USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1098 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 10 TYR OH : rot 30:sc= 0 USER MOD Set 1.2: A 121 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Set 2.1: A 13 SER OG : rot 180:sc= -0.681 USER MOD Set 2.2: A 90 THR OG1 : rot 134:sc= 0.5 USER MOD Set 3.1: A 80 ASN : amide:sc= 0.373 K(o=-2.5,f=-3.1!) USER MOD Set 3.2: A 83 GLN : amide:sc= -2.86! K(o=-2.5!,f=-1.1) USER MOD Single : A 1 SER N :NH3+ -166:sc= 2.47 (180deg=2.45) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 83:sc= 0.0916 USER MOD Single : A 8 SER OG : rot 79:sc= 0.568 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 22 ASN : amide:sc= -0.0428 X(o=-0.043,f=0) USER MOD Single : A 25 THR OG1 : rot -86:sc= 1.3 USER MOD Single : A 26 LYS NZ :NH3+ -132:sc= -1.83 (180deg=-4.82!) USER MOD Single : A 27 THR OG1 : rot 92:sc= 0.819 USER MOD Single : A 43 GLN : amide:sc= -0.932 K(o=-0.93,f=-0.0037) USER MOD Single : A 52 CYS SG : rot -94:sc= 0.507 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -138:sc= -0.127 (180deg=-0.611) USER MOD Single : A 60 SER OG : rot -70:sc= -0.0118 USER MOD Single : A 64 SER OG : rot 130:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -157:sc= 0.811 (180deg=-0.29!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.137) USER MOD Single : A 107 ASN : amide:sc= -0.598 K(o=-0.6,f=-4.3!) USER MOD Single : A 111 THR OG1 : rot 109:sc= 0.927 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ -171:sc=-0.00168 (180deg=-0.0849) USER MOD Single : A 122 THR OG1 : rot 34:sc= 0.69 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -0.291 K(o=-0.29,f=-5.3!) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -164:sc= -0.0418 (180deg=-0.337) USER MOD Single : A 131 CYS SG : rot 72:sc= -4.2! USER MOD Single : A 136 THR OG1 : rot 90:sc= 0.265 USER MOD Single : A 140 GLN : amide:sc= -0.725 X(o=-0.72,f=-0.44) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 7.484 -7.753 4.071 1.00 1.22 N ATOM 2 CA SER A 1 6.029 -7.973 3.845 1.00 54.20 C ATOM 3 C SER A 1 5.225 -6.700 4.121 1.00 33.23 C ATOM 4 O SER A 1 5.763 -5.722 4.628 1.00 13.31 O ATOM 5 CB SER A 1 5.521 -9.112 4.741 1.00 22.34 C ATOM 6 OG SER A 1 6.181 -10.331 4.438 1.00 72.43 O ATOM 0 H1 SER A 1 8.023 -8.540 3.657 1.00 1.22 H new ATOM 0 H2 SER A 1 7.774 -6.861 3.622 1.00 1.22 H new ATOM 0 H3 SER A 1 7.673 -7.704 5.092 1.00 1.22 H new ATOM 0 HA SER A 1 5.890 -8.245 2.799 1.00 54.20 H new ATOM 0 HB2 SER A 1 5.685 -8.856 5.788 1.00 22.34 H new ATOM 0 HB3 SER A 1 4.446 -9.233 4.607 1.00 22.34 H new ATOM 0 HG SER A 1 5.842 -11.041 5.023 1.00 72.43 H new ATOM 14 N ILE A 2 3.933 -6.722 3.782 1.00 71.54 N ATOM 15 CA ILE A 2 3.039 -5.576 4.009 1.00 45.44 C ATOM 16 C ILE A 2 3.516 -4.319 3.258 1.00 31.52 C ATOM 17 O ILE A 2 4.302 -3.526 3.779 1.00 62.15 O ATOM 18 CB ILE A 2 2.886 -5.257 5.527 1.00 44.23 C ATOM 19 CG1 ILE A 2 2.310 -6.472 6.277 1.00 4.11 C ATOM 20 CG2 ILE A 2 2.005 -4.024 5.747 1.00 74.35 C ATOM 21 CD1 ILE A 2 0.929 -6.886 5.806 1.00 13.25 C ATOM 0 H ILE A 2 3.478 -7.524 3.347 1.00 71.54 H new ATOM 0 HA ILE A 2 2.065 -5.864 3.614 1.00 45.44 H new ATOM 0 HB ILE A 2 3.876 -5.038 5.926 1.00 44.23 H new ATOM 0 HG12 ILE A 2 2.991 -7.315 6.160 1.00 4.11 H new ATOM 0 HG13 ILE A 2 2.267 -6.242 7.342 1.00 4.11 H new ATOM 0 HG21 ILE A 2 1.916 -3.826 6.815 1.00 74.35 H new ATOM 0 HG22 ILE A 2 2.455 -3.162 5.254 1.00 74.35 H new ATOM 0 HG23 ILE A 2 1.015 -4.205 5.328 1.00 74.35 H new ATOM 0 HD11 ILE A 2 0.591 -7.748 6.382 1.00 13.25 H new ATOM 0 HD12 ILE A 2 0.233 -6.059 5.949 1.00 13.25 H new ATOM 0 HD13 ILE A 2 0.969 -7.149 4.749 1.00 13.25 H new ATOM 33 N GLY A 3 3.053 -4.162 2.021 1.00 64.13 N ATOM 34 CA GLY A 3 3.375 -2.970 1.245 1.00 72.24 C ATOM 35 C GLY A 3 2.432 -1.812 1.547 1.00 43.05 C ATOM 36 O GLY A 3 1.385 -1.668 0.911 1.00 72.33 O ATOM 0 H GLY A 3 2.460 -4.838 1.539 1.00 64.13 H new ATOM 0 HA2 GLY A 3 4.400 -2.666 1.458 1.00 72.24 H new ATOM 0 HA3 GLY A 3 3.327 -3.207 0.182 1.00 72.24 H new ATOM 40 N VAL A 4 2.793 -0.992 2.529 1.00 34.42 N ATOM 41 CA VAL A 4 1.945 0.129 2.951 1.00 22.23 C ATOM 42 C VAL A 4 2.119 1.363 2.044 1.00 3.43 C ATOM 43 O VAL A 4 3.213 1.914 1.910 1.00 3.53 O ATOM 44 CB VAL A 4 2.204 0.516 4.433 1.00 4.02 C ATOM 45 CG1 VAL A 4 3.679 0.837 4.675 1.00 51.11 C ATOM 46 CG2 VAL A 4 1.311 1.688 4.855 1.00 65.32 C ATOM 0 H VAL A 4 3.666 -1.079 3.050 1.00 34.42 H new ATOM 0 HA VAL A 4 0.915 -0.215 2.857 1.00 22.23 H new ATOM 0 HB VAL A 4 1.948 -0.345 5.051 1.00 4.02 H new ATOM 0 HG11 VAL A 4 3.826 1.104 5.721 1.00 51.11 H new ATOM 0 HG12 VAL A 4 4.286 -0.036 4.434 1.00 51.11 H new ATOM 0 HG13 VAL A 4 3.978 1.672 4.042 1.00 51.11 H new ATOM 0 HG21 VAL A 4 1.510 1.941 5.896 1.00 65.32 H new ATOM 0 HG22 VAL A 4 1.523 2.552 4.225 1.00 65.32 H new ATOM 0 HG23 VAL A 4 0.264 1.406 4.744 1.00 65.32 H new ATOM 56 N PHE A 5 1.020 1.779 1.422 1.00 43.43 N ATOM 57 CA PHE A 5 1.001 2.958 0.553 1.00 14.44 C ATOM 58 C PHE A 5 0.546 4.206 1.321 1.00 15.32 C ATOM 59 O PHE A 5 -0.514 4.208 1.946 1.00 5.43 O ATOM 60 CB PHE A 5 0.051 2.728 -0.631 1.00 31.51 C ATOM 61 CG PHE A 5 0.388 1.526 -1.473 1.00 14.12 C ATOM 62 CD1 PHE A 5 1.439 1.565 -2.378 1.00 24.11 C ATOM 63 CD2 PHE A 5 -0.354 0.360 -1.366 1.00 74.11 C ATOM 64 CE1 PHE A 5 1.744 0.464 -3.155 1.00 30.34 C ATOM 65 CE2 PHE A 5 -0.055 -0.742 -2.142 1.00 12.53 C ATOM 66 CZ PHE A 5 0.994 -0.690 -3.036 1.00 31.52 C ATOM 0 H PHE A 5 0.117 1.311 1.504 1.00 43.43 H new ATOM 0 HA PHE A 5 2.016 3.117 0.190 1.00 14.44 H new ATOM 0 HB2 PHE A 5 -0.964 2.617 -0.250 1.00 31.51 H new ATOM 0 HB3 PHE A 5 0.059 3.615 -1.265 1.00 31.51 H new ATOM 0 HD1 PHE A 5 2.026 2.467 -2.476 1.00 24.11 H new ATOM 0 HD2 PHE A 5 -1.176 0.313 -0.667 1.00 74.11 H new ATOM 0 HE1 PHE A 5 2.567 0.505 -3.854 1.00 30.34 H new ATOM 0 HE2 PHE A 5 -0.642 -1.644 -2.049 1.00 12.53 H new ATOM 0 HZ PHE A 5 1.229 -1.552 -3.643 1.00 31.52 H new ATOM 76 N TYR A 6 1.340 5.269 1.260 1.00 43.34 N ATOM 77 CA TYR A 6 1.000 6.523 1.939 1.00 61.23 C ATOM 78 C TYR A 6 1.764 7.706 1.324 1.00 22.14 C ATOM 79 O TYR A 6 2.514 7.541 0.360 1.00 14.53 O ATOM 80 CB TYR A 6 1.300 6.413 3.443 1.00 52.42 C ATOM 81 CG TYR A 6 2.775 6.272 3.774 1.00 14.41 C ATOM 82 CD1 TYR A 6 3.492 5.143 3.392 1.00 0.31 C ATOM 83 CD2 TYR A 6 3.456 7.276 4.461 1.00 1.20 C ATOM 84 CE1 TYR A 6 4.833 5.016 3.686 1.00 73.51 C ATOM 85 CE2 TYR A 6 4.800 7.154 4.755 1.00 31.21 C ATOM 86 CZ TYR A 6 5.482 6.022 4.365 1.00 51.04 C ATOM 87 OH TYR A 6 6.824 5.897 4.643 1.00 3.21 O ATOM 0 H TYR A 6 2.223 5.292 0.750 1.00 43.34 H new ATOM 0 HA TYR A 6 -0.067 6.704 1.807 1.00 61.23 H new ATOM 0 HB2 TYR A 6 0.909 7.298 3.946 1.00 52.42 H new ATOM 0 HB3 TYR A 6 0.765 5.554 3.847 1.00 52.42 H new ATOM 0 HD1 TYR A 6 2.989 4.352 2.856 1.00 0.31 H new ATOM 0 HD2 TYR A 6 2.924 8.164 4.768 1.00 1.20 H new ATOM 0 HE1 TYR A 6 5.372 4.130 3.385 1.00 73.51 H new ATOM 0 HE2 TYR A 6 5.313 7.941 5.287 1.00 31.21 H new ATOM 0 HH TYR A 6 7.347 6.179 3.864 1.00 3.21 H new ATOM 97 N VAL A 7 1.555 8.901 1.873 1.00 1.31 N ATOM 98 CA VAL A 7 2.250 10.103 1.396 1.00 3.10 C ATOM 99 C VAL A 7 2.798 10.949 2.565 1.00 62.42 C ATOM 100 O VAL A 7 2.046 11.608 3.285 1.00 1.35 O ATOM 101 CB VAL A 7 1.322 10.966 0.492 1.00 11.14 C ATOM 102 CG1 VAL A 7 0.006 11.302 1.201 1.00 31.40 C ATOM 103 CG2 VAL A 7 2.038 12.239 0.032 1.00 21.24 C ATOM 0 H VAL A 7 0.912 9.066 2.647 1.00 1.31 H new ATOM 0 HA VAL A 7 3.098 9.766 0.800 1.00 3.10 H new ATOM 0 HB VAL A 7 1.078 10.376 -0.392 1.00 11.14 H new ATOM 0 HG11 VAL A 7 -0.619 11.905 0.542 1.00 31.40 H new ATOM 0 HG12 VAL A 7 -0.517 10.380 1.453 1.00 31.40 H new ATOM 0 HG13 VAL A 7 0.216 11.860 2.113 1.00 31.40 H new ATOM 0 HG21 VAL A 7 1.369 12.825 -0.598 1.00 21.24 H new ATOM 0 HG22 VAL A 7 2.326 12.829 0.902 1.00 21.24 H new ATOM 0 HG23 VAL A 7 2.929 11.970 -0.536 1.00 21.24 H new ATOM 113 N SER A 8 4.117 10.909 2.758 1.00 4.20 N ATOM 114 CA SER A 8 4.789 11.704 3.802 1.00 23.52 C ATOM 115 C SER A 8 4.787 13.204 3.475 1.00 31.10 C ATOM 116 O SER A 8 4.883 14.042 4.373 1.00 3.51 O ATOM 117 CB SER A 8 6.234 11.227 3.992 1.00 71.11 C ATOM 118 OG SER A 8 6.279 9.896 4.479 1.00 23.52 O ATOM 0 H SER A 8 4.750 10.332 2.204 1.00 4.20 H new ATOM 0 HA SER A 8 4.228 11.557 4.725 1.00 23.52 H new ATOM 0 HB2 SER A 8 6.766 11.287 3.043 1.00 71.11 H new ATOM 0 HB3 SER A 8 6.749 11.889 4.689 1.00 71.11 H new ATOM 0 HG SER A 8 6.120 9.272 3.740 1.00 23.52 H new ATOM 124 N GLU A 9 4.678 13.535 2.190 1.00 33.04 N ATOM 125 CA GLU A 9 4.638 14.935 1.741 1.00 13.25 C ATOM 126 C GLU A 9 3.499 15.717 2.432 1.00 53.23 C ATOM 127 O GLU A 9 3.701 16.821 2.940 1.00 65.24 O ATOM 128 CB GLU A 9 4.479 14.973 0.216 1.00 4.12 C ATOM 129 CG GLU A 9 4.649 16.355 -0.401 1.00 31.44 C ATOM 130 CD GLU A 9 4.725 16.300 -1.920 1.00 73.13 C ATOM 131 OE1 GLU A 9 5.825 16.035 -2.451 1.00 44.12 O ATOM 132 OE2 GLU A 9 3.687 16.500 -2.582 1.00 34.44 O ATOM 0 H GLU A 9 4.615 12.853 1.434 1.00 33.04 H new ATOM 0 HA GLU A 9 5.574 15.419 2.019 1.00 13.25 H new ATOM 0 HB2 GLU A 9 5.209 14.297 -0.230 1.00 4.12 H new ATOM 0 HB3 GLU A 9 3.491 14.592 -0.044 1.00 4.12 H new ATOM 0 HG2 GLU A 9 3.814 16.989 -0.103 1.00 31.44 H new ATOM 0 HG3 GLU A 9 5.556 16.817 -0.010 1.00 31.44 H new ATOM 139 N TYR A 10 2.305 15.126 2.454 1.00 64.41 N ATOM 140 CA TYR A 10 1.163 15.670 3.214 1.00 34.30 C ATOM 141 C TYR A 10 0.982 14.857 4.513 1.00 12.31 C ATOM 142 O TYR A 10 -0.088 14.842 5.120 1.00 21.32 O ATOM 143 CB TYR A 10 -0.109 15.610 2.344 1.00 53.51 C ATOM 144 CG TYR A 10 -1.292 16.407 2.882 1.00 3.21 C ATOM 145 CD1 TYR A 10 -1.269 17.799 2.889 1.00 1.20 C ATOM 146 CD2 TYR A 10 -2.435 15.772 3.367 1.00 52.22 C ATOM 147 CE1 TYR A 10 -2.340 18.532 3.363 1.00 20.35 C ATOM 148 CE2 TYR A 10 -3.513 16.502 3.840 1.00 52.33 C ATOM 149 CZ TYR A 10 -3.461 17.880 3.837 1.00 11.23 C ATOM 150 OH TYR A 10 -4.532 18.618 4.299 1.00 11.23 O ATOM 0 H TYR A 10 2.095 14.263 1.952 1.00 64.41 H new ATOM 0 HA TYR A 10 1.350 16.711 3.478 1.00 34.30 H new ATOM 0 HB2 TYR A 10 0.133 15.976 1.346 1.00 53.51 H new ATOM 0 HB3 TYR A 10 -0.410 14.568 2.237 1.00 53.51 H new ATOM 0 HD1 TYR A 10 -0.397 18.316 2.517 1.00 1.20 H new ATOM 0 HD2 TYR A 10 -2.480 14.693 3.374 1.00 52.22 H new ATOM 0 HE1 TYR A 10 -2.300 19.611 3.363 1.00 20.35 H new ATOM 0 HE2 TYR A 10 -4.391 15.994 4.210 1.00 52.33 H new ATOM 0 HH TYR A 10 -4.571 19.472 3.820 1.00 11.23 H new ATOM 160 N GLY A 11 2.078 14.208 4.916 1.00 12.11 N ATOM 161 CA GLY A 11 2.095 13.217 5.996 1.00 62.31 C ATOM 162 C GLY A 11 1.081 13.390 7.124 1.00 41.24 C ATOM 163 O GLY A 11 1.332 14.091 8.107 1.00 60.13 O ATOM 0 H GLY A 11 2.994 14.359 4.494 1.00 12.11 H new ATOM 0 HA2 GLY A 11 1.941 12.233 5.553 1.00 62.31 H new ATOM 0 HA3 GLY A 11 3.092 13.216 6.437 1.00 62.31 H new ATOM 167 N TYR A 12 -0.072 12.753 6.965 1.00 54.51 N ATOM 168 CA TYR A 12 -0.930 12.384 8.095 1.00 31.43 C ATOM 169 C TYR A 12 -0.810 10.875 8.365 1.00 65.11 C ATOM 170 O TYR A 12 -0.866 10.414 9.506 1.00 24.52 O ATOM 171 CB TYR A 12 -2.395 12.763 7.828 1.00 5.30 C ATOM 172 CG TYR A 12 -2.719 14.209 8.162 1.00 14.43 C ATOM 173 CD1 TYR A 12 -2.566 15.222 7.221 1.00 61.43 C ATOM 174 CD2 TYR A 12 -3.173 14.557 9.430 1.00 35.33 C ATOM 175 CE1 TYR A 12 -2.856 16.537 7.535 1.00 55.45 C ATOM 176 CE2 TYR A 12 -3.464 15.867 9.751 1.00 23.11 C ATOM 177 CZ TYR A 12 -3.305 16.853 8.802 1.00 44.24 C ATOM 178 OH TYR A 12 -3.589 18.161 9.126 1.00 41.33 O ATOM 0 H TYR A 12 -0.442 12.476 6.056 1.00 54.51 H new ATOM 0 HA TYR A 12 -0.598 12.936 8.974 1.00 31.43 H new ATOM 0 HB2 TYR A 12 -2.623 12.581 6.778 1.00 5.30 H new ATOM 0 HB3 TYR A 12 -3.043 12.110 8.412 1.00 5.30 H new ATOM 0 HD1 TYR A 12 -2.215 14.977 6.229 1.00 61.43 H new ATOM 0 HD2 TYR A 12 -3.300 13.788 10.177 1.00 35.33 H new ATOM 0 HE1 TYR A 12 -2.732 17.312 6.794 1.00 55.45 H new ATOM 0 HE2 TYR A 12 -3.815 16.118 10.741 1.00 23.11 H new ATOM 0 HH TYR A 12 -3.894 18.209 10.056 1.00 41.33 H new ATOM 188 N SER A 13 -0.629 10.120 7.280 1.00 20.12 N ATOM 189 CA SER A 13 -0.618 8.651 7.318 1.00 53.22 C ATOM 190 C SER A 13 0.721 8.076 7.800 1.00 54.24 C ATOM 191 O SER A 13 0.809 6.889 8.108 1.00 32.23 O ATOM 192 CB SER A 13 -0.926 8.097 5.920 1.00 1.44 C ATOM 193 OG SER A 13 -2.114 8.663 5.390 1.00 75.43 O ATOM 0 H SER A 13 -0.485 10.507 6.347 1.00 20.12 H new ATOM 0 HA SER A 13 -1.382 8.347 8.034 1.00 53.22 H new ATOM 0 HB2 SER A 13 -0.091 8.307 5.251 1.00 1.44 H new ATOM 0 HB3 SER A 13 -1.029 7.013 5.971 1.00 1.44 H new ATOM 0 HG SER A 13 -2.284 8.292 4.499 1.00 75.43 H new ATOM 199 N ASP A 14 1.760 8.907 7.863 1.00 14.43 N ATOM 200 CA ASP A 14 3.091 8.447 8.279 1.00 52.15 C ATOM 201 C ASP A 14 3.068 7.923 9.725 1.00 44.13 C ATOM 202 O ASP A 14 3.708 6.919 10.048 1.00 22.30 O ATOM 203 CB ASP A 14 4.109 9.584 8.136 1.00 53.41 C ATOM 204 CG ASP A 14 3.767 10.774 9.016 1.00 51.13 C ATOM 205 OD1 ASP A 14 2.684 11.361 8.826 1.00 11.12 O ATOM 206 OD2 ASP A 14 4.568 11.107 9.916 1.00 42.31 O ATOM 0 H ASP A 14 1.710 9.899 7.633 1.00 14.43 H new ATOM 0 HA ASP A 14 3.388 7.623 7.629 1.00 52.15 H new ATOM 0 HB2 ASP A 14 5.101 9.216 8.396 1.00 53.41 H new ATOM 0 HB3 ASP A 14 4.150 9.904 7.095 1.00 53.41 H new ATOM 211 N ARG A 15 2.312 8.605 10.585 1.00 2.14 N ATOM 212 CA ARG A 15 2.143 8.180 11.980 1.00 61.45 C ATOM 213 C ARG A 15 1.284 6.908 12.063 1.00 11.03 C ATOM 214 O ARG A 15 1.544 6.013 12.870 1.00 23.05 O ATOM 215 CB ARG A 15 1.496 9.303 12.801 1.00 31.12 C ATOM 216 CG ARG A 15 2.236 10.634 12.714 1.00 74.14 C ATOM 217 CD ARG A 15 3.672 10.528 13.219 1.00 20.31 C ATOM 218 NE ARG A 15 3.738 10.173 14.635 1.00 45.44 N ATOM 219 CZ ARG A 15 4.846 10.118 15.324 1.00 70.51 C ATOM 220 NH1 ARG A 15 5.985 10.378 14.768 1.00 0.44 N ATOM 221 NH2 ARG A 15 4.811 9.817 16.579 1.00 62.31 N ATOM 0 H ARG A 15 1.805 9.456 10.342 1.00 2.14 H new ATOM 0 HA ARG A 15 3.128 7.959 12.391 1.00 61.45 H new ATOM 0 HB2 ARG A 15 0.471 9.445 12.460 1.00 31.12 H new ATOM 0 HB3 ARG A 15 1.445 8.994 13.845 1.00 31.12 H new ATOM 0 HG2 ARG A 15 2.241 10.978 11.680 1.00 74.14 H new ATOM 0 HG3 ARG A 15 1.702 11.384 13.297 1.00 74.14 H new ATOM 0 HD2 ARG A 15 4.206 9.779 12.634 1.00 20.31 H new ATOM 0 HD3 ARG A 15 4.181 11.479 13.061 1.00 20.31 H new ATOM 0 HE ARG A 15 2.865 9.955 15.115 1.00 45.44 H new ATOM 0 HH11 ARG A 15 6.025 10.630 13.780 1.00 0.44 H new ATOM 0 HH12 ARG A 15 6.843 10.331 15.317 1.00 0.44 H new ATOM 0 HH21 ARG A 15 3.918 9.622 17.032 1.00 62.31 H new ATOM 0 HH22 ARG A 15 5.676 9.774 17.117 1.00 62.31 H new ATOM 235 N LEU A 16 0.261 6.838 11.211 1.00 50.55 N ATOM 236 CA LEU A 16 -0.615 5.664 11.131 1.00 62.21 C ATOM 237 C LEU A 16 0.179 4.412 10.722 1.00 53.35 C ATOM 238 O LEU A 16 0.016 3.337 11.304 1.00 21.45 O ATOM 239 CB LEU A 16 -1.744 5.918 10.121 1.00 71.23 C ATOM 240 CG LEU A 16 -2.597 7.172 10.384 1.00 15.22 C ATOM 241 CD1 LEU A 16 -3.660 7.342 9.301 1.00 32.13 C ATOM 242 CD2 LEU A 16 -3.243 7.105 11.765 1.00 34.41 C ATOM 0 H LEU A 16 0.016 7.585 10.561 1.00 50.55 H new ATOM 0 HA LEU A 16 -1.045 5.492 12.118 1.00 62.21 H new ATOM 0 HB2 LEU A 16 -1.307 5.999 9.126 1.00 71.23 H new ATOM 0 HB3 LEU A 16 -2.401 5.048 10.110 1.00 71.23 H new ATOM 0 HG LEU A 16 -1.940 8.041 10.355 1.00 15.22 H new ATOM 0 HD11 LEU A 16 -4.251 8.235 9.508 1.00 32.13 H new ATOM 0 HD12 LEU A 16 -3.177 7.444 8.329 1.00 32.13 H new ATOM 0 HD13 LEU A 16 -4.313 6.469 9.292 1.00 32.13 H new ATOM 0 HD21 LEU A 16 -3.841 8.001 11.931 1.00 34.41 H new ATOM 0 HD22 LEU A 16 -3.883 6.225 11.825 1.00 34.41 H new ATOM 0 HD23 LEU A 16 -2.466 7.041 12.527 1.00 34.41 H new ATOM 254 N ALA A 17 1.045 4.569 9.720 1.00 40.21 N ATOM 255 CA ALA A 17 1.906 3.479 9.252 1.00 4.45 C ATOM 256 C