USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 775 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 65 GLN : amide:sc= -0.0662 K(o=1.1,f=-0.16!) USER MOD Set 1.2: A 110 SER OG : rot 41:sc= 1.21 USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0542 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -64:sc= 0.0828 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.0146 X(o=-0.015,f=0) USER MOD Single : A 13 HIS : no HD1:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot 180:sc= 0.00575 USER MOD Single : A 27 SER OG : rot -119:sc= 0.398 USER MOD Single : A 32 GLN : amide:sc= -0.293 K(o=-0.29,f=-1.7!) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 7:sc= -10.8! USER MOD Single : A 56 SER OG : rot 176:sc= -0.183 USER MOD Single : A 61 CYS SG : rot -147:sc= -3.23! USER MOD Single : A 72 SER OG : rot 180:sc=-0.000128 USER MOD Single : A 74 ASN : amide:sc= -7.66! C(o=-7.7!,f=-7.6!) USER MOD Single : A 78 THR OG1 : rot -102:sc= 0.614 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.0278 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -2.12! K(o=-2.1!,f=-1) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -1.61 K(o=-1.6,f=-0.56) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot -57:sc= 0.729 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.909 -21.230 -45.480 1.00 0.00 N ATOM 2 CA GLY A 1 -2.165 -20.459 -44.275 1.00 0.00 C ATOM 3 C GLY A 1 -0.855 -20.001 -43.629 1.00 0.00 C ATOM 4 O GLY A 1 0.194 -20.605 -43.849 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.278 -20.717 -46.306 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.885 -21.372 -45.590 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.380 -22.154 -45.408 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.778 -19.591 -44.518 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.733 -21.062 -43.567 1.00 0.00 H new ATOM 8 N SER A 2 -0.959 -18.938 -42.846 1.00 0.00 N ATOM 9 CA SER A 2 0.204 -18.392 -42.167 1.00 0.00 C ATOM 10 C SER A 2 1.226 -17.900 -43.193 1.00 0.00 C ATOM 11 O SER A 2 1.644 -18.655 -44.070 1.00 0.00 O ATOM 12 CB SER A 2 0.839 -19.432 -41.241 1.00 0.00 C ATOM 13 OG SER A 2 1.756 -18.841 -40.324 1.00 0.00 O ATOM 0 H SER A 2 -1.831 -18.440 -42.666 1.00 0.00 H new ATOM 0 HA SER A 2 -0.121 -17.550 -41.555 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.056 -19.951 -40.687 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.357 -20.182 -41.839 1.00 0.00 H new ATOM 0 HG SER A 2 2.138 -19.537 -39.750 1.00 0.00 H new ATOM 19 N SER A 3 1.600 -16.637 -43.049 1.00 0.00 N ATOM 20 CA SER A 3 2.565 -16.035 -43.953 1.00 0.00 C ATOM 21 C SER A 3 3.563 -15.186 -43.163 1.00 0.00 C ATOM 22 O SER A 3 3.281 -14.776 -42.038 1.00 0.00 O ATOM 23 CB SER A 3 1.868 -15.182 -45.015 1.00 0.00 C ATOM 24 OG SER A 3 0.996 -14.215 -44.436 1.00 0.00 O ATOM 0 H SER A 3 1.252 -16.014 -42.320 1.00 0.00 H new ATOM 0 HA SER A 3 3.101 -16.836 -44.463 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.618 -14.676 -45.623 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.299 -15.829 -45.683 1.00 0.00 H new ATOM 0 HG SER A 3 0.572 -13.690 -45.147 1.00 0.00 H new ATOM 30 N GLY A 4 4.710 -14.948 -43.782 1.00 0.00 N ATOM 31 CA GLY A 4 5.752 -14.156 -43.151 1.00 0.00 C ATOM 32 C GLY A 4 5.234 -12.765 -42.781 1.00 0.00 C ATOM 33 O GLY A 4 5.120 -11.892 -43.641 1.00 0.00 O ATOM 0 H GLY A 4 4.941 -15.290 -44.715 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.109 -14.665 -42.256 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.603 -14.064 -43.826 1.00 0.00 H new ATOM 37 N SER A 5 4.935 -12.601 -41.501 1.00 0.00 N ATOM 38 CA SER A 5 4.432 -11.330 -41.007 1.00 0.00 C ATOM 39 C SER A 5 4.740 -11.190 -39.515 1.00 0.00 C ATOM 40 O SER A 5 5.025 -12.179 -38.840 1.00 0.00 O ATOM 41 CB SER A 5 2.928 -11.200 -41.253 1.00 0.00 C ATOM 42 OG SER A 5 2.182 -12.178 -40.534 1.00 0.00 O ATOM 0 H SER A 5 5.031 -13.327 -40.791 1.00 0.00 H new ATOM 0 HA SER A 5 4.932 -10.529 -41.551 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.598 -10.204 -40.959 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.725 -11.301 -42.319 1.00 0.00 H new ATOM 0 HG SER A 5 2.411 -13.072 -40.864 1.00 0.00 H new ATOM 48 N SER A 6 4.672 -9.954 -39.042 1.00 0.00 N ATOM 49 CA SER A 6 4.940 -9.672 -37.642 1.00 0.00 C ATOM 50 C SER A 6 3.627 -9.628 -36.857 1.00 0.00 C ATOM 51 O SER A 6 2.553 -9.506 -37.443 1.00 0.00 O ATOM 52 CB SER A 6 5.699 -8.354 -37.482 1.00 0.00 C ATOM 53 OG SER A 6 7.057 -8.465 -37.901 1.00 0.00 O ATOM 0 H SER A 6 4.435 -9.136 -39.604 1.00 0.00 H new ATOM 0 HA SER A 6 5.566 -10.471 -37.245 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.203 -7.577 -38.063 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.666 -8.041 -36.438 1.00 0.00 H new ATOM 0 HG SER A 6 7.507 -7.602 -37.785 1.00 0.00 H new ATOM 59 N GLY A 7 3.758 -9.729 -35.543 1.00 0.00 N ATOM 60 CA GLY A 7 2.596 -9.701 -34.671 1.00 0.00 C ATOM 61 C GLY A 7 2.772 -8.672 -33.553 1.00 0.00 C ATOM 62 O GLY A 7 2.420 -7.505 -33.718 1.00 0.00 O ATOM 0 H GLY A 7 4.651 -9.830 -35.061 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.706 -9.462 -35.253 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.438 -10.689 -34.239 1.00 0.00 H new ATOM 66 N GLY A 8 3.318 -9.141 -32.441 1.00 0.00 N ATOM 67 CA GLY A 8 3.545 -8.276 -31.296 1.00 0.00 C ATOM 68 C GLY A 8 3.866 -9.095 -30.044 1.00 0.00 C ATOM 69 O GLY A 8 3.971 -10.319 -30.109 1.00 0.00 O ATOM 0 H GLY A 8 3.610 -10.109 -32.308 1.00 0.00 H new ATOM 0 HA2 GLY A 8 4.368 -7.593 -31.509 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.661 -7.664 -31.117 1.00 0.00 H new ATOM 73 N GLY A 9 4.013 -8.387 -28.934 1.00 0.00 N ATOM 74 CA GLY A 9 4.320 -9.033 -27.669 1.00 0.00 C ATOM 75 C GLY A 9 3.039 -9.412 -26.922 1.00 0.00 C ATOM 76 O GLY A 9 2.155 -10.055 -27.485 1.00 0.00 O ATOM 0 H GLY A 9 3.925 -7.372 -28.884 1.00 0.00 H new ATOM 0 HA2 GLY A 9 4.918 -9.926 -27.848 1.00 0.00 H new ATOM 0 HA3 GLY A 9 4.921 -8.365 -27.052 1.00 0.00 H new ATOM 80 N GLN A 10 2.981 -8.996 -25.666 1.00 0.00 N ATOM 81 CA GLN A 10 1.823 -9.284 -24.836 1.00 0.00 C ATOM 82 C GLN A 10 1.811 -8.371 -23.608 1.00 0.00 C ATOM 83 O GLN A 10 2.854 -7.868 -23.193 1.00 0.00 O ATOM 84 CB GLN A 10 1.796 -10.757 -24.424 1.00 0.00 C ATOM 85 CG GLN A 10 3.203 -11.262 -24.101 1.00 0.00 C ATOM 86 CD GLN A 10 3.202 -12.774 -23.864 1.00 0.00 C ATOM 87 OE1 GLN A 10 2.523 -13.291 -22.992 1.00 0.00 O ATOM 88 NE2 GLN A 10 3.998 -13.451 -24.686 1.00 0.00 N ATOM 0 H GLN A 10 3.716 -8.462 -25.203 1.00 0.00 H new ATOM 0 HA GLN A 10 0.924 -9.088 -25.420 1.00 0.00 H new ATOM 0 HB2 GLN A 10 1.152 -10.883 -23.554 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.367 -11.355 -25.228 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.878 -11.019 -24.922 1.00 0.00 H new ATOM 0 HG3 GLN A 10 3.582 -10.752 -23.216 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.540 -12.956 -25.394 1.00 0.00 H new ATOM 0 HE22 GLN A 10 4.067 -14.466 -24.608 1.00 0.00 H new ATOM 97 N ILE A 11 0.619 -8.185 -23.060 1.00 0.00 N ATOM 98 CA ILE A 11 0.457 -7.342 -21.888 1.00 0.00 C ATOM 99 C ILE A 11 -0.181 -8.158 -20.762 1.00 0.00 C ATOM 100 O ILE A 11 -0.845 -9.161 -21.017 1.00 0.00 O ATOM 101 CB ILE A 11 -0.321 -6.073 -22.244 1.00 0.00 C ATOM 102 CG1 ILE A 11 -1.705 -6.416 -22.799 1.00 0.00 C ATOM 103 CG2 ILE A 11 0.479 -5.191 -23.205 1.00 0.00 C ATOM 104 CD1 ILE A 11 -2.808 -5.939 -21.852 1.00 0.00 C ATOM 0 H ILE A 11 -0.244 -8.604 -23.406 1.00 0.00 H new ATOM 0 HA ILE A 11 1.428 -7.003 -21.526 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.474 -5.498 -21.330 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -1.834 -5.952 -23.777 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.786 -7.493 -22.944 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.096 -4.296 -23.442 1.00 0.00 H new ATOM 0 HG22 ILE A 11 1.421 -4.904 -22.737 1.00 0.00 H new ATOM 0 HG23 ILE A 11 0.683 -5.744 -24.122 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.782 -6.195 -22.269 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.690 -6.423 -20.883 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -2.739 -4.858 -21.728 1.00 0.00 H new ATOM 116 N VAL A 12 0.044 -7.698 -19.540 1.00 0.00 N ATOM 117 CA VAL A 12 -0.500 -8.373 -18.374 1.00 0.00 C ATOM 118 C VAL A 12 -2.028 -8.339 -18.438 1.00 0.00 C ATOM 119 O VAL A 12 -2.617 -7.314 -18.779 1.00 0.00 O ATOM 120 CB VAL A 12 0.059 -7.743 -17.097 1.00 0.00 C ATOM 121 CG1 VAL A 12 -0.549 -8.395 -15.853 1.00 0.00 C ATOM 122 CG2 VAL A 12 1.587 -7.826 -17.068 1.00 0.00 C ATOM 0 H VAL A 12 0.596 -6.866 -19.332 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.198 -9.420 -18.363 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.219 -6.689 -17.093 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.135 -7.929 -14.959 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.631 -8.261 -15.864 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.315 -9.460 -15.849 1.00 0.00 H new ATOM 0 HG21 VAL A 12 1.959 -7.371 -16.150 1.00 0.00 H new ATOM 0 HG22 VAL A 12 1.895 -8.871 -17.106 1.00 0.00 H new ATOM 0 HG23 VAL A 12 1.997 -7.295 -17.927 1.00 0.00 H new ATOM 132 N HIS A 13 -2.628 -9.472 -18.104 1.00 0.00 N ATOM 133 CA HIS A 13 -4.077 -9.585 -18.118 1.00 0.00 C ATOM 134 C HIS A 13 -4.694 -8.361 -17.438 1.00 0.00 C ATOM 135 O HIS A 13 -5.495 -7.649 -18.041 1.00 0.00 O ATOM 136 CB HIS A 13 -4.525 -10.904 -17.486 1.00 0.00 C ATOM 137 CG HIS A 13 -4.332 -12.109 -18.376 1.00 0.00 C ATOM 138 ND1 HIS A 13 -3.936 -13.343 -17.891 1.00 0.00 N ATOM 139 CD2 HIS A 13 -4.484 -12.255 -19.724 1.00 0.00 C ATOM 140 CE1 HIS A 13 -3.856 -14.186 -18.910 1.00 0.00 C ATOM 141 NE2 HIS A 13 -4.195 -13.510 -20.045 1.00 0.00 N ATOM 0 H HIS A 13 -2.137 -10.320 -17.822 1.00 0.00 H new ATOM 0 HA HIS A 13 -4.434 -9.603 -19.148 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -3.972 -11.057 -16.559 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -5.579 -10.827 -17.219 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -4.788 -11.481 -20.413 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -3.572 -15.226 -18.852 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -4.222 -13.904 -20.985 1.00 0.00 H new ATOM 149 N THR A 14 -4.297 -8.155 -16.191 1.00 0.00 N ATOM 150 CA THR A 14 -4.801 -7.030 -15.422 1.00 0.00 C ATOM 151 C THR A 14 -3.983 -5.772 -15.719 1.00 0.00 C ATOM 152 O THR A 14 -2.963 -5.837 -16.402 1.00 0.00 O ATOM 153 CB THR A 14 -4.792 -7.426 -13.944 1.00 0.00 C ATOM 154 OG1 THR A 14 -5.317 -8.750 -13.936 1.00 0.00 O ATOM 155 CG2 THR A 14 -5.797 -6.622 -13.116 1.00 0.00 C ATOM 0 H THR A 14 -3.632 -8.748 -15.694 1.00 0.00 H new ATOM 0 HA THR A 14 -5.826 -6.787 -15.702 1.00 0.00 H new ATOM 0 HB THR A 14 -3.791 -7.285 -13.537 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.345 -9.085 -13.016 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.750 -6.942 -12.075 1.00 0.00 H new ATOM 0 HG22 THR A 14 -5.555 -5.561 -13.180 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.803 -6.789 -13.502 1.00 0.00 H new ATOM 163 N GLU A 15 -4.463 -4.655 -15.191 1.00 0.00 N ATOM 164 CA GLU A 15 -3.789 -3.383 -15.391 1.00 0.00 C ATOM 165 C GLU A 15 -2.949 -3.028 -14.162 1.00 0.00 C ATOM 166 O GLU A 15 -3.251 -3.465 -13.053 1.00 0.00 O ATOM 167 CB GLU A 15 -4.794 -2.274 -15.708 1.00 0.00 C ATOM 168 CG GLU A 15 -5.368 -2.440 -17.116 1.00 0.00 C ATOM 169 CD GLU A 15 -6.061 -3.795 -17.270 1.00 0.00 C ATOM 170 OE1 GLU A 15 -6.786 -4.173 -16.324 1.00 0.00 O ATOM 171 OE2 GLU A 15 -5.849 -4.424 -18.330 1.00 0.00 O ATOM 0 H GLU A 15 -5.310 -4.605 -14.625 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.121 -3.478 -16.247 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -5.603 -2.292 -14.977 