USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 923 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0262) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0199 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.996 USER MOD Single : A 25 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.0801 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= -1.8 K(o=-1.8,f=-6.9!) USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 34 GLN : amide:sc=-0.00664 K(o=-0.0066,f=-2.1!) USER MOD Single : A 35 THR OG1 : rot 96:sc= 1.17 USER MOD Single : A 36 GLN : amide:sc= -2.34! C(o=-2.3!,f=-2.9!) USER MOD Single : A 38 GLN : amide:sc= -0.219 K(o=-0.22,f=-0.9) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -0.0136 X(o=-0.014,f=-0.45) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= -3.15! C(o=-3.1!,f=-6!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 59:sc= 1.08 USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 75 SER OG : rot 180:sc= -0.148 USER MOD Single : A 76 GLN : amide:sc= -0.208 K(o=-0.21,f=-0.72) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0363) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.102) USER MOD Single : A 92 ASN : amide:sc= -0.0282 K(o=-0.028,f=-1.9!) USER MOD Single : A 94 LYS NZ :NH3+ 135:sc= -0.424 (180deg=-1.81!) USER MOD Single : A 95 MET CE :methyl -173:sc= 0 (180deg=-0.0398) USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 CYS SG : rot 81:sc= 0.207 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -19:sc= 0.0689 USER MOD Single : A 116 THR OG1 : rot -68:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -44.374 42.143 4.947 1.00 0.00 N ATOM 2 CA MET A 1 -45.216 43.298 4.522 1.00 0.00 C ATOM 3 C MET A 1 -44.963 44.478 5.450 1.00 0.00 C ATOM 4 O MET A 1 -44.768 45.606 4.997 1.00 0.00 O ATOM 5 CB MET A 1 -46.694 42.898 4.577 1.00 0.00 C ATOM 6 CG MET A 1 -47.566 44.091 4.176 1.00 0.00 C ATOM 7 SD MET A 1 -49.298 43.572 4.102 1.00 0.00 S ATOM 8 CE MET A 1 -49.989 45.167 3.595 1.00 0.00 C ATOM 0 H1 MET A 1 -44.482 41.365 4.265 1.00 0.00 H new ATOM 0 H2 MET A 1 -43.377 42.435 4.984 1.00 0.00 H new ATOM 0 H3 MET A 1 -44.675 41.822 5.889 1.00 0.00 H new ATOM 0 HA MET A 1 -44.960 43.584 3.502 1.00 0.00 H new ATOM 0 HB2 MET A 1 -46.879 42.058 3.907 1.00 0.00 H new ATOM 0 HB3 MET A 1 -46.954 42.567 5.582 1.00 0.00 H new ATOM 0 HG2 MET A 1 -47.448 44.900 4.897 1.00 0.00 H new ATOM 0 HG3 MET A 1 -47.249 44.478 3.207 1.00 0.00 H new ATOM 0 HE1 MET A 1 -51.070 45.077 3.487 1.00 0.00 H new ATOM 0 HE2 MET A 1 -49.761 45.919 4.350 1.00 0.00 H new ATOM 0 HE3 MET A 1 -49.553 45.466 2.642 1.00 0.00 H new ATOM 18 N SER A 2 -44.976 44.215 6.752 1.00 0.00 N ATOM 19 CA SER A 2 -44.755 45.272 7.730 1.00 0.00 C ATOM 20 C SER A 2 -43.382 45.900 7.532 1.00 0.00 C ATOM 21 O SER A 2 -42.399 45.206 7.274 1.00 0.00 O ATOM 22 CB SER A 2 -44.858 44.699 9.144 1.00 0.00 C ATOM 23 OG SER A 2 -46.180 44.225 9.364 1.00 0.00 O ATOM 0 H SER A 2 -45.135 43.290 7.151 1.00 0.00 H new ATOM 0 HA SER A 2 -45.517 46.039 7.592 1.00 0.00 H new ATOM 0 HB2 SER A 2 -44.142 43.887 9.273 1.00 0.00 H new ATOM 0 HB3 SER A 2 -44.607 45.465 9.878 1.00 0.00 H new ATOM 0 HG SER A 2 -46.249 43.855 10.269 1.00 0.00 H new ATOM 29 N ALA A 3 -43.324 47.220 7.658 1.00 0.00 N ATOM 30 CA ALA A 3 -42.065 47.939 7.491 1.00 0.00 C ATOM 31 C ALA A 3 -41.050 47.491 8.535 1.00 0.00 C ATOM 32 O ALA A 3 -39.859 47.375 8.247 1.00 0.00 O ATOM 33 CB ALA A 3 -42.298 49.445 7.623 1.00 0.00 C ATOM 0 H ALA A 3 -44.127 47.811 7.874 1.00 0.00 H new ATOM 0 HA ALA A 3 -41.674 47.717 6.498 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -41.352 49.972 7.497 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -43.001 49.773 6.857 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -42.707 49.665 8.609 1.00 0.00 H new ATOM 39 N THR A 4 -41.529 47.236 9.749 1.00 0.00 N ATOM 40 CA THR A 4 -40.653 46.796 10.827 1.00 0.00 C ATOM 41 C THR A 4 -40.363 45.306 10.702 1.00 0.00 C ATOM 42 O THR A 4 -41.047 44.591 9.969 1.00 0.00 O ATOM 43 CB THR A 4 -41.310 47.076 12.180 1.00 0.00 C ATOM 44 OG1 THR A 4 -42.644 46.585 12.165 1.00 0.00 O ATOM 45 CG2 THR A 4 -41.323 48.582 12.442 1.00 0.00 C ATOM 0 H THR A 4 -42.511 47.326 10.009 1.00 0.00 H new ATOM 0 HA THR A 4 -39.715 47.347 10.757 1.00 0.00 H new ATOM 0 HB THR A 4 -40.746 46.578 12.969 1.00 0.00 H new ATOM 0 HG1 THR A 4 -43.067 46.761 13.031 1.00 0.00 H new ATOM 0 HG21 THR A 4 -41.791 48.780 13.406 1.00 0.00 H new ATOM 0 HG22 THR A 4 -40.300 48.958 12.452 1.00 0.00 H new ATOM 0 HG23 THR A 4 -41.887 49.083 11.655 1.00 0.00 H new ATOM 53 N ALA A 5 -39.345 44.840 11.422 1.00 0.00 N ATOM 54 CA ALA A 5 -38.970 43.430 11.388 1.00 0.00 C ATOM 55 C ALA A 5 -38.323 43.020 12.705 1.00 0.00 C ATOM 56 O ALA A 5 -37.678 43.831 13.370 1.00 0.00 O ATOM 57 CB ALA A 5 -37.996 43.178 10.236 1.00 0.00 C ATOM 0 H ALA A 5 -38.767 45.417 12.034 1.00 0.00 H new ATOM 0 HA ALA A 5 -39.870 42.834 11.237 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -37.720 42.124 10.217 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -38.471 43.446 9.292 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -37.101 43.784 10.377 1.00 0.00 H new ATOM 63 N ALA A 6 -38.497 41.755 13.075 1.00 0.00 N ATOM 64 CA ALA A 6 -37.924 41.240 14.314 1.00 0.00 C ATOM 65 C ALA A 6 -36.478 40.810 14.090 1.00 0.00 C ATOM 66 O ALA A 6 -36.032 40.672 12.949 1.00 0.00 O ATOM 67 CB ALA A 6 -38.742 40.048 14.812 1.00 0.00 C ATOM 0 H ALA A 6 -39.028 41.070 12.537 1.00 0.00 H new ATOM 0 HA ALA A 6 -37.947 42.032 15.063 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -38.307 39.670 15.737 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -39.769 40.363 14.996 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -38.733 39.260 14.058 1.00 0.00 H new ATOM 73 N THR A 7 -35.750 40.596 15.185 1.00 0.00 N ATOM 74 CA THR A 7 -34.350 40.179 15.111 1.00 0.00 C ATOM 75 C THR A 7 -34.098 39.005 16.049 1.00 0.00 C ATOM 76 O THR A 7 -34.483 39.035 17.217 1.00 0.00 O ATOM 77 CB THR A 7 -33.442 41.348 15.495 1.00 0.00 C ATOM 78 OG1 THR A 7 -32.149 40.858 15.821 1.00 0.00 O ATOM 79 CG2 THR A 7 -34.032 42.083 16.700 1.00 0.00 C ATOM 0 H THR A 7 -36.106 40.704 16.135 1.00 0.00 H new ATOM 0 HA THR A 7 -34.130 39.868 14.090 1.00 0.00 H new ATOM 0 HB THR A 7 -33.366 42.038 14.655 1.00 0.00 H new ATOM 0 HG1 THR A 7 -31.567 41.608 16.066 1.00 0.00 H new ATOM 0 HG21 THR A 7 -33.383 42.916 16.972 1.00 0.00 H new ATOM 0 HG22 THR A 7 -35.022 42.462 16.446 1.00 0.00 H new ATOM 0 HG23 THR A 7 -34.112 41.396 17.542 1.00 0.00 H new ATOM 87 N VAL A 8 -33.445 37.971 15.527 1.00 0.00 N ATOM 88 CA VAL A 8 -33.142 36.786 16.321 1.00 0.00 C ATOM 89 C VAL A 8 -31.878 36.115 15.792 1.00 0.00 C ATOM 90 O VAL A 8 -31.862 34.907 15.552 1.00 0.00 O ATOM 91 CB VAL A 8 -34.314 35.801 16.260 1.00 0.00 C ATOM 92 CG1 VAL A 8 -35.493 36.350 17.068 1.00 0.00 C ATOM 93 CG2 VAL A 8 -34.745 35.611 14.802 1.00 0.00 C ATOM 0 H VAL A 8 -33.117 37.930 14.562 1.00 0.00 H new ATOM 0 HA VAL A 8 -32.982 37.086 17.356 1.00 0.00 H new ATOM 0 HB VAL A 8 -34.002 34.844 16.679 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -36.324 35.647 17.022 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -35.190 36.487 18.106 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -35.805 37.308 16.652 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -35.579 34.910 14.757 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -35.054 36.570 14.386 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -33.909 35.217 14.224 1.00 0.00 H new ATOM 103 N PRO A 9 -30.828 36.880 15.605 1.00 0.00 N ATOM 104 CA PRO A 9 -29.529 36.360 15.085 1.00 0.00 C ATOM 105 C PRO A 9 -28.951 35.261 16.000 1.00 0.00 C ATOM 106 O PRO A 9 -28.543 35.549 17.124 1.00 0.00 O ATOM 107 CB PRO A 9 -28.613 37.608 15.053 1.00 0.00 C ATOM 108 CG PRO A 9 -29.265 38.598 15.964 1.00 0.00 C ATOM 109 CD PRO A 9 -30.763 38.321 15.872 1.00 0.00 C ATOM 0 HA PRO A 9 -29.631 35.891 14.107 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -27.606 37.366 15.392 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -28.523 38.004 14.042 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -28.908 38.483 16.987 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -29.036 39.619 15.660 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -31.277 38.582 16.797 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -31.230 38.899 15.074 1.00 0.00 H new ATOM 117 N PRO A 10 -28.894 34.023 15.551 1.00 0.00 N ATOM 118 CA PRO A 10 -28.331 32.905 16.374 1.00 0.00 C ATOM 119 C PRO A 10 -26.923 33.219 16.890 1.00 0.00 C ATOM 120 O PRO A 10 -26.115 33.832 16.191 1.00 0.00 O ATOM 121 CB PRO A 10 -28.301 31.710 15.398 1.00 0.00 C ATOM 122 CG PRO A 10 -29.324 32.023 14.355 1.00 0.00 C ATOM 123 CD PRO A 10 -29.367 33.546 14.238 1.00 0.00 C ATOM 0 HA PRO A 10 -28.926 32.718 17.268 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -27.312 31.590 14.955 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -28.536 30.778 15.911 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -29.058 31.567 13.401 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -30.300 31.627 14.637 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -28.727 33.902 13.431 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -30.375 33.901 14.025 1.00 0.00 H new ATOM 131 N ALA A 11 -26.640 32.788 18.117 1.00 0.00 N ATOM 132 CA ALA A 11 -25.330 33.016 18.719 1.00 0.00 C ATOM 133 C ALA A 11 -24.331 31.983 18.211 1.00 0.00 C ATOM 134 O ALA A 11 -24.708 31.013 17.553 1.00 0.00 O ATOM 135 CB ALA A 11 -25.430 32.927 20.243 1.00 0.00 C ATOM 0 H ALA A 11 -27.297 32.282 18.711 1.00 0.00 H new ATOM 0 HA ALA A 11 -24.987 34.012 18.439 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -24.447 33.099 20.683 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -26.127 33.682 20.607 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -25.787 31.937 20.527 1.00 0.00 H new ATOM 141 N ALA A 12 -23.053 32.196 18.521 1.00 0.00 N ATOM 142 CA ALA A 12 -21.997 31.278 18.093 1.00 0.00 C ATOM 143 C ALA A 12 -20.933 31.155 19.179 1.00 0.00 C ATOM 144 O ALA A 12 -19.829 31.686 19.046 1.00 0.00 O ATOM 145 CB ALA A 12 -21.356 31.790 16.801 1.00 0.00 C ATOM 0 H ALA A 12 -22.724 32.993 19.065 1.00 0.00 H new ATOM 0 HA ALA A 12 -22.437 30.297 17.915 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -20.571 31.102 16.487 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -22.114 31.856 16.020 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -20.927 32.777 16.974 1.00 0.00 H new ATOM 151 N PRO A 13 -21.248 30.461 20.244 1.00 0.00 N ATOM 152 CA PRO A 13 -20.305 30.249 21.383 1.00 0.00 C ATOM 153 C PRO A 13 -19.025 29.537 20.935 1.00 0.00 C ATOM 154 O PRO A 13 -19.056 28.681 20.051 1.00 0.00 O ATOM 155 CB PRO A 13 -21.111 29.387 22.380 1.00 0.00 C ATOM 156 CG PRO A 13 -22.545 29.569 21.990 1.00 0.00 C ATOM 157 CD PRO A 13 -22.541 29.807 20.481 1.00 0.00 C ATOM 0 HA PRO A 13 -19.967 31.189 21.820 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -20.817 28.339 22.321 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -20.939 29.709 23.407 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.134 28.688 22.245 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -22.989 30.413 22.517 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -22.626 28.873 19.926 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -23.374 30.439 20.171 1.00 0.00 H new ATOM 165 N ALA A 14 -17.904 29.898 21.556 1.00 0.00 N ATOM 166 CA ALA A 14 -16.618 29.293 21.223 1.00 0.00 C ATOM 167 C ALA A 14 -16.359 28.086 22.112 1.00 0.00 C ATOM 168 O ALA A 14 -16.926 27.970 23.200 1.00 0.00 O ATOM 169 CB ALA A 14 -15.497 30.316 21.413 1.00 0.00 C ATOM 0 H ALA A 14 -17.861 30.605 22.290 1.00 0.00 H new ATOM 0 HA ALA A 14 -16.643 28.971 20.182 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -14.540 29.858 21.163 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -15.671 31.172 20.761 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -15.480 30.648 22.451 1.00 0.00 H new ATOM 175 N GLY A 15 -15.505 27.187 21.642 1.00 0.00 N ATOM 176 CA GLY A 15 -15.181 25.990 22.401 1.00 0.00 C ATOM 177 C GLY A 15 -14.294 26.326 23.593 1.00 0.00 C ATOM 178 O GLY A 15 -13.685 27.396 23.646 1.00 0.00 O ATOM 0 H GLY A 15 -15.027 27.264 20.744 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -16.099 25.515 22.748 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -14.674 25.272 21.756 1.00 0.00 H new ATOM 182 N GLU A 16 -14.221 25.406 24.551 1.00 0.00 N ATOM 183 CA GLU A 16 -13.406 25.615 25.742 1.00 0.00 C ATOM 184 C GLU A 16 -11.940 25.314 25.445 1.00 0.00 C ATOM 185 O GLU A 16 -11.625 24.465 24.611 1.00 0.00 O ATOM 186 CB GLU A 16 -13.899 24.715 26.883 1.00 0.00 C ATOM 187 CG GLU A 16 -15.304 25.146 27.333 1.00 0.00 C ATOM 188 CD GLU A 16 -16.363 24.579 26.390 1.00 0.00 C ATOM 189 OE1 GLU A 16 -15.986 23.978 25.399 1.00 0.00 O ATOM 190 OE2 GLU A 16 -17.537 24.757 26.675 1.00 0.00 O ATOM 0 H GLU A 16 -14.714 24.513 24.526 1.00 0.00 H new ATOM 0 HA GLU A 16 -13.497 26.659 26.044 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -13.918 23.676 26.554 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -13.207 24.770 27.724 