ALA A 17 2.886 3.031 10.347 1.00 3.42 C ATOM 257 O ALA A 17 3.169 1.841 10.490 1.00 71.31 O ATOM 258 CB ALA A 17 2.661 3.907 7.996 1.00 10.52 C ATOM 0 H ALA A 17 1.170 5.446 9.214 1.00 40.21 H new ATOM 0 HA ALA A 17 1.272 2.627 9.008 1.00 4.45 H new ATOM 0 HB1 ALA A 17 3.297 3.089 7.658 1.00 10.52 H new ATOM 0 HB2 ALA A 17 1.948 4.160 7.212 1.00 10.52 H new ATOM 0 HB3 ALA A 17 3.278 4.777 8.221 1.00 10.52 H new ATOM 264 N GLN A 18 3.389 3.994 11.123 1.00 53.01 N ATOM 265 CA GLN A 18 4.309 3.700 12.230 1.00 21.53 C ATOM 266 C GLN A 18 3.671 2.734 13.243 1.00 44.32 C ATOM 267 O GLN A 18 4.318 1.797 13.716 1.00 52.45 O ATOM 268 CB GLN A 18 4.729 4.996 12.939 1.00 22.12 C ATOM 269 CG GLN A 18 5.743 4.778 14.062 1.00 24.03 C ATOM 270 CD GLN A 18 6.099 6.058 14.802 1.00 52.23 C ATOM 271 OE1 GLN A 18 5.288 6.968 14.926 1.00 24.33 O ATOM 272 NE2 GLN A 18 7.313 6.133 15.310 1.00 52.32 N ATOM 0 H GLN A 18 3.176 4.985 11.007 1.00 53.01 H new ATOM 0 HA GLN A 18 5.193 3.221 11.808 1.00 21.53 H new ATOM 0 HB2 GLN A 18 5.154 5.681 12.205 1.00 22.12 H new ATOM 0 HB3 GLN A 18 3.843 5.479 13.350 1.00 22.12 H new ATOM 0 HG2 GLN A 18 5.340 4.055 14.772 1.00 24.03 H new ATOM 0 HG3 GLN A 18 6.651 4.343 13.644 1.00 24.03 H new ATOM 0 HE21 GLN A 18 7.965 5.358 15.189 1.00 52.32 H new ATOM 0 HE22 GLN A 18 7.600 6.966 15.824 1.00 52.32 H new ATOM 281 N ALA A 19 2.396 2.967 13.564 1.00 25.33 N ATOM 282 CA ALA A 19 1.648 2.086 14.469 1.00 31.01 C ATOM 283 C ALA A 19 1.604 0.647 13.930 1.00 73.30 C ATOM 284 O ALA A 19 1.794 -0.318 14.675 1.00 72.41 O ATOM 285 CB ALA A 19 0.233 2.618 14.676 1.00 53.31 C ATOM 0 H ALA A 19 1.858 3.759 13.211 1.00 25.33 H new ATOM 0 HA ALA A 19 2.164 2.071 15.429 1.00 31.01 H new ATOM 0 HB1 ALA A 19 -0.310 1.955 15.349 1.00 53.31 H new ATOM 0 HB2 ALA A 19 0.280 3.617 15.110 1.00 53.31 H new ATOM 0 HB3 ALA A 19 -0.283 2.663 13.717 1.00 53.31 H new ATOM 291 N ILE A 20 1.358 0.517 12.627 1.00 13.35 N ATOM 292 CA ILE A 20 1.363 -0.787 11.954 1.00 4.14 C ATOM 293 C ILE A 20 2.750 -1.446 12.040 1.00 23.21 C ATOM 294 O ILE A 20 2.882 -2.599 12.457 1.00 42.14 O ATOM 295 CB ILE A 20 0.951 -0.647 10.464 1.00 61.11 C ATOM 296 CG1 ILE A 20 -0.454 -0.021 10.354 1.00 73.04 C ATOM 297 CG2 ILE A 20 0.999 -2.004 9.756 1.00 13.20 C ATOM 298 CD1 ILE A 20 -0.920 0.216 8.928 1.00 14.44 C ATOM 0 H ILE A 20 1.151 1.303 12.011 1.00 13.35 H new ATOM 0 HA ILE A 20 0.636 -1.419 12.465 1.00 4.14 H new ATOM 0 HB ILE A 20 1.663 0.014 9.970 1.00 61.11 H new ATOM 0 HG12 ILE A 20 -1.170 -0.673 10.855 1.00 73.04 H new ATOM 0 HG13 ILE A 20 -0.459 0.929 10.889 1.00 73.04 H new ATOM 0 HG21 ILE A 20 0.706 -1.881 8.713 1.00 13.20 H new ATOM 0 HG22 ILE A 20 2.012 -2.404 9.804 1.00 13.20 H new ATOM 0 HG23 ILE A 20 0.313 -2.695 10.246 1.00 13.20 H new ATOM 0 HD11 ILE A 20 -1.916 0.658 8.940 1.00 14.44 H new ATOM 0 HD12 ILE A 20 -0.228 0.893 8.427 1.00 14.44 H new ATOM 0 HD13 ILE A 20 -0.950 -0.733 8.393 1.00 14.44 H new ATOM 310 N ILE A 21 3.783 -0.696 11.658 1.00 31.32 N ATOM 311 CA ILE A 21 5.168 -1.179 11.719 1.00 30.51 C ATOM 312 C ILE A 21 5.531 -1.656 13.137 1.00 5.14 C ATOM 313 O ILE A 21 6.150 -2.706 13.311 1.00 24.51 O ATOM 314 CB ILE A 21 6.166 -0.071 11.280 1.00 23.14 C ATOM 315 CG1 ILE A 21 5.885 0.359 9.828 1.00 20.53 C ATOM 316 CG2 ILE A 21 7.615 -0.543 11.435 1.00 20.25 C ATOM 317 CD1 ILE A 21 6.764 1.495 9.338 1.00 73.31 C ATOM 0 H ILE A 21 3.689 0.255 11.300 1.00 31.32 H new ATOM 0 HA ILE A 21 5.244 -2.022 11.032 1.00 30.51 H new ATOM 0 HB ILE A 21 6.025 0.792 11.931 1.00 23.14 H new ATOM 0 HG12 ILE A 21 6.022 -0.501 9.173 1.00 20.53 H new ATOM 0 HG13 ILE A 21 4.841 0.660 9.745 1.00 20.53 H new ATOM 0 HG21 ILE A 21 8.292 0.251 11.121 1.00 20.25 H new ATOM 0 HG22 ILE A 21 7.807 -0.792 12.479 1.00 20.25 H new ATOM 0 HG23 ILE A 21 7.779 -1.425 10.816 1.00 20.25 H new ATOM 0 HD11 ILE A 21 6.504 1.738 8.308 1.00 73.31 H new ATOM 0 HD12 ILE A 21 6.610 2.371 9.968 1.00 73.31 H new ATOM 0 HD13 ILE A 21 7.810 1.192 9.386 1.00 73.31 H new ATOM 329 N ASN A 22 5.120 -0.883 14.141 1.00 13.23 N ATOM 330 CA ASN A 22 5.379 -1.213 15.549 1.00 12.13 C ATOM 331 C ASN A 22 4.723 -2.553 15.949 1.00 41.12 C ATOM 332 O ASN A 22 5.248 -3.296 16.783 1.00 73.54 O ATOM 333 CB ASN A 22 4.861 -0.078 16.444 1.00 73.21 C ATOM 334 CG ASN A 22 5.163 -0.292 17.916 1.00 62.15 C ATOM 335 OD1 ASN A 22 6.204 0.121 18.420 1.00 43.23 O ATOM 336 ND2 ASN A 22 4.257 -0.935 18.621 1.00 53.41 N ATOM 0 H ASN A 22 4.601 -0.015 14.007 1.00 13.23 H new ATOM 0 HA ASN A 22 6.455 -1.323 15.683 1.00 12.13 H new ATOM 0 HB2 ASN A 22 5.307 0.863 16.121 1.00 73.21 H new ATOM 0 HB3 ASN A 22 3.783 0.018 16.311 1.00 73.21 H new ATOM 0 HD21 ASN A 22 4.409 -1.103 19.615 1.00 53.41 H new ATOM 0 HD22 ASN A 22 3.402 -1.266 18.173 1.00 53.41 H new ATOM 343 N GLY A 23 3.571 -2.853 15.349 1.00 65.34 N ATOM 344 CA GLY A 23 2.856 -4.091 15.652 1.00 75.52 C ATOM 345 C GLY A 23 3.349 -5.298 14.854 1.00 30.13 C ATOM 346 O GLY A 23 3.318 -6.428 15.344 1.00 24.11 O ATOM 0 H GLY A 23 3.116 -2.260 14.655 1.00 65.34 H new ATOM 0 HA2 GLY A 23 2.955 -4.306 16.716 1.00 75.52 H new ATOM 0 HA3 GLY A 23 1.794 -3.945 15.453 1.00 75.52 H new ATOM 350 N ILE A 24 3.807 -5.065 13.629 1.00 31.34 N ATOM 351 CA ILE A 24 4.234 -6.156 12.741 1.00 60.41 C ATOM 352 C ILE A 24 5.699 -6.570 12.981 1.00 40.43 C ATOM 353 O ILE A 24 5.999 -7.754 13.169 1.00 60.31 O ATOM 354 CB ILE A 24 4.047 -5.758 11.253 1.00 10.54 C ATOM 355 CG1 ILE A 24 2.580 -5.386 10.976 1.00 53.03 C ATOM 356 CG2 ILE A 24 4.496 -6.884 10.321 1.00 24.21 C ATOM 357 CD1 ILE A 24 1.591 -6.505 11.253 1.00 54.02 C ATOM 0 H ILE A 24 3.895 -4.134 13.223 1.00 31.34 H new ATOM 0 HA ILE A 24 3.601 -7.012 12.975 1.00 60.41 H new ATOM 0 HB ILE A 24 4.672 -4.887 11.057 1.00 10.54 H new ATOM 0 HG12 ILE A 24 2.315 -4.522 11.586 1.00 53.03 H new ATOM 0 HG13 ILE A 24 2.485 -5.082 9.934 1.00 53.03 H new ATOM 0 HG21 ILE A 24 4.354 -6.577 9.285 1.00 24.21 H new ATOM 0 HG22 ILE A 24 5.550 -7.101 10.494 1.00 24.21 H new ATOM 0 HG23 ILE A 24 3.905 -7.778 10.519 1.00 24.21 H new ATOM 0 HD11 ILE A 24 0.581 -6.161 11.032 1.00 54.02 H new ATOM 0 HD12 ILE A 24 1.827 -7.363 10.624 1.00 54.02 H new ATOM 0 HD13 ILE A 24 1.654 -6.795 12.302 1.00 54.02 H new ATOM 369 N THR A 25 6.606 -5.594 12.994 1.00 21.05 N ATOM 370 CA THR A 25 8.049 -5.874 13.121 1.00 71.23 C ATOM 371 C THR A 25 8.399 -6.532 14.462 1.00 63.34 C ATOM 372 O THR A 25 9.264 -7.405 14.526 1.00 32.24 O ATOM 373 CB THR A 25 8.904 -4.597 12.957 1.00 30.32 C ATOM 374 OG1 THR A 25 8.569 -3.646 13.978 1.00 63.20 O ATOM 375 CG2 THR A 25 8.696 -3.972 11.582 1.00 51.11 C ATOM 0 H THR A 25 6.375 -4.603 12.919 1.00 21.05 H new ATOM 0 HA THR A 25 8.282 -6.569 12.314 1.00 71.23 H new ATOM 0 HB THR A 25 9.953 -4.877 13.053 1.00 30.32 H new ATOM 0 HG1 THR A 25 7.808 -3.104 13.683 1.00 63.20 H new ATOM 0 HG21 THR A 25 9.309 -3.075 11.493 1.00 51.11 H new ATOM 0 HG22 THR A 25 8.984 -4.686 10.810 1.00 51.11 H new ATOM 0 HG23 THR A 25 7.646 -3.707 11.458 1.00 51.11 H new ATOM 383 N LYS A 26 7.728 -6.113 15.536 1.00 2.34 N ATOM 384 CA LYS A 26 7.941 -6.715 16.861 1.00 23.02 C ATOM 385 C LYS A 26 7.496 -8.194 16.881 1.00 45.01 C ATOM 386 O LYS A 26 7.980 -8.994 17.688 1.00 61.34 O ATOM 387 CB LYS A 26 7.199 -5.904 17.937 1.00 65.33 C ATOM 388 CG LYS A 26 7.403 -6.427 19.359 1.00 54.41 C ATOM 389 CD LYS A 26 6.847 -5.476 20.424 1.00 21.34 C ATOM 390 CE LYS A 26 5.323 -5.346 20.386 1.00 71.12 C ATOM 391 NZ LYS A 26 4.838 -4.608 19.186 1.00 70.03 N ATOM 0 H LYS A 26 7.036 -5.364 15.519 1.00 2.34 H new ATOM 0 HA LYS A 26 9.008 -6.691 17.081 1.00 23.02 H new ATOM 0 HB2 LYS A 26 7.532 -4.867 17.891 1.00 65.33 H new ATOM 0 HB3 LYS A 26 6.133 -5.907 17.709 1.00 65.33 H new ATOM 0 HG2 LYS A 26 6.919 -7.399 19.457 1.00 54.41 H new ATOM 0 HG3 LYS A 26 8.467 -6.582 19.536 1.00 54.41 H new ATOM 0 HD2 LYS A 26 7.150 -5.829 21.410 1.00 21.34 H new ATOM 0 HD3 LYS A 26 7.292 -4.490 20.288 1.00 21.34 H new ATOM 0 HE2 LYS A 26 4.877 -6.341 20.400 1.00 71.12 H new ATOM 0 HE3 LYS A 26 4.984 -4.832 21.285 1.00 71.12 H new ATOM 0 HZ1 LYS A 26 4.150 -3.884 19.478 1.00 70.03 H new ATOM 0 HZ2 LYS A 26 5.642 -4.150 18.712 1.00 70.03 H new ATOM 0 HZ3 LYS A 26 4.382 -5.274 18.530 1.00 70.03 H new ATOM 405 N THR A 27 6.586 -8.551 15.972 1.00 54.22 N ATOM 406 CA THR A 27 6.121 -9.940 15.822 1.00 53.10 C ATOM 407 C THR A 27 7.115 -10.774 14.984 1.00 13.55 C ATOM 408 O THR A 27 6.987 -11.991 14.871 1.00 14.03 O ATOM 409 CB THR A 27 4.711 -9.987 15.165 1.00 34.15 C ATOM 410 OG1 THR A 27 3.798 -9.170 15.914 1.00 64.33 O ATOM 411 CG2 THR A 27 4.157 -11.409 15.094 1.00 15.02 C ATOM 0 H THR A 27 6.151 -7.895 15.323 1.00 54.22 H new ATOM 0 HA THR A 27 6.059 -10.372 16.821 1.00 53.10 H new ATOM 0 HB THR A 27 4.816 -9.611 14.147 1.00 34.15 H new ATOM 0 HG1 THR A 27 3.793 -8.262 15.545 1.00 64.33 H new ATOM 0 HG21 THR A 27 3.172 -11.393 14.628 1.00 15.02 H new ATOM 0 HG22 THR A 27 4.828 -12.032 14.502 1.00 15.02 H new ATOM 0 HG23 THR A 27 4.076 -11.819 16.101 1.00 15.02 H new ATOM 419 N GLY A 28 8.117 -10.108 14.407 1.00 32.54 N ATOM 420 CA GLY A 28 9.146 -10.808 13.636 1.00 63.05 C ATOM 421 C GLY A 28 8.934 -10.746 12.123 1.00 33.23 C ATOM 422 O GLY A 28 9.569 -11.489 11.371 1.00 2.03 O ATOM 0 H GLY A 28 8.238 -9.096 14.458 1.00 32.54 H new ATOM 0 HA2 GLY A 28 10.120 -10.380 13.875 1.00 63.05 H new ATOM 0 HA3 GLY A 28 9.172 -11.852 13.947 1.00 63.05 H new ATOM 426 N VAL A 29 8.048 -9.862 11.672 1.00 10.53 N ATOM 427 CA VAL A 29 7.767 -9.701 10.240 1.00 4.14 C ATOM 428 C VAL A 29 8.150 -8.291 9.753 1.00 52.41 C ATOM 429 O VAL A 29 7.742 -7.291 10.342 1.00 4.44 O ATOM 430 CB VAL A 29 6.270 -9.966 9.933 1.00 42.12 C ATOM 431 CG1 VAL A 29 5.979 -9.817 8.441 1.00 64.32 C ATOM 432 CG2 VAL A 29 5.850 -11.348 10.436 1.00 14.52 C ATOM 0 H VAL A 29 7.508 -9.242 12.276 1.00 10.53 H new ATOM 0 HA VAL A 29 8.373 -10.434 9.708 1.00 4.14 H new ATOM 0 HB VAL A 29 5.681 -9.218 10.463 1.00 42.12 H new ATOM 0 HG11 VAL A 29 4.922 -10.008 8.256 1.00 64.32 H new ATOM 0 HG12 VAL A 29 6.226 -8.805 8.121 1.00 64.32 H new ATOM 0 HG13 VAL A 29 6.581 -10.532 7.880 1.00 64.32 H new ATOM 0 HG21 VAL A 29 4.796 -11.513 10.210 1.00 14.52 H new ATOM 0 HG22 VAL A 29 6.451 -12.113 9.943 1.00 14.52 H new ATOM 0 HG23 VAL A 29 6.003 -11.405 11.514 1.00 14.52 H new ATOM 442 N GLY A 30 8.935 -8.220 8.679 1.00 12.33 N ATOM 443 CA GLY A 30 9.373 -6.929 8.149 1.00 72.03 C ATOM 444 C GLY A 30 8.291 -6.209 7.346 1.00 50.23 C ATOM 445 O GLY A 30 7.494 -6.848 6.655 1.00 32.53 O ATOM 0 H GLY A 30 9.278 -9.031 8.164 1.00 12.33 H new ATOM 0 HA2 GLY A 30 9.687 -6.292 8.976 1.00 72.03 H new ATOM 0 HA3 GLY A 30 10.246 -7.081 7.515 1.00 72.03 H new ATOM 449 N VAL A 31 8.269 -4.876 7.430 1.00 13.42 N ATOM 450 CA VAL A 31 7.276 -4.062 6.709 1.00 3.32 C ATOM 451 C VAL A 31 7.923 -3.271 5.558 1.00 54.54 C ATOM 452 O VAL A 31 9.038 -2.762 5.696 1.00 20.31 O ATOM 453 CB VAL A 31 6.568 -3.066 7.666 1.00 51.12 C ATOM 454 CG1 VAL A 31 5.493 -2.264 6.932 1.00 52.21 C ATOM 455 CG2 VAL A 31 5.976 -3.800 8.867 1.00 44.11 C ATOM 0 H VAL A 31 8.927 -4.333 7.990 1.00 13.42 H new ATOM 0 HA VAL A 31 6.542 -4.755 6.297 1.00 3.32 H new ATOM 0 HB VAL A 31 7.316 -2.362 8.031 1.00 51.12 H new ATOM 0 HG11 VAL A 31 5.014 -1.575 7.628 1.00 52.21 H new ATOM 0 HG12 VAL A 31 5.951 -1.700 6.120 1.00 52.21 H new ATOM 0 HG13 VAL A 31 4.746 -2.945 6.524 1.00 52.21 H new ATOM 0 HG21 VAL A 31 5.484 -3.084 9.525 1.00 44.11 H new ATOM 0 HG22 VAL A 31 5.248 -4.534 8.522 1.00 44.11 H new ATOM 0 HG23 VAL A 31 6.772 -4.307 9.412 1.00 44.11 H new ATOM 465 N ASP A 32 7.225 -3.162 4.429 1.00 51.23 N ATOM 466 CA ASP A 32 7.728 -2.407 3.274 1.00 2.23 C ATOM 467 C ASP A 32 6.897 -1.131 3.034 1.00 31.53 C ATOM 468 O ASP A 32 5.697 -1.195 2.764 1.00 54.04 O ATOM 469 CB ASP A 32 7.722 -3.298 2.024 1.00 11.12 C ATOM 470 CG ASP A 32 8.539 -4.563 2.223 1.00 3.34 C ATOM 471 OD1 ASP A 32 9.785 -4.479 2.249 1.00 13.12 O ATOM 472 OD2 ASP A 32 7.945 -5.649 2.376 1.00 64.12 O ATOM 0 H ASP A 32 6.308 -3.586 4.286 1.00 51.23 H new ATOM 0 HA ASP A 32 8.752 -2.099 3.486 1.00 2.23 H new ATOM 0 HB2 ASP A 32 6.695 -3.565 1.774 1.00 11.12 H new ATOM 0 HB3 ASP A 32 8.121 -2.738 1.178 1.00 11.12 H new ATOM 477 N VAL A 33 7.546 0.031 3.137 1.00 35.42 N ATOM 478 CA VAL A 33 6.861 1.322 2.977 1.00 14.25 C ATOM 479 C VAL A 33 6.980 1.856 1.537 1.00 53.03 C ATOM 480 O VAL A 33 8.054 1.815 0.932 1.00 62.54 O ATOM 481 CB VAL A 33 7.409 2.382 3.972 1.00 20.40 C ATOM 482 CG1 VAL A 33 7.184 1.933 5.415 1.00 1.05 C ATOM 483 CG2 VAL A 33 8.891 2.669 3.721 1.00 65.55 C ATOM 0 H VAL A 33 8.545 0.108 3.330 1.00 35.42 H new ATOM 0 HA VAL A 33 5.808 1.145 3.195 1.00 14.25 H new ATOM 0 HB VAL A 33 6.859 3.308 3.808 1.00 20.40 H new ATOM 0 HG11 VAL A 33 7.575 2.689 6.096 1.00 1.05 H new ATOM 0 HG12 VAL A 33 6.117 1.801 5.593 1.00 1.05 H new ATOM 0 HG13 VAL A 33 7.700 0.988 5.587 1.00 1.05 H new ATOM 0 HG21 VAL A 33 9.243 3.415 4.434 1.00 65.55 H new ATOM 0 HG22 VAL A 33 9.465 1.751 3.843 1.00 65.55 H new ATOM 0 HG23 VAL A 33 9.022 3.047 2.707 1.00 65.55 H new ATOM 493 N VAL A 34 5.867 2.346 0.986 1.00 35.41 N ATOM 494 CA VAL A 34 5.851 2.899 -0.376 1.00 0.31 C ATOM 495 C VAL A 34 5.111 4.250 -0.431 1.00 33.22 C ATOM 496 O VAL A 34 3.881 4.304 -0.361 1.00 51.34 O ATOM 497 CB VAL A 34 5.186 1.920 -1.384 1.00 54.44 C ATOM 498 CG1 VAL A 34 5.216 2.496 -2.801 1.00 31.43 C ATOM 499 CG2 VAL A 34 5.862 0.547 -1.341 1.00 30.14 C ATOM 0 H VAL A 34 4.964 2.372 1.460 1.00 35.41 H new ATOM 0 HA VAL A 34 6.893 3.049 -0.658 1.00 0.31 H new ATOM 0 HB VAL A 34 4.144 1.792 -1.091 1.00 54.44 H new ATOM 0 HG11 VAL A 34 4.745 1.794 -3.489 1.00 31.43 H new ATOM 0 HG12 VAL A 34 4.675 3.442 -2.821 1.00 31.43 H new ATOM 0 HG13 VAL A 34 6.250 2.663 -3.104 1.00 31.43 H new ATOM 0 HG21 VAL A 34 5.378 -0.119 -2.055 1.00 30.14 H new ATOM 0 HG22 VAL A 34 6.916 0.652 -1.599 1.00 30.14 H new ATOM 0 HG23 VAL A 34 5.774 0.129 -0.338 1.00 30.14 H new ATOM 509 N ASP A 35 5.867 5.339 -0.540 1.00 4.41 N ATOM 510 CA ASP A 35 5.281 6.671 -0.710 1.00 25.52 C ATOM 511 C ASP A 35 4.837 6.906 -2.159 1.00 50.10 C ATOM 512 O ASP A 35 5.622 7.347 -2.998 1.00 3.45 O ATOM 513 CB ASP A 35 6.275 7.757 -0.282 1.00 41.31 C ATOM 514 CG ASP A 35 6.461 7.799 1.219 1.00 51.21 C ATOM 515 OD1 ASP A 35 7.159 6.915 1.759 1.00 1.40 O ATOM 516 OD2 ASP A 35 5.909 8.716 1.863 1.00 42.32 O ATOM 0 H ASP A 35 6.887 5.328 -0.514 1.00 4.41 H new ATOM 0 HA ASP A 35 4.399 6.726 -0.071 1.00 25.52 H new ATOM 0 HB2 ASP A 35 7.237 7.576 -0.761 1.00 41.31 H new ATOM 0 HB3 ASP A 35 5.923 8.728 -0.630 1.00 41.31 H new ATOM 521 N LEU A 36 3.571 6.604 -2.447 1.00 24.34 N ATOM 522 CA LEU A 36 3.011 6.804 -3.794 1.00 50.25 C ATOM 523 C LEU A 36 2.891 8.297 -4.149 1.00 53.11 C ATOM 524 O LEU A 36 2.668 8.656 -5.306 1.00 53.24 O ATOM 525 CB LEU A 36 1.648 6.089 -3.928 1.00 1.40 C ATOM 526 CG LEU A 36 0.686 6.193 -2.722 1.00 54.25 C ATOM 527 CD1 LEU A 36 0.292 7.639 -2.423 1.00 73.11 C ATOM 528 CD2 LEU A 36 -0.557 5.341 -2.965 1.00 51.23 C ATOM 0 H LEU A 36 2.911 6.220 -1.771 1.00 24.34 H new ATOM 0 HA LEU A 36 3.704 6.360 -4.508 1.00 50.25 H new ATOM 0 HB2 LEU A 36 1.139 6.489 -4.805 1.00 1.40 H new ATOM 0 HB3 LEU A 36 1.836 5.033 -4.123 1.00 1.40 H new ATOM 0 HG LEU A 36 1.215 5.816 -1.847 1.00 54.25 H new ATOM 0 HD11 LEU A 36 -0.384 7.663 -1.568 1.00 73.11 H new ATOM 0 HD12 LEU A 36 1.186 8.220 -2.195 1.00 73.11 H new ATOM 0 HD13 LEU A 36 -0.207 8.067 -3.292 1.00 73.11 H new ATOM 0 HD21 LEU A 36 -1.227 5.422 -2.109 1.00 51.23 H new ATOM 0 HD22 LEU A 36 -1.069 5.692 -3.861 1.00 51.23 H new ATOM 0 HD23 LEU A 36 -0.264 4.300 -3.099 1.00 51.23 H new ATOM 540 N GLY A 37 3.037 