CG TYR A 127 -8.326 -0.959 3.772 1.00 13.33 C ATOM 1293 CD1 TYR A 127 -8.042 -1.429 2.496 1.00 13.15 C ATOM 1294 CD2 TYR A 127 -8.729 0.363 3.909 1.00 10.12 C ATOM 1295 CE1 TYR A 127 -8.157 -0.608 1.392 1.00 74.34 C ATOM 1296 CE2 TYR A 127 -8.848 1.190 2.810 1.00 64.44 C ATOM 1297 CZ TYR A 127 -8.560 0.701 1.553 1.00 1.40 C ATOM 1298 OH TYR A 127 -8.676 1.523 0.455 1.00 12.21 O ATOM 0 H TYR A 127 -8.227 -0.887 7.487 1.00 4.11 H new ATOM 0 HA TYR A 127 -10.263 -1.446 5.410 1.00 73.33 H new ATOM 0 HB2 TYR A 127 -7.273 -1.625 5.505 1.00 63.41 H new ATOM 0 HB3 TYR A 127 -8.115 -2.896 4.642 1.00 63.41 H new ATOM 0 HD1 TYR A 127 -7.726 -2.453 2.365 1.00 13.15 H new ATOM 0 HD2 TYR A 127 -8.953 0.751 4.892 1.00 10.12 H new ATOM 0 HE1 TYR A 127 -7.932 -0.989 0.407 1.00 74.34 H new ATOM 0 HE2 TYR A 127 -9.165 2.215 2.934 1.00 64.44 H new ATOM 0 HH TYR A 127 -8.971 2.412 0.742 1.00 12.21 H new ATOM 1307 N PHE A 128 -10.917 -3.442 6.745 1.00 31.53 N ATOM 1308 CA PHE A 128 -11.310 -4.709 7.349 1.00 23.12 C ATOM 1309 C PHE A 128 -11.514 -5.780 6.282 1.00 32.23 C ATOM 1310 O PHE A 128 -11.787 -5.472 5.122 1.00 42.11 O ATOM 1311 CB PHE A 128 -12.594 -4.533 8.163 1.00 12.34 C ATOM 1312 CG PHE A 128 -12.587 -3.312 9.037 1.00 1.51 C ATOM 1313 CD1 PHE A 128 -13.402 -2.230 8.745 1.00 50.14 C ATOM 1314 CD2 PHE A 128 -11.766 -3.246 10.151 1.00 2.50 C ATOM 1315 CE1 PHE A 128 -13.399 -1.105 9.548 1.00 12.14 C ATOM 1316 CE2 PHE A 128 -11.759 -2.123 10.958 1.00 12.14 C ATOM 1317 CZ PHE A 128 -12.575 -1.051 10.655 1.00 12.23 C ATOM 0 H PHE A 128 -11.698 -2.856 6.450 1.00 31.53 H new ATOM 0 HA PHE A 128 -10.508 -5.031 8.013 1.00 23.12 H new ATOM 0 HB2 PHE A 128 -13.442 -4.477 7.481 1.00 12.34 H new ATOM 0 HB3 PHE A 128 -12.744 -5.415 8.786 1.00 12.34 H new ATOM 0 HD1 PHE A 128 -14.047 -2.266 7.880 1.00 50.14 H new ATOM 0 HD2 PHE A 128 -11.124 -4.081 10.392 1.00 2.50 H new ATOM 0 HE1 PHE A 128 -14.040 -0.269 9.310 1.00 12.14 H new ATOM 0 HE2 PHE A 128 -11.116 -2.084 11.825 1.00 12.14 H new ATOM 0 HZ PHE A 128 -12.569 -0.172 11.283 1.00 12.23 H new ATOM 1326 N ARG A 129 -11.378 -7.040 6.682 1.00 25.14 N ATOM 1327 CA ARG A 129 -11.545 -8.157 5.761 1.00 42.40 C ATOM 1328 C ARG A 129 -12.684 -9.067 6.211 1.00 4.22 C ATOM 1329 O ARG A 129 -12.770 -9.443 7.381 1.00 31.43 O ATOM 1330 CB ARG A 129 -10.247 -8.960 5.659 1.00 51.21 C ATOM 1331 CG ARG A 129 -9.175 -8.280 4.824 1.00 10.21 C ATOM 1332 CD ARG A 129 -9.410 -8.490 3.336 1.00 13.32 C ATOM 1333 NE ARG A 129 -8.257 -8.085 2.538 1.00 60.35 N ATOM 1334 CZ ARG A 129 -8.151 -8.312 1.233 1.00 35.15 C ATOM 1335 NH1 ARG A 129 -9.122 -8.939 0.584 1.00 43.23 N ATOM 1336 NH2 ARG A 129 -7.070 -7.913 0.574 1.00 34.24 N ATOM 0 H ARG A 129 -11.152 -7.313 7.639 1.00 25.14 H new ATOM 0 HA ARG A 129 -11.792 -7.752 4.780 1.00 42.40 H new ATOM 0 HB2 ARG A 129 -9.858 -9.135 6.662 1.00 51.21 H new ATOM 0 HB3 ARG A 129 -10.467 -9.937 5.228 1.00 51.21 H new ATOM 0 HG2 ARG A 129 -9.163 -7.213 5.044 1.00 10.21 H new ATOM 0 HG3 ARG A 129 -8.196 -8.673 5.098 1.00 10.21 H new ATOM 0 HD2 ARG A 129 -9.630 -9.541 3.148 1.00 13.32 H new ATOM 0 HD3 ARG A 129 -10.285 -7.921 3.023 1.00 13.32 H new ATOM 0 HE ARG A 129 -7.491 -7.602 3.007 1.00 60.35 H new ATOM 0 HH11 ARG A 129 -9.954 -9.249 1.086 1.00 43.23 H new ATOM 0 HH12 ARG A 129 -9.037 -9.112 -0.418 1.00 43.23 H new ATOM 0 HH21 ARG A 129 -6.319 -7.432 1.069 1.00 34.24 H new ATOM 0 HH22 ARG A 129 -6.990 -8.088 -0.428 1.00 34.24 H new ATOM 1347 N LYS A 130 -13.559 -9.419 5.274 1.00 64.23 N ATOM 1348 CA LYS