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -15.490 24.799 28.349 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -15.369 26.234 27.351 1.00 0.00 H new ATOM 197 N GLY A 17 -11.051 26.020 26.134 1.00 0.00 N ATOM 198 CA GLY A 17 -9.620 25.824 25.940 1.00 0.00 C ATOM 199 C GLY A 17 -9.163 24.517 26.570 1.00 0.00 C ATOM 200 O GLY A 17 -8.017 24.101 26.398 1.00 0.00 O ATOM 0 H GLY A 17 -11.294 26.728 26.827 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -9.390 25.819 24.874 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -9.071 26.657 26.380 1.00 0.00 H new ATOM 204 N GLY A 18 -10.066 23.871 27.298 1.00 0.00 N ATOM 205 CA GLY A 18 -9.747 22.607 27.947 1.00 0.00 C ATOM 206 C GLY A 18 -9.021 21.671 26.986 1.00 0.00 C ATOM 207 O GLY A 18 -7.815 21.454 27.111 1.00 0.00 O ATOM 0 H GLY A 18 -11.019 24.200 27.453 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.125 22.790 28.823 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.663 22.133 28.300 1.00 0.00 H new ATOM 211 N PRO A 19 -9.734 21.115 26.036 1.00 0.00 N ATOM 212 CA PRO A 19 -9.149 20.175 25.034 1.00 0.00 C ATOM 213 C PRO A 19 -8.018 20.843 24.223 1.00 0.00 C ATOM 214 O PRO A 19 -8.280 21.753 23.437 1.00 0.00 O ATOM 215 CB PRO A 19 -10.348 19.795 24.131 1.00 0.00 C ATOM 216 CG PRO A 19 -11.384 20.846 24.376 1.00 0.00 C ATOM 217 CD PRO A 19 -11.169 21.327 25.812 1.00 0.00 C ATOM 0 HA PRO A 19 -8.687 19.305 25.500 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -10.056 19.770 23.081 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -10.728 18.804 24.380 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -11.279 21.669 23.669 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -12.388 20.441 24.247 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -11.442 22.376 25.929 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -11.773 20.759 26.520 1.00 0.00 H new ATOM 225 N PRO A 20 -6.778 20.415 24.383 1.00 0.00 N ATOM 226 CA PRO A 20 -5.628 21.003 23.624 1.00 0.00 C ATOM 227 C PRO A 20 -5.881 21.019 22.112 1.00 0.00 C ATOM 228 O PRO A 20 -6.449 20.081 21.554 1.00 0.00 O ATOM 229 CB PRO A 20 -4.447 20.076 23.972 1.00 0.00 C ATOM 230 CG PRO A 20 -4.810 19.444 25.278 1.00 0.00 C ATOM 231 CD PRO A 20 -6.334 19.354 25.306 1.00 0.00 C ATOM 0 HA PRO A 20 -5.452 22.045 23.893 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -4.298 19.322 23.199 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -3.517 20.638 24.053 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -4.361 18.455 25.369 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -4.441 20.039 26.113 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -6.681 18.373 24.981 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -6.724 19.513 26.312 1.00 0.00 H new ATOM 239 N ALA A 21 -5.454 22.101 21.461 1.00 0.00 N ATOM 240 CA ALA A 21 -5.637 22.244 20.021 1.00 0.00 C ATOM 241 C ALA A 21 -5.174 20.973 19.292 1.00 0.00 C ATOM 242 O ALA A 21 -4.341 20.225 19.806 1.00 0.00 O ATOM 243 CB ALA A 21 -4.846 23.471 19.516 1.00 0.00 C ATOM 0 H ALA A 21 -4.981 22.887 21.908 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.696 22.392 19.811 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.984 23.575 18.440 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.208 24.369 20.017 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -3.787 23.336 19.734 1.00 0.00 H new ATOM 249 N PRO A 22 -5.694 20.724 18.109 1.00 0.00 N ATOM 250 CA PRO A 22 -5.328 19.533 17.300 1.00 0.00 C ATOM 251 C PRO A 22 -3.842 19.171 17.454 1.00 0.00 C ATOM 252 O PRO A 22 -2.984 19.805 16.843 1.00 0.00 O ATOM 253 CB PRO A 22 -5.647 19.969 15.864 1.00 0.00 C ATOM 254 CG PRO A 22 -6.761 20.972 15.989 1.00 0.00 C ATOM 255 CD PRO A 22 -6.692 21.554 17.416 1.00 0.00 C ATOM 0 HA PRO A 22 -5.868 18.637 17.607 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.773 20.410 15.384 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -5.951 19.119 15.254 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -6.653 21.762 15.246 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -7.727 20.498 15.813 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -6.395 22.603 17.402 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -7.662 21.504 17.911 1.00 0.00 H new ATOM 263 N PRO A 23 -3.517 18.186 18.259 1.00 0.00 N ATOM 264 CA PRO A 23 -2.101 17.786 18.473 1.00 0.00 C ATOM 265 C PRO A 23 -1.559 16.922 17.327 1.00 0.00 C ATOM 266 O PRO A 23 -2.330 16.401 16.518 1.00 0.00 O ATOM 267 CB PRO A 23 -2.145 17.007 19.799 1.00 0.00 C ATOM 268 CG PRO A 23 -3.543 16.461 19.906 1.00 0.00 C ATOM 269 CD PRO A 23 -4.448 17.357 19.046 1.00 0.00 C ATOM 0 HA PRO A 23 -1.429 18.643 18.504 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.409 16.203 19.805 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -1.913 17.657 20.643 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.581 15.429 19.558 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -3.877 16.460 20.944 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -5.093 16.763 18.399 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -5.099 17.973 19.666 1.00 0.00 H new ATOM 277 N PRO A 24 -0.259 16.743 17.254 1.00 0.00 N ATOM 278 CA PRO A 24 0.368 15.898 16.195 1.00 0.00 C ATOM 279 C PRO A 24 -0.316 14.531 16.080 1.00 0.00 C ATOM 280 O PRO A 24 -0.605 13.885 17.089 1.00 0.00 O ATOM 281 CB PRO A 24 1.825 15.736 16.671 1.00 0.00 C ATOM 282 CG PRO A 24 2.098 16.923 17.544 1.00 0.00 C ATOM 283 CD PRO A 24 0.754 17.341 18.154 1.00 0.00 C ATOM 0 HA PRO A 24 0.285 16.350 15.206 1.00 0.00 H new ATOM 0 HB2 PRO A 24 1.956 14.805 17.223 1.00 0.00 H new ATOM 0 HB3 PRO A 24 2.512 15.705 15.826 1.00 0.00 H new ATOM 0 HG2 PRO A 24 2.816 16.672 18.325 1.00 0.00 H new ATOM 0 HG3 PRO A 24 2.530 17.739 16.964 1.00 0.00 H new ATOM 0 HD2 PRO A 24 0.648 16.971 19.174 1.00 0.00 H new ATOM 0 HD3 PRO A 24 0.657 18.426 18.197 1.00 0.00 H new ATOM 291 N ASN A 25 -0.569 14.103 14.844 1.00 0.00 N ATOM 292 CA ASN A 25 -1.218 12.815 14.590 1.00 0.00 C ATOM 293 C ASN A 25 -0.226 11.829 13.982 1.00 0.00 C ATOM 294 O ASN A 25 0.464 12.143 13.010 1.00 0.00 O ATOM 295 CB ASN A 25 -2.394 13.010 13.632 1.00 0.00 C ATOM 296 CG ASN A 25 -3.441 13.917 14.274 1.00 0.00 C ATOM 297 OD1 ASN A 25 -3.515 13.998 15.574 1.00 0.00 O flip ATOM 298 ND2 ASN A 25 -4.209 14.570 13.569 1.00 0.00 N flip ATOM 0 H ASN A 25 -0.335 14.629 14.002 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.579 12.414 15.537 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.044 13.448 12.697 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -2.838 12.045 13.385 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.149 14.505 12.553 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -4.906 15.177 14.001 1.00 0.00 H new ATOM 305 N LEU A 26 -0.164 10.637 14.562 1.00 0.00 N ATOM 306 CA LEU A 26 0.740 9.601 14.077 1.00 0.00 C ATOM 307 C LEU A 26 0.358 9.179 12.665 1.00 0.00 C ATOM 308 O LEU A 26 1.222 8.910 11.832 1.00 0.00 O ATOM 309 CB LEU A 26 0.692 8.389 15.010 1.00 0.00 C ATOM 310 CG LEU A 26 0.938 8.838 16.456 1.00 0.00 C ATOM 311 CD1 LEU A 26 0.832 7.626 17.387 1.00 0.00 C ATOM 312 CD2 LEU A 26 2.335 9.472 16.582 1.00 0.00 C ATOM 0 H LEU A 26 -0.727 10.364 15.367 1.00 0.00 H new ATOM 0 HA LEU A 26 1.753 10.004 14.060 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.277 7.896 14.932 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.445 7.659 14.713 1.00 0.00 H new ATOM 0 HG LEU A 26 0.190 9.580 16.735 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.006 7.941 18.416 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.164 7.190 17.305 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.578 6.883 17.104 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.500 9.787 17.612 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.093 8.741 16.301 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.403 10.337 15.922 1.00 0.00 H new ATOM 324 N THR A 27 -0.943 9.114 12.406 1.00 0.00 N ATOM 325 CA THR A 27 -1.429 8.714 11.092 1.00 0.00 C ATOM 326 C THR A 27 -0.856 9.628 10.013 1.00 0.00 C ATOM 327 O THR A 27 -0.499 9.171 8.927 1.00 0.00 O ATOM 328 CB THR A 27 -2.956 8.783 11.057 1.00 0.00 C ATOM 329 OG1 THR A 27 -3.367 10.142 11.138 1.00 0.00 O ATOM 330 CG2 THR A 27 -3.531 8.007 12.242 1.00 0.00 C ATOM 0 H THR A 27 -1.675 9.331 13.083 1.00 0.00 H new ATOM 0 HA THR A 27 -1.106 7.691 10.901 1.00 0.00 H new ATOM 0 HB THR A 27 -3.319 8.345 10.127 1.00 0.00 H new ATOM 0 HG1 THR A 27 -4.346 10.190 11.114 1.00 0.00 H new ATOM 0 HG21 THR A 27 -4.620 8.057 12.216 1.00 0.00 H new ATOM 0 HG22 THR A 27 -3.214 6.966 12.183 1.00 0.00 H new ATOM 0 HG23 THR A 27 -3.170 8.444 13.173 1.00 0.00 H new ATOM 338 N SER A 28 -0.768 10.919 10.317 1.00 0.00 N ATOM 339 CA SER A 28 -0.234 11.879 9.358 1.00 0.00 C ATOM 340 C SER A 28 1.256 11.642 9.143 1.00 0.00 C ATOM 341 O SER A 28 2.021 11.535 10.102 1.00 0.00 O ATOM 342 CB SER A 28 -0.455 13.302 9.871 1.00 0.00 C ATOM 343 OG SER A 28 0.036 14.230 8.912 1.00 0.00 O ATOM 0 H SER A 28 -1.056 11.321 11.209 1.00 0.00 H new ATOM 0 HA SER A 28 -0.754 11.749 8.409 1.00 0.00 H new ATOM 0 HB2 SER A 28 -1.516 13.475 10.051 1.00 0.00 H new ATOM 0 HB3 SER A 28 0.057 13.441 10.823 1.00 0.00 H new ATOM 0 HG SER A 28 -0.106 15.143 9.238 1.00 0.00 H new ATOM 349 N ASN A 29 1.663 11.565 7.879 1.00 0.00 N ATOM 350 CA ASN A 29 3.067 11.343 7.545 1.00 0.00 C ATOM 351 C ASN A 29 3.278 11.424 6.036 1.00 0.00 C ATOM 352 O ASN A 29 3.708 10.456 5.408 1.00 0.00 O ATOM 353 CB ASN A 29 3.516 9.970 8.050 1.00 0.00 C ATOM 354 CG ASN A 29 2.651 8.880 7.431 1.00 0.00 C ATOM 355 OD1 ASN A 29 1.922 9.132 6.472 1.00 0.00 O ATOM 356 ND2 ASN A 29 2.685 7.673 7.927 1.00 0.00 N ATOM 0 H ASN A 29 1.044 11.652 7.073 1.00 0.00 H new ATOM 0 HA ASN A 29 3.661 12.119 8.027 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.563 9.804 7.795 1.00 0.00 H new ATOM 0 HB3 ASN A 29 3.442 9.931 9.137 1.00 0.00 H new ATOM 0 HD21 ASN A 29 2.107 6.938 7.520 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.290 7.465 8.722 1.00 0.00 H new ATOM 363 N ARG A 30 2.975 12.582 5.460 1.00 0.00 N ATOM 364 CA ARG A 30 3.139 12.777 4.021 1.00 0.00 C ATOM 365 C ARG A 30 4.598 13.063 3.680 1.00 0.00 C ATOM 366 O ARG A 30 5.479 12.955 4.535 1.00 0.00 O ATOM 367 CB ARG A 30 2.258 13.933 3.542 1.00 0.00 C ATOM 368 CG ARG A 30 0.785 13.524 3.629 1.00 0.00 C ATOM 369 CD ARG A 30 -0.094 14.679 3.145 1.00 0.00 C ATOM 370 NE ARG A 30 -0.058 15.780 4.100 1.00 0.00 N ATOM 371 CZ ARG A 30 -0.694 16.921 3.854 1.00 0.00 C ATOM 372 NH1 ARG A 30 -1.355 17.073 2.740 1.00 0.00 N ATOM 373 NH2 ARG A 30 -0.654 17.890 4.728 1.00 0.00 N ATOM 0 H ARG A 30 2.617 13.395 5.961 1.00 0.00 H new ATOM 0 HA ARG A 30 2.835 11.861 3.514 1.00 0.00 H new ATOM 0 HB2 ARG A 30 2.437 14.818 4.153 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.513 14.197 2.516 1.00 0.00 H new ATOM 0 HG2 ARG A 30 0.606 12.637 3.021 1.00 0.00 H new ATOM 0 HG3 ARG A 30 0.529 13.263 4.656 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.251 15.023 2.170 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -1.120 14.334 3.016 1.00 0.00 H new ATOM 0 HE ARG A 30 0.463 15.673 4.970 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.384 16.316 2.057 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -1.843 17.949 2.552 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -0.135 17.771 5.598 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -1.141 18.766 4.541 1.00 0.00 H new ATOM 387 N ARG A 31 4.845 13.427 2.425 1.00 0.00 N ATOM 388 CA ARG A 31 6.198 13.723 1.970 1.00 0.00 C ATOM 389 C ARG A 31 6.621 15.115 2.416 1.00 0.00 C ATOM 390 O ARG A 31 7.530 15.713 1.842 1.00 0.00 O ATOM 391 CB ARG A 31 6.278 13.632 0.446 1.00 0.00 C ATOM 392 CG ARG A 31 6.025 12.191 0.002 1.00 0.00 C ATOM 393 CD ARG A 31 6.042 12.118 -1.526 1.00 0.00 C ATOM 394 NE ARG A 31 7.379 12.412 -2.030 1.00 0.00 N ATOM 395 CZ ARG A 31 7.614 12.515 -3.335 1.00 0.00 C ATOM 396 NH1 ARG A 31 6.640 12.363 -4.188 1.00 0.00 N ATOM 397 NH2 ARG A 31 8.822 12.769 -3.761 1.00 0.00 N ATOM 0 H ARG A 31 4.127 13.524 1.707 1.00 0.00 H new ATOM 0 HA ARG A 31 6.871 12.988 2.411 1.00 0.00 H new ATOM 0 HB2 ARG A 31 5.542 14.297 -0.007 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.259 13.961 0.103 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.788 11.532 0.417 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.064 11.845 0.383 1.00 0.00 H new ATOM 0 HD2 ARG A 31 5.732 11.126 -1.853 1.00 0.00 H new ATOM 0 HD3 ARG A 31 5.326 12.828 -1.939 1.00 0.00 H new ATOM 0 HE ARG A 31 8.146 12.541 -1.371 1.00 0.00 H new ATOM 0 HH11 ARG A 31 5.697 12.165 -3.855 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.821 12.442 -5.189 1.00 0.00 H new ATOM 0 HH21 ARG A 31 9.584 12.888 -3.093 1.00 0.00 H new ATOM 0 HH22 ARG A 31 9.004 12.848 -4.762 1.00 0.00 H new ATOM 411 N LEU A 32 5.954 15.626 3.439 1.00 0.00 N ATOM 412 CA LEU A 32 6.268 16.950 3.955 1.00 0.00 C ATOM 413 C LEU A 32 7.761 17.074 4.241 1.00 0.00 C ATOM 414 O LEU A 32 8.350 18.142 4.066 1.00 0.00 O ATOM 415 CB LEU A 32 5.475 17.200 5.245 1.00 0.00 C ATOM 416 CG LEU A 32 5.876 16.163 6.341 1.00 0.00 C ATOM 417 CD1 LEU A 32 6.852 16.789 7.354 1.00 0.00 C ATOM 418 CD2 LEU A 32 4.627 15.675 7.095 1.00 0.00 C ATOM 0 H LEU A 32 