9.160 -3.143 1.00 63.53 N ATOM 541 CA GLY A 37 3.004 10.601 -3.374 1.00 3.24 C ATOM 542 C GLY A 37 4.355 11.168 -3.800 1.00 61.22 C ATOM 543 O GLY A 37 4.457 12.337 -4.172 1.00 73.13 O ATOM 0 H GLY A 37 3.178 8.888 -2.170 1.00 63.53 H new ATOM 0 HA2 GLY A 37 2.264 10.823 -4.143 1.00 3.24 H new ATOM 0 HA3 GLY A 37 2.677 11.102 -2.463 1.00 3.24 H new ATOM 547 N ALA A 38 5.393 10.336 -3.742 1.00 33.20 N ATOM 548 CA ALA A 38 6.751 10.754 -4.102 1.00 31.44 C ATOM 549 C ALA A 38 7.151 10.253 -5.499 1.00 50.23 C ATOM 550 O ALA A 38 6.432 9.471 -6.125 1.00 23.02 O ATOM 551 CB ALA A 38 7.740 10.250 -3.056 1.00 21.20 C ATOM 0 H ALA A 38 5.321 9.362 -3.448 1.00 33.20 H new ATOM 0 HA ALA A 38 6.772 11.843 -4.128 1.00 31.44 H new ATOM 0 HB1 ALA A 38 8.748 10.563 -3.328 1.00 21.20 H new ATOM 0 HB2 ALA A 38 7.482 10.664 -2.082 1.00 21.20 H new ATOM 0 HB3 ALA A 38 7.698 9.162 -3.010 1.00 21.20 H new ATOM 557 N ALA A 39 8.307 10.703 -5.985 1.00 43.35 N ATOM 558 CA ALA A 39 8.812 10.282 -7.295 1.00 54.51 C ATOM 559 C ALA A 39 9.308 8.825 -7.264 1.00 70.30 C ATOM 560 O ALA A 39 10.499 8.562 -7.086 1.00 21.33 O ATOM 561 CB ALA A 39 9.922 11.222 -7.763 1.00 30.22 C ATOM 0 H ALA A 39 8.913 11.359 -5.493 1.00 43.35 H new ATOM 0 HA ALA A 39 7.988 10.334 -8.006 1.00 54.51 H new ATOM 0 HB1 ALA A 39 10.287 10.897 -8.737 1.00 30.22 H new ATOM 0 HB2 ALA A 39 9.531 12.236 -7.842 1.00 30.22 H new ATOM 0 HB3 ALA A 39 10.741 11.204 -7.044 1.00 30.22 H new ATOM 567 N VAL A 40 8.378 7.885 -7.407 1.00 23.32 N ATOM 568 CA VAL A 40 8.705 6.455 -7.408 1.00 42.03 C ATOM 569 C VAL A 40 9.333 6.004 -8.740 1.00 72.25 C ATOM 570 O VAL A 40 9.234 6.694 -9.760 1.00 34.15 O ATOM 571 CB VAL A 40 7.449 5.593 -7.120 1.00 62.11 C ATOM 572 CG1 VAL A 40 6.881 5.906 -5.734 1.00 24.12 C ATOM 573 CG2 VAL A 40 6.389 5.802 -8.204 1.00 4.11 C ATOM 0 H VAL A 40 7.385 8.086 -7.525 1.00 23.32 H new ATOM 0 HA VAL A 40 9.437 6.308 -6.614 1.00 42.03 H new ATOM 0 HB VAL A 40 7.746 4.544 -7.134 1.00 62.11 H new ATOM 0 HG11 VAL A 40 6.000 5.289 -5.554 1.00 24.12 H new ATOM 0 HG12 VAL A 40 7.634 5.693 -4.976 1.00 24.12 H new ATOM 0 HG13 VAL A 40 6.603 6.959 -5.684 1.00 24.12 H new ATOM 0 HG21 VAL A 40 5.516 5.188 -7.983 1.00 4.11 H new ATOM 0 HG22 VAL A 40 6.097 6.852 -8.230 1.00 4.11 H new ATOM 0 HG23 VAL A 40 6.798 5.515 -9.173 1.00 4.11 H new ATOM 583 N ASP A 41 9.981 4.843 -8.723 1.00 71.30 N ATOM 584 CA ASP A 41 10.609 4.278 -9.923 1.00 34.12 C ATOM 585 C ASP A 41 10.323 2.766 -10.030 1.00 32.21 C ATOM 586 O ASP A 41 9.862 2.142 -9.069 1.00 31.54 O ATOM 587 CB ASP A 41 12.125 4.542 -9.892 1.00 35.41 C ATOM 588 CG ASP A 41 12.810 4.170 -11.196 1.00 43.41 C ATOM 589 OD1 ASP A 41 12.854 5.017 -12.112 1.00 1.31 O ATOM 590 OD2 ASP A 41 13.293 3.026 -11.317 1.00 1.11 O ATOM 0 H ASP A 41 10.088 4.268 -7.887 1.00 71.30 H new ATOM 0 HA ASP A 41 10.184 4.763 -10.802 1.00 34.12 H new ATOM 0 HB2 ASP A 41 12.302 5.597 -9.681 1.00 35.41 H new ATOM 0 HB3 ASP A 41 12.572 3.974 -9.076 1.00 35.41 H new ATOM 595 N LEU A 42 10.603 2.178 -11.194 1.00 40.24 N ATOM 596 CA LEU A 42 10.397 0.739 -11.412 1.00 12.33 C ATOM 597 C LEU A 42 11.224 -0.103 -10.426 1.00 11.12 C ATOM 598 O LEU A 42 10.863 -1.238 -10.117 1.00 72.21 O ATOM 599 CB LEU A 42 10.736 0.351 -12.862 1.00 12.15 C ATOM 600 CG LEU A 42 9.699 0.761 -13.928 1.00 40.44 C ATOM 601 CD1 LEU A 42 8.351 0.095 -13.659 1.00 60.01 C ATOM 602 CD2 LEU A 42 9.543 2.277 -13.997 1.00 42.41 C ATOM 0 H LEU A 42 10.974 2.674 -12.004 1.00 40.24 H new ATOM 0 HA LEU A 42 9.343 0.529 -11.233 1.00 12.33 H new ATOM 0 HB2 LEU A 42 11.694 0.800 -13.123 1.00 12.15 H new ATOM 0 HB3 LEU A 42 10.867 -0.730 -12.907 1.00 12.15 H new ATOM 0 HG LEU A 42 10.067 0.418 -14.895 1.00 40.44 H new ATOM 0 HD11 LEU A 42 7.636 0.399 -14.423 1.00 60.01 H new ATOM 0 HD12 LEU A 42 8.469 -0.988 -13.683 1.00 60.01 H new ATOM 0 HD13 LEU A 42 7.985 0.398 -12.678 1.00 60.01 H new ATOM 0 HD21 LEU A 42 8.805 2.533 -14.758 1.00 42.41 H new ATOM 0 HD22 LEU A 42 9.212 2.653 -13.029 1.00 42.41 H new ATOM 0 HD23 LEU A 42 10.501 2.730 -14.254 1.00 42.41 H new ATOM 614 N GLN A 43 12.328 0.464 -9.932 1.00 5.30 N ATOM 615 CA GLN A 43 13.127 -0.183 -8.880 1.00 41.05 C ATOM 616 C GLN A 43 12.261 -0.500 -7.646 1.00 61.41 C ATOM 617 O GLN A 43 12.464 -1.511 -6.970 1.00 50.12 O ATOM 618 CB GLN A 43 14.305 0.721 -8.476 1.00 31.45 C ATOM 619 CG GLN A 43 15.294 1.001 -9.606 1.00 50.31 C ATOM 620 CD GLN A 43 16.413 1.957 -9.203 1.00 23.21 C ATOM 621 OE1 GLN A 43 17.535 1.865 -9.697 1.00 62.03 O ATOM 622 NE2 GLN A 43 16.120 2.893 -8.318 1.00 22.02 N ATOM 0 H GLN A 43 12.690 1.366 -10.240 1.00 5.30 H new ATOM 0 HA GLN A 43 13.515 -1.121 -9.278 1.00 41.05 H new ATOM 0 HB2 GLN A 43 13.912 1.669 -8.109 1.00 31.45 H new ATOM 0 HB3 GLN A 43 14.839 0.255 -7.648 1.00 31.45 H new ATOM 0 HG2 GLN A 43 15.731 0.060 -9.939 1.00 50.31 H new ATOM 0 HG3 GLN A 43 14.755 1.420 -10.456 1.00 50.31 H new ATOM 0 HE21 GLN A 43 15.181 2.946 -7.924 1.00 22.02 H new ATOM 0 HE22 GLN A 43 16.833 3.562 -8.029 1.00 22.02 H new ATOM 631 N GLU A 44 11.293 0.375 -7.373 1.00 5.30 N ATOM 632 CA GLU A 44 10.340 0.188 -6.271 1.00 25.23 C ATOM 633 C GLU A 44 9.167 -0.705 -6.714 1.00 21.31 C ATOM 634 O GLU A 44 8.818 -1.685 -6.049 1.00 24.04 O ATOM 635 CB GLU A 44 9.803 1.558 -5.817 1.00 14.14 C ATOM 636 CG GLU A 44 8.918 1.517 -4.571 1.00 11.11 C ATOM 637 CD GLU A 44 9.713 1.371 -3.279 1.00 42.25 C ATOM 638 OE1 GLU A 44 10.098 2.407 -2.692 1.00 34.50 O ATOM 639 OE2 GLU A 44 9.956 0.226 -2.846 1.00 14.51 O ATOM 0 H GLU A 44 11.145 1.232 -7.906 1.00 5.30 H new ATOM 0 HA GLU A 44 10.855 -0.299 -5.443 1.00 25.23 H new ATOM 0 HB2 GLU A 44 10.648 2.218 -5.624 1.00 14.14 H new ATOM 0 HB3 GLU A 44 9.234 1.999 -6.635 1.00 14.14 H new ATOM 0 HG2 GLU A 44 8.324 2.430 -4.524 1.00 11.11 H new ATOM 0 HG3 GLU A 44 8.219 0.685 -4.656 1.00 11.11 H new ATOM 646 N LEU A 45 8.572 -0.359 -7.859 1.00 33.03 N ATOM 647 CA LEU A 45 7.411 -1.085 -8.399 1.00 3.04 C ATOM 648 C LEU A 45 7.698 -2.584 -8.599 1.00 74.12 C ATOM 649 O LEU A 45 6.796 -3.414 -8.475 1.00 31.33 O ATOM 650 CB LEU A 45 6.962 -0.452 -9.724 1.00 71.40 C ATOM 651 CG LEU A 45 6.500 1.014 -9.630 1.00 61.01 C ATOM 652 CD1 LEU A 45 6.081 1.542 -11.001 1.00 12.00 C ATOM 653 CD2 LEU A 45 5.356 1.154 -8.624 1.00 32.44 C ATOM 0 H LEU A 45 8.876 0.425 -8.436 1.00 33.03 H new ATOM 0 HA LEU A 45 6.610 -1.005 -7.664 1.00 3.04 H new ATOM 0 HB2 LEU A 45 7.787 -0.511 -10.434 1.00 71.40 H new ATOM 0 HB3 LEU A 45 6.146 -1.047 -10.134 1.00 71.40 H new ATOM 0 HG LEU A 45 7.340 1.613 -9.280 1.00 61.01 H new ATOM 0 HD11 LEU A 45 5.759 2.579 -10.909 1.00 12.00 H new ATOM 0 HD12 LEU A 45 6.926 1.484 -11.687 1.00 12.00 H new ATOM 0 HD13 LEU A 45 5.259 0.940 -11.387 1.00 12.00 H new ATOM 0 HD21 LEU A 45 5.043 2.197 -8.571 1.00 32.44 H new ATOM 0 HD22 LEU A 45 4.515 0.538 -8.942 1.00 32.44 H new ATOM 0 HD23 LEU A 45 5.694 0.827 -7.641 1.00 32.44 H new ATOM 665 N ARG A 46 8.948 -2.934 -8.910 1.00 13.42 N ATOM 666 CA ARG A 46 9.331 -4.346 -9.044 1.00 75.21 C ATOM 667 C ARG A 46 9.170 -5.085 -7.709 1.00 71.20 C ATOM 668 O ARG A 46 8.605 -6.180 -7.654 1.00 53.33 O ATOM 669 CB ARG A 46 10.780 -4.486 -9.536 1.00 30.14 C ATOM 670 CG ARG A 46 11.198 -5.939 -9.765 1.00 13.33 C ATOM 671 CD ARG A 46 12.674 -6.069 -10.126 1.00 43.51 C ATOM 672 NE ARG A 46 13.049 -7.463 -10.371 1.00 43.53 N ATOM 673 CZ ARG A 46 14.170 -8.007 -9.977 1.00 71.50 C ATOM 674 NH1 ARG A 46 15.025 -7.334 -9.274 1.00 62.13 N ATOM 675 NH2 ARG A 46 14.428 -9.237 -10.276 1.00 10.21 N ATOM 0 H ARG A 46 9.706 -2.271 -9.073 1.00 13.42 H new ATOM 0 HA ARG A 46 8.666 -4.793 -9.783 1.00 75.21 H new ATOM 0 HB2 ARG A 46 10.897 -3.930 -10.466 1.00 30.14 H new ATOM 0 HB3 ARG A 46 11.451 -4.032 -8.806 1.00 30.14 H new ATOM 0 HG2 ARG A 46 10.994 -6.519 -8.865 1.00 13.33 H new ATOM 0 HG3 ARG A 46 10.592 -6.367 -10.564 1.00 13.33 H new ATOM 0 HD2 ARG A 46 12.886 -5.473 -11.014 1.00 43.51 H new ATOM 0 HD3 ARG A 46 13.284 -5.664 -9.318 1.00 43.51 H new ATOM 0 HE ARG A 46 12.391 -8.049 -10.884 1.00 43.53 H new ATOM 0 HH11 ARG A 46 14.827 -6.366 -9.021 1.00 62.13 H new ATOM 0 HH12 ARG A 46 15.896 -7.772 -8.974 1.00 62.13 H new ATOM 0 HH21 ARG A 46 13.757 -9.781 -10.819 1.00 10.21 H new ATOM 0 HH22 ARG A 46 15.302 -9.664 -9.970 1.00 10.21 H new ATOM 689 N GLU A 47 9.660 -4.474 -6.628 1.00 72.12 N ATOM 690 CA GLU A 47 9.541 -5.059 -5.292 1.00 34.11 C ATOM 691 C GLU A 47 8.066 -5.180 -4.888 1.00 43.35 C ATOM 692 O GLU A 47 7.667 -6.136 -4.216 1.00 21.21 O ATOM 693 CB GLU A 47 10.311 -4.215 -4.264 1.00 74.24 C ATOM 694 CG GLU A 47 10.391 -4.859 -2.881 1.00 34.34 C ATOM 695 CD GLU A 47 11.225 -4.066 -1.885 1.00 25.45 C ATOM 696 OE1 GLU A 47 12.188 -3.390 -2.304 1.00 55.43 O ATOM 697 OE2 GLU A 47 10.949 -4.152 -0.668 1.00 65.31 O ATOM 0 H GLU A 47 10.142 -3.576 -6.652 1.00 72.12 H new ATOM 0 HA GLU A 47 9.976 -6.058 -5.314 1.00 34.11 H new ATOM 0 HB2 GLU A 47 11.322 -4.041 -4.633 1.00 74.24 H new ATOM 0 HB3 GLU A 47 9.832 -3.240 -4.175 1.00 74.24 H new ATOM 0 HG2 GLU A 47 9.382 -4.976 -2.485 1.00 34.34 H new ATOM 0 HG3 GLU A 47 10.812 -5.859 -2.979 1.00 34.34 H new ATOM 704 N LEU A 48 7.258 -4.210 -5.320 1.00 14.44 N ATOM 705 CA LEU A 48 5.807 -4.248 -5.113 1.00 53.30 C ATOM 706 C LEU A 48 5.210 -5.578 -5.605 1.00 51.13 C ATOM 707 O LEU A 48 4.403 -6.200 -4.913 1.00 24.00 O ATOM 708 CB LEU A 48 5.138 -3.070 -5.838 1.00 44.01 C ATOM 709 CG LEU A 48 3.601 -3.049 -5.791 1.00 25.33 C ATOM 710 CD1 LEU A 48 3.107 -3.012 -4.348 1.00 11.54 C ATOM 711 CD2 LEU A 48 3.054 -1.862 -6.584 1.00 2.53 C ATOM 0 H LEU A 48 7.586 -3.383 -5.819 1.00 14.44 H new ATOM 0 HA LEU A 48 5.616 -4.166 -4.043 1.00 53.30 H new ATOM 0 HB2 LEU A 48 5.510 -2.141 -5.405 1.00 44.01 H new ATOM 0 HB3 LEU A 48 5.452 -3.083 -6.882 1.00 44.01 H new ATOM 0 HG LEU A 48 3.231 -3.965 -6.252 1.00 25.33 H new ATOM 0 HD11 LEU A 48 2.017 -2.998 -4.337 1.00 11.54 H new ATOM 0 HD12 LEU A 48 3.464 -3.896 -3.819 1.00 11.54 H new ATOM 0 HD13 LEU A 48 3.487 -2.116 -3.856 1.00 11.54 H new ATOM 0 HD21 LEU A 48 1.965 -1.865 -6.539 1.00 2.53 H new ATOM 0 HD22 LEU A 48 3.433 -0.933 -6.157 1.00 2.53 H new ATOM 0 HD23 LEU A 48 3.374 -1.940 -7.623 1.00 2.53 H new ATOM 723 N VAL A 49 5.624 -6.014 -6.797 1.00 72.04 N ATOM 724 CA VAL A 49 5.184 -7.304 -7.349 1.00 70.12 C ATOM 725 C VAL A 49 5.509 -8.460 -6.383 1.00 25.24 C ATOM 726 O VAL A 49 4.723 -9.392 -6.220 1.00 5.13 O ATOM 727 CB VAL A 49 5.846 -7.585 -8.725 1.00 3.25 C ATOM 728 CG1 VAL A 49 5.357 -8.910 -9.314 1.00 31.24 C ATOM 729 CG2 VAL A 49 5.589 -6.429 -9.694 1.00 54.00 C ATOM 0 H VAL A 49 6.263 -5.496 -7.400 1.00 72.04 H new ATOM 0 HA VAL A 49 4.104 -7.242 -7.483 1.00 70.12 H new ATOM 0 HB VAL A 49 6.922 -7.668 -8.570 1.00 3.25 H new ATOM 0 HG11 VAL A 49 5.838 -9.079 -10.277 1.00 31.24 H new ATOM 0 HG12 VAL A 49 5.608 -9.725 -8.635 1.00 31.24 H new ATOM 0 HG13 VAL A 49 4.276 -8.871 -9.450 1.00 31.24 H new ATOM 0 HG21 VAL A 49 6.061 -6.646 -10.652 1.00 54.00 H new ATOM 0 HG22 VAL A 49 4.515 -6.307 -9.838 1.00 54.00 H new ATOM 0 HG23 VAL A 49 6.007 -5.510 -9.283 1.00 54.00 H new ATOM 739 N GLY A 50 6.670 -8.379 -5.734 1.00 21.35 N ATOM 740 CA GLY A 50 7.057 -9.387 -4.750 1.00 24.12 C ATOM 741 C GLY A 50 6.249 -9.297 -3.454 1.00 22.05 C ATOM 742 O GLY A 50 6.033 -10.303 -2.773 1.00 4.13 O ATOM 0 H GLY A 50 7.352 -7.633 -5.870 1.00 21.35 H new ATOM 0 HA2 GLY A 50 6.929 -10.379 -5.184 1.00 24.12 H new ATOM 0 HA3 GLY A 50 8.116 -9.275 -4.520 1.00 24.12 H new ATOM 746 N ARG A 51 5.810 -8.086 -3.109 1.00 10.22 N ATOM 747 CA ARG A 51 4.999 -7.852 -1.899 1.00 44.52 C ATOM 748 C ARG A 51 3.493 -7.998 -2.178 1.00 4.51 C ATOM 749 O ARG A 51 2.671 -7.748 -1.296 1.00 14.32 O ATOM 750 CB ARG A 51 5.278 -6.447 -1.329 1.00 2.04 C ATOM 751 CG ARG A 51 6.520 -6.342 -0.442 1.00 5.43 C ATOM 752 CD ARG A 51 7.794 -6.788 -1.151 1.00 51.34 C ATOM 753 NE ARG A 51 8.992 -6.364 -0.430 1.00 23.13 N ATOM 754 CZ ARG A 51 9.959 -7.151 -0.049 1.00 32.32 C ATOM 755 NH1 ARG A 51 9.903 -8.430 -0.247 1.00 43.25 N ATOM 756 NH2 ARG A 51 10.980 -6.639 0.546 1.00 13.43 N ATOM 0 H ARG A 51 6.001 -7.243 -3.650 1.00 10.22 H new ATOM 0 HA ARG A 51 5.285 -8.611 -1.170 1.00 44.52 H new ATOM 0 HB2 ARG A 51 5.384 -5.749 -2.160 1.00 2.04 H new ATOM 0 HB3 ARG A 51 4.410 -6.127 -0.752 1.00 2.04 H new ATOM 0 HG2 ARG A 51 6.637 -5.310 -0.110 1.00 5.43 H new ATOM 0 HG3 ARG A 51 6.375 -6.950 0.451 1.00 5.43 H new ATOM 0 HD2 ARG A 51 7.794 -7.874 -1.250 1.00 51.34 H new ATOM 0 HD3 ARG A 51 7.812 -6.376 -2.160 1.00 51.34 H new ATOM 0 HE ARG A 51 9.079 -5.373 -0.207 1.00 23.13 H new ATOM 0 HH11 ARG A 51 9.091 -8.839 -0.709 1.00 43.25 H new ATOM 0 HH12 ARG A 51 10.671 -9.028 0.059 1.00 43.25 H new ATOM 0 HH21 ARG A 51 11.022 -5.633 0.712 1.00 13.43 H new ATOM 0 HH22 ARG A 51 11.746 -7.239 0.851 1.00 13.43 H new ATOM 770 N CYS A 52 3.141 -8.409 -3.397 1.00 4.11 N ATOM 771 CA CYS A 52 1.732 -8.516 -3.816 1.00 51.22 C ATOM 772 C CYS A 52 0.874 -9.323 -2.828 1.00 10.30 C ATOM 773 O CYS A 52 -0.329 -9.097 -2.722 1.00 42.13 O ATOM 774 CB CYS A 52 1.639 -9.163 -5.203 1.00 61.14 C ATOM 775 SG CYS A 52 2.288 -10.850 -5.280 1.00 11.21 S ATOM 0 H CYS A 52 3.811 -8.676 -4.118 1.00 4.11 H new ATOM 0 HA CYS A 52 1.340 -7.499 -3.842 1.00 51.22 H new ATOM 0 HB2 CYS A 52 0.595 -9.173 -5.518 1.00 61.14 H new ATOM 0 HB3 CYS A 52 2.182 -8.544 -5.917 1.00 61.14 H new ATOM 0 HG CYS A 52 3.532 -10.820 -5.657 1.00 11.21 H new ATOM 781 N THR A 53 1.499 -10.260 -2.105 1.00 0.51 N ATOM 782 CA THR A 53 0.785 -11.126 -1.147 1.00 3.41 C ATOM 783 C THR A 53 -0.032 -10.313 -0.129 1.00 22.44 C ATOM 784 O THR A 53 -1.147 -10.700 0.241 1.00 15.34 O ATOM 785 CB THR A 53 1.760 -12.057 -0.385 1.00 44.23 C ATOM 786 OG1 THR A 53 2.748 -11.283 0.312 1.00 52.11 O ATOM 787 CG2 THR A 53 2.452 -13.021 -1.341 1.00 5.35 C ATOM 0 H THR A 53 2.501 -10.442 -2.163 1.00 0.51 H new ATOM 0 HA THR A 53 0.100 -11.731 -1.741 1.00 3.41 H new ATOM 0 HB THR A 53 1.178 -12.633 0.334 1.00 44.23 H new ATOM 0 HG1 THR A 53 3.356 -11.884 0.791 1.00 52.11 H new ATOM 0 HG21 THR A 53 3.131 -13.664 -0.781 1.00 5.35 H new ATOM 0 HG22 THR A 53 1.704 -13.634 -1.844 1.00 5.35 H new ATOM 0 HG23 THR A 53 3.016 -12.456 -2.083 1.00 5.35 H new ATOM 795 N GLY A 54 0.523 -9.189 0.319 1.00 54.43 N ATOM 796 CA GLY A 54 -0.205 -8.301 1.217 1.00 11.44 C ATOM 797 C GLY A 54 0.232 -6.842 1.099 1.00 42.21 C ATOM 798 O GLY A 54 1.426 -6.533 1.106 1.00 44.03 O ATOM 0 H GLY A 54 1.463 -8.876 0.078 1.00 54.43 H new ATOM 0 HA2 GLY A 54 -1.272 -8.373 1.004 1.00 11.44 H new ATOM 0 HA3 GLY A 54 -0.062 -8.635 2.244 1.00 11.44 H new ATOM 802 N LEU A 55 -0.747 -5.941 1.046 1.00 61.22 N ATOM 803 CA LEU A 55 -0.499 -4.503 0.878 1.00 74.02 C ATOM 804 C LEU A 55 -1.414 -3.682 1.801 1.00 74.14 C ATOM 805 O LEU A 55 -2.273 -4.238 2.479 1.00 22.21 O ATOM 806 CB LEU A 55 -0.745 -4.091 -0.587 1.00 64.05 C ATOM 807 CG LEU A 55 0.104 -4.821 -1.643 1.00 61.31 C ATOM 808 CD1 LEU A 55 -0.324 -4.416 -3.050 1.00 41.25 C ATOM 809 CD2 LEU A 55 1.588 -4.541 -1.434 1.00 31.52 C ATOM 0 H LEU A 55 -1.735 -6.183 1.118 1.00 61.22 H new ATOM 0 HA LEU A 55 0.539 -4.303 1.143 1.00 74.02 H new ATOM 0 HB2 LEU A 55 -1.797 -4.255 -0.818 1.00 64.05 H new ATOM 0 HB3 LEU A 55 -0.562 -3.020 -0.679 1.00 64.05 H new ATOM 0 HG LEU A 55 -0.060 -5.892 -1.528 1.00 61.31 H new ATOM 0 HD11 LEU A 55 0.288 -4.943 -3.782 1.00 41.25 H new ATOM 0 HD12 LEU A 55 -1.372 -4.674 -3.200 1.00 41.25 H new ATOM 0 HD13 LEU A 55 -0.194 -3.341 -3.175 1.00 41.25 H new ATOM 0 HD21 LEU A 55 2.168 -5.067 -2.192 1.00 31.52 H new ATOM 0 HD22 LEU A 55 1.771 -3.470 -1.516 1.00 31.52 H new ATOM 0 HD23 LEU A 55 1.887 -4.885 -0.444 1.00 31.52 H new ATOM 821 N VAL A 56 -1.221 -2.364 