USER MOD reduce.3.24.130724 H: found=0, std=0, add=434, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 435 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 : A1054 SER OG : rot -21:sc= 0.248 USER MOD Single : A1055 ASN : amide:sc= -0.375 X(o=-0.38,f=0) USER MOD Single : A1060 TYR OH : rot 180:sc= 0 USER MOD Single : A1062 LYS NZ :NH3+ -158:sc= -0.0858 (180deg=-0.645) USER MOD Single : A1063 GLN : amide:sc= -1.73 K(o=-1.7,f=-0.87) USER MOD Single : A1064 MET CE :methyl -136:sc= -1.77 (180deg=-5.86!) USER MOD Single : A1066 TYR OH : rot 180:sc= 0 USER MOD Single : A1068 TYR OH : rot 180:sc= 0 USER MOD Single : A1071 SER OG : rot -37:sc= 0.321 USER MOD Single : A1087 TYR OH : rot 180:sc= 0 USER MOD Single : A1088 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1093 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 ASN : amide:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A1097 LYS NZ :NH3+ -162:sc=-0.00832 (180deg=-0.186) USER MOD Single : A1099 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A1054 -9.248 -8.187 0.744 1.00 53.21 N ATOM 2 CA SER A1054 -8.162 -7.607 1.524 1.00 65.54 C ATOM 3 C SER A1054 -6.901 -8.458 1.418 1.00 75.41 C ATOM 4 O SER A1054 -6.576 -9.223 2.325 1.00 45.42 O ATOM 5 CB SER A1054 -8.577 -7.471 2.991 1.00 64.12 C ATOM 6 OG SER A1054 -9.205 -8.653 3.455 1.00 34.42 O ATOM 0 HA SER A1054 -7.946 -6.618 1.120 1.00 65.54 H new ATOM 0 HB2 SER A1054 -7.700 -7.258 3.602 1.00 64.12 H new ATOM 0 HB3 SER A1054 -9.257 -6.626 3.103 1.00 64.12 H new ATOM 0 HG SER A1054 -9.536 -9.169 2.691 1.00 34.42 H new ATOM 12 N ASN A1055 -6.194 -8.320 0.301 1.00 51.32 N ATOM 13 CA ASN A1055 -4.968 -9.076 0.073 1.00 20.24 C ATOM 14 C ASN A1055 -3.786 -8.423 0.783 1.00 63.41 C ATOM 15 O ASN A1055 -3.032 -9.088 1.495 1.00 3.41 O ATOM 16 CB ASN A1055 -4.681 -9.183 -1.425 1.00 52.11 C ATOM 17 CG ASN A1055 -5.373 -10.371 -2.064 1.00 13.03 C ATOM 18 OD1 ASN A1055 -4.750 -11.160 -2.775 1.00 24.12 O ATOM 19 ND2 ASN A1055 -6.671 -10.505 -1.813 1.00 44.13 N ATOM 0 H ASN A1055 -6.449 -7.691 -0.461 1.00 51.32 H new ATOM 0 HA ASN A1055 -5.107 -10.077 0.482 1.00 20.24 H new ATOM 0 HB2 ASN A1055 -5.005 -8.268 -1.920 1.00 52.11 H new ATOM 0 HB3 ASN A1055 -3.605 -9.266 -1.581 1.00 52.11 H new ATOM 0 HD21 ASN A1055 -7.190 -11.285 -2.215 1.00 44.13 H new ATOM 0 HD22 ASN A1055 -7.148 -9.828 -1.218 1.00 44.13 H new ATOM 26 N ALA A1056 -3.631 -7.118 0.587 1.00 32.22 N ATOM 27 CA ALA A1056 -2.544 -6.375 1.210 1.00 74.14 C ATOM 28 C ALA A1056 -2.929 -5.909 2.610 1.00 54.25 C ATOM 29 O ALA A1056 -4.044 -5.438 2.833 1.00 12.30 O ATOM 30 CB ALA A1056 -2.153 -5.186 0.344 1.00 23.33 C ATOM 0 H ALA A1056 -4.246 -6.553 0.001 1.00 32.22 H new ATOM 0 HA ALA A1056 -1.686 -7.042 1.301 1.00 74.14 H new ATOM 0 HB1 ALA A1056 -1.340 -4.640 0.822 1.00 23.33 H new ATOM 0 HB2 ALA A1056 -1.827 -5.540 -0.634 1.00 23.33 H new ATOM 0 HB3 ALA A1056 -3.012 -4.526 0.223 1.00 23.33 H new ATOM 36 N ASP A1057 -2.000 -6.044 3.549 1.00 64.12 N ATOM 37 CA ASP A1057 -2.243 -5.636 4.929 1.00 54.21 C ATOM 38 C ASP A1057 -0.964 -5.729 5.756 1.00 70.11 C ATOM 39 O ASP A1057 -0.417 -6.814 5.953 1.00 12.23 O ATOM 40 CB ASP A1057 -3.334 -6.504 5.555 1.00 31.55 C ATOM 41 CG ASP A1057 -3.255 -7.949 5.103 1.00 24.31 C ATOM 42 OD1 ASP A1057 -2.251 -8.617 5.426 1.00 22.20 O ATOM 43 OD2 ASP A1057 -4.197 -8.412 4.427 1.00 14.40 O ATOM 0 H ASP A1057 -1.072 -6.432 3.381 1.00 64.12 H new ATOM 0 HA ASP A1057 -2.575 -4.598 4.922 1.00 54.21 H new ATOM 0 HB2 ASP A1057 -3.250 -6.461 6.641 1.00 31.55 H new ATOM 0 HB3 ASP A1057 -4.311 -6.098 5.295 1.00 31.55 H new ATOM 48 N VAL A1058 -0.492 -4.583 6.237 1.00 71.31 N ATOM 49 CA VAL A1058 0.722 -4.535 7.044 1.00 15.31 C ATOM 50 C VAL A1058 1.777 -5.497 6.506 1.00 52.45 C ATOM 51 O VAL A1058 2.489 -6.146 7.272 1.00 12.54 O ATOM 52 CB VAL A1058 0.433 -4.880 8.516 1.00 11.12 C ATOM 53 CG1 VAL A1058 -0.035 -6.322 8.645 1.00 62.34 C ATOM 54 CG2 VAL A1058 1.664 -4.631 9.374 1.00 51.51 C ATOM 0 H VAL A1058 -0.932 -3.676 6.082 1.00 71.31 H new ATOM 0 HA VAL A1058 1.100 -3.514 6.986 1.00 15.31 H new ATOM 0 HB VAL A1058 -0.367 -4.231 8.873 1.00 11.12 H new ATOM 0 HG11 VAL A1058 -0.234 -6.547 9.693 1.00 62.34 H new ATOM 0 HG12 VAL A1058 -0.946 -6.462 8.064 1.00 62.34 H new ATOM 0 HG13 VAL A1058 0.740 -6.991 8.271 1.00 62.34 H new ATOM 0 HG21 VAL A1058 1.441 -4.880 10.411 1.00 51.51 H new ATOM 0 HG22 VAL A1058 2.486 -5.253 9.020 1.00 51.51 H new ATOM 0 HG23 VAL A1058 1.948 -3.581 9.306 1.00 51.51 H new ATOM 64 N VAL A1059 1.873 -5.581 5.183 1.00 70.03 N ATOM 65 CA VAL A1059 2.842 -6.462 4.542 1.00 15.23 C ATOM 66 C VAL A1059 4.268 -6.080 4.922 1.00 61.35 C ATOM 67 O VAL A1059 5.180 -6.906 4.868 1.00 10.55 O ATOM 68 CB VAL A1059 2.706 -6.425 3.008 1.00 1.13 C ATOM 69 CG1 VAL A1059 3.725 -7.348 2.358 1.00 43.02 C ATOM 70 CG2 VAL A1059 1.292 -6.802 2.591 1.00 33.01 C ATOM 0 H VAL A1059 1.292 -5.050 4.534 1.00 70.03 H new ATOM 0 HA VAL A1059 2.632 -7.472 4.895 1.00 15.23 H new ATOM 0 HB VAL A1059 2.904 -5.409 2.668 1.00 1.13 H new ATOM 0 HG11 VAL A1059 3.613 -7.308 1.275 1.00 43.02 H new ATOM 0 HG12 VAL A1059 4.731 -7.029 2.631 1.00 43.02 H new ATOM 0 HG13 VAL A1059 3.562 -8.369 2.702 1.00 43.02 H new ATOM 0 HG21 VAL A1059 1.213 -6.771 1.504 1.00 33.01 H new ATOM 0 HG22 VAL A1059 1.065 -7.808 2.943 1.00 33.01 H new ATOM 0 HG23 VAL A1059 0.584 -6.097 3.027 1.00 33.01 H new ATOM 80 N TYR A1060 4.454 -4.823 5.310 1.00 54.30 N ATOM 81 CA TYR A1060 5.770 -4.330 5.699 1.00 1.01 C ATOM 82 C TYR A1060 6.072 -4.674 7.154 1.00 42.54 C ATOM 83 O TYR A1060 6.371 -3.794 7.962 1.00 52.21 O ATOM 84 CB TYR A1060 5.853 -2.816 5.493 1.00 30.34 C ATOM 85 CG TYR A1060 6.022 -2.411 4.046 1.00 1.24 C ATOM 86 CD1 TYR A1060 4.951 -2.455 3.161 1.00 23.52 C ATOM 87 CD2 TYR A1060 7.252 -1.985 3.562 1.00 63.23 C ATOM 88 CE1 TYR A1060 5.100 -2.086 1.839 1.00 34.22 C ATOM 89 CE2 TYR A1060 7.412 -1.613 2.241 1.00 4.21 C ATOM 90 CZ TYR A1060 6.332 -1.666 1.384 1.00 43.43 C ATOM 91 OH TYR A1060 6.487 -1.297 0.067 1.00 24.01 O ATOM 0 H TYR A1060 3.710 -4.127 5.363 1.00 54.30 H new ATOM 0 HA TYR A1060 6.513 -4.817 5.067 1.00 1.01 H new ATOM 0 HB2 TYR A1060 4.948 -2.354 