5.196 15.148 3.926 1.00 0.00 H new ATOM 0 HA LEU A 32 5.993 17.692 3.205 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.664 18.211 5.606 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.406 17.129 5.042 1.00 0.00 H new ATOM 0 HG LEU A 32 6.361 15.323 5.844 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.118 16.049 8.108 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.753 17.118 6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.377 17.644 7.836 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.921 14.952 7.856 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.135 16.523 7.571 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.939 15.203 6.393 1.00 0.00 H new ATOM 430 N GLN A 33 8.368 15.977 4.686 1.00 0.00 N ATOM 431 CA GLN A 33 9.794 15.976 4.996 1.00 0.00 C ATOM 432 C GLN A 33 10.599 16.406 3.775 1.00 0.00 C ATOM 433 O GLN A 33 11.752 16.821 3.894 1.00 0.00 O ATOM 434 CB GLN A 33 10.235 14.578 5.438 1.00 0.00 C ATOM 435 CG GLN A 33 9.585 14.233 6.778 1.00 0.00 C ATOM 436 CD GLN A 33 9.995 12.831 7.213 1.00 0.00 C ATOM 437 OE1 GLN A 33 10.843 12.204 6.575 1.00 0.00 O ATOM 438 NE2 GLN A 33 9.436 12.293 8.263 1.00 0.00 N ATOM 0 H GLN A 33 7.899 15.084 4.839 1.00 0.00 H new ATOM 0 HA GLN A 33 9.974 16.681 5.807 1.00 0.00 H new ATOM 0 HB2 GLN A 33 9.952 13.842 4.685 1.00 0.00 H new ATOM 0 HB3 GLN A 33 11.321 14.540 5.529 1.00 0.00 H new ATOM 0 HG2 GLN A 33 9.884 14.959 7.534 1.00 0.00 H new ATOM 0 HG3 GLN A 33 8.500 14.293 6.691 1.00 0.00 H new ATOM 0 HE21 GLN A 33 8.734 12.813 8.790 1.00 0.00 H new ATOM 0 HE22 GLN A 33 9.701 11.353 8.556 1.00 0.00 H new ATOM 447 N GLN A 34 9.985 16.296 2.604 1.00 0.00 N ATOM 448 CA GLN A 34 10.648 16.671 1.365 1.00 0.00 C ATOM 449 C GLN A 34 10.930 18.170 1.335 1.00 0.00 C ATOM 450 O GLN A 34 11.811 18.627 0.605 1.00 0.00 O ATOM 451 CB GLN A 34 9.774 16.295 0.166 1.00 0.00 C ATOM 452 CG GLN A 34 10.526 16.597 -1.132 1.00 0.00 C ATOM 453 CD GLN A 34 9.724 16.094 -2.330 1.00 0.00 C ATOM 454 OE1 GLN A 34 8.827 15.266 -2.172 1.00 0.00 O ATOM 455 NE2 GLN A 34 9.995 16.548 -3.523 1.00 0.00 N ATOM 0 H GLN A 34 9.032 15.951 2.488 1.00 0.00 H new ATOM 0 HA GLN A 34 11.594 16.133 1.310 1.00 0.00 H new ATOM 0 HB2 GLN A 34 9.514 15.237 0.210 1.00 0.00 H new ATOM 0 HB3 GLN A 34 8.839 16.854 0.195 1.00 0.00 H new ATOM 0 HG2 GLN A 34 10.696 17.670 -1.222 1.00 0.00 H new ATOM 0 HG3 GLN A 34 11.506 16.120 -1.114 1.00 0.00 H new ATOM 0 HE21 GLN A 34 10.739 17.234 -3.651 1.00 0.00 H new ATOM 0 HE22 GLN A 34 9.463 16.217 -4.328 1.00 0.00 H new ATOM 464 N THR A 35 10.179 18.935 2.123 1.00 0.00 N ATOM 465 CA THR A 35 10.362 20.376 2.162 1.00 0.00 C ATOM 466 C THR A 35 11.707 20.723 2.805 1.00 0.00 C ATOM 467 O THR A 35 12.438 19.845 3.263 1.00 0.00 O ATOM 468 CB THR A 35 9.205 21.020 2.955 1.00 0.00 C ATOM 469 OG1 THR A 35 8.054 20.191 2.859 1.00 0.00 O ATOM 470 CG2 THR A 35 8.865 22.418 2.408 1.00 0.00 C ATOM 0 H THR A 35 9.445 18.581 2.737 1.00 0.00 H new ATOM 0 HA THR A 35 10.358 20.766 1.144 1.00 0.00 H new ATOM 0 HB THR A 35 9.517 21.122 3.994 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.002 19.611 3.647 1.00 0.00 H new ATOM 0 HG21 THR A 35 8.046 22.846 2.987 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.741 23.062 2.487 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.567 22.337 1.363 1.00 0.00 H new ATOM 478 N GLN A 36 12.012 22.011 2.835 1.00 0.00 N ATOM 479 CA GLN A 36 13.259 22.487 3.421 1.00 0.00 C ATOM 480 C GLN A 36 13.193 22.415 4.941 1.00 0.00 C ATOM 481 O GLN A 36 14.202 22.588 5.623 1.00 0.00 O ATOM 482 CB GLN A 36 13.526 23.931 2.985 1.00 0.00 C ATOM 483 CG GLN A 36 13.845 23.967 1.488 1.00 0.00 C ATOM 484 CD GLN A 36 12.584 23.677 0.681 1.00 0.00 C ATOM 485 OE1 GLN A 36 12.381 22.551 0.229 1.00 0.00 O ATOM 486 NE2 GLN A 36 11.720 24.632 0.474 1.00 0.00 N ATOM 0 H GLN A 36 11.414 22.747 2.461 1.00 0.00 H new ATOM 0 HA GLN A 36 14.071 21.849 3.072 1.00 0.00 H new ATOM 0 HB2 GLN A 36 12.655 24.552 3.196 1.00 0.00 H new ATOM 0 HB3 GLN A 36 14.358 24.345 3.554 1.00 0.00 H new ATOM 0 HG2 GLN A 36 14.245 24.944 1.216 1.00 0.00 H new ATOM 0 HG3 GLN A 36 14.614 23.231 1.254 1.00 0.00 H new ATOM 0 HE21 GLN A 36 11.891 25.565 0.850 1.00 0.00 H new ATOM 0 HE22 GLN A 36 10.873 24.446 -0.064 1.00 0.00 H new ATOM 495 N ALA A 37 12.000 22.162 5.468 1.00 0.00 N ATOM 496 CA ALA A 37 11.821 22.074 6.910 1.00 0.00 C ATOM 497 C ALA A 37 12.843 21.119 7.515 1.00 0.00 C ATOM 498 O ALA A 37 13.479 21.431 8.520 1.00 0.00 O ATOM 499 CB ALA A 37 10.410 21.576 7.232 1.00 0.00 C ATOM 0 H ALA A 37 11.150 22.016 4.923 1.00 0.00 H new ATOM 0 HA ALA A 37 11.964 23.067 7.337 1.00 0.00 H new ATOM 0 HB1 ALA A 37 10.284 21.513 8.313 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.677 22.270 6.821 1.00 0.00 H new ATOM 0 HB3 ALA A 37 10.263 20.590 6.792 1.00 0.00 H new ATOM 505 N GLN A 38 12.998 19.953 6.896 1.00 0.00 N ATOM 506 CA GLN A 38 13.947 18.963 7.388 1.00 0.00 C ATOM 507 C GLN A 38 15.375 19.488 7.270 1.00 0.00 C ATOM 508 O GLN A 38 16.200 19.279 8.160 1.00 0.00 O ATOM 509 CB GLN A 38 13.811 17.663 6.588 1.00 0.00 C ATOM 510 CG GLN A 38 14.672 16.564 7.222 1.00 0.00 C ATOM 511 CD GLN A 38 14.133 16.213 8.605 1.00 0.00 C ATOM 512 OE1 GLN A 38 12.918 16.163 8.804 1.00 0.00 O ATOM 513 NE2 GLN A 38 14.965 15.973 9.579 1.00 0.00 N ATOM 0 H GLN A 38 12.484 19.673 6.061 1.00 0.00 H new ATOM 0 HA GLN A 38 13.728 18.767 8.438 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.767 17.349 6.563 1.00 0.00 H new ATOM 0 HB3 GLN A 38 14.119 17.828 5.556 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.672 15.678 6.587 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.706 16.900 7.300 1.00 0.00 H new ATOM 0 HE21 GLN A 38 15.970 16.015 9.413 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.611 15.743 10.508 1.00 0.00 H new ATOM 522 N VAL A 39 15.660 20.169 6.166 1.00 0.00 N ATOM 523 CA VAL A 39 16.994 20.717 5.942 1.00 0.00 C ATOM 524 C VAL A 39 17.332 21.743 7.019 1.00 0.00 C ATOM 525 O VAL A 39 18.438 21.752 7.557 1.00 0.00 O ATOM 526 CB VAL A 39 17.065 21.374 4.559 1.00 0.00 C ATOM 527 CG1 VAL A 39 18.407 22.095 4.393 1.00 0.00 C ATOM 528 CG2 VAL A 39 16.934 20.298 3.480 1.00 0.00 C ATOM 0 H VAL A 39 14.992 20.354 5.418 1.00 0.00 H new ATOM 0 HA VAL A 39 17.718 19.904 5.990 1.00 0.00 H new ATOM 0 HB VAL A 39 16.254 22.096 4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 39 18.451 22.560 3.408 1.00 0.00 H new ATOM 0 HG12 VAL A 39 18.505 22.862 5.161 1.00 0.00 H new ATOM 0 HG13 VAL A 39 19.221 21.377 4.492 1.00 0.00 H new ATOM 0 HG21 VAL A 39 16.984 20.762 2.495 1.00 0.00 H new ATOM 0 HG22 VAL A 39 17.746 19.578 3.584 1.00 0.00 H new ATOM 0 HG23 VAL A 39 15.978 19.786 3.591 1.00 0.00 H new ATOM 538 N ASP A 40 16.371 22.606 7.327 1.00 0.00 N ATOM 539 CA ASP A 40 16.580 23.634 8.339 1.00 0.00 C ATOM 540 C ASP A 40 17.220 23.041 9.587 1.00 0.00 C ATOM 541 O ASP A 40 17.820 23.757 10.388 1.00 0.00 O ATOM 542 CB ASP A 40 15.245 24.282 8.708 1.00 0.00 C ATOM 543 CG ASP A 40 15.485 25.552 9.516 1.00 0.00 C ATOM 544 OD1 ASP A 40 16.581 26.086 9.434 1.00 0.00 O ATOM 545 OD2 ASP A 40 14.573 25.973 10.208 1.00 0.00 O ATOM 0 H ASP A 40 15.447 22.615 6.895 1.00 0.00 H new ATOM 0 HA ASP A 40 17.250 24.388 7.927 1.00 0.00 H new ATOM 0 HB2 ASP A 40 14.684 24.518 7.804 1.00 0.00 H new ATOM 0 HB3 ASP A 40 14.640 23.583 9.286 1.00 0.00 H new ATOM 550 N GLU A 41 17.089 21.726 9.751 1.00 0.00 N ATOM 551 CA GLU A 41 17.660 21.042 10.909 1.00 0.00 C ATOM 552 C GLU A 41 19.054 20.515 10.579 1.00 0.00 C ATOM 553 O GLU A 41 19.956 20.562 11.413 1.00 0.00 O ATOM 554 CB GLU A 41 16.756 19.876 11.318 1.00 0.00 C ATOM 555 CG GLU A 41 15.397 20.420 11.775 1.00 0.00 C ATOM 556 CD GLU A 41 15.561 21.236 13.052 1.00 0.00 C ATOM 557 OE1 GLU A 41 16.566 21.059 13.722 1.00 0.00 O ATOM 558 OE2 GLU A 41 14.680 22.027 13.345 1.00 0.00 O ATOM 0 H GLU A 41 16.595 21.116 9.100 1.00 0.00 H new ATOM 0 HA GLU A 41 17.736 21.752 11.733 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.623 19.193 10.479 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.221 19.306 12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.963 21.041 10.991 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.706 19.595 11.948 1.00 0.00 H new ATOM 565 N VAL A 42 19.222 20.022 9.358 1.00 0.00 N ATOM 566 CA VAL A 42 20.512 19.493 8.927 1.00 0.00 C ATOM 567 C VAL A 42 21.565 20.599 8.896 1.00 0.00 C ATOM 568 O VAL A 42 22.702 20.398 9.319 1.00 0.00 O ATOM 569 CB VAL A 42 20.386 18.860 7.537 1.00 0.00 C ATOM 570 CG1 VAL A 42 21.770 18.446 7.029 1.00 0.00 C ATOM 571 CG2 VAL A 42 19.485 17.626 7.618 1.00 0.00 C ATOM 0 H VAL A 42 18.487 19.977 8.652 1.00 0.00 H new ATOM 0 HA VAL A 42 20.825 18.732 9.641 1.00 0.00 H new ATOM 0 HB VAL A 42 19.952 19.586 6.850 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.675 17.996 6.041 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.413 19.324 6.968 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.208 17.722 7.716 1.00 0.00 H new ATOM 0 HG21 VAL A 42 19.395 17.176 6.629 1.00 0.00 H new ATOM 0 HG22 VAL A 42 19.920 16.903 8.308 1.00 0.00 H new ATOM 0 HG23 VAL A 42 18.497 17.919 7.974 1.00 0.00 H new ATOM 581 N VAL A 43 21.180 21.760 8.379 1.00 0.00 N ATOM 582 CA VAL A 43 22.104 22.884 8.280 1.00 0.00 C ATOM 583 C VAL A 43 22.705 23.198 9.638 1.00 0.00 C ATOM 584 O VAL A 43 23.893 23.505 9.758 1.00 0.00 O ATOM 585 CB VAL A 43 21.359 24.112 7.757 1.00 0.00 C ATOM 586 CG1 VAL A 43 20.407 24.658 8.828 1.00 0.00 C ATOM 587 CG2 VAL A 43 22.366 25.190 7.354 1.00 0.00 C ATOM 0 H VAL A 43 20.242 21.947 8.024 1.00 0.00 H new ATOM 0 HA VAL A 43 22.907 22.619 7.593 1.00 0.00 H new ATOM 0 HB VAL A 43 20.771 23.823 6.886 1.00 0.00 H new ATOM 0 HG11 VAL A 43 19.885 25.532 8.439 1.00 0.00 H new ATOM 0 HG12 VAL A 43 19.681 23.890 9.095 1.00 0.00 H new ATOM 0 HG13 VAL A 43 20.978 24.940 9.713 1.00 0.00 H new ATOM 0 HG21 VAL A 43 21.833 26.065 6.981 1.00 0.00 H new ATOM 0 HG22 VAL A 43 22.964 25.471 8.221 1.00 0.00 H new ATOM 0 HG23 VAL A 43 23.020 24.803 6.572 1.00 0.00 H new ATOM 597 N ASP A 44 21.870 23.124 10.656 1.00 0.00 N ATOM 598 CA ASP A 44 22.313 23.406 12.018 1.00 0.00 C ATOM 599 C ASP A 44 23.448 22.463 12.411 1.00 0.00 C ATOM 600 O ASP A 44 24.423 22.879 13.038 1.00 0.00 O ATOM 601 CB ASP A 44 21.152 23.246 13.007 1.00 0.00 C ATOM 602 CG ASP A 44 21.624 23.569 14.424 1.00 0.00 C ATOM 603 OD1 ASP A 44 22.813 23.776 14.599 1.00 0.00 O ATOM 604 OD2 ASP A 44 20.788 23.608 15.312 1.00 0.00 O ATOM 0 H ASP A 44 20.885 22.873 10.573 1.00 0.00 H new ATOM 0 HA ASP A 44 22.670 24.435 12.053 1.00 0.00 H new ATOM 0 HB2 ASP A 44 20.332 23.908 12.728 1.00 0.00 H new ATOM 0 HB3 ASP A 44 20.767 22.227 12.967 1.00 0.00 H new ATOM 609 N ILE A 45 23.314 21.194 12.038 1.00 0.00 N ATOM 610 CA ILE A 45 24.333 20.197 12.351 1.00 0.00 C ATOM 611 C ILE A 45 25.640 20.530 11.642 1.00 0.00 C ATOM 612 O ILE A 45 26.721 20.412 12.220 1.00 0.00 O ATOM 613 CB ILE A 45 23.855 18.808 11.926 1.00 0.00 C ATOM 614 CG1 ILE A 45 22.465 18.534 12.516 1.00 0.00 C ATOM 615 CG2 ILE A 45 24.844 17.747 12.417 1.00 0.00 C ATOM 616 CD1 ILE A 45 22.462 18.737 14.040 1.00 0.00 C ATOM 0 H ILE A 45 22.513 20.832 11.520 1.00 0.00 H new ATOM 0 HA ILE A 45 24.505 20.205 13.427 1.00 0.00 H new ATOM 0 HB ILE A 45 23.797 18.767 10.838 1.00 0.00 H new ATOM 0 HG12 ILE A 45 21.734 19.198 12.056 1.00 0.00 H new ATOM 0 HG13 ILE A 45 22.161 17.514 12.281 1.00 0.00 H new ATOM 0 HG21 ILE A 45 24.499 16.759 12.112 1.00 0.00 H new ATOM 0 HG22 ILE A 45 25.826 17.938 11.985 1.00 0.00 H new ATOM 0 HG23 ILE A 45 24.911 17.788 13.504 1.00 0.00 H new ATOM 0 HD11 ILE A 45 21.465 18.536 14.432 1.00 0.00 H new ATOM 0 HD12 ILE A 45 23.177 18.054 14.499 1.00 0.00 H new ATOM 0 HD13 ILE A 45 22.742 19.765 14.271 1.00 0.00 H new ATOM 628 N MET A 46 25.537 20.938 10.383 1.00 0.00 N ATOM 629 CA MET A 46 26.721 21.276 9.607 1.00 0.00 C ATOM 630 C MET A 46 27.525 22.369 10.303 1.00 0.00 C ATOM 631 O MET A 46 28.754 22.324 10.329 1.00 0.00 O ATOM 632 CB MET A 46 26.307 21.757 8.217 1.00 0.00 C ATOM 633 CG MET A 46 27.558 22.080 7.401 1.00 0.00 C ATOM 634 SD MET A 46 27.091 22.371 5.674 1.00 0.00 S ATOM 635 CE MET A 46 27.556 20.747 5.022 1.00 0.00 C ATOM 0 H MET A 46 24.654 21.042 9.882 1.00 0.00 H new ATOM 0 HA MET A 46 27.342 20.385 9.518 1.00 0.00 H new ATOM 0 HB2 MET A 46 25.719 20.989 7.714 1.00 0.00 H new ATOM 0 HB3 MET A 46 25.674 22.641 8.299 1.00 0.00 H new ATOM 0 HG2 MET A 46 28.054 22.961 7.809 1.00 0.00 H new ATOM 0 HG3 MET A 46 28.269 21.256 7.463 1.00 0.00 H new ATOM 0 HE1 MET A 46 27.347 20.711 3.953 1.00 0.00 H new ATOM 0 HE2 MET A 46 28.620 20.579 5.190 1.00 0.00 H new ATOM 0 HE3 MET A 46 26.982 19.973 5.530 1.00 0.00 H new ATOM 645 N ARG A 47 26.829 23.345 10.872 1.00 0.00 N ATOM 646 CA ARG A 47 27.499 24.436 11.566 1.00 0.00 C ATOM 647 C ARG A 47 28.279 23.908 12.769 1.00 0.00 C ATOM 648 O ARG A 47 29.386 24.365 13.053 1.00 0.00 O ATOM 649 CB ARG A 47 26.471 25.466 12.035 1.00 0.00 C ATOM 650 CG ARG A 47 25.921 26.222 10.824 1.00 0.00 C ATOM 651 CD ARG A 47 24.876 27.239 11.286 1.00 0.00 C ATOM 652 NE ARG A 47 24.366 27.991 10.147 1.00 0.00 N ATOM 653 CZ ARG A 47 23.396 28.889 10.294 1.00 0.00 C ATOM 654 NH1 ARG A 47 22.882 29.104 11.474 