1.831 1.00 21.33 N ATOM 822 CA VAL A 56 -2.093 -1.458 2.599 1.00 64.12 C ATOM 823 C VAL A 56 -2.362 -0.170 1.800 1.00 0.01 C ATOM 824 O VAL A 56 -1.460 0.630 1.587 1.00 74.11 O ATOM 825 CB VAL A 56 -1.477 -1.086 3.979 1.00 61.14 C ATOM 826 CG1 VAL A 56 -2.427 -0.202 4.782 1.00 41.13 C ATOM 827 CG2 VAL A 56 -1.108 -2.337 4.776 1.00 23.30 C ATOM 0 H VAL A 56 -0.467 -1.892 1.332 1.00 21.33 H new ATOM 0 HA VAL A 56 -3.029 -1.988 2.776 1.00 64.12 H new ATOM 0 HB VAL A 56 -0.563 -0.523 3.790 1.00 61.14 H new ATOM 0 HG11 VAL A 56 -1.972 0.043 5.742 1.00 41.13 H new ATOM 0 HG12 VAL A 56 -2.625 0.716 4.229 1.00 41.13 H new ATOM 0 HG13 VAL A 56 -3.364 -0.733 4.950 1.00 41.13 H new ATOM 0 HG21 VAL A 56 -0.680 -2.044 5.735 1.00 23.30 H new ATOM 0 HG22 VAL A 56 -2.002 -2.937 4.945 1.00 23.30 H new ATOM 0 HG23 VAL A 56 -0.378 -2.923 4.217 1.00 23.30 H new ATOM 837 N ILE A 57 -3.602 0.026 1.355 1.00 72.31 N ATOM 838 CA ILE A 57 -3.937 1.144 0.455 1.00 44.30 C ATOM 839 C ILE A 57 -4.391 2.403 1.217 1.00 1.01 C ATOM 840 O ILE A 57 -5.284 2.351 2.067 1.00 43.14 O ATOM 841 CB ILE A 57 -5.033 0.731 -0.577 1.00 0.12 C ATOM 842 CG1 ILE A 57 -4.431 -0.139 -1.701 1.00 72.33 C ATOM 843 CG2 ILE A 57 -5.727 1.960 -1.176 1.00 60.42 C ATOM 844 CD1 ILE A 57 -3.779 -1.422 -1.226 1.00 54.03 C ATOM 0 H ILE A 57 -4.394 -0.569 1.598 1.00 72.31 H new ATOM 0 HA ILE A 57 -3.017 1.390 -0.076 1.00 44.30 H new ATOM 0 HB ILE A 57 -5.780 0.144 -0.042 1.00 0.12 H new ATOM 0 HG12 ILE A 57 -5.220 -0.389 -2.411 1.00 72.33 H new ATOM 0 HG13 ILE A 57 -3.691 0.451 -2.242 1.00 72.33 H new ATOM 0 HG21 ILE A 57 -6.484 1.638 -1.891 1.00 60.42 H new ATOM 0 HG22 ILE A 57 -6.200 2.535 -0.380 1.00 60.42 H new ATOM 0 HG23 ILE A 57 -4.990 2.582 -1.684 1.00 60.42 H new ATOM 0 HD11 ILE A 57 -3.384 -1.968 -2.083 1.00 54.03 H new ATOM 0 HD12 ILE A 57 -2.965 -1.185 -0.541 1.00 54.03 H new ATOM 0 HD13 ILE A 57 -4.518 -2.037 -0.712 1.00 54.03 H new ATOM 856 N GLY A 58 -3.759 3.535 0.892 1.00 3.43 N ATOM 857 CA GLY A 58 -4.168 4.831 1.428 1.00 41.53 C ATOM 858 C GLY A 58 -4.304 5.891 0.333 1.00 63.51 C ATOM 859 O GLY A 58 -3.491 5.944 -0.593 1.00 15.13 O ATOM 0 H GLY A 58 -2.961 3.577 0.259 1.00 3.43 H new ATOM 0 HA2 GLY A 58 -5.120 4.723 1.948 1.00 41.53 H new ATOM 0 HA3 GLY A 58 -3.438 5.164 2.166 1.00 41.53 H new ATOM 863 N MET A 59 -5.336 6.731 0.431 1.00 54.43 N ATOM 864 CA MET A 59 -5.581 7.780 -0.572 1.00 32.50 C ATOM 865 C MET A 59 -4.727 9.035 -0.307 1.00 30.14 C ATOM 866 O MET A 59 -4.230 9.242 0.799 1.00 55.12 O ATOM 867 CB MET A 59 -7.071 8.145 -0.609 1.00 32.44 C ATOM 868 CG MET A 59 -7.961 7.011 -1.100 1.00 72.11 C ATOM 869 SD MET A 59 -9.707 7.462 -1.152 1.00 42.22 S ATOM 870 CE MET A 59 -10.042 7.769 0.582 1.00 50.52 C ATOM 0 H MET A 59 -6.016 6.709 1.191 1.00 54.43 H new ATOM 0 HA MET A 59 -5.288 7.382 -1.544 1.00 32.50 H new ATOM 0 HB2 MET A 59 -7.390 8.440 0.391 1.00 32.44 H new ATOM 0 HB3 MET A 59 -7.209 9.011 -1.256 1.00 32.44 H new ATOM 0 HG2 MET A 59 -7.639 6.709 -2.097 1.00 72.11 H new ATOM 0 HG3 MET A 59 -7.833 6.147 -0.448 1.00 72.11 H new ATOM 0 HE1 MET A 59 -11.008 7.340 0.848 1.00 50.52 H new ATOM 0 HE2 MET A 59 -9.262 7.311 1.190 1.00 50.52 H new ATOM 0 HE3 MET A 59 -10.060 8.843 0.764 1.00 50.52 H new ATOM 880 N SER A 60 -4.576 9.876 -1.331 1.00 53.53 N ATOM 881 CA SER A 60 -3.684 11.046 -1.253 1.00 14.14 C ATOM 882 C SER A 60 -4.257 12.266 -2.011 1.00 53.33 C ATOM 883 O SER A 60 -5.201 12.134 -2.795 1.00 55.54 O ATOM 884 CB SER A 60 -2.304 10.671 -1.816 1.00 13.30 C ATOM 885 OG SER A 60 -2.389 10.265 -3.173 1.00 53.20 O ATOM 0 H SER A 60 -5.057 9.774 -2.225 1.00 53.53 H new ATOM 0 HA SER A 60 -3.594 11.333 -0.205 1.00 14.14 H new ATOM 0 HB2 SER A 60 -1.631 11.525 -1.732 1.00 13.30 H new ATOM 0 HB3 SER A 60 -1.873 9.866 -1.221 1.00 13.30 H new ATOM 0 HG SER A 60 -2.839 9.396 -3.227 1.00 53.20 H new ATOM 891 N PRO A 61 -3.715 13.483 -1.755 1.00 53.03 N ATOM 892 CA PRO A 61 -4.134 14.721 -2.460 1.00 31.13 C ATOM 893 C PRO A 61 -4.028 14.629 -3.995 1.00 1.44 C ATOM 894 O PRO A 61 -3.408 13.713 -4.532 1.00 61.32 O ATOM 895 CB PRO A 61 -3.161 15.781 -1.922 1.00 61.25 C ATOM 896 CG PRO A 61 -2.740 15.261 -0.590 1.00 24.40 C ATOM 897 CD PRO A 61 -2.678 13.765 -0.739 1.00 51.20 C ATOM 0 HA PRO A 61 -5.186 14.938 -2.277 1.00 31.13 H new ATOM 0 HB2 PRO A 61 -2.306 15.909 -2.586 1.00 61.25 H new ATOM 0 HB3 PRO A 61 -3.644 16.754 -1.833 1.00 61.25 H new ATOM 0 HG2 PRO A 61 -1.771 15.666 -0.300 1.00 24.40 H new ATOM 0 HG3 PRO A 61 -3.450 15.548 0.185 1.00 24.40 H new ATOM 0 HD2 PRO A 61 -1.693 13.434 -1.067 1.00 51.20 H new ATOM 0 HD3 PRO A 61 -2.888 13.258 0.202 1.00 51.20 H new ATOM 905 N ALA A 62 -4.615 15.611 -4.687 1.00 15.20 N ATOM 906 CA ALA A 62 -4.678 15.624 -6.160 1.00 33.12 C ATOM 907 C ALA A 62 -3.312 15.380 -6.829 1.00 4.30 C ATOM 908 O ALA A 62 -3.190 14.526 -7.708 1.00 51.33 O ATOM 909 CB ALA A 62 -5.265 16.948 -6.642 1.00 61.31 C ATOM 0 H ALA A 62 -5.059 16.418 -4.248 1.00 15.20 H new ATOM 0 HA ALA A 62 -5.323 14.796 -6.455 1.00 33.12 H new ATOM 0 HB1 ALA A 62 -5.309 16.951 -7.731 1.00 61.31 H new ATOM 0 HB2 ALA A 62 -6.270 17.069 -6.238 1.00 61.31 H new ATOM 0 HB3 ALA A 62 -4.636 17.770 -6.302 1.00 61.31 H new ATOM 915 N ALA A 63 -2.293 16.133 -6.412 1.00 61.10 N ATOM 916 CA ALA A 63 -0.942 16.008 -6.987 1.00 45.43 C ATOM 917 C ALA A 63 -0.388 14.578 -6.849 1.00 74.54 C ATOM 918 O ALA A 63 0.052 13.971 -7.831 1.00 74.05 O ATOM 919 CB ALA A 63 0.005 17.009 -6.333 1.00 44.22 C ATOM 0 H ALA A 63 -2.372 16.837 -5.678 1.00 61.10 H new ATOM 0 HA ALA A 63 -1.017 16.228 -8.052 1.00 45.43 H new ATOM 0 HB1 ALA A 63 1.000 16.906 -6.767 1.00 44.22 H new ATOM 0 HB2 ALA A 63 -0.362 18.021 -6.503 1.00 44.22 H new ATOM 0 HB3 ALA A 63 0.055 16.816 -5.261 1.00 44.22 H new ATOM 925 N SER A 64 -0.414 14.043 -5.629 1.00 20.23 N ATOM 926 CA SER A 64 0.013 12.656 -5.382 1.00 34.32 C ATOM 927 C SER A 64 -0.815 11.662 -6.213 1.00 51.35 C ATOM 928 O SER A 64 -0.268 10.797 -6.900 1.00 51.22 O ATOM 929 CB SER A 64 -0.116 12.307 -3.891 1.00 20.14 C ATOM 930 OG SER A 64 0.730 13.108 -3.078 1.00 74.43 O ATOM 0 H SER A 64 -0.724 14.542 -4.795 1.00 20.23 H new ATOM 0 HA SER A 64 1.058 12.577 -5.682 1.00 34.32 H new ATOM 0 HB2 SER A 64 -1.151 12.440 -3.577 1.00 20.14 H new ATOM 0 HB3 SER A 64 0.130 11.255 -3.743 1.00 20.14 H new ATOM 0 HG SER A 64 0.209 13.490 -2.341 1.00 74.43 H new ATOM 936 N ALA A 65 -2.140 11.808 -6.159 1.00 23.43 N ATOM 937 CA ALA A 65 -3.061 10.937 -6.901 1.00 64.34 C ATOM 938 C ALA A 65 -2.789 10.967 -8.414 1.00 4.25 C ATOM 939 O ALA A 65 -2.936 9.954 -9.102 1.00 71.44 O ATOM 940 CB ALA A 65 -4.505 11.335 -6.615 1.00 1.44 C ATOM 0 H ALA A 65 -2.605 12.527 -5.605 1.00 23.43 H new ATOM 0 HA ALA A 65 -2.894 9.915 -6.560 1.00 64.34 H new ATOM 0 HB1 ALA A 65 -5.179 10.683 -7.170 1.00 1.44 H new ATOM 0 HB2 ALA A 65 -4.704 11.239 -5.548 1.00 1.44 H new ATOM 0 HB3 ALA A 65 -4.665 12.368 -6.922 1.00 1.44 H new ATOM 946 N ALA A 66 -2.399 12.132 -8.927 1.00 1.35 N ATOM 947 CA ALA A 66 -2.029 12.275 -10.339 1.00 13.41 C ATOM 948 C ALA A 66 -0.825 11.387 -10.689 1.00 63.34 C ATOM 949 O ALA A 66 -0.785 10.760 -11.750 1.00 2.22 O ATOM 950 CB ALA A 66 -1.727 13.735 -10.657 1.00 51.25 C ATOM 0 H ALA A 66 -2.330 12.994 -8.387 1.00 1.35 H new ATOM 0 HA ALA A 66 -2.872 11.949 -10.948 1.00 13.41 H new ATOM 0 HB1 ALA A 66 -1.453 13.829 -11.708 1.00 51.25 H new ATOM 0 HB2 ALA A 66 -2.610 14.341 -10.456 1.00 51.25 H new ATOM 0 HB3 ALA A 66 -0.901 14.080 -10.035 1.00 51.25 H new ATOM 956 N SER A 67 0.157 11.337 -9.787 1.00 13.31 N ATOM 957 CA SER A 67 1.330 10.463 -9.961 1.00 62.13 C ATOM 958 C SER A 67 0.929 8.982 -9.904 1.00 20.43 C ATOM 959 O SER A 67 1.400 8.169 -10.701 1.00 41.42 O ATOM 960 CB SER A 67 2.394 10.764 -8.892 1.00 12.10 C ATOM 961 OG SER A 67 2.885 12.090 -9.023 1.00 12.54 O ATOM 0 H SER A 67 0.168 11.888 -8.929 1.00 13.31 H new ATOM 0 HA SER A 67 1.753 10.666 -10.945 1.00 62.13 H new ATOM 0 HB2 SER A 67 1.966 10.627 -7.899 1.00 12.10 H new ATOM 0 HB3 SER A 67 3.218 10.056 -8.984 1.00 12.10 H new ATOM 0 HG SER A 67 3.559 12.259 -8.332 1.00 12.54 H new ATOM 967 N ILE A 68 0.045 8.643 -8.963 1.00 71.41 N ATOM 968 CA ILE A 68 -0.492 7.280 -8.849 1.00 4.13 C ATOM 969 C ILE A 68 -1.115 6.818 -10.175 1.00 33.43 C ATOM 970 O ILE A 68 -0.749 5.778 -10.720 1.00 12.02 O ATOM 971 CB ILE A 68 -1.569 7.190 -7.737 1.00 4.12 C ATOM 972 CG1 ILE A 68 -1.000 7.664 -6.391 1.00 5.20 C ATOM 973 CG2 ILE A 68 -2.108 5.764 -7.619 1.00 12.32 C ATOM 974 CD1 ILE A 68 -2.028 7.713 -5.276 1.00 30.44 C ATOM 0 H ILE A 68 -0.317 9.294 -8.266 1.00 71.41 H new ATOM 0 HA ILE A 68 0.346 6.631 -8.594 1.00 4.13 H new ATOM 0 HB ILE A 68 -2.395 7.846 -8.011 1.00 4.12 H new ATOM 0 HG12 ILE A 68 -0.188 6.999 -6.096 1.00 5.20 H new ATOM 0 HG13 ILE A 68 -0.568 8.657 -6.519 1.00 5.20 H new ATOM 0 HG21 ILE A 68 -2.862 5.724 -6.833 1.00 12.32 H new ATOM 0 HG22 ILE A 68 -2.555 5.465 -8.567 1.00 12.32 H new ATOM 0 HG23 ILE A 68 -1.291 5.085 -7.373 1.00 12.32 H new ATOM 0 HD11 ILE A 68 -1.552 8.056 -4.357 1.00 30.44 H new ATOM 0 HD12 ILE A 68 -2.829 8.401 -5.549 1.00 30.44 H new ATOM 0 HD13 ILE A 68 -2.443 6.717 -5.119 1.00 30.44 H new ATOM 986 N GLN A 69 -2.051 7.616 -10.691 1.00 2.23 N ATOM 987 CA GLN A 69 -2.722 7.316 -11.962 1.00 14.53 C ATOM 988 C GLN A 69 -1.718 7.231 -13.124 1.00 31.00 C ATOM 989 O GLN A 69 -1.917 6.474 -14.074 1.00 44.54 O ATOM 990 CB GLN A 69 -3.790 8.380 -12.256 1.00 12.25 C ATOM 991 CG GLN A 69 -4.908 8.422 -11.216 1.00 44.52 C ATOM 992 CD GLN A 69 -5.926 9.520 -11.480 1.00 34.24 C ATOM 993 OE1 GLN A 69 -6.921 9.315 -12.166 1.00 74.01 O ATOM 994 NE2 GLN A 69 -5.691 10.690 -10.925 1.00 40.44 N ATOM 0 H GLN A 69 -2.364 8.480 -10.248 1.00 2.23 H new ATOM 0 HA GLN A 69 -3.202 6.342 -11.868 1.00 14.53 H new ATOM 0 HB2 GLN A 69 -3.313 9.359 -12.305 1.00 12.25 H new ATOM 0 HB3 GLN A 69 -4.224 8.187 -13.237 1.00 12.25 H new ATOM 0 HG2 GLN A 69 -5.417 7.459 -11.200 1.00 44.52 H new ATOM 0 HG3 GLN A 69 -4.472 8.569 -10.228 1.00 44.52 H new ATOM 0 HE21 GLN A 69 -4.853 10.827 -10.360 1.00 40.44 H new ATOM 0 HE22 GLN A 69 -6.347 11.459 -11.060 1.00 40.44 H new ATOM 1003 N GLY A 70 -0.632 8.000 -13.032 1.00 62.32 N ATOM 1004 CA GLY A 70 0.410 7.967 -14.058 1.00 3.10 C ATOM 1005 C GLY A 70 1.119 6.615 -14.160 1.00 1.34 C ATOM 1006 O GLY A 70 1.402 6.134 -15.258 1.00 45.05 O ATOM 0 H GLY A 70 -0.452 8.648 -12.265 1.00 62.32 H new ATOM 0 HA2 GLY A 70 -0.033 8.210 -15.024 1.00 3.10 H new ATOM 0 HA3 GLY A 70 1.147 8.740 -13.842 1.00 3.10 H new ATOM 1010 N ALA A 71 1.417 6.005 -13.013 1.00 3.41 N ATOM 1011 CA ALA A 71 2.089 4.695 -12.977 1.00 15.22 C ATOM 1012 C ALA A 71 1.102 3.540 -12.716 1.00 35.11 C ATOM 1013 O ALA A 71 1.509 2.380 -12.592 1.00 31.42 O ATOM 1014 CB ALA A 71 3.185 4.704 -11.917 1.00 51.10 C ATOM 0 H ALA A 71 1.206 6.393 -12.093 1.00 3.41 H new ATOM 0 HA ALA A 71 2.531 4.524 -13.959 1.00 15.22 H new ATOM 0 HB1 ALA A 71 3.678 3.732 -11.895 1.00 51.10 H new ATOM 0 HB2 ALA A 71 3.916 5.477 -12.156 1.00 51.10 H new ATOM 0 HB3 ALA A 71 2.746 4.910 -10.941 1.00 51.10 H new ATOM 1020 N LEU A 72 -0.191 3.857 -12.656 1.00 1.25 N ATOM 1021 CA LEU A 72 -1.231 2.875 -12.308 1.00 51.32 C ATOM 1022 C LEU A 72 -1.201 1.633 -13.219 1.00 35.13 C ATOM 1023 O LEU A 72 -1.451 0.513 -12.766 1.00 70.12 O ATOM 1024 CB LEU A 72 -2.615 3.537 -12.371 1.00 34.44 C ATOM 1025 CG LEU A 72 -3.776 2.692 -11.822 1.00 22.12 C ATOM 1026 CD1 LEU A 72 -3.551 2.364 -10.347 1.00 74.11 C ATOM 1027 CD2 LEU A 72 -5.110 3.412 -12.020 1.00 61.13 C ATOM 0 H LEU A 72 -0.551 4.793 -12.845 1.00 1.25 H new ATOM 0 HA LEU A 72 -1.026 2.534 -11.293 1.00 51.32 H new ATOM 0 HB2 LEU A 72 -2.576 4.474 -11.816 1.00 34.44 H new ATOM 0 HB3 LEU A 72 -2.831 3.790 -13.409 1.00 34.44 H new ATOM 0 HG LEU A 72 -3.811 1.755 -12.379 1.00 22.12 H new ATOM 0 HD11 LEU A 72 -4.383 1.765 -9.976 1.00 74.11 H new ATOM 0 HD12 LEU A 72 -2.623 1.803 -10.236 1.00 74.11 H new ATOM 0 HD13 LEU A 72 -3.486 3.289 -9.774 1.00 74.11 H new ATOM 0 HD21 LEU A 72 -5.918 2.796 -11.624 1.00 61.13 H new ATOM 0 HD22 LEU A 72 -5.090 4.366 -11.494 1.00 61.13 H new ATOM 0 HD23 LEU A 72 -5.275 3.587 -13.083 1.00 61.13 H new ATOM 1039 N SER A 73 -0.886 1.835 -14.497 1.00 71.33 N ATOM 1040 CA SER A 73 -0.817 0.733 -15.476 1.00 11.14 C ATOM 1041 C SER A 73 0.169 -0.374 -15.057 1.00 53.41 C ATOM 1042 O SER A 73 0.094 -1.500 -15.547 1.00 3.42 O ATOM 1043 CB SER A 73 -0.422 1.270 -16.861 1.00 71.34 C ATOM 1044 OG SER A 73 -1.349 2.242 -17.319 1.00 10.32 O ATOM 0 H SER A 73 -0.672 2.753 -14.887 1.00 71.33 H new ATOM 0 HA SER A 73 -1.813 0.291 -15.516 1.00 11.14 H new ATOM 0 HB2 SER A 73 0.575 1.709 -16.813 1.00 71.34 H new ATOM 0 HB3 SER A 73 -0.374 0.446 -17.573 1.00 71.34 H new ATOM 0 HG SER A 73 -1.073 2.568 -18.201 1.00 10.32 H new ATOM 1050 N THR A 74 1.098 -0.053 -14.162 1.00 12.03 N ATOM 1051 CA THR A 74 2.076 -1.038 -13.672 1.00 1.20 C ATOM 1052 C THR A 74 1.681 -1.595 -12.288 1.00 44.35 C ATOM 1053 O THR A 74 2.248 -2.581 -11.813 1.00 33.01 O ATOM 1054 CB THR A 74 3.496 -0.415 -13.605 1.00 51.44 C ATOM 1055 OG1 THR A 74 3.830 0.161 -14.879 1.00 70.22 O ATOM 1056 CG2 THR A 74 4.553 -1.452 -13.238 1.00 44.13 C ATOM 0 H THR A 74 1.200 0.878 -13.758 1.00 12.03 H new ATOM 0 HA THR A 74 2.082 -1.866 -14.381 1.00 1.20 H new ATOM 0 HB THR A 74 3.484 0.351 -12.830 1.00 51.44 H new ATOM 0 HG1 THR A 74 4.726 0.555 -14.835 1.00 70.22 H new ATOM 0 HG21 THR A 74 5.533 -0.976 -13.202 1.00 44.13 H new ATOM 0 HG22 THR A 74 4.321 -1.879 -12.262 1.00 44.13 H new ATOM 0 HG23 THR A 74 4.562 -2.243 -13.987 1.00 44.13 H new ATOM 1064 N ILE A 75 0.689 -0.973 -11.655 1.00 55.50 N ATOM 1065 CA ILE A 75 0.259 -1.363 -10.303 1.00 13.51 C ATOM 1066 C ILE A 75 -0.893 -2.392 -10.331 1.00 0.10 C ATOM 1067 O ILE A 75 -0.848 -3.405 -9.628 1.00 10.44 O ATOM 1068 CB ILE A 75 -0.187 -0.120 -9.487 1.00 22.30 C ATOM 1069 CG1 ILE A 75 0.941 0.932 -9.456 1.00 50.33 C ATOM 1070 CG2 ILE A 75 -0.593 -0.518 -8.066 1.00 44.41 C ATOM 1071 CD1 ILE A 75 0.570 2.214 -8.735 1.00 4.44 C ATOM 0 H ILE A 75 0.163 -0.195 -12.053 1.00 55.50 H new ATOM 0 HA ILE A 75 1.121 -1.828 -9.824 1.00 13.51 H new ATOM 0 HB ILE A 75 -1.057 0.318 -9.976 1.00 22.30 H new ATOM 0 HG12 ILE A 75 1.817 0.497 -8.974 1.00 50.33 H new ATOM 0 HG13 ILE A 75 1.227 1.173 -10.480 1.00 50.33 H new ATOM 0 HG21 ILE A 75 -0.902 0.370 -7.514 1.00 44.41 H new ATOM 0 HG22 ILE A 75 -1.422 -1.225 -8.109 1.00 44.41 H new ATOM 0 HG23 ILE A 75 0.255 -0.982 -7.562 1.00 44.41 H new ATOM 0 HD11 ILE A 75 1.415 2.902 -8.757 1.00 4.44 H new ATOM 0 HD12 ILE A 75 -0.285 2.675 -9.229 1.00 4.44 H new ATOM 0 HD13 ILE A 75 0.313 1.988 -7.700 1.00 4.44 H new ATOM 1083 N LEU A 76 -1.909 -2.130 -11.155 1.00 62.11 N ATOM 1084 CA LEU A 76 -3.127 -2.966 -11.210 1.00 21.03 C ATOM 1085 C LEU A 76 -2.819 -4.468 -11.371 1.00 12.41 C ATOM 1086 O LEU A 76 -3.256 -5.293 -10.567 1.00 32.44 O ATOM 1087 CB LEU A 76 -4.027 -2.502 -12.365 1.00 24.22 C ATOM 1088 CG LEU A 76 -4.556 -1.060 -12.254 1.00 31.31 C ATOM 1089 CD1 LEU A 76 -5.380 -0.690 -13.485 1.00 75.24 C ATOM 1090 CD2 LEU A 76 -5.377 -0.880 -10.977 1.00 35.42 C ATOM 0 H LEU A 76 -1.919 -1.341 -11.801 1.00 62.11 H new ATOM 0 HA LEU A 76 -3.637 -2.842 -10.255 1.00 21.03 H new ATOM 0 HB2 LEU A 76 -3.470 -2.595 -13.297 1.00 24.22 H new ATOM 0 HB3 LEU A 76 -4.879 -3.179 -12.434 1.00 24.22 H new ATOM 0 HG LEU A 76 -3.700 -0.387 -12.204 1.00 31.31 H new ATOM 0 HD11 LEU A 76 -5.744 0.333 -13.385 1.00 75.24 H new ATOM 0 HD12 LEU A 76 -4.758 -0.769 -14.376 1.00 75.24 H new ATOM 0 HD13 LEU A 76 -6.228 -1.370 -13.573 1.00 75.24 H new ATOM 0 HD21 LEU A 76 -5.740 0.146 -10.920 1.00 35.42 H new ATOM 0 HD22 LEU A 76 -6.225 -1.565 -10.990 1.00 35.42 H new ATOM 0 HD23 LEU A 76 -4.752 -1.092 -10.110 1.00 35.42 H new ATOM 1102 N GLY A 77 -2.054 -4.812 -12.407 1.00 52.41 N ATOM 1103 CA GLY A 77 -1.767 -6.215 -12.719 1.00 60.22 C ATOM 1104 C GLY A 77 -0.923 -6.954 -11.671 1.00 11.13 C ATOM 1105 O GLY A 77 -0.542 -8.107 -11.887 1.00 44.40 O ATOM 0 H GLY A 77 -1.622 -4.142 -13.044 1.00 52.41 H new ATOM 0 HA2 GLY A 77 -2.712 -6.745 -12.842 1.00 60.22 H new ATOM 0 HA3 GLY A 77 -1.250 -6.260 -13.677 1.00 60.22 H new ATOM 1109 N SER A 78 -0.627 -6.310 -10.543 1.00 32.21 N ATOM 1110 CA SER A 78 0.193 -6.934 -9.488 1.00 21.30 C ATOM 1111 C SER A 78 -0.664 -7.650 -8.432 1.00 22.13 C ATOM 1112 O SER A 78 -0.142 -8.410 -7.618 1.00 21.24 O ATOM 1113 CB SER A 78 1.072 -5.880 -8.796 1.00 52.43 C ATOM 1114 OG SER A 78 1.921 -5.220 -9.725 1.00 15.12 O ATOM 0 H SER A 78 -0.937 -5.362 -10.330 1.00 32.21 H new ATOM 0 HA SER A 78 0.821 -7.679 -9.977 1.00 21.30 H new ATOM 0 HB2 SER A 78 0.438 -5.147 -8.296 1.00 52.43 H new ATOM 0 HB3 SER A 78 1.676 -6.358 -8.025 1.00 52.43 H new ATOM 0 HG SER A 78 2.466 -4.555 -9.255 1.00 15.12 H new ATOM 1120 N VAL A 79 -1.979 -7.410 -8.438 1.00 63.42 N ATOM 1121 CA VAL A 79 -2.870 -7.963 -7.400 1.00 62.00 C ATOM 1122 C VAL A 79 -4.183 -8.532 -7.976 1.00 34.11 C ATOM 1123 O VAL A 79 -4.878 -7.875 -8.756 1.00 55.32 O ATOM 1124 CB VAL A 79 -3.205 -6.893 -6.327 1.00 5.44 C ATOM 1125 CG1 VAL A 79 -1.992 -6.613 -5.441 1.00 61.15 C ATOM 1126 CG2 VAL A 79 -3.699 -5.603 -6.988 1.00 13.55 C ATOM 0 H VAL A 79 -2.452 -6.842 -9.141 1.00 63.42 H new ATOM 0 HA VAL A 79 -2.321 -8.787 -6.943 1.00 62.00 H new ATOM 0 HB VAL A 79 -4.003 -7.284 -5.696 1.00 5.44 H new ATOM 0 HG11 VAL A 79 -2.251 -5.860 -4.697 1.00 61.15 H new ATOM 0 HG12 VAL A 79 -1.689 -7.531 -4.938 1.00 61.15 H new ATOM 0 HG13 VAL A 79 -1.169 -6.248 -6.055 1.00 61.15 H new ATOM 0 HG21 VAL A 79 -3.929 -4.865 -6.219 1.00 13.55 H new ATOM 0 HG22 VAL A 79 -2.924 -5.212 -7.647 1.00 13.55 H new ATOM 0 HG23 VAL A 79 -4.597 -5.813 -7.569 1.00 13.55 H new ATOM 1136 N ASN A 80 -4.505 -9.771 -7.590 1.00 73.44 N ATOM 1137 CA ASN A 80 -5.762 -10.424 -7.983 1.00 4.21 C ATOM 1138 C ASN A 80 -6.075 -11.624 -7.064 1.00 0.24 C ATOM 1139 O ASN A 80 -5.385 -11.845 -6.070 1.00 72.12 O ATOM 1140 CB ASN A 80 -5.684 -10.887 -9.449 1.00 62.21 C ATOM 1141 CG ASN A 80 -4.651 -11.980 -9.673 1.00 14.34 C ATOM 1142 OD1 ASN A 80 -3.647 -12.067 -8.970 1.00 12.20 O ATOM 1143 ND2 ASN A 80 -4.885 -12.821 -10.658 1.00 1.45 N ATOM 0 H ASN A 80 -3.906 -10.348 -6.999 1.00 73.44 H new ATOM 0 HA ASN A 80 -6.568 -9.697 -7.880 1.00 4.21 H new ATOM 0 HB2 ASN A 80 -6.663 -11.250 -9.762 1.00 62.21 H new ATOM 0 HB3 ASN A 80 -5.444 -10.033 -10.082 1.00 62.21 H new ATOM 0 HD21 ASN A 80 -4.223 -13.572 -10.856 1.00 1.45 H new ATOM 0 HD22 ASN A 80 -5.728 -12.722 -11.224 1.00 1.45 H new ATOM 1150 N GLU A 81 -7.131 -12.371 -7.395 1.00 33.23 N ATOM 1151 CA GLU A 81 -7.439 -13.664 -6.750 1.00 43.53 C ATOM 1152 C GLU A 81 -7.689 -13.561 -5.228 1.00 43.43 C ATOM 1153 O GLU A 81 -8.840 -13.584 -4.775 1.00 54.21 O ATOM 1154 CB GLU A 81 -6.312 -14.675 -7.033 1.00 11.45 C ATOM 1155 CG GLU A 81 -6.532 -16.049 -6.400 1.00 22.24 C ATOM 1156 CD GLU A 81 -5.389 -17.016 -6.671 1.00 1.25 C ATOM 1157 OE1 GLU A 81 -5.437 -17.725 -7.699 1.00 3.53 O ATOM 1158 OE2 GLU A 81 -4.443 -17.078 -5.854 1.00 12.42 O ATOM 0 H GLU A 81 -7.800 -12.103 -8.116 1.00 33.23 H new ATOM 0 HA GLU A 81 -8.376 -14.008 -7.188 1.00 43.53 H new ATOM 0 HB2 GLU A 81 -6.210 -14.796 -8.111 1.00 11.45 H new ATOM 0 HB3 GLU A 81 -5.371 -14.265 -6.667 1.00 11.45 H new ATOM 0 HG2 GLU A 81 -6.654 -15.932 -5.323 1.00 22.24 H new ATOM 0 HG3 GLU A 81 -7.460 -16.475 -6.782 1.00 22.24 H new ATOM 1165 N LYS A 82 -6.613 -13.467 -4.441 1.00 35.35 N ATOM 1166 CA LYS A 82 -6.723 -13.517 -2.974 1.00 44.21 C ATOM 1167 C LYS A 82 -5.773 -12.540 -2.262 1.00 45.45 C ATOM 1168 O LYS A 82 -5.819 -12.425 -1.035 1.00 21.42 O ATOM 1169 CB LYS A 82 -6.436 -14.940 -2.474 1.00 21.20 C ATOM 1170 CG LYS A 82 -5.050 -15.453 -2.863 1.00 23.41 C ATOM 1171 CD LYS A 82 -4.711 -16.772 -2.175 1.00 34.05 C ATOM 1172 CE LYS A 82 -4.561 -16.601 -0.669 1.00 21.31 C ATOM 1173 NZ LYS A 82 -4.182 -17.872 -0.001 1.00 30.42 N ATOM 0 H LYS A 82 -5.661 -13.357 -4.789 1.00 35.35 H new ATOM 0 HA LYS A 82 -7.743 -13.218 -2.733 1.00 44.21 H new ATOM 0 HB2 LYS A 82 -6.532 -14.962 -1.388 1.00 21.20 H new ATOM 0 HB3 LYS A 82 -7.191 -15.617 -2.874 1.00 21.20 H new ATOM 0 HG2 LYS A 82 -5.004 -15.586 -3.944 1.00 23.41 H new ATOM 0 HG3 LYS A 82 -4.301 -14.706 -2.602 1.00 23.41 H new ATOM 0 HD2 LYS A 82 -5.494 -17.502 -2.382 1.00 34.05 H new ATOM 0 HD3 LYS A 82 -3.785 -17.171 -2.590 1.00 34.05 H new ATOM 0 HE2 LYS A 82 -3.805 -15.844 -0.463 1.00 21.31 H new ATOM 0 HE3 LYS A 82 -5.499 -16.237 -0.250 1.00 21.31 H new ATOM 0 HZ1 LYS A 82 -4.461 -17.835 1.000 1.00 30.42 H new ATOM 0 HZ2 LYS A 82 -4.666 -18.666 -0.466 1.00 30.42 H new ATOM 0 HZ3 LYS A 82 -3.153 -18.006 -0.069 1.00 30.42 H new ATOM 1187 N GLN A 83 -4.908 -11.853 -3.011 1.00 2.33 N ATOM 1188 CA GLN A 83 -3.940 -10.923 -2.406 1.00 42.02 C ATOM 1189 C GLN A 83 -4.644 -9.892 -1.505 1.00 44.13 C ATOM 1190 O GLN A 83 -5.589 -9.221 -1.926 1.00 12.21 O ATOM 1191 CB GLN A 83 -3.093 -10.224 -3.484 1.00 21.22 C ATOM 1192 CG GLN A 83 -2.051 -11.136 -4.137 1.00 52.03 C ATOM 1193 CD GLN A 83 -2.636 -12.080 -5.173 1.00 63.45 C ATOM 1194 OE1 GLN A 83 -3.104 -13.170 -4.855 1.00 25.32 O ATOM 1195 NE2 GLN A 83 -2.576 -11.686 -6.429 1.00 44.21 N ATOM 0 H GLN A 83 -4.854 -11.919 -4.027 1.00 2.33 H new ATOM 0 HA GLN A 83 -3.268 -11.509 -1.779 1.00 42.02 H new ATOM 0 HB2 GLN A 83 -3.755 -9.833 -4.256 1.00 21.22 H new ATOM 0 HB3 GLN A 83 -2.585 -9.369 -3.037 1.00 21.22 H new ATOM 0 HG2 GLN A 83 -1.286 -10.520 -4.609 1.00 52.03 H new ATOM 0 HG3 GLN A 83 -1.556 -11.721 -3.362 1.00 52.03 H new ATOM 0 HE21 GLN A 83 -2.181 -10.774 -6.659 1.00 44.21 H new ATOM 0 HE22 GLN A 83 -2.925 -12.293 -7.171 1.00 44.21 H new ATOM 1204 N ALA A 84 -4.181 -9.778 -0.261 1.00 22.03 N ATOM 1205 CA ALA A 84 -4.870 -8.972 0.754 1.00 12.11 C ATOM 1206 C ALA A 84 -4.402 -7.516 0.768 1.00 23.51 C ATOM 1207 O ALA A 84 -3.214 -7.226 0.622 1.00 63.32 O ATOM 1208 CB ALA A 84 -4.685 -9.594 2.131 1.00 3.21 C ATOM 0 H ALA A 84 -3.331 -10.233 0.072 1.00 22.03 H new ATOM 0 HA ALA A 84 -5.928 -8.965 0.492 1.00 12.11 H new ATOM 0 HB1 ALA A 84 -5.200 -8.988 2.876 1.00 3.21 H new ATOM 0 HB2 ALA A 84 -5.100 -10.602 2.134 1.00 3.21 H new ATOM 0 HB3 ALA A 84 -3.623 -9.638 2.371 1.00 3.21 H new ATOM 1214 N VAL A 85 -5.350 -6.602 0.960 1.00 22.32 N ATOM 1215 CA VAL A 85 -5.057 -5.171 1.008 1.00 3.55 C ATOM 1216 C VAL A 85 -5.722 -4.493 2.223 1.00 74.51 C ATOM 1217 O VAL A 85 -6.950 -4.357 2.297 1.00 12.43 O ATOM 1218 CB VAL A 85 -5.487 -4.459 -0.304 1.00 43.01 C ATOM 1219 CG1 VAL A 85 -4.604 -4.901 -1.472 1.00 63.43 C ATOM 1220 CG2 VAL A 85 -6.963 -4.718 -0.621 1.00 71.24 C ATOM 0 H VAL A 85 -6.336 -6.830 1.086 1.00 22.32 H new ATOM 0 HA VAL A 85 -3.977 -5.074 1.114 1.00 3.55 H new ATOM 0 HB VAL A 85 -5.359 -3.387 -0.157 1.00 43.01 H new ATOM 0 HG11 VAL A 85 -4.922 -4.391 -2.381 1.00 63.43 H new ATOM 0 HG12 VAL A 85 -3.565 -4.649 -1.258 1.00 63.43 H new ATOM 0 HG13 VAL A 85 -4.695 -5.978 -1.610 1.00 63.43 H new ATOM 0 HG21 VAL A 85 -7.232 -4.206 -1.545 1.00 71.24 H new ATOM 0 HG22 VAL A 85 -7.127 -5.789 -0.739 1.00 71.24 H new ATOM 0 HG23 VAL A 85 -7.581 -4.343 0.195 1.00 71.24 H new ATOM 1230 N GLY A 86 -4.899 -4.091 3.189 1.00 53.20 N ATOM 1231 CA GLY A 86 -5.392 -3.374 4.356 1.00 12.25 C ATOM 1232 C GLY A 86 -5.864 -1.964 4.020 1.00 43.50 C ATOM 1233 O GLY A 86 -5.315 -1.312 3.131 1.00 65.13 O ATOM 0 H GLY A 86 -3.892 -4.250 3.184 1.00 53.20 H new ATOM 0 HA2 GLY A 86 -6.216 -3.933 4.800 1.00 12.25 H new ATOM 0 HA3 GLY A 86 -4.602 -3.320 5.105 1.00 12.25 H new ATOM 1237 N ILE A 87 -6.880 -1.492 4.731 1.00 50.44 N ATOM 1238 CA ILE A 87 -7.451 -0.165 4.479 1.00 14.14 C ATOM 1239 C ILE A 87 -7.466 0.681 5.757 1.00 14.22 C ATOM 1240 O ILE A 87 -8.055 0.288 6.766 1.00 1.31 O ATOM 1241 CB ILE A 87 -8.901 -0.265 3.927 1.00 2.35 C ATOM 1242 CG1 ILE A 87 -8.936 -1.079 2.618 1.00 45.11 C ATOM 1243 CG2 ILE A 87 -9.499 1.127 3.714 1.00 64.15 C ATOM 1244 CD1 ILE A 87 -8.118 -0.480 1.492 1.00 21.53 C ATOM 0 H ILE A 87 -7.330 -2.005 5.489 1.00 50.44 H new ATOM 0 HA ILE A 87 -6.817 0.314 3.733 1.00 14.14 H new ATOM 0 HB ILE A 87 -9.508 -0.787 4.667 1.00 2.35 H new ATOM 0 HG12 ILE A 87 -8.572 -2.087 2.820 1.00 45.11 H new ATOM 0 HG13 ILE A 87 -9.971 -1.174 2.290 1.00 45.11 H new ATOM 0 HG21 ILE A 87 -10.514 1.032 3.327 1.00 64.15 H new ATOM 0 HG22 ILE A 87 -9.521 1.663 4.663 1.00 64.15 H new ATOM 0 HG23 ILE A 87 -8.889 1.680 3.000 1.00 64.15 H new ATOM 0 HD11 ILE A 87 -8.196 -1.113 0.608 1.00 21.53 H new ATOM 0 HD12 ILE A 87 -8.494 0.516 1.259 1.00 21.53 H new ATOM 0 HD13 ILE A 87 -7.074 -0.411 1.797 1.00 21.53 H new ATOM 1256 N PHE A 88 -6.813 1.836 5.711 1.00 74.41 N ATOM 1257 CA PHE A 88 -6.837 2.783 6.830 1.00 64.14 C ATOM 1258 C PHE A 88 -7.428 4.128 6.381 1.00 53.13 C ATOM 1259 O PHE A 88 -6.986 4.717 5.392 1.00 64.22 O ATOM 1260 CB PHE A 88 -5.426 2.972 7.418 1.00 54.14 C ATOM 1261 CG PHE A 88 -4.419 3.567 6.462 1.00 60.22 C ATOM 1262 CD1 PHE A 88 -3.810 2.784 5.494 1.00 4.24 C ATOM 1263 CD2 PHE A 88 -4.081 4.911 6.534 1.00 55.24 C ATOM 1264 CE1 PHE A 88 -2.888 3.327 4.619 1.00 55.05 C ATOM 1265 CE2 PHE A 88 -3.160 5.456 5.662 1.00 70.42 C ATOM 1266 CZ PHE A 88 -2.562 4.663 4.705 1.00 75.03 C ATOM 0 H PHE A 88 -6.259 2.144 4.912 1.00 74.41 H new ATOM 0 HA PHE A 88 -7.474 2.373 7.614 1.00 64.14 H new ATOM 0 HB2 PHE A 88 -5.496 3.614 8.296 1.00 54.14 H new ATOM 0 HB3 PHE A 88 -5.056 2.005 7.758 1.00 54.14 H new ATOM 0 HD1 PHE A 88 -4.059 1.736 5.422 1.00 4.24 H new ATOM 0 HD2 PHE A 88 -4.544 5.538 7.281 1.00 55.24 H new ATOM 0 HE1 PHE A 88 -2.423 2.705 3.869 1.00 55.05 H new ATOM 0 HE2 PHE A 88 -2.908 6.504 5.729 1.00 70.42 H new ATOM 0 HZ PHE A 88 -1.840 5.088 4.024 1.00 75.03 H new ATOM 1276 N GLU A 89 -8.442 4.598 7.101 1.00 63.31 N ATOM 1277 CA GLU A 89 -9.127 5.844 6.743 1.00 33.34 C ATOM 1278 C GLU A 89 -8.209 7.070 6.896 1.00 34.31 C ATOM 1279 O GLU A 89 -7.525 7.231 7.909 1.00 44.32 O ATOM 1280 CB GLU A 89 -10.395 6.020 7.594 1.00 23.43 C ATOM 1281 CG GLU A 89 -11.159 7.313 7.308 1.00 31.34 C ATOM 1282 CD GLU A 89 -11.643 7.425 5.864 1.00 74.55 C ATOM 1283 OE1 GLU A 89 -10.805 7.661 4.961 1.00 24.42 O ATOM 1284 OE2 GLU A 89 -12.866 7.309 5.637 1.00 64.24 O ATOM 0 H GLU A 89 -8.810 4.139 7.934 1.00 63.31 H new ATOM 0 HA GLU A 89 -9.407 5.772 5.692 1.00 33.34 H new ATOM 0 HB2 GLU A 89 -11.058 5.172 7.420 1.00 23.43 H new ATOM 0 HB3 GLU A 89 -10.119 5.998 8.648 1.00 23.43 H new ATOM 0 HG2 GLU A 89 -12.017 7.375 7.977 1.00 31.34 H new ATOM 0 HG3 GLU A 89 -10.516 8.164 7.535 1.00 31.34 H new ATOM 1291 N THR A 90 -8.208 7.931 5.881 1.00 53.15 N ATOM 1292 CA THR A 90 -7.369 9.144 5.864 1.00 63.45 C ATOM 1293 C THR A 90 -7.954 10.220 4.928 1.00 4.33 C ATOM 1294 O THR A 90 -7.672 11.409 5.081 1.00 3.01 O ATOM 1295 CB THR A 90 -5.906 8.830 5.419 1.00 21.44 C ATOM 1296 OG1 THR A 90 -5.267 7.946 6.355 1.00 3.00 O ATOM 1297 CG2 THR A 90 -5.066 10.102 5.292 1.00 53.03 C ATOM 0 H THR A 90 -8.783 7.815 5.047 1.00 53.15 H new ATOM 0 HA THR A 90 -7.356 9.522 6.886 1.00 63.45 H new ATOM 0 HB THR A 90 -5.971 8.352 4.442 1.00 21.44 H new ATOM 0 HG1 THR A 90 -4.805 7.232 5.868 1.00 3.00 H new ATOM 0 HG21 THR A 90 -4.055 9.841 4.980 1.00 53.03 H new ATOM 0 HG22 THR A 90 -5.515 10.762 4.550 1.00 53.03 H new ATOM 0 HG23 THR A 90 -5.029 10.611 6.255 1.00 53.03 H new ATOM 1305 N GLY A 91 -8.777 9.803 3.964 1.00 15.22 N ATOM 1306 CA GLY A 91 -9.320 10.740 2.978 1.00 50.43 C ATOM 1307 C GLY A 91 -8.314 11.118 1.891 1.00 53.23 C ATOM 1308 O GLY A 91 -8.553 10.891 0.704 1.00 0.23 O ATOM 0 H GLY A 91 -9.079 8.836 3.845 1.00 15.22 H new ATOM 0 HA2 GLY A 91 -10.200 10.297 2.512 1.00 50.43 H new ATOM 0 HA3 GLY A 91 -9.651 11.644 3.489 1.00 50.43 H new ATOM 1312 N GLY A 92 -7.193 11.706 2.294 1.00 3.12 N ATOM 1313 CA GLY A 92 -6.140 12.057 1.346 1.00 62.33 C ATOM 1314 C GLY A 92 -6.261 13.477 0.798 1.00 53.10 C ATOM 1315 O GLY A 92 -5.521 14.370 1.209 1.00 43.23 O ATOM 0 H GLY A 92 -6.990 11.949 3.264 1.00 3.12 H new ATOM 0 HA2 GLY A 92 -5.172 11.946 1.834 1.00 62.33 H new ATOM 0 HA3 GLY A 92 -6.161 11.352 0.515 1.00 62.33 H new ATOM 1319 N GLY A 93 -7.188 13.687 -0.138 1.00 62.04 N ATOM 1320 CA GLY A 93 -7.354 15.008 -0.738 1.00 43.31 C ATOM 1321 C GLY A 93 -8.351 15.029 -1.894 1.00 54.33 C ATOM 1322 O GLY A 93 -9.406 15.660 -1.799 1.00 12.23 O ATOM 0 H GLY A 93 -7.824 12.972 -0.491 1.00 62.04 H new ATOM 0 HA2 GLY A 93 -7.684 15.708 0.029 1.00 43.31 H new ATOM 0 HA3 GLY A 93 -6.387 15.360 -1.096 1.00 43.31 H new ATOM 1326 N ASP A 94 -8.024 14.341 -2.991 1.00 32.52 N ATOM 1327 CA ASP A 94 -8.908 14.302 -4.163 1.00 11.01 C ATOM 1328 C ASP A 94 -9.898 13.132 -4.050 1.00 12.34 C ATOM 1329 O ASP A 94 -9.517 11.961 -4.125 1.00 23.41 O ATOM 1330 CB ASP A 94 -8.089 14.192 -5.457 1.00 62.45 C ATOM 1331 CG ASP A 94 -8.865 14.674 -6.678 1.00 23.03 C ATOM 1332 OD1 ASP A 94 -9.863 14.028 -7.056 1.00 52.22 O ATOM 1333 OD2 ASP A 94 -8.492 15.720 -7.250 1.00 2.01 O ATOM 0 H ASP A 94 -7.161 13.807 -3.094 1.00 32.52 H new ATOM 0 HA ASP A 94 -9.475 15.232 -4.196 1.00 11.01 H new ATOM 0 HB2 ASP A 94 -7.175 14.777 -5.356 1.00 62.45 H new ATOM 0 HB3 ASP A 94 -7.789 13.155 -5.607 1.00 62.45 H new ATOM 1338 N ASP A 95 -11.171 13.466 -3.875 1.00 11.23 N ATOM 1339 CA ASP A 95 -12.215 12.477 -3.591 1.00 42.23 C ATOM 1340 C ASP A 95 -12.907 11.958 -4.869 1.00 11.20 C ATOM 1341 O ASP A 95 -13.969 11.334 -4.798 1.00 73.12 O ATOM 1342 CB ASP A 95 -13.246 13.110 -2.646 1.00 61.14 C ATOM 1343 CG ASP A 95 -13.894 14.352 -3.241 1.00 75.52 C ATOM 1344 OD1 ASP A 95 -13.196 15.382 -3.397 1.00 34.33 O ATOM 1345 OD2 ASP A 95 -15.096 14.303 -3.575 1.00 44.04 O ATOM 0 H ASP A 95 -11.512 14.426 -3.925 1.00 11.23 H new ATOM 0 HA ASP A 95 -11.745 11.612 -3.123 1.00 42.23 H new ATOM 0 HB2 ASP A 95 -14.018 12.377 -2.412 1.00 61.14 H new ATOM 0 HB3 ASP A 95 -12.760 13.372 -1.706 1.00 61.14 H new ATOM 1350 N GLU A 96 -12.308 12.200 -6.033 1.00 40.22 N ATOM 1351 CA GLU A 96 -12.907 11.778 -7.311 1.00 45.43 C ATOM 1352 C GLU A 96 -12.455 10.366 -7.765 1.00 60.55 C ATOM 1353 O GLU A 96 -13.301 9.523 -8.082 1.00 4.42 O ATOM 1354 CB GLU A 96 -12.605 12.811 -8.406 1.00 13.14 C ATOM 1355 CG GLU A 96 -13.167 12.440 -9.776 1.00 42.44 C ATOM 1356 CD GLU A 96 -12.869 13.489 -10.833 1.00 64.03 C ATOM 1357 OE1 GLU A 96 -11.704 13.577 -11.274 1.00 2.12 O ATOM 1358 OE2 GLU A 96 -13.801 14.221 -11.233 1.00 5.00 O ATOM 0 H GLU A 96 -11.414 12.682 -6.125 1.00 40.22 H new ATOM 0 HA GLU A 96 -13.983 11.720 -7.145 1.00 45.43 H new ATOM 0 HB2 GLU A 96 -13.014 13.775 -8.105 1.00 13.14 H new ATOM 0 HB3 GLU A 96 -11.525 12.934 -8.488 1.00 13.14 H new ATOM 0 HG2 GLU A 96 -12.748 11.484 -10.090 1.00 42.44 H new ATOM 0 HG3 GLU A 96 -14.246 12.305 -9.698 1.00 42.44 H new ATOM 1365 N PRO A 97 -11.131 10.063 -7.797 1.00 33.24 N ATOM 1366 CA PRO A 97 -10.629 8.780 -8.339 1.00 3.52 C ATOM 1367 C PRO A 97 -10.948 7.566 -7.446 1.00 42.21 C ATOM 1368 O PRO A 97 -10.636 6.428 -7.796 1.00 25.21 O ATOM 1369 CB PRO A 97 -9.112 9.010 -8.426 1.00 34.13 C ATOM 1370 CG PRO A 97 -8.828 10.001 -7.348 1.00 62.31 C ATOM 1371 CD PRO A 97 -10.024 10.916 -7.309 1.00 3.34 C ATOM 0 HA PRO A 97 -11.101 8.536 -9.291 1.00 3.52 H new ATOM 0 HB2 PRO A 97 -8.559 8.083 -8.270 1.00 34.13 H new ATOM 0 HB3 PRO A 97 -8.823 9.393 -9.405 1.00 34.13 H new ATOM 0 HG2 PRO A 97 -8.683 9.505 -6.388 1.00 62.31 H new ATOM 0 HG3 PRO A 97 -7.915 10.558 -7.559 1.00 62.31 H new ATOM 0 HD2 PRO A 97 -10.215 11.283 -6.301 1.00 3.34 H new ATOM 0 HD3 PRO A 97 -9.881 11.790 -7.945 1.00 3.34 H new ATOM 1379 N ILE A 98 -11.576 7.811 -6.299 1.00 25.41 N ATOM 1380 CA ILE A 98 -11.953 6.734 -5.373 1.00 13.10 C ATOM 1381 C ILE A 98 -13.126 5.894 -5.919 1.00 10.54 C ATOM 1382 O ILE A 98 -13.265 4.713 -5.590 1.00 1.24 O ATOM 1383 CB ILE A 98 -12.337 7.306 -3.981 1.00 1.44 C ATOM 1384 CG1 ILE A 98 -12.634 6.170 -2.983 1.00 71.24 C ATOM 1385 CG2 ILE A 98 -13.531 8.255 -4.099 1.00 61.02 C ATOM 1386 CD1 ILE A 98 -13.024 6.649 -1.601 1.00 53.44 C ATOM 0 H ILE A 98 -11.837 8.745 -5.984 1.00 25.41 H new ATOM 0 HA ILE A 98 -11.081 6.088 -5.271 1.00 13.10 H new ATOM 0 HB ILE A 98 -11.488 7.873 -3.600 1.00 1.44 H new ATOM 0 HG12 ILE A 98 -13.438 5.551 -3.382 1.00 71.24 H new ATOM 0 HG13 ILE A 98 -11.753 5.534 -2.900 1.00 71.24 H new ATOM 0 HG21 ILE A 98 -13.785 8.645 -3.113 1.00 61.02 H new ATOM 0 HG22 ILE A 98 -13.275 9.082 -4.761 1.00 61.02 H new ATOM 0 HG23 ILE A 98 -14.386 7.715 -4.506 1.00 61.02 H new ATOM 0 HD11 ILE A 98 -13.216 5.790 -0.959 1.00 53.44 H new ATOM 0 HD12 ILE A 98 -12.213 7.243 -1.179 1.00 53.44 H new ATOM 0 HD13 ILE A 98 -13.924 7.260 -1.668 1.00 53.44 H new ATOM 1398 N ASP A 99 -13.952 6.503 -6.775 1.00 34.32 N ATOM 1399 CA ASP A 99 -15.156 5.849 -7.312 1.00 0.34 C ATOM 1400 C ASP A 99 -14.849 4.490 -7.998 1.00 34.44 C ATOM 1401 O ASP A 99 -15.456 3.475 -7.647 1.00 51.24 O ATOM 1402 CB ASP A 99 -15.881 6.812 -8.267 1.00 61.43 C ATOM 1403 CG ASP A 99 -17.107 6.195 -8.915 1.00 43.43 C ATOM 1404 OD1 ASP A 99 -17.946 5.624 -8.189 1.00 14.54 O ATOM 1405 OD2 ASP A 99 -17.249 6.296 -10.153 1.00 3.24 O ATOM 0 H ASP A 99 -13.810 7.454 -7.115 1.00 34.32 H new ATOM 0 HA ASP A 99 -15.811 5.614 -6.473 1.00 0.34 H new ATOM 0 HB2 ASP A 99 -16.178 7.705 -7.717 1.00 61.43 H new ATOM 0 HB3 ASP A 99 -15.188 7.133 -9.045 1.00 61.43 H new ATOM 1410 N PRO A 100 -13.914 4.426 -8.979 1.00 4.45 N ATOM 1411 CA PRO A 100 -13.531 3.143 -9.603 1.00 13.03 C ATOM 1412 C PRO A 100 -12.787 2.211 -8.625 1.00 54.15 C ATOM 1413 O PRO A 100 -12.875 0.983 -8.728 1.00 65.20 O ATOM 1414 CB PRO A 100 -12.611 3.567 -10.760 1.00 2.22 C ATOM 1415 CG PRO A 100 -12.076 4.899 -10.354 1.00 52.35 C ATOM 1416 CD PRO A 100 -13.178 5.565 -9.571 1.00 72.35 C ATOM 0 HA PRO A 100 -14.401 2.571 -9.925 1.00 13.03 H new ATOM 0 HB2 PRO A 100 -11.807 2.847 -10.910 1.00 2.22 H new ATOM 0 HB3 PRO A 100 -13.161 3.631 -11.699 1.00 2.22 H new ATOM 0 HG2 PRO A 100 -11.177 4.791 -9.748 1.00 52.35 H new ATOM 0 HG3 PRO A 100 -11.803 5.493 -11.226 1.00 52.35 H new ATOM 0 HD2 PRO A 100 -12.781 6.229 -8.804 1.00 72.35 H new ATOM 0 HD3 PRO A 100 -13.820 6.168 -10.213 1.00 72.35 H new ATOM 1424 N LEU A 101 -12.074 2.810 -7.667 1.00 34.20 N ATOM 1425 CA LEU A 101 -11.296 2.056 -6.673 1.00 11.53 C ATOM 1426 C LEU A 101 -12.206 1.162 -5.813 1.00 41.40 C ATOM 1427 O LEU A 101 -11.937 -0.026 -5.632 1.00 64.31 O ATOM 1428 CB LEU A 101 -10.487 3.042 -5.796 1.00 12.11 C ATOM 1429 CG LEU A 101 -9.474 2.422 -4.800 1.00 72.15 C ATOM 1430 CD1 LEU A 101 -8.410 3.450 -4.411 1.00 64.13 C ATOM 1431 CD2 LEU A 101 -10.171 1.899 -3.540 1.00 64.52 C ATOM 0 H LEU A 101 -12.018 3.822 -7.557 1.00 34.20 H new ATOM 0 HA LEU A 101 -10.602 1.396 -7.194 1.00 11.53 H new ATOM 0 HB2 LEU A 101 -9.944 3.717 -6.457 1.00 12.11 H new ATOM 0 HB3 LEU A 101 -11.192 3.650 -5.229 1.00 12.11 H new ATOM 0 HG LEU A 101 -8.998 1.579 -5.301 1.00 72.15 H new ATOM 0 HD11 LEU A 101 -7.707 2.999 -3.711 1.00 64.13 H new ATOM 0 HD12 LEU A 101 -7.876 3.776 -5.303 1.00 64.13 H new ATOM 0 HD13 LEU A 101 -8.889 4.309 -3.941 1.00 64.13 H new ATOM 0 HD21 LEU A 101 -9.430 1.472 -2.865 1.00 64.52 H new ATOM 0 HD22 LEU A 101 -10.685 2.720 -3.041 1.00 64.52 H new ATOM 0 HD23 LEU A 101 -10.895 1.132 -3.816 1.00 64.52 H new ATOM 1443 N LEU A 102 -13.286 1.743 -5.297 1.00 10.33 N ATOM 1444 CA LEU A 102 -14.226 1.017 -4.431 1.00 71.11 C ATOM 1445 C LEU A 102 -14.878 -0.181 -5.146 1.00 70.25 C ATOM 1446 O LEU A 102 -15.349 -1.120 -4.500 1.00 74.25 O ATOM 1447 CB LEU A 102 -15.321 1.971 -3.924 1.00 74.11 C ATOM 1448 CG LEU A 102 -14.830 3.141 -3.055 1.00 74.21 C ATOM 1449 CD1 LEU A 102 -15.995 4.049 -2.661 1.00 72.30 C ATOM 1450 CD2 LEU A 102 -14.100 2.625 -1.814 1.00 32.42 C ATOM 0 H LEU A 102 -13.537 2.718 -5.461 1.00 10.33 H new ATOM 0 HA LEU A 102 -13.651 0.627 -3.591 1.00 71.11 H new ATOM 0 HB2 LEU A 102 -15.851 2.378 -4.785 1.00 74.11 H new ATOM 0 HB3 LEU A 102 -16.044 1.393 -3.349 1.00 74.11 H new ATOM 0 HG LEU A 102 -14.125 3.729 -3.643 1.00 74.21 H new ATOM 0 HD11 LEU A 102 -15.625 4.870 -2.047 1.00 72.30 H new ATOM 0 HD12 LEU A 102 -16.463 4.451 -3.560 1.00 72.30 H new ATOM 0 HD13 LEU A 102 -16.729 3.475 -2.095 1.00 72.30 H new ATOM 0 HD21 LEU A 102 -13.761 3.469 -1.214 1.00 32.42 H new ATOM 0 HD22 LEU A 102 -14.778 2.008 -1.223 1.00 32.42 H new ATOM 0 HD23 LEU A 102 -13.240 2.029 -2.119 1.00 32.42 H new ATOM 1462 N SER A 103 -14.919 -0.139 -6.476 1.00 65.34 N ATOM 1463 CA SER A 103 -15.585 -1.187 -7.267 1.00 2.22 C ATOM 1464 C SER A 103 -14.602 -2.203 -7.871 1.00 44.14 C ATOM 1465 O SER A 103 -14.516 -3.344 -7.416 1.00 42.03 O ATOM 1466 CB SER A 103 -16.416 -0.556 -8.392 1.00 42.53 C ATOM 1467 OG SER A 103 -17.036 -1.552 -9.192 1.00 74.15 O ATOM 0 H SER A 103 -14.501 0.606 -7.034 1.00 65.34 H new ATOM 0 HA SER A 103 -16.231 -1.729 -6.576 1.00 2.22 H new ATOM 0 HB2 SER A 103 -17.177 0.096 -7.964 1.00 42.53 H new ATOM 0 HB3 SER A 103 -15.775 0.068 -9.015 1.00 42.53 H new ATOM 0 HG SER A 103 -17.561 -1.123 -9.900 1.00 74.15 H new ATOM 1473 N LYS A 104 -13.841 -1.768 -8.877 1.00 51.33 N ATOM 1474 CA LYS A 104 -13.065 -2.681 -9.735 1.00 2.31 C ATOM 1475 C LYS A 104 -12.123 -3.615 -8.948 1.00 1.45 C ATOM 1476 O LYS A 104 -12.019 -4.802 -9.258 1.00 0.42 O ATOM 1477 CB LYS A 104 -12.263 -1.876 -10.772 1.00 1.35 C ATOM 1478 CG LYS A 104 -11.622 -2.736 -11.859 1.00 52.44 C ATOM 1479 CD LYS A 104 -12.665 -3.556 -12.619 1.00 5.42 C ATOM 1480 CE LYS A 104 -12.038 -4.409 -13.716 1.00 24.34 C ATOM 1481 NZ LYS A 104 -11.383 -3.579 -14.760 1.00 32.45 N ATOM 0 H LYS A 104 -13.742 -0.783 -9.123 1.00 51.33 H new ATOM 0 HA LYS A 104 -13.789 -3.324 -10.235 1.00 2.31 H new ATOM 0 HB2 LYS A 104 -12.923 -1.146 -11.241 1.00 1.35 H new ATOM 0 HB3 LYS A 104 -11.482 -1.315 -10.258 1.00 1.35 H new ATOM 0 HG2 LYS A 104 -11.082 -2.097 -12.558 1.00 52.44 H new ATOM 0 HG3 LYS A 104 -10.890 -3.406 -11.408 1.00 52.44 H new ATOM 0 HD2 LYS A 104 -13.198 -4.200 -11.920 1.00 5.42 H new ATOM 0 HD3 LYS A 104 -13.402 -2.885 -13.060 1.00 5.42 H new ATOM 0 HE2 LYS A 104 -11.304 -5.084 -13.276 1.00 24.34 H new ATOM 0 HE3 LYS A 104 -12.806 -5.030 -14.176 1.00 24.34 H new ATOM 0 HZ1 LYS A 104 -11.135 -4.177 -15.574 1.00 32.45 H new ATOM 0 HZ2 LYS A 104 -12.035 -2.829 -15.067 1.00 32.45 H new ATOM 0 HZ3 LYS A 104 -10.520 -3.149 -14.371 1.00 32.45 H new ATOM 1495 N PHE A 105 -11.451 -3.087 -7.927 1.00 41.42 N ATOM 1496 CA PHE A 105 -10.492 -3.882 -7.141 1.00 31.13 C ATOM 1497 C PHE A 105 -11.157 -5.105 -6.483 1.00 71.20 C ATOM 1498 O PHE A 105 -10.501 -6.121 -6.232 1.00 14.43 O ATOM 1499 CB PHE A 105 -9.808 -2.998 -6.093 1.00 34.31 C ATOM 1500 CG PHE A 105 -8.856 -1.989 -6.695 1.00 10.43 C ATOM 1501 CD1 PHE A 105 -9.328 -0.812 -7.259 1.00 72.33 C ATOM 1502 CD2 PHE A 105 -7.488 -2.221 -6.700 1.00 32.32 C ATOM 1503 CE1 PHE A 105 -8.457 0.109 -7.811 1.00 20.23 C ATOM 1504 CE2 PHE A 105 -6.614 -1.304 -7.250 1.00 23.21 C ATOM 1505 CZ PHE A 105 -7.099 -0.137 -7.806 1.00 53.32 C ATOM 0 H PHE A 105 -11.547 -2.119 -7.621 1.00 41.42 H new ATOM 0 HA PHE A 105 -9.736 -4.265 -7.827 1.00 31.13 H new ATOM 0 HB2 PHE A 105 -10.570 -2.471 -5.518 1.00 34.31 H new ATOM 0 HB3 PHE A 105 -9.262 -3.631 -5.394 1.00 34.31 H new ATOM 0 HD1 PHE A 105 -10.389 -0.613 -7.267 1.00 72.33 H new ATOM 0 HD2 PHE A 105 -7.101 -3.132 -6.268 1.00 32.32 H new ATOM 0 HE1 PHE A 105 -8.839 1.021 -8.246 1.00 20.23 H new ATOM 0 HE2 PHE A 105 -5.552 -1.500 -7.245 1.00 23.21 H new ATOM 0 HZ PHE A 105 -6.417 0.582 -8.236 1.00 53.32 H new ATOM 1515 N ARG A 106 -12.461 -5.016 -6.224 1.00 71.21 N ATOM 1516 CA ARG A 106 -13.220 -6.158 -5.702 1.00 23.05 C ATOM 1517 C ARG A 106 -13.386 -7.243 -6.783 1.00 3.44 C ATOM 1518 O ARG A 106 -13.391 -8.442 -6.488 1.00 61.32 O ATOM 1519 CB ARG A 106 -14.599 -5.703 -5.195 1.00 51.13 C ATOM 1520 CG ARG A 106 -14.536 -4.731 -4.017 1.00 20.21 C ATOM 1521 CD ARG A 106 -15.928 -4.353 -3.514 1.00 22.14 C ATOM 1522 NE ARG A 106 -16.693 -3.608 -4.515 1.00 12.41 N ATOM 1523 CZ ARG A 106 -17.808 -4.029 -5.053 1.00 24.20 C ATOM 1524 NH1 ARG A 106 -18.306 -5.177 -4.722 1.00 11.53 N ATOM 1525 NH2 ARG A 106 -18.430 -3.295 -5.917 1.00 75.44 N ATOM 0 H ARG A 106 -13.014 -4.171 -6.365 1.00 71.21 H new ATOM 0 HA ARG A 106 -12.662 -6.582 -4.867 1.00 23.05 H new ATOM 0 HB2 ARG A 106 -15.139 -5.230 -6.015 1.00 51.13 H new ATOM 0 HB3 ARG A 106 -15.174 -6.580 -4.899 1.00 51.13 H new ATOM 0 HG2 ARG A 106 -13.967 -5.182 -3.204 1.00 20.21 H new ATOM 0 HG3 ARG A 106 -14.002 -3.830 -4.318 1.00 20.21 H new ATOM 0 HD2 ARG A 106 -16.472 -5.257 -3.242 1.00 22.14 H new ATOM 0 HD3 ARG A 106 -15.835 -3.753 -2.609 1.00 22.14 H new ATOM 0 HE ARG A 106 -16.333 -2.701 -4.812 1.00 12.41 H new ATOM 0 HH11 ARG A 106 -17.828 -5.762 -4.036 1.00 11.53 H new ATOM 0 HH12 ARG A 106 -19.176 -5.497 -5.147 1.00 11.53 H new ATOM 0 HH21 ARG A 106 -18.051 -2.385 -6.180 1.00 75.44 H new ATOM 0 HH22 ARG A 106 -19.300 -3.626 -6.335 1.00 75.44 H new ATOM 1539 N ASN A 107 -13.515 -6.807 -8.038 1.00 31.54 N ATOM 1540 CA ASN A 107 -13.638 -7.724 -9.182 1.00 3.44 C ATOM 1541 C ASN A 107 -12.317 -8.468 -9.449 1.00 32.12 C ATOM 1542 O ASN A 107 -12.318 -9.624 -9.883 1.00 53.51 O ATOM 1543 CB ASN A 107 -14.065 -6.961 -10.444 1.00 31.52 C ATOM 1544 CG ASN A 107 -15.359 -6.188 -10.261 1.00 62.35 C ATOM 1545 OD1 ASN A 107 -15.658 -5.686 -9.184 1.00 43.10 O ATOM 1546 ND2 ASN A 107 -16.142 -6.086 -11.315 1.00 72.35 N ATOM 0 H ASN A 107 -13.537 -5.819 -8.292 1.00 31.54 H new ATOM 0 HA ASN A 107 -14.403 -8.458 -8.931 1.00 3.44 H new ATOM 0 HB2 ASN A 107 -13.272 -6.269 -10.729 1.00 31.52 H new ATOM 0 HB3 ASN A 107 -14.183 -7.667 -11.266 1.00 31.52 H new ATOM 0 HD21 ASN A 107 -17.024 -5.578 -11.248 1.00 72.35 H new ATOM 0 HD22 ASN A 107 -15.866 -6.515 -12.199 1.00 72.35 H new ATOM 1553 N LEU A 108 -11.191 -7.793 -9.205 1.00 54.22 N ATOM 1554 CA LEU A 108 -9.865 -8.415 -9.348 1.00 42.42 C ATOM 1555 C LEU A 108 -9.646 -9.516 -8.296 1.00 62.11 C ATOM 1556 O LEU A 108 -8.993 -10.525 -8.564 1.00 44.31 O ATOM 1557 CB LEU A 108 -8.748 -7.359 -9.240 1.00 54.05 C ATOM 1558 CG LEU A 108 -8.454 -6.552 -10.519 1.00 21.00 C ATOM 1559 CD1 LEU A 108 -9.687 -5.796 -11.000 1.00 23.22 C ATOM 1560 CD2 LEU A 108 -7.286 -5.592 -10.289 1.00 43.01 C ATOM 0 H LEU A 108 -11.167 -6.818 -8.908 1.00 54.22 H new ATOM 0 HA LEU A 108 -9.826 -8.871 -10.337 1.00 42.42 H new ATOM 0 HB2 LEU A 108 -9.012 -6.660 -8.446 1.00 54.05 H new ATOM 0 HB3 LEU A 108 -7.830 -7.860 -8.932 1.00 54.05 H new ATOM 0 HG LEU A 108 -8.176 -7.258 -11.302 1.00 21.00 H new ATOM 0 HD11 LEU A 108 -9.442 -5.238 -11.904 1.00 23.22 H new ATOM 0 HD12 LEU A 108 -10.487 -6.504 -11.216 1.00 23.22 H new ATOM 0 HD13 LEU A 108 -10.015 -5.104 -10.224 1.00 23.22 H new ATOM 0 HD21 LEU A 108 -7.092 -5.030 -11.202 1.00 43.01 H new ATOM 0 HD22 LEU A 108 -7.536 -4.901 -9.484 1.00 43.01 H new ATOM 0 HD23 LEU A 108 -6.396 -6.160 -10.016 1.00 43.01 H new ATOM 1572 N GLY A 109 -10.195 -9.310 -7.100 1.00 21.40 N ATOM 1573 CA GLY A 109 -10.102 -10.317 -6.043 1.00 21.54 C ATOM 1574 C GLY A 109 -9.213 -9.907 -4.872 1.00 61.24 C ATOM 1575 O GLY A 109 -8.676 -10.758 -4.166 1.00 64.32 O ATOM 0 H GLY A 109 -10.704 -8.465 -6.840 1.00 21.40 H new ATOM 0 HA2 GLY A 109 -11.103 -10.530 -5.669 1.00 21.54 H new ATOM 0 HA3 GLY A 109 -9.718 -11.243 -6.470 1.00 21.54 H new ATOM 1579 N LEU A 110 -9.059 -8.603 -4.653 1.00 42.05 N ATOM 1580 CA LEU A 110 -8.255 -8.109 -3.528 1.00 35.42 C ATOM 1581 C LEU A 110 -9.000 -8.282 -2.196 1.00 62.23 C ATOM 1582 O LEU A 110 -10.113 -7.780 -2.030 1.00 10.43 O ATOM 1583 CB LEU A 110 -7.885 -6.630 -3.719 1.00 12.22 C ATOM 1584 CG LEU A 110 -6.785 -6.341 -4.757 1.00 64.35 C ATOM 1585 CD1 LEU A 110 -7.224 -6.742 -6.162 1.00 52.31 C ATOM 1586 CD2 LEU A 110 -6.386 -4.869 -4.706 1.00 11.43 C ATOM 0 H LEU A 110 -9.474 -7.872 -5.231 1.00 42.05 H new ATOM 0 HA LEU A 110 -7.341 -8.702 -3.501 1.00 35.42 H new ATOM 0 HB2 LEU A 110 -8.783 -6.085 -4.009 1.00 12.22 H new ATOM 0 HB3 LEU A 110 -7.565 -6.228 -2.758 1.00 12.22 H new ATOM 0 HG LEU A 110 -5.914 -6.946 -4.506 1.00 64.35 H new ATOM 0 HD11 LEU A 110 -6.424 -6.524 -6.869 1.00 52.31 H new ATOM 0 HD12 LEU A 110 -7.447 -7.809 -6.183 1.00 52.31 H new ATOM 0 HD13 LEU A 110 -8.116 -6.180 -6.439 1.00 52.31 H new ATOM 0 HD21 LEU A 110 -5.608 -4.677 -5.444 1.00 11.43 H new ATOM 0 HD22 LEU A 110 -7.255 -4.249 -4.925 1.00 11.43 H new ATOM 0 HD23 LEU A 110 -6.010 -4.628 -3.712 1.00 11.43 H new ATOM 1598 N THR A 111 -8.386 -8.996 -1.255 1.00 14.04 N ATOM 1599 CA THR A 111 -8.984 -9.207 0.072 1.00 30.21 C ATOM 1600 C THR A 111 -8.888 -7.931 0.920 1.00 45.33 C ATOM 1601 O THR A 111 -7.873 -7.679 1.571 1.00 13.05 O ATOM 1602 CB THR A 111 -8.303 -10.379 0.828 1.00 53.45 C ATOM 1603 OG1 THR A 111 -8.312 -11.563 0.015 1.00 22.13 O ATOM 1604 CG2 THR A 111 -9.002 -10.671 2.154 1.00 55.53 C ATOM 0 H THR A 111 -7.476 -9.440 -1.381 1.00 14.04 H new ATOM 0 HA THR A 111 -10.032 -9.460 -0.086 1.00 30.21 H new ATOM 0 HB THR A 111 -7.275 -10.083 1.038 1.00 53.45 H new ATOM 0 HG1 THR A 111 -7.401 -11.758 -0.289 1.00 22.13 H new ATOM 0 HG21 THR A 111 -8.499 -11.497 2.656 1.00 55.53 H new ATOM 0 HG22 THR A 111 -8.965 -9.785 2.787 1.00 55.53 H new ATOM 0 HG23 THR A 111 -10.041 -10.940 1.966 1.00 55.53 H new ATOM 1612 N THR A 112 -9.943 -7.121 0.895 1.00 14.43 N ATOM 1613 CA THR A 112 -9.947 -5.820 1.580 1.00 23.33 C ATOM 1614 C THR A 112 -10.137 -5.959 3.096 1.00 32.13 C ATOM 1615 O THR A 112 -10.785 -6.893 3.578 1.00 20.13 O ATOM 1616 CB THR A 112 -11.059 -4.887 1.034 1.00 31.32 C ATOM 1617 OG1 THR A 112 -12.356 -5.436 1.318 1.00 11.55 O ATOM 1618 CG2 THR A 112 -10.909 -4.677 -0.470 1.00 2.24 C ATOM 0 H THR A 112 -10.812 -7.339 0.407 1.00 14.43 H new ATOM 0 HA THR A 112 -8.968 -5.383 1.381 1.00 23.33 H new ATOM 0 HB THR A 112 -10.959 -3.922 1.531 1.00 31.32 H new ATOM 0 HG1 THR A 112 -13.048 -4.836 0.970 1.00 11.55 H new ATOM 0 HG21 THR A 112 -11.702 -4.019 -0.826 1.00 2.24 H new ATOM 0 HG22 THR A 112 -9.940 -4.224 -0.679 1.00 2.24 H new ATOM 0 HG23 THR A 112 -10.978 -5.638 -0.980 1.00 2.24 H new ATOM 1626 N ALA A 113 -9.552 -5.029 3.848 1.00 45.30 N ATOM 1627 CA ALA A 113 -9.742 -4.974 5.303 1.00 61.53 C ATOM 1628 C ALA A 113 -11.115 -4.380 5.663 1.00 4.34 C ATOM 1629 O ALA A 113 -11.982 -5.074 6.196 1.00 61.00 O ATOM 1630 CB ALA A 113 -8.624 -4.166 5.955 1.00 40.34 C ATOM 0 H ALA A 113 -8.941 -4.301 3.477 1.00 45.30 H new ATOM 0 HA ALA A 113 -9.707 -5.994 5.686 1.00 61.53 H new ATOM 0 HB1 ALA A 113 -8.779 -4.135 7.033 1.00 40.34 H new ATOM 0 HB2 ALA A 113 -7.664 -4.634 5.740 1.00 40.34 H new ATOM 0 HB3 ALA A 113 -8.629 -3.151 5.558 1.00 40.34 H new ATOM 1636 N PHE A 114 -11.304 -3.091 5.368 1.00 53.12 N ATOM 1637 CA PHE A 114 -12.585 -2.409 5.619 1.00 71.42 C ATOM 1638 C PHE A 114 -12.607 -1.010 4.967 1.00 3.41 C ATOM 1639 O PHE A 114 -12.209 -0.021 5.581 1.00 14.03 O ATOM 1640 CB PHE A 114 -12.852 -2.300 7.133 1.00 32.31 C ATOM 1641 CG PHE A 114 -14.174 -1.651 7.479 1.00 2.10 C ATOM 1642 CD1 PHE A 114 -15.372 -2.287 7.180 1.00 2.31 C ATOM 1643 CD2 PHE A 114 -14.218 -0.409 8.097 1.00 14.43 C ATOM 1644 CE1 PHE A 114 -16.583 -1.699 7.493 