5.888 1.00 30.34 H new ATOM 0 HB3 TYR A1060 6.690 -2.424 6.071 1.00 30.34 H new ATOM 0 HD1 TYR A1060 3.985 -2.784 3.514 1.00 23.52 H new ATOM 0 HD2 TYR A1060 8.099 -1.944 4.231 1.00 63.23 H new ATOM 0 HE1 TYR A1060 4.257 -2.126 1.165 1.00 34.22 H new ATOM 0 HE2 TYR A1060 8.376 -1.283 1.882 1.00 4.21 H new ATOM 0 HH TYR A1060 7.416 -1.026 -0.090 1.00 24.01 H new ATOM 101 N GLU A1061 5.992 -5.960 7.481 1.00 42.35 N ATOM 102 CA GLU A1061 6.256 -6.420 8.839 1.00 43.33 C ATOM 103 C GLU A1061 6.235 -7.944 8.911 1.00 61.11 C ATOM 104 O GLU A1061 5.766 -8.614 7.991 1.00 54.24 O ATOM 105 CB GLU A1061 5.225 -5.838 9.809 1.00 54.51 C ATOM 106 CG GLU A1061 5.633 -5.946 11.268 1.00 72.13 C ATOM 107 CD GLU A1061 7.025 -5.401 11.526 1.00 5.10 C ATOM 108 OE1 GLU A1061 7.197 -4.165 11.479 1.00 31.12 O ATOM 109 OE2 GLU A1061 7.942 -6.212 11.777 1.00 11.21 O ATOM 0 H GLU A1061 5.747 -6.701 6.824 1.00 42.35 H new ATOM 0 HA GLU A1061 7.249 -6.074 9.125 1.00 43.33 H new ATOM 0 HB2 GLU A1061 5.059 -4.789 9.564 1.00 54.51 H new ATOM 0 HB3 GLU A1061 4.275 -6.352 9.667 1.00 54.51 H new ATOM 0 HG2 GLU A1061 4.915 -5.404 11.883 1.00 72.13 H new ATOM 0 HG3 GLU A1061 5.593 -6.991 11.576 1.00 72.13 H new ATOM 116 N LYS A1062 6.746 -8.486 10.012 1.00 54.04 N ATOM 117 CA LYS A1062 6.786 -9.930 10.206 1.00 55.04 C ATOM 118 C LYS A1062 5.458 -10.442 10.754 1.00 30.31 C ATOM 119 O LYS A1062 5.341 -10.740 11.943 1.00 63.44 O ATOM 120 CB LYS A1062 7.922 -10.306 11.160 1.00 54.31 C ATOM 121 CG LYS A1062 9.304 -9.994 10.612 1.00 40.21 C ATOM 122 CD LYS A1062 10.398 -10.468 11.554 1.00 62.31 C ATOM 123 CE LYS A1062 11.772 -10.372 10.907 1.00 12.13 C ATOM 124 NZ LYS A1062 11.851 -11.174 9.655 1.00 54.22 N ATOM 0 H LYS A1062 7.138 -7.946 10.783 1.00 54.04 H new ATOM 0 HA LYS A1062 6.964 -10.397 9.237 1.00 55.04 H new ATOM 0 HB2 LYS A1062 7.785 -9.775 12.102 1.00 54.31 H new ATOM 0 HB3 LYS A1062 7.861 -11.371 11.383 1.00 54.31 H new ATOM 0 HG2 LYS A1062 9.427 -10.472 9.640 1.00 40.21 H new ATOM 0 HG3 LYS A1062 9.399 -8.920 10.453 1.00 40.21 H new ATOM 0 HD2 LYS A1062 10.381 -9.868 12.464 1.00 62.31 H new ATOM 0 HD3 LYS A1062 10.205 -11.500 11.848 1.00 62.31 H new ATOM 0 HE2 LYS A1062 11.997 -9.329 10.685 1.00 12.13 H new ATOM 0 HE3 LYS A1062 12.530 -10.719 11.610 1.00 12.13 H new ATOM 0 HZ1 LYS A1062 12.846 -11.395 9.446 1.00 54.22 H new ATOM 0 HZ2 LYS A1062 11.318 -12.059 9.775 1.00 54.22 H new ATOM 0 HZ3 LYS A1062 11.445 -10.629 8.868 1.00 54.22 H new ATOM 138 N GLN A1063 4.462 -10.543 9.881 1.00 15.15 N ATOM 139 CA GLN A1063 3.142 -11.021 10.279 1.00 62.14 C ATOM 140 C GLN A1063 3.252 -12.301 11.101 1.00 42.40 C ATOM 141 O GLN A1063 2.374 -12.609 11.907 1.00 55.32 O ATOM 142 CB GLN A1063 2.272 -11.266 9.045 1.00 63.01 C ATOM 143 CG GLN A1063 1.814 -9.989 8.360 1.00 23.14 C ATOM 144 CD GLN A1063 0.455 -9.522 8.845 1.00 44.15 C ATOM 145 OE1 GLN A1063 -0.544 -9.640 8.136 1.00 23.10 O ATOM 146 NE2 GLN A1063 0.412 -8.987 10.060 1.00 54.22 N ATOM 0 H GLN A1063 4.543 -10.301 8.894 1.00 15.15 H new ATOM 0 HA GLN A1063 2.676 -10.253 10.897 1.00 62.14 H new ATOM 0 HB2 GLN A1063 2.831 -11.871 8.331 1.00 63.01 H new ATOM 0 HB3 GLN A1063 1.396 -11.846 9.337 1.00 63.01 H new ATOM 0 HG2 GLN A1063 2.548 -9.203 8.536 1.00 23.14 H new ATOM 0 HG3 GLN A1063 1.775 -10.153 7.283 1.00 23.14 H new ATOM 0 HE21 GLN A1063 1.265 -8.909 10.613 1.00 54.22 H new ATOM 0 HE22 GLN A1063 -0.474 -8.654 10.440 1.00 54.22 H new ATOM 155 N MET A1064 4.335 -13.042 10.892 1.00 50.24 N ATOM 156 CA MET A1064 4.559 -14.288 11.615 1.00 21.00 C ATOM 157 C MET A1064 3.430 -15.280 11.353 1.00 12.42 C ATOM 158 O MET A1064 3.220 -16.215 12.125 1.00 72.14 O ATOM 159 CB MET A1064 4.677 -14.018 13.117 1.00 3.34 C ATOM 160 CG MET A1064 5.901 -13.198 13.492 1.00 61.12 C ATOM 161 SD MET A1064 5.546 -11.957 14.752 1.00 1.25 S ATOM 162 CE MET A1064 6.787 -10.724 14.370 1.00 5.31 C ATOM 0 H MET A1064 5.071 -12.801 10.228 1.00 50.24 H new ATOM 0 HA MET A1064 5.492 -14.723 11.257 1.00 21.00 H new ATOM 0 HB2 MET A1064 3.782 -13.496 13.456 1.00 3.34 H new ATOM 0 HB3 MET A1064 4.711 -14.970 13.648 1.00 3.34 H new ATOM 0 HG2 MET A1064 6.683 -13.865 13.855 1.00 61.12 H new ATOM 0 HG3 MET A1064 6.290 -12.705 12.601 1.00 61.12 H new ATOM 0 HE1 MET A1064 7.249 -10.375 15.293 1.00 5.31 H new ATOM 0 HE2 MET A1064 7.549 -11.162 13.726 1.00 5.31 H new ATOM 0 HE3 MET A1064 6.319 -9.883 13.858 1.00 5.31 H new ATOM 172 N LEU A1065 2.706 -15.069 10.259 1.00 42.24 N ATOM 173 CA LEU A1065 1.598 -15.944 9.894 1.00 64.12 C ATOM 174 C LEU A1065 2.098 -17.166 9.132 1.00 52.40 C ATOM 175 O LEU A1065 1.573 -18.269 9.292 1.00 3.10 O ATOM 176 CB LEU A1065 0.578 -15.182 9.047 1.00 1.23 C ATOM 177 CG LEU A1065 -0.546 -14.485 9.816 1.00 13.10 C ATOM 178 CD1 LEU A1065 -1.176 -13.392 8.966 1.00 50.42 C ATOM 179 CD2 LEU A1065 -1.597 -15.493 10.255 1.00 35.25 C ATOM 0 H LEU A1065 2.867 -14.299 9.609 1.00 42.24 H new ATOM 0 HA LEU A1065 1.117 -16.283 10.812 1.00 64.12 H new ATOM 0 HB2 LEU A1065 1.110 -14.432 8.461 1.00 1.23 H new ATOM 0 HB3 LEU A1065 0.129 -15.880 8.340 1.00 1.23 H new ATOM 0 HG LEU A1065 -0.119 -14.024 10.707 1.00 13.10 H new ATOM 0 HD11 LEU A1065 -1.973 -12.907 9.529 1.00 50.42 H new ATOM 0 HD12 LEU A1065 -0.418 -12.654 8.702 1.00 50.42 H new ATOM 0 HD13 LEU A1065 -1.588 -13.830 8.057 1.00 50.42 H new ATOM 0 HD21 LEU A1065 -2.389 -14.979 10.800 1.00 35.25 H new ATOM 0 HD22 LEU A1065 -2.020 -15.983 9.378 1.00 35.25 H new ATOM 0 HD23 LEU A1065 -1.137 -16.240 10.902 1.00 35.25 H new ATOM 191 N TYR A1066 3.115 -16.964 8.302 1.00 61.40 N ATOM 192 CA TYR A1066 3.687 -18.050 7.514 1.00 3.44 C ATOM 193 C TYR A1066 4.057 -19.233 8.404 1.00 52.44 C ATOM 194 O TYR A1066 4.105 -20.376 7.948 1.00 64.00 O ATOM 195 CB TYR A1066 4.922 -17.561 6.755 1.00 34.13 C ATOM 196 CG TYR A1066 6.098 -17.244 7.651 1.00 2.15 C ATOM 197 CD1 TYR A1066 6.180 -16.026 8.316 1.00 61.24 C ATOM 198 CD2 TYR A1066 7.124 -18.163 7.835 1.00 44.51 C ATOM 199 CE1 TYR A1066 7.253 -15.732 9.135 1.00 51.25 C ATOM 200 CE2 TYR A1066 8.200 -17.876 8.654 1.00 33.14 C ATOM 201 CZ TYR A1066 8.260 -16.660 9.301 1.00 70.11 C ATOM 202 OH TYR A1066 9.329 -16.371 10.118 1.00 13.21 