USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 814 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 5 THR OG1 : rot 52:sc= 0.898 USER MOD Set 1.2: A 6 GLN : amide:sc= 0.187 K(o=1.1,f=-2.5!) USER MOD Single : A 18 MET CE :methyl -155:sc=-0.00723 (180deg=-0.261) USER MOD Single : A 19 MET CE :methyl -107:sc= -0.547 (180deg=-1.14) USER MOD Single : A 29 LYS NZ :NH3+ -148:sc= 0.885 (180deg=-0.216) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc=-0.00635 K(o=-0.0063,f=-1.1) USER MOD Single : A 66 THR OG1 : rot 36:sc= 0.316 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.121 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 102 LYS NZ :NH3+ -142:sc= 0.488 (180deg=0.209) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.056 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 161:sc= 1.2 (180deg=0.903) USER MOD ----------------------------------------------------------------- ATOM 41 N LEU A 4 6.040 5.131 -5.647 1.00 0.00 N ATOM 42 CA LEU A 4 6.612 6.193 -6.461 1.00 0.00 C ATOM 43 C LEU A 4 5.748 6.531 -7.677 1.00 0.00 C ATOM 44 O LEU A 4 6.276 6.893 -8.725 1.00 0.00 O ATOM 45 CB LEU A 4 8.035 5.800 -6.868 1.00 0.00 C ATOM 46 CG LEU A 4 8.989 5.796 -5.669 1.00 0.00 C ATOM 47 CD1 LEU A 4 10.326 5.178 -6.058 1.00 0.00 C ATOM 48 CD2 LEU A 4 9.278 7.225 -5.237 1.00 0.00 C ATOM 0 HA LEU A 4 6.646 7.104 -5.864 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.022 4.811 -7.326 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.402 6.495 -7.623 1.00 0.00 H new ATOM 0 HG LEU A 4 8.517 5.226 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.993 5.182 -5.196 1.00 0.00 H new ATOM 0 HD12 LEU A 4 10.169 4.152 -6.391 1.00 0.00 H new ATOM 0 HD13 LEU A 4 10.773 5.757 -6.866 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.957 7.217 -4.384 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.738 7.768 -6.062 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.346 7.715 -4.955 1.00 0.00 H new ATOM 60 N THR A 5 4.423 6.416 -7.549 1.00 0.00 N ATOM 61 CA THR A 5 3.501 6.763 -8.621 1.00 0.00 C ATOM 62 C THR A 5 3.108 8.232 -8.541 1.00 0.00 C ATOM 63 O THR A 5 2.535 8.759 -9.489 1.00 0.00 O ATOM 64 CB THR A 5 2.250 5.888 -8.556 1.00 0.00 C ATOM 65 OG1 THR A 5 2.007 5.433 -7.241 1.00 0.00 O ATOM 66 CG2 THR A 5 2.419 4.690 -9.483 1.00 0.00 C ATOM 0 H THR A 5 3.966 6.081 -6.701 1.00 0.00 H new ATOM 0 HA THR A 5 4.007 6.588 -9.570 1.00 0.00 H new ATOM 0 HB THR A 5 1.398 6.490 -8.871 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.001 6.196 -6.627 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.527 4.066 -9.437 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.565 5.039 -10.505 1.00 0.00 H new ATOM 0 HG23 THR A 5 3.286 4.108 -9.171 1.00 0.00 H new ATOM 74 N GLN A 6 3.419 8.890 -7.422 1.00 0.00 N ATOM 75 CA GLN A 6 3.087 10.286 -7.220 1.00 0.00 C ATOM 76 C GLN A 6 4.335 11.144 -7.112 1.00 0.00 C ATOM 77 O GLN A 6 5.124 10.985 -6.180 1.00 0.00 O ATOM 78 CB GLN A 6 2.245 10.420 -5.954 1.00 0.00 C ATOM 79 CG GLN A 6 0.854 9.808 -6.163 1.00 0.00 C ATOM 80 CD GLN A 6 0.802 8.297 -5.956 1.00 0.00 C ATOM 81 OE1 GLN A 6 1.754 7.675 -5.493 1.00 0.00 O ATOM 82 NE2 GLN A 6 -0.326 7.686 -6.302 1.00 0.00 N ATOM 0 H GLN A 6 3.908 8.462 -6.636 1.00 0.00 H new ATOM 0 HA GLN A 6 2.521 10.638 -8.083 1.00 0.00 H new ATOM 0 HB2 GLN A 6 2.746 9.923 -5.123 1.00 0.00 H new ATOM 0 HB3 GLN A 6 2.149 11.472 -5.685 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.153 10.283 -5.476 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.516 10.038 -7.173 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.102 8.226 -6.684 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -0.416 6.677 -6.185 1.00 0.00 H new ATOM 91 N ILE A 7 4.501 12.057 -8.075 1.00 0.00 N ATOM 92 CA ILE A 7 5.670 12.918 -8.170 1.00 0.00 C ATOM 93 C ILE A 7 5.254 14.386 -8.121 1.00 0.00 C ATOM 94 O ILE A 7 4.375 14.810 -8.872 1.00 0.00 O ATOM 95 CB ILE A 7 6.419 12.630 -9.482 1.00 0.00 C ATOM 96 CG1 ILE A 7 6.626 11.127 -9.719 1.00 0.00 C ATOM 97 CG2 ILE A 7 7.762 13.360 -9.485 1.00 0.00 C ATOM 98 CD1 ILE A 7 7.393 10.433 -8.598 1.00 0.00 C ATOM 0 H ILE A 7 3.817 12.215 -8.815 1.00 0.00 H new ATOM 0 HA ILE A 7 6.328 12.714 -7.325 1.00 0.00 H new ATOM 0 HB ILE A 7 5.801 12.999 -10.300 1.00 0.00 H new ATOM 0 HG12 ILE A 7 5.653 10.648 -9.833 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.163 10.986 -10.657 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.287 13.152 -10.417 1.00 0.00 H new ATOM 0 HG22 ILE A 7 7.593 14.433 -9.396 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.365 13.016 -8.644 1.00 0.00 H new ATOM 0 HD11 ILE A 7 7.502 9.374 -8.833 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.379 10.886 -8.498 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.847 10.543 -7.661 1.00 0.00 H new ATOM 110 N LEU A 8 5.885 15.164 -7.237 1.00 0.00 N ATOM 111 CA LEU A 8 5.624 16.591 -7.125 1.00 0.00 C ATOM 112 C LEU A 8 6.533 17.339 -8.100 1.00 0.00 C ATOM 113 O LEU A 8 7.695 16.975 -8.269 1.00 0.00 O ATOM 114 CB LEU A 8 5.850 17.030 -5.670 1.00 0.00 C ATOM 115 CG LEU A 8 4.941 18.169 -5.195 1.00 0.00 C ATOM 116 CD1 LEU A 8 5.354 18.555 -3.776 1.00 0.00 C ATOM 117 CD2 LEU A 8 5.016 19.423 -6.061 1.00 0.00 C ATOM 0 H LEU A 8 6.588 14.818 -6.584 1.00 0.00 H new ATOM 0 HA LEU A 8 4.591 16.822 -7.385 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.701 16.169 -5.018 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.889 17.341 -5.556 1.00 0.00 H new ATOM 0 HG LEU A 8 3.918 17.797 -5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.718 19.365 -3.420 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.246 17.693 -3.118 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.393 18.883 -3.776 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.345 20.183 -5.660 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.037 19.805 -6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.720 19.179 -7.081 1.00 0.00 H new ATOM 129 N ILE A 9 6.010 18.385 -8.742 1.00 0.00 N ATOM 130 CA ILE A 9 6.732 19.171 -9.732 1.00 0.00 C ATOM 131 C ILE A 9 7.118 20.517 -9.121 1.00 0.00 C ATOM 132 O ILE A 9 6.260 21.219 -8.589 1.00 0.00 O ATOM 133 CB ILE A 9 5.829 19.347 -10.957 1.00 0.00 C ATOM 134 CG1 ILE A 9 5.495 17.977 -11.563 1.00 0.00 C ATOM 135 CG2 ILE A 9 6.478 20.254 -12.007 1.00 0.00 C ATOM 136 CD1 ILE A 9 4.384 18.081 -12.608 1.00 0.00 C ATOM 0 H ILE A 9 5.057 18.711 -8.583 1.00 0.00 H new ATOM 0 HA ILE A 9 7.649 18.669 -10.041 1.00 0.00 H new ATOM 0 HB ILE A 9 4.907 19.829 -10.632 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.389 17.554 -12.022 1.00 0.00 H new ATOM 0 HG13 ILE A 9 5.188 17.293 -10.772 1.00 0.00 H new ATOM 0 HG21 ILE A 9 5.810 20.357 -12.862 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.666 21.236 -11.573 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.421 19.815 -12.334 1.00 0.00 H new ATOM 0 HD11 ILE A 9 4.174 17.092 -13.016 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.483 18.480 -12.143 1.00 0.00 H new ATOM 0 HD13 ILE A 9 4.702 18.745 -13.412 1.00 0.00 H new ATOM 148 N VAL A 10 8.405 20.876 -9.196 1.00 0.00 N ATOM 149 CA VAL A 10 8.902 22.129 -8.643 1.00 0.00 C ATOM 150 C VAL A 10 9.754 22.849 -9.682 1.00 0.00 C ATOM 151 O VAL A 10 10.690 22.273 -10.232 1.00 0.00 O ATOM 152 CB VAL A 10 9.720 21.868 -7.375 1.00 0.00 C ATOM 153 CG1 VAL A 10 10.071 23.192 -6.699 1.00 0.00 C ATOM 154 CG2 VAL A 10 8.953 20.999 -6.378 1.00 0.00 C ATOM 0 H VAL A 10 9.124 20.305 -9.641 1.00 0.00 H new ATOM 0 HA VAL A 10 8.053 22.759 -8.380 1.00 0.00 H new ATOM 0 HB VAL A 10 10.626 21.341 -7.675 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.653 22.997 -5.798 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.656 23.806 -7.383 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.155 23.719 -6.433 1.00 0.00 H new ATOM 0 HG21 VAL A 10 9.566 20.836 -5.491 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.029 21.502 -6.093 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.717 20.039 -6.838 1.00 0.00 H new ATOM 164 N GLU A 11 9.424 24.116 -9.947 1.00 0.00 N ATOM 165 CA GLU A 11 10.082 24.915 -10.971 1.00 0.00 C ATOM 166 C GLU A 11 9.968 26.406 -10.665 1.00 0.00 C ATOM 167 O GLU A 11 9.173 26.811 -9.819 1.00 0.00 O ATOM 168 CB GLU A 11 9.499 24.591 -12.353 1.00 0.00 C ATOM 169 CG GLU A 11 7.969 24.489 -12.385 1.00 0.00 C ATOM 170 CD GLU A 11 7.253 25.788 -12.010 1.00 0.00 C ATOM 171 OE1 GLU A 11 6.254 25.696 -11.263 1.00 0.00 O ATOM 172 OE2 GLU A 11 7.703 26.862 -12.468 1.00 0.00 O ATOM 0 H GLU A 11 8.686 24.615 -9.450 1.00 0.00 H new ATOM 0 HA GLU A 11 11.142 24.661 -10.975 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.815 25.361 -13.057 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.922 23.648 -12.701 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.656 24.188 -13.385 1.00 0.00 H new ATOM 0 HG3 GLU A 11 7.653 23.701 -11.701 1.00 0.00 H new ATOM 179 N ASP A 12 10.766 27.224 -11.356 1.00 0.00 N ATOM 180 CA ASP A 12 10.694 28.678 -11.253 1.00 0.00 C ATOM 181 C ASP A 12 10.477 29.299 -12.641 1.00 0.00 C ATOM 182 O ASP A 12 10.709 30.490 -12.842 1.00 0.00 O ATOM 183 CB ASP A 12 11.941 29.217 -10.553 1.00 0.00 C ATOM 184 CG ASP A 12 11.814 30.703 -10.221 1.00 0.00 C ATOM 185 OD1 ASP A 12 12.790 31.440 -10.490 1.00 0.00 O ATOM 186 OD2 ASP A 12 10.745 31.097 -9.696 1.00 0.00 O ATOM 0 H ASP A 12 11.481 26.893 -12.004 1.00 0.00 H new ATOM 0 HA ASP A 12 9.837 28.961 -10.642 1.00 0.00 H new ATOM 0 HB2 ASP A 12 12.114 28.654 -9.636 1.00 0.00 H new ATOM 0 HB3 ASP A 12 12.811 29.061 -11.191 1.00 0.00 H new ATOM 191 N GLU A 13 10.024 28.486 -13.601 1.00 0.00 N ATOM 192 CA GLU A 13 9.756 28.917 -14.965 1.00 0.00 C ATOM 193 C GLU A 13 8.443 28.284 -15.436 1.00 0.00 C ATOM 194 O GLU A 13 8.281 27.066 -15.355 1.00 0.00 O ATOM 195 CB GLU A 13 10.909 28.499 -15.883 1.00 0.00 C ATOM 196 CG GLU A 13 12.217 29.188 -15.493 1.00 0.00 C ATOM 197 CD GLU A 13 13.362 28.734 -16.390 1.00 0.00 C ATOM 198 OE1 GLU A 13 13.501 29.315 -17.488 1.00 0.00 O ATOM 199 OE2 GLU A 13 14.091 27.804 -15.972 1.00 0.00 O ATOM 0 H GLU A 13 9.832 27.497 -13.444 1.00 0.00 H new ATOM 0 HA GLU A 13 9.668 30.003 -14.999 1.00 0.00 H new ATOM 0 HB2 GLU A 13 11.039 27.418 -15.836 1.00 0.00 H new ATOM 0 HB3 GLU A 13 10.661 28.746 -16.915 1.00 0.00 H new ATOM 0 HG2 GLU A 13 12.099 30.269 -15.567 1.00 0.00 H new ATOM 0 HG3 GLU A 13 12.454 28.964 -14.453 1.00 0.00 H new ATOM 206 N PRO A 14 7.491 29.090 -15.929 1.00 0.00 N ATOM 207 CA PRO A 14 6.140 28.642 -16.233 1.00 0.00 C ATOM 208 C PRO A 14 6.080 27.724 -17.453 1.00 0.00 C ATOM 209 O PRO A 14 5.099 27.003 -17.623 1.00 0.00 O ATOM 210 CB PRO A 14 5.349 29.931 -16.474 1.00 0.00 C ATOM 211 CG PRO A 14 6.407 30.889 -17.016 1.00 0.00 C ATOM 212 CD PRO A 14 7.642 30.507 -16.205 1.00 0.00 C ATOM 0 HA PRO A 14 5.734 28.043 -15.418 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.539 29.780 -17.187 1.00 0.00 H new ATOM 0 HB3 PRO A 14 4.899 30.306 -15.555 1.00 0.00 H new ATOM 0 HG2 PRO A 14 6.566 30.755 -18.086 1.00 0.00 H new ATOM 0 HG3 PRO A 14 6.127 31.931 -16.863 1.00 0.00 H new ATOM 0 HD2 PRO A 14 8.557 30.704 -16.764 1.00 0.00 H new ATOM 0 HD3 PRO A 14 7.701 31.084 -15.282 1.00 0.00 H new ATOM 220 N LEU A 15 7.111 27.734 -18.304 1.00 0.00 N ATOM 221 CA LEU A 15 7.134 26.876 -19.478 1.00 0.00 C ATOM 222 C LEU A 15 7.588 25.466 -19.102 1.00 0.00 C ATOM 223 O LEU A 15 7.248 24.501 -19.781 1.00 0.00 O ATOM 224 CB LEU A 15 8.060 27.481 -20.538 1.00 0.00 C ATOM 225 CG LEU A 15 7.631 28.895 -20.958 1.00 0.00 C ATOM 226 CD1 LEU A 15 8.612 29.417 -22.003 1.00 0.00 C ATOM 227 CD2 LEU A 15 6.228 28.899 -21.561 1.00 0.00 C ATOM 0 H LEU A 15 7.934 28.327 -18.197 1.00 0.00 H new ATOM 0 HA LEU A 15 6.127 26.805 -19.889 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.078 27.514 -20.150 