USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1099 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 CYS SG : rot -97:sc= 1.19 USER MOD Set 1.2: A 49 THR OG1 : rot 120:sc= 1.03 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -176:sc= 0.0281 (180deg=0.0259) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.0255 X(o=-0.026,f=-0.41) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 70:sc= 1.82 USER MOD Single : A 23 GLN : amide:sc= -0.341 K(o=-0.34,f=-2.8!) USER MOD Single : A 28 TYR OH : rot 30:sc= -0.0787 USER MOD Single : A 31 LYS NZ :NH3+ 160:sc= -0.228 (180deg=-0.908) USER MOD Single : A 45 HIS : no HD1:sc= -0.172 K(o=-0.17,f=-1.8) USER MOD Single : A 48 GLN : amide:sc= -0.658 K(o=-0.66,f=-0.021) USER MOD Single : A 54 HIS : no HE2:sc= -8.79! C(o=-8.8!,f=-9.1!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.06 K(o=-1.1,f=-2.8!) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0221 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -71:sc= 1.17 USER MOD Single : A 102 TYR OH : rot 150:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -1.2 USER MOD Single : A 127 GLN : amide:sc= -1.53! K(o=-1.5!,f=-2.7) USER MOD Single : A 129 GLN : amide:sc= -0.83 K(o=-0.83,f=-10!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot -20:sc= 0.949 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.949 -6.556 7.055 1.00 0.00 N ATOM 2 CA MET A 1 12.548 -5.223 7.473 1.00 0.00 C ATOM 3 C MET A 1 11.999 -4.420 6.292 1.00 0.00 C ATOM 4 O MET A 1 12.741 -3.695 5.631 1.00 0.00 O ATOM 5 CB MET A 1 13.752 -4.493 8.072 1.00 0.00 C ATOM 6 CG MET A 1 13.603 -4.342 9.587 1.00 0.00 C ATOM 7 SD MET A 1 15.161 -4.679 10.390 1.00 0.00 S ATOM 8 CE MET A 1 14.983 -3.666 11.850 1.00 0.00 C ATOM 0 H1 MET A 1 13.254 -7.103 7.885 1.00 0.00 H new ATOM 0 H2 MET A 1 12.144 -7.034 6.602 1.00 0.00 H new ATOM 0 H3 MET A 1 13.736 -6.486 6.379 1.00 0.00 H new ATOM 0 HA MET A 1 11.760 -5.318 8.220 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.665 -5.044 7.846 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.851 -3.509 7.613 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.270 -3.333 9.829 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.839 -5.026 9.956 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.876 -3.759 12.469 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.852 -2.624 11.556 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.112 -3.995 12.417 1.00 0.00 H new ATOM 18 N VAL A 2 10.704 -4.577 6.063 1.00 0.00 N ATOM 19 CA VAL A 2 10.046 -3.875 4.973 1.00 0.00 C ATOM 20 C VAL A 2 10.556 -4.423 3.639 1.00 0.00 C ATOM 21 O VAL A 2 11.739 -4.729 3.500 1.00 0.00 O ATOM 22 CB VAL A 2 10.257 -2.367 5.120 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.234 -1.587 4.291 1.00 0.00 C ATOM 24 CG2 VAL A 2 10.206 -1.946 6.590 1.00 0.00 C ATOM 0 H VAL A 2 10.092 -5.180 6.613 1.00 0.00 H new ATOM 0 HA VAL A 2 8.970 -4.044 5.004 1.00 0.00 H new ATOM 0 HB VAL A 2 11.250 -2.129 4.738 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.406 -0.518 4.413 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.339 -1.854 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 2 8.228 -1.834 4.629 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.359 -0.869 6.666 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.234 -2.205 7.009 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.989 -2.463 7.144 1.00 0.00 H new ATOM 34 N PRO A 3 9.613 -4.533 2.665 1.00 0.00 N ATOM 35 CA PRO A 3 9.954 -5.038 1.346 1.00 0.00 C ATOM 36 C PRO A 3 10.718 -3.988 0.537 1.00 0.00 C ATOM 37 O PRO A 3 10.911 -2.864 0.998 1.00 0.00 O ATOM 38 CB PRO A 3 8.626 -5.424 0.716 1.00 0.00 C ATOM 39 CG PRO A 3 7.559 -4.693 1.515 1.00 0.00 C ATOM 40 CD PRO A 3 8.202 -4.180 2.793 1.00 0.00 C ATOM 0 HA PRO A 3 10.625 -5.896 1.385 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.593 -5.136 -0.335 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.474 -6.503 0.756 1.00 0.00 H new ATOM 0 HG2 PRO A 3 7.148 -3.866 0.936 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.730 -5.362 1.747 1.00 0.00 H new ATOM 0 HD2 PRO A 3 8.071 -3.103 2.898 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.756 -4.642 3.674 1.00 0.00 H new ATOM 48 N PRO A 4 11.141 -4.402 -0.687 1.00 0.00 N ATOM 49 CA PRO A 4 11.879 -3.509 -1.565 1.00 0.00 C ATOM 50 C PRO A 4 10.949 -2.472 -2.199 1.00 0.00 C ATOM 51 O PRO A 4 11.156 -1.270 -2.043 1.00 0.00 O ATOM 52 CB PRO A 4 12.538 -4.420 -2.588 1.00 0.00 C ATOM 53 CG PRO A 4 11.777 -5.734 -2.529 1.00 0.00 C ATOM 54 CD PRO A 4 10.930 -5.725 -1.266 1.00 0.00 C ATOM 0 HA PRO A 4 12.628 -2.921 -1.034 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.489 -3.985 -3.586 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.593 -4.569 -2.356 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.147 -5.850 -3.411 1.00 0.00 H new ATOM 0 HG3 PRO A 4 12.469 -6.576 -2.519 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.878 -5.894 -1.494 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.238 -6.512 -0.577 1.00 0.00 H new ATOM 62 N LYS A 5 9.945 -2.976 -2.902 1.00 0.00 N ATOM 63 CA LYS A 5 8.983 -2.108 -3.560 1.00 0.00 C ATOM 64 C LYS A 5 8.669 -0.919 -2.650 1.00 0.00 C ATOM 65 O LYS A 5 8.732 0.231 -3.081 1.00 0.00 O ATOM 66 CB LYS A 5 7.746 -2.903 -3.982 1.00 0.00 C ATOM 67 CG LYS A 5 7.870 -3.382 -5.430 1.00 0.00 C ATOM 68 CD LYS A 5 7.492 -2.270 -6.410 1.00 0.00 C ATOM 69 CE LYS A 5 6.045 -2.424 -6.883 1.00 0.00 C ATOM 70 NZ LYS A 5 5.672 -1.309 -7.781 1.00 0.00 N ATOM 0 H LYS A 5 9.777 -3.974 -3.030 1.00 0.00 H new ATOM 0 HA LYS A 5 9.403 -1.703 -4.481 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.617 -3.760 -3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.856 -2.282 -3.875 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.892 -3.709 -5.622 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.224 -4.246 -5.588 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.620 -1.299 -5.931 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.163 -2.293 -7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.926 -3.374 -7.404 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.375 -2.446 -6.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 4.687 -1.429 -8.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.767 -0.407 -7.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 6.300 -1.306 -8.610 1.00 0.00 H new ATOM 84 N LEU A 6 8.338 -1.237 -1.407 1.00 0.00 N ATOM 85 CA LEU A 6 8.015 -0.209 -0.432 1.00 0.00 C ATOM 86 C LEU A 6 9.246 0.667 -0.193 1.00 0.00 C ATOM 87 O LEU A 6 9.269 1.832 -0.587 1.00 0.00 O ATOM 88 CB LEU A 6 7.451 -0.839 0.843 1.00 0.00 C ATOM 89 CG LEU A 6 6.339 -0.055 1.543 1.00 0.00 C ATOM 90 CD1 LEU A 6 6.392 -0.262 3.058 1.00 0.00 C ATOM 91 CD2 LEU A 6 6.390 1.426 1.165 1.00 0.00 C ATOM 0 H LEU A 6 8.287 -2.192 -1.053 1.00 0.00 H new ATOM 0 HA LEU A 6 7.229 0.443 -0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 6 7.070 -1.830 0.597 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.270 -0.978 1.549 1.00 0.00 H new ATOM 0 HG LEU A 6 5.380 -0.442 1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.591 0.306 3.531 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.269 -1.321 3.285 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.354 0.081 3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.589 1.960 1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.352 1.844 1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 6 6.266 1.531 0.087 1.00 0.00 H new ATOM 103 N LYS A 7 10.240 0.073 0.451 1.00 0.00 N ATOM 104 CA LYS A 7 11.471 0.785 0.746 1.00 0.00 C ATOM 105 C LYS A 7 11.870 1.632 -0.464 1.00 0.00 C ATOM 106 O LYS A 7 12.503 2.676 -0.315 1.00 0.00 O ATOM 107 CB LYS A 7 12.559 -0.191 1.199 1.00 0.00 C ATOM 108 CG LYS A 7 13.714 0.550 1.876 1.00 0.00 C ATOM 109 CD LYS A 7 13.854 0.126 3.340 1.00 0.00 C ATOM 110 CE LYS A 7 14.731 1.112 4.114 1.00 0.00 C ATOM 111 NZ LYS A 7 15.477 0.412 5.184 1.00 0.00 N ATOM 0 H LYS A 7 10.218 -0.893 0.777 1.00 0.00 H new ATOM 0 HA LYS A 7 11.323 1.471 1.580 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.134 -0.919 1.890 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.933 -0.748 0.340 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.643 0.346 1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.544 1.625 1.820 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.868 0.070 3.802 1.00 0.00 H new ATOM 0 HD3 LYS A 7 14.288 -0.872 3.393 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.430 1.598 3.433 1.00 0.00 H new ATOM 0 HE3 LYS A 7 14.111 1.896 4.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.067 1.095 5.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.805 -0.032 5.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 16.083 -0.320 4.762 1.00 0.00 H new ATOM 125 N GLN A 8 11.482 1.150 -1.636 1.00 0.00 N ATOM 126 CA GLN A 8 11.791 1.849 -2.872 1.00 0.00 C ATOM 127 C GLN A 8 10.887 3.073 -3.029 1.00 0.00 C ATOM 128 O GLN A 8 11.366 4.205 -3.048 1.00 0.00 O ATOM 129 CB GLN A 8 11.664 0.915 -4.077 1.00 0.00 C ATOM 130 CG GLN A 8 13.041 0.484 -4.585 1.00 0.00 C ATOM 131 CD GLN A 8 13.068 0.423 -6.114 1.00 0.00 C ATOM 132 OE1 GLN A 8 12.069 0.173 -6.768 1.00 0.00 O ATOM 133 NE2 GLN A 8 14.263 0.666 -6.644 1.00 0.00 N ATOM 0 H GLN A 8 10.957 0.284 -1.756 1.00 0.00 H new ATOM 0 HA GLN A 8 12.826 2.189 -2.826 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.083 0.035 -3.800 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.119 1.418 -4.876 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.798 1.184 -4.232 1.00 0.00 H new ATOM 0 HG3 GLN A 8 13.294 -0.493 -4.174 1.00 0.00 H new ATOM 0 HE21 GLN A 8 15.058 0.869 -6.038 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.385 0.650 -7.657 1.00 0.00 H new ATOM 142 N ALA A 9 9.594 2.804 -3.139 1.00 0.00 N ATOM 143 CA ALA A 9 8.618 3.869 -3.294 1.00 0.00 C ATOM 144 C ALA A 9 8.921 4.982 -2.289 1.00 0.00 C ATOM 145 O ALA A 9 8.667 6.155 -2.561 1.00 0.00 O ATOM 146 CB ALA A 9 7.208 3.299 -3.126 1.00 0.00 C ATOM 0 H ALA A 9 9.200 1.863 -3.124 1.00 0.00 H new ATOM 0 HA ALA A 9 8.677 4.301 -4.293 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.476 4.098 -3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.033 2.534 -3.882 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.109 2.858 -2.134 1.00 0.00 H new ATOM 152 N LEU A 10 9.459 4.576 -1.148 1.00 0.00 N ATOM 153 CA LEU A 10 9.799 5.524 -0.101 1.00 0.00 C ATOM 154 C LEU A 10 11.137 6.187 -0.434 1.00 0.00 C ATOM 155 O LEU A 10 11.237 7.413 -0.459 1.00 0.00 O ATOM 156 CB LEU A 10 9.774 4.842 1.268 1.00 0.00 C ATOM 157 CG LEU A 10 8.390 4.486 1.815 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.504 3.613 3.067 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.559 5.745 2.067 1.00 0.00 C ATOM 0 H LEU A 10 9.668 3.603 -0.926 1.00 0.00 H new ATOM 0 HA LEU A 10 9.054 6.318 -0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.365 3.928 1.207 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.270 5.495 1.986 1.00 0.00 H new ATOM 0 HG LEU A 10 7.864 3.900 1.061 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.507 3.374 3.436 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.030 2.691 2.821 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.056 4.152 3.837 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.580 5.463 2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.069 6.378 2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.435 6.292 1.132 1.00 0.00 H new ATOM 171 N GLU A 11 12.131 5.347 -0.682 1.00 0.00 N ATOM 172 CA GLU A 11 13.459 5.836 -1.013 1.00 0.00 C ATOM 173 C GLU A 11 13.399 6.748 -2.240 1.00 0.00 C ATOM 174 O GLU A 11 13.967 7.839 -2.236 1.00 0.00 O ATOM 175 CB GLU A 11 14.430 4.676 -1.239 1.00 0.00 C ATOM 176 CG GLU A 11 15.043 4.209 0.083 1.00 0.00 C ATOM 177 CD GLU A 11 16.370 3.484 -0.153 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.346 2.489 -0.909 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.377 3.942 0.427 1.00 0.00 O ATOM 0 H GLU A 11 12.044 4.331 -0.660 1.00 0.00 H new ATOM 0 HA GLU A 11 13.831 6.418 -0.170 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.907 3.846 -1.715 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.221 4.987 -1.921 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.204 5.067 0.736 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.348 3.544 0.596 1.00 0.00 H new ATOM 186 N LEU A 12 12.705 6.267 -3.261 1.00 0.00 N ATOM 187 CA LEU A 12 12.563 7.025 -4.493 1.00 0.00 C ATOM 188 C LEU A 12 11.957 8.394 -4.177 1.00 0.00 C ATOM 189 O LEU A 12 12.382 9.407 -4.731 1.00 0.00 O ATOM 190 CB LEU A 12 11.767 6.225 -5.526 1.00 0.00 C ATOM 191 CG LEU A 12 11.430 6.956 -6.826 1.00 0.00 C ATOM 192 CD1 LEU A 12 12.679 7.145 -7.689 1.00 0.00 C ATOM 193 CD2 LEU A 12 10.312 6.238 -7.586 1.00 0.00 C ATOM 0 H LEU A 12 12.235 5.362 -3.261 1.00 0.00 H new ATOM 0 HA LEU A 12 13.539 7.203 -4.945 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.332 5.326 -5.774 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.835 5.899 -5.064 1.00 0.00 H new ATOM 0 HG LEU A 12 11.060 7.950 -6.572 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.411 7.667 -8.607 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.416 7.731 -7.140 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.102 6.171 -7.936 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.092 6.779 -8.506 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.630 5.224 -7.828 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.417 6.199 -6.965 1.00 0.00 H new ATOM 205 N PHE A 13 10.976 8.381 -3.287 1.00 0.00 N ATOM 206 CA PHE A 13 10.308 9.609 -2.891 1.00 0.00 C ATOM 207 C PHE A 13 11.309 10.621 -2.329 1.00 0.00 C ATOM 208 O PHE A 13 11.502 11.692 -2.902 1.00 0.00 O ATOM 209 CB PHE A 13 9.305 9.240 -1.797 1.00 0.00 C ATOM 210 CG PHE A 13 8.182 10.263 -1.610 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.422 10.639 -2.673 1.00 0.00 C ATOM 212 CD2 PHE A 13 7.946 10.796 -0.382 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.380 11.588 -2.500 1.00 0.00 C ATOM 214 CE2 PHE A 13 6.904 11.746 -0.209 1.00 0.00 C ATOM 215 CZ PHE A 13 6.143 12.122 -1.271 1.00 0.00 C ATOM 0 H PHE A 13 10.627 7.539 -2.829 1.00 0.00 H new ATOM 0 HA PHE A 13 9.820 10.062 -3.754 1.00 0.00 H new ATOM 0 HB2 PHE A 13 8.864 8.272 -2.034 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.838 9.125 -0.853 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.611 10.216 -3.649 1.00 0.00 H new ATOM 0 HD2 PHE A 13 8.550 10.497 0.462 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.776 11.886 -3.344 1.00 0.00 H new ATOM 0 HE2 PHE A 13 6.716 12.170 0.767 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.351 12.844 -1.139 1.00 0.00 H new ATOM 225 N LYS A 14 11.918 10.245 -1.214 1.00 0.00 N ATOM 226 CA LYS A 14 12.894 11.106 -0.568 1.00 0.00 C ATOM 227 C LYS A 14 13.931 11.558 -1.599 1.00 0.00 C ATOM 228 O LYS A 14 14.530 12.622 -1.456 1.00 0.00 O ATOM 229 CB LYS A 14 13.502 10.407 0.650 1.00 0.00 C ATOM 230 CG LYS A 14 14.533 11.304 1.339 1.00 0.00 C ATOM 231 CD LYS A 14 15.563 10.469 2.102 1.00 0.00 C ATOM 232 CE LYS A 14 16.850 10.311 1.289 1.00 0.00 C ATOM 233 NZ LYS A 14 18.028 10.283 2.185 1.00 0.00 N ATOM 0 H LYS A 14 11.754 9.356 -0.742 1.00 0.00 H new ATOM 0 HA LYS A 14 12.413 12.005 -0.184 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.713 10.146 1.355 1.00 0.00 H new ATOM 0 HB3 LYS A 14 13.975 9.475 0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.038 11.921 0.596 1.00 0.00 H new ATOM 0 HG3 LYS A 14 14.028 11.983 2.027 1.00 0.00 H new ATOM 0 HD2 LYS A 14 15.787 10.945 3.057 1.00 0.00 H new ATOM 0 HD3 LYS A 14 15.147 9.487 2.326 1.00 0.00 H new ATOM 0 HE2 LYS A 14 16.808 9.392 0.705 1.00 0.00 H new ATOM 0 HE3 LYS A 14 16.943 11.134 0.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 18.893 10.175 1.