1.00 0.00 N ATOM 655 NH2 ARG A 47 22.960 29.553 9.261 1.00 0.00 N ATOM 0 H ARG A 47 25.811 23.404 10.867 1.00 0.00 H new ATOM 0 HA ARG A 47 28.196 24.908 10.874 1.00 0.00 H new ATOM 0 HB2 ARG A 47 25.659 24.970 12.567 1.00 0.00 H new ATOM 0 HB3 ARG A 47 26.932 26.163 12.735 1.00 0.00 H new ATOM 0 HG2 ARG A 47 26.731 26.730 10.301 1.00 0.00 H new ATOM 0 HG3 ARG A 47 25.475 25.522 10.117 1.00 0.00 H new ATOM 0 HD2 ARG A 47 24.056 26.726 11.788 1.00 0.00 H new ATOM 0 HD3 ARG A 47 25.318 27.921 12.012 1.00 0.00 H new ATOM 0 HE ARG A 47 24.760 27.826 9.221 1.00 0.00 H new ATOM 0 HH11 ARG A 47 23.224 28.584 12.282 1.00 0.00 H new ATOM 0 HH12 ARG A 47 22.138 29.792 11.589 1.00 0.00 H new ATOM 0 HH21 ARG A 47 23.363 29.384 8.339 1.00 0.00 H new ATOM 0 HH22 ARG A 47 22.216 30.242 9.374 1.00 0.00 H new ATOM 669 N VAL A 48 27.694 22.941 13.468 1.00 0.00 N ATOM 670 CA VAL A 48 28.338 22.357 14.636 1.00 0.00 C ATOM 671 C VAL A 48 29.629 21.650 14.237 1.00 0.00 C ATOM 672 O VAL A 48 30.650 21.772 14.914 1.00 0.00 O ATOM 673 CB VAL A 48 27.394 21.363 15.316 1.00 0.00 C ATOM 674 CG1 VAL A 48 28.117 20.680 16.480 1.00 0.00 C ATOM 675 CG2 VAL A 48 26.164 22.103 15.845 1.00 0.00 C ATOM 0 H VAL A 48 26.779 22.548 13.246 1.00 0.00 H new ATOM 0 HA VAL A 48 28.578 23.159 15.334 1.00 0.00 H new ATOM 0 HB VAL A 48 27.082 20.611 14.592 1.00 0.00 H new ATOM 0 HG11 VAL A 48 27.442 19.973 16.963 1.00 0.00 H new ATOM 0 HG12 VAL A 48 28.991 20.149 16.104 1.00 0.00 H new ATOM 0 HG13 VAL A 48 28.433 21.432 17.204 1.00 0.00 H new ATOM 0 HG21 VAL A 48 25.493 21.394 16.329 1.00 0.00 H new ATOM 0 HG22 VAL A 48 26.476 22.858 16.567 1.00 0.00 H new ATOM 0 HG23 VAL A 48 25.646 22.586 15.017 1.00 0.00 H new ATOM 685 N ASN A 49 29.576 20.909 13.138 1.00 0.00 N ATOM 686 CA ASN A 49 30.746 20.182 12.662 1.00 0.00 C ATOM 687 C ASN A 49 31.892 21.149 12.388 1.00 0.00 C ATOM 688 O ASN A 49 33.049 20.860 12.690 1.00 0.00 O ATOM 689 CB ASN A 49 30.397 19.419 11.382 1.00 0.00 C ATOM 690 CG ASN A 49 31.639 18.717 10.839 1.00 0.00 C ATOM 691 OD1 ASN A 49 32.415 19.315 10.096 1.00 0.00 O ATOM 692 ND2 ASN A 49 31.871 17.476 11.169 1.00 0.00 N ATOM 0 H ASN A 49 28.742 20.796 12.563 1.00 0.00 H new ATOM 0 HA ASN A 49 31.057 19.474 13.431 1.00 0.00 H new ATOM 0 HB2 ASN A 49 29.615 18.687 11.586 1.00 0.00 H new ATOM 0 HB3 ASN A 49 30.002 20.107 10.635 1.00 0.00 H new ATOM 0 HD21 ASN A 49 32.698 16.999 10.810 1.00 0.00 H new ATOM 0 HD22 ASN A 49 31.225 16.983 11.786 1.00 0.00 H new ATOM 699 N VAL A 50 31.560 22.301 11.817 1.00 0.00 N ATOM 700 CA VAL A 50 32.564 23.311 11.507 1.00 0.00 C ATOM 701 C VAL A 50 33.201 23.846 12.779 1.00 0.00 C ATOM 702 O VAL A 50 34.397 24.141 12.817 1.00 0.00 O ATOM 703 CB VAL A 50 31.937 24.458 10.712 1.00 0.00 C ATOM 704 CG1 VAL A 50 32.988 25.544 10.466 1.00 0.00 C ATOM 705 CG2 VAL A 50 31.433 23.927 9.368 1.00 0.00 C ATOM 0 H VAL A 50 30.607 22.558 11.560 1.00 0.00 H new ATOM 0 HA VAL A 50 33.341 22.844 10.901 1.00 0.00 H new ATOM 0 HB VAL A 50 31.104 24.879 11.276 1.00 0.00 H new ATOM 0 HG11 VAL A 50 32.541 26.361 9.900 1.00 0.00 H new ATOM 0 HG12 VAL A 50 33.352 25.921 11.422 1.00 0.00 H new ATOM 0 HG13 VAL A 50 33.820 25.124 9.901 1.00 0.00 H new ATOM 0 HG21 VAL A 50 30.986 24.742 8.799 1.00 0.00 H new ATOM 0 HG22 VAL A 50 32.268 23.508 8.806 1.00 0.00 H new ATOM 0 HG23 VAL A 50 30.686 23.152 9.540 1.00 0.00 H new ATOM 715 N ASP A 51 32.391 23.976 13.811 1.00 0.00 N ATOM 716 CA ASP A 51 32.869 24.485 15.092 1.00 0.00 C ATOM 717 C ASP A 51 34.103 23.712 15.553 1.00 0.00 C ATOM 718 O ASP A 51 34.920 24.229 16.313 1.00 0.00 O ATOM 719 CB ASP A 51 31.769 24.368 16.154 1.00 0.00 C ATOM 720 CG ASP A 51 32.136 25.196 17.382 1.00 0.00 C ATOM 721 OD1 ASP A 51 33.299 25.545 17.510 1.00 0.00 O ATOM 722 OD2 ASP A 51 31.251 25.470 18.176 1.00 0.00 O ATOM 0 H ASP A 51 31.399 23.738 13.793 1.00 0.00 H new ATOM 0 HA ASP A 51 33.136 25.534 14.961 1.00 0.00 H new ATOM 0 HB2 ASP A 51 30.819 24.712 15.744 1.00 0.00 H new ATOM 0 HB3 ASP A 51 31.635 23.324 16.437 1.00 0.00 H new ATOM 727 N LYS A 52 34.230 22.475 15.086 1.00 0.00 N ATOM 728 CA LYS A 52 35.365 21.644 15.452 1.00 0.00 C ATOM 729 C LYS A 52 36.649 22.225 14.880 1.00 0.00 C ATOM 730 O LYS A 52 37.696 22.208 15.528 1.00 0.00 O ATOM 731 CB LYS A 52 35.159 20.220 14.931 1.00 0.00 C ATOM 732 CG LYS A 52 36.291 19.321 15.433 1.00 0.00 C ATOM 733 CD LYS A 52 36.045 17.884 14.972 1.00 0.00 C ATOM 734 CE LYS A 52 37.165 16.982 15.496 1.00 0.00 C ATOM 735 NZ LYS A 52 36.900 15.574 15.086 1.00 0.00 N ATOM 0 H LYS A 52 33.563 22.029 14.456 1.00 0.00 H new ATOM 0 HA LYS A 52 35.445 21.618 16.539 1.00 0.00 H new ATOM 0 HB2 LYS A 52 34.197 19.834 15.269 1.00 0.00 H new ATOM 0 HB3 LYS A 52 35.137 20.220 13.841 1.00 0.00 H new ATOM 0 HG2 LYS A 52 37.248 19.677 15.052 1.00 0.00 H new ATOM 0 HG3 LYS A 52 36.346 19.361 16.521 1.00 0.00 H new ATOM 0 HD2 LYS A 52 35.080 17.533 15.338 1.00 0.00 H new ATOM 0 HD3 LYS A 52 36.008 17.841 13.883 1.00 0.00 H new ATOM 0 HE2 LYS A 52 38.127 17.312 15.103 1.00 0.00 H new ATOM 0 HE3 LYS A 52 37.224 17.051 16.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 37.660 14.960 15.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 35.990 15.263 15.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 36.864 15.515 14.048 1.00 0.00 H new ATOM 749 N VAL A 53 36.560 22.732 13.656 1.00 0.00 N ATOM 750 CA VAL A 53 37.722 23.313 13.000 1.00 0.00 C ATOM 751 C VAL A 53 38.060 24.670 13.599 1.00 0.00 C ATOM 752 O VAL A 53 39.199 25.131 13.515 1.00 0.00 O ATOM 753 CB VAL A 53 37.459 23.470 11.503 1.00 0.00 C ATOM 754 CG1 VAL A 53 38.715 24.018 10.816 1.00 0.00 C ATOM 755 CG2 VAL A 53 37.105 22.107 10.908 1.00 0.00 C ATOM 0 H VAL A 53 35.703 22.752 13.103 1.00 0.00 H new ATOM 0 HA VAL A 53 38.567 22.641 13.153 1.00 0.00 H new ATOM 0 HB VAL A 53 36.632 24.163 11.348 1.00 0.00 H new ATOM 0 HG11 VAL A 53 38.526 24.130 9.748 1.00 0.00 H new ATOM 0 HG12 VAL A 53 38.969 24.988 11.243 1.00 0.00 H new ATOM 0 HG13 VAL A 53 39.544 23.326 10.968 1.00 0.00 H new ATOM 0 HG21 VAL A 53 36.916 22.214 9.840 1.00 0.00 H new ATOM 0 HG22 VAL A 53 37.934 21.416 11.063 1.00 0.00 H new ATOM 0 HG23 VAL A 53 36.212 21.717 11.397 1.00 0.00 H new ATOM 765 N LEU A 54 37.062 25.312 14.193 1.00 0.00 N ATOM 766 CA LEU A 54 37.265 26.627 14.788 1.00 0.00 C ATOM 767 C LEU A 54 38.301 26.557 15.899 1.00 0.00 C ATOM 768 O LEU A 54 39.150 27.439 16.028 1.00 0.00 O ATOM 769 CB LEU A 54 35.940 27.167 15.344 1.00 0.00 C ATOM 770 CG LEU A 54 36.141 28.563 15.962 1.00 0.00 C ATOM 771 CD1 LEU A 54 36.648 29.553 14.897 1.00 0.00 C ATOM 772 CD2 LEU A 54 34.805 29.055 16.538 1.00 0.00 C ATOM 0 H LEU A 54 36.113 24.948 14.275 1.00 0.00 H new ATOM 0 HA LEU A 54 37.628 27.302 14.013 1.00 0.00 H new ATOM 0 HB2 LEU A 54 35.199 27.220 14.546 1.00 0.00 H new ATOM 0 HB3 LEU A 54 35.549 26.483 16.097 1.00 0.00 H new ATOM 0 HG LEU A 54 36.884 28.500 16.757 1.00 0.00 H new ATOM 0 HD11 LEU A 54 36.785 30.535 15.349 1.00 0.00 H new ATOM 0 HD12 LEU A 54 37.599 29.202 14.497 1.00 0.00 H new ATOM 0 HD13 LEU A 54 35.919 29.624 14.090 1.00 0.00 H new ATOM 0 HD21 LEU A 54 34.940 30.043 16.977 1.00 0.00 H new ATOM 0 HD22 LEU A 54 34.064 29.111 15.741 1.00 0.00 H new ATOM 0 HD23 LEU A 54 34.462 28.361 17.305 1.00 0.00 H new ATOM 784 N GLU A 55 38.217 25.512 16.702 1.00 0.00 N ATOM 785 CA GLU A 55 39.147 25.336 17.812 1.00 0.00 C ATOM 786 C GLU A 55 40.561 25.093 17.298 1.00 0.00 C ATOM 787 O GLU A 55 40.945 23.956 17.022 1.00 0.00 O ATOM 788 CB GLU A 55 38.708 24.155 18.675 1.00 0.00 C ATOM 789 CG GLU A 55 37.405 24.503 19.396 1.00 0.00 C ATOM 790 CD GLU A 55 36.892 23.288 20.158 1.00 0.00 C ATOM 791 OE1 GLU A 55 37.528 22.250 20.077 1.00 0.00 O ATOM 792 OE2 GLU A 55 35.869 23.411 20.812 1.00 0.00 O ATOM 0 H GLU A 55 37.519 24.773 16.611 1.00 0.00 H new ATOM 0 HA GLU A 55 39.144 26.247 18.410 1.00 0.00 H new ATOM 0 HB2 GLU A 55 38.567 23.270 18.054 1.00 0.00 H new ATOM 0 HB3 GLU A 55 39.484 23.914 19.401 1.00 0.00 H new ATOM 0 HG2 GLU A 55 37.571 25.331 20.085 1.00 0.00 H new ATOM 0 HG3 GLU A 55 36.657 24.833 18.675 1.00 0.00 H new ATOM 799 N ARG A 56 41.328 26.168 17.165 1.00 0.00 N ATOM 800 CA ARG A 56 42.697 26.061 16.675 1.00 0.00 C ATOM 801 C ARG A 56 43.566 25.297 17.669 1.00 0.00 C ATOM 802 O ARG A 56 44.374 24.453 17.282 1.00 0.00 O ATOM 803 CB ARG A 56 43.279 27.462 16.468 1.00 0.00 C ATOM 804 CG ARG A 56 42.436 28.249 15.454 1.00 0.00 C ATOM 805 CD ARG A 56 42.747 27.801 14.020 1.00 0.00 C ATOM 806 NE ARG A 56 42.035 28.656 13.072 1.00 0.00 N ATOM 807 CZ ARG A 56 40.799 28.369 12.674 1.00 0.00 C ATOM 808 NH1 ARG A 56 40.182 27.322 13.151 1.00 0.00 N ATOM 809 NH2 ARG A 56 40.200 29.141 11.811 1.00 0.00 N ATOM 0 H ARG A 56 41.029 27.117 17.388 1.00 0.00 H new ATOM 0 HA ARG A 56 42.685 25.520 15.729 1.00 0.00 H new ATOM 0 HB2 ARG A 56 43.307 27.995 17.418 1.00 0.00 H new ATOM 0 HB3 ARG A 56 44.307 27.387 16.115 1.00 0.00 H new ATOM 0 HG2 ARG A 56 41.377 28.102 15.664 1.00 0.00 H new ATOM 0 HG3 ARG A 56 42.637 29.315 15.558 1.00 0.00 H new ATOM 0 HD2 ARG A 56 43.820 27.853 13.837 1.00 0.00 H new ATOM 0 HD3 ARG A 56 42.450 26.761 13.881 1.00 0.00 H new ATOM 0 HE ARG A 56 42.496 29.490 12.708 1.00 0.00 H new ATOM 0 HH11 ARG A 56 40.648 26.721 13.831 1.00 0.00 H new ATOM 0 HH12 ARG A 56 39.234 27.105 12.844 1.00 0.00 H new ATOM 0 HH21 ARG A 56 40.679 29.963 11.443 1.00 0.00 H new ATOM 0 HH22 ARG A 56 39.252 28.923 11.504 1.00 0.00 H new ATOM 823 N ASP A 57 43.388 25.594 18.949 1.00 0.00 N ATOM 824 CA ASP A 57 44.157 24.923 19.988 1.00 0.00 C ATOM 825 C ASP A 57 43.597 23.529 20.242 1.00 0.00 C ATOM 826 O ASP A 57 42.383 23.329 20.221 1.00 0.00 O ATOM 827 CB ASP A 57 44.112 25.740 21.279 1.00 0.00 C ATOM 828 CG ASP A 57 44.941 27.008 21.123 1.00 0.00 C ATOM 829 OD1 ASP A 57 45.649 27.112 20.134 1.00 0.00 O ATOM 830 OD2 ASP A 57 44.860 27.858 21.995 1.00 0.00 O ATOM 0 H ASP A 57 42.724 26.289 19.291 1.00 0.00 H new ATOM 0 HA ASP A 57 45.191 24.833 19.655 1.00 0.00 H new ATOM 0 HB2 ASP A 57 43.081 25.997 21.520 1.00 0.00 H new ATOM 0 HB3 ASP A 57 44.495 25.146 22.109 1.00 0.00 H new ATOM 835 N GLN A 58 44.489 22.565 20.480 1.00 0.00 N ATOM 836 CA GLN A 58 44.084 21.188 20.739 1.00 0.00 C ATOM 837 C GLN A 58 44.326 20.833 22.205 1.00 0.00 C ATOM 838 O GLN A 58 45.445 20.946 22.705 1.00 0.00 O ATOM 839 CB GLN A 58 44.879 20.236 19.834 1.00 0.00 C ATOM 840 CG GLN A 58 45.118 20.898 18.472 1.00 0.00 C ATOM 841 CD GLN A 58 46.260 21.904 18.574 1.00 0.00 C ATOM 842 OE1 GLN A 58 47.179 21.722 19.374 1.00 0.00 O ATOM 843 NE2 GLN A 58 46.261 22.957 17.806 1.00 0.00 N ATOM 0 H GLN A 58 45.498 22.716 20.498 1.00 0.00 H new ATOM 0 HA GLN A 58 43.020 21.086 20.524 1.00 0.00 H new ATOM 0 HB2 GLN A 58 45.832 19.987 20.300 1.00 0.00 H new ATOM 0 HB3 GLN A 58 44.333 19.301 19.704 1.00 0.00 H new ATOM 0 HG2 GLN A 58 45.356 20.139 17.727 1.00 0.00 H new ATOM 0 HG3 GLN A 58 44.210 21.399 18.138 1.00 0.00 H new ATOM 0 HE21 GLN A 58 45.499 23.106 17.144 1.00 0.00 H new ATOM 0 HE22 GLN A 58 47.023 23.632 17.867 1.00 0.00 H new ATOM 852 N LYS A 59 43.267 20.399 22.884 1.00 0.00 N ATOM 853 CA LYS A 59 43.361 20.018 24.294 1.00 0.00 C ATOM 854 C LYS A 59 43.505 18.507 24.431 1.00 0.00 C ATOM 855 O LYS A 59 43.572 17.980 25.539 1.00 0.00 O ATOM 856 CB LYS A 59 42.114 20.483 25.044 1.00 0.00 C ATOM 857 CG LYS A 59 42.073 22.011 25.064 1.00 0.00 C ATOM 858 CD LYS A 59 40.834 22.478 25.829 1.00 0.00 C ATOM 859 CE LYS A 59 40.803 24.006 25.865 1.00 0.00 C ATOM 860 NZ LYS A 59 39.583 24.460 26.590 1.00 0.00 N ATOM 0 H LYS A 59 42.334 20.302 22.483 1.00 0.00 H new ATOM 0 HA LYS A 59 44.242 20.496 24.723 1.00 0.00 H new ATOM 0 HB2 LYS A 59 41.219 20.091 24.562 1.00 0.00 H new ATOM 0 HB3 LYS A 59 42.123 20.095 26.063 1.00 0.00 H new ATOM 0 HG2 LYS A 59 42.974 22.403 25.536 1.00 0.00 H new ATOM 0 HG3 LYS A 59 42.052 22.398 24.045 1.00 0.00 H new ATOM 0 HD2 LYS A 59 39.932 22.097 25.350 1.00 0.00 H new ATOM 0 HD3 LYS A 59 40.848 22.080 26.844 1.00 0.00 H new ATOM 0 HE2 LYS A 59 41.696 24.387 26.360 1.00 0.00 H new ATOM 0 HE3 LYS A 59 40.806 24.405 24.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 39.561 25.499 26.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 38.736 24.107 26.