A 130 -14.694 -10.284 5.573 1.00 35.31 C ATOM 1349 C LYS A 130 -14.237 -11.554 6.285 1.00 25.51 C ATOM 1350 O LYS A 130 -13.060 -11.911 6.242 1.00 53.23 O ATOM 1351 CB LYS A 130 -15.435 -10.650 4.284 1.00 25.42 C ATOM 1352 CG LYS A 130 -16.853 -11.139 4.517 1.00 45.32 C ATOM 1353 CD LYS A 130 -17.707 -10.076 5.189 1.00 54.21 C ATOM 1354 CE LYS A 130 -19.176 -10.471 5.210 1.00 71.13 C ATOM 1355 NZ LYS A 130 -19.454 -11.521 6.228 1.00 31.30 N ATOM 0 H LYS A 130 -13.503 -9.118 4.301 1.00 64.23 H new ATOM 0 HA LYS A 130 -15.370 -9.740 6.233 1.00 35.31 H new ATOM 0 HB2 LYS A 130 -15.463 -9.778 3.631 1.00 25.42 H new ATOM 0 HB3 LYS A 130 -14.874 -11.424 3.759 1.00 25.42 H new ATOM 0 HG2 LYS A 130 -17.303 -11.420 3.565 1.00 45.32 H new ATOM 0 HG3 LYS A 130 -16.832 -12.036 5.137 1.00 45.32 H new ATOM 0 HD2 LYS A 130 -17.357 -9.918 6.209 1.00 54.21 H new ATOM 0 HD3 LYS A 130 -17.592 -9.129 4.662 1.00 54.21 H new ATOM 0 HE2 LYS A 130 -19.785 -9.592 5.420 1.00 71.13 H new ATOM 0 HE3 LYS A 130 -19.468 -10.834 4.225 1.00 71.13 H new ATOM 0 HZ1 LYS A 130 -20.465 -11.762 6.211 1.00 31.30 H new ATOM 0 HZ2 LYS A 130 -18.892 -12.369 6.014 1.00 31.30 H new ATOM 0 HZ3 LYS A 130 -19.199 -11.166 7.172 1.00 31.30 H new ATOM 1365 N ASP A 131 -15.175 -12.229 6.939 1.00 12.52 N ATOM 1366 CA ASP A 131 -14.869 -13.460 7.660 1.00 20.44 C ATOM 1367 C ASP A 131 -14.109 -14.437 6.768 1.00 61.31 C ATOM 1368 O ASP A 131 -12.993 -14.846 7.089 1.00 12.42 O ATOM 1369 CB ASP A 131 -16.156 -14.111 8.170 1.00 31.51 C ATOM 1370 CG ASP A 131 -16.857 -13.265 9.215 1.00 42.11 C ATOM 1371 OD1 ASP A 131 -17.277 -13.826 10.248 1.00 13.22 O ATOM 1372 OD2 ASP A 131 -16.986 -12.043 8.998 1.00 24.35 O ATOM 0 H ASP A 131 -16.154 -11.945 6.985 1.00 12.52 H new ATOM 0 HA ASP A 131 -14.238 -13.206 8.511 1.00 20.44 H new ATOM 0 HB2 ASP A 131 -16.831 -14.281 7.331 1.00 31.51 H new ATOM 0 HB3 ASP A 131 -15.923 -15.088 8.594 1.00 31.51 H new ATOM 1376 N TRP A 132 -14.720 -14.806 5.649 1.00 63.34 N ATOM 1377 CA TRP A 132 -14.101 -15.736 4.711 1.00 64.02 C ATOM 1378 C TRP A 132 -13.382 -14.986 3.595 1.00 73.22 C ATOM 1379 O TRP A 132 -13.266 -15.483 2.475 1.00 14.20 O ATOM 1380 CB TRP A 132 -15.156 -16.671 4.117 1.00 64.42 C ATOM 1381 CG TRP A 132 -14.809 -18.122 4.256 1.00 54.22 C ATOM 1382 CD1 TRP A 132 -14.011 -18.857 3.425 1.00 5.14 C ATOM 1383 CD2 TRP A 132 -15.251 -19.014 5.285 1.00 32.31 C ATOM 1384 NE1 TRP A 132 -13.931 -20.152 3.877 1.00 54.14 N ATOM 1385 CE2 TRP A 132 -14.682 -20.275 5.016 1.00 22.33 C ATOM 1386 CE3 TRP A 132 -16.070 -18.870 6.407 1.00 52.53 C ATOM 1387 CZ2 TRP A 132 -14.907 -21.382 5.830 1.00 64.01 C ATOM 1388 CZ3 TRP A 132 -16.294 -19.970 7.213 1.00 41.10 C ATOM 1389 CH2 TRP A 132 -15.713 -21.212 6.922 1.00 42.32 C ATOM 0 H TRP A 132 -15.643 -14.476 5.368 1.00 63.34 H new ATOM 0 HA TRP A 132 -13.367 -16.328 5.257 1.00 64.02 H new ATOM 0 HB2 TRP A 132 -16.112 -16.485 4.606 1.00 64.42 H new ATOM 0 HB3 TRP A 132 -15.287 -16.436 3.061 1.00 64.42 H new ATOM 0 HD1 TRP A 132 -13.516 -18.476 2.544 1.00 5.14 H new ATOM 0 HE1 TRP A 132 -13.398 -20.901 3.435 1.00 54.14 H new ATOM 0 HE3 TRP A 132 -16.520 -17.916 6.641 1.00 52.53 H new ATOM 0 HZ2 TRP A 132 -14.461 -22.340 5.607 1.00 64.01 H new ATOM 0 HZ3 TRP A 132 -16.928 -19.871 8.082 1.00 41.10 H new ATOM 0 HH2 TRP A 132 -15.906 -22.052 7.573 1.00 42.32 H new ATOM 1399 N SER A 133 -12.902 -13.787 3.908 1.00 22.34 N ATOM 1400 CA SER A 133 -12.196 -12.966 2.930 1.00 13.10 C ATOM 1401 C SER A 133 -12.978 -12.889 1.622 1.00 75.14 C ATOM 