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.074 26.834 -21.415 1.00 0.00 H new ATOM 0 HG LEU A 15 7.627 29.528 -20.071 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.318 30.421 -22.309 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.615 29.447 -21.578 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.605 28.757 -22.870 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.958 29.916 -21.847 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.209 28.257 -22.442 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.515 28.527 -20.825 1.00 0.00 H new ATOM 239 N ILE A 16 8.357 25.350 -18.014 1.00 0.00 N ATOM 240 CA ILE A 16 8.861 24.067 -17.551 1.00 0.00 C ATOM 241 C ILE A 16 7.765 23.360 -16.757 1.00 0.00 C ATOM 242 O ILE A 16 7.758 22.133 -16.677 1.00 0.00 O ATOM 243 CB ILE A 16 10.141 24.291 -16.726 1.00 0.00 C ATOM 244 CG1 ILE A 16 11.366 24.546 -17.621 1.00 0.00 C ATOM 245 CG2 ILE A 16 10.476 23.072 -15.865 1.00 0.00 C ATOM 246 CD1 ILE A 16 11.209 25.738 -18.567 1.00 0.00 C ATOM 0 H ILE A 16 8.642 26.142 -17.438 1.00 0.00 H new ATOM 0 HA ILE A 16 9.126 23.424 -18.390 1.00 0.00 H new ATOM 0 HB ILE A 16 9.935 25.162 -16.104 1.00 0.00 H new ATOM 0 HG12 ILE A 16 12.238 24.710 -16.988 1.00 0.00 H new ATOM 0 HG13 ILE A 16 11.565 23.651 -18.211 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.386 23.267 -15.297 1.00 0.00 H new ATOM 0 HG22 ILE A 16 9.654 22.875 -15.177 1.00 0.00 H new ATOM 0 HG23 ILE A 16 10.628 22.204 -16.507 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.114 25.851 -19.163 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.358 25.569 -19.227 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.042 26.645 -17.985 1.00 0.00 H new ATOM 258 N ALA A 17 6.835 24.114 -16.163 1.00 0.00 N ATOM 259 CA ALA A 17 5.763 23.528 -15.374 1.00 0.00 C ATOM 260 C ALA A 17 4.821 22.715 -16.257 1.00 0.00 C ATOM 261 O ALA A 17 4.420 21.613 -15.888 1.00 0.00 O ATOM 262 CB ALA A 17 5.002 24.647 -14.663 1.00 0.00 C ATOM 0 H ALA A 17 6.809 25.132 -16.218 1.00 0.00 H new ATOM 0 HA ALA A 17 6.189 22.850 -14.635 1.00 0.00 H new ATOM 0 HB1 ALA A 17 4.196 24.218 -14.068 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.683 25.193 -14.010 1.00 0.00 H new ATOM 0 HB3 ALA A 17 4.584 25.330 -15.403 1.00 0.00 H new ATOM 268 N MET A 18 4.463 23.250 -17.429 1.00 0.00 N ATOM 269 CA MET A 18 3.559 22.555 -18.334 1.00 0.00 C ATOM 270 C MET A 18 4.288 21.440 -19.082 1.00 0.00 C ATOM 271 O MET A 18 3.662 20.474 -19.515 1.00 0.00 O ATOM 272 CB MET A 18 2.915 23.557 -19.297 1.00 0.00 C ATOM 273 CG MET A 18 3.941 24.169 -20.249 1.00 0.00 C ATOM 274 SD MET A 18 3.230 25.343 -21.430 1.00 0.00 S ATOM 275 CE MET A 18 4.703 25.652 -22.441 1.00 0.00 C ATOM 0 H MET A 18 4.786 24.157 -17.766 1.00 0.00 H new ATOM 0 HA MET A 18 2.766 22.085 -17.753 1.00 0.00 H new ATOM 0 HB2 MET A 18 2.136 23.058 -19.874 1.00 0.00 H new ATOM 0 HB3 MET A 18 2.430 24.349 -18.727 1.00 0.00 H new ATOM 0 HG2 MET A 18 4.709 24.676 -19.664 1.00 0.00 H new ATOM 0 HG3 MET A 18 4.436 23.369 -20.799 1.00 0.00 H new ATOM 0 HE1 MET A 18 4.620 26.629 -22.916 1.00 0.00 H new ATOM 0 HE2 MET A 18 5.590 25.631 -21.808 1.00 0.00 H new ATOM 0 HE3 MET A 18 4.786 24.882 -23.208 1.00 0.00 H new ATOM 285 N MET A 19 5.610 21.565 -19.236 1.00 0.00 N ATOM 286 CA MET A 19 6.404 20.542 -19.892 1.00 0.00 C ATOM 287 C MET A 19 6.598 19.336 -18.972 1.00 0.00 C ATOM 288 O MET A 19 6.680 18.208 -19.450 1.00 0.00 O ATOM 289 CB MET A 19 7.746 21.149 -20.297 1.00 0.00 C ATOM 290 CG MET A 19 8.574 20.140 -21.092 1.00 0.00 C ATOM 291 SD MET A 19 10.156 20.788 -21.690 1.00 0.00 S ATOM 292 CE MET A 19 10.952 21.123 -20.100 1.00 0.00 C ATOM 0 H MET A 19 6.146 22.370 -18.912 1.00 0.00 H new ATOM 0 HA MET A 19 5.886 20.188 -20.783 1.00 0.00 H new ATOM 0 HB2 MET A 19 7.580 22.044 -20.896 1.00 0.00 H new ATOM 0 HB3 MET A 19 8.295 21.458 -19.407 1.00 0.00 H new ATOM 0 HG2 MET A 19 8.764 19.269 -20.465 1.00 0.00 H new ATOM 0 HG3 MET A 19 7.988 19.798 -21.945 1.00 0.00 H new ATOM 0 HE1 MET A 19 10.983 22.199 -19.928 1.00 0.00 H new ATOM 0 HE2 MET A 19 10.386 20.644 -19.301 1.00 0.00 H new ATOM 0 HE3 MET A 19 11.968 20.728 -20.111 1.00 0.00 H new ATOM 302 N LEU A 20 6.665 19.559 -17.657 1.00 0.00 N ATOM 303 CA LEU A 20 6.817 18.467 -16.710 1.00 0.00 C ATOM 304 C LEU A 20 5.532 17.659 -16.611 1.00 0.00 C ATOM 305 O LEU A 20 5.587 16.444 -16.418 1.00 0.00 O ATOM 306 CB LEU A 20 7.201 19.034 -15.338 1.00 0.00 C ATOM 307 CG LEU A 20 8.677 18.812 -14.988 1.00 0.00 C ATOM 308 CD1 LEU A 20 8.928 17.329 -14.716 1.00 0.00 C ATOM 309 CD2 LEU A 20 9.607 19.313 -16.090 1.00 0.00 C ATOM 0 H LEU A 20 6.616 20.485 -17.231 1.00 0.00 H new ATOM 0 HA LEU A 20 7.606 17.801 -17.058 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.986 20.102 -15.320 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.578 18.571 -14.573 1.00 0.00 H new ATOM 0 HG LEU A 20 8.897 19.390 -14.090 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.978 17.177 -14.468 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.307 17.002 -13.882 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.678 16.749 -15.604 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.643 19.136 -15.800 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.393 18.780 -17.017 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.450 20.381 -16.241 1.00 0.00 H new ATOM 321 N GLU A 21 4.374 18.309 -16.745 1.00 0.00 N ATOM 322 CA GLU A 21 3.105 17.594 -16.724 1.00 0.00 C ATOM 323 C GLU A 21 2.881 16.865 -18.048 1.00 0.00 C ATOM 324 O GLU A 21 2.110 15.907 -18.102 1.00 0.00 O ATOM 325 CB GLU A 21 1.958 18.567 -16.433 1.00 0.00 C ATOM 326 CG GLU A 21 2.105 19.201 -15.049 1.00 0.00 C ATOM 327 CD GLU A 21 0.884 20.056 -14.715 1.00 0.00 C ATOM 328 OE1 GLU A 21 0.036 19.571 -13.933 1.00 0.00 O ATOM 329 OE2 GLU A 21 0.807 21.188 -15.246 1.00 0.00 O ATOM 0 H GLU A 21 4.293 19.318 -16.868 1.00 0.00 H new ATOM 0 HA GLU A 21 3.133 16.848 -15.930 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.939 19.348 -17.193 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.006 18.039 -16.494 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.226 18.421 -14.297 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.005 19.815 -15.019 1.00 0.00 H new ATOM 336 N ASP A 22 3.545 17.306 -19.120 1.00 0.00 N ATOM 337 CA ASP A 22 3.388 16.698 -20.432 1.00 0.00 C ATOM 338 C ASP A 22 4.209 15.416 -20.553 1.00 0.00 C ATOM 339 O ASP A 22 3.740 14.452 -21.154 1.00 0.00 O ATOM 340 CB ASP A 22 3.793 17.715 -21.501 1.00 0.00 C ATOM 341 CG ASP A 22 3.571 17.157 -22.905 1.00 0.00 C ATOM 342 OD1 ASP A 22 4.585 16.889 -23.590 1.00 0.00 O ATOM 343 OD2 ASP A 22 2.390 17.004 -23.286 1.00 0.00 O ATOM 0 H ASP A 22 4.200 18.088 -19.098 1.00 0.00 H new ATOM 0 HA ASP A 22 2.344 16.419 -20.574 1.00 0.00 H new ATOM 0 HB2 ASP A 22 3.214 18.630 -21.374 1.00 0.00 H new ATOM 0 HB3 ASP A 22 4.842 17.982 -21.374 1.00 0.00 H new ATOM 348 N PHE A 23 5.424 15.379 -19.993 1.00 0.00 N ATOM 349 CA PHE A 23 6.241 14.176 -20.067 1.00 0.00 C ATOM 350 C PHE A 23 5.778 13.128 -19.057 1.00 0.00 C ATOM 351 O PHE A 23 6.033 11.939 -19.253 1.00 0.00 O ATOM 352 CB PHE A 23 7.716 14.529 -19.876 1.00 0.00 C ATOM 353 CG PHE A 23 8.361 15.050 -21.140 1.00 0.00 C ATOM 354 CD1 PHE A 23 8.604 14.171 -22.203 1.00 0.00 C ATOM 355 CD2 PHE A 23 8.715 16.400 -21.256 1.00 0.00 C ATOM 356 CE1 PHE A 23 9.190 14.640 -23.387 1.00 0.00 C ATOM 357 CE2 PHE A 23 9.295 16.874 -22.444 1.00 0.00 C ATOM 358 CZ PHE A 23 9.536 15.994 -23.507 1.00 0.00 C ATOM 0 H PHE A 23 5.852 16.158 -19.493 1.00 0.00 H new ATOM 0 HA PHE A 23 6.122 13.737 -21.058 1.00 0.00 H new ATOM 0 HB2 PHE A 23 7.807 15.280 -19.091 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.256 13.645 -19.536 1.00 0.00 H new ATOM 0 HD1 PHE A 23 8.339 13.128 -22.110 1.00 0.00 H new ATOM 0 HD2 PHE A 23 8.542 17.076 -20.432 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.375 13.960 -24.205 1.00 0.00 H new ATOM 0 HE2 PHE A 23 9.555 17.918 -22.538 1.00 0.00 H new ATOM 0 HZ PHE A 23 9.988 16.358 -24.418 1.00 0.00 H new ATOM 368 N LEU A 24 5.099 13.538 -17.979 1.00 0.00 N ATOM 369 CA LEU A 24 4.529 12.573 -17.049 1.00 0.00 C ATOM 370 C LEU A 24 3.257 11.971 -17.640 1.00 0.00 C ATOM 371 O LEU A 24 2.819 10.918 -17.191 1.00 0.00 O ATOM 372 CB LEU A 24 4.260 13.248 -15.702 1.00 0.00 C ATOM 373 CG LEU A 24 5.559 13.597 -14.969 1.00 0.00 C ATOM 374 CD1 LEU A 24 5.223 14.390 -13.709 1.00 0.00 C ATOM 375 CD2 LEU A 24 6.330 12.343 -14.549 1.00 0.00 C ATOM 0 H LEU A 24 4.936 14.515 -17.737 1.00 0.00 H new ATOM 0 HA LEU A 24 5.236 11.761 -16.882 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.677 14.156 -15.861 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.658 12.587 -15.079 1.00 0.00 H new ATOM 0 HG LEU A 24 6.180 14.177 -15.652 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.143 14.642 -13.182 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.700 15.306 -13.984 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.586 13.789 -13.060 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.245 12.634 -14.032 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.712 11.742 -13.882 1.00 0.00 H new ATOM 0 HD23 LEU A 24 6.583 11.758 -15.433 1.00 0.00 H new ATOM 387 N GLU A 25 2.658 12.625 -18.642 1.00 0.00 N ATOM 388 CA GLU A 25 1.504 12.072 -19.330 1.00 0.00 C ATOM 389 C GLU A 25 1.958 11.050 -20.378 1.00 0.00 C ATOM 390 O GLU A 25 1.221 10.116 -20.694 1.00 0.00 O ATOM 391 CB GLU A 25 0.712 13.218 -19.966 1.00 0.00 C ATOM 392 CG GLU A 25 -0.622 12.748 -20.555 1.00 0.00 C ATOM 393 CD GLU A 25 -1.553 12.201 -19.474 1.00 0.00 C ATOM 394 OE1 GLU A 25 -1.779 10.970 -19.469 1.00 0.00 O ATOM 395 OE2 GLU A 25 -2.033 13.017 -18.656 1.00 0.00 O ATOM 0 H GLU A 25 2.959 13.536 -18.988 1.00 0.00 H new ATOM 0 HA GLU A 25 0.857 11.551 -18.624 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.525 13.987 -19.216 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.311 13.678 -20.752 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -1.107 13.579 -21.067 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.439 11.976 -21.302 1.00 0.00 H new ATOM 402 N VAL A 26 3.172 11.212 -20.916 1.00 0.00 N ATOM 403 CA VAL A 26 3.739 10.270 -21.879 1.00 0.00 C ATOM 404 C VAL A 26 4.256 9.024 -21.161 1.00 0.00 C ATOM 405 O VAL A 26 4.362 7.958 -21.763 1.00 0.00 O ATOM 406 CB VAL A 26 4.851 10.973 -22.670 1.00 0.00 C ATOM 407 CG1 VAL A 26 5.597 10.005 -23.588 1.00 0.00 C ATOM 408 CG2 VAL A 26 4.252 12.072 -23.549 1.00 0.00 C ATOM 0 H VAL A 26 3.784 11.997 -20.695 1.00 0.00 H new ATOM 0 HA VAL A 26 2.970 9.943 -22.578 1.00 0.00 H new ATOM 0 HB VAL A 26 5.546 11.386 -21.939 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.375 10.543 -24.129 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.051 9.214 -22.991 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.898 9.566 -24.300 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.048 12.566 -24.107 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.539 11.632 -24.246 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.742 12.802 -22.921 1.00 0.00 H new ATOM 418 N LEU A 27 4.574 9.153 -19.870 1.00 0.00 N ATOM 419 CA LEU A 27 5.031 8.035 -19.054 1.00 0.00 C ATOM 420 C LEU A 27 3.869 7.364 -18.321 1.00 0.00 C ATOM 421 O LEU A 27 4.099 6.506 -17.471 1.00 0.00 O ATOM 422 CB LEU A 27 6.106 8.518 -18.072 1.00 0.00 C ATOM 423 CG LEU A 27 7.393 8.977 -18.765 1.00 0.00 C ATOM 424 CD1 LEU A 27 8.356 9.516 -17.711 1.00 0.00 C ATOM 425 CD2 LEU A 27 8.071 7.822 -19.501 1.00 0.00 C ATOM 0 H LEU A 27 4.520 10.038 -19.365 1.00 0.00 H new ATOM 0 HA LEU A 27 5.468 7.282 -19.710 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.706 9.342 -17.481 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.343 7.712 -17.377 1.00 0.00 H new ATOM 0 