O ATOM 0 H TYR A1066 3.561 -16.058 8.157 1.00 61.40 H new ATOM 0 HA TYR A1066 2.935 -18.380 6.797 1.00 3.44 H new ATOM 0 HB2 TYR A1066 5.220 -18.322 6.034 1.00 34.13 H new ATOM 0 HB3 TYR A1066 4.659 -16.669 6.186 1.00 34.13 H new ATOM 0 HD1 TYR A1066 5.392 -15.298 8.190 1.00 61.24 H new ATOM 0 HD2 TYR A1066 7.080 -19.117 7.330 1.00 44.51 H new ATOM 0 HE1 TYR A1066 7.303 -14.780 9.643 1.00 51.25 H new ATOM 0 HE2 TYR A1066 8.990 -18.601 8.786 1.00 33.14 H new ATOM 0 HH TYR A1066 9.949 -17.130 10.127 1.00 13.21 H new ATOM 212 N LEU A1067 4.317 -18.949 9.676 1.00 54.40 N ATOM 213 CA LEU A1067 4.683 -19.988 10.631 1.00 34.14 C ATOM 214 C LEU A1067 3.453 -20.769 11.084 1.00 11.02 C ATOM 215 O LEU A1067 3.499 -21.990 11.228 1.00 34.33 O ATOM 216 CB LEU A1067 5.384 -19.371 11.842 1.00 73.15 C ATOM 217 CG LEU A1067 6.576 -18.464 11.537 1.00 63.24 C ATOM 218 CD1 LEU A1067 6.668 -17.341 12.558 1.00 44.50 C ATOM 219 CD2 LEU A1067 7.868 -19.270 11.512 1.00 2.02 C ATOM 0 H LEU A1067 4.281 -18.008 10.069 1.00 54.40 H new ATOM 0 HA LEU A1067 5.367 -20.678 10.136 1.00 34.14 H new ATOM 0 HB2 LEU A1067 4.651 -18.796 12.407 1.00 73.15 H new ATOM 0 HB3 LEU A1067 5.724 -20.179 12.490 1.00 73.15 H new ATOM 0 HG LEU A1067 6.427 -18.021 10.552 1.00 63.24 H new ATOM 0 HD11 LEU A1067 7.523 -16.706 12.324 1.00 44.50 H new ATOM 0 HD12 LEU A1067 5.755 -16.746 12.528 1.00 44.50 H new ATOM 0 HD13 LEU A1067 6.793 -17.765 13.555 1.00 44.50 H new ATOM 0 HD21 LEU A1067 8.706 -18.608 11.293 1.00 2.02 H new ATOM 0 HD22 LEU A1067 8.022 -19.741 12.483 1.00 2.02 H new ATOM 0 HD23 LEU A1067 7.803 -20.039 10.742 1.00 2.02 H new ATOM 231 N TYR A1068 2.355 -20.054 11.306 1.00 33.34 N ATOM 232 CA TYR A1068 1.112 -20.680 11.742 1.00 32.13 C ATOM 233 C TYR A1068 0.505 -21.525 10.626 1.00 54.14 C ATOM 234 O TYR A1068 -0.054 -22.593 10.874 1.00 54.04 O ATOM 235 CB TYR A1068 0.111 -19.614 12.193 1.00 15.22 C ATOM 236 CG TYR A1068 -1.152 -19.582 11.363 1.00 3.44 C ATOM 237 CD1 TYR A1068 -2.189 -20.474 11.605 1.00 31.13 C ATOM 238 CD2 TYR A1068 -1.310 -18.658 10.337 1.00 70.33 C ATOM 239 CE1 TYR A1068 -3.345 -20.448 10.849 1.00 51.02 C ATOM 240 CE2 TYR A1068 -2.462 -18.624 9.576 1.00 63.11 C ATOM 241 CZ TYR A1068 -3.477 -19.521 9.836 1.00 44.04 C ATOM 242 OH TYR A1068 -4.627 -19.491 9.081 1.00 1.24 O ATOM 0 H TYR A1068 2.301 -19.042 11.191 1.00 33.34 H new ATOM 0 HA TYR A1068 1.340 -21.334 12.583 1.00 32.13 H new ATOM 0 HB2 TYR A1068 -0.153 -19.793 13.235 1.00 15.22 H new ATOM 0 HB3 TYR A1068 0.590 -18.636 12.149 1.00 15.22 H new ATOM 0 HD1 TYR A1068 -2.090 -21.200 12.398 1.00 31.13 H new ATOM 0 HD2 TYR A1068 -0.518 -17.954 10.131 1.00 70.33 H new ATOM 0 HE1 TYR A1068 -4.141 -21.150 11.050 1.00 51.02 H new ATOM 0 HE2 TYR A1068 -2.567 -17.899 8.782 1.00 63.11 H new ATOM 0 HH TYR A1068 -4.560 -18.779 8.411 1.00 1.24 H new ATOM 252 N VAL A1069 0.621 -21.037 9.395 1.00 12.21 N ATOM 253 CA VAL A1069 0.086 -21.746 8.238 1.00 70.21 C ATOM 254 C VAL A1069 0.931 -22.971 7.907 1.00 32.53 C ATOM 255 O VAL A1069 0.414 -23.986 7.435 1.00 64.23 O ATOM 256 CB VAL A1069 0.019 -20.832 7.001 1.00 53.25 C ATOM 257 CG1 VAL A1069 1.419 -20.448 6.544 1.00 65.40 C ATOM 258 CG2 VAL A1069 -0.750 -21.511 5.878 1.00 74.34 C ATOM 0 H VAL A1069 1.081 -20.154 9.173 1.00 12.21 H new ATOM 0 HA VAL A1069 -0.923 -22.064 8.500 1.00 70.21 H new ATOM 0 HB VAL A1069 -0.511 -19.919 7.273 1.00 53.25 H new ATOM 0 HG11 VAL A1069 1.352 -19.802 5.669 1.00 65.40 H new ATOM 0 HG12 VAL A1069 1.932 -19.919 7.347 1.00 65.40 H new ATOM 0 HG13 VAL A1069 1.978 -21.348 6.288 1.00 65.40 H new ATOM 0 HG21 VAL A1069 -0.787 -20.851 5.012 1.00 74.34 H new ATOM 0 HG22 VAL A1069 -0.250 -22.440 5.605 1.00 74.34 H new ATOM 0 HG23 VAL A1069 -1.764 -21.729 6.212 1.00 74.34 H new ATOM 268 N LEU A1070 2.232 -22.872 8.156 1.00 11.31 N ATOM 269 CA LEU A1070 3.150 -23.973 7.883 1.00 5.24 C ATOM 270 C LEU A1070 3.009 -25.070 8.933 1.00 64.22 C ATOM 271 O LEU A1070 3.116 -26.257 8.624 1.00 21.21 O ATOM 272 CB LEU A1070 4.591 -23.464 7.850 1.00 64.54 C ATOM 273 CG LEU A1070 5.615 -24.390 7.191 1.00 1.11 C ATOM 274 CD1 LEU A1070 5.500 -24.319 5.676 1.00 32.44 C ATOM 275 CD2 LEU A1070 7.024 -24.031 7.638 1.00 62.11 C ATOM 0 H LEU A1070 2.675 -22.041 8.547 1.00 11.31 H new ATOM 0 HA LEU A1070 2.898 -24.393 6.909 1.00 5.24 H new ATOM 0 HB2 LEU A1070 4.606 -22.508 7.327 1.00 64.54 H new ATOM 0 HB3 LEU A1070 4.911 -23.272 8.874 1.00 64.54 H new ATOM 0 HG LEU A1070 5.406 -25.413 7.504 1.00 1.11 H new ATOM 0 HD11 LEU A1070 6.236 -24.984 5.224 1.00 32.44 H new ATOM 0 HD12 LEU A1070 4.499 -24.625 5.372 1.00 32.44 H new ATOM 0 HD13 LEU A1070 5.683 -23.297 5.345 1.00 32.44 H new ATOM 0 HD21 LEU A1070 7.739 -24.700 7.159 1.00 62.11 H new ATOM 0 HD22 LEU A1070 7.244 -23.002 7.355 1.00 62.11 H new ATOM 0 HD23 LEU A1070 7.100 -24.134 8.721 1.00 62.11 H new ATOM 287 N SER A1071 2.767 -24.666 10.176 1.00 44.43 N ATOM 288 CA SER A1071 2.614 -25.615 11.273 1.00 3.33 C ATOM 289 C SER A1071 1.271 -26.335 11.184 1.00 43.14 C ATOM 290 O SER A1071 1.133 -27.470 11.638 1.00 15.31 O ATOM 291 CB SER A1071 2.731 -24.895 12.618 1.00 71.41 C ATOM 292 OG SER A1071 1.571 -24.127 12.889 1.00 30.23 O ATOM 0 H SER A1071 2.673 -23.688 10.449 1.00 44.43 H new ATOM 0 HA SER A1071 3.410 -26.355 11.195 1.00 3.33 H new ATOM 0 HB2 SER A1071 2.881 -25.625 13.413 1.00 71.41 H new ATOM 0 HB3 SER A1071 3.607 -24.246 12.612 1.00 71.41 H new ATOM 0 HG SER A1071 1.239 -23.731 12.056 1.00 30.23 H new ATOM 298 N GLY A1072 0.285 -25.665 10.597 1.00 15.24 N ATOM 299 CA GLY A1072 -1.033 -26.256 10.458 1.00 44.22 C ATOM 300 C GLY A1072 -1.094 -27.286 9.348 1.00 54.24 C ATOM 301 O GLY A1072 -1.760 -28.313 9.480 1.00 51.25 O ATOM 0 H GLY A1072 0.375 -24.723 10.215 1.00 15.24 H new ATOM 0 HA2 GLY A1072 -1.319 -26.725 11.400 1.00 44.22 H new ATOM 0 HA3 GLY A1072 -1.761 -25.469 10.260 1.00 44.22 H new ATOM 305 N ILE A1073 -0.399 -27.011 8.249 1.00 64.14 N ATOM 306 CA ILE A1073 -0.376 -27.921 7.111 1.00 32.24 C ATOM 307 C ILE A1073 0.491 -29.142 7.400 1.00 45.25 C ATOM 308 O ILE A1073 0.230 -30.235 6.898 1.00 44.13 O ATOM 309 CB ILE A1073 0.146 -27.222 5.842 1.00 35.32 C ATOM 310 CG1 ILE A1073 