1402 O SER A 133 -12.395 -12.814 0.540 1.00 30.23 O ATOM 1403 CB SER A 133 -10.800 -13.535 2.669 1.00 23.51 C ATOM 1404 OG SER A 133 -10.073 -13.676 3.878 1.00 62.35 O ATOM 0 H SER A 133 -12.989 -13.362 4.831 1.00 22.34 H new ATOM 0 HA SER A 133 -12.100 -11.959 3.337 1.00 13.10 H new ATOM 0 HB2 SER A 133 -10.885 -14.504 2.177 1.00 23.51 H new ATOM 0 HB3 SER A 133 -10.257 -12.878 1.989 1.00 23.51 H new ATOM 0 HG SER A 133 -9.185 -14.043 3.685 1.00 62.35 H new ATOM 1409 N ASP A 134 -14.302 -12.907 1.729 1.00 31.24 N ATOM 1410 CA ASP A 134 -15.165 -12.837 0.557 1.00 52.42 C ATOM 1411 C ASP A 134 -15.160 -11.433 -0.040 1.00 52.42 C ATOM 1412 O ASP A 134 -15.217 -11.263 -1.258 1.00 55.32 O ATOM 1413 CB ASP A 134 -16.594 -13.244 0.923 1.00 3.33 C ATOM 1414 CG ASP A 134 -17.434 -13.571 -0.295 1.00 60.45 C ATOM 1415 OD1 ASP A 134 -18.626 -13.901 -0.123 1.00 55.34 O ATOM 1416 OD2 ASP A 134 -16.899 -13.496 -1.421 1.00 63.14 O ATOM 0 H ASP A 134 -14.801 -12.970 2.617 1.00 31.24 H new ATOM 0 HA ASP A 134 -14.778 -13.531 -0.189 1.00 52.42 H new ATOM 0 HB2 ASP A 134 -16.564 -14.111 1.583 1.00 3.33 H new ATOM 0 HB3 ASP A 134 -17.067 -12.436 1.480 1.00 3.33 H new ATOM 1420 N LYS A 135 -15.094 -10.428 0.827 1.00 11.04 N ATOM 1421 CA LYS A 135 -15.081 -9.039 0.388 1.00 22.32 C ATOM 1422 C LYS A 135 -14.219 -8.183 1.312 1.00 14.01 C ATOM 1423 O LYS A 135 -13.926 -8.575 2.441 1.00 32.12 O ATOM 1424 CB LYS A 135 -16.506 -8.482 0.345 1.00 74.13 C ATOM 1425 CG LYS A 135 -17.265 -8.652 1.648 1.00 12.15 C ATOM 1426 CD LYS A 135 -18.670 -8.081 1.554 1.00 5.23 C ATOM 1427 CE LYS A 135 -19.627 -8.798 2.493 1.00 3.12 C ATOM 1428 NZ LYS A 135 -21.048 -8.464 2.199 1.00 54.20 N ATOM 0 H LYS A 135 -15.049 -10.551 1.839 1.00 11.04 H new ATOM 0 HA LYS A 135 -14.653 -9.006 -0.614 1.00 22.32 H new ATOM 0 HB2 LYS A 135 -16.465 -7.422 0.094 1.00 74.13 H new ATOM 0 HB3 LYS A 135 -17.057 -8.978 -0.454 1.00 74.13 H new ATOM 0 HG2 LYS A 135 -17.318 -9.710 1.904 1.00 12.15 H new ATOM 0 HG3 LYS A 135 -16.723 -8.156 2.453 1.00 12.15 H new ATOM 0 HD2 LYS A 135 -18.649 -7.018 1.796 1.00 5.23 H new ATOM 0 HD3 LYS A 135 -19.031 -8.167 0.529 1.00 5.23 H new ATOM 0 HE2 LYS A 135 -19.482 -9.875 2.406 1.00 3.12 H new ATOM 0 HE3 LYS A 135 -19.396 -8.527 3.523 1.00 3.12 H new ATOM 0 HZ1 LYS A 135 -21.668 -8.973 2.861 1.00 54.20 H new ATOM 0 HZ2 LYS A 135 -21.193 -7.440 2.306 1.00 54.20 H new ATOM 0 HZ3 LYS A 135 -21.276 -8.746 1.224 1.00 54.20 H new ATOM 1438 N ALA A 136 -13.817 -7.014 0.825 1.00 11.11 N ATOM 1439 CA ALA A 136 -12.992 -6.103 1.608 1.00 21.11 C ATOM 1440 C ALA A 136 -13.775 -4.855 2.002 1.00 73.43 C ATOM 1441 O ALA A 136 -14.543 -4.314 1.206 1.00 52.34 O ATOM 1442 CB ALA A 136 -11.742 -5.721 0.830 1.00 12.20 C ATOM 0 H ALA A 136 -14.049 -6.675 -0.109 1.00 11.11 H new ATOM 0 HA ALA A 136 -12.694 -6.617 2.522 1.00 21.11 H new ATOM 0 HB1 ALA A 136 -11.136 -5.040 1.427 1.00 12.20 H new ATOM 0 HB2 ALA A 136 -11.165 -6.618 0.605 1.00 12.20 H new ATOM 0 HB3 ALA A 136 -12.028 -5.231 -0.100 1.00 12.20 H new ATOM 1448 N LEU A 137 -13.575 -4.401 3.234 1.00 54.20 N ATOM 1449 CA LEU A 137 -14.263 -3.215 3.734 1.00 15.23 C ATOM 1450 C LEU A 137 -13.274 -2.086 4.003 1.00 20.23 C ATOM 1451 O LEU A 137 -12.248 -2.285 4.654 1.00 73.21 O ATOM 1452 CB LEU A 137 -15.033 -3.551 5.013 1.00 65.42 C ATOM 1453 CG LEU A 137 -16.512 -3.161 5.027 1.00 53.12 C ATOM 1454 CD1 LEU A 137 -16.687 -1.713 4.598 1.00 14.14 C ATOM 1455 CD2 LEU A 137 -17.315 -4.087 4.126 1.00 53.13 C ATOM 0 H LEU A 137 -12.942 -4.836 3.906 