HG LEU A 27 7.135 9.748 -19.491 1.00 0.00 H new ATOM 0 HD11 LEU A 27 9.276 9.846 -18.193 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.896 10.358 -17.194 1.00 0.00 H new ATOM 0 HD13 LEU A 27 8.585 8.730 -16.992 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.981 8.181 -19.982 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.323 7.035 -18.790 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.394 7.425 -20.257 1.00 0.00 H new ATOM 437 N ASP A 28 2.624 7.749 -18.636 1.00 0.00 N ATOM 438 CA ASP A 28 1.434 7.232 -17.969 1.00 0.00 C ATOM 439 C ASP A 28 1.544 7.361 -16.446 1.00 0.00 C ATOM 440 O ASP A 28 1.003 6.550 -15.694 1.00 0.00 O ATOM 441 CB ASP A 28 1.143 5.811 -18.455 1.00 0.00 C ATOM 442 CG ASP A 28 -0.228 5.316 -17.994 1.00 0.00 C ATOM 443 OD1 ASP A 28 -1.201 6.086 -18.147 1.00 0.00 O ATOM 444 OD2 ASP A 28 -0.294 4.172 -17.491 1.00 0.00 O ATOM 0 H ASP A 28 2.420 8.432 -19.366 1.00 0.00 H new ATOM 0 HA ASP A 28 0.570 7.839 -18.240 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.191 5.784 -19.544 1.00 0.00 H new ATOM 0 HB3 ASP A 28 1.915 5.136 -18.085 1.00 0.00 H new ATOM 449 N LYS A 29 2.257 8.394 -15.992 1.00 0.00 N ATOM 450 CA LYS A 29 2.521 8.660 -14.587 1.00 0.00 C ATOM 451 C LYS A 29 1.371 9.458 -13.976 1.00 0.00 C ATOM 452 O LYS A 29 0.592 10.074 -14.701 1.00 0.00 O ATOM 453 CB LYS A 29 3.844 9.426 -14.489 1.00 0.00 C ATOM 454 CG LYS A 29 4.830 8.773 -13.522 1.00 0.00 C ATOM 455 CD LYS A 29 4.295 8.775 -12.092 1.00 0.00 C ATOM 456 CE LYS A 29 5.398 8.348 -11.127 1.00 0.00 C ATOM 457 NZ LYS A 29 5.884 6.986 -11.426 1.00 0.00 N ATOM 0 H LYS A 29 2.676 9.085 -16.614 1.00 0.00 H new ATOM 0 HA LYS A 29 2.600 7.727 -14.029 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.298 9.488 -15.478 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.645 10.447 -14.165 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.026 7.748 -13.837 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.781 9.304 -13.557 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.935 9.770 -11.830 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.445 8.097 -12.011 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.228 9.052 -11.187 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.022 8.385 -10.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.179 6.521 -10.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.122 6.435 -11.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.694 7.041 -12.075 1.00 0.00 H new ATOM 471 N THR A 30 1.261 9.454 -12.646 1.00 0.00 N ATOM 472 CA THR A 30 0.232 10.213 -11.946 1.00 0.00 C ATOM 473 C THR A 30 0.852 11.414 -11.231 1.00 0.00 C ATOM 474 O THR A 30 1.401 11.260 -10.141 1.00 0.00 O ATOM 475 CB THR A 30 -0.503 9.290 -10.969 1.00 0.00 C ATOM 476 OG1 THR A 30 -1.102 8.230 -11.686 1.00 0.00 O ATOM 477 CG2 THR A 30 -1.607 10.049 -10.231 1.00 0.00 C ATOM 0 H THR A 30 1.880 8.927 -12.030 1.00 0.00 H new ATOM 0 HA THR A 30 -0.492 10.600 -12.663 1.00 0.00 H new ATOM 0 HB THR A 30 0.221 8.911 -10.248 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.571 7.637 -11.062 1.00 0.00 H new ATOM 0 HG21 THR A 30 -2.115 9.374 -9.543 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.169 10.875 -9.671 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.325 10.440 -10.952 1.00 0.00 H new ATOM 485 N PRO A 31 0.780 12.616 -11.818 1.00 0.00 N ATOM 486 CA PRO A 31 1.244 13.834 -11.180 1.00 0.00 C ATOM 487 C PRO A 31 0.296 14.198 -10.040 1.00 0.00 C ATOM 488 O PRO A 31 -0.853 13.755 -10.025 1.00 0.00 O ATOM 489 CB PRO A 31 1.250 14.894 -12.283 1.00 0.00 C ATOM 490 CG PRO A 31 0.124 14.425 -13.199 1.00 0.00 C ATOM 491 CD PRO A 31 0.232 12.905 -13.131 1.00 0.00 C ATOM 0 HA PRO A 31 2.237 13.736 -10.741 1.00 0.00 H new ATOM 0 HB2 PRO A 31 1.062 15.892 -11.887 1.00 0.00 H new ATOM 0 HB3 PRO A 31 2.207 14.932 -12.803 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.849 14.776 -12.854 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.253 14.793 -14.217 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -0.743 12.436 -13.262 1.00 0.00 H new ATOM 0 HD3 PRO A 31 0.879 12.521 -13.920 1.00 0.00 H new ATOM 499 N VAL A 32 0.770 15.003 -9.084 1.00 0.00 N ATOM 500 CA VAL A 32 -0.029 15.346 -7.908 1.00 0.00 C ATOM 501 C VAL A 32 -0.117 16.850 -7.666 1.00 0.00 C ATOM 502 O VAL A 32 -0.915 17.284 -6.839 1.00 0.00 O ATOM 503 CB VAL A 32 0.524 14.634 -6.671 1.00 0.00 C ATOM 504 CG1 VAL A 32 0.461 13.119 -6.857 1.00 0.00 C ATOM 505 CG2 VAL A 32 1.975 15.034 -6.394 1.00 0.00 C ATOM 0 H VAL A 32 1.698 15.426 -9.103 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.045 15.004 -8.103 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.093 14.934 -5.824 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.858 12.627 -5.969 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.574 12.814 -7.009 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.055 12.834 -7.726 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.334 14.509 -5.509 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.595 14.769 -7.250 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.030 16.109 -6.226 1.00 0.00 H new ATOM 515 N GLY A 33 0.691 17.652 -8.365 1.00 0.00 N ATOM 516 CA GLY A 33 0.616 19.100 -8.228 1.00 0.00 C ATOM 517 C GLY A 33 1.843 19.799 -8.798 1.00 0.00 C ATOM 518 O GLY A 33 2.817 19.151 -9.183 1.00 0.00 O ATOM 0 H GLY A 33 1.396 17.323 -9.024 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.276 19.465 -8.737 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.510 19.358 -7.174 1.00 0.00 H new ATOM 522 N THR A 34 1.775 21.130 -8.843 1.00 0.00 N ATOM 523 CA THR A 34 2.871 21.987 -9.276 1.00 0.00 C ATOM 524 C THR A 34 3.017 23.136 -8.283 1.00 0.00 C ATOM 525 O THR A 34 2.021 23.644 -7.767 1.00 0.00 O ATOM 526 CB THR A 34 2.611 22.536 -10.682 1.00 0.00 C ATOM 527 OG1 THR A 34 1.389 23.241 -10.700 1.00 0.00 O ATOM 528 CG2 THR A 34 2.541 21.421 -11.722 1.00 0.00 C ATOM 0 H THR A 34 0.939 21.649 -8.574 1.00 0.00 H new ATOM 0 HA THR A 34 3.791 21.404 -9.309 1.00 0.00 H new ATOM 0 HB THR A 34 3.442 23.196 -10.933 1.00 0.00 H new ATOM 0 HG1 THR A 34 1.227 23.592 -11.601 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.355 21.852 -12.706 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.486 20.877 -11.737 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.732 20.736 -11.467 1.00 0.00 H new ATOM 536 N VAL A 35 4.258 23.548 -8.016 1.00 0.00 N ATOM 537 CA VAL A 35 4.539 24.664 -7.121 1.00 0.00 C ATOM 538 C VAL A 35 5.690 25.497 -7.683 1.00 0.00 C ATOM 539 O VAL A 35 6.656 24.945 -8.210 1.00 0.00 O ATOM 540 CB VAL A 35 4.847 24.165 -5.703 1.00 0.00 C ATOM 541 CG1 VAL A 35 3.612 23.519 -5.070 1.00 0.00 C ATOM 542 CG2 VAL A 35 5.977 23.136 -5.687 1.00 0.00 C ATOM 0 H VAL A 35 5.092 23.117 -8.415 1.00 0.00 H new ATOM 0 HA VAL A 35 3.655 25.298 -7.054 1.00 0.00 H new ATOM 0 HB VAL A 35 5.153 25.042 -5.133 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.857 23.174 -4.066 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.806 24.251 -5.016 1.00 0.00 H new ATOM 0 HG13 VAL A 35 3.293 22.672 -5.677 1.00 0.00 H new ATOM 0 HG21 VAL A 35 6.159 22.812 -4.662 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.695 22.276 -6.295 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.884 23.585 -6.092 1.00 0.00 H new ATOM 552 N ASP A 36 5.577 26.822 -7.565 1.00 0.00 N ATOM 553 CA ASP A 36 6.556 27.741 -8.130 1.00 0.00 C ATOM 554 C ASP A 36 7.644 28.111 -7.124 1.00 0.00 C ATOM 555 O ASP A 36 8.534 28.904 -7.434 1.00 0.00 O ATOM 556 CB ASP A 36 5.852 28.979 -8.692 1.00 0.00 C ATOM 557 CG ASP A 36 5.309 29.881 -7.585 1.00 0.00 C ATOM 558 OD1 ASP A 36 5.722 31.063 -7.557 1.00 0.00 O ATOM 559 OD2 ASP A 36 4.489 29.387 -6.782 1.00 0.00 O ATOM 0 H ASP A 36 4.808 27.282 -7.078 1.00 0.00 H new ATOM 0 HA ASP A 36 7.063 27.234 -8.951 1.00 0.00 H new ATOM 0 HB2 ASP A 36 6.550 29.544 -9.310 1.00 0.00 H new ATOM 0 HB3 ASP A 36 5.033 28.667 -9.340 1.00 0.00 H new ATOM 564 N THR A 37 7.583 27.545 -5.915 1.00 0.00 N ATOM 565 CA THR A 37 8.571 27.788 -4.871 1.00 0.00 C ATOM 566 C THR A 37 8.862 26.494 -4.122 1.00 0.00 C ATOM 567 O THR A 37 8.040 25.576 -4.112 1.00 0.00 O ATOM 568 CB THR A 37 8.084 28.859 -3.887 1.00 0.00 C ATOM 569 OG1 THR A 37 6.883 28.443 -3.279 1.00 0.00 O ATOM 570 CG2 THR A 37 7.864 30.205 -4.574 1.00 0.00 C ATOM 0 H THR A 37 6.841 26.903 -5.636 1.00 0.00 H new ATOM 0 HA THR A 37 9.484 28.149 -5.345 1.00 0.00 H new ATOM 0 HB THR A 37 8.860 28.987 -3.133 1.00 0.00 H new ATOM 0 HG1 THR A 37 6.579 29.131 -2.651 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.519 30.935 -3.842 1.00 0.00 H new ATOM 0 HG22 THR A 37 8.801 30.546 -5.014 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.114 30.095 -5.358 1.00 0.00 H new ATOM 578 N VAL A 38 10.032 26.415 -3.485 1.00 0.00 N ATOM 579 CA VAL A 38 10.414 25.235 -2.725 1.00 0.00 C ATOM 580 C VAL A 38 9.681 25.192 -1.387 1.00 0.00 C ATOM 581 O VAL A 38 9.534 24.123 -0.802 1.00 0.00 O ATOM 582 CB VAL A 38 11.932 25.197 -2.530 1.00 0.00 C ATOM 583 CG1 VAL A 38 12.629 25.069 -3.885 1.00 0.00 C ATOM 584 CG2 VAL A 38 12.443 26.457 -1.826 1.00 0.00 C ATOM 0 H VAL A 38 10.729 27.159 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 38 10.123 24.348 -3.288 1.00 0.00 H new ATOM 0 HB VAL A 38 12.160 24.334 -1.905 1.00 0.00 H new ATOM 0 HG11 VAL A 38 13.709 25.043 -3.738 1.00 0.00 H new ATOM 0 HG12 VAL A 38 12.307 24.150 -4.374 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.369 25.923 -4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.524 26.393 -1.705 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.196 27.334 -2.424 1.00 0.00 H new ATOM 0 HG23 VAL A 38 11.973 26.542 -0.846 1.00 0.00 H new ATOM 594 N ALA A 39 9.218 26.344 -0.893 1.00 0.00 N ATOM 595 CA ALA A 39 8.478 26.398 0.358 1.00 0.00 C ATOM 596 C ALA A 39 7.090 25.785 0.176 1.00 0.00 C ATOM 597 O ALA A 39 6.504 25.279 1.134 1.00 0.00 O ATOM 598 CB ALA A 39 8.379 27.856 0.807 1.00 0.00 C ATOM 0 H ALA A 39 9.346 27.249 -1.345 1.00 0.00 H new ATOM 0 HA ALA A 39 8.997 25.822 1.124 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.826 27.911 1.745 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.381 28.261 0.952 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.860 28.437 0.045 1.00 0.00 H new ATOM 604 N GLY A 40 6.564 25.825 -1.052 1.00 0.00 N ATOM 605 CA GLY A 40 5.283 25.216 -1.372 1.00 0.00 C ATOM 606 C GLY A 40 5.432 23.711 -1.582 1.00 0.00 C ATOM 607 O GLY A 40 4.447 22.980 -1.500 1.00 0.00 O ATOM 0 H GLY A 40 7.017 26.280 -1.845 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.574 25.406 -0.566 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.873 25.674 -2.272 1.00 0.00 H new ATOM 611 N ALA A 41 6.656 23.237 -1.850 1.00 0.00 N ATOM 612 CA ALA A 41 6.903 21.819 -2.073 1.00 0.00 C ATOM 613 C ALA A 41 6.937 21.061 -0.748 1.00 0.00 C ATOM 614 O ALA A 41 6.468 19.926 -0.674 1.00 0.00 O ATOM 615 CB ALA A 41 8.218 21.653 -2.831 1.00 0.00 C ATOM 0 H ALA A 41 7.489 23.823 -1.916 1.00 0.00 H new ATOM 0 HA ALA A 41 6.092 21.400 -2.669 1.00 0.00 H new ATOM 0 HB1 ALA A 41 8.409 20.593 -3.001 1.00 0.00 H new ATOM 0 HB2 ALA A 41 8.153 22.168 -3.789 1.00 0.00 H new ATOM 0 HB3 ALA A 41 9.032 22.079 -2.245 1.00 0.00 H new ATOM 621 N LEU A 42 7.487 21.680 0.300 1.00 0.00 N ATOM 622 CA LEU A 42 7.532 21.049 1.612 1.00 0.00 C ATOM 623 C LEU A 42 6.181 21.188 2.309 1.00 0.00 C ATOM 624 O LEU A 42 5.805 20.325 3.101 1.00 0.00 O ATOM 625 CB LEU A 42 8.656 21.665 2.454 1.00 0.00 C ATOM 626 CG LEU A 42 10.040 21.048 2.205 1.00 0.00 C ATOM 627 CD1 LEU A 42 10.087 19.592 2.670 1.00 0.00 C ATOM 628 CD2 LEU A 42 10.450 21.098 0.732 1.00 0.00 C ATOM 0 H LEU A 42 7.903 22.610 0.262 1.00 0.00 H new ATOM 0 HA LEU A 42 7.742 19.986 1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.705 