1.621 -26.851 6.008 1.00 33.33 C ATOM 311 CG2 ILE A1073 -0.686 -25.986 5.537 1.00 60.33 C ATOM 312 CD1 ILE A1073 2.226 -26.216 4.776 1.00 51.24 C ATOM 0 H ILE A1073 0.156 -26.164 8.123 1.00 64.14 H new ATOM 0 HA ILE A1073 -1.404 -28.241 6.942 1.00 32.24 H new ATOM 0 HB ILE A1073 0.057 -27.912 5.003 1.00 35.32 H new ATOM 0 HG12 ILE A1073 1.722 -26.164 6.848 1.00 33.33 H new ATOM 0 HG13 ILE A1073 2.187 -27.748 6.260 1.00 33.33 H new ATOM 0 HG21 ILE A1073 -0.304 -25.503 4.637 1.00 60.33 H new ATOM 0 HG22 ILE A1073 -1.725 -26.276 5.380 1.00 60.33 H new ATOM 0 HG23 ILE A1073 -0.626 -25.291 6.375 1.00 60.33 H new ATOM 0 HD11 ILE A1073 3.273 -25.979 4.966 1.00 51.24 H new ATOM 0 HD12 ILE A1073 2.157 -26.909 3.938 1.00 51.24 H new ATOM 0 HD13 ILE A1073 1.685 -25.301 4.535 1.00 51.24 H new ATOM 324 N GLY A1074 1.524 -28.948 8.215 1.00 41.41 N ATOM 325 CA GLY A1074 2.413 -30.041 8.558 1.00 75.10 C ATOM 326 C GLY A1074 1.797 -30.997 9.560 1.00 11.10 C ATOM 327 O GLY A1074 2.055 -32.199 9.521 1.00 23.15 O ATOM 0 H GLY A1074 1.760 -28.053 8.643 1.00 41.41 H new ATOM 0 HA2 GLY A1074 2.677 -30.588 7.653 1.00 75.10 H new ATOM 0 HA3 GLY A1074 3.339 -29.637 8.968 1.00 75.10 H new ATOM 331 N GLY A1075 0.981 -30.461 10.462 1.00 25.45 N ATOM 332 CA GLY A1075 0.340 -31.289 11.468 1.00 14.42 C ATOM 333 C GLY A1075 -0.814 -32.095 10.905 1.00 64.11 C ATOM 334 O GLY A1075 -1.083 -33.207 11.360 1.00 33.53 O ATOM 0 H GLY A1075 0.752 -29.468 10.515 1.00 25.45 H new ATOM 0 HA2 GLY A1075 1.076 -31.967 11.899 1.00 14.42 H new ATOM 0 HA3 GLY A1075 -0.024 -30.656 12.278 1.00 14.42 H new ATOM 338 N LEU A1076 -1.499 -31.533 9.916 1.00 52.04 N ATOM 339 CA LEU A1076 -2.632 -32.206 9.291 1.00 24.42 C ATOM 340 C LEU A1076 -2.162 -33.351 8.400 1.00 63.31 C ATOM 341 O LEU A1076 -2.790 -34.410 8.349 1.00 11.32 O ATOM 342 CB LEU A1076 -3.453 -31.210 8.470 1.00 2.11 C ATOM 343 CG LEU A1076 -4.428 -30.334 9.257 1.00 44.14 C ATOM 344 CD1 LEU A1076 -4.598 -28.983 8.579 1.00 50.13 C ATOM 345 CD2 LEU A1076 -5.772 -31.031 9.405 1.00 0.54 C ATOM 0 H LEU A1076 -1.290 -30.613 9.529 1.00 52.04 H new ATOM 0 HA LEU A1076 -3.258 -32.619 10.082 1.00 24.42 H new ATOM 0 HB2 LEU A1076 -2.764 -30.559 7.931 1.00 2.11 H new ATOM 0 HB3 LEU A1076 -4.018 -31.765 7.721 1.00 2.11 H new ATOM 0 HG LEU A1076 -4.016 -30.169 10.252 1.00 44.14 H new ATOM 0 HD11 LEU A1076 -5.295 -28.373 9.153 1.00 50.13 H new ATOM 0 HD12 LEU A1076 -3.633 -28.479 8.526 1.00 50.13 H new ATOM 0 HD13 LEU A1076 -4.987 -29.128 7.571 1.00 50.13 H new ATOM 0 HD21 LEU A1076 -6.453 -30.393 9.968 1.00 0.54 H new ATOM 0 HD22 LEU A1076 -6.191 -31.227 8.418 1.00 0.54 H new ATOM 0 HD23 LEU A1076 -5.637 -31.974 9.935 1.00 0.54 H new ATOM 357 N LEU A1077 -1.053 -33.133 7.702 1.00 13.14 N ATOM 358 CA LEU A1077 -0.497 -34.148 6.814 1.00 32.41 C ATOM 359 C LEU A1077 0.076 -35.316 7.612 1.00 43.35 C ATOM 360 O LEU A1077 -0.039 -36.473 7.209 1.00 54.14 O ATOM 361 CB LEU A1077 0.590 -33.539 5.928 1.00 55.21 C ATOM 362 CG LEU A1077 0.624 -34.021 4.478 1.00 33.33 C ATOM 363 CD1 LEU A1077 0.748 -35.536 4.422 1.00 20.23 C ATOM 364 CD2 LEU A1077 -0.619 -33.559 3.732 1.00 4.30 C ATOM 0 H LEU A1077 -0.521 -32.263 7.734 1.00 13.14 H new ATOM 0 HA LEU A1077 -1.303 -34.524 6.183 1.00 32.41 H new ATOM 0 HB2 LEU A1077 0.465 -32.456 5.927 1.00 55.21 H new ATOM 0 HB3 LEU A1077 1.559 -33.747 6.382 1.00 55.21 H new ATOM 0 HG LEU A1077 1.497 -33.586 3.992 1.00 33.33 H new ATOM 0 HD11 LEU A1077 0.771 -35.861 3.382 1.00 20.23 H new ATOM 0 HD12 LEU A1077 1.668 -35.844 4.919 1.00 20.23 H new ATOM 0 HD13 LEU A1077 -0.106 -35.990 4.925 1.00 20.23 H new ATOM 0 HD21 LEU A1077 -0.577 -33.912 2.701 1.00 4.30 H new ATOM 0 HD22 LEU A1077 -1.507 -33.964 4.218 1.00 4.30 H new ATOM 0 HD23 LEU A1077 -0.665 -32.470 3.741 1.00 4.30 H new ATOM 376 N LEU A1078 0.692 -35.002 8.747 1.00 25.35 N ATOM 377 CA LEU A1078 1.281 -36.025 9.605 1.00 12.12 C ATOM 378 C LEU A1078 0.200 -36.792 10.360 1.00 21.03 C ATOM 379 O LEU A1078 0.401 -37.941 10.757 1.00 40.32 O ATOM 380 CB LEU A1078 2.257 -35.387 10.596 1.00 14.44 C ATOM 381 CG LEU A1078 3.729 -35.391 10.183 1.00 43.05 C ATOM 382 CD1 LEU A1078 3.894 -34.813 8.786 1.00 22.01 C ATOM 383 CD2 LEU A1078 4.566 -34.610 11.187 1.00 25.14 C ATOM 0 H LEU A1078 0.796 -34.049 9.094 1.00 25.35 H new ATOM 0 HA LEU A1078 1.823 -36.727 8.972 1.00 12.12 H new ATOM 0 HB2 LEU A1078 1.950 -34.355 10.764 1.00 14.44 H new ATOM 0 HB3 LEU A1078 2.166 -35.906 11.550 1.00 14.44 H new ATOM 0 HG LEU A1078 4.080 -36.423 10.170 1.00 43.05 H new ATOM 0 HD11 LEU A1078 4.948 -34.824 8.510 1.00 22.01 H new ATOM 0 HD12 LEU A1078 3.326 -35.413 8.075 1.00 22.01 H new ATOM 0 HD13 LEU A1078 3.526 -33.787 8.771 1.00 22.01 H new ATOM 0 HD21 LEU A1078 5.611 -34.623 10.878 1.00 25.14 H new ATOM 0 HD22 LEU A1078 4.213 -33.580 11.231 1.00 25.14 H new ATOM 0 HD23 LEU A1078 4.473 -35.068 12.172 1.00 25.14 H new ATOM 395 N LEU A1079 -0.948 -36.150 10.553 1.00 71.33 N ATOM 396 CA LEU A1079 -2.062 -36.772 11.259 1.00 34.13 C ATOM 397 C LEU A1079 -2.776 -37.783 10.367 1.00 52.22 C ATOM 398 O LEU A1079 -3.213 -38.837 10.830 1.00 12.44 O ATOM 399 CB LEU A1079 -3.050 -35.707 11.733 1.00 45.41 C ATOM 400 CG LEU A1079 -4.049 -36.145 12.804 1.00 14.34 C ATOM 401 CD1 LEU A1079 -4.467 -34.961 13.662 1.00 13.45 C ATOM 402 CD2 LEU A1079 -5.266 -36.797 12.162 1.00 71.22 C ATOM 0 H LEU A1079 -1.131 -35.200 10.230 1.00 71.33 H new ATOM 0 HA LEU A1079 -1.662 -37.298 12.125 1.00 34.13 H new ATOM 0 HB2 LEU A1079 -2.483 -34.860 12.119 1.00 45.41 H new ATOM 0 HB3 LEU A1079 -3.609 -35.349 10.869 1.00 45.41 H new ATOM 0 HG LEU A1079 -3.564 -36.879 13.447 1.00 14.34 H new ATOM 0 HD11 LEU A1079 -5.178 -35.293 14.418 1.00 13.45 H new ATOM 0 HD12 LEU A1079 -3.589 -34.538 14.150 1.00 13.45 H new ATOM 0 HD13 LEU A1079 -4.934 -34.203 13.033 1.00 13.45 H new ATOM 0 HD21 LEU A1079 -5.967 -37.103 12.939 1.00 71.22 H new ATOM 0 HD22 LEU A1079 -5.751 -36.084 11.495 1.00 71.22 H new ATOM 0 HD23 LEU A1079 -4.952 -37.671 11.592 1.00 71.22 H new ATOM 414 N LEU A1080 -2.888 -37.455 9.083 1.00 23.21 N ATOM 415 CA LEU A1080 -3.547 -38.334 8.124 1.00 21.30 C ATOM 416 C LEU A1080 -2.655 -39.520 7.771 1.00 12.54 