1.00 54.20 H new ATOM 0 HA LEU A 137 -14.966 -2.882 2.971 1.00 15.23 H new ATOM 0 HB2 LEU A 137 -14.959 -4.625 5.187 1.00 65.42 H new ATOM 0 HB3 LEU A 137 -14.540 -3.058 5.851 1.00 65.42 H new ATOM 0 HG LEU A 137 -16.886 -3.263 6.046 1.00 53.12 H new ATOM 0 HD11 LEU A 137 -17.746 -1.454 4.614 1.00 14.14 H new ATOM 0 HD12 LEU A 137 -16.144 -1.062 5.283 1.00 14.14 H new ATOM 0 HD13 LEU A 137 -16.297 -1.583 3.588 1.00 14.14 H new ATOM 0 HD21 LEU A 137 -18.365 -3.795 4.148 1.00 53.13 H new ATOM 0 HD22 LEU A 137 -16.940 -4.017 3.105 1.00 53.13 H new ATOM 0 HD23 LEU A 137 -17.216 -5.114 4.479 1.00 53.13 H new ATOM 1466 N LYS A 138 -13.591 -0.897 3.500 1.00 11.40 N ATOM 1467 CA LYS A 138 -12.733 0.267 3.688 1.00 2.12 C ATOM 1468 C LYS A 138 -13.546 1.471 4.155 1.00 72.11 C ATOM 1469 O LYS A 138 -14.435 1.943 3.447 1.00 11.11 O ATOM 1470 CB LYS A 138 -12.003 0.604 2.387 1.00 62.53 C ATOM 1471 CG LYS A 138 -12.925 0.716 1.184 1.00 51.23 C ATOM 1472 CD LYS A 138 -12.614 1.952 0.356 1.00 21.44 C ATOM 1473 CE LYS A 138 -12.979 3.227 1.101 1.00 45.24 C ATOM 1474 NZ LYS A 138 -12.845 4.432 0.235 1.00 2.31 N ATOM 0 H LYS A 138 -14.436 -0.715 2.959 1.00 11.40 H new ATOM 0 HA LYS A 138 -11.998 0.026 4.456 1.00 2.12 H new ATOM 0 HB2 LYS A 138 -11.468 1.545 2.513 1.00 62.53 H new ATOM 0 HB3 LYS A 138 -11.255 -0.164 2.191 1.00 62.53 H new ATOM 0 HG2 LYS A 138 -12.824 -0.174 0.563 1.00 51.23 H new ATOM 0 HG3 LYS A 138 -13.961 0.754 1.521 1.00 51.23 H new ATOM 0 HD2 LYS A 138 -11.553 1.966 0.106 1.00 21.44 H new ATOM 0 HD3 LYS A 138 -13.163 1.909 -0.585 1.00 21.44 H new ATOM 0 HE2 LYS A 138 -14.003 3.154 1.466 1.00 45.24 H new ATOM 0 HE3 LYS A 138 -12.336 3.334 1.975 1.00 45.24 H new ATOM 0 HZ1 LYS A 138 -13.102 5.280 0.779 1.00 2.31 H new ATOM 0 HZ2 LYS A 138 -11.862 4.516 -0.093 1.00 2.31 H new ATOM 0 HZ3 LYS A 138 -13.477 4.342 -0.586 1.00 2.31 H new ATOM 1484 N ILE A 139 -13.233 1.963 5.348 1.00 1.25 N ATOM 1485 CA ILE A 139 -13.932 3.114 5.908 1.00 32.23 C ATOM 1486 C ILE A 139 -12.955 4.087 6.559 1.00 5.14 C ATOM 1487 O ILE A 139 -11.941 3.679 7.126 1.00 44.23 O ATOM 1488 CB ILE A 139 -14.982 2.683 6.949 1.00 74.43 C ATOM 1489 CG1 ILE A 139 -15.821 3.885 7.386 1.00 42.22 C ATOM 1490 CG2 ILE A 139 -14.304 2.039 8.149 1.00 72.41 C ATOM 1491 CD1 ILE A 139 -15.286 4.580 8.618 1.00 45.32 C ATOM 0 H ILE A 139 -12.500 1.583 5.946 1.00 1.25 H new ATOM 0 HA ILE A 139 -14.437 3.611 5.080 1.00 32.23 H new ATOM 0 HB ILE A 139 -15.645 1.948 6.493 1.00 74.43 H new ATOM 0 HG12 ILE A 139 -15.868 4.602 6.566 1.00 42.22 H new ATOM 0 HG13 ILE A 139 -16.841 3.554 7.580 1.00 42.22 H new ATOM 0 HG21 ILE A 139 -15.059 1.740 8.876 1.00 72.41 H new ATOM 0 HG22 ILE A 139 -13.745 1.161 7.824 1.00 72.41 H new ATOM 0 HG23 ILE A 139 -13.621 2.754 8.608 1.00 72.41 H new ATOM 0 HD11 ILE A 139 -15.931 5.422 8.870 1.00 45.32 H new ATOM 0 HD12 ILE A 139 -15.265 3.878 9.451 1.00 45.32 H new ATOM 0 HD13 ILE A 139 -14.277 4.942 8.422 1.00 45.32 H new ATOM 1502 N ASP A 140 -13.269 5.375 6.475 1.00 0.13 N ATOM 1503 CA ASP A 140 -12.421 6.408 7.060 1.00 51.53 C ATOM 1504 C ASP A 140 -12.782 6.644 8.522 1.00 21.02 C ATOM 1505 O ASP A 140 -13.836 7.204 8.831 1.00 21.21 O ATOM 1506 CB ASP A 140 -12.553 7.712 6.272 1.00 63.32 C ATOM 1507 CG ASP A 140 -11.477 8.717 6.632 1.00 63.54 C ATOM 1508 OD1 ASP A 140 -10.460 8.310 7.232 1.00 51.30 O ATOM 1509 OD2 ASP A 140 -11.651 9.912 6.311 1.00 11.23 O ATOM 0 H ASP A 140 -14.104 5.729 6.008 1.00 0.13 H new ATOM 0 HA ASP A 140 -11.387 6.066 7.011 1.00 51.53 H