22.734 2.248 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.406 21.555 3.509 1.00 0.00 H new ATOM 0 HG LEU A 42 10.741 21.650 2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.079 19.182 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.872 19.544 3.737 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.344 19.011 2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.436 20.649 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.725 20.546 0.134 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.481 22.135 0.398 1.00 0.00 H new ATOM 640 N ALA A 43 5.443 22.263 2.026 1.00 0.00 N ATOM 641 CA ALA A 43 4.136 22.461 2.636 1.00 0.00 C ATOM 642 C ALA A 43 3.091 21.527 2.024 1.00 0.00 C ATOM 643 O ALA A 43 2.097 21.201 2.670 1.00 0.00 O ATOM 644 CB ALA A 43 3.726 23.924 2.468 1.00 0.00 C ATOM 0 H ALA A 43 5.729 23.002 1.383 1.00 0.00 H new ATOM 0 HA ALA A 43 4.197 22.221 3.697 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.748 24.082 2.922 1.00 0.00 H new ATOM 0 HB2 ALA A 43 4.460 24.566 2.955 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.677 24.169 1.407 1.00 0.00 H new ATOM 650 N ARG A 44 3.311 21.099 0.774 1.00 0.00 N ATOM 651 CA ARG A 44 2.397 20.208 0.077 1.00 0.00 C ATOM 652 C ARG A 44 2.706 18.739 0.364 1.00 0.00 C ATOM 653 O ARG A 44 1.809 17.901 0.295 1.00 0.00 O ATOM 654 CB ARG A 44 2.449 20.521 -1.421 1.00 0.00 C ATOM 655 CG ARG A 44 1.356 19.769 -2.184 1.00 0.00 C ATOM 656 CD ARG A 44 1.394 20.167 -3.659 1.00 0.00 C ATOM 657 NE ARG A 44 0.304 19.536 -4.411 1.00 0.00 N ATOM 658 CZ ARG A 44 -0.919 20.064 -4.538 1.00 0.00 C ATOM 659 NH1 ARG A 44 -1.230 21.218 -3.956 1.00 0.00 N ATOM 660 NH2 ARG A 44 -1.840 19.431 -5.257 1.00 0.00 N ATOM 0 H ARG A 44 4.129 21.365 0.225 1.00 0.00 H new ATOM 0 HA ARG A 44 1.384 20.377 0.442 1.00 0.00 H new ATOM 0 HB2 ARG A 44 2.331 21.594 -1.575 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.427 20.248 -1.818 1.00 0.00 H new ATOM 0 HG2 ARG A 44 1.502 18.694 -2.083 1.00 0.00 H new ATOM 0 HG3 ARG A 44 0.379 19.999 -1.760 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.319 21.251 -3.747 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.352 19.877 -4.091 1.00 0.00 H new ATOM 0 HE ARG A 44 0.489 18.641 -4.864 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.532 21.715 -3.403 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.167 21.607 -4.063 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -1.614 18.546 -5.710 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -2.773 19.831 -5.356 1.00 0.00 H new ATOM 674 N VAL A 45 3.961 18.409 0.689 1.00 0.00 N ATOM 675 CA VAL A 45 4.345 17.016 0.915 1.00 0.00 C ATOM 676 C VAL A 45 4.007 16.563 2.332 1.00 0.00 C ATOM 677 O VAL A 45 3.867 15.365 2.571 1.00 0.00 O ATOM 678 CB VAL A 45 5.828 16.817 0.575 1.00 0.00 C ATOM 679 CG1 VAL A 45 6.734 17.327 1.697 1.00 0.00 C ATOM 680 CG2 VAL A 45 6.131 15.341 0.334 1.00 0.00 C ATOM 0 H VAL A 45 4.720 19.082 0.800 1.00 0.00 H new ATOM 0 HA VAL A 45 3.762 16.381 0.248 1.00 0.00 H new ATOM 0 HB VAL A 45 6.028 17.390 -0.331 1.00 0.00 H new ATOM 0 HG11 VAL A 45 7.777 17.170 1.422 1.00 0.00 H new ATOM 0 HG12 VAL A 45 6.556 18.391 1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 45 6.515 16.784 2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.188 15.221 0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.895 14.770 1.232 1.00 0.00 H new ATOM 0 HG23 VAL A 45 5.527 14.976 -0.497 1.00 0.00 H new ATOM 690 N GLU A 46 3.873 17.499 3.278 1.00 0.00 N ATOM 691 CA GLU A 46 3.467 17.162 4.639 1.00 0.00 C ATOM 692 C GLU A 46 2.000 16.735 4.687 1.00 0.00 C ATOM 693 O GLU A 46 1.556 16.164 5.683 1.00 0.00 O ATOM 694 CB GLU A 46 3.716 18.353 5.568 1.00 0.00 C ATOM 695 CG GLU A 46 5.209 18.520 5.840 1.00 0.00 C ATOM 696 CD GLU A 46 5.474 19.670 6.810 1.00 0.00 C ATOM 697 OE1 GLU A 46 6.025 19.390 7.900 1.00 0.00 O ATOM 698 OE2 GLU A 46 5.122 20.819 6.462 1.00 0.00 O ATOM 0 H GLU A 46 4.040 18.493 3.123 1.00 0.00 H new ATOM 0 HA GLU A 46 4.067 16.318 4.979 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.319 19.262 5.117 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.184 18.205 6.508 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.611 17.594 6.252 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.733 18.705 4.902 1.00 0.00 H new ATOM 705 N ASP A 47 1.242 17.008 3.619 1.00 0.00 N ATOM 706 CA ASP A 47 -0.157 16.615 3.520 1.00 0.00 C ATOM 707 C ASP A 47 -0.278 15.143 3.116 1.00 0.00 C ATOM 708 O ASP A 47 -1.364 14.561 3.199 1.00 0.00 O ATOM 709 CB ASP A 47 -0.861 17.534 2.521 1.00 0.00 C ATOM 710 CG ASP A 47 -2.368 17.279 2.487 1.00 0.00 C ATOM 711 OD1 ASP A 47 -2.864 16.885 1.406 1.00 0.00 O ATOM 712 OD2 ASP A 47 -3.013 17.482 3.542 1.00 0.00 O ATOM 0 H ASP A 47 1.588 17.509 2.800 1.00 0.00 H new ATOM 0 HA ASP A 47 -0.639 16.719 4.492 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -0.673 18.574 2.788 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -0.443 17.380 1.526 1.00 0.00 H new ATOM 717 N GLY A 48 0.828 14.533 2.674 1.00 0.00 N ATOM 718 CA GLY A 48 0.851 13.146 2.236 1.00 0.00 C ATOM 719 C GLY A 48 0.335 12.998 0.808 1.00 0.00 C ATOM 720 O GLY A 48 0.053 13.990 0.137 1.00 0.00 O ATOM 0 H GLY A 48 1.734 14.997 2.613 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.869 12.762 2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.241 12.542 2.908 1.00 0.00 H new ATOM 724 N GLY A 49 0.212 11.752 0.342 1.00 0.00 N ATOM 725 CA GLY A 49 -0.260 11.457 -1.005 1.00 0.00 C ATOM 726 C GLY A 49 0.841 11.632 -2.052 1.00 0.00 C ATOM 727 O GLY A 49 0.560 11.616 -3.249 1.00 0.00 O ATOM 0 H GLY A 49 0.438 10.923 0.891 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.635 10.434 -1.041 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -1.097 12.112 -1.247 1.00 0.00 H new ATOM 731 N ILE A 50 2.092 11.798 -1.608 1.00 0.00 N ATOM 732 CA ILE A 50 3.240 11.998 -2.485 1.00 0.00 C ATOM 733 C ILE A 50 4.376 11.091 -2.022 1.00 0.00 C ATOM 734 O ILE A 50 4.479 10.802 -0.830 1.00 0.00 O ATOM 735 CB ILE A 50 3.660 13.476 -2.457 1.00 0.00 C ATOM 736 CG1 ILE A 50 2.437 14.374 -2.694 1.00 0.00 C ATOM 737 CG2 ILE A 50 4.743 13.738 -3.509 1.00 0.00 C ATOM 738 CD1 ILE A 50 2.802 15.853 -2.841 1.00 0.00 C ATOM 0 H ILE A 50 2.333 11.796 -0.617 1.00 0.00 H new ATOM 0 HA ILE A 50 2.983 11.742 -3.513 1.00 0.00 H new ATOM 0 HB ILE A 50 4.074 13.711 -1.477 1.00 0.00 H new ATOM 0 HG12 ILE A 50 1.918 14.042 -3.593 1.00 0.00 H new ATOM 0 HG13 ILE A 50 1.741 14.258 -1.863 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.032 14.788 -3.480 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.613 13.116 -3.298 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.355 13.496 -4.499 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.896 16.437 -3.006 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.295 16.198 -1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.475 15.979 -3.689 1.00 0.00 H new ATOM 750 N ASP A 51 5.232 10.633 -2.944 1.00 0.00 N ATOM 751 CA ASP A 51 6.321 9.729 -2.590 1.00 0.00 C ATOM 752 C ASP A 51 7.675 10.188 -3.124 1.00 0.00 C ATOM 753 O ASP A 51 8.701 9.650 -2.719 1.00 0.00 O ATOM 754 CB ASP A 51 5.993 8.329 -3.108 1.00 0.00 C ATOM 755 CG ASP A 51 6.569 7.242 -2.204 1.00 0.00 C ATOM 756 OD1 ASP A 51 6.297 7.302 -0.981 1.00 0.00 O ATOM 757 OD2 ASP A 51 7.276 6.357 -2.733 1.00 0.00 O ATOM 0 H ASP A 51 5.188 10.875 -3.934 1.00 0.00 H new ATOM 0 HA ASP A 51 6.407 9.724 -1.503 1.00 0.00 H new ATOM 0 HB2 ASP A 51 4.912 8.210 -3.176 1.00 0.00 H new ATOM 0 HB3 ASP A 51 6.390 8.212 -4.116 1.00 0.00 H new ATOM 762 N ALA A 52 7.686 11.174 -4.026 1.00 0.00 N ATOM 763 CA ALA A 52 8.914 11.736 -4.565 1.00 0.00 C ATOM 764 C ALA A 52 8.631 13.090 -5.215 1.00 0.00 C ATOM 765 O ALA A 52 7.474 13.463 -5.401 1.00 0.00 O ATOM 766 CB ALA A 52 9.491 10.773 -5.600 1.00 0.00 C ATOM 0 H ALA A 52 6.838 11.601 -4.400 1.00 0.00 H new ATOM 0 HA ALA A 52 9.632 11.881 -3.758 1.00 0.00 H new ATOM 0 HB1 ALA A 52 10.412 11.188 -6.009 1.00 0.00 H new ATOM 0 HB2 ALA A 52 9.703 9.814 -5.127 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.770 10.629 -6.404 1.00 0.00 H new ATOM 772 N ALA A 53 9.687 13.831 -5.559 1.00 0.00 N ATOM 773 CA ALA A 53 9.530 15.114 -6.222 1.00 0.00 C ATOM 774 C ALA A 53 10.692 15.402 -7.171 1.00 0.00 C ATOM 775 O ALA A 53 11.774 14.834 -7.038 1.00 0.00 O ATOM 776 CB ALA A 53 9.410 16.212 -5.164 1.00 0.00 C ATOM 0 H ALA A 53 10.655 13.560 -5.387 1.00 0.00 H new ATOM 0 HA ALA A 53 8.623 15.087 -6.827 1.00 0.00 H new ATOM 0 HB1 ALA A 53 9.292 17.178 -5.654 1.00 0.00 H new ATOM 0 HB2 ALA A 53 8.543 16.017 -4.534 1.00 0.00 H new ATOM 0 HB3 ALA A 53 10.310 16.225 -4.549 1.00 0.00 H new ATOM 782 N ILE A 54 10.457 16.295 -8.135 1.00 0.00 N ATOM 783 CA ILE A 54 11.474 16.752 -9.069 1.00 0.00 C ATOM 784 C ILE A 54 11.794 18.206 -8.746 1.00 0.00 C ATOM 785 O ILE A 54 10.882 19.028 -8.666 1.00 0.00 O ATOM 786 CB ILE A 54 10.985 16.585 -10.516 1.00 0.00 C ATOM 787 CG1 ILE A 54 10.736 15.098 -10.806 1.00 0.00 C ATOM 788 CG2 ILE A 54 12.018 17.165 -11.485 1.00 0.00 C ATOM 789 CD1 ILE A 54 10.165 14.873 -12.207 1.00 0.00 C ATOM 0 H ILE A 54 9.543 16.722 -8.286 1.00 0.00 H new ATOM 0 HA ILE A 54 12.381 16.155 -8.971 1.00 0.00 H new ATOM 0 HB ILE A 54 10.049 17.127 -10.651 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.671 14.548 -10.703 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.046 14.695 -10.065 1.00 0.00 H new ATOM 0 HG21 ILE A 54 11.665 17.043 -12.509 1.00 0.00 H new ATOM 0 HG22 ILE A 54 12.160 18.225 -11.274 1.00 0.00 H new ATOM 0 HG23 ILE A 54 12.966 16.641 -11.363 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.005 13.807 -12.368 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.216 15.401 -12.302 1.00 0.00 H new ATOM 0 HD13 ILE A 54 10.866 15.251 -12.951 1.00 0.00 H new ATOM 801 N LEU A 55 13.077 18.523 -8.558 1.00 0.00 N ATOM 802 CA LEU A 55 13.507 19.841 -8.117 1.00 0.00 C ATOM 803 C LEU A 55 14.294 20.551 -9.213 1.00 0.00 C ATOM 804 O LEU A 55 15.271 20.017 -9.736 1.00 0.00 O ATOM 805 CB LEU A 55 14.375 19.711 -6.857 1.00 0.00 C ATOM 806 CG LEU A 55 13.609 19.554 -5.535 1.00 0.00 C ATOM 807 CD1 LEU A 55 12.875 20.844 -5.177 1.00 0.00 C ATOM 808 CD2 LEU A 55 12.594 18.415 -5.569 1.00 0.00 C ATOM 0 H LEU A 55 13.844 17.868 -8.709 1.00 0.00 H new ATOM 0 HA LEU A 55 12.621 20.433 -7.890 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.033 18.851 -6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 55 15.012 20.592 -6.784 1.00 0.00 H new ATOM 0 HG LEU A 55 14.361 19.321 -4.781 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.340 20.709 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.595 21.655 -5.071 1.00 0.00 H new ATOM 0 HD13 LEU A 55 12.165 21.090 -5.967 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.084 18.353 -4.608 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.863 18.602 -6.356 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.109 17.475 -5.768 1.00 0.00 H new ATOM 820 N ASP A 56 13.866 21.767 -9.558 1.00 0.00 N ATOM 821 CA ASP A 56 14.624 22.642 -10.438 1.00 0.00 C ATOM 822 C ASP A 56 15.758 23.269 -9.622 1.00 0.00 C ATOM 823 O ASP A 56 15.529 23.756 -8.515 1.00 0.00 O ATOM 824 CB ASP A 56 13.672 23.701 -11.009 1.00 0.00 C ATOM 825 CG ASP A 56 14.319 24.638 -12.023 1.00 0.00 C ATOM 826 OD1 ASP A 56 13.576 25.501 -12.543 1.00 0.00 O ATOM 827 OD2 ASP A 56 15.535 24.498 -12.280 1.00 0.00 O ATOM 0 H ASP A 56 12.986 22.167 -9.233 1.00 0.00 H new ATOM 0 HA ASP A 56 15.062 22.098 -11.275 1.00 0.00 H new ATOM 0 HB2 ASP A 56 12.828 23.198 -11.482 1.00 0.00 H new ATOM 0 HB3 ASP A 56 13.270 24.294 -10.187 1.00 0.00 H new ATOM 832 N VAL A 57 16.982 23.261 -10.157 1.00 0.00 N ATOM 833 CA VAL A 57 18.138 23.797 -9.455 1.00 0.00 C ATOM 834 C VAL A 57 18.154 25.320 -9.546 1.00 0.00 