C ATOM 417 O LEU A1080 -3.139 -40.631 7.549 1.00 22.50 O ATOM 418 CB LEU A1080 -3.910 -37.560 6.857 1.00 44.55 C ATOM 419 CG LEU A1080 -5.270 -36.860 6.865 1.00 42.45 C ATOM 420 CD1 LEU A1080 -5.387 -35.908 5.684 1.00 12.35 C ATOM 421 CD2 LEU A1080 -6.396 -37.883 6.841 1.00 63.34 C ATOM 0 H LEU A1080 -2.531 -36.587 8.683 1.00 23.21 H new ATOM 0 HA LEU A1080 -4.460 -38.713 8.584 1.00 21.30 H new ATOM 0 HB2 LEU A1080 -3.139 -36.810 6.680 1.00 44.55 H new ATOM 0 HB3 LEU A1080 -3.884 -38.250 6.014 1.00 44.55 H new ATOM 0 HG LEU A1080 -5.353 -36.279 7.784 1.00 42.45 H new ATOM 0 HD11 LEU A1080 -6.361 -35.419 5.706 1.00 12.35 H new ATOM 0 HD12 LEU A1080 -4.601 -35.155 5.745 1.00 12.35 H new ATOM 0 HD13 LEU A1080 -5.283 -36.467 4.754 1.00 12.35 H new ATOM 0 HD21 LEU A1080 -7.356 -37.367 6.847 1.00 63.34 H new ATOM 0 HD22 LEU A1080 -6.316 -38.491 5.940 1.00 63.34 H new ATOM 0 HD23 LEU A1080 -6.323 -38.525 7.719 1.00 63.34 H new ATOM 433 N LEU A1081 -1.350 -39.278 7.721 1.00 61.34 N ATOM 434 CA LEU A1081 -0.389 -40.326 7.396 1.00 50.11 C ATOM 435 C LEU A1081 -0.150 -41.238 8.596 1.00 5.34 C ATOM 436 O LEU A1081 0.063 -42.440 8.441 1.00 22.40 O ATOM 437 CB LEU A1081 0.934 -39.708 6.941 1.00 72.45 C ATOM 438 CG LEU A1081 2.056 -39.681 7.980 1.00 31.45 C ATOM 439 CD1 LEU A1081 2.756 -41.030 8.045 1.00 53.31 C ATOM 440 CD2 LEU A1081 3.052 -38.576 7.662 1.00 12.24 C ATOM 0 H LEU A1081 -0.933 -38.365 7.901 1.00 61.34 H new ATOM 0 HA LEU A1081 -0.803 -40.925 6.584 1.00 50.11 H new ATOM 0 HB2 LEU A1081 1.287 -40.258 6.069 1.00 72.45 H new ATOM 0 HB3 LEU A1081 0.742 -38.685 6.617 1.00 72.45 H new ATOM 0 HG LEU A1081 1.616 -39.476 8.956 1.00 31.45 H new ATOM 0 HD11 LEU A1081 3.551 -40.992 8.789 1.00 53.31 H new ATOM 0 HD12 LEU A1081 2.036 -41.800 8.322 1.00 53.31 H new ATOM 0 HD13 LEU A1081 3.183 -41.266 7.070 1.00 53.31 H new ATOM 0 HD21 LEU A1081 3.843 -38.572 8.412 1.00 12.24 H new ATOM 0 HD22 LEU A1081 3.486 -38.750 6.677 1.00 12.24 H new ATOM 0 HD23 LEU A1081 2.541 -37.613 7.668 1.00 12.24 H new ATOM 452 N ILE A1082 -0.192 -40.657 9.791 1.00 30.03 N ATOM 453 CA ILE A1082 0.016 -41.418 11.016 1.00 3.25 C ATOM 454 C ILE A1082 -1.176 -42.324 11.310 1.00 53.12 C ATOM 455 O ILE A1082 -1.019 -43.418 11.852 1.00 50.42 O ATOM 456 CB ILE A1082 0.249 -40.489 12.222 1.00 22.32 C ATOM 457 CG1 ILE A1082 1.704 -40.018 12.257 1.00 22.12 C ATOM 458 CG2 ILE A1082 -0.114 -41.201 13.517 1.00 70.41 C ATOM 459 CD1 ILE A1082 1.912 -38.759 13.070 1.00 40.51 C ATOM 0 H ILE A1082 -0.368 -39.663 9.936 1.00 30.03 H new ATOM 0 HA ILE A1082 0.905 -42.030 10.861 1.00 3.25 H new ATOM 0 HB ILE A1082 -0.394 -39.615 12.118 1.00 22.32 H new ATOM 0 HG12 ILE A1082 2.325 -40.813 12.669 1.00 22.12 H new ATOM 0 HG13 ILE A1082 2.045 -39.843 11.237 1.00 22.12 H new ATOM 0 HG21 ILE A1082 0.056 -40.532 14.360 1.00 70.41 H new ATOM 0 HG22 ILE A1082 -1.164 -41.492 13.490 1.00 70.41 H new ATOM 0 HG23 ILE A1082 0.506 -42.091 13.629 1.00 70.41 H new ATOM 0 HD11 ILE A1082 2.966 -38.484 13.051 1.00 40.51 H new ATOM 0 HD12 ILE A1082 1.318 -37.950 12.646 1.00 40.51 H new ATOM 0 HD13 ILE A1082 1.602 -38.936 14.100 1.00 40.51 H new ATOM 471 N PHE A1083 -2.367 -41.861 10.946 1.00 14.15 N ATOM 472 CA PHE A1083 -3.586 -42.630 11.169 1.00 12.14 C ATOM 473 C PHE A1083 -3.676 -43.802 10.195 1.00 52.41 C ATOM 474 O PHE A1083 -4.112 -44.894 10.560 1.00 41.34 O ATOM 475 CB PHE A1083 -4.816 -41.732 11.017 1.00 23.21 C ATOM 476 CG PHE A1083 -5.885 -42.004 12.037 1.00 33.01 C ATOM 477 CD1 PHE A1083 -5.588 -42.003 13.390 1.00 61.12 C ATOM 478 CD2 PHE A1083 -7.188 -42.259 11.641 1.00 33.15 C ATOM 479 CE1 PHE A1083 -6.570 -42.254 14.330 1.00 55.13 C ATOM 480 CE2 PHE A1083 -8.175 -42.511 12.576 1.00 44.40 C ATOM 481 CZ PHE A1083 -7.865 -42.507 13.922 1.00 13.31 C ATOM 0 H PHE A1083 -2.514 -40.958 10.496 1.00 14.15 H new ATOM 0 HA PHE A1083 -3.555 -43.025 12.184 1.00 12.14 H new ATOM 0 HB2 PHE A1083 -4.507 -40.690 11.095 1.00 23.21 H new ATOM 0 HB3 PHE A1083 -5.234 -41.867 10.019 1.00 23.21 H new ATOM 0 HD1 PHE A1083 -4.577 -41.804 13.714 1.00 61.12 H new ATOM 0 HD2 PHE A1083 -7.436 -42.261 10.590 1.00 33.15 H new ATOM 0 HE1 PHE A1083 -6.325 -42.252 15.382 1.00 55.13 H new ATOM 0 HE2 PHE A1083 -9.187 -42.711 12.254 1.00 44.40 H new ATOM 0 HZ PHE A1083 -8.634 -42.701 14.655 1.00 13.31 H new ATOM 491 N ILE A1084 -3.262 -43.565 8.954 1.00 32.44 N ATOM 492 CA ILE A1084 -3.295 -44.600 7.928 1.00 20.10 C ATOM 493 C ILE A1084 -2.156 -45.596 8.116 1.00 53.31 C ATOM 494 O ILE A1084 -2.316 -46.793 7.869 1.00 45.42 O ATOM 495 CB ILE A1084 -3.206 -43.994 6.515 1.00 24.22 C ATOM 496 CG1 ILE A1084 -4.439 -43.136 6.225 1.00 65.24 C ATOM 497 CG2 ILE A1084 -3.065 -45.096 5.475 1.00 52.21 C ATOM 498 CD1 ILE A1084 -4.408 -42.472 4.866 1.00 61.42 C ATOM 0 H ILE A1084 -2.900 -42.666 8.635 1.00 32.44 H new ATOM 0 HA ILE A1084 -4.248 -45.119 8.032 1.00 20.10 H new ATOM 0 HB ILE A1084 -2.323 -43.357 6.464 1.00 24.22 H new ATOM 0 HG12 ILE A1084 -5.330 -43.760 6.295 1.00 65.24 H new ATOM 0 HG13 ILE A1084 -4.526 -42.368 6.994 1.00 65.24 H new ATOM 0 HG21 ILE A1084 -3.003 -44.653 4.481 1.00 52.21 H new ATOM 0 HG22 ILE A1084 -2.160 -45.670 5.673 1.00 52.21 H new ATOM 0 HG23 ILE A1084 -3.931 -45.756 5.525 1.00 52.21 H new ATOM 0 HD11 ILE A1084 -5.313 -41.880 4.729 1.00 61.42 H new ATOM 0 HD12 ILE A1084 -3.536 -41.822 4.799 1.00 61.42 H new ATOM 0 HD13 ILE A1084 -4.353 -43.235 4.089 1.00 61.42 H new ATOM 510 N VAL A1085 -1.006 -45.096 8.553 1.00 60.22 N ATOM 511 CA VAL A1085 0.161 -45.942 8.777 1.00 51.51 C ATOM 512 C VAL A1085 -0.068 -46.895 9.944 1.00 22.41 C ATOM 513 O VAL A1085 0.434 -48.020 9.949 1.00 34.14 O ATOM 514 CB VAL A1085 1.420 -45.099 9.055 1.00 31.44 C ATOM 515 CG1 VAL A1085 2.492 -45.947 9.722 1.00 61.51 C ATOM 516 CG2 VAL A1085 1.942 -44.481 7.768 1.00 42.31 C ATOM 0 H VAL A1085 -0.856 -44.108 8.759 1.00 60.22 H new ATOM 0 HA VAL A1085 0.314 -46.519 7.865 1.00 51.51 H new ATOM 0 HB VAL A1085 1.153 -44.291 9.736 1.00 31.44 H new ATOM 0 HG11 VAL A1085 3.374 -45.336 9.911 1.00 61.51 H new ATOM 0 HG12 VAL A1085 2.112 -46.337 10.666 1.00 61.51 H new ATOM 0 HG13 VAL A1085 2.759 -46.777 9.068 1.00 61.51 H new ATOM 