new ATOM 0 HB2 ASP A 140 -12.501 7.495 5.205 1.00 63.32 H new ATOM 0 HB3 ASP A 140 -13.533 8.150 6.461 1.00 63.32 H new ATOM 1513 N LEU A 141 -11.903 6.214 9.420 1.00 45.32 N ATOM 1514 CA LEU A 141 -12.129 6.377 10.853 1.00 62.12 C ATOM 1515 C LEU A 141 -11.401 7.609 11.382 1.00 44.14 C ATOM 1516 O LEU A 141 -10.307 7.939 10.925 1.00 4.13 O ATOM 1517 CB LEU A 141 -11.664 5.132 11.608 1.00 31.04 C ATOM 1518 CG LEU A 141 -12.415 4.810 12.900 1.00 23.04 C ATOM 1519 CD1 LEU A 141 -13.850 4.408 12.596 1.00 2.55 C ATOM 1520 CD2 LEU A 141 -11.702 3.710 13.672 1.00 51.15 C ATOM 0 H LEU A 141 -11.027 5.750 9.182 1.00 45.32 H new ATOM 0 HA LEU A 141 -13.198 6.513 11.014 1.00 62.12 H new ATOM 0 HB2 LEU A 141 -11.747 4.275 10.940 1.00 31.04 H new ATOM 0 HB3 LEU A 141 -10.607 5.250 11.846 1.00 31.04 H new ATOM 0 HG LEU A 141 -12.434 5.706 13.520 1.00 23.04 H new ATOM 0 HD11 LEU A 141 -14.370 4.182 13.527 1.00 2.55 H new ATOM 0 HD12 LEU A 141 -14.357 5.227 12.087 1.00 2.55 H new ATOM 0 HD13 LEU A 141 -13.853 3.526 11.956 1.00 2.55 H new ATOM 0 HD21 LEU A 141 -12.251 3.494 14.589 1.00 51.15 H new ATOM 0 HD22 LEU A 141 -11.651 2.810 13.059 1.00 51.15 H new ATOM 0 HD23 LEU A 141 -10.693 4.037 13.922 1.00 51.15 H new ATOM 1531 N MET A 142 -12.017 8.284 12.347 1.00 1.33 N ATOM 1532 CA MET A 142 -11.426 9.477 12.941 1.00 24.54 C ATOM 1533 C MET A 142 -11.882 9.649 14.386 1.00 45.02 C ATOM 1534 O MET A 142 -12.884 9.079 14.817 1.00 20.11 O ATOM 1535 CB MET A 142 -11.798 10.718 12.125 1.00 11.40 C ATOM 1536 CG MET A 142 -13.139 10.600 11.420 1.00 74.31 C ATOM 1537 SD MET A 142 -14.515 10.408 12.570 1.00 15.12 S ATOM 1538 CE MET A 142 -15.228 8.870 11.991 1.00 72.10 C ATOM 0 H MET A 142 -12.925 8.025 12.734 1.00 1.33 H new ATOM 0 HA MET A 142 -10.343 9.357 12.933 1.00 24.54 H new ATOM 0 HB2 MET A 142 -11.819 11.585 12.786 1.00 11.40 H new ATOM 0 HB3 MET A 142 -11.021 10.901 11.383 1.00 11.40 H new ATOM 0 HG2 MET A 142 -13.303 11.487 10.809 1.00 74.31 H new ATOM 0 HG3 MET A 142 -13.115 9.746 10.743 1.00 74.31 H new ATOM 0 HE1 MET A 142 -15.468 8.236 12.845 1.00 72.10 H new ATOM 0 HE2 MET A 142 -16.138 9.080 11.428 1.00 72.10 H new ATOM 0 HE3 MET A 142 -14.513 8.357 11.347 1.00 72.10 H new ATOM 1546 N PRO A 143 -11.132 10.455 15.153 1.00 1.42 N ATOM 1547 CA PRO A 143 -11.441 10.720 16.561 1.00 14.24 C ATOM 1548 C PRO A 143 -12.697 11.569 16.729 1.00 11.20 C ATOM 1549 O PRO A 143 -13.406 11.845 15.760 1.00 14.32 O ATOM 1550 CB PRO A 143 -10.210 11.483 17.057 1.00 13.54 C ATOM 1551 CG PRO A 143 -9.640 12.117 15.836 1.00 64.02 C ATOM 1552 CD PRO A 143 -9.924 11.167 14.705 1.00 23.51 C ATOM 0 HA PRO A 143 -11.642 9.802 17.114 1.00 14.24 H new ATOM 0 HB2 PRO A 143 -10.482 12.231 17.802 1.00 13.54 H new ATOM 0 HB3 PRO A 143 -9.491 10.812 17.527 1.00 13.54 H new ATOM 0 HG2 PRO A 143 -10.096 13.090 15.652 1.00 64.02 H new ATOM 0 HG3 PRO A 143 -8.568 12.283 15.946 1.00 64.02 H new ATOM 0 HD2 PRO A 143 -10.094 11.697 13.768 1.00 23.51 H new ATOM 0 HD3 PRO A 143 -9.093 10.482 14.537 1.00 23.51 H new ATOM 1557 N HIS A 144 -12.967 11.980 17.964 1.00 22.22 N ATOM 1558 CA HIS A 144 -14.137 12.799 18.257 1.00 25.21 C ATOM 1559 C HIS A 144 -13.818 14.282 18.094 1.00 41.34 C ATOM 1560 O HIS A 144 -14.080 15.086 18.988 1.00 11.51 O ATOM 1561 CB HIS A 144 -14.633 12.526 19.678 1.00 53.24 C ATOM 1562 CG HIS A 144 -15.271 11.181 19.841 1.00 60.12 C ATOM 1563 ND1 HIS A 144 -16.583 11.012 20.234 1.00 71.12 N ATOM 1564 CD2 HIS A 144 -14.772 9.936 19.660 1.00 61.22 C ATOM 1565 CE1 HIS A 144 -16.861 9.722 20.290 1.00 22.21 C ATOM 1566 NE2 HIS A 144 -15.779 9.048 19.946 1.00 52.51 N ATOM 0 H HIS A 144 -12.392 11.759 18.777 1.00 22.22 H new ATOM 0 HA HIS A 144 -14.922 12.534 17.548 1.00 25.21 H new ATOM 0 HB2 HIS A 144 -13.794 12.607 20.369 1.00 53.24 H new ATOM 0 HB3 HIS A 144 -15.352 13.296 19.958 1.00 53.24 H new ATOM 0 HD2 HIS A 144 -13.768 9.687 19.348 1.00 61.22 H new ATOM 0 HE1 HIS A 144 -17.811 9.292 20.570 1.00 22.21 H new ATOM 0 HE2 HIS A 144 -15.704 8.032 19.900 1.00 52.51 H new ATOM 1930 N THR A 169 -15.615 12.042 6.285 1.00 64.51 N ATOM 1931 CA THR A 169 -15.374 10.607 6.211 1.00 10.55 C ATOM 1932 C THR A 169 -16.245 9.957 5.142 1.00 5.44 C ATOM 1933 O THR A 169 -15.761 9.588 4.074 1.00 33.11 O ATOM 1934 CB THR A 169 -15.644 9.922 7.565 1.00 31.32 C ATOM 1935 OG1 THR A 169 -16.769 10.531 8.206 1.00 63.04 O ATOM 1936 CG2 THR A 169 -14.426 10.015 8.471 1.00 21.54 C ATOM 0 HA THR A 169 -14.324 10.476 5.948 1.00 10.55 H new ATOM 0 HB THR A 169 -15.858 8.870 7.378 1.00 31.32 H new ATOM 0 HG1 THR A 169 -16.885 11.443 7.866 1.00 63.04 H new ATOM 0 HG21 THR A 169 -14.641 9.525 9.421 1.00 21.54 H new ATOM 0 HG22 THR A 169 -13.578 9.524 7.993 1.00 21.54 H new ATOM 0 HG23 THR A 169 -14.185 11.063 8.650 1.00 21.54 H new ATOM 1944 N GLY A 170 -17.534 9.820 5.439 1.00 51.43 N ATOM 1945 CA GLY A 170 -18.453 9.214 4.493 1.00 22.32 C ATOM 1946 C GLY A 170 -18.785 7.778 4.845 1.00 73.31 C ATOM 1947 O GLY A 170 -18.234 7.204 5.784 1.00 55.43 O ATOM 0 H GLY A 170 -17.958 10.118 6.318 1.00 51.43 H new ATOM 0 HA2 GLY A 170 -19.373 9.798 4.459 1.00 22.32 H new ATOM 0 HA3 GLY A 170 -18.017 9.248 3.495 1.00 22.32 H new ATOM 1951 N PRO A 171 -19.707 7.175 4.080 1.00 21.40 N ATOM 1952 CA PRO A 171 -20.133 5.790 4.298 1.00 63.24 C ATOM 1953 C PRO A 171 -19.042 4.785 3.944 1.00 2.13 C ATOM 1954 O PRO A 171 -18.139 5.084 3.163 1.00 50.32 O ATOM 1955 CB PRO A 171 -21.328 5.634 3.355 1.00 63.44 C ATOM 1956 CG PRO A 171 -21.099 6.642 2.282 1.00 22.22 C ATOM 1957 CD PRO A 171 -20.404 7.799 2.943 1.00 24.31 C ATOM 0 HA PRO A 171 -20.369 5.597 5.344 1.00 63.24 H new ATOM 0 HB2 PRO A 171 -21.380 4.625 2.946 1.00 63.44 H new ATOM 0 HB3 PRO A 171 -22.269 5.816 3.875 1.00 63.44 H new ATOM 0 HG2 PRO A 171 -20.489 6.227 1.480 1.00 22.22 H new ATOM 0 HG3 PRO A 171 -22.042 6.957 1.835 1.00 22.22 H new ATOM 0 HD2 PRO A 171 -19.706 8.289 2.264 1.00 24.31 H new ATOM 0 HD3 PRO A 171 -21.113 8.558 3.274 1.00 24.31 H new ATOM 1962 N ALA A 172 -19.131 3.592 4.525 1.00 64.44 N ATOM 1963 CA ALA A 172 -18.152 2.543 4.268 1.00 24.11 C ATOM 1964 C ALA A 172 -18.283 2.006 2.848 1.00 61.34 C ATOM 1965 O ALA A 172 -19.373 1.989 2.278 1.00 64.34 O ATOM 1966 CB ALA A 172 -18.310 1.416 5.279 1.00 72.55 C ATOM 0 H ALA A 172 -19.871 3.329 5.176 1.00 64.44 H new ATOM 0 HA ALA A 172 -17.157 2.974 4.374 1.00 24.11 H new ATOM 0 HB1 ALA A 172 -17.573 0.639 5.076 1.00 72.55 H new ATOM 0 HB2 ALA A 172 -18.158 1.806 6.285 1.00 72.55 H new ATOM 0 HB3 ALA A 172 -19.312 0.995 5.201 1.00 72.55 H new ATOM 1972 N VAL A 173 -17.163 1.567 2.281 1.00 62.13 N ATOM 1973 CA VAL A 173 -17.153 1.029 0.926 1.00 42.10 C ATOM 1974 C VAL A 173 -16.696 -0.426 0.917 1.00 51.14 C ATOM 1975 O VAL A 173 -15.646 -0.760 1.465 1.00 51.12 O ATOM 1976 CB VAL A 173 -16.234 1.849 0.002 1.00 60.52 C ATOM 1977 CG1 VAL A 173 -16.375 1.386 -1.440 1.00 62.52 C ATOM 1978 CG2 VAL A 173 -16.543 3.334 0.127 1.00 64.35 C ATOM 0 H VAL A 173 -16.252 1.574 2.739 1.00 62.13 H new ATOM 0 HA VAL A 173 -18.176 1.089 0.554 1.00 42.10 H