C ATOM 835 O VAL A 57 18.898 25.981 -8.821 1.00 0.00 O ATOM 836 CB VAL A 57 19.417 23.156 -10.004 1.00 0.00 C ATOM 837 CG1 VAL A 57 20.670 23.661 -9.289 1.00 0.00 C ATOM 838 CG2 VAL A 57 19.355 21.644 -9.789 1.00 0.00 C ATOM 0 H VAL A 57 17.193 22.885 -11.081 1.00 0.00 H new ATOM 0 HA VAL A 57 18.079 23.548 -8.395 1.00 0.00 H new ATOM 0 HB VAL A 57 19.478 23.419 -11.060 1.00 0.00 H new ATOM 0 HG11 VAL A 57 21.550 23.178 -9.713 1.00 0.00 H new ATOM 0 HG12 VAL A 57 20.751 24.740 -9.416 1.00 0.00 H new ATOM 0 HG13 VAL A 57 20.603 23.425 -8.227 1.00 0.00 H new ATOM 0 HG21 VAL A 57 20.263 21.184 -10.178 1.00 0.00 H new ATOM 0 HG22 VAL A 57 19.268 21.431 -8.723 1.00 0.00 H new ATOM 0 HG23 VAL A 57 18.489 21.237 -10.312 1.00 0.00 H new ATOM 848 N ASN A 58 17.332 25.891 -10.432 1.00 0.00 N ATOM 849 CA ASN A 58 17.171 27.334 -10.522 1.00 0.00 C ATOM 850 C ASN A 58 16.373 27.812 -9.306 1.00 0.00 C ATOM 851 O ASN A 58 15.494 27.098 -8.824 1.00 0.00 O ATOM 852 CB ASN A 58 16.473 27.685 -11.838 1.00 0.00 C ATOM 853 CG ASN A 58 16.446 29.183 -12.110 1.00 0.00 C ATOM 854 OD1 ASN A 58 17.139 29.961 -11.461 1.00 0.00 O ATOM 855 ND2 ASN A 58 15.640 29.600 -13.081 1.00 0.00 N ATOM 0 H ASN A 58 16.767 25.366 -11.099 1.00 0.00 H new ATOM 0 HA ASN A 58 18.138 27.837 -10.518 1.00 0.00 H new ATOM 0 HB2 ASN A 58 16.981 27.180 -12.660 1.00 0.00 H new ATOM 0 HB3 ASN A 58 15.451 27.306 -11.814 1.00 0.00 H new ATOM 0 HD21 ASN A 58 15.584 30.593 -13.306 1.00 0.00 H new ATOM 0 HD22 ASN A 58 15.077 28.927 -13.601 1.00 0.00 H new ATOM 967 N THR A 66 20.208 24.249 -3.947 1.00 0.00 N ATOM 968 CA THR A 66 18.938 23.649 -3.551 1.00 0.00 C ATOM 969 C THR A 66 19.125 22.787 -2.295 1.00 0.00 C ATOM 970 O THR A 66 18.840 21.590 -2.318 1.00 0.00 O ATOM 971 CB THR A 66 18.363 22.835 -4.715 1.00 0.00 C ATOM 972 OG1 THR A 66 18.462 23.571 -5.911 1.00 0.00 O ATOM 973 CG2 THR A 66 16.886 22.515 -4.482 1.00 0.00 C ATOM 0 HA THR A 66 18.225 24.436 -3.305 1.00 0.00 H new ATOM 0 HB THR A 66 18.934 21.909 -4.783 1.00 0.00 H new ATOM 0 HG1 THR A 66 19.288 24.098 -5.904 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.502 21.937 -5.322 1.00 0.00 H new ATOM 0 HG22 THR A 66 16.779 21.936 -3.564 1.00 0.00 H new ATOM 0 HG23 THR A 66 16.322 23.444 -4.393 1.00 0.00 H new ATOM 981 N PRO A 67 19.603 23.377 -1.189 1.00 0.00 N ATOM 982 CA PRO A 67 19.852 22.664 0.054 1.00 0.00 C ATOM 983 C PRO A 67 18.545 22.246 0.729 1.00 0.00 C ATOM 984 O PRO A 67 18.561 21.464 1.679 1.00 0.00 O ATOM 985 CB PRO A 67 20.625 23.656 0.922 1.00 0.00 C ATOM 986 CG PRO A 67 20.105 25.012 0.447 1.00 0.00 C ATOM 987 CD PRO A 67 19.937 24.784 -1.049 1.00 0.00 C ATOM 0 HA PRO A 67 20.407 21.740 -0.111 1.00 0.00 H new ATOM 0 HB2 PRO A 67 20.431 23.499 1.983 1.00 0.00 H new ATOM 0 HB3 PRO A 67 21.701 23.564 0.778 1.00 0.00 H new ATOM 0 HG2 PRO A 67 19.163 25.278 0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 67 20.810 25.816 0.660 1.00 0.00 H new ATOM 0 HD2 PRO A 67 19.149 25.417 -1.457 1.00 0.00 H new ATOM 0 HD3 PRO A 67 20.852 25.026 -1.589 1.00 0.00 H new ATOM 995 N VAL A 68 17.411 22.760 0.246 1.00 0.00 N ATOM 996 CA VAL A 68 16.098 22.430 0.783 1.00 0.00 C ATOM 997 C VAL A 68 15.686 21.012 0.393 1.00 0.00 C ATOM 998 O VAL A 68 14.769 20.445 0.986 1.00 0.00 O ATOM 999 CB VAL A 68 15.065 23.447 0.286 1.00 0.00 C ATOM 1000 CG1 VAL A 68 15.397 24.838 0.821 1.00 0.00 C ATOM 1001 CG2 VAL A 68 15.042 23.489 -1.243 1.00 0.00 C ATOM 0 H VAL A 68 17.383 23.419 -0.532 1.00 0.00 H new ATOM 0 HA VAL A 68 16.147 22.474 1.871 1.00 0.00 H new ATOM 0 HB VAL A 68 14.084 23.140 0.649 1.00 0.00 H new ATOM 0 HG11 VAL A 68 14.656 25.552 0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 68 15.386 24.821 1.911 1.00 0.00 H new ATOM 0 HG13 VAL A 68 16.386 25.135 0.473 1.00 0.00 H new ATOM 0 HG21 VAL A 68 14.302 24.217 -1.576 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.026 23.776 -1.614 1.00 0.00 H new ATOM 0 HG23 VAL A 68 14.781 22.504 -1.630 1.00 0.00 H new ATOM 1011 N ALA A 69 16.357 20.422 -0.603 1.00 0.00 N ATOM 1012 CA ALA A 69 16.068 19.062 -1.017 1.00 0.00 C ATOM 1013 C ALA A 69 16.537 18.081 0.057 1.00 0.00 C ATOM 1014 O ALA A 69 16.034 16.963 0.140 1.00 0.00 O ATOM 1015 CB ALA A 69 16.763 18.795 -2.351 1.00 0.00 C ATOM 0 H ALA A 69 17.103 20.873 -1.132 1.00 0.00 H new ATOM 0 HA ALA A 69 14.994 18.927 -1.145 1.00 0.00 H new ATOM 0 HB1 ALA A 69 16.553 17.775 -2.673 1.00 0.00 H new ATOM 0 HB2 ALA A 69 16.394 19.495 -3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 69 17.839 18.924 -2.233 1.00 0.00 H new ATOM 1021 N GLU A 70 17.497 18.498 0.886 1.00 0.00 N ATOM 1022 CA GLU A 70 18.024 17.657 1.950 1.00 0.00 C ATOM 1023 C GLU A 70 17.048 17.615 3.124 1.00 0.00 C ATOM 1024 O GLU A 70 17.121 16.711 3.954 1.00 0.00 O ATOM 1025 CB GLU A 70 19.387 18.188 2.390 1.00 0.00 C ATOM 1026 CG GLU A 70 20.364 18.173 1.212 1.00 0.00 C ATOM 1027 CD GLU A 70 21.707 18.771 1.618 1.00 0.00 C ATOM 1028 OE1 GLU A 70 22.449 18.082 2.353 1.00 0.00 O ATOM 1029 OE2 GLU A 70 21.989 19.912 1.193 1.00 0.00 O ATOM 0 H GLU A 70 17.925 19.423 0.835 1.00 0.00 H new ATOM 0 HA GLU A 70 18.148 16.639 1.581 1.00 0.00 H new ATOM 0 HB2 GLU A 70 19.284 19.203 2.774 1.00 0.00 H new ATOM 0 HB3 GLU A 70 19.778 17.578 3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 70 20.506 17.150 0.864 1.00 0.00 H new ATOM 0 HG3 GLU A 70 19.946 18.738 0.379 1.00 0.00 H new ATOM 1036 N ALA A 71 16.131 18.584 3.200 1.00 0.00 N ATOM 1037 CA ALA A 71 15.074 18.556 4.195 1.00 0.00 C ATOM 1038 C ALA A 71 13.969 17.612 3.717 1.00 0.00 C ATOM 1039 O ALA A 71 13.292 16.984 4.527 1.00 0.00 O ATOM 1040 CB ALA A 71 14.541 19.974 4.418 1.00 0.00 C ATOM 0 H ALA A 71 16.106 19.394 2.581 1.00 0.00 H new ATOM 0 HA ALA A 71 15.457 18.189 5.147 1.00 0.00 H new ATOM 0 HB1 ALA A 71 13.748 19.951 5.165 1.00 0.00 H new ATOM 0 HB2 ALA A 71 15.350 20.616 4.767 1.00 0.00 H new ATOM 0 HB3 ALA A 71 14.146 20.366 3.481 1.00 0.00 H new ATOM 1046 N LEU A 72 13.785 17.505 2.395 1.00 0.00 N ATOM 1047 CA LEU A 72 12.850 16.549 1.830 1.00 0.00 C ATOM 1048 C LEU A 72 13.399 15.133 2.013 1.00 0.00 C ATOM 1049 O LEU A 72 12.632 14.180 2.146 1.00 0.00 O ATOM 1050 CB LEU A 72 12.632 16.891 0.350 1.00 0.00 C ATOM 1051 CG LEU A 72 11.606 15.974 -0.323 1.00 0.00 C ATOM 1052 CD1 LEU A 72 10.235 16.094 0.336 1.00 0.00 C ATOM 1053 CD2 LEU A 72 11.474 16.368 -1.791 1.00 0.00 C ATOM 0 H LEU A 72 14.276 18.073 1.704 1.00 0.00 H new ATOM 0 HA LEU A 72 11.888 16.598 2.339 1.00 0.00 H new ATOM 0 HB2 LEU A 72 12.299 17.926 0.265 1.00 0.00 H new ATOM 0 HB3 LEU A 72 13.582 16.817 -0.180 1.00 0.00 H new ATOM 0 HG LEU A 72 11.953 14.945 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU A 72 9.531 15.430 -0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 72 10.311 15.815 1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 72 9.883 17.123 0.258 1.00 0.00 H new ATOM 0 HD21 LEU A 72 10.745 15.720 -2.278 1.00 0.00 H new ATOM 0 HD22 LEU A 72 11.142 17.404 -1.861 1.00 0.00 H new ATOM 0 HD23 LEU A 72 12.440 16.262 -2.284 1.00 0.00 H new ATOM 1065 N ALA A 73 14.729 14.990 2.027 1.00 0.00 N ATOM 1066 CA ALA A 73 15.369 13.712 2.288 1.00 0.00 C ATOM 1067 C ALA A 73 15.341 13.390 3.783 1.00 0.00 C ATOM 1068 O ALA A 73 15.470 12.229 4.166 1.00 0.00 O ATOM 1069 CB ALA A 73 16.802 13.749 1.756 1.00 0.00 C ATOM 0 H ALA A 73 15.381 15.756 1.858 1.00 0.00 H new ATOM 0 HA ALA A 73 14.823 12.921 1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 73 17.287 12.792 1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.787 13.938 0.683 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.355 14.544 2.256 1.00 0.00 H new ATOM 1075 N ALA A 74 15.173 14.409 4.635 1.00 0.00 N ATOM 1076 CA ALA A 74 15.016 14.193 6.066 1.00 0.00 C ATOM 1077 C ALA A 74 13.605 13.682 6.362 1.00 0.00 C ATOM 1078 O ALA A 74 13.359 13.117 7.427 1.00 0.00 O ATOM 1079 CB ALA A 74 15.317 15.491 6.814 1.00 0.00 C ATOM 0 H ALA A 74 15.143 15.388 4.352 1.00 0.00 H new ATOM 0 HA ALA A 74 15.721 13.435 6.408 1.00 0.00 H new ATOM 0 HB1 ALA A 74 15.199 15.329 7.885 1.00 0.00 H new ATOM 0 HB2 ALA A 74 16.340 15.803 6.604 1.00 0.00 H new ATOM 0 HB3 ALA A 74 14.626 16.268 6.487 1.00 0.00 H new ATOM 1085 N ARG A 75 12.680 13.877 5.418 1.00 0.00 N ATOM 1086 CA ARG A 75 11.345 13.293 5.469 1.00 0.00 C ATOM 1087 C ARG A 75 11.331 11.931 4.775 1.00 0.00 C ATOM 1088 O ARG A 75 10.263 11.385 4.504 1.00 0.00 O ATOM 1089 CB ARG A 75 10.321 14.250 4.847 1.00 0.00 C ATOM 1090 CG ARG A 75 10.252 15.596 5.579 1.00 0.00 C ATOM 1091 CD ARG A 75 9.904 15.438 7.061 1.00 0.00 C ATOM 1092 NE ARG A 75 8.604 14.779 7.243 1.00 0.00 N ATOM 1093 CZ ARG A 75 8.164 14.307 8.411 1.00 0.00 C ATOM 1094 NH1 ARG A 75 8.901 14.417 9.512 1.00 0.00 N ATOM 1095 NH2 ARG A 75 6.974 13.719 8.484 1.00 0.00 N ATOM 0 H ARG A 75 12.843 14.451 4.591 1.00 0.00 H new ATOM 0 HA ARG A 75 11.067 13.137 6.511 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.578 14.422 3.802 1.00 0.00 H new ATOM 0 HB3 ARG A 75 9.337 13.782 4.861 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.211 16.106 5.486 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.506 16.229 5.099 1.00 0.00 H new ATOM 0 HD2 ARG A 75 10.680 14.856 7.558 1.00 0.00 H new ATOM 0 HD3 ARG A 75 9.886 16.418 7.538 1.00 0.00 H new ATOM 0 HE ARG A 75 8.001 14.676 6.427 1.00 0.00 H new ATOM 0 HH11 ARG A 75 9.816 14.867 9.471 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.552 14.052 10.398 1.00 0.00 H new ATOM 0 HH21 ARG A 75 6.398 13.629 7.647 1.00 0.00 H new ATOM 0 HH22 ARG A 75 6.637 13.358 9.377 1.00 0.00 H new ATOM 1109 N ASP A 76 12.516 11.380 4.487 1.00 0.00 N ATOM 1110 CA ASP A 76 12.697 10.095 3.821 1.00 0.00 C ATOM 1111 C ASP A 76 12.056 10.051 2.430 1.00 0.00 C ATOM 1112 O ASP A 76 11.594 8.999 1.991 1.00 0.00 O ATOM 1113 CB ASP A 76 12.254 8.957 4.749 1.00 0.00 C ATOM 1114 CG ASP A 76 12.693 7.591 4.226 1.00 0.00 C ATOM 1115 OD1 ASP A 76 11.847 6.667 4.232 1.00 0.00 O ATOM 1116 OD2 ASP A 76 13.871 7.476 3.820 1.00 0.00 O ATOM 0 H ASP A 76 13.399 11.834 4.720 1.00 0.00 H new ATOM 0 HA ASP A 76 13.760 9.954 3.624 1.00 0.00 H new ATOM 0 HB2 ASP A 76 12.671 9.116 5.743 1.00 0.00 H new ATOM 0 HB3 ASP A 76 11.169 8.974 4.852 1.00 0.00 H new ATOM 1121 N ILE A 77 12.022 11.192 1.733 1.00 0.00 N ATOM 1122 CA ILE A 77 11.484 11.269 0.381 1.00 0.00 C ATOM 1123 C ILE A 77 12.609 11.602 -0.608 1.00 0.00 C ATOM 1124 O ILE A 77 13.321 12.588 -0.421 1.00 0.00 O ATOM 1125 CB ILE A 77 10.340 12.290 0.337 1.00 0.00 C ATOM 1126 CG1 ILE A 77 9.166 11.735 1.155 1.00 0.00 C ATOM 1127 CG2 ILE A 77 9.904 12.561 -1.105 1.00 0.00 C ATOM 1128 CD1 ILE A 77 7.998 12.713 1.230 1.00 0.00 C ATOM 0 H ILE A 77 12.367 12.082 2.093 1.00 0.00 H new ATOM 0 HA ILE A 77 11.070 10.305 0.085 1.00 0.00 H new ATOM 0 HB ILE A 77 10.678 13.236 0.760 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.826 10.800 0.710 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.507 11.502 2.164 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.092 13.288 -1.109 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.747 12.956 -1.672 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.562 11.633 -1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.193 12.274 1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.328 13.639 1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.637 12.926 0.224 1.00 0.00 H new ATOM 1140 N PRO A 78 12.781 10.790 -1.661 1.00 0.00 N ATOM 1141 CA PRO A 78 13.811 10.969 -2.672 1.00 0.00 C ATOM 1142 C PRO A 78 13.479 12.100 -3.646 1.00 0.00 C ATOM 1143 O PRO A 78 12.326 12.512 -3.783 1.00 0.00 O ATOM 1144 CB PRO A 78 13.884 9.628 -3.401 1.00 0.00 C ATOM 1145 CG PRO A 78 12.439 9.137 -3.329 1.00 0.00 C ATOM 1146 CD PRO A 78 11.997 9.603 -1.945 1.00 0.00 C ATOM 0 HA PRO A 78 14.761 11.252 -2.219 1.00 0.00 H new ATOM 0 HB2 PRO A 