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 18.076 11.171 2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 17.944 9.483 2.844 1.00 0.00 H new ATOM 247 N SER A 15 14.110 10.726 -2.614 1.00 0.00 N ATOM 248 CA SER A 15 15.064 11.026 -3.669 1.00 0.00 C ATOM 249 C SER A 15 14.478 12.068 -4.623 1.00 0.00 C ATOM 250 O SER A 15 15.191 12.950 -5.099 1.00 0.00 O ATOM 251 CB SER A 15 15.452 9.762 -4.437 1.00 0.00 C ATOM 252 OG SER A 15 16.792 9.820 -4.920 1.00 0.00 O ATOM 0 H SER A 15 13.611 9.844 -2.729 1.00 0.00 H new ATOM 0 HA SER A 15 15.966 11.430 -3.209 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.338 8.894 -3.788 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.770 9.624 -5.276 1.00 0.00 H new ATOM 0 HG SER A 15 17.002 8.994 -5.403 1.00 0.00 H new ATOM 258 N LEU A 16 13.184 11.932 -4.874 1.00 0.00 N ATOM 259 CA LEU A 16 12.494 12.851 -5.763 1.00 0.00 C ATOM 260 C LEU A 16 12.389 14.222 -5.092 1.00 0.00 C ATOM 261 O LEU A 16 12.463 14.326 -3.868 1.00 0.00 O ATOM 262 CB LEU A 16 11.144 12.271 -6.190 1.00 0.00 C ATOM 263 CG LEU A 16 11.194 11.151 -7.231 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.786 10.665 -7.582 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.975 11.589 -8.471 1.00 0.00 C ATOM 0 H LEU A 16 12.596 11.199 -4.477 1.00 0.00 H new ATOM 0 HA LEU A 16 13.062 12.989 -6.683 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.637 11.893 -5.303 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.532 13.081 -6.586 1.00 0.00 H new ATOM 0 HG LEU A 16 11.727 10.305 -6.797 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.850 9.869 -8.324 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.298 10.286 -6.684 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.206 11.494 -7.988 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.995 10.774 -9.195 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.492 12.459 -8.917 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.995 11.847 -8.186 1.00 0.00 H new ATOM 277 N PRO A 17 12.215 15.268 -5.944 1.00 0.00 N ATOM 278 CA PRO A 17 12.099 16.628 -5.446 1.00 0.00 C ATOM 279 C PRO A 17 10.725 16.867 -4.816 1.00 0.00 C ATOM 280 O PRO A 17 9.704 16.476 -5.380 1.00 0.00 O ATOM 281 CB PRO A 17 12.361 17.512 -6.654 1.00 0.00 C ATOM 282 CG PRO A 17 12.153 16.627 -7.872 1.00 0.00 C ATOM 283 CD PRO A 17 12.122 15.183 -7.399 1.00 0.00 C ATOM 0 HA PRO A 17 12.809 16.846 -4.648 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.681 18.364 -6.669 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.374 17.914 -6.632 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.221 16.884 -8.376 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.957 16.775 -8.593 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.204 14.684 -7.709 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.951 14.612 -7.816 1.00 0.00 H new ATOM 291 N LYS A 18 10.745 17.507 -3.656 1.00 0.00 N ATOM 292 CA LYS A 18 9.513 17.802 -2.944 1.00 0.00 C ATOM 293 C LYS A 18 8.400 18.084 -3.955 1.00 0.00 C ATOM 294 O LYS A 18 7.462 17.299 -4.086 1.00 0.00 O ATOM 295 CB LYS A 18 9.734 18.935 -1.940 1.00 0.00 C ATOM 296 CG LYS A 18 8.405 19.411 -1.350 1.00 0.00 C ATOM 297 CD LYS A 18 8.216 20.914 -1.565 1.00 0.00 C ATOM 298 CE LYS A 18 7.272 21.504 -0.515 1.00 0.00 C ATOM 299 NZ LYS A 18 5.867 21.415 -0.972 1.00 0.00 N ATOM 0 H LYS A 18 11.594 17.829 -3.192 1.00 0.00 H new ATOM 0 HA LYS A 18 9.197 16.941 -2.354 1.00 0.00 H new ATOM 0 HB2 LYS A 18 10.390 18.593 -1.139 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.237 19.768 -2.431 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.582 18.867 -1.814 1.00 0.00 H new ATOM 0 HG3 LYS A 18 8.375 19.186 -0.284 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.182 21.417 -1.514 1.00 0.00 H new ATOM 0 HD3 LYS A 18 7.815 21.095 -2.562 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.388 20.970 0.428 1.00 0.00 H new ATOM 0 HE3 LYS A 18 7.534 22.545 -0.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.240 21.820 -0.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.757 21.944 -1.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.616 20.418 -1.130 1.00 0.00 H new ATOM 313 N GLU A 19 8.540 19.207 -4.643 1.00 0.00 N ATOM 314 CA GLU A 19 7.557 19.603 -5.638 1.00 0.00 C ATOM 315 C GLU A 19 7.001 18.370 -6.354 1.00 0.00 C ATOM 316 O GLU A 19 5.792 18.147 -6.365 1.00 0.00 O ATOM 317 CB GLU A 19 8.157 20.593 -6.638 1.00 0.00 C ATOM 318 CG GLU A 19 9.657 20.351 -6.817 1.00 0.00 C ATOM 319 CD GLU A 19 10.476 21.399 -6.061 1.00 0.00 C ATOM 320 OE1 GLU A 19 10.635 22.506 -6.620 1.00 0.00 O ATOM 321 OE2 GLU A 19 10.925 21.069 -4.942 1.00 0.00 O ATOM 0 H GLU A 19 9.319 19.856 -4.532 1.00 0.00 H new ATOM 0 HA GLU A 19 6.735 20.105 -5.128 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.652 20.495 -7.599 1.00 0.00 H new ATOM 0 HB3 GLU A 19 7.988 21.613 -6.291 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.914 19.355 -6.457 1.00 0.00 H new ATOM 0 HG3 GLU A 19 9.910 20.382 -7.877 1.00 0.00 H new ATOM 328 N LEU A 20 7.911 17.602 -6.935 1.00 0.00 N ATOM 329 CA LEU A 20 7.527 16.398 -7.652 1.00 0.00 C ATOM 330 C LEU A 20 6.831 15.435 -6.687 1.00 0.00 C ATOM 331 O LEU A 20 5.717 14.985 -6.950 1.00 0.00 O ATOM 332 CB LEU A 20 8.737 15.788 -8.362 1.00 0.00 C ATOM 333 CG LEU A 20 9.169 16.475 -9.660 1.00 0.00 C ATOM 334 CD1 LEU A 20 10.260 15.670 -10.369 1.00 0.00 C ATOM 335 CD2 LEU A 20 7.967 16.736 -10.569 1.00 0.00 C ATOM 0 H LEU A 20 8.913 17.790 -6.924 1.00 0.00 H new ATOM 0 HA LEU A 20 6.811 16.636 -8.439 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.581 15.796 -7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.516 14.744 -8.583 1.00 0.00 H new ATOM 0 HG LEU A 20 9.597 17.445 -9.407 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.549 16.180 -11.288 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.128 15.580 -9.716 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.881 14.676 -10.609 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.302 17.225 -11.484 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.487 15.790 -10.818 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.254 17.380 -10.054 1.00 0.00 H new ATOM 347 N ARG A 21 7.517 15.149 -5.590 1.00 0.00 N ATOM 348 CA ARG A 21 6.979 14.248 -4.585 1.00 0.00 C ATOM 349 C ARG A 21 5.480 14.494 -4.400 1.00 0.00 C ATOM 350 O ARG A 21 4.672 13.584 -4.578 1.00 0.00 O ATOM 351 CB ARG A 21 7.689 14.434 -3.242 1.00 0.00 C ATOM 352 CG ARG A 21 9.168 14.060 -3.347 1.00 0.00 C ATOM 353 CD ARG A 21 9.809 13.961 -1.961 1.00 0.00 C ATOM 354 NE ARG A 21 10.987 14.853 -1.883 1.00 0.00 N ATOM 355 CZ ARG A 21 11.503 15.318 -0.738 1.00 0.00 C ATOM 356 NH1 ARG A 21 10.947 14.980 0.433 1.00 0.00 N ATOM 357 NH2 ARG A 21 12.574 16.123 -0.763 1.00 0.00 N ATOM 0 H ARG A 21 8.440 15.525 -5.375 1.00 0.00 H new ATOM 0 HA ARG A 21 7.143 13.228 -4.932 1.00 0.00 H new ATOM 0 HB2 ARG A 21 7.595 15.470 -2.917 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.207 13.817 -2.483 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.270 13.108 -3.867 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.694 14.806 -3.942 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.083 14.236 -1.195 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.108 12.932 -1.762 1.00 0.00 H new ATOM 0 HE ARG A 21 11.434 15.131 -2.756 1.00 0.00 H new ATOM 0 HH11 ARG A 21 10.131 14.369 0.452 1.00 0.00 H new ATOM 0 HH12 ARG A 21 11.340 15.334 1.305 1.00 0.00 H new ATOM 0 HH21 ARG A 21 12.997 16.382 -1.654 1.00 0.00 H new ATOM 0 HH22 ARG A 21 12.967 16.477 0.109 1.00 0.00 H new ATOM 371 N SER A 22 5.154 15.728 -4.045 1.00 0.00 N ATOM 372 CA SER A 22 3.767 16.105 -3.835 1.00 0.00 C ATOM 373 C SER A 22 2.911 15.626 -5.009 1.00 0.00 C ATOM 374 O SER A 22 1.809 15.117 -4.811 1.00 0.00 O ATOM 375 CB SER A 22 3.628 17.618 -3.659 1.00 0.00 C ATOM 376 OG SER A 22 3.041 17.958 -2.405 1.00 0.00 O ATOM 0 H SER A 22 5.827 16.480 -3.897 1.00 0.00 H new ATOM 0 HA SER A 22 3.417 15.627 -2.920 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.610 18.084 -3.738 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.018 18.022 -4.467 1.00 0.00 H new ATOM 0 HG SER A 22 3.673 17.757 -1.683 1.00 0.00 H new ATOM 382 N GLN A 23 3.450 15.806 -6.206 1.00 0.00 N ATOM 383 CA GLN A 23 2.749 15.399 -7.411 1.00 0.00 C ATOM 384 C GLN A 23 2.670 13.873 -7.490 1.00 0.00 C ATOM 385 O GLN A 23 1.679 13.323 -7.968 1.00 0.00 O ATOM 386 CB GLN A 23 3.421 15.978 -8.658 1.00 0.00 C ATOM 387 CG GLN A 23 3.793 17.447 -8.448 1.00 0.00 C ATOM 388 CD GLN A 23 2.910 18.363 -9.299 1.00 0.00 C ATOM 389 OE1 GLN A 23 2.019 17.925 -10.008 1.00 0.00 O ATOM 390 NE2 GLN A 23 3.207 19.655 -9.190 1.00 0.00 N ATOM 0 H GLN A 23 4.364 16.228 -6.367 1.00 0.00 H new ATOM 0 HA GLN A 23 1.734 15.794 -7.368 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.316 15.402 -8.893 1.00 0.00 H new ATOM 0 HB3 GLN A 23 2.750 15.888 -9.512 1.00 0.00 H new ATOM 0 HG2 GLN A 23 3.684 17.707 -7.395 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.840 17.601 -8.708 1.00 0.00 H new ATOM 0 HE21 GLN A 23 3.966 19.954 -8.578 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.676 20.347 -9.719 1.00 0.00 H new ATOM 399 N VAL A 24 3.727 13.233 -7.012 1.00 0.00 N ATOM 400 CA VAL A 24 3.790 11.781 -7.022 1.00 0.00 C ATOM 401 C VAL A 24 2.675 11.221 -6.136 1.00 0.00 C ATOM 402 O VAL A 24 1.755 10.569 -6.628 1.00 0.00 O ATOM 403 CB VAL A 24 5.183 11.314 -6.597 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.136 9.895 -6.027 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.171 11.406 -7.762 1.00 0.00 C ATOM 0 H VAL A 24 4.546 13.693 -6.615 1.00 0.00 H new ATOM 0 HA VAL A 24 3.628 11.399 -8.030 1.00 0.00 H new ATOM 0 HB VAL A 24 5.533 11.979 -5.808 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.140 9.588 -5.733 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.480 9.874 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.755 9.211 -6.785 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.154 11.068 -7.433 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.826 10.776 -8.582 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.238 12.440 -8.102 1.00 0.00 H new ATOM 415 N LEU A 25 2.795 11.495 -4.845 1.00 0.00 N ATOM 416 CA LEU A 25 1.809 11.026 -3.886 1.00 0.00 C ATOM 417 C LEU A 25 0.412 11.140 -4.500 1.00 0.00 C ATOM 418 O LEU A 25 -0.484 10.370 -4.160 1.00 0.00 O ATOM 419 CB LEU A 25 1.959 11.769 -2.557 1.00 0.00 C ATOM 420 CG LEU A 25 3.141 11.347 -1.683 1.00 0.00 C ATOM 421 CD1 LEU A 25 3.182 12.158 -0.386 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.115 9.840 -1.416 1.00 0.00 C ATOM 0 H LEU A 25 3.560 12.036 -4.441 1.00 0.00 H new ATOM 0 HA LEU A 25 1.972 9.973 -3.656 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.050 12.835 -2.767 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.042 11.635 -1.983 1.00 0.00 H new ATOM 0 HG LEU A 25 4.061 11.562 -2.226 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.032 11.838 0.217 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.283 13.217 -0.622 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.260 11.997 0.173 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.966 9.566 -0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.190 9.577 -0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.171 9.302 -2.362 1.00 0.00 H new ATOM 434 N LEU A 26 0.271 12.108 -5.394 1.00 0.00 N ATOM 435 CA LEU A 26 -1.002 12.333 -6.058 1.00 0.00 C ATOM 436 C LEU A 26 -1.300 11.158 -6.992 1.00 0.00 C ATOM 437 O LEU A 26 -2.275 10.436 -6.794 1.00 0.00 O ATOM 438 CB LEU A 26 -1.007 13.693 -6.760 1.00 0.00 C ATOM 439 CG LEU A 26 -2.225 14.580 -6.496 1.00 0.00 C ATOM 440 CD1 LEU A 26 -3.516 13.758 -6.517 1.00 0.00 C ATOM 441 CD2 LEU A 26 -2.063 15.359 -5.189 1.00 0.00 C ATOM 0 H LEU A 26 1.017 12.745 -5.674 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.810 12.374 -5.328 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.113 14.239 -6.458 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.931 13.525 -7.834 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.296 15.312 -7.300 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.367 14.412 -6.327 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -3.632 13.287 -7.493 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.470 12.989 -5.746 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.943 15.982 -5.025 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.954 14.660 -4.360 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.177 15.991 -5.250 1.00 0.00 H new ATOM 453 N GLU A 27 -0.441 11.003 -7.989 1.00 0.00 N ATOM 454 CA GLU A 27 -0.600 9.928 -8.953 1.00 0.00 C ATOM 455 C GLU A 27 -0.752 8.587 -8.233 1.00 0.00 C ATOM 456 O GLU A 27 -1.448 7.695 -8.715 1.00 0.00 O ATOM 457 CB GLU A 27 0.574 9.894 -9.934 1.00 0.00 C ATOM 458 CG GLU A 27 1.826 9.316 -9.272 1.00 0.00 C ATOM 459 CD GLU A 27 2.179 7.951 -9.865 1.00 0.00 C ATOM 460 OE1 GLU A 27 2.088 7.830 -11.105 1.00 0.00 O ATOM 461 OE2 GLU A 27 2.533 7.059 -9.064 1.00 0.00 O ATOM 0 H GLU A 27 0.367 11.604 -8.150 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.507 10.113 -9.529 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.308 9.293 -10.804 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.781 10.902 -10.294 1.00 0.00 H new ATOM 0 HG2 GLU A 27 2.662 10.002 -9.406 1.00 0.00 H new ATOM 0 HG3 GLU A 27 1.662 9.219 -8.199 1.00 0.00 H new ATOM 468 N TYR A 28 -0.089 8.487 -7.090 1.00 0.00 N ATOM 469 CA TYR A 28 -0.141 7.270 -6.298 1.00 0.00 C ATOM 470 C TYR A 28 -1.583 6.923 -5.921 1.00 0.00 C ATOM 471 O TYR A 28 -1.938 5.749 -5.823 1.00 0.00 O ATOM 472 CB TYR A 28 0.652 7.562 -5.023 1.00 0.00 C ATOM 473 CG TYR A 28 2.090 7.041 -5.051 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.961 7.471 -6.031 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.516 6.140 -4.097 1.00 0.00 C ATOM 476 CE1 TYR A 28 4.314 6.981 -6.058 1.00 0.00 C ATOM 477 CE2 TYR A 28 3.870 5.649 -4.123 1.00 0.00 C ATOM 478 CZ TYR A 28 4.702 6.094 -5.102 1.00 0.00 C ATOM 479 OH TYR A 28 5.980 5.630 -5.127 1.00 0.00 O ATOM 0 H TYR A 28 0.487 9.229 -6.693 1.00 0.00 H new ATOM 0 HA TYR A 28 0.266 6.429 -6.859 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.670 8.639 -4.857 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.132 7.118 -4.174 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.627 8.176 -6.778 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.834 5.803 -3.330 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.005 7.310 -6.820 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.216 4.944 -3.382 1.00 0.00 H new ATOM 0 HH TYR A 28 6.569 6.313 -5.511 1.00 0.00 H new ATOM 489 N ALA A 29 -2.375 7.966 -5.718 1.00 0.00 N ATOM 490 CA ALA A 29 -3.770 7.787 -5.354 1.00 0.00 C ATOM 491 C ALA A 29 -4.596 7.545 -6.618 1.00 0.00 C ATOM 492 O ALA A 29 -5.521 6.734 -6.614 1.00 0.00 O ATOM 493 CB ALA A 29 -4.252 9.006 -4.566 1.00 0.00 C ATOM 0 H ALA A 29 -2.077 8.938 -5.799 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.890 6.915 -4.711 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.299 8.872 -4.293 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.652 9.116 -3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.149 9.900 -5.180 1.00 0.00 H new ATOM 499 N ALA A 30 -4.233 8.264 -7.670 1.00 0.00 N ATOM 500 CA ALA A 30 -4.930 8.138 -8.939 1.00 0.00 C ATOM 501 C ALA A 30 -4.700 6.736 -9.505 1.00 0.00 C ATOM 502 O ALA A 30 -5.434 6.290 -10.386 1.00 0.00 O ATOM 503 CB ALA A 30 -4.456 9.237 -9.893 1.00 0.00 C ATOM 0 H ALA A 30 -3.465 8.936 -7.670 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.004 8.266 -8.802 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.979 9.143 -10.845 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.668 10.213 -9.458 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.383 9.139 -10.057 1.00 0.00 H new ATOM 509 N LYS A 31 -3.678 6.079 -8.977 1.00 0.00 N ATOM 510 CA LYS A 31 -3.342 4.736 -9.418 1.00 0.00 C ATOM 511 C LYS A 31 -4.172 3.722 -8.629 1.00 0.00 C ATOM 512 O LYS A 31 -4.415 2.612 -9.100 1.00 0.00 O ATOM 513 CB LYS A 31 -1.833 4.503 -9.323 1.00 0.00 C ATOM 514 CG LYS A 31 -1.135 4.889 -10.629 1.00 0.00 C ATOM 515 CD LYS A 31 0.202 5.580 -10.352 1.00 0.00 C ATOM 516 CE LYS A 31 1.218 4.595 -9.770 1.00 0.00 C ATOM 517 NZ LYS A 31 1.183 3.315 -10.512 1.00 0.00 N ATOM 0 H LYS A 31 -3.071 6.452 -8.247 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.596 4.606 -10.470 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.422 5.088 -8.500 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.637 3.455 -9.098 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.969 3.998 -11.234 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.778 5.552 -11.207 1.00 0.00 H new ATOM 0 HD2 LYS A 31 0.593 6.008 -11.275 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.051 6.406 -9.657 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.219 5.024 -9.820 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.999 4.418 -8.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.069 2.796 -10.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.381 2.743 -10.