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.308 -1.302 -15.622 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -6.079 -1.639 -17.319 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.568 -2.351 -17.851 1.00 0.00 H new ATOM 178 N THR A 16 -1.912 -2.240 -14.402 1.00 0.00 N ATOM 179 CA THR A 16 -1.026 -1.821 -13.328 1.00 0.00 C ATOM 180 C THR A 16 -0.696 -0.333 -13.459 1.00 0.00 C ATOM 181 O THR A 16 -0.507 0.170 -14.566 1.00 0.00 O ATOM 182 CB THR A 16 0.209 -2.723 -13.356 1.00 0.00 C ATOM 183 OG1 THR A 16 0.457 -2.930 -14.744 1.00 0.00 O ATOM 184 CG2 THR A 16 -0.077 -4.125 -12.814 1.00 0.00 C ATOM 0 H THR A 16 -1.665 -1.880 -15.324 1.00 0.00 H new ATOM 0 HA THR A 16 -1.504 -1.931 -12.355 1.00 0.00 H new ATOM 0 HB THR A 16 1.006 -2.264 -12.771 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.244 -3.504 -14.854 1.00 0.00 H new ATOM 0 HG21 THR A 16 0.833 -4.724 -12.856 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.417 -4.053 -11.781 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.851 -4.598 -13.418 1.00 0.00 H new ATOM 192 N THR A 17 -0.636 0.330 -12.314 1.00 0.00 N ATOM 193 CA THR A 17 -0.332 1.751 -12.286 1.00 0.00 C ATOM 194 C THR A 17 0.907 2.014 -11.429 1.00 0.00 C ATOM 195 O THR A 17 0.972 1.586 -10.278 1.00 0.00 O ATOM 196 CB THR A 17 -1.578 2.492 -11.798 1.00 0.00 C ATOM 197 OG1 THR A 17 -1.470 3.782 -12.392 1.00 0.00 O ATOM 198 CG2 THR A 17 -1.541 2.771 -10.294 1.00 0.00 C ATOM 0 H THR A 17 -0.793 -0.090 -11.398 1.00 0.00 H new ATOM 0 HA THR A 17 -0.085 2.122 -13.281 1.00 0.00 H new ATOM 0 HB THR A 17 -2.465 1.906 -12.038 1.00 0.00 H new ATOM 0 HG1 THR A 17 -2.240 4.329 -12.129 1.00 0.00 H new ATOM 0 HG21 THR A 17 -2.448 3.299 -9.999 1.00 0.00 H new ATOM 0 HG22 THR A 17 -1.477 1.828 -9.751 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.672 3.385 -10.059 1.00 0.00 H new ATOM 206 N GLU A 18 1.860 2.718 -12.023 1.00 0.00 N ATOM 207 CA GLU A 18 3.094 3.044 -11.328 1.00 0.00 C ATOM 208 C GLU A 18 3.078 4.505 -10.875 1.00 0.00 C ATOM 209 O GLU A 18 2.922 5.410 -11.693 1.00 0.00 O ATOM 210 CB GLU A 18 4.311 2.755 -12.208 1.00 0.00 C ATOM 211 CG GLU A 18 5.611 2.917 -11.416 1.00 0.00 C ATOM 212 CD GLU A 18 6.784 2.262 -12.148 1.00 0.00 C ATOM 213 OE1 GLU A 18 6.897 1.021 -12.044 1.00 0.00 O ATOM 214 OE2 GLU A 18 7.541 3.017 -12.796 1.00 0.00 O ATOM 0 H GLU A 18 1.802 3.072 -12.978 1.00 0.00 H new ATOM 0 HA GLU A 18 3.169 2.411 -10.444 1.00 0.00 H new ATOM 0 HB2 GLU A 18 4.246 1.741 -12.604 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.315 3.431 -13.063 1.00 0.00 H new ATOM 0 HG2 GLU A 18 5.819 3.976 -11.264 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.498 2.469 -10.429 1.00 0.00 H new ATOM 221 N VAL A 19 3.242 4.690 -9.573 1.00 0.00 N ATOM 222 CA VAL A 19 3.248 6.026 -9.002 1.00 0.00 C ATOM 223 C VAL A 19 4.566 6.251 -8.257 1.00 0.00 C ATOM 224 O VAL A 19 5.003 5.394 -7.489 1.00 0.00 O ATOM 225 CB VAL A 19 2.018 6.221 -8.114 1.00 0.00 C ATOM 226 CG1 VAL A 19 2.069 7.572 -7.396 1.00 0.00 C ATOM 227 CG2 VAL A 19 0.728 6.080 -8.925 1.00 0.00 C ATOM 0 H VAL A 19 3.372 3.937 -8.897 1.00 0.00 H new ATOM 0 HA VAL A 19 3.186 6.778 -9.788 1.00 0.00 H new ATOM 0 HB VAL A 19 2.025 5.438 -7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.183 7.686 -6.771 1.00 0.00 H new ATOM 0 HG12 VAL A 19 2.961 7.619 -6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 19 2.099 8.375 -8.133 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.131 6.223 -8.270 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.711 6.831 -9.715 1.00 0.00 H new ATOM 0 HG23 VAL A 19 0.684 5.085 -9.369 1.00 0.00 H new ATOM 237 N VAL A 20 5.161 7.407 -8.509 1.00 0.00 N ATOM 238 CA VAL A 20 6.420 7.755 -7.871 1.00 0.00 C ATOM 239 C VAL A 20 6.150 8.714 -6.710 1.00 0.00 C ATOM 240 O VAL A 20 6.002 9.917 -6.915 1.00 0.00 O ATOM 241 CB VAL A 20 7.390 8.328 -8.906 1.00 0.00 C ATOM 242 CG1 VAL A 20 8.666 8.842 -8.236 1.00 0.00 C ATOM 243 CG2 VAL A 20 7.716 7.293 -9.985 1.00 0.00 C ATOM 0 H VAL A 20 4.795 8.115 -9.146 1.00 0.00 H new ATOM 0 HA VAL A 20 6.896 6.867 -7.455 1.00 0.00 H new ATOM 0 HB VAL A 20 6.902 9.174 -9.390 1.00 0.00 H new ATOM 0 HG11 VAL A 20 9.338 9.244 -8.994 1.00 0.00 H new ATOM 0 HG12 VAL A 20 8.412 9.627 -7.523 1.00 0.00 H new ATOM 0 HG13 VAL A 20 9.158 8.022 -7.713 1.00 0.00 H new ATOM 0 HG21 VAL A 20 8.407 7.726 -10.708 1.00 0.00 H new ATOM 0 HG22 VAL A 20 8.175 6.418 -9.524 1.00 0.00 H new ATOM 0 HG23 VAL A 20 6.799 6.996 -10.493 1.00 0.00 H new ATOM 253 N LEU A 21 6.094 8.144 -5.515 1.00 0.00 N ATOM 254 CA LEU A 21 5.845 8.933 -4.320 1.00 0.00 C ATOM 255 C LEU A 21 7.177 9.421 -3.750 1.00 0.00 C ATOM 256 O LEU A 21 8.196 8.744 -3.876 1.00 0.00 O ATOM 257 CB LEU A 21 5.001 8.139 -3.320 1.00 0.00 C ATOM 258 CG LEU A 21 3.701 8.803 -2.864 1.00 0.00 C ATOM 259 CD1 LEU A 21 2.644 8.757 -3.969 1.00 0.00 C ATOM 260 CD2 LEU A 21 3.195 8.180 -1.561 1.00 0.00 C ATOM 0 H LEU A 21 6.217 7.145 -5.349 1.00 0.00 H new ATOM 0 HA LEU A 21 5.259 9.819 -4.563 1.00 0.00 H new ATOM 0 HB2 LEU A 21 4.756 7.175 -3.766 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.611 7.937 -2.439 1.00 0.00 H new ATOM 0 HG LEU A 21 3.908 9.854 -2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 21 1.730 9.236 -3.618 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.014 9.283 -4.849 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.434 7.719 -4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.270 8.670 -1.259 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.009 7.117 -1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 21 3.945 8.309 -0.781 1.00 0.00 H new ATOM 272 N CYS A 22 7.127 10.593 -3.133 1.00 0.00 N ATOM 273 CA CYS A 22 8.318 11.180 -2.543 1.00 0.00 C ATOM 274 C CYS A 22 7.963 11.675 -1.139 1.00 0.00 C ATOM 275 O CYS A 22 7.252 12.667 -0.988 1.00 0.00 O ATOM 276 CB CYS A 22 8.889 12.299 -3.416 1.00 0.00 C ATOM 277 SG CYS A 22 7.552 13.073 -4.396 1.00 0.00 S ATOM 0 H CYS A 22 6.280 11.152 -3.029 1.00 0.00 H new ATOM 0 HA CYS A 22 9.103 10.427 -2.474 1.00 0.00 H new ATOM 0 HB2 CYS A 22 9.373 13.049 -2.790 1.00 0.00 H new ATOM 0 HB3 CYS A 22 9.653 11.898 -4.082 1.00 0.00 H new ATOM 0 HG CYS A 22 8.048 14.023 -5.132 1.00 0.00 H new ATOM 283 N GLY A 23 8.476 10.962 -0.147 1.00 0.00 N ATOM 284 CA GLY A 23 8.223 11.317 1.239 1.00 0.00 C ATOM 285 C GLY A 23 9.526 11.369 2.038 1.00 0.00 C ATOM 286 O GLY A 23 10.603 11.131 1.493 1.00 0.00 O ATOM 0 H GLY A 23 9.066 10.140 -0.276 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.725 12.286 1.285 1.00 0.00 H new ATOM 0 HA3 GLY A 23 7.546 10.589 1.687 1.00 0.00 H new ATOM 290 N ASP A 24 9.386 11.680 3.318 1.00 0.00 N ATOM 291 CA ASP A 24 10.538 11.766 4.199 1.00 0.00 C ATOM 292 C ASP A 24 10.726 10.429 4.918 1.00 0.00 C ATOM 293 O ASP A 24 9.787 9.643 5.030 1.00 0.00 O ATOM 294 CB ASP A 24 10.342 12.851 5.259 1.00 0.00 C ATOM 295 CG ASP A 24 9.692 14.141 4.753 1.00 0.00 C ATOM 296 OD1 ASP A 24 10.237 14.706 3.780 1.00 0.00 O ATOM 297 OD2 ASP A 24 8.667 14.532 5.351 1.00 0.00 O ATOM 0 H ASP A 24 8.491 11.876 3.767 1.00 0.00 H new ATOM 0 HA ASP A 24 11.409 12.010 3.591 1.00 0.00 H new ATOM 0 HB2 ASP A 24 9.729 12.445 6.064 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.313 13.096 5.690 1.00 0.00 H new ATOM 302 N PRO A 25 11.978 10.207 5.401 1.00 0.00 N ATOM 303 CA PRO A 25 12.301 8.979 6.107 1.00 0.00 C ATOM 304 C PRO A 25 11.720 8.991 7.522 1.00 0.00 C ATOM 305 O PRO A 25 11.649 7.952 8.177 1.00 0.00 O ATOM 306 CB PRO A 25 13.819 8.902 6.089 1.00 0.00 C ATOM 307 CG PRO A 25 14.304 10.310 5.786 1.00 0.00 C ATOM 308 CD PRO A 25 13.115 11.116 5.288 1.00 0.00 C ATOM 0 HA PRO A 25 11.865 8.097 5.637 1.00 0.00 H new ATOM 0 HB2 PRO A 25 14.204 8.554 7.048 1.00 0.00 H new ATOM 0 HB3 PRO A 25 14.165 8.198 5.332 1.00 0.00 H new ATOM 0 HG2 PRO A 25 14.728 10.768 6.679 1.00 0.00 H new ATOM 0 HG3 PRO A 25 15.093 10.288 5.034 1.00 0.00 H new ATOM 0 HD2 PRO A 25 12.966 12.014 5.888 1.00 0.00 H new ATOM 0 HD3 PRO A 25 13.261 11.442 4.258 1.00 0.00 H new ATOM 316 N LEU A 26 11.318 10.178 7.953 1.00 0.00 N ATOM 317 CA LEU A 26 10.746 10.339 9.278 1.00 0.00 C ATOM 318 C LEU A 26 9.228 10.170 9.197 1.00 0.00 C ATOM 319 O LEU A 26 8.649 9.369 9.930 1.00 0.00 O ATOM 320 CB LEU A 26 11.184 11.670 9.893 1.00 0.00 C ATOM 321 CG LEU A 26 12.323 11.596 10.912 1.00 0.00 C ATOM 322 CD1 LEU A 26 13.349 12.705 10.668 1.00 0.00 C ATOM 323 CD2 LEU A 26 11.782 11.620 12.342 1.00 0.00 C ATOM 0 H LEU A 26 11.377 11.038 7.407 1.00 0.00 H new ATOM 0 HA LEU A 26 11.118 9.566 9.950 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.487 12.338 9.087 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.320 12.126 10.376 1.00 0.00 H new ATOM 0 HG LEU A 26 12.839 10.645 10.780 1.00 0.00 H new ATOM 0 HD11 LEU A 26 14.148 12.630 11.406 1.00 0.00 H new ATOM 0 HD12 LEU A 26 13.768 12.599 9.667 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.863 13.676 10.757 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.612 11.566 13.046 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.227 12.544 12.506 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.121 10.767 12.495 1.00 0.00 H new ATOM 335 N SER A 27 8.625 10.936 8.300 1.00 0.00 N ATOM 336 CA SER A 27 7.185 10.881 8.114 1.00 0.00 C ATOM 337 C SER A 27 6.808 9.628 7.322 1.00 0.00 C ATOM 338 O SER A 27 5.728 9.071 7.512 1.00 0.00 O ATOM 339 CB SER A 27 6.673 12.134 7.401 1.00 0.00 C ATOM 340 OG SER A 27 6.960 12.108 6.005 1.00 0.00 O ATOM 0 H SER A 27 9.108 11.599 7.693 1.00 0.00 H new ATOM 0 HA SER A 27 6.715 10.838 9.096 1.00 0.00 H new ATOM 0 HB2 SER A 27 5.597 12.221 7.548 1.00 0.00 H new ATOM 0 HB3 SER A 27 7.128 13.018 7.848 1.00 0.00 H new ATOM 0 HG SER A 27 7.537 12.866 5.775 1.00 0.00 H new ATOM 346 N GLY A 28 7.719 9.221 6.450 1.00 0.00 N ATOM 347 CA GLY A 28 7.496 8.043 5.629 1.00 0.00 C ATOM 348 C GLY A 28 6.781 8.411 4.327 1.00 0.00 C ATOM 349 O GLY A 28 7.270 9.237 3.558 1.00 0.00 O ATOM 0 H GLY A 28 8.613 9.686 6.294 1.00 0.00 H new ATOM 0 HA2 GLY A 28 8.450 7.567 5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.901 7.317 6.182 1.00 0.00 H new ATOM 353 N PHE A 29 5.634 7.780 4.120 1.00 0.00 N ATOM 354 CA PHE A 29 4.847 8.031 2.925 1.00 0.00 C ATOM 355 C PHE A 29 3.384 8.308 3.280 1.00 0.00 C ATOM 356 O PHE A 29 2.524 8.336 2.402 1.00 0.00 O ATOM 357 CB PHE A 29 4.920 6.766 2.068 1.00 0.00 C ATOM 358 CG PHE A 29 6.237 6.607 1.305 1.00 0.00 C ATOM 359 CD1 PHE A 29 6.644 7.576 0.442 1.00 0.00 C ATOM 360 CD2 PHE A 29 7.000 5.496 1.490 1.00 0.00 C ATOM 361 CE1 PHE A 29 7.866 7.428 -0.266 1.00 0.00 C ATOM 362 CE2 PHE A 29 8.222 5.348 0.781 1.00 0.00 C ATOM 363 CZ PHE A 29 8.629 6.318 -0.081 1.00 0.00 C ATOM 0 H PHE A 29 5.231 7.095 4.760 1.00 0.00 H new ATOM 0 HA PHE A 29 5.237 8.902 2.399 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.776 5.896 2.709 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.097 6.775 1.354 1.00 0.00 H new ATOM 0 HD1 PHE A 29 6.038 8.458 0.295 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.677 4.727 2.176 1.00 0.00 H new ATOM 0 HE1 PHE A 29 8.189 8.197 -0.952 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.828 4.466 0.926 1.00 0.00 H new ATOM 0 HZ PHE A 29 9.559 6.206 -0.619 1.00 0.00 H new ATOM 373 N GLY A 30 3.149 8.505 4.569 1.00 0.00 N ATOM 374 CA GLY A 30 1.805 8.779 5.050 1.00 0.00 C ATOM 375 C GLY A 30 0.794 7.807 4.438 1.00 0.00 C ATOM 376 O GLY A 30 -0.145 8.226 3.764 1.00 0.00 O ATOM 0 H GLY A 30 3.866 8.480 5.295 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.780 8.698 6.137 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.527 9.803 4.800 1.00 0.00 H new ATOM 380 N LEU A 31 1.022 6.527 4.694 1.00 0.00 N ATOM 381 CA LEU A 31 0.143 5.493 4.177 1.00 0.00 C ATOM 382 C LEU A 31 