1.00 4.21 C ATOM 1645 CE2 PHE A 114 -15.427 0.183 8.411 1.00 22.25 C ATOM 1646 CZ PHE A 114 -16.611 -0.462 8.108 1.00 52.13 C ATOM 0 H PHE A 114 -10.587 -2.494 4.954 1.00 53.12 H new ATOM 0 HA PHE A 114 -13.377 -3.006 5.167 1.00 71.42 H new ATOM 0 HB2 PHE A 114 -12.824 -3.298 7.569 1.00 32.31 H new ATOM 0 HB3 PHE A 114 -12.046 -1.728 7.593 1.00 32.31 H new ATOM 0 HD1 PHE A 114 -15.357 -3.253 6.697 1.00 2.31 H new ATOM 0 HD2 PHE A 114 -13.296 0.101 8.335 1.00 14.43 H new ATOM 0 HE1 PHE A 114 -17.507 -2.206 7.257 1.00 4.21 H new ATOM 0 HE2 PHE A 114 -15.446 1.149 8.893 1.00 22.25 H new ATOM 0 HZ PHE A 114 -17.556 -0.000 8.351 1.00 52.13 H new ATOM 1656 N PRO A 115 -13.042 -0.916 3.696 1.00 62.43 N ATOM 1657 CA PRO A 115 -13.129 0.358 2.978 1.00 12.34 C ATOM 1658 C PRO A 115 -14.497 1.056 3.137 1.00 72.13 C ATOM 1659 O PRO A 115 -15.477 0.690 2.484 1.00 22.25 O ATOM 1660 CB PRO A 115 -12.887 -0.073 1.529 1.00 21.24 C ATOM 1661 CG PRO A 115 -13.449 -1.462 1.436 1.00 61.40 C ATOM 1662 CD PRO A 115 -13.458 -2.043 2.838 1.00 20.20 C ATOM 0 HA PRO A 115 -12.421 1.098 3.352 1.00 12.34 H new ATOM 0 HB2 PRO A 115 -13.382 0.600 0.829 1.00 21.24 H new ATOM 0 HB3 PRO A 115 -11.825 -0.060 1.286 1.00 21.24 H new ATOM 0 HG2 PRO A 115 -14.457 -1.441 1.023 1.00 61.40 H new ATOM 0 HG3 PRO A 115 -12.844 -2.077 0.770 1.00 61.40 H new ATOM 0 HD2 PRO A 115 -14.448 -2.409 3.112 1.00 20.20 H new ATOM 0 HD3 PRO A 115 -12.772 -2.885 2.925 1.00 20.20 H new ATOM 1670 N ALA A 116 -14.559 2.051 4.020 1.00 71.33 N ATOM 1671 CA ALA A 116 -15.790 2.822 4.239 1.00 4.21 C ATOM 1672 C ALA A 116 -15.478 4.299 4.523 1.00 2.24 C ATOM 1673 O ALA A 116 -14.932 4.633 5.576 1.00 33.12 O ATOM 1674 CB ALA A 116 -16.596 2.216 5.385 1.00 40.15 C ATOM 0 H ALA A 116 -13.772 2.346 4.598 1.00 71.33 H new ATOM 0 HA ALA A 116 -16.385 2.776 3.327 1.00 4.21 H new ATOM 0 HB1 ALA A 116 -17.506 2.797 5.537 1.00 40.15 H new ATOM 0 HB2 ALA A 116 -16.859 1.187 5.140 1.00 40.15 H new ATOM 0 HB3 ALA A 116 -15.999 2.231 6.297 1.00 40.15 H new ATOM 1680 N ILE A 117 -15.824 5.176 3.579 1.00 63.51 N ATOM 1681 CA ILE A 117 -15.546 6.617 3.709 1.00 12.10 C ATOM 1682 C ILE A 117 -16.295 7.265 4.893 1.00 1.51 C ATOM 1683 O ILE A 117 -17.454 7.672 4.780 1.00 4.24 O ATOM 1684 CB ILE A 117 -15.838 7.397 2.386 1.00 74.45 C ATOM 1685 CG1 ILE A 117 -16.954 6.727 1.548 1.00 14.25 C ATOM 1686 CG2 ILE A 117 -14.561 7.530 1.558 1.00 52.41 C ATOM 1687 CD1 ILE A 117 -18.331 6.741 2.184 1.00 21.42 C ATOM 0 H ILE A 117 -16.298 4.918 2.713 1.00 63.51 H new ATOM 0 HA ILE A 117 -14.479 6.691 3.917 1.00 12.10 H new ATOM 0 HB ILE A 117 -16.193 8.389 2.664 1.00 74.45 H new ATOM 0 HG12 ILE A 117 -17.012 7.228 0.582 1.00 14.25 H new ATOM 0 HG13 ILE A 117 -16.670 5.692 1.354 1.00 14.25 H new ATOM 0 HG21 ILE A 117 -14.778 8.075 0.639 1.00 52.41 H new ATOM 0 HG22 ILE A 117 -13.810 8.072 2.132 1.00 52.41 H new ATOM 0 HG23 ILE A 117 -14.183 6.538 1.311 1.00 52.41 H new ATOM 0 HD11 ILE A 117 -19.043 6.249 1.521 1.00 21.42 H new ATOM 0 HD12 ILE A 117 -18.297 6.212 3.137 1.00 21.42 H new ATOM 0 HD13 ILE A 117 -18.644 7.772 2.352 1.00 21.42 H new ATOM 1699 N ARG A 118 -15.621 7.345 6.034 1.00 31.15 N ATOM 1700 CA ARG A 118 -16.192 7.958 7.237 1.00 72.33 C ATOM 1701 C ARG A 118 -15.563 9.327 7.539 1.00 41.10 C ATOM 1702 O ARG A 118 -16.096 10.098 8.344 1.00 32.10 O ATOM 1703 CB ARG A 118 -16.004 7.031 8.447 1.00 21.35 C ATOM 1704 CG ARG A 118 -16.763 5.708 8.353 1.00 52.41 C ATOM 1705 CD ARG A 118 -18.262 5.923 8.149 1.00 21.43 C ATOM 1706 NE ARG A 118 -18.798 6.954 9.039 1.00 33.21 N ATOM 1707 CZ ARG A 118 -19.519 6.720 10.100 1.00 25.21 C ATOM 1708 NH1 ARG A 118 -19.804 5.510 10.461 1.00 15.13 N ATOM 1709 NH2 ARG A 118 -19.951 7.708 10.808 1.00 72.54 N ATOM 0 H ARG A 118 -14.672 6.992 6.156 1.00 31.15 H new ATOM 0 HA ARG A 118 -17.255 8.109 7.048 1.00 72.33 H new ATOM 0 HB2 ARG A 118 -14.941 6.819 8.565 1.00 21.35 H new ATOM 0 HB3 ARG A 118 -16.326 7.557 9.346 1.00 21.35 H new ATOM 0 HG2 ARG A 118 -16.365 5.119 7.526 1.00 52.41 H new ATOM 0 HG3 ARG A 118 -16.600 5.131 9.263 1.00 52.41 H new ATOM 0 HD2 ARG A 118 -18.449 6.206 7.113 1.00 21.43 H new ATOM 0 HD3 ARG A 118 -18.789 4.985 8.323 1.00 21.43 H new ATOM 0 HE ARG A 118 -18.592 7.927 8.813 1.00 33.21 H new ATOM 0 HH11 ARG A 118 -19.463 4.720 9.912 1.00 15.13 H new ATOM 0 HH12 ARG A 118 -20.369 5.346 11.294 1.00 15.13 H new ATOM 0 HH21 ARG A 118 -19.728 8.666 10.537 1.00 72.54 H new ATOM 0 HH22 ARG A 118 -20.515 7.532 11.639 1.00 72.54 H new ATOM 1723 N ILE A 119 -14.437 9.630 6.900 1.00 24.10 N ATOM 1724 CA ILE A 119 -13.694 10.864 7.190 1.00 72.13 C ATOM 1725 C ILE A 119 -14.237 12.077 6.411 1.00 23.21 C ATOM 1726 O ILE A 119 -14.870 11.938 5.363 1.00 32.12 O ATOM 1727 CB ILE A 119 -12.183 10.698 6.867 1.00 42.32 C ATOM 1728 CG1 ILE A 119 -11.348 11.772 7.583 1.00 11.11 C ATOM 1729 CG2 ILE A 119 -11.942 10.754 5.357 1.00 45.32 C ATOM 1730 CD1 ILE A 119 -11.466 11.727 9.094 1.00 32.23 C ATOM 0 H ILE A 119 -14.016 9.044 6.179 1.00 24.10 H new ATOM 0 HA ILE A 119 -13.828 11.050 8.256 1.00 72.13 H new ATOM 0 HB ILE A 119 -11.868 9.720 7.231 1.00 42.32 H new ATOM 0 HG12 ILE A 119 -10.301 11.651 7.305 1.00 11.11 H new ATOM 0 HG13 ILE A 119 -11.659 12.756 7.232 1.00 11.11 H new ATOM 0 HG21 ILE A 119 -10.878 10.636 5.154 1.00 45.32 H new ATOM 0 HG22 ILE A 119 -12.496 9.951 4.870 1.00 45.32 H new ATOM 0 HG23 ILE A 119 -12.281 11.715 4.970 1.00 45.32 H new ATOM 0 HD11 ILE A 119 -10.850 12.513 9.531 1.00 32.23 H new ATOM 0 HD12 ILE A 119 -12.506 11.879 9.382 1.00 32.23 H new ATOM 0 HD13 ILE A 119 -11.127 10.757 9.457 1.00 32.23 H new ATOM 1742 N LYS A 120 -13.984 13.270 6.948 1.00 3.13 N ATOM 1743 CA LYS A 120 -14.274 14.525 6.239 1.00 11.41 C ATOM 1744 C LYS A 120 -13.029 14.996 5.462 1.00 43.20 C ATOM 1745 O LYS A 120 -13.134 15.487 4.337 1.00 25.24 O ATOM 1746 CB LYS A 120 -14.759 15.622 7.219 1.00 50.01 C ATOM 1747 CG LYS A 120 -13.706 16.144 8.208 1.00 31.21 C ATOM 1748 CD LYS A 120 -13.282 15.104 9.246 1.00 23.30 C ATOM 1749 CE LYS A 120 -14.442 14.668 10.140 1.00 32.41 C ATOM 1750 NZ LYS A 120 -14.958 15.787 10.968 1.00 44.43 N ATOM 0 H LYS A 120 -13.577 13.398 7.875 1.00 3.13 H new ATOM 0 HA LYS A 120 -15.079 14.338 5.528 1.00 11.41 H new ATOM 0 HB2 LYS A 120 -15.133 16.464 6.637 1.00 50.01 H new ATOM 0 HB3 LYS A 120 -15.602 15.229 7.788 1.00 50.01 H new ATOM 0 HG2 LYS A 120 -12.827 16.472 7.653 1.00 31.21 H new ATOM 0 HG3 LYS A 120 -14.103 17.019 8.722 1.00 31.21 H new ATOM 0 HD2 LYS A 120 -12.872 14.232 8.736 1.00 23.30 H new ATOM 0 HD3 LYS A 120 -12.485 15.516 9.865 1.00 23.30 H new ATOM 0 HE2 LYS A 120 -15.248 14.273 9.521 1.00 32.41 H new ATOM 0 HE3 LYS A 120 -14.113 13.857 10.790 1.00 32.41 H new ATOM 0 HZ1 LYS A 120 -15.636 15.419 11.665 1.00 44.43 H new ATOM 0 HZ2 LYS A 120 -14.167 16.246 11.463 1.00 44.43 H new ATOM 0 HZ3 LYS A 120 -15.433 16.481 10.356 1.00 44.43 H new ATOM 1764 N GLN A 121 -11.857 14.827 6.089 1.00 54.31 N ATOM 1765 CA GLN A 121 -10.550 15.095 5.463 1.00 41.41 C ATOM 1766 C GLN A 121 -9.417 14.870 6.479 1.00 63.40 C ATOM 1767 O GLN A 121 -8.529 14.046 6.265 1.00 0.43 O ATOM 1768 CB GLN A 121 -10.467 16.526 4.909 1.00 14.54 C ATOM 1769 CG GLN A 121 -9.145 16.836 4.208 1.00 3.11 C ATOM 1770 CD GLN A 121 -9.062 18.266 3.698 1.00 14.22 C ATOM 1771 OE1 GLN A 121 -10.070 18.879 3.352 1.00 52.42 O ATOM 1772 NE2 GLN A 121 -7.861 18.810 3.646 1.00 61.45 N ATOM 0 H GLN A 121 -11.786 14.498 7.052 1.00 54.31 H new ATOM 0 HA GLN A 121 -10.439 14.401 4.630 1.00 41.41 H new ATOM 0 HB2 GLN A 121 -11.286 16.683 4.207 1.00 14.54 H new ATOM 0 HB3 GLN A 121 -10.609 17.232 5.727 1.00 14.54 H new ATOM 0 HG2 GLN A 121 -8.322 16.655 4.900 1.00 3.11 H new ATOM 0 HG3 GLN A 121 -9.015 16.150 3.371 1.00 3.11 H new ATOM 0 HE21 GLN A 121 -7.045 18.274 3.941 1.00 61.45 H new ATOM 0 HE22 GLN A 121 -7.749 19.767 3.311 1.00 61.45 H new ATOM 1781 N THR A 122 -9.457 15.611 7.587 1.00 72.43 N ATOM 1782 CA THR A 122 -8.467 15.462 8.666 1.00 74.44 C ATOM 1783 C THR A 122 -8.802 14.264 9.574 1.00 62.31 C ATOM 1784 O THR A 122 -9.865 14.236 10.199 1.00 5.02 O ATOM 1785 CB THR A 122 -8.395 16.734 9.546 1.00 12.20 C ATOM 1786 OG1 THR A 122 -9.670 16.983 10.158 1.00 44.04 O ATOM 1787 CG2 THR A 122 -7.978 17.952 8.724 1.00 12.43 C ATOM 0 H THR A 122 -10.165 16.324 7.765 1.00 72.43 H new ATOM 0 HA THR A 122 -7.505 15.297 8.181 1.00 74.44 H new ATOM 0 HB THR A 122 -7.644 16.565 10.318 1.00 12.20 H new ATOM 0 HG1 THR A 122 -10.112 16.130 10.351 1.00 44.04 H new ATOM 0 HG21 THR A 122 -7.936 18.829 9.369 1.00 12.43 H new ATOM 0 HG22 THR A 122 -6.995 17.776 8.286 1.00 12.43 H new ATOM 0 HG23 THR A 122 -8.704 18.120 7.929 1.00 12.43 H new ATOM 1795 N PRO A 123 -7.908 13.255 9.659 1.00 50.32 N ATOM 1796 CA PRO A 123 -8.133 12.065 10.505 1.00 65.13 C ATOM 1797 C PRO A 123 -8.093 12.374 12.015 1.00 31.03 C ATOM 1798 O PRO A 123 -7.352 13.252 12.465 1.00 35.14 O ATOM 1799 CB PRO A 123 -6.983 11.127 10.109 1.00 50.10 C ATOM 1800 CG PRO A 123 -5.909 12.032 9.605 1.00 34.45 C ATOM 1801 CD PRO A 123 -6.619 13.185 8.940 1.00 23.52 C ATOM 0 HA PRO A 123 -9.125 11.642 10.346 1.00 65.13 H new ATOM 0 HB2 PRO A 123 -6.639 10.541 10.961 1.00 50.10 H new ATOM 0 HB3 PRO A 123 -7.296 10.419 9.342 1.00 50.10 H new ATOM 0 HG2 PRO A 123 -5.277 12.381 10.422 1.00 34.45 H new ATOM 0 HG3 PRO A 123 -5.260 11.513 8.899 1.00 34.45 H new ATOM 0 HD2 PRO A 123 -6.055 14.113 9.035 1.00 23.52 H new ATOM 0 HD3 PRO A 123 -6.763 13.007 7.874 1.00 23.52 H new ATOM 1809 N THR A 124 -8.899 11.652 12.795 1.00 30.14 N ATOM 1810 CA THR A 124 -8.963 11.848 14.255 1.00 73.33 C ATOM 1811 C THR A 124 -8.122 10.805 15.002 1.00 3.01 C ATOM 1812 O THR A 124 -7.520 9.920 14.389 1.00 13.14 O ATOM 1813 CB THR A 124 -10.418 11.752 14.774 1.00 73.23 C ATOM 1814 OG1 THR A 124 -10.894 10.403 14.654 1.00 45.00 O ATOM 1815 CG2 THR A 124 -11.342 12.688 13.999 1.00 73.11 C ATOM 0 H THR A 124 -9.520 10.923 12.445 1.00 30.14 H new ATOM 0 HA THR A 124 -8.566 12.845 14.446 1.00 73.33 H new ATOM 0 HB THR A 124 -10.422 12.051 15.822 1.00 73.23 H new ATOM 0 HG1 THR A 124 -11.815 10.350 14.986 1.00 45.00 H new ATOM 0 HG21 THR A 124 -12.357 12.599 14.385 1.00 73.11 H new ATOM 0 HG22 THR A 124 -10.999 13.716 14.114 1.00 73.11 H new ATOM 0 HG23 THR A 124 -11.331 12.418 12.943 1.00 73.11 H new ATOM 1823 N GLU A 125 -8.096 10.897 16.334 1.00 14.40 N ATOM 1824 CA GLU A 125 -7.358 9.932 17.159 1.00 31.55 C ATOM 1825 C GLU A 125 -7.905 8.509 16.970 1.00 43.31 C ATOM 1826 O GLU A 125 -7.159 7.527 17.029 1.00 22.25 O ATOM 1827 CB GLU A 125 -7.423 10.327 18.640 1.00 4.21 C ATOM 1828 CG GLU A 125 -6.636 9.394 19.559 1.00 65.33 C ATOM 1829 CD GLU A 125 -6.576 9.892 20.994 1.00 62.32 C ATOM 1830 OE1 GLU A 125 -5.896 10.915 21.239 1.00 32.33 O ATOM 1831 OE2 GLU A 125 -7.200 9.272 21.879 1.00 2.24 O ATOM 0 H GLU A 125 -8.574 11.625 16.864 1.00 14.40 H new ATOM 0 HA GLU A 125 -6.317 9.946 16.835 1.00 31.55 H new ATOM 0 HB2 GLU A 125 -7.041 11.342 18.753 1.00 4.21 H new ATOM 0 HB3 GLU A 125 -8.466 10.341 18.958 1.00 4.21 H new ATOM 0 HG2 GLU A 125 -7.093 8.404 19.542 1.00 65.33 H new ATOM 0 HG3 GLU A 125 -5.622 9.284 19.175 1.00 65.33 H new ATOM 1838 N ASN A 126 -9.210 8.408 16.729 1.00 13.34 N ATOM 1839 CA ASN A 126 -9.856 7.117 16.476 1.00 3.53 C ATOM 1840 C ASN A 126 -9.208 6.403 15.277 1.00 51.23 C ATOM 1841 O ASN A 126 -9.072 5.178 15.269 1.00 13.21 O ATOM 1842 CB ASN A 126 -11.355 7.315 16.229 1.00 2.40 C ATOM 1843 CG ASN A 126 -12.048 8.035 17.375 1.00 34.50 C ATOM 1844 OD1 ASN A 126 -11.461 8.876 18.052 1.00 72.42 O ATOM 1845 ND2 ASN A 126 -13.302 7.709 17.605 1.00 21.14 N ATOM 0 H ASN A 126 -9.845 9.206 16.703 1.00 13.34 H new ATOM 0 HA ASN A 126 -9.722 6.490 17.358 1.00 3.53 H new ATOM 0 HB2 ASN A 126 -11.496 7.884 15.310 1.00 2.40 H new ATOM 0 HB3 ASN A 126 -11.826 6.344 16.078 1.00 2.40 H new ATOM 0 HD21 ASN A 126 -13.815 8.159 18.363 1.00 21.14 H new ATOM 0 HD22 ASN A 126 -13.761 7.007 17.025 1.00 21.14 H new ATOM 1852 N THR A 127 -8.793 7.181 14.273 1.00 43.34 N ATOM 1853 CA THR A 127 -8.094 6.632 13.100 1.00 51.15 C ATOM 1854 C THR A 127 -6.760 5.980 13.494 1.00 71.24 C ATOM 1855 O THR A 127 -6.386 4.937 12.954 1.00 20.02 O ATOM 1856 CB THR A 127 -7.831 7.723 12.028 1.00 53.31 C ATOM 1857 OG1 THR A 127 -9.073 8.173 11.464 1.00 11.33 O ATOM 1858 CG2 THR A 127 -6.927 7.208 10.910 1.00 52.22 C ATOM 0 H THR A 127 -8.927 8.192 14.246 1.00 43.34 H new ATOM 0 HA THR A 127 -8.751 5.872 12.677 1.00 51.15 H new ATOM 0 HB THR A 127 -7.326 8.553 12.523 1.00 53.31 H new ATOM 0 HG1 THR A 127 -8.896 8.862 10.790 1.00 11.33 H new ATOM 0 HG21 THR A 127 -6.766 8.000 10.179 1.00 52.22 H new ATOM 0 HG22 THR A 127 -5.969 6.901 11.329 1.00 52.22 H new ATOM 0 HG23 THR A 127 -7.400 6.355 10.423 1.00 52.22 H new ATOM 1866 N TYR A 128 -6.045 6.596 14.434 1.00 32.14 N ATOM 1867 CA TYR A 128 -4.780 6.040 14.934 1.00 34.42 C ATOM 1868 C TYR A 128 -4.996 4.654 15.560 1.00 51.23 C ATOM 1869 O TYR A 128 -4.262 3.704 15.272 1.00 51.22 O ATOM 1870 CB TYR A 128 -4.139 6.985 15.963 1.00 24.21 C ATOM 1871 CG TYR A 128 -3.592 8.269 15.364 1.00 41.03 C ATOM 1872 CD1 TYR A 128 -4.432 9.325 15.021 1.00 65.23 C ATOM 1873 CD2 TYR A 128 -2.227 8.424 15.145 1.00 12.31 C ATOM 1874 CE1 TYR A 128 -3.927 10.492 14.474 1.00 2.31 C ATOM 1875 CE2 TYR A 128 -1.719 9.586 14.600 1.00 41.40 C ATOM 1876 CZ TYR A 128 -2.570 10.616 14.268 1.00 44.14 C ATOM 1877 OH TYR A 128 -2.060 11.777 13.732 1.00 64.02 O ATOM 0 H TYR A 128 -6.316 7.479 14.867 1.00 32.14 H new ATOM 0 HA TYR A 128 -4.106 5.935 14.084 1.00 34.42 H new ATOM 0 HB2 TYR A 128 -4.880 7.237 16.721 1.00 24.21 H new ATOM 0 HB3 TYR A 128 -3.330 6.459 16.470 1.00 24.21 H new ATOM 0 HD1 TYR A 128 -5.496 9.232 15.184 1.00 65.23 H new ATOM 0 HD2 TYR A 128 -1.553 7.621 15.406 1.00 12.31 H new ATOM 0 HE1 TYR A 128 -4.593 11.301 14.210 1.00 2.31 H new ATOM 0 HE2 TYR A 128 -0.657 9.687 14.434 1.00 41.40 H new ATOM 0 HH TYR A 128 -1.086 11.701 13.653 1.00 64.02 H new ATOM 1887 N LYS A 129 -6.011 4.548 16.414 1.00 31.32 N ATOM 1888 CA LYS A 129 -6.352 3.273 17.055 1.00 5.53 C ATOM 1889 C LYS A 129 -6.847 2.247 16.020 1.00 61.20 C ATOM 1890 O LYS A 129 -6.531 1.058 16.105 1.00 5.10 O ATOM 1891 CB LYS A 129 -7.414 3.498 18.139 1.00 11.12 C ATOM 1892 CG LYS A 129 -6.963 4.451 19.245 1.00 61.32 C ATOM 1893 CD LYS A 129 -8.037 4.638 20.312 1.00 44.14 C ATOM 1894 CE LYS A 129 -7.551 5.531 21.449 1.00 63.43 C ATOM 1895 NZ LYS A 129 -6.340 4.977 22.111 1.00 62.25 N ATOM 0 H LYS A 129 -6.613 5.327 16.680 1.00 31.32 H new ATOM 0 HA LYS A 129 -5.451 2.871 17.519 1.00 5.53 H new ATOM 0 HB2 LYS A 129 -8.317 3.894 17.675 1.00 11.12 H new ATOM 0 HB3 LYS A 129 -7.678 2.538 18.583 1.00 11.12 H new ATOM 0 HG2 LYS A 129 -6.055 4.065 19.708 1.00 61.32 H new ATOM 0 HG3 LYS A 129 -6.712 5.418 18.810 1.00 61.32 H new ATOM 0 HD2 LYS A 129 -8.927 5.076 19.860 1.00 44.14 H new ATOM 0 HD3 LYS A 129 -8.327 3.666 20.711 1.00 44.14 H new ATOM 0 HE2 LYS A 129 -7.330 6.525 21.060 1.00 63.43 H new ATOM 0 HE3 LYS A 129 -8.346 5.646 22.185 1.00 63.43 H new ATOM 0 HZ1 LYS A 129 -6.199 5.448 23.027 1.00 62.25 H new ATOM 0 HZ2 LYS A 129 -6.464 3.955 22.262 1.00 62.25 H new ATOM 0 HZ3 LYS A 129 -5.509 5.140 21.507 1.00 62.25 H new ATOM 1909 N LEU A 130 -7.618 2.722 15.038 1.00 53.45 N ATOM 1910 CA LEU A 130 -8.106 1.870 13.945 1.00 44.53 C ATOM 1911 C LEU A 130 -6.927 1.237 13.187 1.00 2.53 C ATOM 1912 O LEU A 130 -6.867 0.022 13.020 1.00 41.25 O ATOM 1913 CB LEU A 130 -8.994 2.704 12.991 1.00 30.13 C ATOM 1914 CG LEU A 130 -9.815 1.919 11.939 1.00 61.25 C ATOM 1915 CD1 LEU A 130 -10.946 2.789 11.390 1.00 72.20 C ATOM 1916 CD2 LEU A 130 -8.933 1.430 10.787 