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.074 3.506 -11.529 1.00 0.00 H new ATOM 531 N VAL A 32 -4.584 4.139 -7.441 1.00 0.00 N ATOM 532 CA VAL A 32 -5.382 3.281 -6.581 1.00 0.00 C ATOM 533 C VAL A 32 -6.771 3.101 -7.196 1.00 0.00 C ATOM 534 O VAL A 32 -7.544 4.054 -7.283 1.00 0.00 O ATOM 535 CB VAL A 32 -5.425 3.855 -5.164 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.394 3.064 -4.282 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.027 3.893 -4.545 1.00 0.00 C ATOM 0 H VAL A 32 -4.380 5.060 -7.053 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.930 2.292 -6.503 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.790 4.880 -5.228 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.406 3.492 -3.280 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.396 3.111 -4.709 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.071 2.024 -4.228 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.086 4.305 -3.538 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.621 2.882 -4.500 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.376 4.519 -5.155 1.00 0.00 H new ATOM 547 N PRO A 33 -7.054 1.839 -7.618 1.00 0.00 N ATOM 548 CA PRO A 33 -8.337 1.522 -8.222 1.00 0.00 C ATOM 549 C PRO A 33 -9.439 1.452 -7.164 1.00 0.00 C ATOM 550 O PRO A 33 -9.155 1.419 -5.967 1.00 0.00 O ATOM 551 CB PRO A 33 -8.117 0.200 -8.940 1.00 0.00 C ATOM 552 CG PRO A 33 -6.863 -0.403 -8.328 1.00 0.00 C ATOM 553 CD PRO A 33 -6.163 0.686 -7.532 1.00 0.00 C ATOM 0 HA PRO A 33 -8.674 2.288 -8.920 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -8.973 -0.462 -8.809 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.993 0.354 -10.012 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.119 -1.243 -7.682 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.206 -0.789 -9.107 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.008 0.382 -6.497 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.181 0.912 -7.949 1.00 0.00 H new ATOM 561 N PRO A 34 -10.707 1.430 -7.655 1.00 0.00 N ATOM 562 CA PRO A 34 -11.853 1.364 -6.764 1.00 0.00 C ATOM 563 C PRO A 34 -12.017 -0.042 -6.184 1.00 0.00 C ATOM 564 O PRO A 34 -11.591 -1.022 -6.793 1.00 0.00 O ATOM 565 CB PRO A 34 -13.037 1.797 -7.614 1.00 0.00 C ATOM 566 CG PRO A 34 -12.591 1.642 -9.059 1.00 0.00 C ATOM 567 CD PRO A 34 -11.082 1.467 -9.065 1.00 0.00 C ATOM 0 HA PRO A 34 -11.746 2.011 -5.893 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -13.912 1.181 -7.407 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -13.315 2.829 -7.400 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.077 0.781 -9.518 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -12.876 2.518 -9.642 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.792 0.549 -9.576 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -10.590 2.290 -9.584 1.00 0.00 H new ATOM 575 N PRO A 35 -12.652 -0.097 -4.982 1.00 0.00 N ATOM 576 CA PRO A 35 -12.877 -1.367 -4.313 1.00 0.00 C ATOM 577 C PRO A 35 -14.008 -2.148 -4.985 1.00 0.00 C ATOM 578 O PRO A 35 -15.019 -1.569 -5.377 1.00 0.00 O ATOM 579 CB PRO A 35 -13.183 -1.002 -2.870 1.00 0.00 C ATOM 580 CG PRO A 35 -13.576 0.466 -2.886 1.00 0.00 C ATOM 581 CD PRO A 35 -13.169 1.043 -4.232 1.00 0.00 C ATOM 0 HA PRO A 35 -12.014 -2.030 -4.368 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.990 -1.618 -2.474 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -12.314 -1.167 -2.233 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.650 0.575 -2.733 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -13.082 1.002 -2.076 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.018 1.499 -4.740 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.412 1.818 -4.118 1.00 0.00 H new ATOM 589 N PRO A 36 -13.792 -3.486 -5.100 1.00 0.00 N ATOM 590 CA PRO A 36 -14.781 -4.353 -5.718 1.00 0.00 C ATOM 591 C PRO A 36 -15.966 -4.590 -4.780 1.00 0.00 C ATOM 592 O PRO A 36 -15.871 -4.340 -3.579 1.00 0.00 O ATOM 593 CB PRO A 36 -14.029 -5.629 -6.058 1.00 0.00 C ATOM 594 CG PRO A 36 -12.771 -5.611 -5.205 1.00 0.00 C ATOM 595 CD PRO A 36 -12.606 -4.207 -4.647 1.00 0.00 C ATOM 0 HA PRO A 36 -15.222 -3.915 -6.614 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.635 -6.509 -5.842 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -13.781 -5.665 -7.119 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.848 -6.337 -4.395 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.902 -5.890 -5.801 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -12.541 -4.218 -3.559 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.693 -3.739 -5.016 1.00 0.00 H new ATOM 603 N PRO A 37 -17.084 -5.080 -5.378 1.00 0.00 N ATOM 604 CA PRO A 37 -18.286 -5.353 -4.609 1.00 0.00 C ATOM 605 C PRO A 37 -18.128 -6.629 -3.779 1.00 0.00 C ATOM 606 O PRO A 37 -17.672 -7.652 -4.287 1.00 0.00 O ATOM 607 CB PRO A 37 -19.400 -5.449 -5.639 1.00 0.00 C ATOM 608 CG PRO A 37 -18.713 -5.689 -6.974 1.00 0.00 C ATOM 609 CD PRO A 37 -17.234 -5.387 -6.797 1.00 0.00 C ATOM 0 HA PRO A 37 -18.503 -4.574 -3.879 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -20.084 -6.263 -5.400 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -19.990 -4.533 -5.663 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -18.856 -6.720 -7.297 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -19.144 -5.050 -7.745 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -16.619 -6.240 -7.085 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -16.925 -4.547 -7.419 1.00 0.00 H new ATOM 617 N GLY A 38 -18.515 -6.527 -2.516 1.00 0.00 N ATOM 618 CA GLY A 38 -18.422 -7.660 -1.611 1.00 0.00 C ATOM 619 C GLY A 38 -17.286 -7.466 -0.605 1.00 0.00 C ATOM 620 O GLY A 38 -17.353 -7.966 0.517 1.00 0.00 O ATOM 0 H GLY A 38 -18.894 -5.677 -2.098 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -19.366 -7.784 -1.080 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.255 -8.573 -2.182 1.00 0.00 H new ATOM 624 N VAL A 39 -16.268 -6.739 -1.042 1.00 0.00 N ATOM 625 CA VAL A 39 -15.119 -6.473 -0.194 1.00 0.00 C ATOM 626 C VAL A 39 -15.554 -5.610 0.992 1.00 0.00 C ATOM 627 O VAL A 39 -16.059 -4.504 0.807 1.00 0.00 O ATOM 628 CB VAL A 39 -13.997 -5.836 -1.017 1.00 0.00 C ATOM 629 CG1 VAL A 39 -12.839 -5.399 -0.119 1.00 0.00 C ATOM 630 CG2 VAL A 39 -13.513 -6.788 -2.113 1.00 0.00 C ATOM 0 H VAL A 39 -16.215 -6.326 -1.973 1.00 0.00 H new ATOM 0 HA VAL A 39 -14.720 -7.403 0.210 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.400 -4.946 -1.501 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.055 -4.950 -0.729 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -13.197 -4.669 0.607 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -12.438 -6.266 0.406 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.716 -6.311 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -13.136 -7.704 -1.659 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -14.342 -7.028 -2.779 1.00 0.00 H new ATOM 640 N GLU A 40 -15.343 -6.149 2.184 1.00 0.00 N ATOM 641 CA GLU A 40 -15.708 -5.442 3.399 1.00 0.00 C ATOM 642 C GLU A 40 -14.517 -4.637 3.923 1.00 0.00 C ATOM 643 O GLU A 40 -13.517 -5.210 4.354 1.00 0.00 O ATOM 644 CB GLU A 40 -16.224 -6.413 4.464 1.00 0.00 C ATOM 645 CG GLU A 40 -17.235 -5.728 5.386 1.00 0.00 C ATOM 646 CD GLU A 40 -17.269 -6.402 6.759 1.00 0.00 C ATOM 647 OE1 GLU A 40 -17.449 -7.639 6.779 1.00 0.00 O ATOM 648 OE2 GLU A 40 -17.114 -5.666 7.757 1.00 0.00 O ATOM 0 H GLU A 40 -14.924 -7.067 2.334 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.515 -4.748 3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -16.690 -7.273 3.982 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.388 -6.791 5.052 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -16.974 -4.676 5.500 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -18.227 -5.764 4.935 1.00 0.00 H new ATOM 655 N LEU A 41 -14.663 -3.321 3.868 1.00 0.00 N ATOM 656 CA LEU A 41 -13.611 -2.432 4.331 1.00 0.00 C ATOM 657 C LEU A 41 -13.922 -1.982 5.759 1.00 0.00 C ATOM 658 O LEU A 41 -15.075 -1.708 6.091 1.00 0.00 O ATOM 659 CB LEU A 41 -13.419 -1.274 3.349 1.00 0.00 C ATOM 660 CG LEU A 41 -13.042 -1.663 1.918 1.00 0.00 C ATOM 661 CD1 LEU A 41 -14.130 -1.237 0.930 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.671 -1.099 1.539 1.00 0.00 C ATOM 0 H LEU A 41 -15.494 -2.849 3.510 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.655 -2.955 4.363 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.342 -0.695 3.316 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.644 -0.616 3.742 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.968 -2.749 1.868 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.838 -1.525 -0.080 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.069 -1.726 1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.260 -0.156 0.976 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.428 -1.390 0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.692 -0.012 1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.915 -1.493 2.218 1.00 0.00 H new ATOM 674 N GLU A 42 -12.874 -1.919 6.568 1.00 0.00 N ATOM 675 CA GLU A 42 -13.021 -1.507 7.953 1.00 0.00 C ATOM 676 C GLU A 42 -12.792 0.000 8.086 1.00 0.00 C ATOM 677 O GLU A 42 -11.815 0.531 7.560 1.00 0.00 O ATOM 678 CB GLU A 42 -12.070 -2.289 8.861 1.00 0.00 C ATOM 679 CG GLU A 42 -12.728 -2.599 10.207 1.00 0.00 C ATOM 680 CD GLU A 42 -12.996 -4.099 10.353 1.00 0.00 C ATOM 681 OE1 GLU A 42 -13.866 -4.595 9.606 1.00 0.00 O ATOM 682 OE2 GLU A 42 -12.324 -4.715 11.208 1.00 0.00 O ATOM 0 H GLU A 42 -11.919 -2.147 6.290 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.039 -1.729 8.272 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.777 -3.218 8.373 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.159 -1.713 9.022 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -12.083 -2.260 11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.665 -2.048 10.294 1.00 0.00 H new ATOM 689 N ARG A 43 -13.709 0.646 8.791 1.00 0.00 N ATOM 690 CA ARG A 43 -13.619 2.081 8.999 1.00 0.00 C ATOM 691 C ARG A 43 -12.425 2.413 9.897 1.00 0.00 C ATOM 692 O ARG A 43 -12.276 1.841 10.975 1.00 0.00 O ATOM 693 CB ARG A 43 -14.897 2.626 9.640 1.00 0.00 C ATOM 694 CG ARG A 43 -14.641 3.978 10.309 1.00 0.00 C ATOM 695 CD ARG A 43 -14.439 5.077 9.264 1.00 0.00 C ATOM 696 NE ARG A 43 -13.417 6.039 9.734 1.00 0.00 N ATOM 697 CZ ARG A 43 -13.682 7.096 10.513 1.00 0.00 C ATOM 698 NH1 ARG A 43 -14.938 7.334 10.915 1.00 0.00 N ATOM 699 NH2 ARG A 43 -12.691 7.916 10.890 1.00 0.00 N ATOM 0 H ARG A 43 -14.518 0.202 9.225 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.487 2.550 8.024 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.672 2.733 8.881 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.269 1.916 10.378 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -15.482 4.234 10.953 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.760 3.911 10.947 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -14.128 4.637 8.317 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -15.381 5.594 9.081 1.00 0.00 H new ATOM 0 HE ARG A 43 -12.450 5.888 9.447 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -15.692 6.710 10.628 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.140 8.139 11.508 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.735 7.735 10.584 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.893 8.721 11.483 1.00 0.00 H new ATOM 713 N VAL A 44 -11.605 3.337 9.418 1.00 0.00 N ATOM 714 CA VAL A 44 -10.429 3.752 10.164 1.00 0.00 C ATOM 715 C VAL A 44 -10.767 4.995 10.991 1.00 0.00 C ATOM 716 O VAL A 44 -10.579 6.120 10.531 1.00 0.00 O ATOM 717 CB VAL A 44 -9.254 3.971 9.209 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.063 4.597 9.939 1.00 0.00 C ATOM 719 CG2 VAL A 44 -8.852 2.663 8.525 1.00 0.00 C ATOM 0 H VAL A 44 -11.732 3.810 8.523 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.123 2.971 10.861 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.577 4.668 8.435 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.242 4.742 9.237 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.357 5.560 10.357 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -7.741 3.936 10.743 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.015 2.847 7.852 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.558 1.933 9.279 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.697 2.275 7.956 1.00 0.00 H new ATOM 729 N HIS A 45 -11.259 4.748 12.196 1.00 0.00 N ATOM 730 CA HIS A 45 -11.625 5.833 13.091 1.00 0.00 C ATOM 731 C HIS A 45 -10.415 6.742 13.316 1.00 0.00 C ATOM 732 O HIS A 45 -10.536 7.965 13.269 1.00 0.00 O ATOM 733 CB HIS A 45 -12.209 5.288 14.395 1.00 0.00 C ATOM 734 CG HIS A 45 -13.718 5.272 14.434 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.497 5.233 13.290 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.583 5.288 15.488 1.00 0.00 C ATOM 737 CE1 HIS A 45 -15.771 5.228 13.652 1.00 0.00 C ATOM 738 NE2 HIS A 45 -15.823 5.263 15.014 1.00 0.00 N ATOM 0 H HIS A 45 -11.413 3.813 12.574 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.409 6.437 12.635 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -11.841 4.274 14.550 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -11.841 5.890 15.225 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -14.306 5.316 16.532 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.620 5.201 12.985 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -16.674 5.269 15.576 1.00 0.00 H new ATOM 746 N GLU A 46 -9.277 6.109 13.557 1.00 0.00 N ATOM 747 CA GLU A 46 -8.046 6.845 13.791 1.00 0.00 C ATOM 748 C GLU A 46 -7.971 8.061 12.865 1.00 0.00 C ATOM 749 O GLU A 46 -7.680 9.169 13.312 1.00 0.00 O ATOM 750 CB GLU A 46 -6.824 5.942 13.610 1.00 0.00 C ATOM 751 CG GLU A 46 -6.233 5.542 14.964 1.00 0.00 C ATOM 752 CD GLU A 46 -7.212 4.669 15.753 1.00 0.00 C ATOM 753 OE1 GLU A 46 -7.392 3.504 15.339 1.00 0.00 O ATOM 754 OE2 GLU A 46 -7.756 5.187 16.751 1.00 0.00 O ATOM 0 H GLU A 46 -9.181 5.094 13.595 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.047 7.197 14.823 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.107 5.048 13.054 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.069 6.460 13.018 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.299 5.001 14.812 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.993 6.437 15.539 1.00 0.00 H new ATOM 761 N CYS A 47 -8.239 7.812 11.591 1.00 0.00 N ATOM 762 CA CYS A 47 -8.205 8.872 10.598 1.00 0.00 C ATOM 763 C CYS A 47 -9.535 9.627 10.656 1.00 0.00 C ATOM 764 O CYS A 47 -10.581 9.074 10.322 1.00 0.00 O ATOM 765 CB CYS A 47 -7.919 8.327 9.198 1.00 0.00 C ATOM 766 SG CYS A 47 -7.283 9.664 8.123 1.00 0.00 S ATOM 0 H CYS A 47 -8.481 6.891 11.224 1.00 0.00 H new ATOM 0 HA CYS A 47 -7.388 9.558 10.823 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.191 7.518 9.256 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -8.829 7.907 8.770 1.00 0.00 H new ATOM 0 HG CYS A 47 -8.260 10.160 7.423 1.00 0.00 H new ATOM 772 N GLN A 48 -9.450 10.879 11.083 1.00 0.00 N ATOM 773 CA GLN A 48 -10.633 11.715 11.189 1.00 0.00 C ATOM 774 C GLN A 48 -11.573 11.457 10.009 1.00 0.00 C ATOM 775 O GLN A 48 -12.792 11.516 10.158 1.00 0.00 O ATOM 776 CB GLN A 48 -10.253 13.194 11.274 1.00 0.00 C ATOM 777 CG GLN A 48 -9.200 13.551 10.224 1.00 0.00 C ATOM 778 CD GLN A 48 -8.092 14.416 10.829 1.00 0.00 C ATOM 779 OE1 GLN A 48 -8.308 15.541 11.250 1.00 0.00 O ATOM 780 NE2 GLN A 48 -6.899 13.830 10.850 1.00 0.00 N ATOM 0 H GLN A 48 -8.580 11.334 11.359 1.00 0.00 H new ATOM 0 HA GLN A 48 -11.157 11.455 12.109 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -11.140 13.810 11.128 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.870 13.418 12.269 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -8.769 12.639 9.811 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.671 14.083 9.398 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.788 12.886 10.481 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.094 14.325 11.235 1.00 0.00 H new ATOM 789 N THR A 49 -10.969 11.177 8.864 1.00 0.00 N ATOM 790 CA THR A 49 -11.737 10.910 7.659 1.00 0.00 C ATOM 791 C THR A 49 -12.161 9.440 7.612 1.00 0.00 C ATOM 792 O THR A 49 -11.488 8.578 8.173 1.00 0.00 O ATOM 793 CB THR A 49 -10.893 11.337 6.456 1.00 0.00 C ATOM 794 OG1 THR A 49 -9.708 10.553 6.567 1.00 0.00 O ATOM 795 CG2 THR A 49 -10.397 12.780 6.572 1.00 0.00 C ATOM 0 H THR A 49 -9.957 11.129 8.745 1.00 0.00 H new ATOM 0 HA THR A 49 -12.663 11.484 7.645 1.00 0.00 H new ATOM 0 HB THR A 49 -11.479 11.226 5.544 1.00 0.00 H new ATOM 0 HG1 THR A 49 -9.609 9.994 5.768 1.00 0.00 H new ATOM 0 HG21 THR A 49 -9.804 13.033 5.693 1.00 0.00 H new ATOM 0 HG22 THR A 49 -11.251 13.454 6.639 1.00 0.00 H new ATOM 0 HG23 THR A 49 -9.783 12.883 7.466 1.00 0.00 H new ATOM 803 N PRO A 50 -13.305 9.195 6.919 1.00 0.00 N ATOM 804 CA PRO A 50 -13.828 7.845 6.791 1.00 0.00 C ATOM 805 C PRO A 50 -13.005 7.032 5.789 1.00 0.00 C ATOM 806 O PRO A 50 -13.446 6.796 4.665 1.00 0.00 O ATOM 807 CB PRO A 50 -15.276 8.022 6.365 1.00 0.00 C ATOM 808 CG PRO A 50 -15.380 9.438 5.822 1.00 0.00 C ATOM 809 CD PRO A 50 -14.129 10.192 6.241 1.00 0.00 C ATOM 0 HA PRO A 50 -13.767 7.280 7.721 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.552 7.291 5.605 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -15.952 7.876 7.208 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.471 9.424 4.736 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.271 9.931 6.211 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.612 10.612 5.378 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -14.371 11.023 6.904 1.00 0.00 H new ATOM 817 N PHE A 51 -11.825 6.625 6.233 1.00 