0.289 4.231 5.030 1.00 0.00 C ATOM 383 O LEU A 31 1.394 3.881 5.442 1.00 0.00 O ATOM 384 CB LEU A 31 0.406 5.262 2.687 1.00 0.00 C ATOM 385 CG LEU A 31 1.383 4.135 2.345 1.00 0.00 C ATOM 386 CD1 LEU A 31 0.639 2.902 1.829 1.00 0.00 C ATOM 387 CD2 LEU A 31 2.450 4.615 1.359 1.00 0.00 C ATOM 0 H LEU A 31 1.803 6.183 5.253 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.898 5.808 4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.546 5.052 2.199 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.787 6.189 2.258 1.00 0.00 H new ATOM 0 HG LEU A 31 1.898 3.841 3.259 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.357 2.116 1.593 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.050 2.546 2.595 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.080 3.164 0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.131 3.795 1.133 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.971 4.953 0.440 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.009 5.440 1.801 1.00 0.00 H new ATOM 399 N GLN A 32 -0.841 3.583 5.270 1.00 0.00 N ATOM 400 CA GLN A 32 -0.853 2.368 6.066 1.00 0.00 C ATOM 401 C GLN A 32 -1.246 1.169 5.200 1.00 0.00 C ATOM 402 O GLN A 32 -2.266 1.203 4.514 1.00 0.00 O ATOM 403 CB GLN A 32 -1.790 2.508 7.267 1.00 0.00 C ATOM 404 CG GLN A 32 -1.008 2.858 8.535 1.00 0.00 C ATOM 405 CD GLN A 32 -1.139 1.751 9.583 1.00 0.00 C ATOM 406 OE1 GLN A 32 -2.086 0.981 9.596 1.00 0.00 O ATOM 407 NE2 GLN A 32 -0.139 1.713 10.458 1.00 0.00 N ATOM 0 H GLN A 32 -1.756 3.877 4.927 1.00 0.00 H new ATOM 0 HA GLN A 32 0.153 2.199 6.450 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -2.530 3.282 7.067 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -2.336 1.577 7.418 1.00 0.00 H new ATOM 0 HG2 GLN A 32 0.043 3.008 8.289 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -1.376 3.798 8.946 1.00 0.00 H new ATOM 0 HE21 GLN A 32 0.623 2.387 10.391 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -0.134 1.010 11.197 1.00 0.00 H new ATOM 416 N LEU A 33 -0.417 0.138 5.261 1.00 0.00 N ATOM 417 CA LEU A 33 -0.666 -1.069 4.491 1.00 0.00 C ATOM 418 C LEU A 33 -1.248 -2.144 5.411 1.00 0.00 C ATOM 419 O LEU A 33 -0.716 -2.398 6.490 1.00 0.00 O ATOM 420 CB LEU A 33 0.604 -1.508 3.759 1.00 0.00 C ATOM 421 CG LEU A 33 1.085 -0.585 2.638 1.00 0.00 C ATOM 422 CD1 LEU A 33 2.355 -1.132 1.984 1.00 0.00 C ATOM 423 CD2 LEU A 33 -0.026 -0.339 1.615 1.00 0.00 C ATOM 0 H LEU A 33 0.428 0.113 5.832 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.406 -0.880 3.713 1.00 0.00 H new ATOM 0 HB2 LEU A 33 1.406 -1.606 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.433 -2.499 3.338 1.00 0.00 H new ATOM 0 HG LEU A 33 1.339 0.380 3.076 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.675 -0.457 1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.144 -1.213 2.732 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.152 -2.117 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.343 0.320 0.829 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.334 -1.288 1.177 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.879 0.127 2.109 1.00 0.00 H new ATOM 435 N GLN A 34 -2.334 -2.747 4.949 1.00 0.00 N ATOM 436 CA GLN A 34 -2.995 -3.789 5.717 1.00 0.00 C ATOM 437 C GLN A 34 -2.704 -5.162 5.108 1.00 0.00 C ATOM 438 O GLN A 34 -2.979 -5.394 3.931 1.00 0.00 O ATOM 439 CB GLN A 34 -4.501 -3.535 5.803 1.00 0.00 C ATOM 440 CG GLN A 34 -5.289 -4.825 5.567 1.00 0.00 C ATOM 441 CD GLN A 34 -6.737 -4.678 6.040 1.00 0.00 C ATOM 442 OE1 GLN A 34 -7.034 -4.676 7.223 1.00 0.00 O ATOM 443 NE2 GLN A 34 -7.619 -4.555 5.052 1.00 0.00 N ATOM 0 H GLN A 34 -2.772 -2.534 4.053 1.00 0.00 H new ATOM 0 HA GLN A 34 -2.599 -3.772 6.732 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -4.749 -3.127 6.783 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -4.790 -2.788 5.064 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -5.273 -5.076 4.506 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -4.811 -5.649 6.097 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -7.303 -4.565 4.082 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -8.611 -4.451 5.264 1.00 0.00 H new ATOM 452 N GLY A 35 -2.152 -6.037 5.936 1.00 0.00 N ATOM 453 CA GLY A 35 -1.821 -7.380 5.494 1.00 0.00 C ATOM 454 C GLY A 35 -2.051 -8.398 6.613 1.00 0.00 C ATOM 455 O GLY A 35 -2.643 -8.073 7.641 1.00 0.00 O ATOM 0 H GLY A 35 -1.926 -5.841 6.911 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.429 -7.642 4.628 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.780 -7.415 5.174 1.00 0.00 H new ATOM 459 N GLY A 36 -1.569 -9.610 6.375 1.00 0.00 N ATOM 460 CA GLY A 36 -1.715 -10.677 7.350 1.00 0.00 C ATOM 461 C GLY A 36 -1.524 -10.149 8.774 1.00 0.00 C ATOM 462 O GLY A 36 -0.753 -9.216 8.996 1.00 0.00 O ATOM 0 H GLY A 36 -1.078 -9.876 5.522 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.703 -11.128 7.255 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.985 -11.461 7.148 1.00 0.00 H new ATOM 466 N ILE A 37 -2.240 -10.768 9.701 1.00 0.00 N ATOM 467 CA ILE A 37 -2.159 -10.372 11.097 1.00 0.00 C ATOM 468 C ILE A 37 -0.719 -10.535 11.587 1.00 0.00 C ATOM 469 O ILE A 37 -0.179 -9.648 12.245 1.00 0.00 O ATOM 470 CB ILE A 37 -3.184 -11.142 11.932 1.00 0.00 C ATOM 471 CG1 ILE A 37 -4.611 -10.819 11.484 1.00 0.00 C ATOM 472 CG2 ILE A 37 -2.980 -10.882 13.426 1.00 0.00 C ATOM 473 CD1 ILE A 37 -5.609 -11.821 12.067 1.00 0.00 C ATOM 0 H ILE A 37 -2.879 -11.541 9.513 1.00 0.00 H new ATOM 0 HA ILE A 37 -2.416 -9.319 11.210 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.028 -12.208 11.766 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.876 -9.810 11.801 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.667 -10.836 10.396 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -3.721 -11.441 13.997 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -1.980 -11.202 13.718 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -3.093 -9.817 13.629 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -6.615 -11.568 11.733 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -5.356 -12.826 11.728 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -5.568 -11.784 13.156 1.00 0.00 H new ATOM 485 N PHE A 38 -0.138 -11.676 11.246 1.00 0.00 N ATOM 486 CA PHE A 38 1.229 -11.967 11.643 1.00 0.00 C ATOM 487 C PHE A 38 2.228 -11.367 10.651 1.00 0.00 C ATOM 488 O PHE A 38 2.320 -11.814 9.510 1.00 0.00 O ATOM 489 CB PHE A 38 1.381 -13.490 11.642 1.00 0.00 C ATOM 490 CG PHE A 38 0.303 -14.223 12.443 1.00 0.00 C ATOM 491 CD1 PHE A 38 0.419 -14.336 13.794 1.00 0.00 C ATOM 492 CD2 PHE A 38 -0.770 -14.762 11.805 1.00 0.00 C ATOM 493 CE1 PHE A 38 -0.581 -15.016 14.537 1.00 0.00 C ATOM 494 CE2 PHE A 38 -1.770 -15.443 12.549 1.00 0.00 C ATOM 495 CZ PHE A 38 -1.655 -15.555 13.899 1.00 0.00 C ATOM 0 H PHE A 38 -0.589 -12.410 10.699 1.00 0.00 H new ATOM 0 HA PHE A 38 1.430 -11.538 12.625 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.359 -13.846 10.612 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.359 -13.748 12.048 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.272 -13.908 14.301 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.862 -14.672 10.733 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.489 -15.106 15.609 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.622 -15.872 12.042 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.416 -16.072 14.465 1.00 0.00 H new ATOM 505 N ALA A 39 2.950 -10.362 11.124 1.00 0.00 N ATOM 506 CA ALA A 39 3.939 -9.695 10.293 1.00 0.00 C ATOM 507 C ALA A 39 4.699 -10.740 9.475 1.00 0.00 C ATOM 508 O ALA A 39 4.979 -10.527 8.296 1.00 0.00 O ATOM 509 CB ALA A 39 4.866 -8.857 11.176 1.00 0.00 C ATOM 0 H ALA A 39 2.870 -9.993 12.072 1.00 0.00 H new ATOM 0 HA ALA A 39 3.456 -9.015 9.591 1.00 0.00 H new ATOM 0 HB1 ALA A 39 5.608 -8.357 10.553 1.00 0.00 H new ATOM 0 HB2 ALA A 39 4.280 -8.111 11.713 1.00 0.00 H new ATOM 0 HB3 ALA A 39 5.371 -9.506 11.892 1.00 0.00 H new ATOM 515 N THR A 40 5.012 -11.847 10.133 1.00 0.00 N ATOM 516 CA THR A 40 5.735 -12.925 9.481 1.00 0.00 C ATOM 517 C THR A 40 4.844 -13.615 8.446 1.00 0.00 C ATOM 518 O THR A 40 3.791 -13.095 8.083 1.00 0.00 O ATOM 519 CB THR A 40 6.252 -13.872 10.566 1.00 0.00 C ATOM 520 OG1 THR A 40 5.087 -14.567 11.003 1.00 0.00 O ATOM 521 CG2 THR A 40 6.731 -13.127 11.813 1.00 0.00 C ATOM 0 H THR A 40 4.778 -12.020 11.111 1.00 0.00 H new ATOM 0 HA THR A 40 6.592 -12.546 8.925 1.00 0.00 H new ATOM 0 HB THR A 40 7.069 -14.472 10.165 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.331 -15.204 11.706 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.087 -13.845 12.551 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.542 -12.451 11.544 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.905 -12.554 12.234 1.00 0.00 H new ATOM 529 N GLU A 41 5.300 -14.777 8.000 1.00 0.00 N ATOM 530 CA GLU A 41 4.557 -15.544 7.015 1.00 0.00 C ATOM 531 C GLU A 41 4.475 -14.774 5.695 1.00 0.00 C ATOM 532 O GLU A 41 4.059 -13.616 5.673 1.00 0.00 O ATOM 533 CB GLU A 41 3.162 -15.896 7.532 1.00 0.00 C ATOM 534 CG GLU A 41 3.245 -16.682 8.843 1.00 0.00 C ATOM 535 CD GLU A 41 2.634 -18.076 8.686 1.00 0.00 C ATOM 536 OE1 GLU A 41 1.483 -18.140 8.201 1.00 0.00 O ATOM 537 OE2 GLU A 41 3.331 -19.046 9.054 1.00 0.00 O ATOM 0 H GLU A 41 6.175 -15.205 8.303 1.00 0.00 H new ATOM 0 HA GLU A 41 5.088 -16.479 6.836 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.587 -14.983 7.687 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.631 -16.485 6.784 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.286 -16.770 9.153 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.723 -16.139 9.631 1.00 0.00 H new ATOM 544 N THR A 42 4.877 -15.447 4.627 1.00 0.00 N ATOM 545 CA THR A 42 4.853 -14.840 3.307 1.00 0.00 C ATOM 546 C THR A 42 3.475 -14.240 3.021 1.00 0.00 C ATOM 547 O THR A 42 2.475 -14.670 3.594 1.00 0.00 O ATOM 548 CB THR A 42 5.276 -15.903 2.291 1.00 0.00 C ATOM 549 OG1 THR A 42 6.577 -16.295 2.720 1.00 0.00 O ATOM 550 CG2 THR A 42 5.504 -15.320 0.895 1.00 0.00 C ATOM 0 H THR A 42 5.221 -16.407 4.649 1.00 0.00 H new ATOM 0 HA THR A 42 5.555 -14.008 3.241 1.00 0.00 H new ATOM 0 HB THR A 42 4.513 -16.680 2.240 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.926 -16.984 2.117 1.00 0.00 H new ATOM 0 HG21 THR A 42 5.802 -16.116 0.213 1.00 0.00 H new ATOM 0 HG22 THR A 42 4.582 -14.862 0.537 1.00 0.00 H new ATOM 0 HG23 THR A 42 6.290 -14.566 0.939 1.00 0.00 H new ATOM 558 N LEU A 43 3.467 -13.255 2.135 1.00 0.00 N ATOM 559 CA LEU A 43 2.228 -12.591 1.765 1.00 0.00 C ATOM 560 C LEU A 43 1.621 -13.294 0.550 1.00 0.00 C ATOM 561 O LEU A 43 2.126 -13.164 -0.564 1.00 0.00 O ATOM 562 CB LEU A 43 2.465 -11.094 1.555 1.00 0.00 C ATOM 563 CG LEU A 43 2.440 -10.228 2.816 1.00 0.00 C ATOM 564 CD1 LEU A 43 2.514 -8.741 2.461 1.00 0.00 C ATOM 565 CD2 LEU A 43 1.220 -10.551 3.680 1.00 0.00 C ATOM 0 H LEU A 43 4.299 -12.901 1.662 1.00 0.00 H new ATOM 0 HA LEU A 43 1.500 -12.665 2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.431 -10.964 1.068 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.708 -10.720 0.866 1.00 0.00 H new ATOM 0 HG LEU A 43 3.324 -10.462 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.495 -8.147 3.375 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.438 -8.542 1.919 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.662 -8.473 1.836 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.227 -9.921 4.570 1.00 0.00 H new ATOM 0 HD22 LEU A 43 0.310 -10.363 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.252 -11.599 3.977 1.00 0.00 H new ATOM 577 N SER A 44 0.545 -14.024 0.805 1.00 0.00 N ATOM 578 CA SER A 44 -0.137 -14.748 -0.254 1.00 0.00 C ATOM 579 C SER A 44 -0.873 -13.767 -1.168 1.00 0.00 C ATOM 580 O SER A 44 -1.116 -14.064 -2.337 1.00 0.00 O ATOM 581 CB SER A 44 -1.115 -15.774 0.321 1.00 0.00 C ATOM 582 OG SER A 44 -0.952 -17.059 -0.274 1.00 0.00 O ATOM 0 H SER A 44 0.129 -14.130 1.730 1.00 0.00 H new ATOM 0 HA SER A 44 0.611 -15.286 -0.836 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.967 -15.852 1.398 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.137 -15.429 0.164 1.00 0.00 H new ATOM 0 HG SER A 44 -1.593 -17.686 0.121 1.00 0.00 H new ATOM 588 N SER A 45 -1.209 -12.618 -0.601 1.00 0.00 N ATOM 589 CA SER A 45 -1.913 -11.591 -1.351 1.00 0.00 C ATOM 590 C SER A 45 -1.277 -10.224 -1.090 1.00 0.00 C ATOM 591 O SER A 45 -0.525 -10.058 -0.130 1.00 0.00 O ATOM 592 CB SER A 45 -3.398 -11.564 -0.986 1.00 0.00 C ATOM 593 OG SER A 45 -3.743 -10.403 -0.235 1.00 0.00 O ATOM 0 H SER A 45 -1.007 -12.375 0.369 1.00 0.00 H new ATOM 0 HA SER A 45 -1.832 -11.826 -2.412 1.00 0.00 H new ATOM 0 HB2 SER A 45 -3.996 -11.597 -1.897 1.00 0.00 H new ATOM 0 HB3 SER A 45 -3.646 -12.455 -0.410 1.00 0.00 H new ATOM 0 HG SER A 45 -4.700 -10.423 -0.023 1.00 0.00 H new ATOM 599 N PRO A 46 -1.612 -9.254 -1.983 1.00 0.00 N ATOM 600 CA PRO A 46 -1.082 -7.907 -1.858 1.00 0.00 C ATOM 601 C PRO A 46 -1.774 -7.149 -0.724 1.00 0.00 C ATOM 602 O PRO A 46 -2.967 -7.331 -0.487 1.00 0.00 O ATOM 603 CB PRO A 46 -1.303 -7.270 -3.220 1.00 0.00 C ATOM 604 CG PRO A 46 -2.361 -8.117 -3.910 1.00 0.00 C ATOM 605 CD PRO A 46 -2.499 -9.415 -3.131 1.00 0.00 C ATOM 0 HA PRO A 46 -0.025 -7.893 -1.593 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.635 -6.237 -3.119 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.379 -7.253 -3.798 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.313 -7.587 -3.941 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -2.075 -8.320 -4.942 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -3.529 -9.580 -2.815 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -2.210 -10.273 -3.737 1.00 0.00 H new ATOM 613 N PRO A 47 -0.974 -6.291 -0.034 1.00 0.00 N ATOM 614 CA PRO A 47 -1.497 -5.504 1.070 1.00 0.00 C ATOM 615 C PRO A 47 -2.357 -4.346 0.559 1.00 0.00 C ATOM 616 O PRO A 47 -2.047 -3.745 -0.468 1.00 0.00 O ATOM 617 CB PRO A 47 -0.270 -5.040 1.837 1.00 0.00 C ATOM 618 CG PRO A 47 0.901 -5.190 0.881 1.00 0.00 C ATOM 619 CD PRO A 47 0.443 -6.049 -0.286 1.00 0.00 C ATOM 0 HA PRO A 47 -2.162 -6.076 1.717 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -0.380 -4.005 2.160 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -0.121 -5.640 2.735 1.00 0.00 H new ATOM 0 HG2 PRO A 47 1.234 -4.214 0.529 1.00 0.00 H new ATOM 0 HG3 PRO A 47 1.749 -5.653 1.386 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.595 -5.538 -1.237 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.002 -6.983 -0.333 1.00 0.00 H new ATOM 627 N LEU A 48 -3.420 -4.069 1.299 1.00 0.00 N ATOM 628 CA LEU A 48 -4.327 -2.994 0.934 1.00 0.00 C ATOM 629 C LEU A 48 -4.119 -1.813 1.883 1.00 0.00 C ATOM 630 O LEU A 48 -3.588 -1.980 2.980 1.00 0.00 O ATOM 631 CB LEU A 48 -5.769 -3.502 0.890 1.00 0.00 C ATOM 632 CG LEU A 48 -5.961 -4.939 0.400 1.00 0.00 C ATOM 633 CD1 LEU A 48 -6.928 -5.703 1.306 1.00 0.00 C ATOM 634 CD2 LEU A 48 -6.406 -4.964 -1.064 1.00 0.00 C ATOM 0 H LEU A 48 -3.674 -4.571 2.150 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.109 -2.636 -0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.192 -3.421 1.891 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.347 -2.839 0.246 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.999 -5.449 0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.047 -6.721 0.935 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -6.531 -5.730 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -7.896 -5.203 1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.535 -5.997 -1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.351 -4.431 -1.166 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -5.649 -4.482 -1.683 1.00 0.00 H new ATOM 646 N VAL A 49 -4.548 -0.645 1.427 1.00 0.00 N ATOM 647 CA VAL A 49 -4.416 0.563 2.223 1.00 0.00 C ATOM 648 C VAL A 49 -5.403 0.511 3.391 1.00 0.00 C ATOM 649 O VAL A 49 -6.549 0.097 3.222 1.00 0.00 O ATOM 650 CB VAL A 49 -4.604 1.796 1.336 1.00 0.00 C ATOM 651 CG1 VAL A 49 -4.840 3.049 2.182 1.00 0.00 C ATOM 652 CG2 VAL A 49 -3.410 1.984 0.398 1.00 0.00 C ATOM 0 H VAL A 49 -4.987 -0.510 0.516 1.00 0.00 H new ATOM 0 HA VAL A 49 -3.415 0.633 2.648 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.490 1.635 0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -4.970 3.911 1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.736 2.915 2.789 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.982 3.215 2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.569 2.867 -0.221 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.502 2.112 0.987 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.307 1.107 -0.241 1.00 0.00 H new ATOM 662 N CYS A 50 -4.922 0.936 4.550 1.00 0.00 N ATOM 663 CA CYS A 50 -5.747 0.942 5.745 1.00 0.00 C ATOM 664 C CYS A 50 -6.063 2.396 6.104 1.00 0.00 C ATOM 665 O CYS A 50 -7.215 2.739 6.364 1.00 0.00 O ATOM 666 CB CYS A 50 -5.073 0.203 6.903 1.00 0.00 C ATOM 667 SG CYS A 50 -3.481 -0.509 6.347 1.00 0.00 S ATOM 0 H CYS A 50 -3.971 1.279 4.686 1.00 0.00 H new ATOM 0 HA CYS A 50 -6.676 0.406 5.550 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -4.904 0.888 7.734 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -5.727 -0.588 7.270 1.00 0.00 H new ATOM 0 HG CYS A 50 -3.224 -0.106 5.138 1.00 0.00 H new ATOM 673 N PHE A 51 -5.018 3.211 6.105 1.00 0.00 N ATOM 674 CA PHE A 51 -5.169 4.620 6.427 1.00 0.00 C ATOM 675 C PHE A 51 -4.206 5.477 5.603 1.00 0.00 C ATOM 676 O PHE A 51 -3.184 4.985 5.127 1.00 0.00 O ATOM 677 CB PHE A 51 -4.832 4.779 7.911 1.00 0.00 C ATOM 678 CG PHE A 51 -4.586 6.226 8.342 1.00 0.00 C ATOM 679 CD1 PHE A 51 -5.638 7.041 8.620 1.00 0.00 C ATOM 680 CD2 PHE A 51 -3.314 6.697 8.448 1.00 0.00 C ATOM 681 CE1 PHE A 51 -5.409 8.384 9.021 1.00 0.00 C ATOM 682 CE2 PHE A 51 -3.086 8.040 8.848 1.00 0.00 C ATOM 683 CZ PHE A 51 -4.138 8.855 9.126 1.00 0.00 C ATOM 0 H PHE A 51 -4.064 2.923 5.888 1.00 0.00 H new ATOM 0 HA PHE A 51 -6.185 4.946 6.204 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -5.649 4.368 8.504 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.945 4.188 8.137 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.648 6.667 8.536 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.478 6.050 8.228 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.245 9.031 9.243 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -2.076 8.414 8.931 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.964 9.877 9.430 1.00 0.00 H new ATOM 693 N ILE A 52 -4.566 6.744 5.460 1.00 0.00 N ATOM 694 CA ILE A 52 -3.747 7.674 4.702 1.00 0.00 C ATOM 695 C ILE A 52 -3.612 8.983 5.484 1.00 0.00 C ATOM 696 O ILE A 52 -4.612 9.578 5.882 1.00 0.00 O ATOM 697 CB ILE A 52 -4.309 7.856 3.291 1.00 0.00 C ATOM 698 CG1 ILE A 52 -3.918 6.684 2.389 1.00 0.00 C ATOM 699 CG2 ILE A 52 -3.883 9.202 2.700 1.00 0.00 C ATOM 700 CD1 ILE A 52 -4.402 6.910 0.955 1.00 0.00 C ATOM 0 H ILE A 52 -5.414 7.148 5.857 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.741 7.276 4.570 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.397 7.863 3.355 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.835 6.561 2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.346 5.761 2.780 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -4.296 9.306 1.697 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.254 10.010 3.331 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.795 9.250 2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.111 6.062 0.335 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.488 7.008 0.949 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -3.953 7.821 0.559 1.00 0.00 H new ATOM 712 N GLU A 53 -2.367 9.391 5.681 1.00 0.00 N ATOM 713 CA GLU A 53 -2.088 10.618 6.408 1.00 0.00 C ATOM 714 C GLU A 53 -2.613 11.827 5.630 1.00 0.00 C ATOM 715 O GLU A 53 -2.598 11.833 4.400 1.00 0.00 O ATOM 716 CB GLU A 53 -0.592 10.758 6.694 1.00 0.00 C ATOM 717 CG GLU A 53 -0.261 10.304 8.117 1.00 0.00 C ATOM 718 CD GLU A 53 0.664 11.306 8.811 1.00 0.00 C ATOM 719 OE1 GLU A 53 0.313 12.506 8.799 1.00 0.00 O ATOM 720 OE2 GLU A 53 1.703 10.850 9.337 1.00 0.00 O ATOM 0 H GLU A 53 -1.540 8.894 5.350 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.605 10.575 7.367 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -0.024 10.164 5.978 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.288 11.796 6.560 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.181 10.195 8.691 1.00 0.00 H new ATOM 0 HG3 GLU A 53 0.215 9.324 8.088 1.00 0.00 H new ATOM 727 N PRO A 54 -3.077 12.848 6.400 1.00 0.00 N ATOM 728 CA PRO A 54 -3.606 14.059 5.796 1.00 0.00 C ATOM 729 C PRO A 54 -2.477 14.937 5.250 1.00 0.00 C ATOM 730 O PRO A 54 -1.449 15.109 5.903 1.00 0.00 O ATOM 731 CB PRO A 54 -4.402 14.734 6.901 1.00 0.00 C ATOM 732 CG PRO A 54 -3.910 14.122 8.203 1.00 0.00 C ATOM 733 CD PRO A 54 -3.111 12.876 7.859 1.00 0.00 C ATOM 0 HA PRO A 54 -4.240 13.857 4.933 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.245 15.813 6.893 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.471 14.567 6.770 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.291 14.834 8.750 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.751 13.870 8.848 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -2.106 12.922 8.278 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.583 11.980 8.261 1.00 0.00 H new ATOM 741 N ASP A 55 -2.709 15.470 4.059 1.00 0.00 N ATOM 742 CA ASP A 55 -1.725 16.326 3.419 1.00 0.00 C ATOM 743 C ASP A 55 -0.462 15.513 3.125 1.00 0.00 C ATOM 744 O ASP A 55 0.580 16.076 2.795 1.00 0.00 O ATOM 745 CB ASP A 55 -1.334 17.493 4.328 1.00 0.00 C ATOM 746 CG ASP A 55 -2.507 18.322 4.855 1.00 0.00 C ATOM 747 OD1 ASP A 55 -3.184 17.823 5.780 1.00 0.00 O ATOM 748 OD2 ASP A 55 -2.701 19.435 4.322 1.00 0.00 O ATOM 0 H ASP A 55 -3.564 15.326 3.521 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.165 16.716 2.501 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.775 17.101 5.178 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -0.660 18.151 3.780 1.00 0.00 H new ATOM 753 N SER A 56 -0.598 14.201 3.255 1.00 0.00 N ATOM 754 CA SER A 56 0.519 13.305 3.008 1.00 0.00 C ATOM 755 C SER A 56 0.647 13.030 1.508 1.00 0.00 C ATOM 756 O SER A 56 -0.134 13.546 0.710 1.00 0.00 O ATOM 757 CB SER A 56 0.353 11.993 3.776 1.00 0.00 C ATOM 758 OG SER A 56 -0.056 10.925 2.926 1.00 0.00 O ATOM 0 H SER A 56 -1.465 13.737 3.528 1.00 0.00 H new ATOM 0 HA SER A 56 1.430 13.788 3.361 1.00 0.00 H new ATOM 0 HB2 SER A 56 1.296 11.733 4.257 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.383 12.128 4.569 1.00 0.00 H new ATOM 0 HG SER A 56 -0.086 10.091 3.440 1.00 0.00 H new ATOM 764 N PRO A 57 1.664 12.197 1.161 1.00 0.00 N ATOM 765 CA PRO A 57 1.905 11.847 -0.228 1.00 0.00 C ATOM 766 C PRO A 57 0.865 10.842 -0.728 1.00 0.00 C ATOM 767 O PRO A 57 0.308 11.007 -1.812 1.00 0.00 O ATOM 768 CB PRO A 57 3.322 11.299 -0.257 1.00 0.00 C ATOM 769 CG PRO A 57 3.655 10.929 1.180 1.00 0.00 C ATOM 770 CD PRO A 57 2.609 11.568 2.080 1.00 0.00 C ATOM 0 HA PRO A 57 1.809 12.701 -0.899 1.00 0.00 H new ATOM 0 HB2 PRO A 57 3.391 10.429 -0.910 1.00 0.00 H new ATOM 0 HB3 PRO A 57 4.021 12.042 -0.641 1.00 0.00 H new ATOM 0 HG2 PRO A 57 3.656 9.846 1.305 1.00 0.00 H new ATOM 0 HG3 PRO A 57 4.652 11.281 1.444 1.00 0.00 H new ATOM 0 HD2 PRO A 57 2.117 10.824 2.706 1.00 0.00 H new ATOM 0 HD3 PRO A 57 3.058 12.301 2.750 1.00 0.00 H new ATOM 778 N ALA A 58 0.635 9.823 0.086 