78 14.223 9.743 -4.430 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.573 8.938 -2.914 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.824 9.570 -4.118 1.00 0.00 H new ATOM 0 HG3 PRO A 78 12.373 8.054 -3.432 1.00 0.00 H new ATOM 0 HD2 PRO A 78 10.930 9.826 -1.929 1.00 0.00 H new ATOM 0 HD3 PRO A 78 12.172 8.830 -1.197 1.00 0.00 H new ATOM 1154 N PHE A 79 14.513 12.598 -4.328 1.00 0.00 N ATOM 1155 CA PHE A 79 14.383 13.682 -5.291 1.00 0.00 C ATOM 1156 C PHE A 79 15.419 13.552 -6.405 1.00 0.00 C ATOM 1157 O PHE A 79 16.318 12.715 -6.331 1.00 0.00 O ATOM 1158 CB PHE A 79 14.541 15.023 -4.567 1.00 0.00 C ATOM 1159 CG PHE A 79 15.888 15.224 -3.906 1.00 0.00 C ATOM 1160 CD1 PHE A 79 16.027 15.044 -2.522 1.00 0.00 C ATOM 1161 CD2 PHE A 79 17.004 15.595 -4.672 1.00 0.00 C ATOM 1162 CE1 PHE A 79 17.272 15.247 -1.911 1.00 0.00 C ATOM 1163 CE2 PHE A 79 18.250 15.787 -4.061 1.00 0.00 C ATOM 1164 CZ PHE A 79 18.380 15.620 -2.678 1.00 0.00 C ATOM 0 H PHE A 79 15.468 12.255 -4.223 1.00 0.00 H new ATOM 0 HA PHE A 79 13.395 13.630 -5.750 1.00 0.00 H new ATOM 0 HB2 PHE A 79 14.377 15.829 -5.282 1.00 0.00 H new ATOM 0 HB3 PHE A 79 13.762 15.106 -3.809 1.00 0.00 H new ATOM 0 HD1 PHE A 79 15.175 14.749 -1.927 1.00 0.00 H new ATOM 0 HD2 PHE A 79 16.902 15.733 -5.738 1.00 0.00 H new ATOM 0 HE1 PHE A 79 17.376 15.115 -0.844 1.00 0.00 H new ATOM 0 HE2 PHE A 79 19.108 16.063 -4.656 1.00 0.00 H new ATOM 0 HZ PHE A 79 19.337 15.779 -2.203 1.00 0.00 H new ATOM 1174 N VAL A 80 15.288 14.390 -7.436 1.00 0.00 N ATOM 1175 CA VAL A 80 16.222 14.452 -8.554 1.00 0.00 C ATOM 1176 C VAL A 80 16.393 15.910 -8.978 1.00 0.00 C ATOM 1177 O VAL A 80 15.463 16.706 -8.848 1.00 0.00 O ATOM 1178 CB VAL A 80 15.720 13.562 -9.699 1.00 0.00 C ATOM 1179 CG1 VAL A 80 14.341 13.997 -10.189 1.00 0.00 C ATOM 1180 CG2 VAL A 80 16.692 13.575 -10.877 1.00 0.00 C ATOM 0 H VAL A 80 14.517 15.053 -7.515 1.00 0.00 H new ATOM 0 HA VAL A 80 17.201 14.073 -8.260 1.00 0.00 H new ATOM 0 HB VAL A 80 15.650 12.551 -9.298 1.00 0.00 H new ATOM 0 HG11 VAL A 80 14.020 13.343 -11.000 1.00 0.00 H new ATOM 0 HG12 VAL A 80 13.627 13.935 -9.368 1.00 0.00 H new ATOM 0 HG13 VAL A 80 14.390 15.024 -10.550 1.00 0.00 H new ATOM 0 HG21 VAL A 80 16.309 12.935 -11.672 1.00 0.00 H new ATOM 0 HG22 VAL A 80 16.798 14.594 -11.250 1.00 0.00 H new ATOM 0 HG23 VAL A 80 17.664 13.205 -10.551 1.00 0.00 H new ATOM 1190 N PHE A 81 17.578 16.261 -9.486 1.00 0.00 N ATOM 1191 CA PHE A 81 17.883 17.626 -9.890 1.00 0.00 C ATOM 1192 C PHE A 81 17.633 17.835 -11.383 1.00 0.00 C ATOM 1193 O PHE A 81 17.689 16.897 -12.175 1.00 0.00 O ATOM 1194 CB PHE A 81 19.347 17.952 -9.572 1.00 0.00 C ATOM 1195 CG PHE A 81 19.741 18.018 -8.110 1.00 0.00 C ATOM 1196 CD1 PHE A 81 21.036 17.626 -7.736 1.00 0.00 C ATOM 1197 CD2 PHE A 81 18.844 18.475 -7.133 1.00 0.00 C ATOM 1198 CE1 PHE A 81 21.434 17.685 -6.393 1.00 0.00 C ATOM 1199 CE2 PHE A 81 19.243 18.534 -5.789 1.00 0.00 C ATOM 1200 CZ PHE A 81 20.536 18.142 -5.418 1.00 0.00 C ATOM 0 H PHE A 81 18.347 15.605 -9.626 1.00 0.00 H new ATOM 0 HA PHE A 81 17.224 18.292 -9.333 1.00 0.00 H new ATOM 0 HB2 PHE A 81 19.973 17.203 -10.057 1.00 0.00 H new ATOM 0 HB3 PHE A 81 19.586 18.912 -10.030 1.00 0.00 H new ATOM 0 HD1 PHE A 81 21.729 17.277 -8.487 1.00 0.00 H new ATOM 0 HD2 PHE A 81 17.847 18.781 -7.415 1.00 0.00 H new ATOM 0 HE1 PHE A 81 22.430 17.379 -6.110 1.00 0.00 H new ATOM 0 HE2 PHE A 81 18.550 18.883 -5.037 1.00 0.00 H new ATOM 0 HZ PHE A 81 20.840 18.192 -4.383 1.00 0.00 H new ATOM 1210 N ALA A 82 17.359 19.089 -11.760 1.00 0.00 N ATOM 1211 CA ALA A 82 17.256 19.504 -13.149 1.00 0.00 C ATOM 1212 C ALA A 82 17.964 20.844 -13.304 1.00 0.00 C ATOM 1213 O ALA A 82 17.647 21.798 -12.594 1.00 0.00 O ATOM 1214 CB ALA A 82 15.785 19.588 -13.555 1.00 0.00 C ATOM 0 H ALA A 82 17.202 19.847 -11.096 1.00 0.00 H new ATOM 0 HA ALA A 82 17.734 18.778 -13.807 1.00 0.00 H new ATOM 0 HB1 ALA A 82 15.712 19.899 -14.597 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.318 18.610 -13.435 1.00 0.00 H new ATOM 0 HB3 ALA A 82 15.274 20.314 -12.923 1.00 0.00 H new ATOM 1220 N THR A 83 18.923 20.925 -14.229 1.00 0.00 N ATOM 1221 CA THR A 83 19.765 22.107 -14.370 1.00 0.00 C ATOM 1222 C THR A 83 20.308 22.227 -15.792 1.00 0.00 C ATOM 1223 O THR A 83 20.185 21.303 -16.592 1.00 0.00 O ATOM 1224 CB THR A 83 20.914 22.029 -13.359 1.00 0.00 C ATOM 1225 OG1 THR A 83 21.651 23.228 -13.377 1.00 0.00 O ATOM 1226 CG2 THR A 83 21.856 20.861 -13.665 1.00 0.00 C ATOM 0 H THR A 83 19.134 20.180 -14.893 1.00 0.00 H new ATOM 0 HA THR A 83 19.166 22.996 -14.172 1.00 0.00 H new ATOM 0 HB THR A 83 20.475 21.871 -12.374 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.383 23.172 -12.727 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.658 20.838 -12.927 1.00 0.00 H new ATOM 0 HG22 THR A 83 21.299 19.925 -13.626 1.00 0.00 H new ATOM 0 HG23 THR A 83 22.282 20.988 -14.660 1.00 0.00 H new ATOM 1234 N GLY A 84 20.914 23.373 -16.110 1.00 0.00 N ATOM 1235 CA GLY A 84 21.529 23.607 -17.407 1.00 0.00 C ATOM 1236 C GLY A 84 22.449 24.822 -17.342 1.00 0.00 C ATOM 1237 O GLY A 84 22.031 25.900 -16.916 1.00 0.00 O ATOM 0 H GLY A 84 20.989 24.163 -15.470 1.00 0.00 H new ATOM 0 HA2 GLY A 84 22.096 22.728 -17.712 1.00 0.00 H new ATOM 0 HA3 GLY A 84 20.757 23.766 -18.160 1.00 0.00 H new ATOM 1241 N GLY A 85 23.701 24.641 -17.763 1.00 0.00 N ATOM 1242 CA GLY A 85 24.703 25.695 -17.747 1.00 0.00 C ATOM 1243 C GLY A 85 26.098 25.101 -17.570 1.00 0.00 C ATOM 1244 O GLY A 85 26.291 23.896 -17.740 1.00 0.00 O ATOM 0 H GLY A 85 24.046 23.752 -18.126 1.00 0.00 H new ATOM 0 HA2 GLY A 85 24.658 26.262 -18.677 1.00 0.00 H new ATOM 0 HA3 GLY A 85 24.493 26.393 -16.937 1.00 0.00 H new ATOM 1248 N SER A 86 27.069 25.948 -17.227 1.00 0.00 N ATOM 1249 CA SER A 86 28.429 25.504 -16.943 1.00 0.00 C ATOM 1250 C SER A 86 28.487 24.810 -15.584 1.00 0.00 C ATOM 1251 O SER A 86 27.617 25.011 -14.737 1.00 0.00 O ATOM 1252 CB SER A 86 29.377 26.701 -16.983 1.00 0.00 C ATOM 1253 OG SER A 86 29.318 27.326 -18.249 1.00 0.00 O ATOM 0 H SER A 86 26.934 26.955 -17.139 1.00 0.00 H new ATOM 0 HA SER A 86 28.739 24.786 -17.702 1.00 0.00 H new ATOM 0 HB2 SER A 86 29.108 27.414 -16.204 1.00 0.00 H new ATOM 0 HB3 SER A 86 30.396 26.374 -16.777 1.00 0.00 H new ATOM 0 HG SER A 86 29.928 28.093 -18.264 1.00 0.00 H new ATOM 1259 N ASP A 87 29.517 23.988 -15.365 1.00 0.00 N ATOM 1260 CA ASP A 87 29.684 23.256 -14.115 1.00 0.00 C ATOM 1261 C ASP A 87 30.336 24.126 -13.041 1.00 0.00 C ATOM 1262 O ASP A 87 30.405 23.725 -11.881 1.00 0.00 O ATOM 1263 CB ASP A 87 30.508 21.995 -14.375 1.00 0.00 C ATOM 1264 CG ASP A 87 31.923 22.340 -14.831 1.00 0.00 C ATOM 1265 OD1 ASP A 87 32.066 22.758 -16.003 1.00 0.00 O ATOM 1266 OD2 ASP A 87 32.852 22.184 -14.006 1.00 0.00 O ATOM 0 H ASP A 87 30.254 23.814 -16.049 1.00 0.00 H new ATOM 0 HA ASP A 87 28.701 22.971 -13.740 1.00 0.00 H new ATOM 0 HB2 ASP A 87 30.553 21.394 -13.467 1.00 0.00 H new ATOM 0 HB3 ASP A 87 30.017 21.388 -15.135 1.00 0.00 H new ATOM 1271 N ASP A 88 30.812 25.315 -13.418 1.00 0.00 N ATOM 1272 CA ASP A 88 31.504 26.222 -12.511 1.00 0.00 C ATOM 1273 C ASP A 88 30.534 26.964 -11.585 1.00 0.00 C ATOM 1274 O ASP A 88 30.958 27.781 -10.769 1.00 0.00 O ATOM 1275 CB ASP A 88 32.334 27.200 -13.347 1.00 0.00 C ATOM 1276 CG ASP A 88 33.253 28.050 -12.473 1.00 0.00 C ATOM 1277 OD1 ASP A 88 34.072 27.453 -11.737 1.00 0.00 O ATOM 1278 OD2 ASP A 88 33.134 29.292 -12.555 1.00 0.00 O ATOM 0 H ASP A 88 30.725 25.674 -14.369 1.00 0.00 H new ATOM 0 HA ASP A 88 32.158 25.643 -11.859 1.00 0.00 H new ATOM 0 HB2 ASP A 88 32.931 26.645 -14.071 1.00 0.00 H new ATOM 0 HB3 ASP A 88 31.668 27.850 -13.915 1.00 0.00 H new ATOM 1283 N SER A 89 29.231 26.684 -11.711 1.00 0.00 N ATOM 1284 CA SER A 89 28.197 27.322 -10.905 1.00 0.00 C ATOM 1285 C SER A 89 27.340 26.298 -10.160 1.00 0.00 C ATOM 1286 O SER A 89 26.297 26.650 -9.610 1.00 0.00 O ATOM 1287 CB SER A 89 27.341 28.230 -11.790 1.00 0.00 C ATOM 1288 OG SER A 89 26.703 27.464 -12.792 1.00 0.00 O ATOM 0 H SER A 89 28.868 26.004 -12.380 1.00 0.00 H new ATOM 0 HA SER A 89 28.683 27.930 -10.142 1.00 0.00 H new ATOM 0 HB2 SER A 89 26.596 28.745 -11.184 1.00 0.00 H new ATOM 0 HB3 SER A 89 27.964 28.998 -12.249 1.00 0.00 H new ATOM 0 HG SER A 89 26.156 28.051 -13.354 1.00 0.00 H new ATOM 1294 N VAL A 90 27.775 25.035 -10.138 1.00 0.00 N ATOM 1295 CA VAL A 90 27.053 23.961 -9.468 1.00 0.00 C ATOM 1296 C VAL A 90 28.025 23.134 -8.623 1.00 0.00 C ATOM 1297 O VAL A 90 29.199 23.006 -8.974 1.00 0.00 O ATOM 1298 CB VAL A 90 26.313 23.092 -10.495 1.00 0.00 C ATOM 1299 CG1 VAL A 90 25.395 22.102 -9.778 1.00 0.00 C ATOM 1300 CG2 VAL A 90 25.441 23.938 -11.419 1.00 0.00 C ATOM 0 H VAL A 90 28.640 24.733 -10.586 1.00 0.00 H new ATOM 0 HA VAL A 90 26.303 24.388 -8.802 1.00 0.00 H new ATOM 0 HB VAL A 90 27.071 22.572 -11.081 1.00 0.00 H new ATOM 0 HG11 VAL A 90 24.874 21.490 -10.514 1.00 0.00 H new ATOM 0 HG12 VAL A 90 25.989 21.460 -9.128 1.00 0.00 H new ATOM 0 HG13 VAL A 90 24.666 22.649 -9.180 1.00 0.00 H new ATOM 0 HG21 VAL A 90 24.932 23.290 -12.133 1.00 0.00 H new ATOM 0 HG22 VAL A 90 24.701 24.478 -10.828 1.00 0.00 H new ATOM 0 HG23 VAL A 90 26.066 24.651 -11.957 1.00 0.00 H new ATOM 1310 N ASP A 91 27.543 22.573 -7.510 1.00 0.00 N ATOM 1311 CA ASP A 91 28.381 21.852 -6.559 1.00 0.00 C ATOM 1312 C ASP A 91 28.530 20.368 -6.913 1.00 0.00 C ATOM 1313 O ASP A 91 27.735 19.806 -7.669 1.00 0.00 O ATOM 1314 CB ASP A 91 27.807 22.051 -5.156 1.00 0.00 C ATOM 1315 CG ASP A 91 28.670 21.381 -4.093 1.00 0.00 C ATOM 1316 OD1 ASP A 91 28.237 20.318 -3.600 1.00 0.00 O ATOM 1317 OD2 ASP A 91 29.750 21.934 -3.788 1.00 0.00 O ATOM 0 H ASP A 91 26.558 22.608 -7.246 1.00 0.00 H new ATOM 0 HA ASP A 91 29.391 22.259 -6.600 1.00 0.00 H new ATOM 0 HB2 ASP A 91 27.729 23.117 -4.943 1.00 0.00 H new ATOM 0 HB3 ASP A 91 26.797 21.643 -5.115 1.00 0.00 H new ATOM 1322 N SER A 92 29.561 19.725 -6.357 1.00 0.00 N ATOM 1323 CA SER A 92 29.885 18.336 -6.654 1.00 0.00 C ATOM 1324 C SER A 92 28.799 17.365 -6.196 1.00 0.00 C ATOM 1325 O SER A 92 28.787 16.219 -6.640 1.00 0.00 O ATOM 1326 CB SER A 92 31.222 17.979 -6.002 1.00 0.00 C ATOM 1327 OG SER A 92 32.235 18.841 -6.479 1.00 0.00 O ATOM 0 H SER A 92 30.194 20.160 -5.686 1.00 0.00 H new ATOM 0 HA SER A 92 29.954 18.238 -7.737 1.00 0.00 H new ATOM 0 HB2 SER A 92 31.142 18.063 -4.918 1.00 0.00 H new ATOM 0 HB3 SER A 92 31.480 16.943 -6.224 1.00 0.00 H new ATOM 0 HG SER A 92 33.088 18.608 -6.057 1.00 0.00 H new ATOM 1333 N ARG A 93 27.881 17.793 -5.321 1.00 0.00 N ATOM 1334 CA ARG A 93 26.793 16.927 -4.889 1.00 0.00 C ATOM 1335 C ARG A 93 25.697 16.848 -5.946 1.00 0.00 C ATOM 1336 O ARG A 93 24.869 15.941 -5.900 1.00 0.00 O ATOM 1337 CB ARG A 93 26.259 17.376 -3.528 1.00 0.00 C ATOM 1338 CG ARG A 93 27.364 17.262 -2.473 1.00 0.00 C ATOM 1339 CD ARG A 93 26.800 17.483 -1.071 1.00 0.00 C ATOM 1340 NE ARG A 93 26.081 18.761 -0.973 1.00 0.00 N ATOM 1341 CZ ARG A 93 25.070 18.978 -0.130 1.00 0.00 C ATOM 1342 NH1 ARG A 93 24.686 18.029 0.721 1.00 0.00 N ATOM 1343 NH2 ARG A 93 24.432 20.146 -0.131 1.00 0.00 N ATOM 0 H ARG A 93 27.874 18.725 -4.906 1.00 0.00 H new ATOM 0 HA ARG A 93 27.181 15.916 -4.768 1.00 0.00 H new ATOM 0 HB2 ARG A 93 25.905 18.405 -3.588 1.00 0.00 H new ATOM 0 HB3 ARG A 93 25.405 16.762 -3.241 1.00 0.00 H new ATOM 0 HG2 ARG A 93 27.829 16.278 -2.532 1.00 0.00 H new ATOM 0 HG3 ARG A 93 28.144 17.996 -2.676 1.00 0.00 H new ATOM 0 HD2 ARG A 93 26.126 16.665 -0.816 1.00 0.00 H new ATOM 0 HD3 ARG A 93 27.612 17.465 -0.344 1.00 0.00 H new ATOM 0 HE ARG A 93 26.371 19.525 -1.584 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.166 17.129 0.731 1.00 0.00 H new ATOM 0 HH12 ARG A 93 23.912 18.202 1.363 1.00 0.00 H new ATOM 0 HH21 ARG A 93 24.715 20.881 -0.779 1.00 0.00 H new