0.00 N ATOM 818 CA PHE A 51 -10.937 5.843 5.390 1.00 0.00 C ATOM 819 C PHE A 51 -11.092 4.347 5.670 1.00 0.00 C ATOM 820 O PHE A 51 -10.653 3.857 6.709 1.00 0.00 O ATOM 821 CB PHE A 51 -9.507 6.268 5.730 1.00 0.00 C ATOM 822 CG PHE A 51 -8.441 5.643 4.828 1.00 0.00 C ATOM 823 CD1 PHE A 51 -8.732 5.352 3.532 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.202 5.378 5.323 1.00 0.00 C ATOM 825 CE1 PHE A 51 -7.743 4.772 2.695 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.213 4.797 4.486 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.504 4.507 3.190 1.00 0.00 C ATOM 0 H PHE A 51 -11.463 6.822 7.166 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.174 6.015 4.340 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.435 7.353 5.661 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.295 5.999 6.765 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.716 5.562 3.139 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -6.971 5.609 6.352 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.974 4.541 1.666 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.230 4.585 4.879 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.751 4.066 2.553 1.00 0.00 H new ATOM 837 N PHE A 52 -11.717 3.662 4.723 1.00 0.00 N ATOM 838 CA PHE A 52 -11.935 2.231 4.855 1.00 0.00 C ATOM 839 C PHE A 52 -10.872 1.442 4.089 1.00 0.00 C ATOM 840 O PHE A 52 -10.507 1.807 2.972 1.00 0.00 O ATOM 841 CB PHE A 52 -13.309 1.931 4.253 1.00 0.00 C ATOM 842 CG PHE A 52 -14.401 2.919 4.669 1.00 0.00 C ATOM 843 CD1 PHE A 52 -15.013 2.786 5.877 1.00 0.00 C ATOM 844 CD2 PHE A 52 -14.759 3.929 3.832 1.00 0.00 C ATOM 845 CE1 PHE A 52 -16.026 3.703 6.263 1.00 0.00 C ATOM 846 CE2 PHE A 52 -15.772 4.846 4.219 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.384 4.714 5.426 1.00 0.00 C ATOM 0 H PHE A 52 -12.079 4.071 3.862 1.00 0.00 H new ATOM 0 HA PHE A 52 -11.878 1.941 5.904 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.226 1.933 3.166 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.612 0.926 4.547 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -14.728 1.984 6.542 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.273 4.034 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.513 3.598 7.221 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.056 5.648 3.554 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.154 5.412 5.720 1.00 0.00 H new ATOM 857 N VAL A 53 -10.405 0.374 4.719 1.00 0.00 N ATOM 858 CA VAL A 53 -9.391 -0.470 4.111 1.00 0.00 C ATOM 859 C VAL A 53 -9.762 -1.939 4.323 1.00 0.00 C ATOM 860 O VAL A 53 -10.376 -2.289 5.330 1.00 0.00 O ATOM 861 CB VAL A 53 -8.011 -0.116 4.669 1.00 0.00 C ATOM 862 CG1 VAL A 53 -7.632 1.325 4.321 1.00 0.00 C ATOM 863 CG2 VAL A 53 -7.955 -0.347 6.181 1.00 0.00 C ATOM 0 H VAL A 53 -10.710 0.074 5.645 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.346 -0.298 3.036 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.281 -0.777 4.201 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.647 1.551 4.729 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.612 1.444 3.238 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.367 2.008 4.748 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.963 -0.088 6.552 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.701 0.277 6.672 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.160 -1.395 6.397 1.00 0.00 H new ATOM 873 N HIS A 54 -9.373 -2.760 3.358 1.00 0.00 N ATOM 874 CA HIS A 54 -9.657 -4.183 3.426 1.00 0.00 C ATOM 875 C HIS A 54 -8.405 -4.975 3.045 1.00 0.00 C ATOM 876 O HIS A 54 -8.043 -5.043 1.871 1.00 0.00 O ATOM 877 CB HIS A 54 -10.869 -4.537 2.562 1.00 0.00 C ATOM 878 CG HIS A 54 -11.153 -6.018 2.480 1.00 0.00 C ATOM 879 ND1 HIS A 54 -11.730 -6.730 3.517 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.934 -6.912 1.473 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.847 -7.995 3.141 1.00 0.00 C ATOM 882 NE2 HIS A 54 -11.353 -8.106 1.874 1.00 0.00 N ATOM 0 H HIS A 54 -8.863 -2.466 2.525 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.920 -4.457 4.448 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.748 -4.031 2.962 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.709 -4.152 1.555 1.00 0.00 H new ATOM 0 HD1 HIS A 54 -12.016 -6.346 4.418 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -10.494 -6.687 0.513 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -12.261 -8.798 3.733 1.00 0.00 H new ATOM 890 N ALA A 55 -7.779 -5.555 4.058 1.00 0.00 N ATOM 891 CA ALA A 55 -6.575 -6.340 3.844 1.00 0.00 C ATOM 892 C ALA A 55 -6.922 -7.828 3.918 1.00 0.00 C ATOM 893 O ALA A 55 -7.614 -8.263 4.838 1.00 0.00 O ATOM 894 CB ALA A 55 -5.513 -5.937 4.869 1.00 0.00 C ATOM 0 H ALA A 55 -8.083 -5.497 5.030 1.00 0.00 H new ATOM 0 HA ALA A 55 -6.162 -6.147 2.854 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.610 -6.526 4.708 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.281 -4.878 4.755 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.891 -6.119 5.875 1.00 0.00 H new ATOM 900 N ASP A 56 -6.426 -8.568 2.937 1.00 0.00 N ATOM 901 CA ASP A 56 -6.675 -9.999 2.879 1.00 0.00 C ATOM 902 C ASP A 56 -5.582 -10.669 2.045 1.00 0.00 C ATOM 903 O ASP A 56 -4.835 -9.995 1.337 1.00 0.00 O ATOM 904 CB ASP A 56 -8.023 -10.297 2.220 1.00 0.00 C ATOM 905 CG ASP A 56 -9.191 -10.484 3.191 1.00 0.00 C ATOM 906 OD1 ASP A 56 -8.935 -10.388 4.411 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.313 -10.717 2.692 1.00 0.00 O ATOM 0 H ASP A 56 -5.853 -8.204 2.176 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.680 -10.382 3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.265 -9.482 1.537 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.924 -11.199 1.617 1.00 0.00 H new ATOM 912 N VAL A 57 -5.523 -11.988 2.155 1.00 0.00 N ATOM 913 CA VAL A 57 -4.534 -12.757 1.419 1.00 0.00 C ATOM 914 C VAL A 57 -5.211 -13.970 0.778 1.00 0.00 C ATOM 915 O VAL A 57 -5.870 -14.751 1.463 1.00 0.00 O ATOM 916 CB VAL A 57 -3.374 -13.137 2.342 1.00 0.00 C ATOM 917 CG1 VAL A 57 -3.865 -13.366 3.773 1.00 0.00 C ATOM 918 CG2 VAL A 57 -2.633 -14.366 1.813 1.00 0.00 C ATOM 0 H VAL A 57 -6.144 -12.544 2.743 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.108 -12.160 0.613 1.00 0.00 H new ATOM 0 HB VAL A 57 -2.671 -12.304 2.358 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -3.021 -13.635 4.409 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -4.327 -12.453 4.150 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.597 -14.173 3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.813 -14.615 2.487 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -3.322 -15.208 1.753 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -2.235 -14.152 0.821 1.00 0.00 H new ATOM 928 N GLU A 58 -5.024 -14.091 -0.528 1.00 0.00 N ATOM 929 CA GLU A 58 -5.608 -15.196 -1.268 1.00 0.00 C ATOM 930 C GLU A 58 -4.515 -15.993 -1.983 1.00 0.00 C ATOM 931 O GLU A 58 -4.011 -15.569 -3.022 1.00 0.00 O ATOM 932 CB GLU A 58 -6.660 -14.696 -2.261 1.00 0.00 C ATOM 933 CG GLU A 58 -8.065 -15.126 -1.835 1.00 0.00 C ATOM 934 CD GLU A 58 -8.319 -16.594 -2.185 1.00 0.00 C ATOM 935 OE1 GLU A 58 -7.491 -17.430 -1.762 1.00 0.00 O ATOM 936 OE2 GLU A 58 -9.334 -16.847 -2.868 1.00 0.00 O ATOM 0 H GLU A 58 -4.476 -13.442 -1.093 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.109 -15.857 -0.560 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.613 -13.609 -2.329 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.442 -15.087 -3.255 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.185 -14.978 -0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.807 -14.497 -2.328 1.00 0.00 H new ATOM 943 N GLY A 59 -4.180 -17.134 -1.397 1.00 0.00 N ATOM 944 CA GLY A 59 -3.156 -17.994 -1.965 1.00 0.00 C ATOM 945 C GLY A 59 -1.804 -17.756 -1.289 1.00 0.00 C ATOM 946 O GLY A 59 -1.388 -18.536 -0.434 1.00 0.00 O ATOM 0 H GLY A 59 -4.600 -17.482 -0.535 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.447 -19.038 -1.848 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.070 -17.805 -3.035 1.00 0.00 H new ATOM 950 N GLY A 60 -1.156 -16.675 -1.699 1.00 0.00 N ATOM 951 CA GLY A 60 0.140 -16.325 -1.144 1.00 0.00 C ATOM 952 C GLY A 60 0.452 -14.844 -1.372 1.00 0.00 C ATOM 953 O GLY A 60 1.616 -14.448 -1.395 1.00 0.00 O ATOM 0 H GLY A 60 -1.504 -16.031 -2.409 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.153 -16.543 -0.076 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.914 -16.939 -1.604 1.00 0.00 H new ATOM 957 N LYS A 61 -0.608 -14.067 -1.535 1.00 0.00 N ATOM 958 CA LYS A 61 -0.462 -12.639 -1.761 1.00 0.00 C ATOM 959 C LYS A 61 -1.567 -11.893 -1.010 1.00 0.00 C ATOM 960 O LYS A 61 -2.701 -12.365 -0.937 1.00 0.00 O ATOM 961 CB LYS A 61 -0.423 -12.335 -3.259 1.00 0.00 C ATOM 962 CG LYS A 61 0.849 -12.894 -3.899 1.00 0.00 C ATOM 963 CD LYS A 61 0.810 -12.743 -5.421 1.00 0.00 C ATOM 964 CE LYS A 61 1.556 -13.890 -6.106 1.00 0.00 C ATOM 965 NZ LYS A 61 0.673 -14.578 -7.074 1.00 0.00 N ATOM 0 H LYS A 61 -1.572 -14.399 -1.515 1.00 0.00 H new ATOM 0 HA LYS A 61 0.489 -12.285 -1.363 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.298 -12.767 -3.744 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.470 -11.257 -3.416 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.720 -12.373 -3.501 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.960 -13.946 -3.637 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -0.225 -12.723 -5.761 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.258 -11.791 -5.707 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.437 -13.504 -6.619 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.909 -14.600 -5.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 1.195 -15.353 -7.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -0.155 -14.963 -6.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 0.357 -13.901 -7.798 1.00 0.00 H new ATOM 979 N VAL A 62 -1.198 -10.740 -0.472 1.00 0.00 N ATOM 980 CA VAL A 62 -2.144 -9.924 0.270 1.00 0.00 C ATOM 981 C VAL A 62 -2.787 -8.909 -0.676 1.00 0.00 C ATOM 982 O VAL A 62 -2.090 -8.121 -1.314 1.00 0.00 O ATOM 983 CB VAL A 62 -1.446 -9.270 1.465 1.00 0.00 C ATOM 984 CG1 VAL A 62 -0.267 -10.119 1.943 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.996 -7.848 1.125 1.00 0.00 C ATOM 0 H VAL A 62 -0.257 -10.351 -0.535 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.945 -10.542 0.677 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.166 -9.208 2.281 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.211 -9.632 2.793 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.626 -11.103 2.244 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.455 -10.228 1.134 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.503 -7.406 1.991 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.300 -7.877 0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.864 -7.246 0.855 1.00 0.00 H new ATOM 995 N ARG A 63 -4.110 -8.960 -0.738 1.00 0.00 N ATOM 996 CA ARG A 63 -4.855 -8.055 -1.596 1.00 0.00 C ATOM 997 C ARG A 63 -5.136 -6.741 -0.864 1.00 0.00 C ATOM 998 O ARG A 63 -5.771 -6.736 0.189 1.00 0.00 O ATOM 999 CB ARG A 63 -6.180 -8.679 -2.036 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.943 -9.873 -2.962 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.324 -9.426 -4.288 1.00 0.00 C ATOM 1002 NE ARG A 63 -6.272 -9.671 -5.398 1.00 0.00 N ATOM 1003 CZ ARG A 63 -6.090 -9.234 -6.651 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -4.995 -8.528 -6.962 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -7.004 -9.504 -7.594 1.00 0.00 N ATOM 0 H ARG A 63 -4.685 -9.615 -0.208 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.247 -7.860 -2.480 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.744 -9.000 -1.160 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.786 -7.932 -2.548 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.285 -10.591 -2.473 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.887 -10.384 -3.151 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.071 -8.367 -4.242 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.395 -9.968 -4.466 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.117 -10.206 -5.196 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.300 -8.323 -6.245 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.857 -8.195 -7.916 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.838 -10.042 -7.357 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.866 -9.171 -8.548 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.649 -5.657 -1.452 1.00 0.00 N ATOM 1020 CA LEU A 64 -4.839 -4.340 -0.868 1.00 0.00 C ATOM 1021 C LEU A 64 -6.121 -3.720 -1.428 1.00 0.00 C ATOM 1022 O LEU A 64 -6.400 -3.833 -2.621 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.595 -3.475 -1.080 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.364 -3.859 -0.256 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.157 -3.000 -0.641 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -2.663 -3.788 1.243 1.00 0.00 C ATOM 0 H LEU A 64 -4.124 -5.664 -2.326 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.965 -4.417 0.212 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.327 -3.511 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.852 -2.441 -0.852 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.109 -4.894 -0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.296 -3.293 -0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.930 -3.145 -1.697 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.385 -1.950 -0.460 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.772 -4.066 1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.957 -2.772 1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.474 -4.475 1.485 1.00 0.00 H new ATOM 1038 N TYR A 65 -6.867 -3.079 -0.540 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.112 -2.440 -0.931 1.00 0.00 C ATOM 1040 C TYR A 65 -8.363 -1.176 -0.106 1.00 0.00 C ATOM 1041 O TYR A 65 -8.435 -1.235 1.120 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.217 -3.456 -0.633 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.193 -4.686 -1.542 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -9.476 -4.557 -2.887 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -8.887 -5.926 -1.018 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -9.453 -5.715 -3.742 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -8.864 -7.084 -1.873 1.00 0.00 C ATOM 1048 CZ TYR A 65 -9.148 -6.922 -3.193 1.00 0.00 C ATOM 1049 OH TYR A 65 -9.126 -8.016 -4.001 1.00 0.00 O ATOM 0 H TYR A 65 -6.633 -2.989 0.449 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.081 -2.149 -1.981 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.127 -3.781 0.404 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.185 -2.964 -0.730 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -9.715 -3.587 -3.298 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.665 -6.027 0.034 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -9.673 -5.628 -4.796 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.627 -8.060 -1.475 1.00 0.00 H new ATOM 0 HH TYR A 65 -8.892 -8.808 -3.473 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.488 -0.062 -0.813 1.00 0.00 N ATOM 1060 CA PHE A 66 -8.728 1.214 -0.162 1.00 0.00 C ATOM 1061 C PHE A 66 -9.982 1.888 -0.724 1.00 0.00 C ATOM 1062 O PHE A 66 -10.280 1.762 -1.911 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.515 2.099 -0.451 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.203 1.566 0.130 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -5.981 1.623 1.470 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.260 1.036 -0.694 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -4.763 1.129 2.009 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.043 0.541 -0.155 1.00 0.00 C ATOM 1069 CZ PHE A 66 -3.821 0.598 1.185 1.00 0.00 C ATOM 0 H PHE A 66 -8.427 -0.017 -1.830 1.00 0.00 H new ATOM 0 HA PHE A 66 -8.876 1.064 0.907 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.405 2.206 -1.530 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -7.701 3.095 -0.049 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -6.730 2.044 2.124 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -5.437 0.992 -1.759 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -4.585 1.175 3.073 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.294 0.119 -0.809 1.00 0.00 H new ATOM 0 HZ PHE A 66 -2.896 0.221 1.595 1.00 0.00 H new ATOM 1079 N HIS A 67 -10.682 2.590 0.155 1.00 0.00 N ATOM 1080 CA HIS A 67 -11.896 3.284 -0.238 1.00 0.00 C ATOM 1081 C HIS A 67 -11.885 4.702 0.336 1.00 0.00 C ATOM 1082 O HIS A 67 -11.822 4.883 1.551 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.136 2.487 0.174 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.424 3.004 -0.420 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -14.696 4.354 -0.559 