1.00 0.00 N ATOM 779 CA ALA A 58 -0.328 8.791 -0.260 1.00 0.00 C ATOM 780 C ALA A 58 -1.688 9.439 -0.532 1.00 0.00 C ATOM 781 O ALA A 58 -2.522 8.868 -1.232 1.00 0.00 O ATOM 782 CB ALA A 58 -0.391 7.753 0.863 1.00 0.00 C ATOM 0 H ALA A 58 1.099 9.689 0.985 1.00 0.00 H new ATOM 0 HA ALA A 58 -0.023 8.271 -1.168 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -1.113 6.979 0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.592 7.302 0.997 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -0.697 8.238 1.790 1.00 0.00 H new ATOM 788 N GLU A 59 -1.868 10.622 0.036 1.00 0.00 N ATOM 789 CA GLU A 59 -3.111 11.353 -0.136 1.00 0.00 C ATOM 790 C GLU A 59 -3.010 12.298 -1.336 1.00 0.00 C ATOM 791 O GLU A 59 -3.939 12.391 -2.137 1.00 0.00 O ATOM 792 CB GLU A 59 -3.477 12.121 1.136 1.00 0.00 C ATOM 793 CG GLU A 59 -4.857 12.768 1.008 1.00 0.00 C ATOM 794 CD GLU A 59 -5.928 11.719 0.702 1.00 0.00 C ATOM 795 OE1 GLU A 59 -6.462 11.151 1.679 1.00 0.00 O ATOM 796 OE2 GLU A 59 -6.189 11.510 -0.502 1.00 0.00 O ATOM 0 H GLU A 59 -1.173 11.092 0.616 1.00 0.00 H new ATOM 0 HA GLU A 59 -3.908 10.634 -0.329 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.467 11.443 1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.728 12.889 1.330 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -5.106 13.288 1.933 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.840 13.517 0.216 1.00 0.00 H new ATOM 803 N ARG A 60 -1.874 12.973 -1.422 1.00 0.00 N ATOM 804 CA ARG A 60 -1.639 13.907 -2.511 1.00 0.00 C ATOM 805 C ARG A 60 -1.918 13.234 -3.856 1.00 0.00 C ATOM 806 O ARG A 60 -2.409 13.875 -4.784 1.00 0.00 O ATOM 807 CB ARG A 60 -0.198 14.420 -2.495 1.00 0.00 C ATOM 808 CG ARG A 60 -0.048 15.604 -1.537 1.00 0.00 C ATOM 809 CD ARG A 60 0.849 16.687 -2.140 1.00 0.00 C ATOM 810 NE ARG A 60 0.628 17.974 -1.444 1.00 0.00 N ATOM 811 CZ ARG A 60 1.324 19.092 -1.691 1.00 0.00 C ATOM 812 NH1 ARG A 60 2.291 19.087 -2.619 1.00 0.00 N ATOM 813 NH2 ARG A 60 1.054 20.214 -1.010 1.00 0.00 N ATOM 0 H ARG A 60 -1.106 12.892 -0.756 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.315 14.751 -2.376 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.474 13.617 -2.194 1.00 0.00 H new ATOM 0 HB3 ARG A 60 0.096 14.722 -3.500 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -1.029 16.022 -1.314 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.375 15.261 -0.593 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.895 16.393 -2.055 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.635 16.798 -3.203 1.00 0.00 H new ATOM 0 HE ARG A 60 -0.100 18.013 -0.731 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.497 18.233 -3.137 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.821 19.938 -2.808 1.00 0.00 H new ATOM 0 HH21 ARG A 60 0.318 20.217 -0.303 1.00 0.00 H new ATOM 0 HH22 ARG A 60 1.584 21.065 -1.198 1.00 0.00 H new ATOM 827 N CYS A 61 -1.594 11.951 -3.919 1.00 0.00 N ATOM 828 CA CYS A 61 -1.804 11.185 -5.136 1.00 0.00 C ATOM 829 C CYS A 61 -3.307 11.136 -5.419 1.00 0.00 C ATOM 830 O CYS A 61 -3.721 11.035 -6.573 1.00 0.00 O ATOM 831 CB CYS A 61 -1.197 9.784 -5.034 1.00 0.00 C ATOM 832 SG CYS A 61 -0.609 9.236 -6.678 1.00 0.00 S ATOM 0 H CYS A 61 -1.188 11.422 -3.147 1.00 0.00 H new ATOM 0 HA CYS A 61 -1.294 11.671 -5.968 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -0.369 9.788 -4.325 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -1.940 9.084 -4.652 1.00 0.00 H new ATOM 0 HG CYS A 61 -0.752 7.948 -6.783 1.00 0.00 H new ATOM 838 N GLY A 62 -4.082 11.211 -4.347 1.00 0.00 N ATOM 839 CA GLY A 62 -5.529 11.176 -4.466 1.00 0.00 C ATOM 840 C GLY A 62 -6.009 9.799 -4.931 1.00 0.00 C ATOM 841 O GLY A 62 -6.775 9.137 -4.233 1.00 0.00 O ATOM 0 H GLY A 62 -3.735 11.296 -3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -5.982 11.417 -3.505 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -5.858 11.937 -5.173 1.00 0.00 H new ATOM 845 N LEU A 63 -5.537 9.410 -6.106 1.00 0.00 N ATOM 846 CA LEU A 63 -5.908 8.124 -6.672 1.00 0.00 C ATOM 847 C LEU A 63 -5.789 7.044 -5.595 1.00 0.00 C ATOM 848 O LEU A 63 -6.649 6.171 -5.489 1.00 0.00 O ATOM 849 CB LEU A 63 -5.084 7.834 -7.928 1.00 0.00 C ATOM 850 CG LEU A 63 -4.204 6.583 -7.879 1.00 0.00 C ATOM 851 CD1 LEU A 63 -5.036 5.319 -8.103 1.00 0.00 C ATOM 852 CD2 LEU A 63 -3.044 6.689 -8.871 1.00 0.00 C ATOM 0 H LEU A 63 -4.901 9.962 -6.682 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.948 8.137 -6.997 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.767 7.741 -8.773 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.446 8.695 -8.127 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.769 6.510 -6.882 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.387 4.444 -8.063 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.797 5.242 -7.326 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.518 5.369 -9.079 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.434 5.787 -8.816 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.438 6.799 -9.881 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.432 7.556 -8.624 1.00 0.00 H new ATOM 864 N LEU A 64 -4.716 7.138 -4.824 1.00 0.00 N ATOM 865 CA LEU A 64 -4.473 6.180 -3.759 1.00 0.00 C ATOM 866 C LEU A 64 -5.511 6.379 -2.653 1.00 0.00 C ATOM 867 O LEU A 64 -5.745 7.502 -2.211 1.00 0.00 O ATOM 868 CB LEU A 64 -3.027 6.278 -3.269 1.00 0.00 C ATOM 869 CG LEU A 64 -2.429 4.998 -2.682 1.00 0.00 C ATOM 870 CD1 LEU A 64 -0.917 4.944 -2.910 1.00 0.00 C ATOM 871 CD2 LEU A 64 -2.791 4.852 -1.203 1.00 0.00 C ATOM 0 H LEU A 64 -4.005 7.863 -4.916 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.592 5.162 -4.129 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.403 6.598 -4.103 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.973 7.061 -2.512 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.864 4.147 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.517 4.024 -2.483 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.709 4.968 -3.980 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.446 5.802 -2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.354 3.934 -0.810 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.403 5.706 -0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.875 4.812 -1.096 1.00 0.00 H new ATOM 883 N GLN A 65 -6.108 5.270 -2.239 1.00 0.00 N ATOM 884 CA GLN A 65 -7.116 5.309 -1.194 1.00 0.00 C ATOM 885 C GLN A 65 -7.192 3.958 -0.480 1.00 0.00 C ATOM 886 O GLN A 65 -6.614 2.975 -0.941 1.00 0.00 O ATOM 887 CB GLN A 65 -8.480 5.707 -1.762 1.00 0.00 C ATOM 888 CG GLN A 65 -8.833 4.858 -2.984 1.00 0.00 C ATOM 889 CD GLN A 65 -9.951 5.510 -3.800 1.00 0.00 C ATOM 890 OE1 GLN A 65 -10.099 6.721 -3.842 1.00 0.00 O ATOM 891 NE2 GLN A 65 -10.728 4.644 -4.444 1.00 0.00 N ATOM 0 H GLN A 65 -5.912 4.340 -2.609 1.00 0.00 H new ATOM 0 HA GLN A 65 -6.828 6.067 -0.466 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -9.246 5.585 -0.996 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -8.470 6.761 -2.038 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -7.949 4.729 -3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -9.144 3.864 -2.663 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -10.549 3.643 -4.366 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -11.503 4.981 -5.016 1.00 0.00 H new ATOM 900 N VAL A 66 -7.911 3.952 0.633 1.00 0.00 N ATOM 901 CA VAL A 66 -8.070 2.738 1.415 1.00 0.00 C ATOM 902 C VAL A 66 -8.781 1.681 0.568 1.00 0.00 C ATOM 903 O VAL A 66 -9.809 1.962 -0.047 1.00 0.00 O ATOM 904 CB VAL A 66 -8.803 3.049 2.722 1.00 0.00 C ATOM 905 CG1 VAL A 66 -9.159 1.763 3.470 1.00 0.00 C ATOM 906 CG2 VAL A 66 -7.976 3.987 3.604 1.00 0.00 C ATOM 0 H VAL A 66 -8.390 4.769 1.012 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.097 2.332 1.692 1.00 0.00 H new ATOM 0 HB VAL A 66 -9.733 3.559 2.472 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.679 2.012 4.395 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.805 1.146 2.846 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.247 1.213 3.703 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -8.519 4.192 4.526 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -7.022 3.516 3.842 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.797 4.922 3.073 1.00 0.00 H new ATOM 916 N GLY A 67 -8.207 0.487 0.564 1.00 0.00 N ATOM 917 CA GLY A 67 -8.773 -0.614 -0.198 1.00 0.00 C ATOM 918 C GLY A 67 -7.880 -0.975 -1.386 1.00 0.00 C ATOM 919 O GLY A 67 -7.852 -2.126 -1.819 1.00 0.00 O ATOM 0 H GLY A 67 -7.355 0.257 1.076 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -8.894 -1.484 0.448 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.766 -0.341 -0.555 1.00 0.00 H new ATOM 923 N ASP A 68 -7.171 0.030 -1.880 1.00 0.00 N ATOM 924 CA ASP A 68 -6.279 -0.167 -3.010 1.00 0.00 C ATOM 925 C ASP A 68 -5.409 -1.400 -2.758 1.00 0.00 C ATOM 926 O ASP A 68 -5.461 -1.992 -1.681 1.00 0.00 O ATOM 927 CB ASP A 68 -5.353 1.036 -3.197 1.00 0.00 C ATOM 928 CG ASP A 68 -6.033 2.299 -3.727 1.00 0.00 C ATOM 929 OD1 ASP A 68 -7.232 2.470 -3.420 1.00 0.00 O ATOM 930 OD2 ASP A 68 -5.337 3.067 -4.427 1.00 0.00 O ATOM 0 H ASP A 68 -7.196 0.983 -1.518 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.890 -0.294 -3.904 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.885 1.268 -2.240 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -4.553 0.757 -3.883 1.00 0.00 H new ATOM 935 N ARG A 69 -4.628 -1.751 -3.769 1.00 0.00 N ATOM 936 CA ARG A 69 -3.748 -2.902 -3.671 1.00 0.00 C ATOM 937 C ARG A 69 -2.299 -2.488 -3.940 1.00 0.00 C ATOM 938 O ARG A 69 -2.050 -1.435 -4.526 1.00 0.00 O ATOM 939 CB ARG A 69 -4.152 -3.992 -4.666 1.00 0.00 C ATOM 940 CG ARG A 69 -5.478 -4.638 -4.262 1.00 0.00 C ATOM 941 CD ARG A 69 -6.594 -4.258 -5.238 1.00 0.00 C ATOM 942 NE ARG A 69 -6.469 -5.049 -6.482 1.00 0.00 N ATOM 943 CZ ARG A 69 -7.383 -5.057 -7.462 1.00 0.00 C ATOM 944 NH1 ARG A 69 -8.495 -4.317 -7.348 1.00 0.00 N ATOM 945 NH2 ARG A 69 -7.186 -5.806 -8.556 1.00 0.00 N ATOM 0 H ARG A 69 -4.587 -1.258 -4.661 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.835 -3.299 -2.660 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -4.241 -3.563 -5.664 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.373 -4.752 -4.714 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.366 -5.722 -4.237 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.748 -4.322 -3.254 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -7.566 -4.438 -4.779 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -6.541 -3.194 -5.467 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.635 -5.624 -6.601 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.646 -3.748 -6.515 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -9.190 -4.323 -8.094 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.340 -6.370 -8.643 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.882 -5.812 -9.302 1.00 0.00 H new ATOM 959 N VAL A 70 -1.383 -3.336 -3.498 1.00 0.00 N ATOM 960 CA VAL A 70 0.034 -3.071 -3.684 1.00 0.00 C ATOM 961 C VAL A 70 0.729 -4.349 -4.156 1.00 0.00 C ATOM 962 O VAL A 70 1.107 -5.192 -3.344 1.00 0.00 O ATOM 963 CB VAL A 70 0.633 -2.506 -2.395 1.00 0.00 C ATOM 964 CG1 VAL A 70 2.160 -2.446 -2.481 1.00 0.00 C ATOM 965 CG2 VAL A 70 0.047 -1.129 -2.075 1.00 0.00 C ATOM 0 H VAL A 70 -1.594 -4.207 -3.011 1.00 0.00 H new ATOM 0 HA VAL A 70 0.184 -2.316 -4.455 1.00 0.00 H new ATOM 0 HB VAL A 70 0.369 -3.179 -1.579 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.561 -2.041 -1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.555 -3.449 -2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 70 2.453 -1.805 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 70 0.490 -0.750 -1.154 1.00 0.00 