ATOM 0 HH22 ARG A 93 23.660 20.306 0.516 1.00 0.00 H new ATOM 1357 N PHE A 94 25.687 17.781 -6.898 1.00 0.00 N ATOM 1358 CA PHE A 94 24.807 17.686 -8.052 1.00 0.00 C ATOM 1359 C PHE A 94 25.492 16.843 -9.123 1.00 0.00 C ATOM 1360 O PHE A 94 24.821 16.251 -9.967 1.00 0.00 O ATOM 1361 CB PHE A 94 24.510 19.077 -8.614 1.00 0.00 C ATOM 1362 CG PHE A 94 23.854 20.042 -7.651 1.00 0.00 C ATOM 1363 CD1 PHE A 94 24.602 20.622 -6.621 1.00 0.00 C ATOM 1364 CD2 PHE A 94 22.499 20.371 -7.800 1.00 0.00 C ATOM 1365 CE1 PHE A 94 23.996 21.520 -5.732 1.00 0.00 C ATOM 1366 CE2 PHE A 94 21.890 21.266 -6.910 1.00 0.00 C ATOM 1367 CZ PHE A 94 22.641 21.842 -5.877 1.00 0.00 C ATOM 0 H PHE A 94 26.281 18.610 -6.888 1.00 0.00 H new ATOM 0 HA PHE A 94 23.867 17.224 -7.750 1.00 0.00 H new ATOM 0 HB2 PHE A 94 25.445 19.517 -8.961 1.00 0.00 H new ATOM 0 HB3 PHE A 94 23.866 18.967 -9.486 1.00 0.00 H new ATOM 0 HD1 PHE A 94 25.648 20.377 -6.511 1.00 0.00 H new ATOM 0 HD2 PHE A 94 21.923 19.934 -8.602 1.00 0.00 H new ATOM 0 HE1 PHE A 94 24.574 21.964 -4.935 1.00 0.00 H new ATOM 0 HE2 PHE A 94 20.844 21.511 -7.020 1.00 0.00 H new ATOM 0 HZ PHE A 94 22.175 22.535 -5.192 1.00 0.00 H new ATOM 1377 N ARG A 95 26.828 16.789 -9.084 1.00 0.00 N ATOM 1378 CA ARG A 95 27.603 15.976 -10.013 1.00 0.00 C ATOM 1379 C ARG A 95 27.595 14.505 -9.593 1.00 0.00 C ATOM 1380 O ARG A 95 27.938 13.639 -10.395 1.00 0.00 O ATOM 1381 CB ARG A 95 29.040 16.499 -10.084 1.00 0.00 C ATOM 1382 CG ARG A 95 29.093 17.997 -10.394 1.00 0.00 C ATOM 1383 CD ARG A 95 30.558 18.439 -10.453 1.00 0.00 C ATOM 1384 NE ARG A 95 30.684 19.901 -10.529 1.00 0.00 N ATOM 1385 CZ ARG A 95 31.795 20.568 -10.199 1.00 0.00 C ATOM 1386 NH1 ARG A 95 32.878 19.918 -9.777 1.00 0.00 N ATOM 1387 NH2 ARG A 95 31.833 21.894 -10.290 1.00 0.00 N ATOM 0 H ARG A 95 27.394 17.305 -8.411 1.00 0.00 H new ATOM 0 HA ARG A 95 27.145 16.047 -11.000 1.00 0.00 H new ATOM 0 HB2 ARG A 95 29.542 16.308 -9.136 1.00 0.00 H new ATOM 0 HB3 ARG A 95 29.587 15.951 -10.851 1.00 0.00 H new ATOM 0 HG2 ARG A 95 28.598 18.203 -11.343 1.00 0.00 H new ATOM 0 HG3 ARG A 95 28.560 18.560 -9.628 1.00 0.00 H new ATOM 0 HD2 ARG A 95 31.084 18.074 -9.570 1.00 0.00 H new ATOM 0 HD3 ARG A 95 31.039 17.987 -11.320 1.00 0.00 H new ATOM 0 HE ARG A 95 29.879 20.437 -10.852 1.00 0.00 H new ATOM 0 HH11 ARG A 95 32.866 18.901 -9.703 1.00 0.00 H new ATOM 0 HH12 ARG A 95 33.720 20.437 -9.528 1.00 0.00 H new ATOM 0 HH21 ARG A 95 31.012 22.407 -10.613 1.00 0.00 H new ATOM 0 HH22 ARG A 95 32.683 22.398 -10.037 1.00 0.00 H new ATOM 1401 N ASP A 96 27.207 14.221 -8.344 1.00 0.00 N ATOM 1402 CA ASP A 96 27.146 12.859 -7.819 1.00 0.00 C ATOM 1403 C ASP A 96 25.708 12.330 -7.794 1.00 0.00 C ATOM 1404 O ASP A 96 25.496 11.118 -7.828 1.00 0.00 O ATOM 1405 CB ASP A 96 27.762 12.852 -6.421 1.00 0.00 C ATOM 1406 CG ASP A 96 27.808 11.443 -5.831 1.00 0.00 C ATOM 1407 OD1 ASP A 96 28.598 10.625 -6.354 1.00 0.00 O ATOM 1408 OD2 ASP A 96 27.056 11.195 -4.864 1.00 0.00 O ATOM 0 H ASP A 96 26.927 14.934 -7.670 1.00 0.00 H new ATOM 0 HA ASP A 96 27.710 12.193 -8.473 1.00 0.00 H new ATOM 0 HB2 ASP A 96 28.771 13.261 -6.466 1.00 0.00 H new ATOM 0 HB3 ASP A 96 27.184 13.503 -5.765 1.00 0.00 H new ATOM 1413 N ARG A 97 24.719 13.230 -7.735 1.00 0.00 N ATOM 1414 CA ARG A 97 23.308 12.869 -7.784 1.00 0.00 C ATOM 1415 C ARG A 97 22.831 12.868 -9.236 1.00 0.00 C ATOM 1416 O ARG A 97 23.472 13.480 -10.088 1.00 0.00 O ATOM 1417 CB ARG A 97 22.505 13.853 -6.929 1.00 0.00 C ATOM 1418 CG ARG A 97 22.746 13.583 -5.444 1.00 0.00 C ATOM 1419 CD ARG A 97 21.942 14.574 -4.602 1.00 0.00 C ATOM 1420 NE ARG A 97 22.113 14.312 -3.165 1.00 0.00 N ATOM 1421 CZ ARG A 97 21.341 13.487 -2.455 1.00 0.00 C ATOM 1422 NH1 ARG A 97 20.336 12.828 -3.027 1.00 0.00 N ATOM 1423 NH2 ARG A 97 21.574 13.315 -1.156 1.00 0.00 N ATOM 0 H ARG A 97 24.882 14.233 -7.651 1.00 0.00 H new ATOM 0 HA ARG A 97 23.160 11.867 -7.381 1.00 0.00 H new ATOM 0 HB2 ARG A 97 22.794 14.876 -7.171 1.00 0.00 H new ATOM 0 HB3 ARG A 97 21.443 13.759 -7.155 1.00 0.00 H new ATOM 0 HG2 ARG A 97 22.454 12.562 -5.198 1.00 0.00 H new ATOM 0 HG3 ARG A 97 23.808 13.675 -5.216 1.00 0.00 H new ATOM 0 HD2 ARG A 97 22.261 15.591 -4.829 1.00 0.00 H new ATOM 0 HD3 ARG A 97 20.886 14.505 -4.864 1.00 0.00 H new ATOM 0 HE ARG A 97 22.871 14.792 -2.680 1.00 0.00 H new ATOM 0 HH11 ARG A 97 20.147 12.950 -4.022 1.00 0.00 H new ATOM 0 HH12 ARG A 97 19.755 12.201 -2.471 1.00 0.00 H new ATOM 0 HH21 ARG A 97 22.341 13.813 -0.705 1.00 0.00 H new ATOM 0 HH22 ARG A 97 20.985 12.685 -0.611 1.00 0.00 H new ATOM 1437 N PRO A 98 21.713 12.193 -9.542 1.00 0.00 N ATOM 1438 CA PRO A 98 21.148 12.171 -10.879 1.00 0.00 C ATOM 1439 C PRO A 98 20.705 13.573 -11.301 1.00 0.00 C ATOM 1440 O PRO A 98 20.227 14.358 -10.480 1.00 0.00 O ATOM 1441 CB PRO A 98 19.971 11.199 -10.810 1.00 0.00 C ATOM 1442 CG PRO A 98 19.575 11.219 -9.334 1.00 0.00 C ATOM 1443 CD PRO A 98 20.913 11.402 -8.627 1.00 0.00 C ATOM 0 HA PRO A 98 21.874 11.851 -11.626 1.00 0.00 H new ATOM 0 HB2 PRO A 98 19.149 11.519 -11.450 1.00 0.00 H new ATOM 0 HB3 PRO A 98 20.257 10.199 -11.135 1.00 0.00 H new ATOM 0 HG2 PRO A 98 18.885 12.033 -9.111 1.00 0.00 H new ATOM 0 HG3 PRO A 98 19.083 10.294 -9.035 1.00 0.00 H new ATOM 0 HD2 PRO A 98 20.788 11.910 -7.671 1.00 0.00 H new ATOM 0 HD3 PRO A 98 21.385 10.442 -8.419 1.00 0.00 H new ATOM 1451 N VAL A 99 20.867 13.877 -12.592 1.00 0.00 N ATOM 1452 CA VAL A 99 20.564 15.185 -13.160 1.00 0.00 C ATOM 1453 C VAL A 99 19.932 15.043 -14.538 1.00 0.00 C ATOM 1454 O VAL A 99 20.146 14.046 -15.230 1.00 0.00 O ATOM 1455 CB VAL A 99 21.827 16.049 -13.274 1.00 0.00 C ATOM 1456 CG1 VAL A 99 22.365 16.431 -11.899 1.00 0.00 C ATOM 1457 CG2 VAL A 99 22.933 15.331 -14.052 1.00 0.00 C ATOM 0 H VAL A 99 21.218 13.209 -13.278 1.00 0.00 H new ATOM 0 HA VAL A 99 19.860 15.673 -12.486 1.00 0.00 H new ATOM 0 HB VAL A 99 21.536 16.950 -13.813 1.00 0.00 H new ATOM 0 HG11 VAL A 99 23.260 17.043 -12.015 1.00 0.00 H new ATOM 0 HG12 VAL A 99 21.607 16.996 -11.356 1.00 0.00 H new ATOM 0 HG13 VAL A 99 22.613 15.528 -11.342 1.00 0.00 H new ATOM 0 HG21 VAL A 99 23.811 15.974 -14.112 1.00 0.00 H new ATOM 0 HG22 VAL A 99 23.195 14.405 -13.541 1.00 0.00 H new ATOM 0 HG23 VAL A 99 22.581 15.103 -15.058 1.00 0.00 H new ATOM 1467 N LEU A 100 19.147 16.048 -14.933 1.00 0.00 N ATOM 1468 CA LEU A 100 18.570 16.135 -16.264 1.00 0.00 C ATOM 1469 C LEU A 100 18.632 17.590 -16.736 1.00 0.00 C ATOM 1470 O LEU A 100 18.647 18.509 -15.918 1.00 0.00 O ATOM 1471 CB LEU A 100 17.135 15.601 -16.228 1.00 0.00 C ATOM 1472 CG LEU A 100 16.453 15.593 -17.602 1.00 0.00 C ATOM 1473 CD1 LEU A 100 17.228 14.747 -18.613 1.00 0.00 C ATOM 1474 CD2 LEU A 100 15.047 15.012 -17.465 1.00 0.00 C ATOM 0 H LEU A 100 18.895 16.829 -14.327 1.00 0.00 H new ATOM 0 HA LEU A 100 19.131 15.526 -16.973 1.00 0.00 H new ATOM 0 HB2 LEU A 100 17.143 14.587 -15.829 1.00 0.00 H new ATOM 0 HB3 LEU A 100 16.546 16.209 -15.542 1.00 0.00 H new ATOM 0 HG LEU A 100 16.419 16.622 -17.961 1.00 0.00 H new ATOM 0 HD11 LEU A 100 16.714 14.766 -19.574 1.00 0.00 H new ATOM 0 HD12 LEU A 100 18.233 15.152 -18.732 1.00 0.00 H new ATOM 0 HD13 LEU A 100 17.291 13.719 -18.255 1.00 0.00 H new ATOM 0 HD21 LEU A 100 14.560 15.005 -18.440 1.00 0.00 H new ATOM 0 HD22 LEU A 100 15.110 13.993 -17.083 1.00 0.00 H new ATOM 0 HD23 LEU A 100 14.467 15.623 -16.774 1.00 0.00 H new ATOM 1486 N GLN A 101 18.667 17.807 -18.053 1.00 0.00 N ATOM 1487 CA GLN A 101 18.710 19.149 -18.613 1.00 0.00 C ATOM 1488 C GLN A 101 17.371 19.853 -18.376 1.00 0.00 C ATOM 1489 O GLN A 101 16.358 19.193 -18.157 1.00 0.00 O ATOM 1490 CB GLN A 101 19.036 19.077 -20.104 1.00 0.00 C ATOM 1491 CG GLN A 101 20.410 18.435 -20.328 1.00 0.00 C ATOM 1492 CD GLN A 101 20.779 18.381 -21.808 1.00 0.00 C ATOM 1493 OE1 GLN A 101 20.017 18.814 -22.670 1.00 0.00 O ATOM 1494 NE2 GLN A 101 21.957 17.843 -22.118 1.00 0.00 N ATOM 0 H GLN A 101 18.666 17.062 -18.750 1.00 0.00 H new ATOM 0 HA GLN A 101 19.492 19.726 -18.119 1.00 0.00 H new ATOM 0 HB2 GLN A 101 18.270 18.499 -20.621 1.00 0.00 H new ATOM 0 HB3 GLN A 101 19.023 20.079 -20.533 1.00 0.00 H new ATOM 0 HG2 GLN A 101 21.168 19.000 -19.785 1.00 0.00 H new ATOM 0 HG3 GLN A 101 20.410 17.426 -19.917 1.00 0.00 H new ATOM 0 HE21 GLN A 101 22.568 17.492 -21.380 1.00 0.00 H new ATOM 0 HE22 GLN A 101 22.249 17.782 -23.093 1.00 0.00 H new ATOM 1503 N LYS A 102 17.355 21.191 -18.418 1.00 0.00 N ATOM 1504 CA LYS A 102 16.114 21.936 -18.240 1.00 0.00 C ATOM 1505 C LYS A 102 15.109 21.609 -19.344 1.00 0.00 C ATOM 1506 O LYS A 102 13.954 21.348 -19.019 1.00 0.00 O ATOM 1507 CB LYS A 102 16.385 23.443 -18.145 1.00 0.00 C ATOM 1508 CG LYS A 102 17.200 23.808 -16.897 1.00 0.00 C ATOM 1509 CD LYS A 102 16.564 23.309 -15.593 1.00 0.00 C ATOM 1510 CE LYS A 102 15.131 23.816 -15.415 1.00 0.00 C ATOM 1511 NZ LYS A 102 15.107 25.251 -15.076 1.00 0.00 N ATOM 0 H LYS A 102 18.181 21.770 -18.572 1.00 0.00 H new ATOM 0 HA LYS A 102 15.667 21.625 -17.296 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.921 23.771 -19.036 1.00 0.00 H new ATOM 0 HB3 LYS A 102 15.437 23.981 -18.128 1.00 0.00 H new ATOM 0 HG2 LYS A 102 18.202 23.388 -16.989 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.312 24.891 -16.848 1.00 0.00 H new ATOM 0 HD2 LYS A 102 16.565 22.219 -15.585 1.00 0.00 H new ATOM 0 HD3 LYS A 102 17.170 23.635 -14.748 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.567 23.648 -16.333 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.637 23.246 -14.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.354 25.431 -14.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 16.024 25.527 -14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.926 25.808 -15.936 1.00 0.00 H new ATOM 1525 N PRO A 103 15.494 21.610 -20.630 1.00 0.00 N ATOM 1526 CA PRO A 103 14.632 21.091 -21.680 1.00 0.00 C ATOM 1527 C PRO A 103 14.568 19.570 -21.559 1.00 0.00 C ATOM 1528 O PRO A 103 15.595 18.917 -21.370 1.00 0.00 O ATOM 1529 CB PRO A 103 15.278 21.532 -22.991 1.00 0.00 C ATOM 1530 CG PRO A 103 16.762 21.604 -22.635 1.00 0.00 C ATOM 1531 CD PRO A 103 16.748 22.087 -21.185 1.00 0.00 C ATOM 0 HA PRO A 103 13.608 21.459 -21.620 1.00 0.00 H new ATOM 0 HB2 PRO A 103 15.090 20.819 -23.794 1.00 0.00 H new ATOM 0 HB3 PRO A 103 14.896 22.497 -23.325 1.00 0.00 H new ATOM 0 HG2 PRO A 103 17.247 20.633 -22.732 1.00 0.00 H new ATOM 0 HG3 PRO A 103 17.299 22.295 -23.285 1.00 0.00 H new ATOM 0 HD2 PRO A 103 17.599 21.690 -20.631 1.00 0.00 H new ATOM 0 HD3 PRO A 103 16.812 23.174 -21.133 1.00 0.00 H new ATOM 1539 N PHE A 104 13.364 19.003 -21.667 1.00 0.00 N ATOM 1540 CA PHE A 104 13.160 17.573 -21.504 1.00 0.00 C ATOM 1541 C PHE A 104 12.988 16.884 -22.856 1.00 0.00 C ATOM 1542 O PHE A 104 12.608 17.511 -23.844 1.00 0.00 O ATOM 1543 CB PHE A 104 11.945 17.312 -20.608 1.00 0.00 C ATOM 1544 CG PHE A 104 12.182 17.405 -19.116 1.00 0.00 C ATOM 1545 CD1 PHE A 104 11.278 16.776 -18.250 1.00 0.00 C ATOM 1546 CD2 PHE A 104 13.279 18.098 -18.582 1.00 0.00 C ATOM 1547 CE1 PHE A 104 11.483 16.808 -16.864 1.00 0.00 C ATOM 1548 CE2 PHE A 104 13.478 18.145 -17.194 1.00 0.00 C ATOM 1549 CZ PHE A 104 12.584 17.495 -16.335 1.00 0.00 C ATOM 0 H PHE A 104 12.511 19.524 -21.869 1.00 0.00 H new ATOM 0 HA PHE A 104 14.046 17.154 -21.027 1.00 0.00 H new ATOM 0 HB2 PHE A 104 11.163 18.023 -20.876 1.00 0.00 H new ATOM 0 HB3 PHE A 104 11.561 16.317 -20.832 1.00 0.00 H new ATOM 0 HD1 PHE A 104 10.417 16.263 -18.653 1.00 0.00 H new ATOM 0 HD2 PHE A 104 13.973 18.597 -19.242 1.00 0.00 H new ATOM 0 HE1 PHE A 104 10.793 16.304 -16.204 1.00 0.00 H new ATOM 0 HE2 PHE A 104 14.322 18.683 -16.788 1.00 0.00 H new ATOM 0 HZ PHE A 104 12.742 17.523 -15.267 1.00 0.00 H new ATOM 1559 N THR A 105 13.276 15.581 -22.883 1.00 0.00 N ATOM 1560 CA THR A 105 13.129 