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.510 2.340 -0.909 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -15.895 4.484 -1.108 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.398 3.235 -1.323 1.00 0.00 N ATOM 0 H HIS A 67 -10.431 2.693 1.138 1.00 0.00 H new ATOM 0 HA HIS A 67 -11.935 3.369 -1.324 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.002 1.447 -0.124 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.219 2.499 1.261 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.628 1.267 -0.952 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.387 5.416 -1.344 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.307 3.023 -1.734 1.00 0.00 H new ATOM 1096 N VAL A 68 -11.949 5.671 -0.565 1.00 0.00 N ATOM 1097 CA VAL A 68 -11.947 7.068 -0.163 1.00 0.00 C ATOM 1098 C VAL A 68 -13.111 7.791 -0.843 1.00 0.00 C ATOM 1099 O VAL A 68 -13.109 7.971 -2.060 1.00 0.00 O ATOM 1100 CB VAL A 68 -10.588 7.699 -0.472 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -10.532 9.147 0.020 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -9.450 6.871 0.126 1.00 0.00 C ATOM 0 H VAL A 68 -12.003 5.517 -1.572 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.094 7.157 0.913 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.461 7.708 -1.555 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.556 9.573 -0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.309 9.730 -0.475 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.692 9.171 1.098 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.495 7.342 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.571 6.814 1.208 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.472 5.866 -0.294 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.103 8.197 -0.006 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.271 8.897 -0.514 1.00 0.00 C ATOM 1114 C PRO A 69 -14.931 10.345 -0.869 1.00 0.00 C ATOM 1115 O PRO A 69 -15.045 10.748 -2.026 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.309 8.784 0.591 1.00 0.00 C ATOM 1117 CG PRO A 69 -15.537 8.434 1.853 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.139 8.001 1.440 1.00 0.00 C ATOM 0 HA PRO A 69 -15.648 8.467 -1.442 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -16.853 9.721 0.713 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.046 8.015 0.358 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -15.488 9.294 2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -16.039 7.634 2.398 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.376 8.598 1.940 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -13.953 6.960 1.703 1.00 0.00 H new ATOM 1126 N ASP A 70 -14.520 11.089 0.147 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.163 12.485 -0.043 1.00 0.00 C ATOM 1128 C ASP A 70 -13.178 12.600 -1.209 1.00 0.00 C ATOM 1129 O ASP A 70 -13.048 13.664 -1.813 1.00 0.00 O ATOM 1130 CB ASP A 70 -13.487 13.056 1.205 1.00 0.00 C ATOM 1131 CG ASP A 70 -14.436 13.401 2.354 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -15.660 13.267 2.138 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -13.916 13.790 3.422 1.00 0.00 O ATOM 0 H ASP A 70 -14.426 10.752 1.105 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.078 13.043 -0.244 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -12.753 12.335 1.564 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.939 13.955 0.924 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.511 11.491 -1.490 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.542 11.454 -2.572 1.00 0.00 C ATOM 1140 C GLU A 71 -10.343 12.346 -2.242 1.00 0.00 C ATOM 1141 O GLU A 71 -9.873 13.099 -3.093 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.185 11.867 -3.897 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.762 10.654 -4.629 1.00 0.00 C ATOM 1144 CD GLU A 71 -13.352 11.059 -5.982 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -12.556 11.506 -6.836 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -14.584 10.912 -6.130 1.00 0.00 O ATOM 0 H GLU A 71 -12.622 10.611 -0.987 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.187 10.429 -2.682 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.976 12.594 -3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.444 12.358 -4.528 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.980 9.909 -4.778 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.534 10.188 -4.016 1.00 0.00 H new ATOM 1153 N ALA A 72 -9.884 12.231 -1.005 1.00 0.00 N ATOM 1154 CA ALA A 72 -8.749 13.018 -0.552 1.00 0.00 C ATOM 1155 C ALA A 72 -7.469 12.468 -1.184 1.00 0.00 C ATOM 1156 O ALA A 72 -7.172 11.281 -1.063 1.00 0.00 O ATOM 1157 CB ALA A 72 -8.696 13.005 0.977 1.00 0.00 C ATOM 0 H ALA A 72 -10.277 11.605 -0.302 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.852 14.057 -0.866 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.845 13.595 1.317 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.616 13.432 1.377 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.589 11.979 1.329 1.00 0.00 H new ATOM 1163 N PRO A 73 -6.725 13.382 -1.863 1.00 0.00 N ATOM 1164 CA PRO A 73 -5.483 13.002 -2.514 1.00 0.00 C ATOM 1165 C PRO A 73 -4.365 12.802 -1.489 1.00 0.00 C ATOM 1166 O PRO A 73 -3.266 12.373 -1.839 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.194 14.125 -3.497 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.027 15.309 -3.034 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.045 14.797 -2.028 1.00 0.00 C ATOM 0 HA PRO A 73 -5.556 12.046 -3.032 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.133 14.373 -3.505 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.461 13.833 -4.513 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.391 16.069 -2.580 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.529 15.777 -3.881 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -6.970 15.333 -1.082 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.064 14.933 -2.392 1.00 0.00 H new ATOM 1177 N THR A 74 -4.683 13.122 -0.244 1.00 0.00 N ATOM 1178 CA THR A 74 -3.720 12.983 0.835 1.00 0.00 C ATOM 1179 C THR A 74 -3.868 11.618 1.510 1.00 0.00 C ATOM 1180 O THR A 74 -2.875 10.943 1.778 1.00 0.00 O ATOM 1181 CB THR A 74 -3.910 14.160 1.794 1.00 0.00 C ATOM 1182 OG1 THR A 74 -5.300 14.130 2.108 1.00 0.00 O ATOM 1183 CG2 THR A 74 -3.712 15.513 1.108 1.00 0.00 C ATOM 0 H THR A 74 -5.595 13.478 0.042 1.00 0.00 H new ATOM 0 HA THR A 74 -2.698 13.015 0.459 1.00 0.00 H new ATOM 0 HB THR A 74 -3.209 14.069 2.624 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.511 14.860 2.727 1.00 0.00 H new ATOM 0 HG21 THR A 74 -3.858 16.313 1.833 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.702 15.571 0.702 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.435 15.620 0.299 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.116 11.253 1.766 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.407 9.981 2.405 1.00 0.00 C ATOM 1193 C VAL A 75 -5.185 8.848 1.401 1.00 0.00 C ATOM 1194 O VAL A 75 -4.485 7.881 1.695 1.00 0.00 O ATOM 1195 CB VAL A 75 -6.823 9.998 2.984 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.276 8.588 3.366 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -6.914 10.946 4.181 1.00 0.00 C ATOM 0 H VAL A 75 -5.937 11.816 1.542 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.730 9.811 3.242 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.497 10.368 2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.286 8.628 3.775 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.268 7.951 2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.598 8.178 4.114 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.931 10.940 4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.223 10.619 4.958 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.653 11.956 3.866 1.00 0.00 H new ATOM 1207 N LYS A 76 -5.795 9.006 0.235 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.674 8.008 -0.814 1.00 0.00 C ATOM 1209 C LYS A 76 -4.197 7.830 -1.173 1.00 0.00 C ATOM 1210 O LYS A 76 -3.727 6.705 -1.342 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.557 8.376 -2.008 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.300 7.149 -2.539 1.00 0.00 C ATOM 1213 CD LYS A 76 -7.882 7.419 -3.928 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.020 6.121 -4.727 1.00 0.00 C ATOM 1215 NZ LYS A 76 -9.443 5.733 -4.845 1.00 0.00 N ATOM 0 H LYS A 76 -6.374 9.810 -0.006 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.037 7.041 -0.465 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.275 9.140 -1.712 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.943 8.805 -2.800 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.619 6.299 -2.585 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.101 6.879 -1.851 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.857 7.896 -3.831 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.239 8.115 -4.467 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.589 6.251 -5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -7.459 5.325 -4.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.518 4.850 -5.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -9.843 5.589 -3.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.969 6.486 -5.332 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.506 8.955 -1.279 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.093 8.937 -1.614 1.00 0.00 C ATOM 1231 C ALA A 77 -1.416 7.773 -0.889 1.00 0.00 C ATOM 1232 O ALA A 77 -0.971 6.816 -1.522 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.467 10.288 -1.261 1.00 0.00 C ATOM 0 H ALA A 77 -3.899 9.886 -1.139 1.00 0.00 H new ATOM 0 HA ALA A 77 -1.954 8.784 -2.684 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.406 10.274 -1.512 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.964 11.078 -1.825 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.584 10.476 -0.194 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.358 7.892 0.430 1.00 0.00 N ATOM 1240 CA PHE A 78 -0.743 6.861 1.248 1.00 0.00 C ATOM 1241 C PHE A 78 -1.130 5.466 0.756 1.00 0.00 C ATOM 1242 O PHE A 78 -0.263 4.645 0.458 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.266 7.050 2.673 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.334 6.504 3.756 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.987 6.826 3.742 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -0.826 5.696 4.734 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.853 6.319 4.747 1.00 0.00 C ATOM 1248 CE2 PHE A 78 0.040 5.189 5.739 1.00 0.00 C ATOM 1249 CZ PHE A 78 1.361 5.512 5.724 1.00 0.00 C ATOM 0 H PHE A 78 -1.727 8.687 0.952 1.00 0.00 H new ATOM 0 HA PHE A 78 0.343 6.945 1.198 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.429 8.113 2.851 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.235 6.559 2.761 1.00 0.00 H new ATOM 0 HD1 PHE A 78 1.378 7.468 2.966 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.875 5.440 4.746 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.902 6.575 4.735 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.350 4.547 6.515 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.019 5.127 6.489 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.434 5.239 0.685 1.00 0.00 N ATOM 1260 CA ALA A 79 -2.947 3.956 0.233 1.00 0.00 C ATOM 1261 C ALA A 79 -2.146 3.492 -0.984 1.00 0.00 C ATOM 1262 O ALA A 79 -1.599 2.390 -0.988 1.00 0.00 O ATOM 1263 CB ALA A 79 -4.442 4.081 -0.065 1.00 0.00 C ATOM 0 H ALA A 79 -3.150 5.922 0.933 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.832 3.201 1.010 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -4.827 3.119 -0.404 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.969 4.385 0.839 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.597 4.828 -0.843 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.102 4.355 -1.988 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.376 4.047 -3.209 1.00 0.00 C ATOM 1271 C GLY A 80 0.066 3.638 -2.902 1.00 0.00 C ATOM 1272 O GLY A 80 0.609 2.739 -3.541 1.00 0.00 O ATOM 0 H GLY A 80 -2.557 5.268 -1.981 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.880 3.241 -3.743 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.379 4.916 -3.867 1.00 0.00 H new ATOM 1276 N LEU A 81 0.644 4.319 -1.923 1.00 0.00 N ATOM 1277 CA LEU A 81 2.013 4.038 -1.524 1.00 0.00 C ATOM 1278 C LEU A 81 2.139 2.557 -1.160 1.00 0.00 C ATOM 1279 O LEU A 81 2.895 1.822 -1.793 1.00 0.00 O ATOM 1280 CB LEU A 81 2.449 4.986 -0.405 1.00 0.00 C ATOM 1281 CG LEU A 81 3.959 5.137 -0.205 1.00 0.00 C ATOM 1282 CD1 LEU A 81 4.276 6.351 0.671 1.00 0.00 C ATOM 1283 CD2 LEU A 81 4.569 3.851 0.355 1.00 0.00 C ATOM 0 H LEU A 81 0.190 5.064 -1.395 1.00 0.00 H new ATOM 0 HA LEU A 81 2.698 4.223 -2.352 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.029 5.971 -0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.011 4.638 0.531 1.00 0.00 H new ATOM 0 HG LEU A 81 4.417 5.313 -1.178 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.355 6.436 0.798 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.894 7.254 0.194 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.804 6.229 1.646 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.643 3.985 0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.111 3.620 1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.389 3.030 -0.340 1.00 0.00 H new ATOM 1295 N LEU A 82 1.388 2.165 -0.142 1.00 0.00 N ATOM 1296 CA LEU A 82 1.407 0.785 0.314 1.00 0.00 C ATOM 1297 C LEU A 82 1.472 -0.147 -0.898 1.00 0.00 C ATOM 1298 O LEU A 82 2.462 -0.852 -1.091 1.00 0.00 O ATOM 1299 CB LEU A 82 0.219 0.510 1.238 1.00 0.00 C ATOM 1300 CG LEU A 82 0.113 1.401 2.477 1.00 0.00 C ATOM 1301 CD1 LEU A 82 1.493 1.674 3.077 1.00 0.00 C ATOM 1302 CD2 LEU A 82 -0.640 2.695 2.158 1.00 0.00 C ATOM 0 H LEU A 82 0.762 2.778 0.380 1.00 0.00 H new ATOM 0 HA LEU A 82 2.298 0.593 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -0.698 0.616 0.659 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.271 -0.528 1.565 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.466 0.869 3.232 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.388 2.310 3.956 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.958 0.731 3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.118 2.176 2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.702 3.311 3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.110 3.242 1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.646 2.455 1.813 1.00 0.00 H new ATOM 1314 N ARG A 83 0.405 -0.120 -1.683 1.00 0.00 N ATOM 1315 CA ARG A 83 0.329 -0.954 -2.871 1.00 0.00 C ATOM 1316 C ARG A 83 1.575 -0.759 -3.737 1.00 0.00 C ATOM 1317 O ARG A 83 2.030 -1.694 -4.395 1.00 0.00 O ATOM 1318 CB ARG A 83 -0.915 -0.622 -3.697 1.00 0.00 C ATOM 1319 CG ARG A 83 -0.844 -1.274 -5.080 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.050 -0.878 -5.935 1.00 0.00 C ATOM 1321 NE ARG A 83 -2.413 -1.988 -6.843 1.00 0.00 N ATOM 1322 CZ ARG A 83 -3.077 -1.829 -7.996 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -3.455 -0.605 -8.388 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -3.364 -2.895 -8.757 1.00 0.00 N ATOM 0 H ARG A 83 -0.414 0.466 -1.520 1.00 0.00 H new ATOM 0 HA ARG A 83 0.268 -1.992 -2.545 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.807 -0.967 -3.173 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.007 0.459 -3.805 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.076 -0.973 -5.581 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.809 -2.358 -4.974 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -2.896 -0.631 -5.293 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -1.818 0.016 -6.514 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.141 -2.934 -6.575 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.237 0.206 -7.809 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.960 -0.484 -9.266 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.077 -3.827 -8.458 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -3.869 -2.774 -9.635 1.00 0.00 H new ATOM 1338 N GLU A 84 2.092 0.460 -3.708 1.00 0.00 N ATOM 1339 CA GLU A 84 3.277 0.789 -4.482 1.00 0.00 C ATOM 1340 C GLU A 84 4.522 0.187 -3.829 1.00 0.00 C ATOM 1341 O GLU A 84 5.624 0.300 -4.363 1.00 0.00 O ATOM 1342 CB GLU A 84 3.422 2.304 -4.646 1.00 0.00 C ATOM 1343 CG GLU A 84 2.624 2.804 -5.852 1.00 0.00 C ATOM 1344 CD GLU A 84 2.998 2.028 -7.117 1.00 0.00 C ATOM 1345 OE1 GLU A 84 4.209 1.764 -7.284 1.00 0.00 O ATOM 1346 OE2 GLU A 84 2.065 1.716 -7.888 1.00 0.00 O ATOM 0 H GLU A 84 1.712 1.232 -3.161 1.00 0.00 H new ATOM 0 HA GLU A 84 3.168 0.358 -5.477 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.075 2.806 -3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.474 2.561 -4.770 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.557 2.696 -5.657 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.814 