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 39.599 24.090 27.562 1.00 0.00 H new ATOM 874 N LEU A 60 43.548 17.814 23.293 1.00 0.00 N ATOM 875 CA LEU A 60 43.681 16.358 23.298 1.00 0.00 C ATOM 876 C LEU A 60 42.801 15.745 24.383 1.00 0.00 C ATOM 877 O LEU A 60 43.291 15.304 25.423 1.00 0.00 O ATOM 878 CB LEU A 60 45.149 15.971 23.539 1.00 0.00 C ATOM 879 CG LEU A 60 45.947 16.116 22.240 1.00 0.00 C ATOM 880 CD1 LEU A 60 45.852 17.559 21.737 1.00 0.00 C ATOM 881 CD2 LEU A 60 47.414 15.761 22.504 1.00 0.00 C ATOM 0 H LEU A 60 43.493 18.233 22.365 1.00 0.00 H new ATOM 0 HA LEU A 60 43.359 15.975 22.330 1.00 0.00 H new ATOM 0 HB2 LEU A 60 45.579 16.607 24.313 1.00 0.00 H new ATOM 0 HB3 LEU A 60 45.209 14.944 23.900 1.00 0.00 H new ATOM 0 HG LEU A 60 45.539 15.444 21.485 1.00 0.00 H new ATOM 0 HD11 LEU A 60 46.421 17.660 20.813 1.00 0.00 H new ATOM 0 HD12 LEU A 60 44.808 17.811 21.551 1.00 0.00 H new ATOM 0 HD13 LEU A 60 46.260 18.234 22.489 1.00 0.00 H new ATOM 0 HD21 LEU A 60 47.985 15.863 21.581 1.00 0.00 H new ATOM 0 HD22 LEU A 60 47.821 16.434 23.259 1.00 0.00 H new ATOM 0 HD23 LEU A 60 47.481 14.733 22.860 1.00 0.00 H new ATOM 893 N SER A 61 41.497 15.720 24.131 1.00 0.00 N ATOM 894 CA SER A 61 40.555 15.162 25.086 1.00 0.00 C ATOM 895 C SER A 61 39.234 14.842 24.402 1.00 0.00 C ATOM 896 O SER A 61 38.265 15.591 24.518 1.00 0.00 O ATOM 897 CB SER A 61 40.315 16.155 26.223 1.00 0.00 C ATOM 898 OG SER A 61 39.735 17.341 25.696 1.00 0.00 O ATOM 0 H SER A 61 41.072 16.079 23.276 1.00 0.00 H new ATOM 0 HA SER A 61 40.976 14.242 25.492 1.00 0.00 H new ATOM 0 HB2 SER A 61 39.656 15.716 26.972 1.00 0.00 H new ATOM 0 HB3 SER A 61 41.255 16.387 26.723 1.00 0.00 H new ATOM 0 HG SER A 61 38.893 17.121 25.245 1.00 0.00 H new ATOM 904 N GLU A 62 39.198 13.720 23.694 1.00 0.00 N ATOM 905 CA GLU A 62 37.988 13.309 23.005 1.00 0.00 C ATOM 906 C GLU A 62 38.156 11.906 22.439 1.00 0.00 C ATOM 907 O GLU A 62 37.695 10.933 23.035 1.00 0.00 O ATOM 908 CB GLU A 62 37.660 14.293 21.874 1.00 0.00 C ATOM 909 CG GLU A 62 36.281 13.971 21.285 1.00 0.00 C ATOM 910 CD GLU A 62 35.192 14.321 22.294 1.00 0.00 C ATOM 911 OE1 GLU A 62 35.520 14.918 23.306 1.00 0.00 O ATOM 912 OE2 GLU A 62 34.046 13.986 22.040 1.00 0.00 O ATOM 0 H GLU A 62 39.988 13.084 23.584 1.00 0.00 H new ATOM 0 HA GLU A 62 37.165 13.306 23.720 1.00 0.00 H new ATOM 0 HB2 GLU A 62 37.673 15.315 22.254 1.00 0.00 H new ATOM 0 HB3 GLU A 62 38.421 14.232 21.096 1.00 0.00 H new ATOM 0 HG2 GLU A 62 36.129 14.533 20.363 1.00 0.00 H new ATOM 0 HG3 GLU A 62 36.224 12.914 21.027 1.00 0.00 H new ATOM 919 N LEU A 63 38.818 11.806 21.282 1.00 0.00 N ATOM 920 CA LEU A 63 39.043 10.516 20.637 1.00 0.00 C ATOM 921 C LEU A 63 40.531 10.184 20.605 1.00 0.00 C ATOM 922 O LEU A 63 41.331 10.918 20.022 1.00 0.00 O ATOM 923 CB LEU A 63 38.498 10.545 19.201 1.00 0.00 C ATOM 924 CG LEU A 63 38.554 9.135 18.585 1.00 0.00 C ATOM 925 CD1 LEU A 63 37.624 8.164 19.345 1.00 0.00 C ATOM 926 CD2 LEU A 63 38.134 9.216 17.109 1.00 0.00 C ATOM 0 H LEU A 63 39.205 12.603 20.777 1.00 0.00 H new ATOM 0 HA LEU A 63 38.521 9.751 21.211 1.00 0.00 H new ATOM 0 HB2 LEU A 63 37.471 10.910 19.201 1.00 0.00 H new ATOM 0 HB3 LEU A 63 39.082 11.238 18.596 1.00 0.00 H new ATOM 0 HG LEU A 63 39.573 8.755 18.661 1.00 0.00 H new ATOM 0 HD11 LEU A 63 37.681 7.175 18.891 1.00 0.00 H new ATOM 0 HD12 LEU A 63 37.936 8.103 20.388 1.00 0.00 H new ATOM 0 HD13 LEU A 63 36.598 8.528 19.294 1.00 0.00 H new ATOM 0 HD21 LEU A 63 38.171 8.221 16.665 1.00 0.00 H new ATOM 0 HD22 LEU A 63 37.119 9.606 17.041 1.00 0.00 H new ATOM 0 HD23 LEU A 63 38.814 9.878 16.573 1.00 0.00 H new ATOM 938 N ASP A 64 40.892 9.071 21.230 1.00 0.00 N ATOM 939 CA ASP A 64 42.280 8.646 21.266 1.00 0.00 C ATOM 940 C ASP A 64 42.390 7.221 21.803 1.00 0.00 C ATOM 941 O ASP A 64 43.332 6.498 21.479 1.00 0.00 O ATOM 942 CB ASP A 64 43.078 9.585 22.159 1.00 0.00 C ATOM 943 CG ASP A 64 44.569 9.309 22.003 1.00 0.00 C ATOM 944 OD1 ASP A 64 44.906 8.343 21.336 1.00 0.00 O ATOM 945 OD2 ASP A 64 45.353 10.066 22.551 1.00 0.00 O ATOM 0 H ASP A 64 40.244 8.451 21.716 1.00 0.00 H new ATOM 0 HA ASP A 64 42.679 8.672 20.252 1.00 0.00 H new ATOM 0 HB2 ASP A 64 42.862 10.621 21.897 1.00 0.00 H new ATOM 0 HB3 ASP A 64 42.782 9.451 23.199 1.00 0.00 H new ATOM 950 N ASP A 65 41.422 6.826 22.628 1.00 0.00 N ATOM 951 CA ASP A 65 41.421 5.485 23.207 1.00 0.00 C ATOM 952 C ASP A 65 40.784 4.485 22.248 1.00 0.00 C ATOM 953 O ASP A 65 40.724 3.290 22.535 1.00 0.00 O ATOM 954 CB ASP A 65 40.646 5.486 24.527 1.00 0.00 C ATOM 955 CG ASP A 65 39.242 6.042 24.308 1.00 0.00 C ATOM 956 OD1 ASP A 65 38.851 6.173 23.159 1.00 0.00 O ATOM 957 OD2 ASP A 65 38.579 6.325 25.292 1.00 0.00 O ATOM 0 H ASP A 65 40.635 7.410 22.909 1.00 0.00 H new ATOM 0 HA ASP A 65 42.455 5.191 23.389 1.00 0.00 H new ATOM 0 HB2 ASP A 65 40.587 4.473 24.924 1.00 0.00 H new ATOM 0 HB3 ASP A 65 41.173 6.088 25.267 1.00 0.00 H new ATOM 962 N ARG A 66 40.310 4.981 21.105 1.00 0.00 N ATOM 963 CA ARG A 66 39.677 4.121 20.102 1.00 0.00 C ATOM 964 C ARG A 66 40.239 4.426 18.717 1.00 0.00 C ATOM 965 O ARG A 66 40.353 5.586 18.323 1.00 0.00 O ATOM 966 CB ARG A 66 38.163 4.347 20.105 1.00 0.00 C ATOM 967 CG ARG A 66 37.497 3.352 19.152 1.00 0.00 C ATOM 968 CD ARG A 66 35.985 3.567 19.166 1.00 0.00 C ATOM 969 NE ARG A 66 35.660 4.883 18.623 1.00 0.00 N ATOM 970 CZ ARG A 66 35.527 5.077 17.314 1.00 0.00 C ATOM 971 NH1 ARG A 66 35.693 4.080 16.489 1.00 0.00 N ATOM 972 NH2 ARG A 66 35.235 6.263 16.856 1.00 0.00 N ATOM 0 H ARG A 66 40.351 5.968 20.850 1.00 0.00 H new ATOM 0 HA ARG A 66 39.887 3.080 20.348 1.00 0.00 H new ATOM 0 HB2 ARG A 66 37.768 4.222 21.113 1.00 0.00 H new ATOM 0 HB3 ARG A 66 37.936 5.368 19.798 1.00 0.00 H new ATOM 0 HG2 ARG A 66 37.884 3.485 18.142 1.00 0.00 H new ATOM 0 HG3 ARG A 66 37.733 2.331 19.452 1.00 0.00 H new ATOM 0 HD2 ARG A 66 35.494 2.791 18.578 1.00 0.00 H new ATOM 0 HD3 ARG A 66 35.607 3.482 20.185 1.00 0.00 H new ATOM 0 HE ARG A 66 35.532 5.669 19.260 1.00 0.00 H new ATOM 0 HH11 ARG A 66 35.924 3.154 16.848 1.00 0.00 H new ATOM 0 HH12 ARG A 66 35.591 4.227 15.485 1.00 0.00 H new ATOM 0 HH21 ARG A 66 35.109 7.042 17.502 1.00 0.00 H new ATOM 0 HH22 ARG A 66 35.133 6.411 15.852 1.00 0.00 H new ATOM 986 N ALA A 67 40.587 3.374 17.984 1.00 0.00 N ATOM 987 CA ALA A 67 41.138 3.534 16.644 1.00 0.00 C ATOM 988 C ALA A 67 42.330 4.484 16.662 1.00 0.00 C ATOM 989 O ALA A 67 42.615 5.117 17.679 1.00 0.00 O ATOM 990 CB ALA A 67 40.063 4.082 15.702 1.00 0.00 C ATOM 0 H ALA A 67 40.498 2.406 18.293 1.00 0.00 H new ATOM 0 HA ALA A 67 41.472 2.558 16.291 1.00 0.00 H new ATOM 0 HB1 ALA A 67 40.481 4.199 14.702 1.00 0.00 H new ATOM 0 HB2 ALA A 67 39.223 3.388 15.665 1.00 0.00 H new ATOM 0 HB3 ALA A 67 39.718 5.049 16.067 1.00 0.00 H new ATOM 996 N ASP A 68 43.025 4.576 15.532 1.00 0.00 N ATOM 997 CA ASP A 68 44.187 5.452 15.431 1.00 0.00 C ATOM 998 C ASP A 68 45.229 5.084 16.481 1.00 0.00 C ATOM 999 O ASP A 68 45.863 5.957 17.074 1.00 0.00 O ATOM 1000 CB ASP A 68 43.761 6.909 15.620 1.00 0.00 C ATOM 1001 CG ASP A 68 44.930 7.837 15.305 1.00 0.00 C ATOM 1002 OD1 ASP A 68 46.025 7.335 15.114 1.00 0.00 O ATOM 1003 OD2 ASP A 68 44.714 9.037 15.262 1.00 0.00 O ATOM 0 H ASP A 68 42.806 4.059 14.680 1.00 0.00 H new ATOM 0 HA ASP A 68 44.627 5.328 14.441 1.00 0.00 H new ATOM 0 HB2 ASP A 68 42.918 7.138 14.968 1.00 0.00 H new ATOM 0 HB3 ASP A 68 43.424 7.069 16.644 1.00 0.00 H new ATOM 1008 N ALA A 69 45.398 3.785 16.708 1.00 0.00 N ATOM 1009 CA ALA A 69 46.365 3.306 17.693 1.00 0.00 C ATOM 1010 C ALA A 69 46.810 1.886 17.357 1.00 0.00 C ATOM 1011 O ALA A 69 46.098 1.147 16.678 1.00 0.00 O ATOM 1012 CB ALA A 69 45.743 3.332 19.090 1.00 0.00 C ATOM 0 H ALA A 69 44.882 3.048 16.227 1.00 0.00 H new ATOM 0 HA ALA A 69 47.235 3.962 17.672 1.00 0.00 H new ATOM 0 HB1 ALA A 69 46.470 2.973 19.819 1.00 0.00 H new ATOM 0 HB2 ALA A 69 45.452 4.352 19.340 1.00 0.00 H new ATOM 0 HB3 ALA A 69 44.863 2.689 19.109 1.00 0.00 H new ATOM 1018 N LEU A 70 47.992 1.513 17.841 1.00 0.00 N ATOM 1019 CA LEU A 70 48.530 0.180 17.592 1.00 0.00 C ATOM 1020 C LEU A 70 48.564 -0.113 16.094 1.00 0.00 C ATOM 1021 O LEU A 70 47.524 -0.284 15.462 1.00 0.00 O ATOM 1022 CB LEU A 70 47.666 -0.870 18.303 1.00 0.00 C ATOM 1023 CG LEU A 70 48.019 -0.909 19.794 1.00 0.00 C ATOM 1024 CD1 LEU A 70 47.796 0.476 20.410 1.00 0.00 C ATOM 1025 CD2 LEU A 70 47.126 -1.936 20.497 1.00 0.00 C ATOM 0 H LEU A 70 48.593 2.113 18.406 1.00 0.00 H new ATOM 0 HA LEU A 70 49.548 0.138 17.980 1.00 0.00 H new ATOM 0 HB2 LEU A 70 46.610 -0.632 18.176 1.00 0.00 H new ATOM 0 HB3 LEU A 70 47.828 -1.851 17.856 1.00 0.00 H new ATOM 0 HG LEU A 70 49.065 -1.191 19.916 1.00 0.00 H new ATOM 0 HD11 LEU A 70 48.047 0.447 21.470 1.00 0.00 H new ATOM 0 HD12 LEU A 70 48.431 1.205 19.906 1.00 0.00 H new ATOM 0 HD13 LEU A 70 46.751 0.763 20.292 1.00 0.00 H new ATOM 0 HD21 LEU A 70 47.373 -1.967 21.558 1.00 0.00 H new ATOM 0 HD22 LEU A 70 46.081 -1.652 20.376 1.00 0.00 H new ATOM 0 HD23 LEU A 70 47.288 -2.920 20.057 1.00 0.00 H new ATOM 1037 N GLN A 71 49.768 -0.173 15.538 1.00 0.00 N ATOM 1038 CA GLN A 71 49.928 -0.447 14.116 1.00 0.00 C ATOM 1039 C GLN A 71 49.085 0.523 13.291 1.00 0.00 C ATOM 1040 O GLN A 71 49.584 1.547 12.824 1.00 0.00 O ATOM 1041 CB GLN A 71 49.511 -1.889 13.810 1.00 0.00 C ATOM 1042 CG GLN A 71 49.703 -2.173 12.319 1.00 0.00 C ATOM 1043 CD GLN A 71 49.438 -3.646 12.031 1.00 0.00 C ATOM 1044 OE1 GLN A 71 49.427 -4.467 12.948 1.00 0.00 O ATOM 1045 NE2 GLN A 71 49.220 -4.030 10.804 1.00 0.00 N ATOM 0 H GLN A 71 50.642 -0.037 16.046 1.00 0.00 H new ATOM 0 HA GLN A 71 50.977 -0.314 13.851 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.106 -2.584 14.403 1.00 0.00 H new ATOM 0 HB3 GLN A 71 48.469 -2.044 14.089 1.00 0.00 H new ATOM 0 HG2 GLN A 71 49.027 -1.552 11.732 1.00 0.00 H new ATOM 0 HG3 GLN A 71 50.718 -1.912 12.018 1.00 0.00 H new ATOM 0 HE21 GLN A 71 49.230 -3.347 10.046 1.00 0.00 H new ATOM 0 HE22 GLN A 71 49.040 -5.013 10.602 1.00 0.00 H new ATOM 1054 N ALA A 72 47.806 0.192 13.114 1.00 0.00 N ATOM 1055 CA ALA A 72 46.890 1.036 12.342 1.00 0.00 C ATOM 1056 C ALA A 72 45.539 1.139 13.043 1.00 0.00 C ATOM 1057 O ALA A 72 45.141 2.216 13.487 1.00 0.00 O ATOM 1058 CB ALA A 72 46.698 0.442 10.946 1.00 0.00 C ATOM 0 H ALA A 72 47.380 -0.653 13.494 1.00 0.00 H new ATOM 0 HA ALA A 72 47.320 2.034 12.260 1.00 0.00 H new ATOM 0 HB1 ALA A 72 46.016 1.071 10.373 1.00 0.00 H new ATOM 0 HB2 ALA A 72 47.660 0.392 10.436 1.00 0.00 H new ATOM 0 HB3 ALA A 72 46.280 -0.561 11.032 1.00 0.00 H new ATOM 1064 N GLY A 73 44.838 0.014 13.141 1.00 0.00 N ATOM 1065 CA GLY A 73 43.533 -0.004 13.793 1.00 0.00 C ATOM 1066 C GLY A 73 42.500 0.744 12.961 1.00 0.00 C ATOM 1067 O GLY A 73 41.526 1.277 13.492 1.00 0.00 O ATOM 0 H GLY A 73 45.147 -0.889 12.781 1.00 0.00 H new ATOM 0 HA2 GLY A 73 43.210 -1.034 13.941 1.00 0.00 H new ATOM 0 HA3 GLY A 73 43.609 0.451 14.781 1.00 0.00 H new ATOM 1071 N ALA A 74 42.725 0.782 11.654 1.00 0.00 N ATOM 1072 CA ALA A 74 41.815 1.470 10.740 1.00 0.00 C ATOM 1073 C ALA A 74 41.897 0.865 9.342 1.00 0.00 C ATOM 1074 O ALA A 74 42.823 0.116 9.033 1.00 0.00 O ATOM 1075 CB ALA A 74 42.165 2.958 10.677 1.00 0.00 C ATOM 0 H ALA A 74 43.528 0.346 11.201 1.00 0.00 H new ATOM 0 HA ALA A 74 40.798 1.352 11.114 1.00 0.00 H new ATOM 0 HB1 ALA A 74 41.483 3.464 9.994 1.00 0.00 H new ATOM 0 HB2 ALA A 74 42.074 3.396 11.671 1.00 0.00 H new ATOM 0 HB3 ALA A 74 43.188 3.076 10.321 1.00 0.00 H new ATOM 1081 N SER A 75 40.915 1.193 8.504 1.00 0.00 N ATOM 1082 CA SER A 75 40.871 0.681 7.140 1.00 0.00 C ATOM 1083 C SER A 75 40.207 1.688 6.210 1.00 0.00 C ATOM 1084 O SER A 75 40.267 2.896 6.440 1.00 0.00 O ATOM 1085 CB SER A 75 40.104 -0.639 7.102 1.00 0.00 C ATOM 1086 OG SER A 75 40.605 -1.502 8.114 1.00 0.00 O ATOM 0 H SER A 75 40.141 1.811 8.748 1.00 0.00 H new ATOM 0 HA SER A 75 41.894 0.514 6.802 1.00 0.00 H new ATOM 0 HB2 SER A 75 39.040 -0.459 7.255 1.00 0.00 H new ATOM 0 HB3 SER A 75 40.211 -1.107 6.123 1.00 0.00 H new ATOM 0 HG SER A 75 40.114 -2.350 8.094 1.00 0.00 H new ATOM 1092 N GLN A 76 39.581 1.182 5.152 1.00 0.00 N ATOM 1093 CA GLN A 76 38.916 2.048 4.185 1.00 0.00 C ATOM 1094 C GLN A 76 37.784 2.823 4.855 1.00 0.00 C ATOM 1095 O GLN A 76 37.086 3.602 4.208 1.00 0.00 O ATOM 1096 CB GLN A 76 38.360 1.209 3.022 1.00 0.00 C ATOM 1097 CG GLN A 76 38.200 2.085 1.772 1.00 0.00 C ATOM 1098 CD GLN A 76 39.574 2.428 1.209 1.00 0.00 C ATOM 1099 OE1 GLN A 76 40.429 1.552 1.086 1.00 0.00 O ATOM 1100 NE2 GLN A 76 39.843 3.658 0.865 1.00 0.00 N ATOM 0 H GLN A 76 39.520 0.185 4.943 1.00 0.00 H new ATOM 0 HA GLN A 76 39.645 2.759 3.796 1.00 0.00 H new ATOM 0 HB2 GLN A 76 39.031 0.377 2.810 1.00 0.00 H new ATOM 0 HB3 GLN A 76 37.398 0.779 3.300 1.00 0.00 H new ATOM 0 HG2 GLN A 76 37.609 1.561 1.021 1.00 0.00 H new ATOM 0 HG3 GLN A 76 37.660 2.998 2.022 1.00 0.00 H new ATOM 0 HE21 GLN A 76 39.133 4.383 0.968 1.00 0.00 H new ATOM 0 HE22 GLN A 76 40.763 3.894 0.494 1.00 0.00 H new ATOM 1109 N PHE A 77 37.609 2.599 6.153 1.00 0.00 N ATOM 1110 CA PHE A 77 36.558 3.277 6.902 1.00 0.00 C ATOM 1111 C PHE A 77 35.190 2.983 6.294 1.00 0.00 C ATOM 1112 O PHE A 77 34.930 3.306 5.135 1.00 0.00 O ATOM 1113 CB PHE A 77 36.801 4.785 6.903 1.00 0.00 C ATOM 1114 CG PHE A 77 38.181 5.075 7.440 1.00 0.00 C ATOM 1115 CD1 PHE A 77 38.399 5.108 8.820 1.00 0.00 C ATOM 1116 CD2 PHE A 77 39.243 5.311 6.557 1.00 0.00 C ATOM 1117 CE1 PHE A 77 39.677 5.376 9.321 1.00 0.00 C ATOM 1118 CE2 PHE A 77 40.522 5.580 7.058 1.00 0.00 C ATOM 1119 CZ PHE A 77 40.739 5.614 8.440 1.00 0.00 C ATOM 0 H PHE A 77 38.178 1.957 6.705 1.00 0.00 H new ATOM 0 HA PHE A 77 36.577 2.907 7.927 1.00 0.00 H new ATOM 0 HB2 PHE A 77 36.703 5.180 5.892 1.00 0.00 H new ATOM 0 HB3 PHE A 77 36.049 5.284 7.515 1.00 0.00 H new ATOM 0 HD1 PHE A 77 37.580 4.926 9.500 1.00 0.00 H new ATOM 0 HD2 PHE A 77 39.075 5.285 5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 77 39.845 5.399 10.388 1.00 0.00 H new ATOM 0 HE2 PHE A 77 41.341 5.761 6.378 1.00 0.00 H new ATOM 0 HZ PHE A 77 41.725 5.824 8.827 1.00 0.00 H new ATOM 1129 N GLU A 78 34.322 2.368 7.088 1.00 0.00 N ATOM 1130 CA GLU A 78 32.977 2.031 6.625 1.00 0.00 C ATOM 1131 C GLU A 78 32.146 3.292 6.410 1.00 0.00 C ATOM 