H new ATOM 0 HG22 VAL A 70 0.266 -0.442 -2.892 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.033 -1.213 -1.951 1.00 0.00 H new ATOM 975 N LEU A 71 0.878 -4.453 -5.469 1.00 0.00 N ATOM 976 CA LEU A 71 1.522 -5.614 -6.060 1.00 0.00 C ATOM 977 C LEU A 71 3.002 -5.624 -5.672 1.00 0.00 C ATOM 978 O LEU A 71 3.474 -6.566 -5.037 1.00 0.00 O ATOM 979 CB LEU A 71 1.282 -5.649 -7.570 1.00 0.00 C ATOM 980 CG LEU A 71 -0.181 -5.698 -8.017 1.00 0.00 C ATOM 981 CD1 LEU A 71 -0.289 -6.022 -9.508 1.00 0.00 C ATOM 982 CD2 LEU A 71 -0.983 -6.677 -7.158 1.00 0.00 C ATOM 0 H LEU A 71 0.564 -3.752 -6.140 1.00 0.00 H new ATOM 0 HA LEU A 71 1.084 -6.532 -5.670 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.747 -4.768 -8.012 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.795 -6.519 -7.979 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.616 -4.709 -7.871 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.339 -6.051 -9.799 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.227 -5.255 -10.085 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.168 -6.992 -9.704 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.019 -6.693 -7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.556 -7.676 -7.249 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.946 -6.361 -6.116 1.00 0.00 H new ATOM 994 N SER A 72 3.692 -4.565 -6.069 1.00 0.00 N ATOM 995 CA SER A 72 5.108 -4.440 -5.770 1.00 0.00 C ATOM 996 C SER A 72 5.398 -3.061 -5.175 1.00 0.00 C ATOM 997 O SER A 72 4.597 -2.138 -5.319 1.00 0.00 O ATOM 998 CB SER A 72 5.957 -4.666 -7.023 1.00 0.00 C ATOM 999 OG SER A 72 5.426 -3.987 -8.158 1.00 0.00 O ATOM 0 H SER A 72 3.297 -3.786 -6.595 1.00 0.00 H new ATOM 0 HA SER A 72 5.372 -5.206 -5.041 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.975 -4.322 -6.838 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.015 -5.734 -7.234 1.00 0.00 H new ATOM 0 HG SER A 72 5.997 -4.155 -8.936 1.00 0.00 H new ATOM 1005 N ILE A 73 6.544 -2.964 -4.518 1.00 0.00 N ATOM 1006 CA ILE A 73 6.949 -1.713 -3.899 1.00 0.00 C ATOM 1007 C ILE A 73 8.412 -1.427 -4.247 1.00 0.00 C ATOM 1008 O ILE A 73 9.308 -2.154 -3.821 1.00 0.00 O ATOM 1009 CB ILE A 73 6.669 -1.743 -2.396 1.00 0.00 C ATOM 1010 CG1 ILE A 73 5.165 -1.784 -2.119 1.00 0.00 C ATOM 1011 CG2 ILE A 73 7.351 -0.571 -1.687 1.00 0.00 C ATOM 1012 CD1 ILE A 73 4.886 -2.145 -0.658 1.00 0.00 C ATOM 0 H ILE A 73 7.205 -3.732 -4.401 1.00 0.00 H new ATOM 0 HA ILE A 73 6.359 -0.885 -4.293 1.00 0.00 H new ATOM 0 HB ILE A 73 7.097 -2.659 -1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 73 4.723 -0.815 -2.349 1.00 0.00 H new ATOM 0 HG13 ILE A 73 4.691 -2.514 -2.775 1.00 0.00 H new ATOM 0 HG21 ILE A 73 7.136 -0.616 -0.619 1.00 0.00 H new ATOM 0 HG22 ILE A 73 8.428 -0.629 -1.843 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.976 0.368 -2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 73 3.810 -2.167 -0.488 1.00 0.00 H new ATOM 0 HD12 ILE A 73 5.308 -3.126 -0.438 1.00 0.00 H new ATOM 0 HD13 ILE A 73 5.341 -1.400 -0.006 1.00 0.00 H new ATOM 1024 N ASN A 74 8.607 -0.367 -5.017 1.00 0.00 N ATOM 1025 CA ASN A 74 9.945 0.023 -5.427 1.00 0.00 C ATOM 1026 C ASN A 74 10.472 -0.979 -6.456 1.00 0.00 C ATOM 1027 O ASN A 74 11.643 -0.932 -6.830 1.00 0.00 O ATOM 1028 CB ASN A 74 10.907 0.027 -4.236 1.00 0.00 C ATOM 1029 CG ASN A 74 11.538 1.408 -4.047 1.00 0.00 C ATOM 1030 OD1 ASN A 74 11.554 2.240 -4.938 1.00 0.00 O ATOM 1031 ND2 ASN A 74 12.057 1.603 -2.838 1.00 0.00 N ATOM 0 H ASN A 74 7.861 0.234 -5.368 1.00 0.00 H new ATOM 0 HA ASN A 74 9.889 1.026 -5.849 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.372 -0.260 -3.331 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.689 -0.716 -4.393 1.00 0.00 H new ATOM 0 HD21 ASN A 74 12.502 2.492 -2.612 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.010 0.863 -2.137 1.00 0.00 H new ATOM 1038 N GLY A 75 9.582 -1.861 -6.885 1.00 0.00 N ATOM 1039 CA GLY A 75 9.942 -2.873 -7.864 1.00 0.00 C ATOM 1040 C GLY A 75 10.037 -4.255 -7.214 1.00 0.00 C ATOM 1041 O GLY A 75 10.432 -5.223 -7.862 1.00 0.00 O ATOM 0 H GLY A 75 8.612 -1.896 -6.573 1.00 0.00 H new ATOM 0 HA2 GLY A 75 9.200 -2.893 -8.662 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.897 -2.617 -8.323 1.00 0.00 H new ATOM 1045 N ILE A 76 9.669 -4.303 -5.942 1.00 0.00 N ATOM 1046 CA ILE A 76 9.708 -5.550 -5.198 1.00 0.00 C ATOM 1047 C ILE A 76 8.279 -6.047 -4.969 1.00 0.00 C ATOM 1048 O ILE A 76 7.466 -5.351 -4.362 1.00 0.00 O ATOM 1049 CB ILE A 76 10.514 -5.380 -3.909 1.00 0.00 C ATOM 1050 CG1 ILE A 76 11.908 -4.822 -4.204 1.00 0.00 C ATOM 1051 CG2 ILE A 76 10.576 -6.691 -3.124 1.00 0.00 C ATOM 1052 CD1 ILE A 76 12.874 -5.940 -4.600 1.00 0.00 C ATOM 0 H ILE A 76 9.342 -3.498 -5.408 1.00 0.00 H new ATOM 0 HA ILE A 76 10.226 -6.319 -5.771 1.00 0.00 H new ATOM 0 HB ILE A 76 10.002 -4.652 -3.280 1.00 0.00 H new ATOM 0 HG12 ILE A 76 11.847 -4.088 -5.007 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.289 -4.302 -3.325 1.00 0.00 H new ATOM 0 HG21 ILE A 76 11.155 -6.542 -2.212 1.00 0.00 H new ATOM 0 HG22 ILE A 76 9.566 -7.008 -2.865 1.00 0.00 H new ATOM 0 HG23 ILE A 76 11.052 -7.458 -3.735 1.00 0.00 H new ATOM 0 HD11 ILE A 76 13.857 -5.516 -4.804 1.00 0.00 H new ATOM 0 HD12 ILE A 76 12.951 -6.660 -3.785 1.00 0.00 H new ATOM 0 HD13 ILE A 76 12.503 -6.442 -5.493 1.00 0.00 H new ATOM 1064 N ALA A 77 8.017 -7.247 -5.466 1.00 0.00 N ATOM 1065 CA ALA A 77 6.700 -7.845 -5.322 1.00 0.00 C ATOM 1066 C ALA A 77 6.435 -8.134 -3.844 1.00 0.00 C ATOM 1067 O ALA A 77 7.224 -8.814 -3.189 1.00 0.00 O ATOM 1068 CB ALA A 77 6.614 -9.103 -6.188 1.00 0.00 C ATOM 0 H ALA A 77 8.694 -7.821 -5.969 1.00 0.00 H new ATOM 0 HA ALA A 77 5.926 -7.159 -5.667 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.627 -9.552 -6.080 1.00 0.00 H new ATOM 0 HB2 ALA A 77 6.780 -8.838 -7.232 1.00 0.00 H new ATOM 0 HB3 ALA A 77 7.374 -9.817 -5.869 1.00 0.00 H new ATOM 1074 N THR A 78 5.321 -7.605 -3.361 1.00 0.00 N ATOM 1075 CA THR A 78 4.941 -7.798 -1.971 1.00 0.00 C ATOM 1076 C THR A 78 4.633 -9.273 -1.703 1.00 0.00 C ATOM 1077 O THR A 78 4.799 -9.751 -0.582 1.00 0.00 O ATOM 1078 CB THR A 78 3.766 -6.867 -1.668 1.00 0.00 C ATOM 1079 OG1 THR A 78 2.849 -7.108 -2.732 1.00 0.00 O ATOM 1080 CG2 THR A 78 4.134 -5.390 -1.822 1.00 0.00 C ATOM 0 H THR A 78 4.669 -7.042 -3.907 1.00 0.00 H new ATOM 0 HA THR A 78 5.759 -7.541 -1.298 1.00 0.00 H new ATOM 0 HB THR A 78 3.411 -7.049 -0.653 1.00 0.00 H new ATOM 0 HG1 THR A 78 2.911 -6.382 -3.388 1.00 0.00 H new ATOM 0 HG21 THR A 78 3.265 -4.773 -1.595 1.00 0.00 H new ATOM 0 HG22 THR A 78 4.943 -5.143 -1.135 1.00 0.00 H new ATOM 0 HG23 THR A 78 4.457 -5.200 -2.846 1.00 0.00 H new ATOM 1088 N GLU A 79 4.190 -9.952 -2.751 1.00 0.00 N ATOM 1089 CA GLU A 79 3.857 -11.362 -2.643 1.00 0.00 C ATOM 1090 C GLU A 79 5.123 -12.190 -2.413 1.00 0.00 C ATOM 1091 O GLU A 79 5.045 -13.369 -2.069 1.00 0.00 O ATOM 1092 CB GLU A 79 3.104 -11.845 -3.884 1.00 0.00 C ATOM 1093 CG GLU A 79 1.848 -11.004 -4.124 1.00 0.00 C ATOM 1094 CD GLU A 79 0.690 -11.877 -4.613 1.00 0.00 C ATOM 1095 OE1 GLU A 79 0.980 -13.009 -5.057 1.00 0.00 O ATOM 1096 OE2 GLU A 79 -0.459 -11.392 -4.532 1.00 0.00 O ATOM 0 H GLU A 79 4.054 -9.552 -3.679 1.00 0.00 H new ATOM 0 HA GLU A 79 3.198 -11.495 -1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.757 -11.788 -4.755 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.827 -12.892 -3.761 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.563 -10.498 -3.202 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.060 -10.229 -4.860 1.00 0.00 H new ATOM 1103 N ASP A 80 6.261 -11.541 -2.613 1.00 0.00 N ATOM 1104 CA ASP A 80 7.542 -12.203 -2.432 1.00 0.00 C ATOM 1105 C ASP A 80 8.183 -11.717 -1.130 1.00 0.00 C ATOM 1106 O ASP A 80 9.400 -11.554 -1.056 1.00 0.00 O ATOM 1107 CB ASP A 80 8.498 -11.875 -3.581 1.00 0.00 C ATOM 1108 CG ASP A 80 8.280 -12.690 -4.857 1.00 0.00 C ATOM 1109 OD1 ASP A 80 7.196 -13.305 -4.959 1.00 0.00 O ATOM 1110 OD2 ASP A 80 9.201 -12.680 -5.702 1.00 0.00 O ATOM 0 H ASP A 80 6.323 -10.564 -2.899 1.00 0.00 H new ATOM 0 HA ASP A 80 7.365 -13.278 -2.405 1.00 0.00 H new ATOM 0 HB2 ASP A 80 8.401 -10.817 -3.823 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.521 -12.031 -3.238 1.00 0.00 H new ATOM 1115 N GLY A 81 7.334 -11.500 -0.136 1.00 0.00 N ATOM 1116 CA GLY A 81 7.803 -11.036 1.159 1.00 0.00 C ATOM 1117 C GLY A 81 6.661 -11.011 2.178 1.00 0.00 C ATOM 1118 O GLY A 81 5.491 -11.097 1.807 1.00 0.00 O ATOM 0 H GLY A 81 6.325 -11.637 -0.201 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.600 -11.688 1.516 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.229 -10.037 1.059 1.00 0.00 H new ATOM 1122 N THR A 82 7.041 -10.891 3.441 1.00 0.00 N ATOM 1123 CA THR A 82 6.064 -10.853 4.516 1.00 0.00 C ATOM 1124 C THR A 82 5.587 -9.419 4.753 1.00 0.00 C ATOM 1125 O THR A 82 6.259 -8.465 4.362 1.00 0.00 O ATOM 1126 CB THR A 82 6.696 -11.496 5.753 1.00 0.00 C ATOM 1127 OG1 THR A 82 7.872 -10.725 5.982 1.00 0.00 O ATOM 1128 CG2 THR A 82 7.222 -12.905 5.476 1.00 0.00 C ATOM 0 H THR A 82 8.012 -10.819 3.744 1.00 0.00 H new ATOM 0 HA THR A 82 5.170 -11.421 4.258 1.00 0.00 H new ATOM 0 HB THR A 82 5.962 -11.535 6.557 1.00 0.00 H new ATOM 0 HG1 THR A 82 8.343 -11.072 6.768 1.00 0.00 H new ATOM 0 HG21 THR A 82 7.660 -13.315 6.386 1.00 0.00 H new ATOM 0 HG22 THR A 82 6.400 -13.542 5.149 1.00 0.00 H new ATOM 0 HG23 THR A 82 7.981 -12.863 4.695 1.00 0.00 H new ATOM 1136 N MET A 83 4.432 -9.311 5.392 1.00 0.00 N ATOM 1137 CA MET A 83 3.858 -8.009 5.685 1.00 0.00 C ATOM 1138 C MET A 83 4.945 -7.004 6.070 1.00 0.00 C ATOM 1139 O MET A 83 5.110 -5.979 5.410 1.00 0.00 O ATOM 1140 CB MET A 83 2.854 -8.140 6.833 1.00 0.00 C ATOM 1141 CG MET A 83 1.699 -7.150 6.668 1.00 0.00 C ATOM 1142 SD MET A 83 2.335 -5.489 6.518 1.00 0.00 S ATOM 1143 CE MET A 83 1.560 -4.997 4.987 1.00 0.00 C ATOM 0 H MET A 83 3.878 -10.104 5.715 1.00 0.00 H new ATOM 0 HA MET A 83 3.354 -7.645 4.789 1.00 0.00 H new ATOM 0 HB2 MET A 83 2.464 -9.157 6.865 1.00 0.00 H new ATOM 0 HB3 MET A 83 3.357 -7.962 7.783 1.00 0.00 H new ATOM 0 HG2 MET A 83 1.114 -7.405 5.785 1.00 0.00 H new ATOM 0 HG3 MET A 83 1.028 -7.215 7.525 1.00 0.00 H new ATOM 0 HE1 MET A 83 1.853 -3.976 4.743 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.877 -5.666 4.187 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.477 -5.048 5.095 1.00 0.00 H new ATOM 1153 N GLU A 84 5.659 -7.333 7.136 1.00 0.00 N ATOM 1154 CA GLU A 84 6.727 -6.472 7.617 1.00 0.00 C ATOM 1155 C GLU A 84 7.634 -6.054 6.458 1.00 0.00 C ATOM 1156 O GLU A 84 7.882 -4.867 6.256 1.00 0.00 O ATOM 1157 CB GLU A 84 7.530 -7.160 8.722 1.00 0.00 C ATOM 1158 CG GLU A 84 7.838 -6.187 9.863 1.00 0.00 C ATOM 1159 CD GLU A 84 9.050 -5.316 9.529 1.00 0.00 C ATOM 1160 OE1 GLU A 84 10.159 -5.888 9.463 1.00 0.00 O ATOM 1161 OE2 GLU A 84 8.840 -4.097 9.347 1.00 0.00 O ATOM 0 H GLU A 84 5.519 -8.184 7.681 1.00 0.00 H new ATOM 0 HA GLU A 84 6.280 -5.574 8.044 1.00 0.00 H new ATOM 0 HB2 GLU A 84 6.970 -8.012 9.107 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.461 -7.550 8.311 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.971 -5.553 10.049 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.028 -6.745 10.780 1.00 0.00 H new ATOM 1168 N GLU A 85 8.105 -7.054 5.727 1.00 0.00 N ATOM 1169 CA GLU A 85 8.980 -6.806 4.594 1.00 0.00 C ATOM 1170 C GLU A 85 8.420 -5.674 3.730 1.00 0.00 C ATOM 1171 O GLU A 85 9.172 -4.832 3.241 1.00 0.00 O ATOM 1172 CB GLU A 85 9.182 -8.078 3.768 1.00 0.00 C ATOM 1173 CG GLU A 85 10.556 -8.694 4.039 1.00 0.00 C ATOM 1174 CD GLU A 85 11.624 -8.069 3.139 1.00 0.00 C ATOM 1175 OE1 GLU A 85 12.159 -7.013 3.542 1.00 0.00 O ATOM 1176 OE2 GLU A 85 11.882 -8.660 2.068 1.00 0.00 