3.867 -6.003 1.00 0.00 H new ATOM 1353 N GLY A 85 4.305 -0.441 -2.682 1.00 0.00 N ATOM 1354 CA GLY A 85 5.396 -1.061 -1.950 1.00 0.00 C ATOM 1355 C GLY A 85 5.109 -2.541 -1.690 1.00 0.00 C ATOM 1356 O GLY A 85 5.998 -3.382 -1.821 1.00 0.00 O ATOM 0 H GLY A 85 3.389 -0.533 -2.242 1.00 0.00 H new ATOM 0 HA2 GLY A 85 6.322 -0.960 -2.516 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.544 -0.543 -1.002 1.00 0.00 H new ATOM 1360 N LEU A 86 3.866 -2.815 -1.325 1.00 0.00 N ATOM 1361 CA LEU A 86 3.451 -4.179 -1.044 1.00 0.00 C ATOM 1362 C LEU A 86 2.905 -4.815 -2.325 1.00 0.00 C ATOM 1363 O LEU A 86 3.528 -5.711 -2.891 1.00 0.00 O ATOM 1364 CB LEU A 86 2.466 -4.210 0.126 1.00 0.00 C ATOM 1365 CG LEU A 86 2.974 -3.626 1.446 1.00 0.00 C ATOM 1366 CD1 LEU A 86 3.637 -4.705 2.303 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.905 -2.438 1.197 1.00 0.00 C ATOM 0 H LEU A 86 3.132 -2.115 -1.217 1.00 0.00 H new ATOM 0 HA LEU A 86 4.304 -4.779 -0.727 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.568 -3.667 -0.167 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.171 -5.245 0.299 1.00 0.00 H new ATOM 0 HG LEU A 86 2.118 -3.251 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.989 -4.264 3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.914 -5.490 2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.481 -5.132 1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.252 -2.041 2.151 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.761 -2.764 0.607 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.366 -1.661 0.655 1.00 0.00 H new ATOM 1379 N GLU A 87 1.747 -4.326 -2.743 1.00 0.00 N ATOM 1380 CA GLU A 87 1.110 -4.835 -3.945 1.00 0.00 C ATOM 1381 C GLU A 87 1.150 -6.365 -3.960 1.00 0.00 C ATOM 1382 O GLU A 87 2.196 -6.959 -4.218 1.00 0.00 O ATOM 1383 CB GLU A 87 1.767 -4.257 -5.200 1.00 0.00 C ATOM 1384 CG GLU A 87 1.753 -5.273 -6.344 1.00 0.00 C ATOM 1385 CD GLU A 87 2.033 -4.593 -7.686 1.00 0.00 C ATOM 1386 OE1 GLU A 87 1.178 -3.780 -8.099 1.00 0.00 O ATOM 1387 OE2 GLU A 87 3.096 -4.901 -8.268 1.00 0.00 O ATOM 0 H GLU A 87 1.233 -3.582 -2.270 1.00 0.00 H new ATOM 0 HA GLU A 87 0.067 -4.518 -3.942 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.242 -3.352 -5.506 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.794 -3.969 -4.977 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.502 -6.044 -6.160 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.784 -5.772 -6.380 1.00 0.00 H new ATOM 1394 N GLY A 88 -0.002 -6.958 -3.681 1.00 0.00 N ATOM 1395 CA GLY A 88 -0.111 -8.406 -3.659 1.00 0.00 C ATOM 1396 C GLY A 88 1.119 -9.039 -3.006 1.00 0.00 C ATOM 1397 O GLY A 88 1.576 -10.099 -3.432 1.00 0.00 O ATOM 0 H GLY A 88 -0.867 -6.462 -3.468 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.008 -8.698 -3.113 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.221 -8.781 -4.676 1.00 0.00 H new ATOM 1401 N GLU A 89 1.619 -8.364 -1.982 1.00 0.00 N ATOM 1402 CA GLU A 89 2.788 -8.847 -1.266 1.00 0.00 C ATOM 1403 C GLU A 89 2.404 -10.008 -0.346 1.00 0.00 C ATOM 1404 O GLU A 89 1.291 -10.527 -0.426 1.00 0.00 O ATOM 1405 CB GLU A 89 3.452 -7.718 -0.476 1.00 0.00 C ATOM 1406 CG GLU A 89 4.928 -7.578 -0.855 1.00 0.00 C ATOM 1407 CD GLU A 89 5.829 -8.211 0.207 1.00 0.00 C ATOM 1408 OE1 GLU A 89 5.889 -9.459 0.230 1.00 0.00 O ATOM 1409 OE2 GLU A 89 6.438 -7.432 0.972 1.00 0.00 O ATOM 0 H GLU A 89 1.236 -7.486 -1.631 1.00 0.00 H new ATOM 0 HA GLU A 89 3.512 -9.211 -1.995 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.933 -6.780 -0.670 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.364 -7.916 0.592 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.106 -8.054 -1.819 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.180 -6.524 -0.969 1.00 0.00 H new ATOM 1416 N SER A 90 3.346 -10.381 0.507 1.00 0.00 N ATOM 1417 CA SER A 90 3.120 -11.471 1.442 1.00 0.00 C ATOM 1418 C SER A 90 2.516 -10.931 2.739 1.00 0.00 C ATOM 1419 O SER A 90 2.670 -9.753 3.057 1.00 0.00 O ATOM 1420 CB SER A 90 4.420 -12.224 1.734 1.00 0.00 C ATOM 1421 OG SER A 90 5.493 -11.337 2.039 1.00 0.00 O ATOM 0 H SER A 90 4.267 -9.948 0.571 1.00 0.00 H new ATOM 0 HA SER A 90 2.420 -12.172 0.988 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.264 -12.906 2.570 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.688 -12.834 0.871 1.00 0.00 H new ATOM 0 HG SER A 90 5.769 -10.866 1.225 1.00 0.00 H new ATOM 1427 N PRO A 91 1.822 -11.843 3.473 1.00 0.00 N ATOM 1428 CA PRO A 91 1.194 -11.470 4.729 1.00 0.00 C ATOM 1429 C PRO A 91 2.235 -11.317 5.839 1.00 0.00 C ATOM 1430 O PRO A 91 1.920 -10.845 6.930 1.00 0.00 O ATOM 1431 CB PRO A 91 0.187 -12.574 5.007 1.00 0.00 C ATOM 1432 CG PRO A 91 0.611 -13.753 4.147 1.00 0.00 C ATOM 1433 CD PRO A 91 1.619 -13.247 3.128 1.00 0.00 C ATOM 0 HA PRO A 91 0.699 -10.500 4.680 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.184 -12.843 6.063 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.824 -12.252 4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.052 -14.536 4.764 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -0.253 -14.190 3.645 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.552 -13.807 3.183 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.242 -13.354 2.111 1.00 0.00 H new ATOM 1441 N GLU A 92 3.455 -11.725 5.522 1.00 0.00 N ATOM 1442 CA GLU A 92 4.545 -11.639 6.479 1.00 0.00 C ATOM 1443 C GLU A 92 5.295 -10.316 6.312 1.00 0.00 C ATOM 1444 O GLU A 92 5.779 -9.745 7.289 1.00 0.00 O ATOM 1445 CB GLU A 92 5.496 -12.830 6.336 1.00 0.00 C ATOM 1446 CG GLU A 92 4.720 -14.147 6.287 1.00 0.00 C ATOM 1447 CD GLU A 92 5.024 -15.009 7.514 1.00 0.00 C ATOM 1448 OE1 GLU A 92 6.150 -15.548 7.564 1.00 0.00 O ATOM 1449 OE2 GLU A 92 4.123 -15.109 8.375 1.00 0.00 O ATOM 0 H GLU A 92 3.713 -12.116 4.616 1.00 0.00 H new ATOM 0 HA GLU A 92 4.123 -11.671 7.484 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.090 -12.719 5.428 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.194 -12.846 7.173 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.651 -13.941 6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.981 -14.693 5.381 1.00 0.00 H new ATOM 1456 N ALA A 93 5.369 -9.867 5.068 1.00 0.00 N ATOM 1457 CA ALA A 93 6.051 -8.622 4.761 1.00 0.00 C ATOM 1458 C ALA A 93 5.149 -7.444 5.134 1.00 0.00 C ATOM 1459 O ALA A 93 5.634 -6.386 5.531 1.00 0.00 O ATOM 1460 CB ALA A 93 6.447 -8.607 3.283 1.00 0.00 C ATOM 0 H ALA A 93 4.968 -10.344 4.260 1.00 0.00 H new ATOM 0 HA ALA A 93 6.967 -8.533 5.345 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.959 -7.673 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.112 -9.445 3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.553 -8.692 2.666 1.00 0.00 H new ATOM 1466 N VAL A 94 3.850 -7.668 4.994 1.00 0.00 N ATOM 1467 CA VAL A 94 2.875 -6.638 5.312 1.00 0.00 C ATOM 1468 C VAL A 94 2.733 -6.528 6.831 1.00 0.00 C ATOM 1469 O VAL A 94 2.272 -5.509 7.342 1.00 0.00 O ATOM 1470 CB VAL A 94 1.550 -6.938 4.607 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.459 -5.962 5.054 1.00 0.00 C ATOM 1472 CG2 VAL A 94 1.720 -6.912 3.087 1.00 0.00 C ATOM 0 H VAL A 94 3.450 -8.547 4.665 1.00 0.00 H new ATOM 0 HA VAL A 94 3.210 -5.667 4.946 1.00 0.00 H new ATOM 0 HB VAL A 94 1.238 -7.943 4.892 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -0.472 -6.196 4.539 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.310 -6.050 6.130 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.761 -4.943 4.812 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.764 -7.128 2.610 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.066 -5.926 2.776 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.452 -7.663 2.790 1.00 0.00 H new ATOM 1482 N LEU A 95 3.137 -7.592 7.510 1.00 0.00 N ATOM 1483 CA LEU A 95 3.060 -7.627 8.960 1.00 0.00 C ATOM 1484 C LEU A 95 4.393 -7.162 9.549 1.00 0.00 C ATOM 1485 O LEU A 95 4.437 -6.646 10.665 1.00 0.00 O ATOM 1486 CB LEU A 95 2.627 -9.014 9.440 1.00 0.00 C ATOM 1487 CG LEU A 95 1.127 -9.308 9.377 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.845 -10.784 9.661 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.348 -8.385 10.315 1.00 0.00 C ATOM 0 H LEU A 95 3.519 -8.436 7.082 1.00 0.00 H new ATOM 0 HA LEU A 95 2.295 -6.937 9.317 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.149 -9.762 8.844 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.959 -9.140 10.471 1.00 0.00 H new ATOM 0 HG LEU A 95 0.781 -9.104 8.364 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.229 -10.966 9.610 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.353 -11.401 8.920 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.209 -11.039 10.656 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.716 -8.615 10.251 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.690 -8.534 11.339 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.513 -7.348 10.024 1.00 0.00 H new ATOM 1501 N GLU A 96 5.448 -7.360 8.772 1.00 0.00 N ATOM 1502 CA GLU A 96 6.779 -6.967 9.202 1.00 0.00 C ATOM 1503 C GLU A 96 7.020 -5.487 8.897 1.00 0.00 C ATOM 1504 O GLU A 96 8.137 -4.993 9.042 1.00 0.00 O ATOM 1505 CB GLU A 96 7.849 -7.843 8.547 1.00 0.00 C ATOM 1506 CG GLU A 96 8.300 -7.250 7.210 1.00 0.00 C ATOM 1507 CD GLU A 96 9.296 -8.175 6.509 1.00 0.00 C ATOM 1508 OE1 GLU A 96 9.231 -9.393 6.784 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.099 -7.644 5.712 1.00 0.00 O ATOM 0 H GLU A 96 5.408 -7.788 7.847 1.00 0.00 H new ATOM 0 HA GLU A 96 6.848 -7.112 10.280 1.00 0.00 H new ATOM 0 HB2 GLU A 96 8.706 -7.937 9.214 1.00 0.00 H new ATOM 0 HB3 GLU A 96 7.456 -8.847 8.389 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.434 -7.089 6.568 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.758 -6.275 7.376 1.00 0.00 H new ATOM 1516 N VAL A 97 5.953 -4.820 8.480 1.00 0.00 N ATOM 1517 CA VAL A 97 6.035 -3.407 8.154 1.00 0.00 C ATOM 1518 C VAL A 97 5.620 -2.581 9.373 1.00 0.00 C ATOM 1519 O VAL A 97 4.499 -2.711 9.863 1.00 0.00 O ATOM 1520 CB VAL A 97 5.191 -3.107 6.913 1.00 0.00 C ATOM 1521 CG1 VAL A 97 5.020 -1.599 6.717 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.797 -3.757 5.668 1.00 0.00 C ATOM 0 H VAL A 97 5.028 -5.232 8.361 1.00 0.00 H new ATOM 0 HA VAL A 97 7.060 -3.131 7.909 1.00 0.00 H new ATOM 0 HB VAL A 97 4.202 -3.538 7.068 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.416 -1.414 5.828 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.523 -1.173 7.589 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.999 -1.135 6.594 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.178 -3.528 4.800 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.803 -3.369 5.508 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.842 -4.837 5.807 1.00 0.00 H new ATOM 1532 N PRO A 98 6.570 -1.727 9.840 1.00 0.00 N ATOM 1533 CA PRO A 98 6.315 -0.881 10.992 1.00 0.00 C ATOM 1534 C PRO A 98 5.398 0.287 10.622 1.00 0.00 C ATOM 1535 O PRO A 98 5.268 0.631 9.448 1.00 0.00 O ATOM 1536 CB PRO A 98 7.688 -0.431 11.463 1.00 0.00 C ATOM 1537 CG PRO A 98 8.627 -0.660 10.289 1.00 0.00 C ATOM 1538 CD PRO A 98 7.908 -1.546 9.284 1.00 0.00 C ATOM 0 HA PRO A 98 5.788 -1.405 11.789 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.676 0.619 11.755 1.00 0.00 H new ATOM 0 HB3 PRO A 98 8.008 -1.000 12.336 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.905 0.289 9.831 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.549 -1.134 10.625 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.868 -1.078 8.301 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.419 -2.501 9.162 1.00 0.00 H new ATOM 1546 N PRO A 99 4.770 0.880 11.673 1.00 0.00 N ATOM 1547 CA PRO A 99 3.870 2.003 11.470 1.00 0.00 C ATOM 1548 C PRO A 99 4.649 3.284 11.168 1.00 0.00 C ATOM 1549 O PRO A 99 4.056 4.338 10.943 1.00 0.00 O ATOM 1550 CB PRO A 99 3.056 2.091 12.751 1.00 0.00 C ATOM 1551 CG PRO A 99 3.842 1.318 13.798 1.00 0.00 C ATOM 1552 CD PRO A 99 4.901 0.500 13.076 1.00 0.00 C ATOM 0 HA PRO A 99 3.218 1.868 10.607 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.916 3.129 13.055 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.063 1.663 12.613 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.306 2.002 14.508 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.180 0.667 14.369 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.899 0.721 13.455 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.738 -0.569 13.214 1.00 0.00 H new ATOM 1560 N GLY A 100 5.968 3.151 11.172 1.00 0.00 N ATOM 1561 CA GLY A 100 6.835 4.285 10.901 1.00 0.00 C ATOM 1562 C GLY A 100 7.674 4.046 9.645 1.00 0.00 C ATOM 1563 O GLY A 100 8.710 4.682 9.455 1.00 0.00 O ATOM 0 H GLY A 100 6.457 2.275 11.359 1.00 0.00 H new ATOM 0 HA2 GLY A 100 6.233 5.185 10.775 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.492 4.457 11.754 1.00 0.00 H new ATOM 1567 N PHE A 101 7.196 3.127 8.818 1.00 0.00 N ATOM 1568 CA PHE A 101 7.889 2.796 7.585 1.00 0.00 C ATOM 1569 C PHE A 101 7.981 4.014 6.664 1.00 0.00 C ATOM 1570 O PHE A 101 8.825 4.059 5.771 1.00 0.00 O ATOM 1571 CB PHE A 101 7.070 1.706 6.890 1.00 0.00 C ATOM 1572 CG PHE A 101 5.799 2.221 6.212 1.00 0.00 C ATOM 1573 CD1 PHE A 101 4.662 2.394 6.939 1.00 0.00 C ATOM 1574 CD2 PHE A 101 5.804 2.505 4.882 1.00 0.00 C ATOM 1575 CE1 PHE A 101 3.482 2.871 6.310 1.00 0.00 C ATOM 1576 CE2 PHE A 101 4.625 2.982 4.253 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.488 3.155 4.980 1.00 0.00 C ATOM 0 H PHE A 101 6.337 2.601 8.978 1.00 0.00 H new ATOM 0 HA PHE A 101 8.903 2.464 7.806 1.00 0.00 H new ATOM 0 HB2 PHE A 101 7.695 1.216 6.143 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.797 0.948 7.624 1.00 0.00 H new ATOM 0 HD1 PHE A 101 4.657 2.168 7.995 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.706 2.367 4.304 1.00 0.00 H new ATOM 0 HE1 PHE A 101 2.580 3.008 6.888 1.00 0.00 H new ATOM 0 HE2 PHE A 101 4.630 3.208 3.197 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.591 3.518 4.501 1.00 0.00 H new ATOM 1587 N TYR A 102 7.100 4.972 6.913 1.00 0.00 N ATOM 1588 CA TYR A 102 7.071 6.187 6.117 1.00 0.00 C ATOM 1589 C TYR A 102 7.989 7.256 6.714 1.00 0.00 C ATOM 1590 O TYR A 102 8.135 8.339 6.150 1.00 0.00 O ATOM 1591 CB TYR A 102 5.626 6.688 6.164 1.00 0.00 C ATOM 1592 CG TYR A 102 5.230 7.317 7.501 1.00 0.00 C ATOM 1593 CD1 TYR A 102 4.721 6.527 8.512 1.00 0.00 C ATOM 1594 CD2 TYR A 102 5.381 8.675 7.697 1.00 0.00 C ATOM 1595 CE1 TYR A 102 4.347 7.119 9.770 1.00 0.00 C ATOM 1596 CE2 TYR A 102 5.007 9.267 8.955 1.00 0.00 C ATOM 1597 CZ TYR A 102 4.509 8.460 9.930 1.00 0.00 C ATOM 1598 OH TYR A 102 4.156 9.019 11.118 1.00 0.00 O ATOM 0 H TYR A 102 6.401 4.931 7.655 1.00 0.00 H new ATOM 0 HA TYR A 102 7.411 5.988 5.101 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.481 7.422 5.371 1.00 0.00 H new ATOM 0 HB3 TYR A 102 4.956 5.854 5.953 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.603 5.464 8.359 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.780 9.294 6.907 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.947 6.512 10.569 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.119 10.328 9.121 1.00 0.00 H new ATOM 0 HH TYR A 102 4.720 9.802 11.292 1.00 0.00 H new ATOM 1608 N ARG A 103 8.583 6.914 7.847 1.00 0.00 N ATOM 1609 CA ARG A 103 9.483 7.830 8.527 1.00 0.00 C ATOM 1610 C ARG A 103 10.844 7.853 7.829 1.00 0.00 C ATOM 1611 O ARG A 103 11.172 6.942 7.070 1.00 0.00 O ATOM 1612 CB ARG A 103 9.674 7.430 9.991 1.00 0.00 C ATOM 1613 CG ARG A 103 8.374 7.595 10.779 1.00 0.00 C ATOM 1614 CD ARG A 103 8.659 7.885 12.254 1.00 0.00 C ATOM 1615 NE ARG A 103 9.212 9.250 12.403 1.00 0.00 N ATOM 1616 CZ ARG A 103 8.467 10.364 12.424 1.00 0.00 C ATOM 1617 NH1 ARG A 103 7.135 10.281 12.305 1.00 0.00 N ATOM 1618 NH2 ARG A 103 9.054 11.560 12.563 1.00 0.00 N ATOM 0 H ARG A 103 8.459 6.015 8.312 1.00 0.00 H new ATOM 0 HA ARG A 103 9.035 8.823 8.490 1.00 0.00 H new ATOM 0 HB2 ARG A 103 10.009 6.394 10.048 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.456 8.043 10.440 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.787 8.408 10.352 1.00 0.00 H new ATOM 0 HG3 ARG A 103 7.775 6.689 10.692 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.742 7.789 12.836 1.00 0.00 H new ATOM 0 HD3 ARG A 103 9.364 7.153 12.648 1.00 0.00 H new ATOM 0 HE ARG A 103 10.223 9.349 12.495 1.00 0.00 H new ATOM 0 HH11 ARG A 103 6.688 9.370 12.198 1.00 0.00 H new ATOM 0 HH12 ARG A 103 6.568 11.129 12.321 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.068 11.623 12.653 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.487 12.408 12.579 1.00 0.00 H new ATOM 1632 N GLY A 104 11.601 8.904 8.111 1.00 0.00 N ATOM 1633 CA GLY A 104 12.919 9.057 7.520 1.00 0.00 C ATOM 1634 C GLY A 104 12.834 9.099 5.993 1.00 0.00 C ATOM 1635 O GLY A 104 13.311 8.190 5.316 1.00 0.00 O ATOM 0 H GLY A 104 11.326 9.658 8.741 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.382 9.973 7.887 1.00 