new ATOM 0 HB VAL A 173 -15.201 1.688 0.310 1.00 60.52 H new ATOM 0 HG11 VAL A 173 -15.718 1.977 -2.078 1.00 62.52 H new ATOM 0 HG12 VAL A 173 -16.101 0.334 -1.513 1.00 62.52 H new ATOM 0 HG13 VAL A 173 -17.408 1.515 -1.764 1.00 62.52 H new ATOM 0 HG21 VAL A 173 -15.885 3.899 -0.533 1.00 64.35 H new ATOM 0 HG22 VAL A 173 -17.581 3.515 -0.154 1.00 64.35 H new ATOM 0 HG23 VAL A 173 -16.385 3.653 1.157 1.00 64.35 H new ATOM 1988 N GLU A 174 -17.492 -1.287 0.290 1.00 71.44 N ATOM 1989 CA GLU A 174 -17.169 -2.706 0.210 1.00 62.34 C ATOM 1990 C GLU A 174 -16.834 -3.108 -1.224 1.00 71.14 C ATOM 1991 O GLU A 174 -17.393 -2.568 -2.179 1.00 25.34 O ATOM 1992 CB GLU A 174 -18.337 -3.548 0.727 1.00 21.24 C ATOM 1993 CG GLU A 174 -19.697 -3.056 0.259 1.00 22.33 C ATOM 1994 CD GLU A 174 -19.894 -3.223 -1.236 1.00 4.40 C ATOM 1995 OE1 GLU A 174 -19.554 -4.304 -1.761 1.00 24.31 O ATOM 1996 OE2 GLU A 174 -20.390 -2.274 -1.878 1.00 71.40 O ATOM 0 H GLU A 174 -18.365 -1.026 -0.169 1.00 71.44 H new ATOM 0 HA GLU A 174 -16.294 -2.889 0.834 1.00 62.34 H new ATOM 0 HB2 GLU A 174 -18.202 -4.580 0.402 1.00 21.24 H new ATOM 0 HB3 GLU A 174 -18.317 -3.552 1.817 1.00 21.24 H new ATOM 0 HG2 GLU A 174 -20.479 -3.601 0.788 1.00 22.33 H new ATOM 0 HG3 GLU A 174 -19.809 -2.004 0.521 1.00 22.33 H new ATOM 2001 N VAL A 175 -15.918 -4.060 -1.368 1.00 65.12 N ATOM 2002 CA VAL A 175 -15.509 -4.536 -2.683 1.00 60.23 C ATOM 2003 C VAL A 175 -15.095 -6.002 -2.634 1.00 64.21 C ATOM 2004 O VAL A 175 -14.248 -6.392 -1.829 1.00 63.34 O ATOM 2005 CB VAL A 175 -14.340 -3.702 -3.243 1.00 14.22 C ATOM 2006 CG1 VAL A 175 -13.951 -4.190 -4.630 1.00 50.45 C ATOM 2007 CG2 VAL A 175 -14.705 -2.225 -3.270 1.00 13.23 C ATOM 0 H VAL A 175 -15.445 -4.517 -0.589 1.00 65.12 H new ATOM 0 HA VAL A 175 -16.372 -4.428 -3.341 1.00 60.23 H new ATOM 0 HB VAL A 175 -13.479 -3.828 -2.586 1.00 14.22 H new ATOM 0 HG11 VAL A 175 -13.124 -3.589 -5.009 1.00 50.45 H new ATOM 0 HG12 VAL A 175 -13.645 -5.235 -4.576 1.00 50.45 H new ATOM 0 HG13 VAL A 175 -14.805 -4.096 -5.301 1.00 50.45 H new ATOM 0 HG21 VAL A 175 -13.868 -1.651 -3.668 1.00 13.23 H new ATOM 0 HG22 VAL A 175 -15.580 -2.078 -3.903 1.00 13.23 H new ATOM 0 HG23 VAL A 175 -14.928 -1.887 -2.258 1.00 13.23 H new ATOM 2017 N ASP A 176 -15.697 -6.810 -3.499 1.00 31.12 N ATOM 2018 CA ASP A 176 -15.390 -8.235 -3.556 1.00 41.53 C ATOM 2019 C ASP A 176 -13.891 -8.461 -3.720 1.00 14.45 C ATOM 2020 O ASP A 176 -13.207 -7.697 -4.402 1.00 52.24 O ATOM 2021 CB ASP A 176 -16.147 -8.896 -4.708 1.00 2.41 C ATOM 2022 CG ASP A 176 -17.650 -8.869 -4.505 1.00 31.15 C ATOM 2023 OD1 ASP A 176 -18.383 -8.783 -5.511 1.00 34.30 O ATOM 2024 OD2 ASP A 176 -18.092 -8.932 -3.339 1.00 4.34 O ATOM 0 H ASP A 176 -16.401 -6.503 -4.171 1.00 31.12 H new ATOM 0 HA ASP A 176 -15.707 -8.688 -2.617 1.00 41.53 H new ATOM 0 HB2 ASP A 176 -15.900 -8.388 -5.640 1.00 2.41 H new ATOM 0 HB3 ASP A 176 -15.816 -9.929 -4.811 1.00 2.41 H new ATOM 2028 N VAL A 177 -13.384 -9.516 -3.090 1.00 13.45 N ATOM 2029 CA VAL A 177 -11.965 -9.844 -3.165 1.00 62.12 C ATOM 2030 C VAL A 177 -11.488 -9.888 -4.613 1.00 43.22 C ATOM 2031 O VAL A 177 -10.330 -9.592 -4.906 1.00 72.10 O ATOM 2032 CB VAL A 177 -11.666 -11.198 -2.496 1.00 15.43 C ATOM 2033 CG1 VAL A 177 -12.269 -12.338 -3.303 1.00 5.23 C ATOM 2034 CG2 VAL A 177 -10.166 -11.389 -2.328 1.00 15.11 C ATOM 0 H VAL A 177 -13.935 -10.159 -2.521 1.00 13.45 H new ATOM 0 HA VAL A 177 -11.429 -9.058 -2.632 1.00 62.12 H new ATOM 0 HB VAL A 177 -12.124 -11.203 -1.507 1.00 15.43 