O ATOM 0 H GLU A 85 7.897 -8.038 5.898 1.00 0.00 H new ATOM 0 HA GLU A 85 9.955 -6.500 4.973 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.402 -8.800 4.009 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.086 -7.846 2.707 1.00 0.00 H new ATOM 0 HG2 GLU A 85 10.825 -8.546 5.085 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.516 -9.770 3.869 1.00 0.00 H new ATOM 1183 N ALA A 86 7.105 -5.692 3.567 1.00 0.00 N ATOM 1184 CA ALA A 86 6.436 -4.677 2.770 1.00 0.00 C ATOM 1185 C ALA A 86 6.616 -3.311 3.436 1.00 0.00 C ATOM 1186 O ALA A 86 7.012 -2.347 2.783 1.00 0.00 O ATOM 1187 CB ALA A 86 4.963 -5.053 2.598 1.00 0.00 C ATOM 0 H ALA A 86 6.485 -6.393 3.973 1.00 0.00 H new ATOM 0 HA ALA A 86 6.876 -4.618 1.774 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.461 -4.292 2.000 1.00 0.00 H new ATOM 0 HB2 ALA A 86 4.890 -6.017 2.094 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.487 -5.118 3.577 1.00 0.00 H new ATOM 1193 N ASN A 87 6.317 -3.273 4.726 1.00 0.00 N ATOM 1194 CA ASN A 87 6.440 -2.042 5.487 1.00 0.00 C ATOM 1195 C ASN A 87 7.902 -1.588 5.481 1.00 0.00 C ATOM 1196 O ASN A 87 8.184 -0.392 5.450 1.00 0.00 O ATOM 1197 CB ASN A 87 6.015 -2.248 6.942 1.00 0.00 C ATOM 1198 CG ASN A 87 4.508 -2.036 7.107 1.00 0.00 C ATOM 1199 OD1 ASN A 87 3.995 -0.934 7.010 1.00 0.00 O ATOM 1200 ND2 ASN A 87 3.831 -3.152 7.363 1.00 0.00 N ATOM 0 H ASN A 87 5.990 -4.076 5.264 1.00 0.00 H new ATOM 0 HA ASN A 87 5.794 -1.295 5.026 1.00 0.00 H new ATOM 0 HB2 ASN A 87 6.282 -3.255 7.264 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.556 -1.554 7.585 1.00 0.00 H new ATOM 0 HD21 ASN A 87 2.820 -3.117 7.491 1.00 0.00 H new ATOM 0 HD22 ASN A 87 4.323 -4.043 7.431 1.00 0.00 H new ATOM 1207 N GLN A 88 8.792 -2.569 5.513 1.00 0.00 N ATOM 1208 CA GLN A 88 10.217 -2.286 5.513 1.00 0.00 C ATOM 1209 C GLN A 88 10.655 -1.767 4.141 1.00 0.00 C ATOM 1210 O GLN A 88 11.396 -0.789 4.051 1.00 0.00 O ATOM 1211 CB GLN A 88 11.022 -3.524 5.913 1.00 0.00 C ATOM 1212 CG GLN A 88 12.525 -3.256 5.815 1.00 0.00 C ATOM 1213 CD GLN A 88 13.145 -3.097 7.205 1.00 0.00 C ATOM 1214 OE1 GLN A 88 13.243 -4.035 7.980 1.00 0.00 O ATOM 1215 NE2 GLN A 88 13.557 -1.862 7.476 1.00 0.00 N ATOM 0 H GLN A 88 8.554 -3.560 5.539 1.00 0.00 H new ATOM 0 HA GLN A 88 10.414 -1.510 6.253 1.00 0.00 H new ATOM 0 HB2 GLN A 88 10.767 -3.815 6.932 1.00 0.00 H new ATOM 0 HB3 GLN A 88 10.755 -4.360 5.267 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.011 -4.077 5.288 1.00 0.00 H new ATOM 0 HG3 GLN A 88 12.700 -2.353 5.229 1.00 0.00 H new ATOM 0 HE21 GLN A 88 13.445 -1.123 6.782 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.985 -1.654 8.378 1.00 0.00 H new ATOM 1224 N LEU A 89 10.178 -2.445 3.108 1.00 0.00 N ATOM 1225 CA LEU A 89 10.511 -2.065 1.746 1.00 0.00 C ATOM 1226 C LEU A 89 10.149 -0.594 1.528 1.00 0.00 C ATOM 1227 O LEU A 89 10.761 0.085 0.705 1.00 0.00 O ATOM 1228 CB LEU A 89 9.848 -3.016 0.747 1.00 0.00 C ATOM 1229 CG LEU A 89 10.518 -4.380 0.573 1.00 0.00 C ATOM 1230 CD1 LEU A 89 9.581 -5.366 -0.126 1.00 0.00 C ATOM 1231 CD2 LEU A 89 11.856 -4.245 -0.156 1.00 0.00 C ATOM 0 H LEU A 89 9.563 -3.255 3.187 1.00 0.00 H new ATOM 0 HA LEU A 89 11.584 -2.158 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.816 -3.177 1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.814 -2.524 -0.225 1.00 0.00 H new ATOM 0 HG LEU A 89 10.730 -4.785 1.563 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.082 -6.328 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.677 -5.494 0.470 1.00 0.00 H new ATOM 0 HD13 LEU A 89 9.315 -4.980 -1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 89 12.311 -5.229 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.691 -3.809 -1.141 1.00 0.00 H new ATOM 0 HD23 LEU A 89 12.521 -3.601 0.420 1.00 0.00 H new ATOM 1243 N LEU A 90 9.155 -0.146 2.281 1.00 0.00 N ATOM 1244 CA LEU A 90 8.703 1.232 2.181 1.00 0.00 C ATOM 1245 C LEU A 90 9.676 2.139 2.937 1.00 0.00 C ATOM 1246 O LEU A 90 9.905 3.279 2.537 1.00 0.00 O ATOM 1247 CB LEU A 90 7.253 1.356 2.653 1.00 0.00 C ATOM 1248 CG LEU A 90 6.193 1.427 1.552 1.00 0.00 C ATOM 1249 CD1 LEU A 90 4.796 1.612 2.148 1.00 0.00 C ATOM 1250 CD2 LEU A 90 6.531 2.517 0.534 1.00 0.00 C ATOM 0 H LEU A 90 8.650 -0.712 2.963 1.00 0.00 H new ATOM 0 HA LEU A 90 8.704 1.559 1.141 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.026 0.504 3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 90 7.168 2.250 3.270 1.00 0.00 H new ATOM 0 HG LEU A 90 6.192 0.477 1.017 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.061 1.659 1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.565 0.771 2.802 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.765 2.538 2.723 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.761 2.546 -0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.577 3.483 1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 90 7.496 2.300 0.076 1.00 0.00 H new ATOM 1262 N ARG A 91 10.223 1.598 4.016 1.00 0.00 N ATOM 1263 CA ARG A 91 11.166 2.344 4.831 1.00 0.00 C ATOM 1264 C ARG A 91 12.383 2.751 3.998 1.00 0.00 C ATOM 1265 O ARG A 91 12.648 3.939 3.819 1.00 0.00 O ATOM 1266 CB ARG A 91 11.632 1.517 6.031 1.00 0.00 C ATOM 1267 CG ARG A 91 11.461 2.298 7.336 1.00 0.00 C ATOM 1268 CD ARG A 91 12.292 1.677 8.460 1.00 0.00 C ATOM 1269 NE ARG A 91 12.704 2.724 9.422 1.00 0.00 N ATOM 1270 CZ ARG A 91 13.749 3.543 9.239 1.00 0.00 C ATOM 1271 NH1 ARG A 91 14.493 3.443 8.129 1.00 0.00 N ATOM 1272 NH2 ARG A 91 14.049 4.463 10.165 1.00 0.00 N ATOM 0 H ARG A 91 10.031 0.652 4.344 1.00 0.00 H new ATOM 0 HA ARG A 91 10.656 3.236 5.195 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.062 0.589 6.081 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.679 1.241 5.903 1.00 0.00 H new ATOM 0 HG2 ARG A 91 11.763 3.334 7.186 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.409 2.311 7.621 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.711 0.910 8.972 1.00 0.00 H new ATOM 0 HD3 ARG A 91 13.172 1.186 8.044 1.00 0.00 H new ATOM 0 HE ARG A 91 12.159 2.829 10.278 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.264 2.743 7.423 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.288 4.067 7.990 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.482 4.540 11.009 1.00 0.00 H new ATOM 0 HH22 ARG A 91 14.844 5.086 10.026 1.00 0.00 H new ATOM 1286 N ASP A 92 13.090 1.742 3.510 1.00 0.00 N ATOM 1287 CA ASP A 92 14.272 1.980 2.700 1.00 0.00 C ATOM 1288 C ASP A 92 13.926 2.956 1.574 1.00 0.00 C ATOM 1289 O ASP A 92 14.704 3.858 1.269 1.00 0.00 O ATOM 1290 CB ASP A 92 14.773 0.682 2.063 1.00 0.00 C ATOM 1291 CG ASP A 92 16.197 0.743 1.505 1.00 0.00 C ATOM 1292 OD1 ASP A 92 16.333 1.186 0.344 1.00 0.00 O ATOM 1293 OD2 ASP A 92 17.117 0.346 2.253 1.00 0.00 O ATOM 0 H ASP A 92 12.867 0.758 3.660 1.00 0.00 H new ATOM 0 HA ASP A 92 15.048 2.387 3.348 1.00 0.00 H new ATOM 0 HB2 ASP A 92 14.724 -0.113 2.807 1.00 0.00 H new ATOM 0 HB3 ASP A 92 14.094 0.405 1.256 1.00 0.00 H new ATOM 1298 N ALA A 93 12.757 2.743 0.988 1.00 0.00 N ATOM 1299 CA ALA A 93 12.298 3.592 -0.098 1.00 0.00 C ATOM 1300 C ALA A 93 12.077 5.011 0.430 1.00 0.00 C ATOM 1301 O ALA A 93 12.213 5.982 -0.314 1.00 0.00 O ATOM 1302 CB ALA A 93 11.031 2.995 -0.713 1.00 0.00 C ATOM 0 H ALA A 93 12.114 1.994 1.245 1.00 0.00 H new ATOM 0 HA ALA A 93 13.048 3.646 -0.887 1.00 0.00 H new ATOM 0 HB1 ALA A 93 10.687 3.632 -1.528 1.00 0.00 H new ATOM 0 HB2 ALA A 93 11.248 1.999 -1.098 1.00 0.00 H new ATOM 0 HB3 ALA A 93 10.254 2.928 0.048 1.00 0.00 H new ATOM 1308 N ALA A 94 11.740 5.087 1.709 1.00 0.00 N ATOM 1309 CA ALA A 94 11.499 6.371 2.344 1.00 0.00 C ATOM 1310 C ALA A 94 12.834 7.086 2.562 1.00 0.00 C ATOM 1311 O ALA A 94 12.894 8.315 2.552 1.00 0.00 O ATOM 1312 CB ALA A 94 10.732 6.159 3.651 1.00 0.00 C ATOM 0 H ALA A 94 11.628 4.280 2.323 1.00 0.00 H new ATOM 0 HA ALA A 94 10.885 7.005 1.705 1.00 0.00 H new ATOM 0 HB1 ALA A 94 10.551 7.123 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.779 5.675 3.439 1.00 0.00 H new ATOM 0 HB3 ALA A 94 11.319 5.528 4.319 1.00 0.00 H new ATOM 1318 N LEU A 95 13.873 6.286 2.755 1.00 0.00 N ATOM 1319 CA LEU A 95 15.203 6.827 2.975 1.00 0.00 C ATOM 1320 C LEU A 95 15.776 7.319 1.644 1.00 0.00 C ATOM 1321 O LEU A 95 16.844 7.929 1.611 1.00 0.00 O ATOM 1322 CB LEU A 95 16.089 5.800 3.684 1.00 0.00 C ATOM 1323 CG LEU A 95 15.530 5.215 4.982 1.00 0.00 C ATOM 1324 CD1 LEU A 95 16.286 3.947 5.382 1.00 0.00 C ATOM 1325 CD2 LEU A 95 15.532 6.260 6.100 1.00 0.00 C ATOM 0 H LEU A 95 13.820 5.267 2.763 1.00 0.00 H new ATOM 0 HA LEU A 95 15.158 7.689 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 95 16.284 4.980 2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 95 17.049 6.267 3.903 1.00 0.00 H new ATOM 0 HG LEU A 95 14.492 4.930 4.809 1.00 0.00 H new ATOM 0 HD11 LEU A 95 15.869 3.551 6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 95 16.189 3.201 4.593 1.00 0.00 H new ATOM 0 HD13 LEU A 95 17.340 4.183 5.531 1.00 0.00 H new ATOM 0 HD21 LEU A 95 15.130 5.818 7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 95 16.552 6.598 6.280 1.00 0.00 H new ATOM 0 HD23 LEU A 95 14.915 7.109 5.805 1.00 0.00 H new ATOM 1337 N ALA A 96 15.041 7.034 0.579 1.00 0.00 N ATOM 1338 CA ALA A 96 15.462 7.440 -0.751 1.00 0.00 C ATOM 1339 C ALA A 96 14.682 8.687 -1.171 1.00 0.00 C ATOM 1340 O ALA A 96 15.080 9.390 -2.098 1.00 0.00 O ATOM 1341 CB ALA A 96 15.269 6.275 -1.725 1.00 0.00 C ATOM 0 H ALA A 96 14.157 6.527 0.610 1.00 0.00 H new ATOM 0 HA ALA A 96 16.521 7.698 -0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 96 15.585 6.579 -2.723 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.868 5.425 -1.398 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.217 5.991 -1.748 1.00 0.00 H new ATOM 1347 N HIS A 97 13.583 8.922 -0.469 1.00 0.00 N ATOM 1348 CA HIS A 97 12.742 10.072 -0.757 1.00 0.00 C ATOM 1349 C HIS A 97 11.952 9.820 -2.043 1.00 0.00 C ATOM 1350 O HIS A 97 11.290 10.721 -2.555 1.00 0.00 O ATOM 1351 CB HIS A 97 13.576 11.353 -0.816 1.00 0.00 C ATOM 1352 CG HIS A 97 14.629 11.450 0.263 1.00 0.00 C ATOM 1353 ND1 HIS A 97 15.690 12.336 0.197 1.00 0.00 N ATOM 1354 CD2 HIS A 97 14.772 10.765 1.433 1.00 0.00 C ATOM 1355 CE1 HIS A 97 16.432 12.182 1.283 1.00 0.00 C ATOM 1356 NE2 HIS A 97 15.862 11.207 2.048 1.00 0.00 N ATOM 0 H HIS A 97 13.255 8.336 0.299 1.00 0.00 H new ATOM 0 HA HIS A 97 12.022 10.212 0.050 1.00 0.00 H new ATOM 0 HB2 HIS A 97 14.062 11.414 -1.790 1.00 0.00 H new ATOM 0 HB3 HIS A 97 12.910 12.212 -0.738 1.00 0.00 H new ATOM 0 HD2 HIS A 97 14.110 9.993 1.798 1.00 0.00 H new ATOM 0 HE1 HIS A 97 17.331 12.732 1.521 1.00 0.00 H new ATOM 0 HE2 HIS A 97 16.215 10.873 2.945 1.00 0.00 H new ATOM 1364 N LYS A 98 12.046 8.590 -2.526 1.00 0.00 N ATOM 1365 CA LYS A 98 11.348 8.208 -3.742 1.00 0.00 C ATOM 1366 C LYS A 98 11.070 6.704 -3.714 1.00 0.00 C ATOM 1367 O LYS A 98 11.931 5.917 -3.322 1.00 0.00 O ATOM 1368 CB LYS A 98 12.128 8.667 -4.975 1.00 0.00 C ATOM 1369 CG LYS A 98 11.586 8.008 -6.244 1.00 0.00 C ATOM 1370 CD LYS A 98 12.658 7.148 -6.917 1.00 0.00 C ATOM 1371 CE LYS A 98 12.089 6.414 -8.133 1.00 0.00 C ATOM 1372 NZ LYS A 98 13.071 6.407 -9.240 1.00 0.00 N ATOM 0 H LYS A 98 12.595 7.845 -2.097 1.00 0.00 H new ATOM 0 HA LYS A 98 10.382 8.710 -3.800 1.00 0.00 H new ATOM 0 HB2 LYS A 98 12.063 9.751 -5.068 1.00 0.00 H new ATOM 0 HB3 LYS A 98 13.183 8.420 -4.855 1.00 0.00 H new ATOM 0 HG2 LYS A 98 10.722 7.391 -5.997 1.00 0.00 H new ATOM 0 HG3 LYS A 98 11.242 8.775 -6.938 1.00 0.00 H new ATOM 0 HD2 LYS A 98 13.493 7.777 -7.225 1.00 0.00 H new ATOM 0 HD3 LYS A 98 13.051 6.425 -6.202 1.00 0.00 H new ATOM 0 HE2 LYS A 98 11.832 5.390 -7.860 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.168 6.897 -8.