1132 O GLU A 78 31.360 3.376 5.465 1.00 0.00 O ATOM 1133 CB GLU A 78 32.279 1.129 7.643 1.00 0.00 C ATOM 1134 CG GLU A 78 32.969 -0.235 7.676 1.00 0.00 C ATOM 1135 CD GLU A 78 32.327 -1.117 8.740 1.00 0.00 C ATOM 1136 OE1 GLU A 78 31.374 -0.670 9.358 1.00 0.00 O ATOM 1137 OE2 GLU A 78 32.795 -2.230 8.920 1.00 0.00 O ATOM 0 H GLU A 78 34.521 2.093 8.050 1.00 0.00 H new ATOM 0 HA GLU A 78 33.069 1.504 5.675 1.00 0.00 H new ATOM 0 HB2 GLU A 78 32.309 1.587 8.631 1.00 0.00 H new ATOM 0 HB3 GLU A 78 31.228 1.010 7.379 1.00 0.00 H new ATOM 0 HG2 GLU A 78 32.893 -0.714 6.700 1.00 0.00 H new ATOM 0 HG3 GLU A 78 34.031 -0.110 7.888 1.00 0.00 H new ATOM 1144 N THR A 79 32.319 4.266 7.296 1.00 0.00 N ATOM 1145 CA THR A 79 31.572 5.516 7.198 1.00 0.00 C ATOM 1146 C THR A 79 31.797 6.166 5.837 1.00 0.00 C ATOM 1147 O THR A 79 30.862 6.684 5.225 1.00 0.00 O ATOM 1148 CB THR A 79 32.016 6.480 8.304 1.00 0.00 C ATOM 1149 OG1 THR A 79 31.685 7.809 7.930 1.00 0.00 O ATOM 1150 CG2 THR A 79 33.529 6.374 8.505 1.00 0.00 C ATOM 0 H THR A 79 32.964 4.216 8.084 1.00 0.00 H new ATOM 0 HA THR A 79 30.511 5.294 7.314 1.00 0.00 H new ATOM 0 HB THR A 79 31.509 6.221 9.233 1.00 0.00 H new ATOM 0 HG1 THR A 79 31.966 8.427 8.636 1.00 0.00 H new ATOM 0 HG21 THR A 79 33.840 7.061 9.292 1.00 0.00 H new ATOM 0 HG22 THR A 79 33.788 5.354 8.790 1.00 0.00 H new ATOM 0 HG23 THR A 79 34.038 6.631 7.576 1.00 0.00 H new ATOM 1158 N SER A 80 33.037 6.132 5.366 1.00 0.00 N ATOM 1159 CA SER A 80 33.370 6.717 4.072 1.00 0.00 C ATOM 1160 C SER A 80 32.586 6.035 2.955 1.00 0.00 C ATOM 1161 O SER A 80 32.074 6.694 2.051 1.00 0.00 O ATOM 1162 CB SER A 80 34.869 6.577 3.807 1.00 0.00 C ATOM 1163 OG SER A 80 35.128 6.819 2.430 1.00 0.00 O ATOM 0 H SER A 80 33.825 5.709 5.856 1.00 0.00 H new ATOM 0 HA SER A 80 33.102 7.773 4.093 1.00 0.00 H new ATOM 0 HB2 SER A 80 35.426 7.283 4.423 1.00 0.00 H new ATOM 0 HB3 SER A 80 35.207 5.578 4.082 1.00 0.00 H new ATOM 0 HG SER A 80 36.089 6.731 2.258 1.00 0.00 H new ATOM 1169 N ALA A 81 32.498 4.712 3.026 1.00 0.00 N ATOM 1170 CA ALA A 81 31.777 3.945 2.017 1.00 0.00 C ATOM 1171 C ALA A 81 30.285 4.259 2.065 1.00 0.00 C ATOM 1172 O ALA A 81 29.549 3.965 1.122 1.00 0.00 O ATOM 1173 CB ALA A 81 31.990 2.448 2.242 1.00 0.00 C ATOM 0 H ALA A 81 32.915 4.150 3.768 1.00 0.00 H new ATOM 0 HA ALA A 81 32.165 4.223 1.037 1.00 0.00 H new ATOM 0 HB1 ALA A 81 31.447 1.885 1.483 1.00 0.00 H new ATOM 0 HB2 ALA A 81 33.053 2.217 2.174 1.00 0.00 H new ATOM 0 HB3 ALA A 81 31.622 2.173 3.230 1.00 0.00 H new ATOM 1179 N ALA A 82 29.842 4.854 3.168 1.00 0.00 N ATOM 1180 CA ALA A 82 28.433 5.192 3.323 1.00 0.00 C ATOM 1181 C ALA A 82 27.938 5.982 2.116 1.00 0.00 C ATOM 1182 O ALA A 82 26.900 5.663 1.542 1.00 0.00 O ATOM 1183 CB ALA A 82 28.233 6.025 4.591 1.00 0.00 C ATOM 0 H ALA A 82 30.432 5.110 3.960 1.00 0.00 H new ATOM 0 HA ALA A 82 27.863 4.266 3.400 1.00 0.00 H new ATOM 0 HB1 ALA A 82 27.177 6.274 4.700 1.00 0.00 H new ATOM 0 HB2 ALA A 82 28.562 5.453 5.458 1.00 0.00 H new ATOM 0 HB3 ALA A 82 28.817 6.943 4.519 1.00 0.00 H new ATOM 1189 N LYS A 83 28.688 7.009 1.735 1.00 0.00 N ATOM 1190 CA LYS A 83 28.311 7.832 0.595 1.00 0.00 C ATOM 1191 C LYS A 83 28.309 7.009 -0.691 1.00 0.00 C ATOM 1192 O LYS A 83 27.417 7.151 -1.528 1.00 0.00 O ATOM 1193 CB LYS A 83 29.283 9.001 0.449 1.00 0.00 C ATOM 1194 CG LYS A 83 29.115 9.953 1.633 1.00 0.00 C ATOM 1195 CD LYS A 83 30.083 11.130 1.484 1.00 0.00 C ATOM 1196 CE LYS A 83 29.879 12.111 2.642 1.00 0.00 C ATOM 1197 NZ LYS A 83 30.495 11.553 3.879 1.00 0.00 N ATOM 0 H LYS A 83 29.554 7.289 2.195 1.00 0.00 H new ATOM 0 HA LYS A 83 27.305 8.213 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 83 30.308 8.633 0.407 1.00 0.00 H new ATOM 0 HB3 LYS A 83 29.096 9.529 -0.486 1.00 0.00 H new ATOM 0 HG2 LYS A 83 28.088 10.316 1.678 1.00 0.00 H new ATOM 0 HG3 LYS A 83 29.308 9.426 2.567 1.00 0.00 H new ATOM 0 HD2 LYS A 83 31.112 10.769 1.476 1.00 0.00 H new ATOM 0 HD3 LYS A 83 29.915 11.634 0.533 1.00 0.00 H new ATOM 0 HE2 LYS A 83 30.329 13.074 2.401 1.00 0.00 H new ATOM 0 HE3 LYS A 83 28.815 12.288 2.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 30.462 12.266 4.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 29.969 10.707 4.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 31.484 11.296 3.688 1.00 0.00 H new ATOM 1211 N LEU A 84 29.317 6.156 -0.845 1.00 0.00 N ATOM 1212 CA LEU A 84 29.426 5.323 -2.039 1.00 0.00 C ATOM 1213 C LEU A 84 28.233 4.379 -2.145 1.00 0.00 C ATOM 1214 O LEU A 84 27.681 4.180 -3.225 1.00 0.00 O ATOM 1215 CB LEU A 84 30.720 4.508 -1.988 1.00 0.00 C ATOM 1216 CG LEU A 84 31.907 5.441 -1.722 1.00 0.00 C ATOM 1217 CD1 LEU A 84 33.198 4.618 -1.663 1.00 0.00 C ATOM 1218 CD2 LEU A 84 32.009 6.497 -2.838 1.00 0.00 C ATOM 0 H LEU A 84 30.065 6.023 -0.164 1.00 0.00 H new ATOM 0 HA LEU A 84 29.439 5.973 -2.914 1.00 0.00 H new ATOM 0 HB2 LEU A 84 30.655 3.753 -1.204 1.00 0.00 H new ATOM 0 HB3 LEU A 84 30.865 3.978 -2.929 1.00 0.00 H new ATOM 0 HG LEU A 84 31.758 5.950 -0.770 1.00 0.00 H new ATOM 0 HD11 LEU A 84 34.043 5.280 -1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 84 33.125 3.884 -0.860 1.00 0.00 H new ATOM 0 HD13 LEU A 84 33.345 4.104 -2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 84 32.855 7.155 -2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 84 32.153 6.000 -3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 84 31.092 7.085 -2.868 1.00 0.00 H new ATOM 1230 N LYS A 85 27.839 3.804 -1.018 1.00 0.00 N ATOM 1231 CA LYS A 85 26.705 2.888 -1.001 1.00 0.00 C ATOM 1232 C LYS A 85 25.428 3.609 -1.414 1.00 0.00 C ATOM 1233 O LYS A 85 24.601 3.059 -2.142 1.00 0.00 O ATOM 1234 CB LYS A 85 26.530 2.290 0.395 1.00 0.00 C ATOM 1235 CG LYS A 85 27.653 1.286 0.674 1.00 0.00 C ATOM 1236 CD LYS A 85 27.386 0.562 1.999 1.00 0.00 C ATOM 1237 CE LYS A 85 27.597 1.512 3.183 1.00 0.00 C ATOM 1238 NZ LYS A 85 27.677 0.718 4.442 1.00 0.00 N ATOM 0 H LYS A 85 28.282 3.952 -0.111 1.00 0.00 H new ATOM 0 HA LYS A 85 26.902 2.086 -1.713 1.00 0.00 H new ATOM 0 HB2 LYS A 85 26.543 3.082 1.144 1.00 0.00 H new ATOM 0 HB3 LYS A 85 25.561 1.796 0.470 1.00 0.00 H new ATOM 0 HG2 LYS A 85 27.717 0.563 -0.139 1.00 0.00 H new ATOM 0 HG3 LYS A 85 28.612 1.802 0.718 1.00 0.00 H new ATOM 0 HD2 LYS A 85 26.366 0.178 2.011 1.00 0.00 H new ATOM 0 HD3 LYS A 85 28.051 -0.297 2.091 1.00 0.00 H new ATOM 0 HE2 LYS A 85 28.512 2.088 3.044 1.00 0.00 H new ATOM 0 HE3 LYS A 85 26.776 2.227 3.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 27.820 1.359 5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 26.792 0.187 4.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 28.474 0.053 4.383 1.00 0.00 H new ATOM 1252 N ARG A 86 25.270 4.842 -0.944 1.00 0.00 N ATOM 1253 CA ARG A 86 24.082 5.621 -1.270 1.00 0.00 C ATOM 1254 C ARG A 86 24.002 5.875 -2.769 1.00 0.00 C ATOM 1255 O ARG A 86 22.920 5.854 -3.357 1.00 0.00 O ATOM 1256 CB ARG A 86 24.111 6.958 -0.526 1.00 0.00 C ATOM 1257 CG ARG A 86 23.863 6.721 0.967 1.00 0.00 C ATOM 1258 CD ARG A 86 23.986 8.049 1.716 1.00 0.00 C ATOM 1259 NE ARG A 86 22.934 8.964 1.287 1.00 0.00 N ATOM 1260 CZ ARG A 86 22.923 10.233 1.680 1.00 0.00 C ATOM 1261 NH1 ARG A 86 23.867 10.684 2.457 1.00 0.00 N ATOM 1262 NH2 ARG A 86 21.967 11.029 1.285 1.00 0.00 N ATOM 0 H ARG A 86 25.942 5.319 -0.343 1.00 0.00 H new ATOM 0 HA ARG A 86 23.204 5.053 -0.961 1.00 0.00 H new ATOM 0 HB2 ARG A 86 25.075 7.446 -0.672 1.00 0.00 H new ATOM 0 HB3 ARG A 86 23.351 7.627 -0.930 1.00 0.00 H new ATOM 0 HG2 ARG A 86 22.872 6.294 1.120 1.00 0.00 H new ATOM 0 HG3 ARG A 86 24.583 6.002 1.357 1.00 0.00 H new ATOM 0 HD2 ARG A 86 23.915 7.878 2.790 1.00 0.00 H new ATOM 0 HD3 ARG A 86 24.964 8.493 1.528 1.00 0.00 H new ATOM 0 HE ARG A 86 22.193 8.623 0.674 1.00 0.00 H new ATOM 0 HH11 ARG A 86 24.615 10.063 2.764 1.00 0.00 H new ATOM 0 HH12 ARG A 86 23.858 11.658 2.758 1.00 0.00 H new ATOM 0 HH21 ARG A 86 21.229 10.677 0.675 1.00 0.00 H new ATOM 0 HH22 ARG A 86 21.958 12.003 1.586 1.00 0.00 H new ATOM 1276 N LYS A 87 25.152 6.109 -3.376 1.00 0.00 N ATOM 1277 CA LYS A 87 25.213 6.363 -4.813 1.00 0.00 C ATOM 1278 C LYS A 87 24.699 5.159 -5.596 1.00 0.00 C ATOM 1279 O LYS A 87 23.946 5.311 -6.558 1.00 0.00 O ATOM 1280 CB LYS A 87 26.649 6.678 -5.235 1.00 0.00 C ATOM 1281 CG LYS A 87 26.676 7.049 -6.720 1.00 0.00 C ATOM 1282 CD LYS A 87 28.094 7.462 -7.120 1.00 0.00 C ATOM 1283 CE LYS A 87 28.120 7.833 -8.603 1.00 0.00 C ATOM 1284 NZ LYS A 87 29.498 8.256 -8.984 1.00 0.00 N ATOM 0 H LYS A 87 26.055 6.129 -2.903 1.00 0.00 H new ATOM 0 HA LYS A 87 24.578 7.221 -5.034 1.00 0.00 H new ATOM 0 HB2 LYS A 87 27.043 7.500 -4.637 1.00 0.00 H new ATOM 0 HB3 LYS A 87 27.290 5.815 -5.053 1.00 0.00 H new ATOM 0 HG2 LYS A 87 26.349 6.202 -7.323 1.00 0.00 H new ATOM 0 HG3 LYS A 87 25.980 7.865 -6.914 1.00 0.00 H new ATOM 0 HD2 LYS A 87 28.421 8.309 -6.517 1.00 0.00 H new ATOM 0 HD3 LYS A 87 28.790 6.646 -6.927 1.00 0.00 H new ATOM 0 HE2 LYS A 87 27.809 6.981 -9.208 1.00 0.00 H new ATOM 0 HE3 LYS A 87 27.413 8.639 -8.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 29.517 8.509 -9.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 29.778 9.080 -8.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 30.162 7.474 -8.810 1.00 0.00 H new ATOM 1298 N TYR A 88 25.111 3.963 -5.179 1.00 0.00 N ATOM 1299 CA TYR A 88 24.686 2.732 -5.848 1.00 0.00 C ATOM 1300 C TYR A 88 23.510 2.102 -5.112 1.00 0.00 C ATOM 1301 O TYR A 88 23.514 0.906 -4.822 1.00 0.00 O ATOM 1302 CB TYR A 88 25.848 1.736 -5.891 1.00 0.00 C ATOM 1303 CG TYR A 88 26.958 2.298 -6.750 1.00 0.00 C ATOM 1304 CD1 TYR A 88 26.830 2.292 -8.144 1.00 0.00 C ATOM 1305 CD2 TYR A 88 28.112 2.822 -6.153 1.00 0.00 C ATOM 1306 CE1 TYR A 88 27.855 2.813 -8.943 1.00 0.00 C ATOM 1307 CE2 TYR A 88 29.137 3.342 -6.954 1.00 0.00 C ATOM 1308 CZ TYR A 88 29.009 3.334 -8.347 1.00 0.00 C ATOM 1309 OH TYR A 88 30.021 3.845 -9.136 1.00 0.00 O ATOM 0 H TYR A 88 25.735 3.819 -4.385 1.00 0.00 H new ATOM 0 HA TYR A 88 24.377 2.981 -6.863 1.00 0.00 H new ATOM 0 HB2 TYR A 88 26.215 1.544 -4.883 1.00 0.00 H new ATOM 0 HB3 TYR A 88 25.509 0.782 -6.294 1.00 0.00 H new ATOM 0 HD1 TYR A 88 25.941 1.886 -8.603 1.00 0.00 H new ATOM 0 HD2 TYR A 88 28.211 2.825 -5.078 1.00 0.00 H new ATOM 0 HE1 TYR A 88 27.755 2.813 -10.018 1.00 0.00 H new ATOM 0 HE2 TYR A 88 30.026 3.749 -6.496 1.00 0.00 H new ATOM 0 HH TYR A 88 30.750 4.167 -8.565 1.00 0.00 H new ATOM 1319 N TRP A 89 22.499 2.917 -4.812 1.00 0.00 N ATOM 1320 CA TRP A 89 21.314 2.430 -4.107 1.00 0.00 C ATOM 1321 C TRP A 89 20.080 3.230 -4.514 1.00 0.00 C ATOM 1322 O TRP A 89 19.225 2.737 -5.247 1.00 0.00 O ATOM 1323 CB TRP A 89 21.522 2.547 -2.597 1.00 0.00 C ATOM 1324 CG TRP A 89 20.400 1.862 -1.888 1.00 0.00 C ATOM 1325 CD1 TRP A 89 19.318 2.481 -1.363 1.00 0.00 C ATOM 1326 CD2 TRP A 89 20.232 0.441 -1.614 1.00 0.00 C ATOM 1327 NE1 TRP A 89 18.495 1.531 -0.787 1.00 0.00 N ATOM 1328 CE2 TRP A 89 19.016 0.258 -0.916 1.00 0.00 C ATOM 1329 CE3 TRP A 89 21.010 -0.697 -1.903 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 18.585 -1.009 -0.515 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 20.578 -1.972 -1.501 1.00 0.00 C ATOM 1332 CH2 TRP A 89 19.369 -2.127 -0.810 1.00 0.00 C ATOM 0 H TRP A 89 22.476 3.910 -5.044 1.00 0.00 H new ATOM 0 HA TRP A 89 21.160 1.385 -4.374 1.00 0.00 H new ATOM 0 HB2 TRP A 89 22.474 2.098 -2.314 1.00 0.00 H new ATOM 0 HB3 TRP A 89 21.565 3.596 -2.305 1.00 0.00 H new ATOM 0 HD1 TRP A 89 19.128 3.544 -1.389 1.00 0.00 H new ATOM 0 HE1 TRP A 89 17.612 1.744 -0.324 1.00 0.00 H new ATOM 0 HE3 TRP A 89 21.943 -0.589 -2.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 17.653 -1.123 0.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 21.182 -2.839 -1.726 1.00 0.00 H new ATOM 0 HH2 TRP A 89 19.043 -3.111 -0.505 1.00 0.00 H new ATOM 1343 N TRP A 90 19.995 4.466 -4.034 1.00 0.00 N ATOM 1344 CA TRP A 90 18.857 5.323 -4.353 1.00 0.00 C ATOM 1345 C TRP A 90 18.694 5.458 -5.863 1.00 0.00 C ATOM 1346 O TRP A 90 17.578 5.522 -6.374 1.00 0.00 O ATOM 1347 CB TRP A 90 19.057 6.708 -3.735 1.00 0.00 C ATOM 1348 CG TRP A 90 18.904 6.622 -2.249 1.00 0.00 C ATOM 1349 CD1 TRP A 90 19.925 6.586 -1.364 1.00 0.00 C ATOM 1350 CD2 TRP A 90 17.678 6.565 -1.464 1.00 0.00 C ATOM 1351 NE1 TRP A 90 19.405 6.506 -0.084 1.00 0.00 N ATOM 1352 CE2 TRP A 90 18.025 6.491 -0.093 1.00 0.00 C ATOM 1353 CE3 TRP A 90 16.313 6.569 -1.804 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 17.051 6.424 0.903 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 15.331 6.502 -0.802 1.00 0.00 C ATOM 1356 CH2 TRP A 90 15.699 6.430 0.548 1.00 0.00 C ATOM 0 H TRP A 90 20.694 4.895 -3.427 1.00 0.00 H new ATOM 0 HA TRP A 90 17.957 4.867 -3.941 1.00 0.00 H new ATOM 0 HB2 TRP A 90 20.046 7.090 -3.987 1.00 0.00 H new ATOM 0 HB3 TRP A 90 18.330 7.409 -4.146 1.00 0.00 H new ATOM 0 HD1 TRP A 90 20.975 6.615 -1.615 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.972 6.463 0.763 1.00 0.00 H new ATOM 0 HE3 TRP A 90 16.018 6.624 -2.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 17.340 6.368 1.