0 HG21 VAL A1085 2.832 -43.889 7.983 1.00 42.31 H new ATOM 0 HG22 VAL A1085 2.194 -45.271 7.061 1.00 42.31 H new ATOM 0 HG23 VAL A1085 1.175 -43.839 7.335 1.00 42.31 H new ATOM 526 N LEU A1086 -0.828 -46.440 10.934 1.00 12.33 N ATOM 527 CA LEU A1086 -1.125 -47.253 12.107 1.00 65.45 C ATOM 528 C LEU A1086 -2.249 -48.241 11.815 1.00 71.41 C ATOM 529 O LEU A1086 -2.252 -49.362 12.325 1.00 23.41 O ATOM 530 CB LEU A1086 -1.511 -46.358 13.287 1.00 73.54 C ATOM 531 CG LEU A1086 -0.368 -45.582 13.943 1.00 52.31 C ATOM 532 CD1 LEU A1086 -0.886 -44.752 15.107 1.00 30.22 C ATOM 533 CD2 LEU A1086 0.725 -46.533 14.406 1.00 41.05 C ATOM 0 H LEU A1086 -1.250 -45.511 10.947 1.00 12.33 H new ATOM 0 HA LEU A1086 -0.229 -47.817 12.364 1.00 65.45 H new ATOM 0 HB2 LEU A1086 -2.260 -45.643 12.945 1.00 73.54 H new ATOM 0 HB3 LEU A1086 -1.986 -46.978 14.047 1.00 73.54 H new ATOM 0 HG LEU A1086 0.058 -44.905 13.203 1.00 52.31 H new ATOM 0 HD11 LEU A1086 -0.059 -44.207 15.562 1.00 30.22 H new ATOM 0 HD12 LEU A1086 -1.632 -44.044 14.746 1.00 30.22 H new ATOM 0 HD13 LEU A1086 -1.339 -45.409 15.849 1.00 30.22 H new ATOM 0 HD21 LEU A1086 1.530 -45.964 14.870 1.00 41.05 H new ATOM 0 HD22 LEU A1086 0.313 -47.236 15.130 1.00 41.05 H new ATOM 0 HD23 LEU A1086 1.116 -47.082 13.550 1.00 41.05 H new ATOM 545 N TYR A1087 -3.201 -47.820 10.990 1.00 31.32 N ATOM 546 CA TYR A1087 -4.330 -48.669 10.631 1.00 15.44 C ATOM 547 C TYR A1087 -3.909 -49.745 9.634 1.00 52.22 C ATOM 548 O TYR A1087 -4.607 -50.740 9.444 1.00 34.02 O ATOM 549 CB TYR A1087 -5.461 -47.824 10.038 1.00 31.32 C ATOM 550 CG TYR A1087 -5.991 -48.357 8.726 1.00 61.41 C ATOM 551 CD1 TYR A1087 -5.376 -48.034 7.523 1.00 43.34 C ATOM 552 CD2 TYR A1087 -7.107 -49.184 8.689 1.00 74.00 C ATOM 553 CE1 TYR A1087 -5.856 -48.517 6.322 1.00 11.24 C ATOM 554 CE2 TYR A1087 -7.594 -49.674 7.493 1.00 55.30 C ATOM 555 CZ TYR A1087 -6.966 -49.338 6.311 1.00 45.01 C ATOM 556 OH TYR A1087 -7.449 -49.822 5.118 1.00 14.20 O ATOM 0 H TYR A1087 -3.213 -46.896 10.558 1.00 31.32 H new ATOM 0 HA TYR A1087 -4.686 -49.159 11.537 1.00 15.44 H new ATOM 0 HB2 TYR A1087 -6.279 -47.772 10.756 1.00 31.32 H new ATOM 0 HB3 TYR A1087 -5.102 -46.806 9.889 1.00 31.32 H new ATOM 0 HD1 TYR A1087 -4.507 -47.393 7.527 1.00 43.34 H new ATOM 0 HD2 TYR A1087 -7.602 -49.448 9.612 1.00 74.00 H new ATOM 0 HE1 TYR A1087 -5.366 -48.254 5.396 1.00 11.24 H new ATOM 0 HE2 TYR A1087 -8.462 -50.317 7.483 1.00 55.30 H new ATOM 0 HH TYR A1087 -8.233 -50.385 5.287 1.00 14.20 H new ATOM 566 N LYS A1088 -2.759 -49.537 9.001 1.00 3.51 N ATOM 567 CA LYS A1088 -2.239 -50.488 8.026 1.00 2.41 C ATOM 568 C LYS A1088 -1.092 -51.301 8.616 1.00 21.21 C ATOM 569 O LYS A1088 -0.720 -52.346 8.083 1.00 32.24 O ATOM 570 CB LYS A1088 -1.764 -49.753 6.769 1.00 5.24 C ATOM 571 CG LYS A1088 -0.459 -49.001 6.963 1.00 14.51 C ATOM 572 CD LYS A1088 -0.174 -48.070 5.795 1.00 64.53 C ATOM 573 CE LYS A1088 1.320 -47.869 5.595 1.00 31.42 C ATOM 574 NZ LYS A1088 1.614 -47.080 4.367 1.00 43.11 N ATOM 0 H LYS A1088 -2.169 -48.718 9.146 1.00 3.51 H new ATOM 0 HA LYS A1088 -3.044 -51.172 7.758 1.00 2.41 H new ATOM 0 HB2 LYS A1088 -1.642 -50.474 5.961 1.00 5.24 H new ATOM 0 HB3 LYS A1088 -2.536 -49.050 6.455 1.00 5.24 H new ATOM 0 HG2 LYS A1088 -0.504 -48.424 7.887 1.00 14.51 H new ATOM 0 HG3 LYS A1088 0.360 -49.712 7.071 1.00 14.51 H new ATOM 0 HD2 LYS A1088 -0.612 -48.481 4.885 1.00 64.53 H new ATOM 0 HD3 LYS A1088 -0.652 -47.106 5.971 1.00 64.53 H new ATOM 0 HE2 LYS A1088 1.737 -47.359 6.463 1.00 31.42 H new ATOM 0 HE3 LYS A1088 1.811 -48.840 5.529 1.00 31.42 H new ATOM 0 HZ1 LYS A1088 2.643 -46.965 4.266 1.00 43.11 H new ATOM 0 HZ2 LYS A1088 1.238 -47.579 3.535 1.00 43.11 H new ATOM 0 HZ3 LYS A1088 1.167 -46.144 4.440 1.00 43.11 H new ATOM 588 N VAL A1089 -0.536 -50.815 9.721 1.00 72.00 N ATOM 589 CA VAL A1089 0.567 -51.499 10.386 1.00 41.22 C ATOM 590 C VAL A1089 0.053 -52.511 11.403 1.00 65.14 C ATOM 591 O VAL A1089 0.651 -53.568 11.600 1.00 72.01 O ATOM 592 CB VAL A1089 1.500 -50.500 11.096 1.00 33.30 C ATOM 593 CG1 VAL A1089 2.157 -51.150 12.305 1.00 4.53 C ATOM 594 CG2 VAL A1089 2.550 -49.971 10.130 1.00 20.24 C ATOM 0 H VAL A1089 -0.831 -49.950 10.175 1.00 72.00 H new ATOM 0 HA VAL A1089 1.129 -52.021 9.612 1.00 41.22 H new ATOM 0 HB VAL A1089 0.903 -49.657 11.445 1.00 33.30 H new ATOM 0 HG11 VAL A1089 2.813 -50.429 12.794 1.00 4.53 H new ATOM 0 HG12 VAL A1089 1.388 -51.475 13.006 1.00 4.53 H new ATOM 0 HG13 VAL A1089 2.742 -52.012 11.982 1.00 4.53 H new ATOM 0 HG21 VAL A1089 3.200 -49.267 10.649 1.00 20.24 H new ATOM 0 HG22 VAL A1089 3.145 -50.801 9.749 1.00 20.24 H new ATOM 0 HG23 VAL A1089 2.058 -49.466 9.299 1.00 20.24 H new ATOM 604 N GLY A1090 -1.060 -52.178 12.050 1.00 33.21 N ATOM 605 CA GLY A1090 -1.637 -53.069 13.041 1.00 54.14 C ATOM 606 C GLY A1090 -1.907 -52.372 14.359 1.00 70.13 C ATOM 607 O GLY A1090 -1.519 -52.863 15.420 1.00 14.22 O ATOM 0 H GLY A1090 -1.572 -51.308 11.906 1.00 33.21 H new ATOM 0 HA2 GLY A1090 -2.569 -53.483 12.655 1.00 54.14 H new ATOM 0 HA3 GLY A1090 -0.961 -53.908 13.209 1.00 54.14 H new ATOM 611 N PHE A1091 -2.571 -51.222 14.295 1.00 32.32 N ATOM 612 CA PHE A1091 -2.889 -50.455 15.493 1.00 22.12 C ATOM 613 C PHE A1091 -4.381 -50.141 15.557 1.00 12.44 C ATOM 614 O PHE A1091 -5.090 -50.619 16.443 1.00 64.03 O ATOM 615 CB PHE A1091 -2.081 -49.156 15.522 1.00 34.22 C ATOM 616 CG PHE A1091 -0.861 -49.229 16.395 1.00 52.51 C ATOM 617 CD1 PHE A1091 0.197 -50.059 16.062 1.00 74.04 C ATOM 618 CD2 PHE A1091 -0.772 -48.467 17.549 1.00 60.12 C ATOM 619 CE1 PHE A1091 1.322 -50.128 16.862 1.00 42.12 C ATOM 620 CE2 PHE A1091 0.350 -48.531 18.353 1.00 23.43 C ATOM 621 CZ PHE A1091 1.398 -49.364 18.011 1.00 14.23 C ATOM 0 H PHE A1091 -2.899 -50.801 13.426 1.00 32.32 H new ATOM 0 HA PHE A1091 -2.625 -51.058 16.362 1.00 22.12 H new ATOM 0 HB2 PHE A1091 -1.777 -48.904 14.506 1.00 34.22 H new ATOM 0 HB3 PHE A1091 -2.721 -48.347 15.873 1.00 34.22 H new ATOM 0 HD1 PHE A1091 0.142 -50.660 15.166 1.00 74.04 H new ATOM 0 HD2 PHE A1091 -1.589 -47.816 17.823 1.00 60.12 H new ATOM 0 HE1 PHE A1091 2.140 -50.778 16.590 1.00 42.12 H new ATOM 0 HE2 PHE A1091 0.408 -47.930 19.249 1.00 23.43 H new ATOM 0 HZ PHE A1091 2.274 -49.418 18.640 1.00 14.23 H new ATOM 631 N PHE A1092 -4.850 -49.334 14.612 1.00 4.53 N ATOM 632 CA PHE A1092 -6.257 -48.954 14.561 1.00 12.32 C ATOM 633 C PHE A1092 -7.056 -49.936 13.709 1.00 35.43 C ATOM 634 O PHE A1092 -8.286 -49.907 13.695 1.00 1.41 O ATOM 635 CB PHE A1092 -6.405 -47.538 14.000 1.00 31.05 C ATOM 636 CG PHE A1092 -6.234 -46.462 15.034 1.00 73.11 C ATOM 637 CD1 PHE A1092 -4.970 -46.011 15.380 1.00 2.02 C ATOM 638 CD2 PHE A1092 -7.336 -45.903 15.660 1.00 63.11 C ATOM 639 CE1 PHE A1092 -4.808 -45.021 16.331 1.00 13.10 C ATOM 640 CE2 PHE A1092 -7.180 -44.912 16.611 1.00 12.03 C ATOM 641 CZ PHE A1092 -5.915 -44.472 16.948 1.00 61.21 C ATOM 0 H PHE A1092 -4.277 -48.930 13.871 1.00 4.53 H new ATOM 0 HA PHE A1092 -6.650 -48.978 15.577 1.00 12.32 H new ATOM 0 HB2 PHE A1092 -5.670 -47.391 13.209 1.00 31.05 H new ATOM 0 HB3 PHE A1092 -7.389 -47.438 13.543 1.00 31.05 H new ATOM 0 HD1 PHE A1092 -4.101 -46.438 14.901 1.00 2.02 H new ATOM 0 HD2 PHE A1092 -8.327 -46.245 15.402 1.00 63.11 H new ATOM 0 HE1 PHE A1092 -3.818 -44.677 16.591 1.00 13.10 H new ATOM 0 HE2 PHE A1092 -8.047 -44.482 17.090 1.00 12.03 H new ATOM 0 HZ PHE A1092 -5.792 -43.700 17.693 1.00 61.21 H new ATOM 651 N LYS A1093 -6.347 -50.806 12.999 1.00 75.44 N ATOM 652 CA LYS A1093 -6.986 -51.800 12.144 1.00 52.53 C ATOM 653 C LYS A1093 -8.053 -52.572 12.912 1.00 21.12 C ATOM 654 O LYS A1093 -7.740 -53.450 13.716 1.00 75.33 O ATOM 655 CB LYS A1093 -5.943 -52.769 11.584 1.00 63.33 C ATOM 656 CG LYS A1093 -6.480 -53.678 10.494 1.00 13.25 C ATOM 657 CD LYS A1093 -5.702 -53.517 9.198 1.00 10.31 C ATOM 658 CE LYS A1093 -6.068 -54.593 8.189 1.00 33.23 C ATOM 659 NZ LYS A1093 -5.357 -55.873 8.462 1.00 14.32 N ATOM 0 H LYS A1093 -5.328 -50.843 12.998 1.00 75.44 H new ATOM 0 HA LYS A1093 -7.466 -51.276 11.317 1.00 52.53 H new ATOM 0 HB2 LYS A1093 -5.104 -52.197 11.188 1.00 63.33 H new ATOM 0 HB3 LYS A1093 -5.555 -53.382 12.398 1.00 63.33 H new ATOM 0 HG2 LYS A1093 -6.426 -54.715 10.825 1.00 13.25 H new ATOM 0 HG3 LYS A1093 -7.532 -53.454 10.318 1.00 13.25 H new ATOM 0 HD2 LYS A1093 -5.903 -52.534 8.772 1.00 10.31 H new ATOM 0 HD3 LYS A1093 -4.633 -53.561 9.407 1.00 10.31 H new ATOM 0 HE2 LYS A1093 -7.144 -54.763 8.213 1.00 33.23 H new ATOM 0 HE3 LYS A1093 -5.822 -54.248 7.185 1.00 33.23 H new ATOM 0 HZ1 LYS A1093 -5.633 -56.582 7.753 1.00 14.32 H new ATOM 0 HZ2 LYS A1093 -4.330 -55.717 8.414 1.00 14.32 H new ATOM 0 HZ3 LYS A1093 -5.611 -56.216 9.411 1.00 14.32 H new ATOM 673 N ARG A1094 -9.314 -52.241 12.659 1.00 1.05 N ATOM 674 CA ARG A1094 -10.428 -52.905 13.327 1.00 51.44 C ATOM 675 C ARG A1094 -11.726 -52.706 12.549 1.00 42.42 C ATOM 676 O ARG A1094 -12.132 -51.576 12.278 1.00 55.05 O ATOM 677 CB ARG A1094 -10.588 -52.369 14.751 1.00 72.04 C ATOM 678 CG ARG A1094 -11.232 -53.362 15.706 1.00 52.31 C ATOM 679 CD ARG A1094 -10.276 -54.487 16.067 1.00 64.14 C ATOM 680 NE ARG A1094 -9.103 -53.999 16.789 1.00 50.02 N ATOM 681 CZ ARG A1094 -8.324 -54.774 17.535 1.00 50.54 C ATOM 682 NH1 ARG A1094 -8.590 -56.066 17.656 1.00 74.11 N ATOM 683 NH2 ARG A1094 -7.275 -54.255 18.160 1.00 32.10 N ATOM 0 H ARG A1094 -9.591 -51.517 11.996 1.00 1.05 H new ATOM 0 HA ARG A1094 -10.210 -53.972 13.369 1.00 51.44 H new ATOM 0 HB2 ARG A1094 -9.608 -52.089 15.137 1.00 72.04 H new ATOM 0 HB3 ARG A1094 -11.191 -51.461 14.723 1.00 72.04 H new ATOM 0 HG2 ARG A1094 -11.546 -52.845 16.613 1.00 52.31 H new ATOM 0 HG3 ARG A1094 -12.130 -53.778 15.249 1.00 52.31 H new ATOM 0 HD2 ARG A1094 -10.797 -55.223 16.678 1.00 64.14 H new ATOM 0 HD3 ARG A1094 -9.956 -54.996 15.158 1.00 64.14 H new ATOM 0 HE ARG A1094 -8.870 -53.009 16.716 1.00 50.02 H new ATOM 0 HH11 ARG A1094 -9.395 -56.468 17.176 1.00 74.11 H new ATOM 0 HH12 ARG A1094 -7.990 -56.659 18.230 1.00 74.11 H new ATOM 0 HH21 ARG A1094 -7.067 -53.261 18.068 1.00 32.10 H new ATOM 0 HH22 ARG A1094 -6.677 -54.850 18.733 1.00 32.10 H new ATOM 697 N ASN A1095 -12.371 -53.811 12.192 1.00 23.40 N ATOM 698 CA ASN A1095 -13.622 -53.758 11.445 1.00 14.24 C ATOM 699 C ASN A1095 -14.821 -53.804 12.386 1.00 23.23 C ATOM 700 O ASN A1095 -15.700 -54.657 12.249 1.00 42.45 O ATOM 701 CB ASN A1095 -13.695 -54.919 10.450 1.00 1.42 C ATOM 702 CG ASN A1095 -14.544 -54.588 9.238 1.00 33.34 C ATOM 703 OD1 ASN A1095 -15.520 -55.278 8.943 1.00 24.12 O ATOM 704 ND2 ASN A1095 -14.176 -53.528 8.528 1.00 34.40 N ATOM 0 H ASN A1095 -12.048 -54.754 12.408 1.00 23.40 H new ATOM 0 HA ASN A1095 -13.649 -52.816 10.897 1.00 14.24 H new ATOM 0 HB2 ASN A1095 -12.688 -55.179 10.125 1.00 1.42 H new ATOM 0 HB3 ASN A1095 -14.105 -55.797 10.949 1.00 1.42 H new ATOM 0 HD21 ASN A1095 -14.709 -53.257 7.702 1.00 34.40 H new ATOM 0 HD22 ASN A1095 -13.360 -52.984 8.809 1.00 34.40 H new ATOM 711 N LEU A1096 -14.852 -52.882 13.342 1.00 1.13 N ATOM 712 CA LEU A1096 -15.944 -52.816 14.307 1.00 75.11 C ATOM 713 C LEU A1096 -16.929 -51.711 13.941 1.00 51.34 C ATOM 714 O LEU A1096 -16.617 -50.525 14.049 1.00 54.12 O ATOM 715 CB LEU A1096 -15.393 -52.578 15.714 1.00 22.42 C ATOM 716 CG LEU A1096 -16.227 -53.141 16.865 1.00 30.42 C ATOM 717 CD1 LEU A1096 -17.631 -52.556 16.844 1.00 31.21 C ATOM 718 CD2 LEU A1096 -16.279 -54.661 16.793 1.00 12.15 C ATOM 0 H LEU A1096 -14.133 -52.170 13.470 1.00 1.13 H new ATOM 0 HA LEU A1096 -16.472 -53.769 14.286 1.00 75.11 H new ATOM 0 HB2 LEU A1096 -14.394 -53.011 15.770 1.00 22.42 H new ATOM 0 HB3 LEU A1096 -15.283 -51.504 15.863 1.00 22.42 H new ATOM 0 HG LEU A1096 -15.752 -52.858 17.804 1.00 30.42 H new ATOM 0 HD11 LEU A1096 -18.209 -52.969 17.671 1.00 31.21 H new ATOM 0 HD12 LEU A1096 -17.575 -51.472 16.946 1.00 31.21 H new ATOM 0 HD13 LEU A1096 -18.116 -52.807 15.901 1.00 31.21 H new ATOM 0 HD21 LEU A1096 -16.877 -55.044 17.620 1.00 12.15 H new ATOM 0 HD22 LEU A1096 -16.729 -54.965 15.848 1.00 12.15 H new ATOM 0 HD23 LEU A1096 -15.268 -55.063 16.859 1.00 12.15 H new ATOM 730 N LYS A1097 -18.121 -52.108 13.509 1.00 14.32 N ATOM 731 CA LYS A1097 -19.154 -51.152 13.129 1.00 31.11 C ATOM 732 C LYS A1097 -20.148 -50.944 14.268 1.00 52.24 C ATOM 733 O LYS A1097 -20.326 -51.818 15.114 1.00 10.44 O