0.00 H new ATOM 0 HA3 GLY A 104 13.558 8.230 7.830 1.00 0.00 H new ATOM 1639 N TYR A 105 12.223 10.164 5.495 1.00 0.00 N ATOM 1640 CA TYR A 105 12.069 10.337 4.061 1.00 0.00 C ATOM 1641 C TYR A 105 11.619 11.760 3.725 1.00 0.00 C ATOM 1642 O TYR A 105 12.445 12.663 3.602 1.00 0.00 O ATOM 1643 CB TYR A 105 10.976 9.355 3.633 1.00 0.00 C ATOM 1644 CG TYR A 105 11.449 7.903 3.534 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.546 7.585 2.760 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.777 6.911 4.219 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.991 6.219 2.667 1.00 0.00 C ATOM 1648 CE2 TYR A 105 11.222 5.544 4.126 1.00 0.00 C ATOM 1649 CZ TYR A 105 12.307 5.266 3.354 1.00 0.00 C ATOM 1650 OH TYR A 105 12.726 3.975 3.266 1.00 0.00 O ATOM 0 H TYR A 105 11.829 10.916 6.060 1.00 0.00 H new ATOM 0 HA TYR A 105 13.015 10.159 3.549 1.00 0.00 H new ATOM 0 HB2 TYR A 105 10.153 9.411 4.345 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.582 9.665 2.665 1.00 0.00 H new ATOM 0 HD1 TYR A 105 13.071 8.361 2.224 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.918 7.159 4.824 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.849 5.957 2.065 1.00 0.00 H new ATOM 0 HE2 TYR A 105 10.706 4.758 4.657 1.00 0.00 H new ATOM 0 HH TYR A 105 12.144 3.404 3.810 1.00 0.00 H new ATOM 1660 N GLY A 106 10.310 11.915 3.587 1.00 0.00 N ATOM 1661 CA GLY A 106 9.741 13.213 3.267 1.00 0.00 C ATOM 1662 C GLY A 106 8.233 13.107 3.029 1.00 0.00 C ATOM 1663 O GLY A 106 7.719 13.628 2.040 1.00 0.00 O ATOM 0 H GLY A 106 9.628 11.164 3.691 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.936 13.910 4.082 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.226 13.617 2.378 1.00 0.00 H new ATOM 1667 N LEU A 107 7.567 12.428 3.951 1.00 0.00 N ATOM 1668 CA LEU A 107 6.128 12.247 3.854 1.00 0.00 C ATOM 1669 C LEU A 107 5.430 13.224 4.802 1.00 0.00 C ATOM 1670 O LEU A 107 4.561 13.987 4.383 1.00 0.00 O ATOM 1671 CB LEU A 107 5.756 10.783 4.095 1.00 0.00 C ATOM 1672 CG LEU A 107 5.982 9.830 2.919 1.00 0.00 C ATOM 1673 CD1 LEU A 107 6.852 8.643 3.335 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.650 9.381 2.314 1.00 0.00 C ATOM 0 H LEU A 107 7.997 11.996 4.769 1.00 0.00 H new ATOM 0 HA LEU A 107 5.781 12.478 2.847 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.330 10.419 4.947 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.704 10.738 4.376 1.00 0.00 H new ATOM 0 HG LEU A 107 6.524 10.369 2.141 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.997 7.981 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.820 9.005 3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.360 8.095 4.139 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.839 8.705 1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 107 4.061 8.866 3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.100 10.252 1.957 1.00 0.00 H new ATOM 1686 N GLU A 108 5.836 13.168 6.062 1.00 0.00 N ATOM 1687 CA GLU A 108 5.260 14.038 7.073 1.00 0.00 C ATOM 1688 C GLU A 108 5.119 15.461 6.531 1.00 0.00 C ATOM 1689 O GLU A 108 4.114 16.127 6.776 1.00 0.00 O ATOM 1690 CB GLU A 108 6.097 14.019 8.354 1.00 0.00 C ATOM 1691 CG GLU A 108 5.354 14.703 9.504 1.00 0.00 C ATOM 1692 CD GLU A 108 5.855 16.135 9.705 1.00 0.00 C ATOM 1693 OE1 GLU A 108 5.898 16.869 8.695 1.00 0.00 O ATOM 1694 OE2 GLU A 108 6.184 16.463 10.866 1.00 0.00 O ATOM 0 H GLU A 108 6.557 12.534 6.406 1.00 0.00 H new ATOM 0 HA GLU A 108 4.266 13.665 7.322 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.328 12.989 8.627 1.00 0.00 H new ATOM 0 HB3 GLU A 108 7.047 14.523 8.179 1.00 0.00 H new ATOM 0 HG2 GLU A 108 4.284 14.714 9.295 1.00 0.00 H new ATOM 0 HG3 GLU A 108 5.494 14.133 10.422 1.00 0.00 H new ATOM 1701 N GLU A 109 6.142 15.887 5.803 1.00 0.00 N ATOM 1702 CA GLU A 109 6.145 17.220 5.224 1.00 0.00 C ATOM 1703 C GLU A 109 4.823 17.488 4.503 1.00 0.00 C ATOM 1704 O GLU A 109 4.279 18.588 4.585 1.00 0.00 O ATOM 1705 CB GLU A 109 7.333 17.403 4.278 1.00 0.00 C ATOM 1706 CG GLU A 109 8.589 17.816 5.048 1.00 0.00 C ATOM 1707 CD GLU A 109 9.124 19.158 4.545 1.00 0.00 C ATOM 1708 OE1 GLU A 109 8.473 20.180 4.853 1.00 0.00 O ATOM 1709 OE2 GLU A 109 10.172 19.133 3.865 1.00 0.00 O ATOM 0 H GLU A 109 6.974 15.332 5.601 1.00 0.00 H new ATOM 0 HA GLU A 109 6.250 17.946 6.030 1.00 0.00 H new ATOM 0 HB2 GLU A 109 7.521 16.474 3.741 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.094 18.160 3.531 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.361 17.887 6.112 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.356 17.050 4.937 1.00 0.00 H new ATOM 1716 N PHE A 110 4.344 16.464 3.812 1.00 0.00 N ATOM 1717 CA PHE A 110 3.095 16.575 3.077 1.00 0.00 C ATOM 1718 C PHE A 110 1.910 16.141 3.941 1.00 0.00 C ATOM 1719 O PHE A 110 0.837 16.738 3.874 1.00 0.00 O ATOM 1720 CB PHE A 110 3.202 15.640 1.871 1.00 0.00 C ATOM 1721 CG PHE A 110 4.374 15.957 0.939 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.428 17.155 0.298 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.361 15.040 0.752 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.515 17.449 -0.566 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.448 15.335 -0.112 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.503 16.533 -0.753 1.00 0.00 C ATOM 0 H PHE A 110 4.798 15.553 3.745 1.00 0.00 H new ATOM 0 HA PHE A 110 2.930 17.610 2.776 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.301 14.615 2.227 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.274 15.691 1.301 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.644 17.883 0.446 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.318 14.088 1.260 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.558 18.400 -1.075 1.00 0.00 H new ATOM 0 HE2 PHE A 110 7.232 14.607 -0.260 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.330 16.757 -1.410 1.00 0.00 H new ATOM 1736 N PHE A 111 2.143 15.104 4.732 1.00 0.00 N ATOM 1737 CA PHE A 111 1.108 14.583 5.608 1.00 0.00 C ATOM 1738 C PHE A 111 1.318 15.056 7.048 1.00 0.00 C ATOM 1739 O PHE A 111 2.200 14.558 7.746 1.00 0.00 O ATOM 1740 CB PHE A 111 1.212 13.057 5.565 1.00 0.00 C ATOM 1741 CG PHE A 111 0.981 12.457 4.177 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.151 12.756 3.486 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.909 11.623 3.634 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.365 12.199 2.197 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.695 11.066 2.345 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.563 11.365 1.654 1.00 0.00 C ATOM 0 H PHE A 111 3.034 14.610 4.784 1.00 0.00 H new ATOM 0 HA PHE A 111 0.130 14.934 5.278 1.00 0.00 H new ATOM 0 HB2 PHE A 111 2.200 12.760 5.918 1.00 0.00 H new ATOM 0 HB3 PHE A 111 0.485 12.634 6.258 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.888 13.417 3.917 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.808 11.385 4.183 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.264 12.437 1.648 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.432 10.405 1.914 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.400 10.941 0.674 1.00 0.00 H new ATOM 1756 N THR A 112 0.493 16.012 7.449 1.00 0.00 N ATOM 1757 CA THR A 112 0.578 16.558 8.793 1.00 0.00 C ATOM 1758 C THR A 112 0.830 15.441 9.808 1.00 0.00 C ATOM 1759 O THR A 112 0.602 14.268 9.515 1.00 0.00 O ATOM 1760 CB THR A 112 -0.704 17.347 9.064 1.00 0.00 C ATOM 1761 OG1 THR A 112 -1.749 16.421 8.779 1.00 0.00 O ATOM 1762 CG2 THR A 112 -0.922 18.476 8.054 1.00 0.00 C ATOM 0 H THR A 112 -0.237 16.422 6.867 1.00 0.00 H new ATOM 0 HA THR A 112 1.423 17.239 8.890 1.00 0.00 H new ATOM 0 HB THR A 112 -0.667 17.763 10.071 1.00 0.00 H new ATOM 0 HG1 THR A 112 -2.617 16.850 8.931 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.845 19.004 8.292 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.084 19.172 8.100 1.00 0.00 H new ATOM 0 HG23 THR A 112 -0.992 18.058 7.050 1.00 0.00 H new ATOM 1770 N PRO A 113 1.309 15.855 11.011 1.00 0.00 N ATOM 1771 CA PRO A 113 1.594 14.903 12.071 1.00 0.00 C ATOM 1772 C PRO A 113 0.303 14.400 12.719 1.00 0.00 C ATOM 1773 O PRO A 113 0.330 13.477 13.531 1.00 0.00 O ATOM 1774 CB PRO A 113 2.493 15.651 13.041 1.00 0.00 C ATOM 1775 CG PRO A 113 2.301 17.128 12.733 1.00 0.00 C ATOM 1776 CD PRO A 113 1.591 17.235 11.393 1.00 0.00 C ATOM 0 HA PRO A 113 2.087 14.002 11.705 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.224 15.429 14.074 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.535 15.358 12.913 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.714 17.608 13.516 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.263 17.639 12.697 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.674 17.818 11.476 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.217 17.731 10.652 1.00 0.00 H new ATOM 1784 N LEU A 114 -0.798 15.031 12.336 1.00 0.00 N ATOM 1785 CA LEU A 114 -2.098 14.659 12.869 1.00 0.00 C ATOM 1786 C LEU A 114 -2.745 13.623 11.949 1.00 0.00 C ATOM 1787 O LEU A 114 -2.962 12.480 12.350 1.00 0.00 O ATOM 1788 CB LEU A 114 -2.959 15.903 13.096 1.00 0.00 C ATOM 1789 CG LEU A 114 -3.246 16.263 14.556 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -3.100 17.768 14.789 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -4.621 15.747 14.987 1.00 0.00 C ATOM 0 H LEU A 114 -0.816 15.797 11.663 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.989 14.192 13.848 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.467 16.753 12.623 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.911 15.760 12.584 1.00 0.00 H new ATOM 0 HG LEU A 114 -2.504 15.767 15.182 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -3.309 17.996 15.834 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -2.083 18.077 14.547 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.803 18.305 14.152 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -4.801 16.016 16.028 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -5.391 16.195 14.359 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -4.652 14.663 14.882 1.00 0.00 H new ATOM 1803 N ARG A 115 -3.035 14.058 10.732 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.653 13.182 9.751 1.00 0.00 C ATOM 1805 C ARG A 115 -2.852 11.886 9.617 1.00 0.00 C ATOM 1806 O ARG A 115 -3.410 10.836 9.304 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.742 13.863 8.383 1.00 0.00 C ATOM 1808 CG ARG A 115 -5.198 14.131 7.997 1.00 0.00 C ATOM 1809 CD ARG A 115 -5.283 14.890 6.672 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.357 16.346 6.926 1.00 0.00 N ATOM 1811 CZ ARG A 115 -5.714 17.252 6.006 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -6.032 16.858 4.765 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -5.753 18.553 6.326 1.00 0.00 N ATOM 0 H ARG A 115 -2.853 15.006 10.403 1.00 0.00 H new ATOM 0 HA ARG A 115 -4.661 12.955 10.098 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -3.189 14.802 8.404 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.272 13.233 7.628 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.736 13.187 7.914 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.686 14.708 8.783 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.412 14.664 6.057 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.161 14.565 6.113 1.00 0.00 H new ATOM 0 HE ARG A 115 -5.121 16.681 7.860 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -6.002 15.868 4.521 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.304 17.548 4.065 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.511 18.853 7.270 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -6.025 19.243 5.625 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.554 12.002 9.861 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.670 10.852 9.771 1.00 0.00 C ATOM 1829 C LEU A 116 -1.203 9.734 10.670 1.00 0.00 C ATOM 1830 O LEU A 116 -1.345 8.594 10.230 1.00 0.00 O ATOM 1831 CB LEU A 116 0.771 11.259 10.084 1.00 0.00 C ATOM 1832 CG LEU A 116 1.686 11.469 8.876 1.00 0.00 C ATOM 1833 CD1 LEU A 116 3.039 12.039 9.306 1.00 0.00 C ATOM 1834 CD2 LEU A 116 1.838 10.176 8.073 1.00 0.00 C ATOM 0 H LEU A 116 -1.094 12.874 10.121 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.653 10.462 8.753 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.749 12.182 10.663 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.214 10.493 10.721 1.00 0.00 H new ATOM 0 HG LEU A 116 1.221 12.204 8.219 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.670 12.179 8.429 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.889 12.998 9.801 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.523 11.347 9.995 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.493 10.352 7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.269 9.402 8.708 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.860 9.851 7.718 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.482 10.100 11.912 1.00 0.00 N ATOM 1847 CA ARG A 117 -1.996 9.141 12.877 1.00 0.00 C ATOM 1848 C ARG A 117 -2.974 8.180 12.200 1.00 0.00 C ATOM 1849 O ARG A 117 -2.930 6.974 12.438 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.705 9.849 14.033 1.00 0.00 C ATOM 1851 CG ARG A 117 -1.695 10.374 15.056 1.00 0.00 C ATOM 1852 CD ARG A 117 -1.793 11.895 15.192 1.00 0.00 C ATOM 1853 NE ARG A 117 -3.204 12.297 15.385 1.00 0.00 N ATOM 1854 CZ ARG A 117 -3.836 12.277 16.566 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -3.186 11.874 17.667 1.00 0.00 N ATOM 1856 NH2 ARG A 117 -5.118 12.658 16.647 1.00 0.00 N ATOM 0 H ARG A 117 -1.362 11.046 12.273 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.148 8.582 13.274 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.301 10.676 13.647 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.395 9.159 14.519 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -1.876 9.906 16.024 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.686 10.097 14.751 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -1.192 12.232 16.036 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -1.388 12.375 14.301 1.00 0.00 H new ATOM 0 HE ARG A 117 -3.728 12.609 14.568 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -2.210 11.583 17.605 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -3.667 11.859 18.566 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -5.613 12.963 15.809 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -5.599 12.643 17.546 1.00 0.00 H new ATOM 1870 N GLY A 118 -3.835 8.749 11.369 1.00 0.00 N ATOM 1871 CA GLY A 118 -4.823 7.958 10.656 1.00 0.00 C ATOM 1872 C GLY A 118 -4.153 7.023 9.648 1.00 0.00 C ATOM 1873 O GLY A 118 -4.311 5.806 9.723 1.00 0.00 O ATOM 0 H GLY A 118 -3.869 9.750 11.174 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.408 7.374 11.366 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.518 8.619 10.138 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.417 7.628 8.726 1.00 0.00 N ATOM 1878 CA LEU A 119 -2.722 6.865 7.704 1.00 0.00 C ATOM 1879 C LEU A 119 -2.113 5.612 8.335 1.00 0.00 C ATOM 1880 O LEU A 119 -2.432 4.493 7.935 1.00 0.00 O ATOM 1881 CB LEU A 119 -1.703 7.746 6.978 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.199 8.439 5.708 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -3.701 8.723 5.789 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -1.391 9.707 5.424 1.00 0.00 C ATOM 0 H LEU A 119 -3.287 8.638 8.666 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.421 6.529 6.938 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.354 8.510 7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.840 7.132 6.720 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.044 7.763 4.867 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.028 9.216 4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.243 7.785 5.909 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.903 9.371 6.642 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.764 10.180 4.516 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.492 10.398 6.261 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.341 9.447 5.293 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.246 5.841 9.311 1.00 0.00 N ATOM 1897 CA GLU A 120 -0.589 4.744 10.001 1.00 0.00 C ATOM 1898 C GLU A 120 -1.617 3.696 10.431 1.00 0.00 C ATOM 1899 O GLU A 120 -1.387 2.497 10.280 1.00 0.00 O ATOM 1900 CB GLU A 120 0.211 5.252 11.202 1.00 0.00 C ATOM 1901 CG GLU A 120 1.403 6.098 10.749 1.00 0.00 C ATOM 1902 CD GLU A 120 1.934 6.956 11.898 1.00 0.00 C ATOM 1903 OE1 GLU A 120 1.437 8.095 12.033 1.00 0.00 O ATOM 1904 OE2 GLU A 120 2.826 6.455 12.616 1.00 0.00 O ATOM 0 H GLU A 120 -0.984 6.770 9.640 1.00 0.00 H new ATOM 0 HA GLU A 120 0.113 4.275 9.311 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.435 5.845 11.849 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.564 4.406 11.792 1.00 0.00 H new ATOM 0 HG2 GLU A 120 2.196 5.447 10.380 1.00 0.00 H new ATOM 0 