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 14.286 6.506 -1.074 1.00 0.00 H new ATOM 0 HH2 TRP A 90 14.939 6.379 1.314 1.00 0.00 H new ATOM 1367 N LYS A 91 19.815 5.506 -6.570 1.00 0.00 N ATOM 1368 CA LYS A 91 19.781 5.638 -8.020 1.00 0.00 C ATOM 1369 C LYS A 91 19.075 4.439 -8.647 1.00 0.00 C ATOM 1370 O LYS A 91 18.558 3.575 -7.941 1.00 0.00 O ATOM 1371 CB LYS A 91 21.205 5.742 -8.566 1.00 0.00 C ATOM 1372 CG LYS A 91 21.973 6.837 -7.818 1.00 0.00 C ATOM 1373 CD LYS A 91 21.317 8.202 -8.066 1.00 0.00 C ATOM 1374 CE LYS A 91 22.299 9.317 -7.707 1.00 0.00 C ATOM 1375 NZ LYS A 91 22.618 9.242 -6.256 1.00 0.00 N ATOM 0 H LYS A 91 20.751 5.456 -6.168 1.00 0.00 H new ATOM 0 HA LYS A 91 19.230 6.543 -8.275 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.717 4.786 -8.455 1.00 0.00 H new ATOM 0 HB3 LYS A 91 21.179 5.968 -9.632 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.985 6.619 -6.750 1.00 0.00 H new ATOM 0 HG3 LYS A 91 23.011 6.857 -8.151 1.00 0.00 H new ATOM 0 HD2 LYS A 91 21.019 8.289 -9.111 1.00 0.00 H new ATOM 0 HD3 LYS A 91 20.411 8.295 -7.467 1.00 0.00 H new ATOM 0 HE2 LYS A 91 23.210 9.219 -8.297 1.00 0.00 H new ATOM 0 HE3 LYS A 91 21.867 10.289 -7.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.648 10.202 -5.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.887 8.687 -5.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.543 8.785 -6.127 1.00 0.00 H new ATOM 1389 N ASN A 92 19.050 4.403 -9.978 1.00 0.00 N ATOM 1390 CA ASN A 92 18.395 3.314 -10.705 1.00 0.00 C ATOM 1391 C ASN A 92 19.393 2.208 -11.041 1.00 0.00 C ATOM 1392 O ASN A 92 19.131 1.359 -11.892 1.00 0.00 O ATOM 1393 CB ASN A 92 17.778 3.852 -11.996 1.00 0.00 C ATOM 1394 CG ASN A 92 16.594 4.757 -11.666 1.00 0.00 C ATOM 1395 OD1 ASN A 92 16.018 4.655 -10.582 1.00 0.00 O ATOM 1396 ND2 ASN A 92 16.199 5.644 -12.538 1.00 0.00 N ATOM 0 H ASN A 92 19.474 5.113 -10.575 1.00 0.00 H new ATOM 0 HA ASN A 92 17.614 2.898 -10.069 1.00 0.00 H new ATOM 0 HB2 ASN A 92 18.525 4.408 -12.563 1.00 0.00 H new ATOM 0 HB3 ASN A 92 17.451 3.025 -12.626 1.00 0.00 H new ATOM 0 HD21 ASN A 92 15.411 6.255 -12.323 1.00 0.00 H new ATOM 0 HD22 ASN A 92 16.678 5.726 -13.435 1.00 0.00 H new ATOM 1403 N LEU A 93 20.538 2.228 -10.365 1.00 0.00 N ATOM 1404 CA LEU A 93 21.578 1.226 -10.592 1.00 0.00 C ATOM 1405 C LEU A 93 21.270 -0.043 -9.803 1.00 0.00 C ATOM 1406 O LEU A 93 22.043 -1.001 -9.817 1.00 0.00 O ATOM 1407 CB LEU A 93 22.951 1.784 -10.180 1.00 0.00 C ATOM 1408 CG LEU A 93 23.518 2.651 -11.308 1.00 0.00 C ATOM 1409 CD1 LEU A 93 22.548 3.793 -11.610 1.00 0.00 C ATOM 1410 CD2 LEU A 93 24.863 3.231 -10.875 1.00 0.00 C ATOM 0 H LEU A 93 20.770 2.925 -9.657 1.00 0.00 H new ATOM 0 HA LEU A 93 21.601 0.982 -11.654 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.855 2.374 -9.268 1.00 0.00 H new ATOM 0 HB3 LEU A 93 23.635 0.965 -9.959 1.00 0.00 H new ATOM 0 HG LEU A 93 23.653 2.042 -12.202 1.00 0.00 H new ATOM 0 HD11 LEU A 93 22.951 4.410 -12.413 1.00 0.00 H new ATOM 0 HD12 LEU A 93 21.586 3.382 -11.917 1.00 0.00 H new ATOM 0 HD13 LEU A 93 22.414 4.402 -10.716 1.00 0.00 H new ATOM 0 HD21 LEU A 93 25.268 3.848 -11.677 1.00 0.00 H new ATOM 0 HD22 LEU A 93 24.726 3.840 -9.982 1.00 0.00 H new ATOM 0 HD23 LEU A 93 25.556 2.419 -10.657 1.00 0.00 H new ATOM 1422 N LYS A 94 20.142 -0.045 -9.115 1.00 0.00 N ATOM 1423 CA LYS A 94 19.754 -1.203 -8.325 1.00 0.00 C ATOM 1424 C LYS A 94 19.630 -2.440 -9.211 1.00 0.00 C ATOM 1425 O LYS A 94 20.027 -3.540 -8.823 1.00 0.00 O ATOM 1426 CB LYS A 94 18.417 -0.938 -7.635 1.00 0.00 C ATOM 1427 CG LYS A 94 18.594 0.146 -6.566 1.00 0.00 C ATOM 1428 CD LYS A 94 17.239 0.471 -5.907 1.00 0.00 C ATOM 1429 CE LYS A 94 16.939 -0.533 -4.788 1.00 0.00 C ATOM 1430 NZ LYS A 94 18.006 -0.442 -3.751 1.00 0.00 N ATOM 0 H LYS A 94 19.483 0.733 -9.086 1.00 0.00 H new ATOM 0 HA LYS A 94 20.524 -1.381 -7.575 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.675 -0.622 -8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 94 18.044 -1.855 -7.179 1.00 0.00 H new ATOM 0 HG2 LYS A 94 19.303 -0.191 -5.810 1.00 0.00 H new ATOM 0 HG3 LYS A 94 19.013 1.046 -7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 94 17.257 1.483 -5.502 1.00 0.00 H new ATOM 0 HD3 LYS A 94 16.446 0.441 -6.655 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.966 -0.322 -4.345 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.893 -1.544 -5.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 17.572 -0.433 -2.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 18.640 -1.262 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.551 0.433 -3.890 1.00 0.00 H new ATOM 1444 N MET A 95 19.079 -2.252 -10.403 1.00 0.00 N ATOM 1445 CA MET A 95 18.903 -3.360 -11.334 1.00 0.00 C ATOM 1446 C MET A 95 20.254 -3.969 -11.696 1.00 0.00 C ATOM 1447 O MET A 95 20.380 -5.186 -11.824 1.00 0.00 O ATOM 1448 CB MET A 95 18.207 -2.866 -12.602 1.00 0.00 C ATOM 1449 CG MET A 95 16.882 -2.192 -12.228 1.00 0.00 C ATOM 1450 SD MET A 95 15.761 -3.404 -11.476 1.00 0.00 S ATOM 1451 CE MET A 95 15.116 -4.126 -13.007 1.00 0.00 C ATOM 0 H MET A 95 18.748 -1.350 -10.747 1.00 0.00 H new ATOM 0 HA MET A 95 18.288 -4.123 -10.856 1.00 0.00 H new ATOM 0 HB2 MET A 95 18.849 -2.162 -13.131 1.00 0.00 H new ATOM 0 HB3 MET A 95 18.024 -3.701 -13.278 1.00 0.00 H new ATOM 0 HG2 MET A 95 17.065 -1.373 -11.533 1.00 0.00 H new ATOM 0 HG3 MET A 95 16.421 -1.760 -13.116 1.00 0.00 H new ATOM 0 HE1 MET A 95 14.308 -4.818 -12.771 1.00 0.00 H new ATOM 0 HE2 MET A 95 14.738 -3.333 -13.652 1.00 0.00 H new ATOM 0 HE3 MET A 95 15.914 -4.662 -13.521 1.00 0.00 H new ATOM 1461 N MET A 96 21.260 -3.115 -11.857 1.00 0.00 N ATOM 1462 CA MET A 96 22.599 -3.579 -12.206 1.00 0.00 C ATOM 1463 C MET A 96 23.136 -4.522 -11.136 1.00 0.00 C ATOM 1464 O MET A 96 23.888 -5.449 -11.433 1.00 0.00 O ATOM 1465 CB MET A 96 23.547 -2.388 -12.362 1.00 0.00 C ATOM 1466 CG MET A 96 23.132 -1.560 -13.578 1.00 0.00 C ATOM 1467 SD MET A 96 24.292 -0.189 -13.798 1.00 0.00 S ATOM 1468 CE MET A 96 23.362 0.694 -15.075 1.00 0.00 C ATOM 0 H MET A 96 21.175 -2.104 -11.752 1.00 0.00 H new ATOM 0 HA MET A 96 22.538 -4.117 -13.152 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.523 -1.771 -11.464 1.00 0.00 H new ATOM 0 HB3 MET A 96 24.572 -2.739 -12.481 1.00 0.00 H new ATOM 0 HG2 MET A 96 23.119 -2.186 -14.470 1.00 0.00 H new ATOM 0 HG3 MET A 96 22.121 -1.177 -13.442 1.00 0.00 H new ATOM 0 HE1 MET A 96 23.906 1.593 -15.366 1.00 0.00 H new ATOM 0 HE2 MET A 96 23.236 0.049 -15.945 1.00 0.00 H new ATOM 0 HE3 MET A 96 22.383 0.973 -14.685 1.00 0.00 H new ATOM 1478 N ILE A 97 22.746 -4.278 -9.889 1.00 0.00 N ATOM 1479 CA ILE A 97 23.195 -5.113 -8.781 1.00 0.00 C ATOM 1480 C ILE A 97 22.738 -6.552 -8.983 1.00 0.00 C ATOM 1481 O ILE A 97 23.492 -7.492 -8.736 1.00 0.00 O ATOM 1482 CB ILE A 97 22.632 -4.586 -7.459 1.00 0.00 C ATOM 1483 CG1 ILE A 97 23.021 -3.115 -7.295 1.00 0.00 C ATOM 1484 CG2 ILE A 97 23.201 -5.402 -6.294 1.00 0.00 C ATOM 1485 CD1 ILE A 97 22.353 -2.539 -6.042 1.00 0.00 C ATOM 0 H ILE A 97 22.125 -3.515 -9.622 1.00 0.00 H new ATOM 0 HA ILE A 97 24.284 -5.082 -8.749 1.00 0.00 H new ATOM 0 HB ILE A 97 21.546 -4.678 -7.463 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.104 -3.022 -7.216 1.00 0.00 H new ATOM 0 HG13 ILE A 97 22.716 -2.548 -8.175 1.00 0.00 H new ATOM 0 HG21 ILE A 97 22.798 -5.024 -5.354 1.00 0.00 H new ATOM 0 HG22 ILE A 97 22.923 -6.449 -6.413 1.00 0.00 H new ATOM 0 HG23 ILE A 97 24.287 -5.314 -6.285 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.633 -1.492 -5.929 1.00 0.00 H new ATOM 0 HD12 ILE A 97 21.270 -2.617 -6.139 1.00 0.00 H new ATOM 0 HD13 ILE A 97 22.680 -3.098 -5.166 1.00 0.00 H new ATOM 1497 N ILE A 98 21.497 -6.720 -9.421 1.00 0.00 N ATOM 1498 CA ILE A 98 20.953 -8.060 -9.638 1.00 0.00 C ATOM 1499 C ILE A 98 21.800 -8.808 -10.670 1.00 0.00 C ATOM 1500 O ILE A 98 22.085 -9.996 -10.507 1.00 0.00 O ATOM 1501 CB ILE A 98 19.489 -7.966 -10.125 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.563 -7.700 -8.929 1.00 0.00 C ATOM 1503 CG2 ILE A 98 19.059 -9.277 -10.808 1.00 0.00 C ATOM 1504 CD1 ILE A 98 18.897 -6.340 -8.315 1.00 0.00 C ATOM 0 H ILE A 98 20.853 -5.958 -9.632 1.00 0.00 H new ATOM 0 HA ILE A 98 20.977 -8.607 -8.696 1.00 0.00 H new ATOM 0 HB ILE A 98 19.417 -7.149 -10.843 1.00 0.00 H new ATOM 0 HG12 ILE A 98 17.522 -7.719 -9.251 1.00 0.00 H new ATOM 0 HG13 ILE A 98 18.681 -8.486 -8.183 1.00 0.00 H new ATOM 0 HG21 ILE A 98 18.026 -9.190 -11.144 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.704 -9.469 -11.665 1.00 0.00 H new ATOM 0 HG23 ILE A 98 19.142 -10.101 -10.099 1.00 0.00 H new ATOM 0 HD11 ILE A 98 18.239 -6.152 -7.466 1.00 0.00 H new ATOM 0 HD12 ILE A 98 19.934 -6.338 -7.978 1.00 0.00 H new ATOM 0 HD13 ILE A 98 18.757 -5.559 -9.062 1.00 0.00 H new ATOM 1516 N LEU A 99 22.189 -8.117 -11.732 1.00 0.00 N ATOM 1517 CA LEU A 99 22.987 -8.741 -12.780 1.00 0.00 C ATOM 1518 C LEU A 99 24.312 -9.244 -12.211 1.00 0.00 C ATOM 1519 O LEU A 99 24.772 -10.331 -12.557 1.00 0.00 O ATOM 1520 CB LEU A 99 23.245 -7.731 -13.914 1.00 0.00 C ATOM 1521 CG LEU A 99 22.083 -7.741 -14.916 1.00 0.00 C ATOM 1522 CD1 LEU A 99 20.797 -7.293 -14.225 1.00 0.00 C ATOM 1523 CD2 LEU A 99 22.405 -6.781 -16.065 1.00 0.00 C ATOM 0 H LEU A 99 21.968 -7.134 -11.891 1.00 0.00 H new ATOM 0 HA LEU A 99 22.437 -9.592 -13.181 1.00 0.00 H new ATOM 0 HB2 LEU A 99 23.366 -6.731 -13.498 1.00 0.00 H new ATOM 0 HB3 LEU A 99 24.176 -7.978 -14.425 1.00 0.00 H new ATOM 0 HG LEU A 99 21.946 -8.751 -15.303 1.00 0.00 H new ATOM 0 HD11 LEU A 99 19.976 -7.302 -14.942 1.00 0.00 H new ATOM 0 HD12 LEU A 99 20.569 -7.973 -13.404 1.00 0.00 H new ATOM 0 HD13 LEU A 99 20.926 -6.283 -13.835 1.00 0.00 H new ATOM 0 HD21 LEU A 99 21.584 -6.783 -16.782 1.00 0.00 H new ATOM 0 HD22 LEU A 99 22.541 -5.774 -15.671 1.00 0.00 H new ATOM 0 HD23 LEU A 99 23.320 -7.102 -16.562 1.00 0.00 H new ATOM 1535 N GLY A 100 24.916 -8.451 -11.340 1.00 0.00 N ATOM 1536 CA GLY A 100 26.184 -8.835 -10.739 1.00 0.00 C ATOM 1537 C GLY A 100 26.028 -10.100 -9.902 1.00 0.00 C ATOM 1538 O GLY A 100 26.927 -10.940 -9.858 1.00 0.00 O ATOM 0 H GLY A 100 24.554 -7.547 -11.036 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.926 -9.000 -11.520 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.555 -8.023 -10.113 1.00 0.00 H new ATOM 1542 N VAL A 101 24.886 -10.231 -9.236 1.00 0.00 N ATOM 1543 CA VAL A 101 24.631 -11.399 -8.402 1.00 0.00 C ATOM 1544 C VAL A 101 24.613 -12.672 -9.247 1.00 0.00 C ATOM 1545 O VAL A 101 25.216 -13.680 -8.878 1.00 0.00 O ATOM 1546 CB VAL A 101 23.287 -11.243 -7.681 1.00 0.00 C ATOM 1547 CG1 VAL A 101 22.949 -12.532 -6.926 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.377 -10.081 -6.688 1.00 0.00 C ATOM 0 H VAL A 101 24.128 -9.549 -9.257 1.00 0.00 H new ATOM 0 HA VAL A 101 25.432 -11.478 -7.667 1.00 0.00 H new ATOM 0 HB VAL A 101 22.506 -11.041 -8.414 1.00 0.00 H new ATOM 0 HG11 VAL A 101 21.993 -12.415 -6.416 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.885 -13.361 -7.631 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.728 -12.739 -6.193 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.423 -9.967 -6.174 1.00 0.00 H new ATOM 0 HG22 VAL A 101 24.160 -10.286 -5.958 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.612 -9.162 -7.224 1.00 0.00 H new ATOM 1558 N ILE A 102 23.916 -12.620 -10.377 1.00 0.00 N ATOM 1559 CA ILE A 102 23.823 -13.781 -11.258 1.00 0.00 C ATOM 1560 C ILE A 102 25.196 -14.160 -11.785 1.00 0.00 C ATOM 1561 O ILE A 102 25.591 -15.327 -11.757 1.00 0.00 O ATOM 1562 CB ILE A 102 22.893 -13.463 -12.426 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.529 -13.023 -11.884 1.00 0.00 C ATOM 1564 CG2 ILE A 102 22.716 -14.714 -13.288 1.00 0.00 C ATOM 1565 CD1 ILE A 102 20.730 -12.377 -13.010 1.00 0.00 C ATOM 0 H ILE A 102 23.411 -11.796 -10.703 1.00 0.00 H new ATOM 0 HA ILE A 102 23.423 -14.621 -10.691 1.00 0.00 H new ATOM 0 HB ILE A 102 23.323 -12.662 -13.028 1.00 0.00 H new ATOM 0 HG12 ILE A 102 20.989 -13.881 -11.484 1.00 0.00 H new ATOM 0 HG13 ILE A 102 21.660 -12.318 -11.063 1.00 0.00 H new ATOM 0 HG21 ILE A 102 22.052 -14.490 -14.123 1.00 0.00 H new ATOM 0 HG22 ILE A 102 23.686 -15.032 -13.671 1.00 0.00 H new ATOM 0 HG23 ILE A 102 22.284 -15.513 -12.685 1.00 0.00 H new ATOM 0 HD11 ILE A 102 19.758 -12.061 -12.632 1.00 0.00 H new ATOM 0 HD12 ILE A 102 21.271 -11.510 -13.389 1.00 0.00 H new ATOM 0 HD13 ILE A 102 20.589 -13.097 -13.816 1.00 0.00 H new ATOM 1577 N CYS A 103 25.918 -13.162 -12.261 1.00 0.00 N ATOM 1578 CA CYS A 103 27.261 -13.387 -12.796 1.00 0.00 C ATOM 1579 C CYS A 103 28.185 -13.935 -11.714 1.00 0.00 C ATOM 1580 O CYS A 103 29.044 -14.776 -11.987 1.00 0.00 O ATOM 1581 CB CYS A 103 27.843 -12.084 -13.347 1.00 0.00 C ATOM 1582 SG CYS A 103 26.859 -11.554 -14.766 1.00 0.00 S ATOM 0 H CYS A 103 25.605 -12.192 -12.291 1.00 0.00 H new ATOM 0 HA CYS A 103 27.184 -14.116 -13.603 1.00 0.00 H new ATOM 0 HB2 CYS A 103 27.837 -11.313 -12.576 1.00 0.00 H new ATOM 0 HB3 CYS A 103 28.882 -12.231 -13.643 1.00 0.00 H new ATOM 0 HG CYS A 103 25.790 -10.944 -14.349 1.00 0.00 H new ATOM 1588 N ALA A 104 28.008 -13.454 -10.491 1.00 0.00 N ATOM 1589 CA ALA A 104 28.830 -13.901 -9.378 1.00 0.00 C ATOM 1590 C ALA A 104 28.663 -15.400 -9.160 1.00 0.00 C ATOM 1591 O ALA A 104 29.619 -16.099 -8.821 1.00 0.00 O ATOM 1592 CB ALA A 104 28.433 -13.156 -8.103 1.00 0.00 C ATOM 0 H ALA