1.00 33.23 C ATOM 0 H LEU A 130 -7.920 3.694 14.976 1.00 53.45 H new ATOM 0 HA LEU A 130 -8.706 1.062 14.363 1.00 44.53 H new ATOM 0 HB2 LEU A 130 -9.687 3.289 13.596 1.00 30.13 H new ATOM 0 HB3 LEU A 130 -8.355 3.412 12.464 1.00 30.13 H new ATOM 0 HG LEU A 130 -10.238 1.046 12.437 1.00 61.25 H new ATOM 0 HD11 LEU A 130 -11.514 2.224 10.652 1.00 72.20 H new ATOM 0 HD12 LEU A 130 -11.605 3.086 12.206 1.00 72.20 H new ATOM 0 HD13 LEU A 130 -10.526 3.679 10.921 1.00 72.20 H new ATOM 0 HD21 LEU A 130 -9.543 0.883 10.068 1.00 33.23 H new ATOM 0 HD22 LEU A 130 -8.471 2.285 10.294 1.00 33.23 H new ATOM 0 HD23 LEU A 130 -8.156 0.773 11.177 1.00 33.23 H new ATOM 1928 N CYS A 131 -5.984 2.073 12.746 1.00 62.42 N ATOM 1929 CA CYS A 131 -4.804 1.603 12.002 1.00 33.22 C ATOM 1930 C CYS A 131 -3.963 0.628 12.838 1.00 14.11 C ATOM 1931 O CYS A 131 -3.477 -0.385 12.330 1.00 40.32 O ATOM 1932 CB CYS A 131 -3.933 2.792 11.576 1.00 64.11 C ATOM 1933 SG CYS A 131 -4.782 3.994 10.523 1.00 43.22 S ATOM 0 H CYS A 131 -6.011 3.082 12.890 1.00 62.42 H new ATOM 0 HA CYS A 131 -5.164 1.077 11.118 1.00 33.22 H new ATOM 0 HB2 CYS A 131 -3.570 3.301 12.469 1.00 64.11 H new ATOM 0 HB3 CYS A 131 -3.058 2.416 11.046 1.00 64.11 H new ATOM 0 HG CYS A 131 -5.636 4.668 11.235 1.00 43.22 H new ATOM 1939 N GLU A 132 -3.806 0.943 14.125 1.00 33.22 N ATOM 1940 CA GLU A 132 -3.038 0.107 15.057 1.00 54.22 C ATOM 1941 C GLU A 132 -3.573 -1.340 15.083 1.00 44.31 C ATOM 1942 O GLU A 132 -2.805 -2.308 15.034 1.00 24.12 O ATOM 1943 CB GLU A 132 -3.100 0.725 16.463 1.00 52.03 C ATOM 1944 CG GLU A 132 -2.184 0.065 17.486 1.00 40.12 C ATOM 1945 CD GLU A 132 -2.276 0.725 18.855 1.00 1.50 C ATOM 1946 OE1 GLU A 132 -1.920 1.921 18.969 1.00 43.05 O ATOM 1947 OE2 GLU A 132 -2.711 0.064 19.818 1.00 13.32 O ATOM 0 H GLU A 132 -4.204 1.780 14.551 1.00 33.22 H new ATOM 0 HA GLU A 132 -2.002 0.069 14.719 1.00 54.22 H new ATOM 0 HB2 GLU A 132 -2.843 1.782 16.393 1.00 52.03 H new ATOM 0 HB3 GLU A 132 -4.127 0.670 16.825 1.00 52.03 H new ATOM 0 HG2 GLU A 132 -2.444 -0.990 17.576 1.00 40.12 H new ATOM 0 HG3 GLU A 132 -1.154 0.111 17.131 1.00 40.12 H new ATOM 1954 N GLU A 133 -4.896 -1.472 15.147 1.00 5.01 N ATOM 1955 CA GLU A 133 -5.554 -2.783 15.136 1.00 22.42 C ATOM 1956 C GLU A 133 -5.603 -3.390 13.724 1.00 41.33 C ATOM 1957 O GLU A 133 -5.370 -4.586 13.548 1.00 74.22 O ATOM 1958 CB GLU A 133 -6.976 -2.658 15.706 1.00 21.41 C ATOM 1959 CG GLU A 133 -7.016 -2.489 17.221 1.00 2.21 C ATOM 1960 CD GLU A 133 -6.438 -3.692 17.951 1.00 43.23 C ATOM 1961 OE1 GLU A 133 -7.038 -4.788 17.864 1.00 13.53 O ATOM 1962 OE2 GLU A 133 -5.382 -3.557 18.604 1.00 5.22 O ATOM 0 H GLU A 133 -5.540 -0.683 15.207 1.00 5.01 H new ATOM 0 HA GLU A 133 -4.965 -3.455 15.761 1.00 22.42 H new ATOM 0 HB2 GLU A 133 -7.471 -1.805 15.241 1.00 21.41 H new ATOM 0 HB3 GLU A 133 -7.547 -3.546 15.433 1.00 21.41 H new ATOM 0 HG2 GLU A 133 -6.458 -1.595 17.500 1.00 2.21 H new ATOM 0 HG3 GLU A 133 -8.047 -2.334 17.540 1.00 2.21 H new ATOM 1969 N ALA A 134 -5.901 -2.559 12.727 1.00 73.30 N ATOM 1970 CA ALA A 134 -6.036 -3.014 11.337 1.00 14.10 C ATOM 1971 C ALA A 134 -4.744 -3.663 10.814 1.00 41.22 C ATOM 1972 O ALA A 134 -4.774 -4.757 10.243 1.00 11.24 O ATOM 1973 CB ALA A 134 -6.445 -1.849 10.439 1.00 24.32 C ATOM 0 H ALA A 134 -6.055 -1.559 12.854 1.00 73.30 H new ATOM 0 HA ALA A 134 -6.815 -3.777 11.316 1.00 14.10 H new ATOM 0 HB1 ALA A 134 -6.542 -2.199 9.411 1.00 24.32 H new ATOM 0 HB2 ALA A 134 -7.400 -1.447 10.777 1.00 24.32 H new ATOM 0 HB3 ALA A 134 -5.685 -1.069 10.487 1.00 24.32 H new ATOM 1979 N GLY A 135 -3.615 -2.982 11.018 1.00 21.31 N ATOM 1980 CA GLY A 135 -2.326 -3.513 10.581 1.00 23.21 C ATOM 1981 C GLY A 135 -1.983 -4.849 11.231 1.00 1.55 C ATOM 1982 O GLY A 135 -1.580 -5.794 10.554 1.00 53.31 O ATOM 0 H GLY A 135 -3.568 -2.073 11.478 1.00 21.31 H new ATOM 0 HA2 GLY A 135 -2.337 -3.634 9.498 1.00 23.21 H new ATOM 0 HA3 GLY A 135 -1.544 -2.790 10.813 1.00 23.21 H new ATOM 1986 N THR A 136 -2.152 -4.925 12.553 1.00 53.14 N ATOM 1987 CA THR A 136 -1.908 -6.167 13.300 1.00 55.43 C ATOM 1988 C THR A 136 -2.823 -7.303 12.814 1.00 41.22 C ATOM 1989 O THR A 136 -2.371 -8.430 12.596 1.00 30.34 O ATOM 1990 CB THR A 136 -2.125 -5.964 14.823 1.00 71.23 C ATOM 1991 OG1 THR A 136 -1.228 -4.957 15.326 1.00 75.41 O ATOM 1992 CG2 THR A 136 -1.910 -7.264 15.596 1.00 3.14 C ATOM 0 H THR A 136 -2.457 -4.142 13.131 1.00 53.14 H new ATOM 0 HA THR A 136 -0.869 -6.440 13.119 1.00 55.43 H new ATOM 0 HB THR A 136 -3.156 -5.642 14.967 1.00 71.23 H new ATOM 0 HG1 THR A 136 -1.657 -4.078 15.266 1.00 75.41 H new ATOM 0 HG21 THR A 136 -2.070 -7.086 16.659 1.00 3.14 H new ATOM 0 HG22 THR A 136 -2.615 -8.017 15.244 1.00 3.14 H new ATOM 0 HG23 THR A 136 -0.891 -7.618 15.437 1.00 3.14 H new ATOM 2000 N ASP A 137 -4.109 -6.994 12.645 1.00 33.33 N ATOM 2001 CA ASP A 137 -5.102 -7.967 12.170 1.00 30.33 C ATOM 2002 C ASP A 137 -4.719 -8.533 10.789 1.00 23.51 C ATOM 2003 O ASP A 137 -4.780 -9.743 10.562 1.00 20.31 O ATOM 2004 CB ASP A 137 -6.485 -7.301 12.121 1.00 74.13 C ATOM 2005 CG ASP A 137 -7.599 -8.264 11.736 1.00 23.21 C ATOM 2006 OD1 ASP A 137 -8.085 -9.003 12.621 1.00 51.15 O ATOM 2007 OD2 ASP A 137 -8.007 -8.268 10.556 1.00 14.15 O ATOM 0 H ASP A 137 -4.494 -6.068 12.832 1.00 33.33 H new ATOM 0 HA ASP A 137 -5.130 -8.805 12.866 1.00 30.33 H new ATOM 0 HB2 ASP A 137 -6.708 -6.868 13.096 1.00 74.13 H new ATOM 0 HB3 ASP A 137 -6.460 -6.479 11.406 1.00 74.13 H new ATOM 2012 N LEU A 138 -4.307 -7.650 9.875 1.00 21.35 N ATOM 2013 CA LEU A 138 -3.867 -8.064 8.536 1.00 35.02 C ATOM 2014 C LEU A 138 -2.581 -8.906 8.606 1.00 2.24 C ATOM 2015 O LEU A 138 -2.454 -9.923 7.921 1.00 63.14 O ATOM 2016 CB LEU A 138 -3.637 -6.835 7.648 1.00 20.22 C ATOM 2017 CG LEU A 138 -3.211 -7.139 6.197 1.00 31.34 C ATOM 2018 CD1 LEU A 138 -4.306 -7.902 5.453 1.00 72.31 C ATOM 2019 CD2 LEU A 138 -2.845 -5.853 5.458 1.00 45.55 C ATOM 0 H LEU A 138 -4.268 -6.644 10.036 1.00 21.35 H new ATOM 0 HA LEU A 138 -4.655 -8.679 8.102 1.00 35.02 H new ATOM 0 HB2 LEU A 138 -4.555 -6.248 7.624 1.00 20.22 H new ATOM 0 HB3 LEU A 138 -2.872 -6.211 8.111 1.00 20.22 H new ATOM 0 HG LEU A 138 -2.325 -7.773 6.232 1.00 31.34 H new ATOM 0 HD11 LEU A 138 -3.980 -8.104 4.433 1.00 72.31 H new ATOM 0 HD12 LEU A 138 -4.504 -8.844 5.964 1.00 72.31 H new ATOM 0 HD13 LEU A 138 -5.216 -7.303 5.431 1.00 72.31 H new ATOM 0 HD21 LEU A 138 -2.548 -6.092 4.437 1.00 45.55 H new ATOM 0 HD22 LEU A 138 -3.707 -5.187 5.438 1.00 45.55 H new ATOM 0 HD23 LEU A 138 -2.018 -5.361 5.971 1.00 45.55 H new ATOM 2031 N GLY A 139 -1.633 -8.475 9.443 1.00 72.43 N ATOM 2032 CA GLY A 139 -0.390 -9.219 9.628 1.00 51.02 C ATOM 2033 C GLY A 139 -0.623 -10.671 10.036 1.00 24.31 C ATOM 2034 O GLY A 139 0.114 -11.570 9.618 1.00 1.33 O ATOM 0 H GLY A 139 -1.704 -7.622 9.998 1.00 72.43 H new ATOM 0 HA2 GLY A 139 0.184 -9.195 8.701 1.00 51.02 H new ATOM 0 HA3 GLY A 139 0.213 -8.725 10.390 1.00 51.02 H new ATOM 2038 N GLN A 140 -1.656 -10.896 10.853 1.00 32.15 N ATOM 2039 CA GLN A 140 -2.064 -12.248 11.247 1.00 54.51 C ATOM 2040 C GLN A 140 -2.400 -13.107 10.017 1.00 62.21 C ATOM 2041 O GLN A 140 -1.973 -14.258 9.914 1.00 20.52 O ATOM 2042 CB GLN A 140 -3.287 -12.186 12.177 1.00 43.12 C ATOM 2043 CG GLN A 140 -3.040 -11.437 13.484 1.00 62.22 C ATOM 2044 CD GLN A 140 -4.293 -11.322 14.343 1.00 41.52 C ATOM 2045 OE1 GLN A 140 -5.169 -12.178 14.304 1.00 65.10 O ATOM 2046 NE2 GLN A 140 -4.384 -10.266 15.131 1.00 23.55 N ATOM 0 H GLN A 140 -2.228 -10.154 11.257 1.00 32.15 H new ATOM 0 HA GLN A 140 -1.228 -12.707 11.774 1.00 54.51 H new ATOM 0 HB2 GLN A 140 -4.110 -11.707 11.646 1.00 43.12 H new ATOM 0 HB3 GLN A 140 -3.606 -13.202 12.408 1.00 43.12 H new ATOM 0 HG2 GLN A 140 -2.262 -11.950 14.050 1.00 62.22 H new ATOM 0 HG3 GLN A 140 -2.665 -10.438 13.260 1.00 62.22 H new ATOM 0 HE21 GLN A 140 -3.638 -9.571 15.141 1.00 23.55 H new ATOM 0 HE22 GLN A 140 -5.201 -10.146 15.730 1.00 23.55 H new ATOM 2055 N TRP A 141 -3.162 -12.534 9.083 1.00 74.30 N ATOM 2056 CA TRP A 141 -3.544 -13.240 7.856 1.00 13.43 C ATOM 2057 C TRP A 141 -2.311 -13.593 7.012 1.00 13.45 C ATOM 2058 O TRP A 141 -2.146 -14.733 6.587 1.00 4.52 O ATOM 2059 CB TRP A 141 -4.519 -12.391 7.024 1.00 54.34 C ATOM 2060 CG TRP A 141 -4.979 -13.066 5.755 1.00 20.01 C ATOM 2061 CD1 TRP A 141 -6.074 -13.869 5.604 1.00 1.14 C ATOM 2062 CD2 TRP A 141 -4.356 -12.997 4.460 1.00 24.54 C ATOM 2063 NE1 TRP A 141 -6.164 -14.308 4.305 1.00 31.41 N ATOM 2064 CE2 TRP A 141 -5.124 -13.787 3.584 1.00 20.40 C ATOM 2065 CE3 TRP A 141 -3.223 -12.347 3.958 1.00 42.15 C ATOM 2066 CZ2 TRP A 141 -4.796 -13.945 2.239 1.00 61.42 C ATOM 2067 CZ3 TRP A 141 -2.898 -12.504 2.622 1.00 63.24 C ATOM 2068 CH2 TRP A 141 -3.683 -13.297 1.776 1.00 5.24 C ATOM 0 H TRP A 141 -3.527 -11.584 9.152 1.00 74.30 H new ATOM 0 HA TRP A 141 -4.039 -14.166 8.149 1.00 13.43 H new ATOM 0 HB2 TRP A 141 -5.390 -12.151 7.634 1.00 54.34 H new ATOM 0 HB3 TRP A 141 -4.038 -11.446 6.769 1.00 54.34 H new ATOM 0 HD1 TRP A 141 -6.768 -14.122 6.392 1.00 1.14 H new ATOM 0 HE1 TRP A 141 -6.890 -14.923 3.937 1.00 31.41 H new ATOM 0 HE3 TRP A 141 -2.612 -11.733 4.603 1.00 42.15 H new ATOM 0 HZ2 TRP A 141 -5.399 -14.557 1.585 1.00 61.42 H new ATOM 0 HZ3 TRP A 141 -2.025 -12.007 2.226 1.00 63.24 H new ATOM 0 HH2 TRP A 141 -3.405 -13.399 0.738 1.00 5.24 H new ATOM 2079 N VAL A 142 -1.445 -12.605 6.786 1.00 55.23 N ATOM 2080 CA VAL A 142 -0.259 -12.785 5.937 1.00 23.03 C ATOM 2081 C VAL A 142 0.602 -13.982 6.381 1.00 42.51 C ATOM 2082 O VAL A 142 0.860 -14.899 5.597 1.00 32.01 O ATOM 2083 CB VAL A 142 0.613 -11.504 5.918 1.00 62.31 C ATOM 2084 CG1 VAL A 142 1.849 -11.690 5.037 1.00 20.33 C ATOM 2085 CG2 VAL A 142 -0.209 -10.302 5.455 1.00 52.42 C ATOM 0 H VAL A 142 -1.540 -11.668 7.178 1.00 55.23 H new ATOM 0 HA VAL A 142 -0.630 -12.987 4.932 1.00 23.03 H new ATOM 0 HB VAL A 142 0.956 -11.314 6.935 1.00 62.31 H new ATOM 0 HG11 VAL A 142 2.441 -10.775 5.043 1.00 20.33 H new ATOM 0 HG12 VAL A 142 2.450 -12.514 5.422 1.00 20.33 H new ATOM 0 HG13 VAL A 142 1.538 -11.914 4.017 1.00 20.33 H new ATOM 0 HG21 VAL A 142 0.420 -9.412 5.448 1.00 52.42 H new ATOM 0 HG22 VAL A 142 -0.588 -10.486 4.450 1.00 52.42 H new ATOM 0 HG23 VAL A 142 -1.046 -10.149 6.136 1.00 52.42 H new ATOM 2095 N THR A 143 1.038 -13.975 7.640 1.00 24.54 N ATOM 2096 CA THR A 143 1.897 -15.051 8.163 1.00 65.54 C ATOM 2097 C THR A 143 1.172 -16.406 8.203 1.00 21.15 C ATOM 2098 O THR A 143 1.748 -17.441 7.856 1.00 45.13 O ATOM 2099 CB THR A 143 2.435 -14.723 9.583 1.00 63.31 C ATOM 2100 OG1 THR A 143 3.231 -15.814 10.078 1.00 64.21 O ATOM 2101 CG2 THR A 143 1.298 -14.439 10.562 1.00 71.10 C ATOM 0 H THR A 143 0.816 -13.245 8.317 1.00 24.54 H new ATOM 0 HA THR A 143 2.736 -15.122 7.471 1.00 65.54 H new ATOM 0 HB THR A 143 3.050 -13.827 9.502 1.00 63.31 H new ATOM 0 HG1 THR A 143 3.566 -15.595 10.973 1.00 64.21 H new ATOM 0 HG21 THR A 143 1.712 -14.214 11.545 1.00 71.10 H new ATOM 0 HG22 THR A 143 0.718 -13.587 10.208 1.00 71.10 H new ATOM 0 HG23 THR A 143 0.652 -15.314 10.633 1.00 71.10 H new ATOM 2109 N ARG A 144 -0.102 -16.395 8.592 1.00 34.42 N ATOM 2110 CA ARG A 144 -0.855 -17.639 8.788 1.00 44.54 C ATOM 2111 C ARG A 144 -1.254 -18.286 7.451 1.00 50.03 C ATOM 2112 O ARG A 144 -1.278 -19.511 7.331 1.00 2.23 O ATOM 2113 CB ARG A 144 -2.100 -17.367 9.648 1.00 72.32 C ATOM 2114 CG ARG A 144 -2.542 -18.561 10.490 1.00 4.34 C ATOM 2115 CD ARG A 144 -3.572 -18.162 11.543 1.00 11.05 C ATOM 2116 NE ARG A 144 -3.677 -19.159 12.610 1.00 33.34 N ATOM 2117 CZ ARG A 144 -4.379 -18.993 13.701 1.00 11.03 C ATOM 2118 NH1 ARG A 144 -5.032 -17.896 13.905 1.00 53.44 N ATOM 2119 NH2 ARG A 144 -4.415 -19.925 14.601 1.00 64.50 N ATOM 0 H ARG A 144 -0.635 -15.545 8.778 1.00 34.42 H new ATOM 0 HA ARG A 144 -0.205 -18.345 9.306 1.00 44.54 H new ATOM 0 HB2 ARG A 144 -1.896 -16.524 10.309 1.00 72.32 H new ATOM 0 HB3 ARG A 144 -2.922 -17.070 8.997 1.00 72.32 H new ATOM 0 HG2 ARG A 144 -2.965 -19.327 9.840 1.00 4.34 H new ATOM 0 HG3 ARG A 144 -1.674 -19.002 10.980 1.00 4.34 H new ATOM 0 HD2 ARG A 144 -3.298 -17.198 11.972 1.00 11.05 H new ATOM 0 HD3 ARG A 144 -4.545 -18.034 11.069 1.00 11.05 H new ATOM 0 HE ARG A 144 -3.171 -20.037 12.495 1.00 33.34 H new ATOM 0 HH11 ARG A 144 -5.003 -17.149 13.211 1.00 53.44 H new ATOM 0 HH12 ARG A 144 -5.576 -17.778 14.760 1.00 53.44 H new ATOM 0 HH21 ARG A 144 -3.895 -20.791 14.460 1.00 64.50 H new ATOM 0 HH22 ARG A 144 -4.963 -19.792 15.451 1.00 64.50 H new ATOM 2133 N ASP A 145 -1.564 -17.459 6.455 1.00 1.30 N ATOM 2134 CA ASP A 145 -1.909 -17.942 5.112 1.00 64.05 C ATOM 2135 C ASP A 145 -0.653 -18.432 4.372 1.00 75.24 C ATOM 2136 O ASP A 145 -0.661 -19.487 3.735 1.00 5.23 O ATOM 2137 CB ASP A 145 -2.593 -16.822 4.315 1.00 33.25 C ATOM 2138 CG ASP A 145 -3.057 -17.268 2.938 1.00 34.54 C ATOM 2139 OD1 ASP A 145 -2.270 -17.170 1.971 1.00 62.44 O ATOM 2140 OD2 ASP A 145 -4.214 -17.722 2.805 1.00 62.13 O ATOM 0 H ASP A 145 -1.584 -16.444 6.550 1.00 1.30 H new ATOM 0 HA ASP A 145 -2.597 -18.782 5.209 1.00 64.05 H new ATOM 0 HB2 ASP A 145 -3.450 -16.454 4.879 1.00 33.25 H new ATOM 0 HB3 ASP A 145 -1.901 -15.987 4.206 1.00 33.25 H new ATOM 2145 N ARG A 146 0.426 -17.651 4.466 1.00 61.45 N ATOM 2146 CA ARG A 146 1.708 -17.995 3.834 1.00 44.34 C ATOM 2147 C ARG A 146 2.229 -19.356 4.335 1.00 53.51 C ATOM 2148 O ARG A 146 2.727 -20.175 3.556 1.00 62.10 O ATOM 2149 CB ARG A 146 2.738 -16.891 4.126 1.00 22.44 C ATOM 2150 CG ARG A 146 4.048 -17.018 3.349 1.00 35.35 C ATOM 2151 CD ARG A 146 5.030 -15.909 3.725 1.00 62.12 C ATOM 2152 NE ARG A 146 6.231 -15.914 2.888 1.00 60.43 N ATOM 2153 CZ ARG A 146 7.403 -15.493 3.283 1.00 64.12 C ATOM 2154 NH1 ARG A 146 7.588 -15.090 4.502 1.00 12.33 N ATOM 2155 NH2 ARG A 146 8.400 -15.495 2.462 1.00 10.04 N ATOM 0 H ARG A 146 0.439 -16.769 4.977 1.00 61.45 H new ATOM 0 HA ARG A 146 1.553 -18.073 2.758 1.00 44.34 H new ATOM 0 HB2 ARG A 146 2.289 -15.924 3.898 1.00 22.44 H new ATOM 0 HB3 ARG A 146 2.962 -16.895 5.193 1.00 22.44 H new ATOM 0 HG2 ARG A 146 4.499 -17.989 3.551 1.00 35.35 H new ATOM 0 HG3 ARG A 146 3.843 -16.977 2.279 1.00 35.35 H new ATOM 0 HD2 ARG A 146 4.533 -14.943 3.636 1.00 62.12 H new ATOM 0 HD3 ARG A 146 5.319 -16.023 4.770 1.00 62.12 H new ATOM 0 HE ARG A 146 6.147 -16.269 1.935 1.00 60.43 H new ATOM 0 HH11 ARG A 146 6.813 -15.099 5.165 1.00 12.33 H new ATOM 0 HH12 ARG A 146 8.508 -14.764 4.797 1.00 12.33 H new ATOM 0 HH21 ARG A 146 8.272 -15.825 1.505 1.00 10.04 H new ATOM 0 HH22 ARG A 146 9.315 -15.166 2.770 1.00 10.04 H new ATOM 2169 N LEU A 147 2.110 -19.584 5.644 1.00 5.24 N ATOM 2170 CA LEU A 147 2.499 -20.860 6.256 1.00 53.32 C ATOM 2171 C LEU A 147 1.416 -21.928 5.997 1.00 72.10 C ATOM 2172 O LEU A 147 1.682 -22.960 5.380 1.00 45.34 O ATOM 2173 CB LEU A 147 2.717 -20.658 7.773 1.00 34.14 C ATOM 2174 CG LEU A 147 3.555 -21.732 8.501 1.00 5.21 C ATOM 2175 CD1 LEU A 147 3.843 -21.295 9.934 1.00 2.33 C ATOM 2176 CD2 LEU A 147 2.864 -23.096 8.501 1.00 50.54 C ATOM 0 H LEU A 147 1.745 -18.899 6.306 1.00 5.24 H new ATOM 0 HA LEU A 147 3.430 -21.207 5.809 1.00 53.32 H new ATOM 0 HB2 LEU A 147 3.198 -19.692 7.922 1.00 34.14 H new ATOM 0 HB3 LEU A 147 1.740 -20.605 8.253 1.00 34.14 H new ATOM 0 HG LEU A 147 4.493 -21.836 7.956 1.00 5.21 H new ATOM 0 HD11 LEU A 147 4.434 -22.061 10.436 1.00 2.33 H new ATOM 0 HD12 LEU A 147 4.398 -20.357 9.924 1.00 2.33 H new ATOM 0 HD13 LEU A 147 2.903 -21.155 10.468 1.00 2.33 H new ATOM 0 HD21 LEU A 147 3.489 -23.820 9.023 1.00 50.54 H new ATOM 0 HD22 LEU A 147 1.901 -23.016 9.006 1.00 50.54 H new ATOM 0 HD23 LEU A 147 2.709 -23.425 7.474 1.00 50.54 H new