ATOM 734 CB LYS A1097 -19.891 -51.636 11.877 1.00 21.34 C ATOM 735 CG LYS A1097 -19.012 -51.700 10.640 1.00 45.12 C ATOM 736 CD LYS A1097 -19.833 -51.939 9.385 1.00 11.25 C ATOM 737 CE LYS A1097 -19.090 -51.486 8.138 1.00 35.44 C ATOM 738 NZ LYS A1097 -19.014 -50.002 8.045 1.00 31.23 N ATOM 0 H LYS A1097 -18.396 -53.086 13.413 1.00 14.32 H new ATOM 0 HA LYS A1097 -18.670 -50.199 12.913 1.00 31.11 H new ATOM 0 HB2 LYS A1097 -20.305 -52.626 12.069 1.00 21.34 H new ATOM 0 HB3 LYS A1097 -20.732 -50.971 11.681 1.00 21.34 H new ATOM 0 HG2 LYS A1097 -18.455 -50.768 10.540 1.00 45.12 H new ATOM 0 HG3 LYS A1097 -18.279 -52.499 10.754 1.00 45.12 H new ATOM 0 HD2 LYS A1097 -20.072 -52.999 9.302 1.00 11.25 H new ATOM 0 HD3 LYS A1097 -20.779 -51.403 9.461 1.00 11.25 H new ATOM 0 HE2 LYS A1097 -18.082 -51.901 8.145 1.00 35.44 H new ATOM 0 HE3 LYS A1097 -19.591 -51.880 7.254 1.00 35.44 H new ATOM 0 HZ1 LYS A1097 -18.785 -49.727 7.069 1.00 31.23 H new ATOM 0 HZ2 LYS A1097 -19.930 -49.590 8.316 1.00 31.23 H new ATOM 0 HZ3 LYS A1097 -18.274 -49.651 8.686 1.00 31.23 H new ATOM 752 N GLU A1098 -20.791 -49.780 14.281 1.00 14.42 N ATOM 753 CA GLU A1098 -21.767 -49.459 15.316 1.00 53.33 C ATOM 754 C GLU A1098 -23.172 -49.365 14.728 1.00 22.43 C ATOM 755 O GLU A1098 -24.154 -49.722 15.380 1.00 43.22 O ATOM 756 CB GLU A1098 -21.400 -48.141 16.002 1.00 11.31 C ATOM 757 CG GLU A1098 -21.374 -46.950 15.058 1.00 72.32 C ATOM 758 CD GLU A1098 -21.030 -45.653 15.765 1.00 34.32 C ATOM 759 OE1 GLU A1098 -20.267 -45.701 16.752 1.00 53.14 O ATOM 760 OE2 GLU A1098 -21.524 -44.592 15.332 1.00 14.34 O ATOM 0 H GLU A1098 -20.654 -49.045 13.587 1.00 14.42 H new ATOM 0 HA GLU A1098 -21.754 -50.261 16.054 1.00 53.33 H new ATOM 0 HB2 GLU A1098 -22.115 -47.945 16.801 1.00 11.31 H new ATOM 0 HB3 GLU A1098 -20.421 -48.245 16.470 1.00 11.31 H new ATOM 0 HG2 GLU A1098 -20.646 -47.133 14.268 1.00 72.32 H new ATOM 0 HG3 GLU A1098 -22.347 -46.851 14.578 1.00 72.32 H new ATOM 767 N LYS A1099 -23.260 -48.884 13.494 1.00 41.40 N ATOM 768 CA LYS A1099 -24.544 -48.743 12.817 1.00 75.21 C ATOM 769 C LYS A1099 -24.455 -49.234 11.375 1.00 62.52 C ATOM 770 O LYS A1099 -23.758 -48.644 10.551 1.00 12.31 O ATOM 771 CB LYS A1099 -25.000 -47.283 12.842 1.00 42.33 C ATOM 772 CG LYS A1099 -25.895 -46.945 14.021 1.00 25.25 C ATOM 773 CD LYS A1099 -26.626 -45.630 13.808 1.00 65.32 C ATOM 774 CE LYS A1099 -26.110 -44.548 14.746 1.00 31.13 C ATOM 775 NZ LYS A1099 -26.800 -44.583 16.064 1.00 44.01 N ATOM 0 H LYS A1099 -22.457 -48.585 12.941 1.00 41.40 H new ATOM 0 HA LYS A1099 -25.275 -49.354 13.347 1.00 75.21 H new ATOM 0 HB2 LYS A1099 -24.122 -46.637 12.866 1.00 42.33 H new ATOM 0 HB3 LYS A1099 -25.533 -47.062 11.917 1.00 42.33 H new ATOM 0 HG2 LYS A1099 -26.620 -47.745 14.170 1.00 25.25 H new ATOM 0 HG3 LYS A1099 -25.295 -46.886 14.929 1.00 25.25 H new ATOM 0 HD2 LYS A1099 -26.502 -45.307 12.774 1.00 65.32 H new ATOM 0 HD3 LYS A1099 -27.694 -45.775 13.971 1.00 65.32 H new ATOM 0 HE2 LYS A1099 -25.038 -44.676 14.894 1.00 31.13 H new ATOM 0 HE3 LYS A1099 -26.254 -43.570 14.287 1.00 31.13 H new ATOM 0 HZ1 LYS A1099 -26.421 -43.831 16.674 1.00 44.01 H new ATOM 0 HZ2 LYS A1099 -27.820 -44.435 15.926 1.00 44.01 H new ATOM 0 HZ3 LYS A1099 -26.642 -45.507 16.514 1.00 44.01 H new ATOM 789 N MET A1100 -25.167 -50.316 11.079 1.00 10.21 N ATOM 790 CA MET A1100 -25.170 -50.884 9.735 1.00 4.33 C ATOM 791 C MET A1100 -25.972 -50.008 8.777 1.00 21.33 C ATOM 792 O MET A1100 -25.672 -49.943 7.585 1.00 31.01 O ATOM 793 CB MET A1100 -25.752 -52.299 9.758 1.00 72.43 C ATOM 794 CG MET A1100 -25.333 -53.147 8.568 1.00 22.15 C ATOM 795 SD MET A1100 -23.620 -53.698 8.676 1.00 53.30 S ATOM 796 CE MET A1100 -23.829 -55.309 9.432 1.00 45.30 C ATOM 0 H MET A1100 -25.749 -50.817 11.750 1.00 10.21 H new ATOM 0 HA MET A1100 -24.139 -50.928 9.383 1.00 4.33 H new ATOM 0 HB2 MET A1100 -25.440 -52.797 10.676 1.00 72.43 H new ATOM 0 HB3 MET A1100 -26.840 -52.235 9.784 1.00 72.43 H new ATOM 0 HG2 MET A1100 -25.986 -54.017 8.499 1.00 22.15 H new ATOM 0 HG3 MET A1100 -25.469 -52.572 7.652 1.00 22.15 H new ATOM 0 HE1 MET A1100 -22.854 -55.778 9.565 1.00 45.30 H new ATOM 0 HE2 MET A1100 -24.312 -55.196 10.402 1.00 45.30 H new ATOM 0 HE3 MET A1100 -24.448 -55.935 8.789 1.00 45.30 H new ATOM 806 N GLU A1101 -26.991 -49.338 9.306 1.00 31.01 N ATOM 807 CA GLU A1101 -27.835 -48.468 8.496 1.00 55.02 C ATOM 808 C GLU A1101 -26.990 -47.469 7.711 1.00 55.42 C ATOM 809 O GLU A1101 -27.257 -47.198 6.540 1.00 4.21 O ATOM 810 CB GLU A1101 -28.835 -47.722 9.381 1.00 20.13 C ATOM 811 CG GLU A1101 -30.004 -48.581 9.835 1.00 10.50 C ATOM 812 CD GLU A1101 -31.187 -47.756 10.304 1.00 62.43 C ATOM 813 OE1 GLU A1101 -31.276 -46.572 9.917 1.00 32.50 O ATOM 814 OE2 GLU A1101 -32.023 -48.296 11.059 1.00 43.52 O ATOM 0 H GLU A1101 -27.252 -49.381 10.291 1.00 31.01 H new ATOM 0 HA GLU A1101 -28.382 -49.091 7.788 1.00 55.02 H new ATOM 0 HB2 GLU A1101 -28.315 -47.338 10.258 1.00 20.13 H new ATOM 0 HB3 GLU A1101 -29.219 -46.860 8.835 1.00 20.13 H new ATOM 0 HG2 GLU A1101 -30.318 -49.225 9.013 1.00 10.50 H new ATOM 0 HG3 GLU A1101 -29.677 -49.234 10.644 1.00 10.50 H new ATOM 821 N ALA A1102 -25.970 -46.923 8.364 1.00 43.01 N ATOM 822 CA ALA A1102 -25.085 -45.955 7.728 1.00 64.03 C ATOM 823 C ALA A1102 -23.793 -46.615 7.262 1.00 75.51 C ATOM 824 O ALA A1102 -23.149 -47.344 8.017 1.00 63.03 O ATOM 825 CB ALA A1102 -24.780 -44.810 8.684 1.00 13.14 C ATOM 0 H ALA A1102 -25.736 -47.135 9.334 1.00 43.01 H new ATOM 0 HA ALA A1102 -25.595 -45.556 6.851 1.00 64.03 H new ATOM 0 HB1 ALA A1102 -24.118 -44.095 8.196 1.00 13.14 H new ATOM 0 HB2 ALA A1102 -25.709 -44.313 8.964 1.00 13.14 H new ATOM 0 HB3 ALA A1102 -24.295 -45.202 9.578 1.00 13.14 H new ATOM 831 N GLY A1103 -23.418 -46.358 6.013 1.00 51.25 N ATOM 832 CA GLY A1103 -22.204 -46.936 5.468 1.00 54.13 C ATOM 833 C GLY A1103 -21.886 -46.417 4.079 1.00 23.12 C ATOM 834 O GLY A1103 -22.788 -45.923 3.404 1.00 24.01 O ATOM 0 H GLY A1103 -23.934 -45.759 5.368 1.00 51.25 H new ATOM 0 HA2 GLY A1103 -21.370 -46.716 6.134 1.00 54.13 H new ATOM 0 HA3 GLY A1103 -22.306 -48.021 5.432 1.00 54.13 H new TER 838 GLY A1103