A 104 27.305 -12.757 -10.246 1.00 0.00 H new ATOM 0 HA ALA A 104 29.873 -13.690 -9.614 1.00 0.00 H new ATOM 0 HB1 ALA A 104 29.054 -13.497 -7.274 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.577 -12.085 -8.248 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.385 -13.354 -7.877 1.00 0.00 H new ATOM 1598 N ILE A 105 27.443 -15.890 -9.354 1.00 0.00 N ATOM 1599 CA ILE A 105 27.166 -17.310 -9.171 1.00 0.00 C ATOM 1600 C ILE A 105 27.937 -18.143 -10.189 1.00 0.00 C ATOM 1601 O ILE A 105 28.527 -19.167 -9.849 1.00 0.00 O ATOM 1602 CB ILE A 105 25.665 -17.576 -9.322 1.00 0.00 C ATOM 1603 CG1 ILE A 105 24.916 -16.918 -8.160 1.00 0.00 C ATOM 1604 CG2 ILE A 105 25.399 -19.088 -9.302 1.00 0.00 C ATOM 1605 CD1 ILE A 105 23.409 -16.949 -8.434 1.00 0.00 C ATOM 0 H ILE A 105 26.637 -15.331 -9.635 1.00 0.00 H new ATOM 0 HA ILE A 105 27.485 -17.595 -8.169 1.00 0.00 H new ATOM 0 HB ILE A 105 25.320 -17.161 -10.269 1.00 0.00 H new ATOM 0 HG12 ILE A 105 25.137 -17.441 -7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 105 25.252 -15.889 -8.035 1.00 0.00 H new ATOM 0 HG21 ILE A 105 24.330 -19.271 -9.410 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.933 -19.562 -10.125 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.745 -19.506 -8.357 1.00 0.00 H new ATOM 0 HD11 ILE A 105 22.879 -16.480 -7.605 1.00 0.00 H new ATOM 0 HD12 ILE A 105 23.195 -16.406 -9.355 1.00 0.00 H new ATOM 0 HD13 ILE A 105 23.079 -17.983 -8.537 1.00 0.00 H new ATOM 1617 N ILE A 106 27.927 -17.694 -11.438 1.00 0.00 N ATOM 1618 CA ILE A 106 28.621 -18.402 -12.507 1.00 0.00 C ATOM 1619 C ILE A 106 30.108 -18.470 -12.211 1.00 0.00 C ATOM 1620 O ILE A 106 30.758 -19.483 -12.469 1.00 0.00 O ATOM 1621 CB ILE A 106 28.392 -17.702 -13.847 1.00 0.00 C ATOM 1622 CG1 ILE A 106 26.889 -17.556 -14.090 1.00 0.00 C ATOM 1623 CG2 ILE A 106 29.005 -18.541 -14.970 1.00 0.00 C ATOM 1624 CD1 ILE A 106 26.650 -16.681 -15.321 1.00 0.00 C ATOM 0 H ILE A 106 27.447 -16.845 -11.735 1.00 0.00 H new ATOM 0 HA ILE A 106 28.222 -19.415 -12.565 1.00 0.00 H new ATOM 0 HB ILE A 106 28.859 -16.717 -13.829 1.00 0.00 H new ATOM 0 HG12 ILE A 106 26.437 -18.537 -14.236 1.00 0.00 H new ATOM 0 HG13 ILE A 106 26.411 -17.111 -13.217 1.00 0.00 H new ATOM 0 HG21 ILE A 106 28.843 -18.043 -15.926 1.00 0.00 H new ATOM 0 HG22 ILE A 106 30.075 -18.654 -14.797 1.00 0.00 H new ATOM 0 HG23 ILE A 106 28.534 -19.524 -14.988 1.00 0.00 H new ATOM 0 HD11 ILE A 106 25.578 -16.579 -15.492 1.00 0.00 H new ATOM 0 HD12 ILE A 106 27.087 -15.696 -15.158 1.00 0.00 H new ATOM 0 HD13 ILE A 106 27.114 -17.144 -16.192 1.00 0.00 H new ATOM 1636 N LEU A 107 30.644 -17.383 -11.677 1.00 0.00 N ATOM 1637 CA LEU A 107 32.063 -17.327 -11.360 1.00 0.00 C ATOM 1638 C LEU A 107 32.435 -18.436 -10.383 1.00 0.00 C ATOM 1639 O LEU A 107 33.516 -19.013 -10.481 1.00 0.00 O ATOM 1640 CB LEU A 107 32.419 -15.967 -10.746 1.00 0.00 C ATOM 1641 CG LEU A 107 33.927 -15.899 -10.427 1.00 0.00 C ATOM 1642 CD1 LEU A 107 34.760 -16.114 -11.706 1.00 0.00 C ATOM 1643 CD2 LEU A 107 34.250 -14.527 -9.819 1.00 0.00 C ATOM 0 H LEU A 107 30.123 -16.534 -11.456 1.00 0.00 H new ATOM 0 HA LEU A 107 32.624 -17.462 -12.285 1.00 0.00 H new ATOM 0 HB2 LEU A 107 32.151 -15.168 -11.437 1.00 0.00 H new ATOM 0 HB3 LEU A 107 31.841 -15.809 -9.836 1.00 0.00 H new ATOM 0 HG LEU A 107 34.178 -16.687 -9.717 1.00 0.00 H new ATOM 0 HD11 LEU A 107 35.821 -16.063 -11.462 1.00 0.00 H new ATOM 0 HD12 LEU A 107 34.532 -17.092 -12.129 1.00 0.00 H new ATOM 0 HD13 LEU A 107 34.517 -15.339 -12.433 1.00 0.00 H new ATOM 0 HD21 LEU A 107 35.314 -14.472 -9.591 1.00 0.00 H new ATOM 0 HD22 LEU A 107 33.990 -13.743 -10.531 1.00 0.00 H new ATOM 0 HD23 LEU A 107 33.675 -14.390 -8.903 1.00 0.00 H new ATOM 1655 N ILE A 108 31.549 -18.716 -9.434 1.00 0.00 N ATOM 1656 CA ILE A 108 31.820 -19.747 -8.438 1.00 0.00 C ATOM 1657 C ILE A 108 31.995 -21.108 -9.115 1.00 0.00 C ATOM 1658 O ILE A 108 32.899 -21.865 -8.780 1.00 0.00 O ATOM 1659 CB ILE A 108 30.663 -19.817 -7.437 1.00 0.00 C ATOM 1660 CG1 ILE A 108 30.627 -18.524 -6.615 1.00 0.00 C ATOM 1661 CG2 ILE A 108 30.858 -21.015 -6.500 1.00 0.00 C ATOM 1662 CD1 ILE A 108 29.342 -18.475 -5.782 1.00 0.00 C ATOM 0 H ILE A 108 30.647 -18.250 -9.333 1.00 0.00 H new ATOM 0 HA ILE A 108 32.741 -19.493 -7.913 1.00 0.00 H new ATOM 0 HB ILE A 108 29.724 -19.935 -7.977 1.00 0.00 H new ATOM 0 HG12 ILE A 108 31.498 -18.474 -5.961 1.00 0.00 H new ATOM 0 HG13 ILE A 108 30.675 -17.660 -7.277 1.00 0.00 H new ATOM 0 HG21 ILE A 108 30.032 -21.060 -5.790 1.00 0.00 H new ATOM 0 HG22 ILE A 108 30.884 -21.934 -7.085 1.00 0.00 H new ATOM 0 HG23 ILE A 108 31.797 -20.904 -5.958 1.00 0.00 H new ATOM 0 HD11 ILE A 108 29.321 -17.554 -5.199 1.00 0.00 H new ATOM 0 HD12 ILE A 108 28.477 -18.505 -6.445 1.00 0.00 H new ATOM 0 HD13 ILE A 108 29.312 -19.331 -5.108 1.00 0.00 H new ATOM 1674 N ILE A 109 31.127 -21.415 -10.064 1.00 0.00 N ATOM 1675 CA ILE A 109 31.214 -22.687 -10.773 1.00 0.00 C ATOM 1676 C ILE A 109 32.482 -22.740 -11.627 1.00 0.00 C ATOM 1677 O ILE A 109 33.170 -23.760 -11.669 1.00 0.00 O ATOM 1678 CB ILE A 109 29.970 -22.886 -11.659 1.00 0.00 C ATOM 1679 CG1 ILE A 109 28.723 -23.154 -10.786 1.00 0.00 C ATOM 1680 CG2 ILE A 109 30.186 -24.068 -12.616 1.00 0.00 C ATOM 1681 CD1 ILE A 109 28.168 -21.845 -10.213 1.00 0.00 C ATOM 0 H ILE A 109 30.361 -20.811 -10.361 1.00 0.00 H new ATOM 0 HA ILE A 109 31.258 -23.491 -10.038 1.00 0.00 H new ATOM 0 HB ILE A 109 29.812 -21.976 -12.237 1.00 0.00 H new ATOM 0 HG12 ILE A 109 27.956 -23.649 -11.382 1.00 0.00 H new ATOM 0 HG13 ILE A 109 28.982 -23.832 -9.972 1.00 0.00 H new ATOM 0 HG21 ILE A 109 29.300 -24.200 -13.238 1.00 0.00 H new ATOM 0 HG22 ILE A 109 31.049 -23.869 -13.251 1.00 0.00 H new ATOM 0 HG23 ILE A 109 30.362 -24.976 -12.039 1.00 0.00 H new ATOM 0 HD11 ILE A 109 27.291 -22.058 -9.602 1.00 0.00 H new ATOM 0 HD12 ILE A 109 28.930 -21.365 -9.599 1.00 0.00 H new ATOM 0 HD13 ILE A 109 27.888 -21.180 -11.030 1.00 0.00 H new ATOM 1693 N ILE A 110 32.772 -21.648 -12.320 1.00 0.00 N ATOM 1694 CA ILE A 110 33.942 -21.604 -13.184 1.00 0.00 C ATOM 1695 C ILE A 110 35.220 -21.832 -12.387 1.00 0.00 C ATOM 1696 O ILE A 110 36.033 -22.686 -12.736 1.00 0.00 O ATOM 1697 CB ILE A 110 34.014 -20.243 -13.880 1.00 0.00 C ATOM 1698 CG1 ILE A 110 32.824 -20.090 -14.833 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.319 -20.134 -14.670 1.00 0.00 C ATOM 1700 CD1 ILE A 110 32.735 -18.639 -15.313 1.00 0.00 C ATOM 0 H ILE A 110 32.220 -20.790 -12.302 1.00 0.00 H new ATOM 0 HA ILE A 110 33.850 -22.398 -13.925 1.00 0.00 H new ATOM 0 HB ILE A 110 33.981 -19.454 -13.129 1.00 0.00 H new ATOM 0 HG12 ILE A 110 32.939 -20.759 -15.685 1.00 0.00 H new ATOM 0 HG13 ILE A 110 31.901 -20.374 -14.327 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.365 -19.163 -15.164 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.165 -20.236 -13.991 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.358 -20.924 -15.420 1.00 0.00 H new ATOM 0 HD11 ILE A 110 31.888 -18.531 -15.991 1.00 0.00 H new ATOM 0 HD12 ILE A 110 32.600 -17.980 -14.456 1.00 0.00 H new ATOM 0 HD13 ILE A 110 33.654 -18.371 -15.835 1.00 0.00 H new ATOM 1712 N ILE A 111 35.395 -21.063 -11.321 1.00 0.00 N ATOM 1713 CA ILE A 111 36.589 -21.187 -10.496 1.00 0.00 C ATOM 1714 C ILE A 111 36.614 -22.535 -9.782 1.00 0.00 C ATOM 1715 O ILE A 111 37.670 -23.150 -9.630 1.00 0.00 O ATOM 1716 CB ILE A 111 36.644 -20.044 -9.477 1.00 0.00 C ATOM 1717 CG1 ILE A 111 38.008 -20.036 -8.775 1.00 0.00 C ATOM 1718 CG2 ILE A 111 35.543 -20.226 -8.434 1.00 0.00 C ATOM 1719 CD1 ILE A 111 39.133 -19.696 -9.767 1.00 0.00 C ATOM 0 H ILE A 111 34.732 -20.353 -11.009 1.00 0.00 H new ATOM 0 HA ILE A 111 37.465 -21.127 -11.142 1.00 0.00 H new ATOM 0 HB ILE A 111 36.498 -19.099 -10.000 1.00 0.00 H new ATOM 0 HG12 ILE A 111 38.000 -19.308 -7.964 1.00 0.00 H new ATOM 0 HG13 ILE A 111 38.196 -21.011 -8.326 1.00 0.00 H new ATOM 0 HG21 ILE A 111 35.587 -19.410 -7.712 1.00 0.00 H new ATOM 0 HG22 ILE A 111 34.571 -20.222 -8.927 1.00 0.00 H new ATOM 0 HG23 ILE A 111 35.684 -21.175 -7.918 1.00 0.00 H new ATOM 0 HD11 ILE A 111 40.090 -19.696 -9.246 1.00 0.00 H new ATOM 0 HD12 ILE A 111 39.153 -20.440 -10.563 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.954 -18.710 -10.196 1.00 0.00 H new ATOM 1731 N VAL A 112 35.444 -22.988 -9.352 1.00 0.00 N ATOM 1732 CA VAL A 112 35.333 -24.264 -8.660 1.00 0.00 C ATOM 1733 C VAL A 112 35.702 -25.402 -9.603 1.00 0.00 C ATOM 1734 O VAL A 112 36.334 -26.376 -9.199 1.00 0.00 O ATOM 1735 CB VAL A 112 33.900 -24.448 -8.115 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.665 -25.916 -7.724 1.00 0.00 C ATOM 1737 CG2 VAL A 112 33.697 -23.552 -6.874 1.00 0.00 C ATOM 0 H VAL A 112 34.561 -22.492 -9.470 1.00 0.00 H new ATOM 0 HA VAL A 112 36.025 -24.276 -7.818 1.00 0.00 H new ATOM 0 HB VAL A 112 33.190 -24.166 -8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.651 -26.033 -7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 112 33.798 -26.551 -8.600 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.379 -26.206 -6.954 1.00 0.00 H new ATOM 0 HG21 VAL A 112 32.685 -23.684 -6.492 1.00 0.00 H new ATOM 0 HG22 VAL A 112 34.415 -23.830 -6.103 1.00 0.00 H new ATOM 0 HG23 VAL A 112 33.847 -22.508 -7.150 1.00 0.00 H new ATOM 1747 N TYR A 113 35.276 -25.286 -10.851 1.00 0.00 N ATOM 1748 CA TYR A 113 35.545 -26.330 -11.822 1.00 0.00 C ATOM 1749 C TYR A 113 37.036 -26.616 -11.912 1.00 0.00 C ATOM 1750 O TYR A 113 37.457 -27.772 -11.904 1.00 0.00 O ATOM 1751 CB TYR A 113 35.011 -25.914 -13.195 1.00 0.00 C ATOM 1752 CG TYR A 113 35.363 -26.971 -14.218 1.00 0.00 C ATOM 1753 CD1 TYR A 113 34.619 -28.154 -14.281 1.00 0.00 C ATOM 1754 CD2 TYR A 113 36.429 -26.767 -15.103 1.00 0.00 C ATOM 1755 CE1 TYR A 113 34.941 -29.135 -15.225 1.00 0.00 C ATOM 1756 CE2 TYR A 113 36.751 -27.747 -16.049 1.00 0.00 C ATOM 1757 CZ TYR A 113 36.006 -28.932 -16.110 1.00 0.00 C ATOM 1758 OH TYR A 113 36.324 -29.900 -17.041 1.00 0.00 O ATOM 0 H TYR A 113 34.749 -24.490 -11.210 1.00 0.00 H new ATOM 0 HA TYR A 113 35.040 -27.240 -11.497 1.00 0.00 H new ATOM 0 HB2 TYR A 113 33.930 -25.782 -13.151 1.00 0.00 H new ATOM 0 HB3 TYR A 113 35.438 -24.955 -13.487 1.00 0.00 H new ATOM 0 HD1 TYR A 113 33.795 -28.310 -13.600 1.00 0.00 H new ATOM 0 HD2 TYR A 113 37.003 -25.853 -15.056 1.00 0.00 H new ATOM 0 HE1 TYR A 113 34.368 -30.049 -15.271 1.00 0.00 H new ATOM 0 HE2 TYR A 113 37.573 -27.590 -16.731 1.00 0.00 H new ATOM 0 HH TYR A 113 37.088 -29.600 -17.577 1.00 0.00 H new ATOM 1768 N PHE A 114 37.821 -25.559 -11.987 1.00 0.00 N ATOM 1769 CA PHE A 114 39.269 -25.707 -12.072 1.00 0.00 C ATOM 1770 C PHE A 114 39.807 -26.402 -10.833 1.00 0.00 C ATOM 1771 O PHE A 114 40.644 -27.301 -10.919 1.00 0.00 O ATOM 1772 CB PHE A 114 39.935 -24.337 -12.224 1.00 0.00 C ATOM 1773 CG PHE A 114 39.690 -23.800 -13.618 1.00 0.00 C ATOM 1774 CD1 PHE A 114 40.346 -24.380 -14.710 1.00 0.00 C ATOM 1775 CD2 PHE A 114 38.809 -22.732 -13.821 1.00 0.00 C ATOM 1776 CE1 PHE A 114 40.123 -23.891 -16.003 1.00 0.00 C ATOM 1777 CE2 PHE A 114 38.583 -22.243 -15.114 1.00 0.00 C ATOM 1778 CZ PHE A 114 39.241 -22.822 -16.205 1.00 0.00 C ATOM 0 H PHE A 114 37.489 -24.595 -11.991 1.00 0.00 H new ATOM 0 HA PHE A 114 39.499 -26.315 -12.947 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.537 -23.645 -11.482 1.00 0.00 H new ATOM 0 HB3 PHE A 114 41.006 -24.421 -12.039 1.00 0.00 H new ATOM 0 HD1 PHE A 114 41.025 -25.206 -14.555 1.00 0.00 H new ATOM 0 HD2 PHE A 114 38.302 -22.284 -12.979 1.00 0.00 H new ATOM 0 HE1 PHE A 114 40.631 -24.338 -16.845 1.00 0.00 H new ATOM 0 HE2 PHE A 114 37.901 -21.420 -15.269 1.00 0.00 H new ATOM 0 HZ PHE A 114 39.069 -22.445 -17.202 1.00 0.00 H new ATOM 1788 N SER A 115 39.321 -25.974 -9.681 1.00 0.00 N ATOM 1789 CA SER A 115 39.754 -26.552 -8.419 1.00 0.00 C ATOM 1790 C SER A 115 39.281 -27.992 -8.290 1.00 0.00 C ATOM 1791 O SER A 115 39.808 -28.748 -7.475 1.00 0.00 O ATOM 1792 CB SER A 115 39.225 -25.737 -7.240 1.00 0.00 C ATOM 1793 OG SER A 115 39.746 -26.279 -6.033 1.00 0.00 O ATOM 0 H SER A 115 38.628 -25.231 -9.592 1.00 0.00 H new ATOM 0 HA SER A 115 40.844 -26.534 -8.406 1.00 0.00 H new ATOM 0 HB2 SER A 115 39.519 -24.692 -7.342 1.00 0.00 H new ATOM 0 HB3 SER A 115 38.135 -25.761 -7.224 1.00 0.00 H new ATOM 0 HG SER A 115 40.064 -27.192 -6.195 1.00 0.00 H new ATOM 1799 N THR A 116 38.282 -28.355 -9.096 1.00 0.00 N ATOM 1800 CA THR A 116 37.722 -29.712 -9.081 1.00 0.00 C ATOM 1801 C THR A 116 37.756 -30.318 -7.678 1.00 0.00 C ATOM 1802 O THR A 116 37.569 -29.575 -6.727 1.00 0.00 O ATOM 1803 CB THR A 116 38.492 -30.613 -10.053 1.00 0.00 C ATOM 1804 OG1 THR A 116 38.032 -31.951 -9.918 1.00 0.00 O ATOM 1805 CG2 THR A 116 39.989 -30.558 -9.745 1.00 0.00 C ATOM 1806 OXT THR A 116 37.966 -31.516 -7.576 1.00 0.00 O ATOM 0 H THR A 116 37.842 -27.728 -9.770 1.00 0.00 H new ATOM 0 HA THR A 116 36.681 -29.643 -9.395 1.00 0.00 H new ATOM 0 HB THR A 116 38.325 -30.265 -11.072 1.00 0.00 H new ATOM 0 HG1 THR A 116 38.296 -32.301 -9.041 1.00 0.00 H new ATOM 0 HG21 THR A 116 40.528 -31.201 -10.441 1.00 0.00 H new ATOM 0 HG22 THR A 116 40.344 -29.533 -9.849 1.00 0.00 H new ATOM 0 HG23 THR A 116 40.163 -30.901 -8.725 1.00 0.00 H new TER 1814 THR A 116