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 12.669 5.905 -10.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 13.296 7.386 -9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 13.939 5.925 -8.931 1.00 0.00 H new ATOM 1386 N VAL A 99 9.866 6.349 -4.137 1.00 0.00 N ATOM 1387 CA VAL A 99 9.465 4.952 -4.166 1.00 0.00 C ATOM 1388 C VAL A 99 8.465 4.737 -5.304 1.00 0.00 C ATOM 1389 O VAL A 99 7.795 5.675 -5.733 1.00 0.00 O ATOM 1390 CB VAL A 99 8.913 4.538 -2.800 1.00 0.00 C ATOM 1391 CG1 VAL A 99 7.618 5.288 -2.481 1.00 0.00 C ATOM 1392 CG2 VAL A 99 8.702 3.024 -2.730 1.00 0.00 C ATOM 0 H VAL A 99 9.155 7.004 -4.462 1.00 0.00 H new ATOM 0 HA VAL A 99 10.325 4.312 -4.363 1.00 0.00 H new ATOM 0 HB VAL A 99 9.651 4.809 -2.045 1.00 0.00 H new ATOM 0 HG11 VAL A 99 7.247 4.975 -1.505 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.812 6.360 -2.468 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.871 5.064 -3.242 1.00 0.00 H new ATOM 0 HG21 VAL A 99 8.309 2.756 -1.749 1.00 0.00 H new ATOM 0 HG22 VAL A 99 7.993 2.719 -3.500 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.653 2.516 -2.891 1.00 0.00 H new ATOM 1402 N VAL A 100 8.397 3.495 -5.762 1.00 0.00 N ATOM 1403 CA VAL A 100 7.490 3.145 -6.842 1.00 0.00 C ATOM 1404 C VAL A 100 6.401 2.214 -6.306 1.00 0.00 C ATOM 1405 O VAL A 100 6.700 1.199 -5.679 1.00 0.00 O ATOM 1406 CB VAL A 100 8.275 2.538 -8.007 1.00 0.00 C ATOM 1407 CG1 VAL A 100 7.382 1.631 -8.856 1.00 0.00 C ATOM 1408 CG2 VAL A 100 8.919 3.631 -8.863 1.00 0.00 C ATOM 0 H VAL A 100 8.955 2.719 -5.405 1.00 0.00 H new ATOM 0 HA VAL A 100 6.995 4.035 -7.229 1.00 0.00 H new ATOM 0 HB VAL A 100 9.074 1.925 -7.590 1.00 0.00 H new ATOM 0 HG11 VAL A 100 7.964 1.212 -9.677 1.00 0.00 H new ATOM 0 HG12 VAL A 100 6.993 0.822 -8.238 1.00 0.00 H new ATOM 0 HG13 VAL A 100 6.552 2.211 -9.259 1.00 0.00 H new ATOM 0 HG21 VAL A 100 9.471 3.173 -9.684 1.00 0.00 H new ATOM 0 HG22 VAL A 100 8.143 4.282 -9.266 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.603 4.218 -8.250 1.00 0.00 H new ATOM 1418 N LEU A 101 5.160 2.594 -6.572 1.00 0.00 N ATOM 1419 CA LEU A 101 4.024 1.806 -6.125 1.00 0.00 C ATOM 1420 C LEU A 101 3.279 1.255 -7.342 1.00 0.00 C ATOM 1421 O LEU A 101 3.033 1.981 -8.305 1.00 0.00 O ATOM 1422 CB LEU A 101 3.140 2.627 -5.183 1.00 0.00 C ATOM 1423 CG LEU A 101 3.862 3.342 -4.039 1.00 0.00 C ATOM 1424 CD1 LEU A 101 4.605 2.342 -3.150 1.00 0.00 C ATOM 1425 CD2 LEU A 101 4.791 4.433 -4.574 1.00 0.00 C ATOM 0 H LEU A 101 4.916 3.437 -7.091 1.00 0.00 H new ATOM 0 HA LEU A 101 4.361 0.949 -5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.609 3.373 -5.774 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.388 1.965 -4.754 1.00 0.00 H new ATOM 0 HG LEU A 101 3.114 3.833 -3.417 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.110 2.876 -2.345 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.893 1.634 -2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.342 1.803 -3.746 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.292 4.925 -3.740 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.536 3.986 -5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.208 5.166 -5.131 1.00 0.00 H new ATOM 1437 N GLU A 102 2.940 -0.023 -7.261 1.00 0.00 N ATOM 1438 CA GLU A 102 2.229 -0.680 -8.344 1.00 0.00 C ATOM 1439 C GLU A 102 0.883 -1.214 -7.848 1.00 0.00 C ATOM 1440 O GLU A 102 0.839 -2.158 -7.060 1.00 0.00 O ATOM 1441 CB GLU A 102 3.072 -1.800 -8.955 1.00 0.00 C ATOM 1442 CG GLU A 102 2.329 -2.481 -10.106 1.00 0.00 C ATOM 1443 CD GLU A 102 3.169 -2.466 -11.385 1.00 0.00 C ATOM 1444 OE1 GLU A 102 3.493 -1.347 -11.838 1.00 0.00 O ATOM 1445 OE2 GLU A 102 3.467 -3.574 -11.881 1.00 0.00 O ATOM 0 H GLU A 102 3.145 -0.622 -6.461 1.00 0.00 H new ATOM 0 HA GLU A 102 2.040 0.055 -9.127 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.016 -1.393 -9.317 1.00 0.00 H new ATOM 0 HB3 GLU A 102 3.315 -2.536 -8.189 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.093 -3.510 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 102 1.381 -1.973 -10.283 1.00 0.00 H new ATOM 1452 N VAL A 103 -0.180 -0.588 -8.330 1.00 0.00 N ATOM 1453 CA VAL A 103 -1.523 -0.989 -7.946 1.00 0.00 C ATOM 1454 C VAL A 103 -2.181 -1.734 -9.109 1.00 0.00 C ATOM 1455 O VAL A 103 -1.930 -1.421 -10.272 1.00 0.00 O ATOM 1456 CB VAL A 103 -2.323 0.232 -7.488 1.00 0.00 C ATOM 1457 CG1 VAL A 103 -3.368 -0.158 -6.441 1.00 0.00 C ATOM 1458 CG2 VAL A 103 -1.396 1.327 -6.957 1.00 0.00 C ATOM 0 H VAL A 103 -0.139 0.194 -8.983 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.489 -1.675 -7.099 1.00 0.00 H new ATOM 0 HB VAL A 103 -2.851 0.631 -8.354 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -3.922 0.728 -6.133 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -4.057 -0.887 -6.868 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -2.870 -0.594 -5.575 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.990 2.184 -6.638 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -0.828 0.943 -6.109 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.709 1.635 -7.745 1.00 0.00 H new ATOM 1468 N GLU A 104 -3.010 -2.704 -8.755 1.00 0.00 N ATOM 1469 CA GLU A 104 -3.706 -3.496 -9.755 1.00 0.00 C ATOM 1470 C GLU A 104 -5.214 -3.250 -9.672 1.00 0.00 C ATOM 1471 O GLU A 104 -5.802 -3.335 -8.595 1.00 0.00 O ATOM 1472 CB GLU A 104 -3.384 -4.983 -9.599 1.00 0.00 C ATOM 1473 CG GLU A 104 -3.216 -5.654 -10.964 1.00 0.00 C ATOM 1474 CD GLU A 104 -3.392 -7.170 -10.855 1.00 0.00 C ATOM 1475 OE1 GLU A 104 -4.246 -7.585 -10.042 1.00 0.00 O ATOM 1476 OE2 GLU A 104 -2.669 -7.880 -11.587 1.00 0.00 O ATOM 0 H GLU A 104 -3.216 -2.960 -7.789 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.360 -3.185 -10.741 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -2.470 -5.102 -9.017 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.182 -5.475 -9.044 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.946 -5.249 -11.665 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -2.229 -5.427 -11.366 1.00 0.00 H new ATOM 1483 N PHE A 105 -5.796 -2.949 -10.824 1.00 0.00 N ATOM 1484 CA PHE A 105 -7.224 -2.690 -10.894 1.00 0.00 C ATOM 1485 C PHE A 105 -7.764 -2.971 -12.298 1.00 0.00 C ATOM 1486 O PHE A 105 -6.994 -3.223 -13.224 1.00 0.00 O ATOM 1487 CB PHE A 105 -7.427 -1.208 -10.571 1.00 0.00 C ATOM 1488 CG PHE A 105 -6.482 -0.272 -11.326 1.00 0.00 C ATOM 1489 CD1 PHE A 105 -6.523 -0.215 -12.684 1.00 0.00 C ATOM 1490 CD2 PHE A 105 -5.602 0.505 -10.640 1.00 0.00 C ATOM 1491 CE1 PHE A 105 -5.646 0.654 -13.386 1.00 0.00 C ATOM 1492 CE2 PHE A 105 -4.725 1.374 -11.341 1.00 0.00 C ATOM 1493 CZ PHE A 105 -4.766 1.431 -12.699 1.00 0.00 C ATOM 0 H PHE A 105 -5.305 -2.879 -11.715 1.00 0.00 H new ATOM 0 HA PHE A 105 -7.753 -3.336 -10.193 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -8.456 -0.934 -10.803 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -7.291 -1.058 -9.500 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -7.223 -0.831 -13.229 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -5.570 0.461 -9.561 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -5.678 0.698 -14.465 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -4.025 1.990 -10.796 1.00 0.00 H new ATOM 0 HZ PHE A 105 -4.100 2.093 -13.232 1.00 0.00 H new ATOM 1503 N ASP A 106 -9.083 -2.919 -12.412 1.00 0.00 N ATOM 1504 CA ASP A 106 -9.734 -3.165 -13.688 1.00 0.00 C ATOM 1505 C ASP A 106 -10.237 -1.839 -14.263 1.00 0.00 C ATOM 1506 O ASP A 106 -11.014 -1.827 -15.216 1.00 0.00 O ATOM 1507 CB ASP A 106 -10.937 -4.095 -13.522 1.00 0.00 C ATOM 1508 CG ASP A 106 -10.605 -5.493 -12.995 1.00 0.00 C ATOM 1509 OD1 ASP A 106 -9.398 -5.816 -12.964 1.00 0.00 O ATOM 1510 OD2 ASP A 106 -11.567 -6.206 -12.635 1.00 0.00 O ATOM 0 H ASP A 106 -9.719 -2.710 -11.642 1.00 0.00 H new ATOM 0 HA ASP A 106 -9.007 -3.631 -14.353 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -11.649 -3.626 -12.842 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.436 -4.195 -14.486 1.00 0.00 H new ATOM 1515 N SER A 107 -9.774 -0.755 -13.658 1.00 0.00 N ATOM 1516 CA SER A 107 -10.168 0.573 -14.098 1.00 0.00 C ATOM 1517 C SER A 107 -11.693 0.682 -14.132 1.00 0.00 C ATOM 1518 O SER A 107 -12.311 0.478 -15.176 1.00 0.00 O ATOM 1519 CB SER A 107 -9.582 0.893 -15.475 1.00 0.00 C ATOM 1520 OG SER A 107 -10.361 1.860 -16.174 1.00 0.00 O ATOM 0 H SER A 107 -9.130 -0.769 -12.867 1.00 0.00 H new ATOM 0 HA SER A 107 -9.774 1.300 -13.387 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.563 1.263 -15.359 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.523 -0.021 -16.066 1.00 0.00 H new ATOM 0 HG SER A 107 -11.283 1.539 -16.258 1.00 0.00 H new ATOM 1526 N GLY A 108 -12.258 1.003 -12.977 1.00 0.00 N ATOM 1527 CA GLY A 108 -13.700 1.142 -12.861 1.00 0.00 C ATOM 1528 C GLY A 108 -14.067 2.355 -12.005 1.00 0.00 C ATOM 1529 O GLY A 108 -13.200 2.962 -11.378 1.00 0.00 O ATOM 0 H GLY A 108 -11.743 1.171 -12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -14.140 1.246 -13.853 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -14.121 0.239 -12.419 1.00 0.00 H new ATOM 1533 N PRO A 109 -15.387 2.680 -12.005 1.00 0.00 N ATOM 1534 CA PRO A 109 -15.880 3.810 -11.236 1.00 0.00 C ATOM 1535 C PRO A 109 -15.927 3.478 -9.743 1.00 0.00 C ATOM 1536 O PRO A 109 -16.989 3.168 -9.206 1.00 0.00 O ATOM 1537 CB PRO A 109 -17.250 4.116 -11.820 1.00 0.00 C ATOM 1538 CG PRO A 109 -17.670 2.866 -12.575 1.00 0.00 C ATOM 1539 CD PRO A 109 -16.442 1.984 -12.736 1.00 0.00 C ATOM 0 HA PRO A 109 -15.229 4.682 -11.304 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -17.965 4.356 -11.033 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -17.207 4.978 -12.485 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -18.452 2.336 -12.031 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -18.082 3.129 -13.549 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -16.614 0.987 -12.329 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -16.179 1.859 -13.786 1.00 0.00 H new ATOM 1547 N SER A 110 -14.763 3.555 -9.116 1.00 0.00 N ATOM 1548 CA SER A 110 -14.658 3.266 -7.695 1.00 0.00 C ATOM 1549 C SER A 110 -15.864 3.844 -6.953 1.00 0.00 C ATOM 1550 O SER A 110 -15.905 5.039 -6.663 1.00 0.00 O ATOM 1551 CB SER A 110 -13.358 3.827 -7.114 1.00 0.00 C ATOM 1552 OG SER A 110 -13.339 5.252 -7.126 1.00 0.00 O ATOM 0 H SER A 110 -13.884 3.813 -9.565 1.00 0.00 H new ATOM 0 HA SER A 110 -14.645 2.184 -7.566 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.235 3.471 -6.091 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.512 3.448 -7.687 1.00 0.00 H new ATOM 0 HG SER A 110 -14.222 5.593 -6.873 1.00 0.00 H new ATOM 1558 N SER A 111 -16.817 2.970 -6.667 1.00 0.00 N ATOM 1559 CA SER A 111 -18.022 3.378 -5.964 1.00 0.00 C ATOM 1560 C SER A 111 -18.818 4.365 -6.820 1.00 0.00 C ATOM 1561 O SER A 111 -18.752 5.574 -6.603 1.00 0.00 O ATOM 1562 CB SER A 111 -17.684 4.004 -4.609 1.00 0.00 C ATOM 1563 OG SER A 111 -18.850 4.437 -3.915 1.00 0.00 O ATOM 0 H SER A 111 -16.780 1.980 -6.909 1.00 0.00 H new ATOM 0 HA SER A 111 -18.629 2.491 -5.783 1.00 0.00 H new ATOM 0 HB2 SER A 111 -17.147 3.278 -3.998 1.00 0.00 H new ATOM 0 HB3 SER A 111 -17.015 4.852 -4.758 1.00 0.00 H new ATOM 0 HG SER A 111 -18.592 4.829 -3.055 1.00 0.00 H new ATOM 1569 N GLY A 112 -19.552 3.813 -7.775 1.00 0.00 N ATOM 1570 CA GLY A 112 -20.359 4.630 -8.665 1.00 0.00 C ATOM 1571 C GLY A 112 -21.668 5.046 -7.990 1.00 0.00 C ATOM 1572 O GLY A 112 -22.409 5.872 -8.521 1.00 0.00 O ATOM 0 H GLY A 112 -19.605 2.810 -7.952 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -19.798 5.518 -8.958 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -20.576 4.075 -9.577 1.00 0.00 H new TER 1576 GLY A 112