HG3 GLU A 120 1.104 6.739 9.920 1.00 0.00 H new ATOM 1911 N ALA A 121 -2.730 4.186 10.958 1.00 0.00 N ATOM 1912 CA ALA A 121 -3.794 3.306 11.410 1.00 0.00 C ATOM 1913 C ALA A 121 -4.135 2.311 10.299 1.00 0.00 C ATOM 1914 O ALA A 121 -4.380 1.136 10.567 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.003 4.143 11.835 1.00 0.00 C ATOM 0 H ALA A 121 -2.918 5.181 11.082 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.473 2.732 12.279 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.801 3.483 12.174 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.716 4.812 12.647 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.354 4.731 10.987 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.140 2.819 9.075 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.447 1.989 7.922 1.00 0.00 C ATOM 1923 C ALA A 122 -3.579 0.730 7.960 1.00 0.00 C ATOM 1924 O ALA A 122 -4.094 -0.380 8.081 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.243 2.800 6.641 1.00 0.00 C ATOM 0 H ALA A 122 -3.937 3.794 8.857 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.489 1.671 7.944 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.473 2.178 5.776 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.903 3.667 6.650 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.207 3.134 6.583 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.276 0.945 7.853 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.331 -0.159 7.874 1.00 0.00 C ATOM 1933 C LEU A 123 -1.644 -1.071 9.062 1.00 0.00 C ATOM 1934 O LEU A 123 -1.769 -2.284 8.902 1.00 0.00 O ATOM 1935 CB LEU A 123 0.106 0.365 7.863 1.00 0.00 C ATOM 1936 CG LEU A 123 1.205 -0.685 8.039 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.516 -1.380 6.712 1.00 0.00 C ATOM 1938 CD2 LEU A 123 2.455 -0.071 8.671 1.00 0.00 C ATOM 0 H LEU A 123 -1.852 1.867 7.752 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.432 -0.763 6.973 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.275 0.884 6.920 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.208 1.105 8.657 1.00 0.00 H new ATOM 0 HG LEU A 123 0.840 -1.449 8.726 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.300 -2.121 6.865 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.618 -1.873 6.340 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.852 -0.641 5.984 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.220 -0.839 8.785 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.833 0.726 8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.204 0.339 9.649 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.762 -0.452 10.227 1.00 0.00 N ATOM 1951 CA LEU A 124 -2.059 -1.192 11.442 1.00 0.00 C ATOM 1952 C LEU A 124 -3.319 -2.033 11.227 1.00 0.00 C ATOM 1953 O LEU A 124 -3.301 -3.246 11.425 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.149 -0.244 12.639 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.860 0.494 13.008 1.00 0.00 C ATOM 1956 CD1 LEU A 124 -1.169 1.828 13.691 1.00 0.00 C ATOM 1957 CD2 LEU A 124 0.052 -0.388 13.862 1.00 0.00 C ATOM 0 H LEU A 124 -1.657 0.554 10.356 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.249 -1.884 11.674 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.922 0.496 12.434 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.478 -0.816 13.507 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.321 0.719 12.088 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.236 2.332 13.943 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.750 2.456 13.016 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -1.741 1.647 14.601 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.961 0.161 14.110 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.466 -0.666 14.780 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.312 -1.288 13.306 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.383 -1.354 10.824 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.650 -2.023 10.580 1.00 0.00 C ATOM 1971 C ARG A 125 -5.440 -3.247 9.687 1.00 0.00 C ATOM 1972 O ARG A 125 -5.832 -4.356 10.046 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.651 -1.079 9.912 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.268 -0.121 10.934 1.00 0.00 C ATOM 1975 CD ARG A 125 -8.792 -0.090 10.806 1.00 0.00 C ATOM 1976 NE ARG A 125 -9.400 -1.029 11.776 1.00 0.00 N ATOM 1977 CZ ARG A 125 -9.321 -0.890 13.106 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -8.659 0.149 13.634 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -9.903 -1.791 13.910 1.00 0.00 N ATOM 0 H ARG A 125 -4.394 -0.347 10.660 1.00 0.00 H new ATOM 0 HA ARG A 125 -6.051 -2.336 11.544 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.151 -0.509 9.129 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.438 -1.659 9.431 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -6.990 -0.430 11.942 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.867 0.882 10.786 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -9.160 0.920 10.985 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.086 -0.361 9.792 1.00 0.00 H new ATOM 0 HE ARG A 125 -9.911 -1.832 11.409 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.215 0.835 13.023 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -8.599 0.254 14.647 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -10.406 -2.583 13.509 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -9.843 -1.685 14.923 1.00 0.00 H new ATOM 1993 N LEU A 126 -4.821 -3.005 8.541 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.554 -4.074 7.594 1.00 0.00 C ATOM 1995 C LEU A 126 -3.732 -5.166 8.282 1.00 0.00 C ATOM 1996 O LEU A 126 -4.056 -6.348 8.181 1.00 0.00 O ATOM 1997 CB LEU A 126 -3.899 -3.518 6.328 1.00 0.00 C ATOM 1998 CG LEU A 126 -4.611 -2.334 5.670 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -3.603 -1.295 5.175 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -5.542 -2.807 4.552 1.00 0.00 C ATOM 0 H LEU A 126 -4.497 -2.084 8.247 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.487 -4.534 7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.881 -3.214 6.573 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.824 -4.323 5.597 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.232 -1.848 6.422 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.135 -0.464 4.712 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.017 -0.926 6.017 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.938 -1.753 4.443 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.036 -1.946 4.101 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.962 -3.332 3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.293 -3.481 4.965 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.685 -4.730 8.967 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.814 -5.656 9.672 1.00 0.00 C ATOM 2014 C GLN A 127 -2.644 -6.634 10.507 1.00 0.00 C ATOM 2015 O GLN A 127 -2.236 -7.775 10.719 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.808 -4.904 10.547 1.00 0.00 C ATOM 2017 CG GLN A 127 0.358 -4.375 9.710 1.00 0.00 C ATOM 2018 CD GLN A 127 1.685 -4.537 10.455 1.00 0.00 C ATOM 2019 OE1 GLN A 127 1.735 -4.649 11.668 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.753 -4.543 9.662 1.00 0.00 N ATOM 0 H GLN A 127 -2.420 -3.748 9.049 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.249 -6.227 8.935 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -1.306 -4.074 11.049 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.430 -5.567 11.325 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.402 -4.910 8.761 1.00 0.00 H new ATOM 0 HG3 GLN A 127 0.194 -3.323 9.476 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.640 -4.445 8.653 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.685 -4.646 10.063 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.792 -6.151 10.958 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.682 -6.968 11.764 1.00 0.00 C ATOM 2031 C ALA A 128 -5.547 -7.833 10.845 1.00 0.00 C ATOM 2032 O ALA A 128 -5.954 -8.931 11.222 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.520 -6.067 12.674 1.00 0.00 C ATOM 0 H ALA A 128 -4.126 -5.204 10.780 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.110 -7.638 12.406 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.188 -6.681 13.279 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.861 -5.496 13.328 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.109 -5.382 12.065 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.801 -7.306 9.656 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.610 -8.016 8.680 1.00 0.00 C ATOM 2041 C GLN A 129 -5.772 -9.085 7.974 1.00 0.00 C ATOM 2042 O GLN A 129 -6.307 -9.908 7.232 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.227 -7.047 7.670 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.186 -6.074 8.359 1.00 0.00 C ATOM 2045 CD GLN A 129 -8.671 -5.000 7.384 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -8.032 -4.690 6.393 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.835 -4.450 7.720 1.00 0.00 N ATOM 0 H GLN A 129 -5.461 -6.396 9.347 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.428 -8.510 9.205 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.437 -6.489 7.166 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.761 -7.607 6.902 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.040 -6.621 8.758 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.686 -5.603 9.205 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.319 -4.756 8.564 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.244 -3.722 7.133 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.473 -9.037 8.229 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.557 -9.990 7.626 1.00 0.00 C ATOM 2058 C VAL A 130 -3.512 -11.258 8.481 1.00 0.00 C ATOM 2059 O VAL A 130 -3.876 -12.337 8.017 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.181 -9.347 7.438 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.228 -10.294 6.707 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -2.297 -8.010 6.704 1.00 0.00 C ATOM 0 H VAL A 130 -4.033 -8.353 8.845 1.00 0.00 H new ATOM 0 HA VAL A 130 -3.904 -10.278 6.634 1.00 0.00 H new ATOM 0 HB VAL A 130 -1.765 -9.151 8.426 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.258 -9.812 6.587 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.109 -11.209 7.287 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.637 -10.536 5.726 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.305 -7.574 6.583 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -2.744 -8.171 5.723 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -2.924 -7.331 7.282 1.00 0.00 H new ATOM 2072 N ARG A 131 -3.063 -11.085 9.716 1.00 0.00 N ATOM 2073 CA ARG A 131 -2.966 -12.202 10.640 1.00 0.00 C ATOM 2074 C ARG A 131 -4.271 -13.002 10.645 1.00 0.00 C ATOM 2075 O ARG A 131 -4.250 -14.230 10.717 1.00 0.00 O ATOM 2076 CB ARG A 131 -2.668 -11.718 12.060 1.00 0.00 C ATOM 2077 CG ARG A 131 -1.167 -11.497 12.260 1.00 0.00 C ATOM 2078 CD ARG A 131 -0.890 -10.785 13.586 1.00 0.00 C ATOM 2079 NE ARG A 131 0.200 -11.474 14.312 1.00 0.00 N ATOM 2080 CZ ARG A 131 1.502 -11.313 14.041 1.00 0.00 C ATOM 2081 NH1 ARG A 131 1.885 -10.486 13.058 1.00 0.00 N ATOM 2082 NH2 ARG A 131 2.423 -11.980 14.751 1.00 0.00 N ATOM 0 H ARG A 131 -2.763 -10.188 10.098 1.00 0.00 H new ATOM 0 HA ARG A 131 -2.147 -12.838 10.306 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.205 -10.789 12.252 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -3.031 -12.450 12.781 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.649 -12.456 12.243 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -0.770 -10.905 11.435 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -0.615 -9.747 13.400 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -1.793 -10.771 14.196 1.00 0.00 H new ATOM 0 HE ARG A 131 -0.056 -12.111 15.066 1.00 0.00 H new ATOM 0 HH11 ARG A 131 1.185 -9.979 12.516 1.00 0.00 H new ATOM 0 HH12 ARG A 131 2.876 -10.364 12.852 1.00 0.00 H new ATOM 0 HH21 ARG A 131 2.133 -12.611 15.498 1.00 0.00 H new ATOM 0 HH22 ARG A 131 3.414 -11.857 14.544 1.00 0.00 H new ATOM 2096 N LYS A 132 -5.375 -12.273 10.567 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.686 -12.899 10.562 1.00 0.00 C ATOM 2098 C LYS A 132 -6.841 -13.737 9.291 1.00 0.00 C ATOM 2099 O LYS A 132 -7.358 -14.852 9.337 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.782 -11.848 10.743 1.00 0.00 C ATOM 2101 CG LYS A 132 -8.214 -11.268 9.394 1.00 0.00 C ATOM 2102 CD LYS A 132 -9.107 -12.252 8.635 1.00 0.00 C ATOM 2103 CE LYS A 132 -10.513 -11.680 8.442 1.00 0.00 C ATOM 2104 NZ LYS A 132 -11.384 -12.049 9.580 1.00 0.00 N ATOM 0 H LYS A 132 -5.388 -11.255 10.507 1.00 0.00 H new ATOM 0 HA LYS A 132 -6.787 -13.580 11.407 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -8.641 -12.296 11.242 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -7.420 -11.047 11.388 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -8.750 -10.332 9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -7.333 -11.034 8.796 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -8.665 -12.475 7.664 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -9.165 -13.193 9.183 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -10.461 -10.595 8.353 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -10.940 -12.056 7.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -12.334 -11.653 9.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -11.447 -13.085 9.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -10.983 -11.669 10.461 1.00 0.00 H new ATOM 2118 N ALA A 133 -6.383 -13.167 8.185 1.00 0.00 N ATOM 2119 CA ALA A 133 -6.465 -13.848 6.904 1.00 0.00 C ATOM 2120 C ALA A 133 -5.748 -15.196 7.001 1.00 0.00 C ATOM 2121 O ALA A 133 -6.123 -16.153 6.325 1.00 0.00 O ATOM 2122 CB ALA A 133 -5.877 -12.952 5.812 1.00 0.00 C ATOM 0 H ALA A 133 -5.954 -12.242 8.150 1.00 0.00 H new ATOM 0 HA ALA A 133 -7.504 -14.046 6.640 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -5.938 -13.462 4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -6.440 -12.020 5.764 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.834 -12.735 6.042 1.00 0.00 H new ATOM 2128 N LEU A 134 -4.729 -15.228 7.847 1.00 0.00 N ATOM 2129 CA LEU A 134 -3.956 -16.443 8.041 1.00 0.00 C ATOM 2130 C LEU A 134 -4.841 -17.508 8.691 1.00 0.00 C ATOM 2131 O LEU A 134 -4.829 -18.667 8.280 1.00 0.00 O ATOM 2132 CB LEU A 134 -2.676 -16.145 8.824 1.00 0.00 C ATOM 2133 CG LEU A 134 -1.791 -15.030 8.265 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -0.428 -15.011 8.959 1.00 0.00 C ATOM 2135 CD2 LEU A 134 -1.659 -15.145 6.745 1.00 0.00 C ATOM 0 H LEU A 134 -4.421 -14.432 8.406 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.629 -16.843 7.081 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -2.951 -15.885 9.846 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.085 -17.059 8.876 1.00 0.00 H new ATOM 0 HG LEU A 134 -2.272 -14.075 8.475 1.00 0.00 H new ATOM 0 HD11 LEU A 134 0.181 -14.209 8.542 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -0.566 -14.845 10.027 1.00 0.00 H new ATOM 0 HD13 LEU A 134 0.073 -15.966 8.802 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -1.025 -14.340 6.373 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -1.213 -16.106 6.490 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -2.646 -15.070 6.287 1.00 0.00 H new ATOM 2147 N THR A 135 -5.589 -17.076 9.696 1.00 0.00 N ATOM 2148 CA THR A 135 -6.479 -17.978 10.408 1.00 0.00 C ATOM 2149 C THR A 135 -7.909 -17.843 9.879 1.00 0.00 C ATOM 2150 O THR A 135 -8.859 -18.270 10.533 1.00 0.00 O ATOM 2151 CB THR A 135 -6.354 -17.683 11.904 1.00 0.00 C ATOM 2152 OG1 THR A 135 -7.267 -18.591 12.514 1.00 0.00 O ATOM 2153 CG2 THR A 135 -6.898 -16.301 12.275 1.00 0.00 C ATOM 0 H THR A 135 -5.597 -16.114 10.034 1.00 0.00 H new ATOM 0 HA THR A 135 -6.202 -19.019 10.244 1.00 0.00 H new ATOM 0 HB THR A 135 -5.308 -17.754 12.202 1.00 0.00 H new ATOM 0 HG1 THR A 135 -7.925 -18.888 11.851 1.00 0.00 H new ATOM 0 HG21 THR A 135 -6.786 -16.142 13.347 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.343 -15.534 11.734 1.00 0.00 H new ATOM 0 HG23 THR A 135 -7.953 -16.242 12.008 1.00 0.00 H new ATOM 2161 N SER A 136 -8.016 -17.247 8.700 1.00 0.00 N ATOM 2162 CA SER A 136 -9.314 -17.051 8.077 1.00 0.00 C ATOM 2163 C SER A 136 -9.669 -18.264 7.214 1.00 0.00 C ATOM 2164 O SER A 136 -10.840 -18.613 7.081 1.00 0.00 O ATOM 2165 CB SER A 136 -9.331 -15.775 7.232 1.00 0.00 C ATOM 2166 OG SER A 136 -10.639 -15.467 6.757 1.00 0.00 O ATOM 0 H SER A 136 -7.226 -16.894 8.160 1.00 0.00 H new ATOM 0 HA SER A 136 -10.059 -16.943 8.865 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.955 -14.942 7.826 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.656 -15.892 6.384 1.00 0.00 H new ATOM 0 HG SER A 136 -10.608 -14.645 6.224 1.00 0.00 H new TER 2172 SER A 136