14.729 -24.058 1.00 0.00 C ATOM 1561 C THR A 105 12.600 13.369 -23.613 1.00 0.00 C ATOM 1562 O THR A 105 12.706 13.022 -22.435 1.00 0.00 O ATOM 1563 CB THR A 105 14.466 14.553 -24.780 1.00 0.00 C ATOM 1564 OG1 THR A 105 15.398 13.952 -23.909 1.00 0.00 O ATOM 1565 CG2 THR A 105 15.021 15.892 -25.260 1.00 0.00 C ATOM 0 H THR A 105 13.626 15.080 -22.067 1.00 0.00 H new ATOM 0 HA THR A 105 12.432 15.198 -24.752 1.00 0.00 H new ATOM 0 HB THR A 105 14.297 13.918 -25.650 1.00 0.00 H new ATOM 0 HG1 THR A 105 16.254 13.838 -24.373 1.00 0.00 H new ATOM 0 HG21 THR A 105 15.971 15.731 -25.769 1.00 0.00 H new ATOM 0 HG22 THR A 105 14.314 16.353 -25.950 1.00 0.00 H new ATOM 0 HG23 THR A 105 15.174 16.550 -24.405 1.00 0.00 H new ATOM 1573 N MET A 106 12.031 12.590 -24.539 1.00 0.00 N ATOM 1574 CA MET A 106 11.439 11.304 -24.200 1.00 0.00 C ATOM 1575 C MET A 106 12.490 10.346 -23.645 1.00 0.00 C ATOM 1576 O MET A 106 12.167 9.472 -22.841 1.00 0.00 O ATOM 1577 CB MET A 106 10.783 10.687 -25.440 1.00 0.00 C ATOM 1578 CG MET A 106 9.626 11.534 -25.976 1.00 0.00 C ATOM 1579 SD MET A 106 10.115 13.059 -26.829 1.00 0.00 S ATOM 1580 CE MET A 106 8.466 13.686 -27.246 1.00 0.00 C ATOM 0 H MET A 106 11.971 12.833 -25.528 1.00 0.00 H new ATOM 0 HA MET A 106 10.684 11.470 -23.432 1.00 0.00 H new ATOM 0 HB2 MET A 106 11.533 10.567 -26.222 1.00 0.00 H new ATOM 0 HB3 MET A 106 10.416 9.690 -25.195 1.00 0.00 H new ATOM 0 HG2 MET A 106 9.039 10.925 -26.663 1.00 0.00 H new ATOM 0 HG3 MET A 106 8.973 11.796 -25.144 1.00 0.00 H new ATOM 0 HE1 MET A 106 8.561 14.631 -27.782 1.00 0.00 H new ATOM 0 HE2 MET A 106 7.950 12.962 -27.876 1.00 0.00 H new ATOM 0 HE3 MET A 106 7.895 13.843 -26.331 1.00 0.00 H new ATOM 1590 N ASP A 107 13.751 10.503 -24.063 1.00 0.00 N ATOM 1591 CA ASP A 107 14.833 9.653 -23.595 1.00 0.00 C ATOM 1592 C ASP A 107 15.384 10.154 -22.262 1.00 0.00 C ATOM 1593 O ASP A 107 15.881 9.365 -21.460 1.00 0.00 O ATOM 1594 CB ASP A 107 15.931 9.625 -24.660 1.00 0.00 C ATOM 1595 CG ASP A 107 17.091 8.724 -24.247 1.00 0.00 C ATOM 1596 OD1 ASP A 107 18.166 9.274 -23.918 1.00 0.00 O ATOM 1597 OD2 ASP A 107 16.898 7.488 -24.262 1.00 0.00 O ATOM 0 H ASP A 107 14.041 11.219 -24.730 1.00 0.00 H new ATOM 0 HA ASP A 107 14.456 8.643 -23.431 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.514 9.273 -25.604 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.298 10.637 -24.831 1.00 0.00 H new ATOM 1602 N GLY A 108 15.303 11.466 -22.018 1.00 0.00 N ATOM 1603 CA GLY A 108 15.839 12.061 -20.806 1.00 0.00 C ATOM 1604 C GLY A 108 14.943 11.807 -19.599 1.00 0.00 C ATOM 1605 O GLY A 108 15.446 11.664 -18.487 1.00 0.00 O ATOM 0 H GLY A 108 14.867 12.134 -22.654 1.00 0.00 H new ATOM 0 HA2 GLY A 108 16.832 11.655 -20.612 1.00 0.00 H new ATOM 0 HA3 GLY A 108 15.956 13.135 -20.951 1.00 0.00 H new ATOM 1609 N VAL A 109 13.622 11.741 -19.804 1.00 0.00 N ATOM 1610 CA VAL A 109 12.696 11.516 -18.701 1.00 0.00 C ATOM 1611 C VAL A 109 12.594 10.036 -18.363 1.00 0.00 C ATOM 1612 O VAL A 109 12.256 9.689 -17.232 1.00 0.00 O ATOM 1613 CB VAL A 109 11.314 12.108 -19.013 1.00 0.00 C ATOM 1614 CG1 VAL A 109 11.444 13.613 -19.246 1.00 0.00 C ATOM 1615 CG2 VAL A 109 10.671 11.447 -20.230 1.00 0.00 C ATOM 0 H VAL A 109 13.179 11.840 -20.717 1.00 0.00 H new ATOM 0 HA VAL A 109 13.090 12.030 -17.824 1.00 0.00 H new ATOM 0 HB VAL A 109 10.667 11.917 -18.157 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.463 14.033 -19.467 1.00 0.00 H new ATOM 0 HG12 VAL A 109 11.848 14.086 -18.351 1.00 0.00 H new ATOM 0 HG13 VAL A 109 12.114 13.795 -20.086 1.00 0.00 H new ATOM 0 HG21 VAL A 109 9.695 11.896 -20.415 1.00 0.00 H new ATOM 0 HG22 VAL A 109 11.308 11.592 -21.102 1.00 0.00 H new ATOM 0 HG23 VAL A 109 10.550 10.380 -20.043 1.00 0.00 H new ATOM 1625 N ALA A 110 12.887 9.147 -19.318 1.00 0.00 N ATOM 1626 CA ALA A 110 12.851 7.722 -19.052 1.00 0.00 C ATOM 1627 C ALA A 110 14.037 7.325 -18.172 1.00 0.00 C ATOM 1628 O ALA A 110 13.934 6.394 -17.378 1.00 0.00 O ATOM 1629 CB ALA A 110 12.880 6.972 -20.383 1.00 0.00 C ATOM 0 H ALA A 110 13.149 9.395 -20.272 1.00 0.00 H new ATOM 0 HA ALA A 110 11.937 7.463 -18.518 1.00 0.00 H new ATOM 0 HB1 ALA A 110 12.853 5.898 -20.196 1.00 0.00 H new ATOM 0 HB2 ALA A 110 12.015 7.258 -20.981 1.00 0.00 H new ATOM 0 HB3 ALA A 110 13.793 7.224 -20.923 1.00 0.00 H new ATOM 1635 N LYS A 111 15.161 8.035 -18.312 1.00 0.00 N ATOM 1636 CA LYS A 111 16.361 7.776 -17.527 1.00 0.00 C ATOM 1637 C LYS A 111 16.317 8.496 -16.181 1.00 0.00 C ATOM 1638 O LYS A 111 16.956 8.051 -15.231 1.00 0.00 O ATOM 1639 CB LYS A 111 17.581 8.202 -18.344 1.00 0.00 C ATOM 1640 CG LYS A 111 17.742 7.294 -19.568 1.00 0.00 C ATOM 1641 CD LYS A 111 18.844 7.824 -20.481 1.00 0.00 C ATOM 1642 CE LYS A 111 18.997 6.887 -21.676 1.00 0.00 C ATOM 1643 NZ LYS A 111 19.909 7.451 -22.685 1.00 0.00 N ATOM 0 H LYS A 111 15.259 8.805 -18.974 1.00 0.00 H new ATOM 0 HA LYS A 111 16.423 6.710 -17.307 1.00 0.00 H new ATOM 0 HB2 LYS A 111 17.470 9.238 -18.663 1.00 0.00 H new ATOM 0 HB3 LYS A 111 18.477 8.153 -17.725 1.00 0.00 H new ATOM 0 HG2 LYS A 111 17.982 6.280 -19.248 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.801 7.241 -20.116 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.599 8.830 -20.821 1.00 0.00 H new ATOM 0 HD3 LYS A 111 19.784 7.893 -19.934 1.00 0.00 H new ATOM 0 HE2 LYS A 111 19.377 5.923 -21.338 1.00 0.00 H new ATOM 0 HE3 LYS A 111 18.021 6.706 -22.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 20.247 6.692 -23.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 19.405 8.165 -23.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 20.721 7.895 -22.210 1.00 0.00 H new ATOM 1657 N ALA A 112 15.571 9.603 -16.090 1.00 0.00 N ATOM 1658 CA ALA A 112 15.472 10.354 -14.847 1.00 0.00 C ATOM 1659 C ALA A 112 14.503 9.678 -13.882 1.00 0.00 C ATOM 1660 O ALA A 112 14.742 9.664 -12.675 1.00 0.00 O ATOM 1661 CB ALA A 112 15.028 11.782 -15.162 1.00 0.00 C ATOM 0 H ALA A 112 15.031 9.992 -16.863 1.00 0.00 H new ATOM 0 HA ALA A 112 16.447 10.382 -14.361 1.00 0.00 H new ATOM 0 HB1 ALA A 112 14.951 12.352 -14.236 1.00 0.00 H new ATOM 0 HB2 ALA A 112 15.759 12.254 -15.819 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.057 11.760 -15.656 1.00 0.00 H new ATOM 1667 N LEU A 113 13.409 9.109 -14.398 1.00 0.00 N ATOM 1668 CA LEU A 113 12.463 8.392 -13.558 1.00 0.00 C ATOM 1669 C LEU A 113 13.017 7.012 -13.214 1.00 0.00 C ATOM 1670 O LEU A 113 12.677 6.466 -12.169 1.00 0.00 O ATOM 1671 CB LEU A 113 11.101 8.293 -14.258 1.00 0.00 C ATOM 1672 CG LEU A 113 10.188 9.502 -14.007 1.00 0.00 C ATOM 1673 CD1 LEU A 113 9.724 9.532 -12.550 1.00 0.00 C ATOM 1674 CD2 LEU A 113 10.864 10.835 -14.319 1.00 0.00 C ATOM 0 H LEU A 113 13.163 9.134 -15.388 1.00 0.00 H new ATOM 0 HA LEU A 113 12.318 8.940 -12.627 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.261 8.186 -15.331 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.594 7.389 -13.920 1.00 0.00 H new ATOM 0 HG LEU A 113 9.341 9.380 -14.682 1.00 0.00 H new ATOM 0 HD11 LEU A 113 9.078 10.396 -12.392 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.172 8.620 -12.325 1.00 0.00 H new ATOM 0 HD13 LEU A 113 10.591 9.602 -11.893 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.168 11.651 -14.122 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.747 10.951 -13.690 1.00 0.00 H new ATOM 0 HD23 LEU A 113 11.160 10.856 -15.368 1.00 0.00 H new ATOM 1686 N ALA A 114 13.868 6.442 -14.073 1.00 0.00 N ATOM 1687 CA ALA A 114 14.516 5.178 -13.765 1.00 0.00 C ATOM 1688 C ALA A 114 15.618 5.376 -12.723 1.00 0.00 C ATOM 1689 O ALA A 114 16.017 4.423 -12.059 1.00 0.00 O ATOM 1690 CB ALA A 114 15.075 4.577 -15.053 1.00 0.00 C ATOM 0 H ALA A 114 14.118 6.838 -14.979 1.00 0.00 H new ATOM 0 HA ALA A 114 13.787 4.489 -13.339 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.563 3.628 -14.830 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.262 4.410 -15.759 1.00 0.00 H new ATOM 0 HB3 ALA A 114 15.800 5.264 -15.490 1.00 0.00 H new ATOM 1696 N ALA A 115 16.115 6.610 -12.578 1.00 0.00 N ATOM 1697 CA ALA A 115 17.107 6.941 -11.566 1.00 0.00 C ATOM 1698 C ALA A 115 16.442 7.313 -10.239 1.00 0.00 C ATOM 1699 O ALA A 115 17.099 7.306 -9.201 1.00 0.00 O ATOM 1700 CB ALA A 115 17.988 8.075 -12.085 1.00 0.00 C ATOM 0 H ALA A 115 15.838 7.400 -13.160 1.00 0.00 H new ATOM 0 HA ALA A 115 17.729 6.067 -11.372 1.00 0.00 H new ATOM 0 HB1 ALA A 115 18.734 8.329 -11.333 1.00 0.00 H new ATOM 0 HB2 ALA A 115 18.489 7.757 -13.000 1.00 0.00 H new ATOM 0 HB3 ALA A 115 17.371 8.949 -12.294 1.00 0.00 H new ATOM 1706 N LEU A 116 15.143 7.635 -10.264 1.00 0.00 N ATOM 1707 CA LEU A 116 14.391 7.958 -9.057 1.00 0.00 C ATOM 1708 C LEU A 116 13.751 6.688 -8.490 1.00 0.00 C ATOM 1709 O LEU A 116 13.848 6.419 -7.294 1.00 0.00 O ATOM 1710 CB LEU A 116 13.355 9.035 -9.408 1.00 0.00 C ATOM 1711 CG LEU A 116 13.031 9.974 -8.241 1.00 0.00 C ATOM 1712 CD1 LEU A 116 11.995 10.987 -8.707 1.00 0.00 C ATOM 1713 CD2 LEU A 116 12.477 9.231 -7.028 1.00 0.00 C ATOM 0 H LEU A 116 14.590 7.677 -11.120 1.00 0.00 H new ATOM 0 HA LEU A 116 15.045 8.354 -8.280 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.725 9.625 -10.247 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.437 8.550 -9.740 1.00 0.00 H new ATOM 0 HG LEU A 116 13.959 10.458 -7.936 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.753 11.663 -7.887 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.396 11.559 -9.543 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.093 10.465 -9.025 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.265 9.943 -6.231 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.559 8.714 -7.306 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.211 8.505 -6.680 1.00 0.00 H new ATOM 1725 N LEU A 117 13.100 5.904 -9.356 1.00 0.00 N ATOM 1726 CA LEU A 117 12.512 4.613 -9.019 1.00 0.00 C ATOM 1727 C LEU A 117 13.574 3.505 -8.966 1.00 0.00 C ATOM 1728 O LEU A 117 13.236 2.324 -9.028 1.00 0.00 O ATOM 1729 CB LEU A 117 11.398 4.270 -10.019 1.00 0.00 C ATOM 1730 CG LEU A 117 10.079 5.010 -9.766 1.00 0.00 C ATOM 1731 CD1 LEU A 117 10.193 6.530 -9.872 1.00 0.00 C ATOM 1732 CD2 LEU A 117 9.052 4.533 -10.793 1.00 0.00 C ATOM 0 H LEU A 117 12.967 6.161 -10.334 1.00 0.00 H new ATOM 0 HA LEU A 117 12.077 4.683 -8.022 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.745 4.502 -11.026 1.00 0.00 H new ATOM 0 HB3 LEU A 117 11.212 3.197 -9.985 1.00 0.00 H new ATOM 0 HG LEU A 117 9.782 4.784 -8.742 1.00 0.00 H new ATOM 0 HD11 LEU A 117 9.220 6.982 -9.680 1.00 0.00 H new ATOM 0 HD12 LEU A 117 10.913 6.893 -9.138 1.00 0.00 H new ATOM 0 HD13 LEU A 117 10.528 6.801 -10.873 1.00 0.00 H new ATOM 0 HD21 LEU A 117 8.106 5.049 -10.628 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.414 4.751 -11.798 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.902 3.459 -10.686 1.00 0.00 H new ATOM 1744 N VAL A 118 14.855 3.879 -8.853 1.00 0.00 N ATOM 1745 CA VAL A 118 15.963 2.930 -8.810 1.00 0.00 C ATOM 1746 C VAL A 118 15.851 2.006 -7.598 1.00 0.00 C ATOM 1747 O VAL A 118 15.428 2.491 -6.523 1.00 0.00 O ATOM 1748 CB VAL A 118 17.295 3.687 -8.842 1.00 0.00 C ATOM 1749 CG1 VAL A 118 17.507 4.526 -7.581 1.00 0.00 C ATOM 1750 CG2 VAL A 118 18.463 2.715 -9.005 1.00 0.00 C ATOM 0 H VAL A 118 15.148 4.854 -8.789 1.00 0.00 H new ATOM 0 HA VAL A 118 15.919 2.290 -9.691 1.00 0.00 H new ATOM 0 HB VAL A 118 17.256 4.361 -9.698 1.00 0.00 H new ATOM 0 HG11 VAL A 118 18.463 5.045 -7.646 1.00 0.00 H new ATOM 0 HG12 VAL A 118 16.703 5.256 -7.490 1.00 0.00 H new ATOM 0 HG13 VAL A 118 17.506 3.875 -6.707 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.400 3.272 -9.025 1.00 0.00 H new ATOM 0 HG22 VAL A 118 18.474 2.016 -8.168 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.349 2.162 -9.938 1.00 0.00 H new