H new ATOM 0 HG11 VAL A 177 -12.047 -13.287 -2.814 1.00 5.23 H new ATOM 0 HG12 VAL A 177 -13.349 -12.207 -3.367 1.00 5.23 H new ATOM 0 HG13 VAL A 177 -11.843 -12.338 -4.306 1.00 5.23 H new ATOM 0 HG21 VAL A 177 -9.973 -12.351 -1.854 1.00 15.11 H new ATOM 0 HG22 VAL A 177 -9.684 -11.363 -3.305 1.00 15.11 H new ATOM 0 HG23 VAL A 177 -9.765 -10.590 -1.704 1.00 15.11 H new ATOM 2044 N LYS A 178 -12.389 -10.260 -5.515 1.00 52.35 N ATOM 2045 CA LYS A 178 -12.063 -10.342 -6.935 1.00 24.32 C ATOM 2046 C LYS A 178 -12.161 -8.971 -7.596 1.00 1.04 C ATOM 2047 O LYS A 178 -11.385 -8.647 -8.495 1.00 11.23 O ATOM 2048 CB LYS A 178 -12.999 -11.327 -7.638 1.00 74.32 C ATOM 2049 CG LYS A 178 -14.470 -10.980 -7.491 1.00 20.11 C ATOM 2050 CD LYS A 178 -15.028 -10.363 -8.763 1.00 13.32 C ATOM 2051 CE LYS A 178 -15.576 -11.426 -9.703 1.00 31.55 C ATOM 2052 NZ LYS A 178 -17.006 -11.729 -9.424 1.00 14.12 N ATOM 0 H LYS A 178 -13.352 -10.510 -5.289 1.00 52.35 H new ATOM 0 HA LYS A 178 -11.037 -10.697 -7.027 1.00 24.32 H new ATOM 0 HB2 LYS A 178 -12.747 -11.361 -8.698 1.00 74.32 H new ATOM 0 HB3 LYS A 178 -12.828 -12.326 -7.237 1.00 74.32 H new ATOM 0 HG2 LYS A 178 -15.034 -11.880 -7.244 1.00 20.11 H new ATOM 0 HG3 LYS A 178 -14.600 -10.285 -6.661 1.00 20.11 H new ATOM 0 HD2 LYS A 178 -15.819 -9.657 -8.510 1.00 13.32 H new ATOM 0 HD3 LYS A 178 -14.245 -9.797 -9.268 1.00 13.32 H new ATOM 0 HE2 LYS A 178 -15.471 -11.088 -10.734 1.00 31.55 H new ATOM 0 HE3 LYS A 178 -14.986 -12.337 -9.604 1.00 31.55 H new ATOM 0 HZ1 LYS A 178 -17.342 -12.458 -10.086 1.00 14.12 H new ATOM 0 HZ2 LYS A 178 -17.103 -12.076 -8.448 1.00 14.12 H new ATOM 0 HZ3 LYS A 178 -17.573 -10.866 -9.543 1.00 14.12 H new ATOM 2062 N ASP A 179 -13.118 -8.168 -7.143 1.00 31.05 N ATOM 2063 CA ASP A 179 -13.315 -6.830 -7.689 1.00 1.51 C ATOM 2064 C ASP A 179 -12.087 -5.958 -7.447 1.00 32.32 C ATOM 2065 O ASP A 179 -11.570 -5.328 -8.371 1.00 11.21 O ATOM 2066 CB ASP A 179 -14.550 -6.178 -7.063 1.00 31.44 C ATOM 2067 CG ASP A 179 -15.832 -6.575 -7.766 1.00 41.02 C ATOM 2068 OD1 ASP A 179 -15.810 -6.717 -9.007 1.00 51.20 O ATOM 2069 OD2 ASP A 179 -16.859 -6.745 -7.075 1.00 63.21 O ATOM 0 H ASP A 179 -13.769 -8.420 -6.399 1.00 31.05 H new ATOM 0 HA ASP A 179 -13.467 -6.922 -8.764 1.00 1.51 H new ATOM 0 HB2 ASP A 179 -14.613 -6.460 -6.012 1.00 31.44 H new ATOM 0 HB3 ASP A 179 -14.441 -5.094 -7.096 1.00 31.44 H new ATOM 2073 N ILE A 180 -11.626 -5.926 -6.202 1.00 23.14 N ATOM 2074 CA ILE A 180 -10.458 -5.131 -5.840 1.00 75.53 C ATOM 2075 C ILE A 180 -9.270 -5.461 -6.737 1.00 32.33 C ATOM 2076 O ILE A 180 -9.172 -6.549 -7.306 1.00 50.13 O ATOM 2077 CB ILE A 180 -10.057 -5.356 -4.371 1.00 13.15 C ATOM 2078 CG1 ILE A 180 -10.026 -6.853 -4.052 1.00 31.11 C ATOM 2079 CG2 ILE A 180 -11.019 -4.632 -3.442 1.00 24.11 C ATOM 2080 CD1 ILE A 180 -9.191 -7.194 -2.837 1.00 14.51 C ATOM 0 H ILE A 180 -12.043 -6.441 -5.426 1.00 23.14 H new ATOM 0 HA ILE A 180 -10.733 -4.085 -5.976 1.00 75.53 H new ATOM 0 HB ILE A 180 -9.058 -4.949 -4.216 1.00 13.15 H new ATOM 0 HG12 ILE A 180 -11.046 -7.204 -3.892 1.00 31.11 H new ATOM 0 HG13 ILE A 180 -9.635 -7.392 -4.915 1.00 31.11 H new ATOM 0 HG21 ILE A 180 -10.722 -4.801 -2.407 1.00 24.11 H new ATOM 0 HG22 ILE A 180 -10.997 -3.563 -3.656 1.00 24.11 H new ATOM 0 HG23 ILE A 180 -12.029 -5.012 -3.596 1.00 24.11 H new ATOM 0 HD11 ILE A 180 -9.214 -8.271 -2.670 1.00 14.51 H new ATOM 0 HD12 ILE A 180 -8.162 -6.874 -3.001 1.00 14.51 H new ATOM 0 HD13 ILE A 180 -9.595 -6.683 -1.963 1.00 14.51 H new