USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1078 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 109 CYS SG : rot -11:sc= -0.0905 USER MOD Set 1.2: A 117 TYR OH : rot 65:sc= 1.06 USER MOD Set 2.1: A 71 TYR OH : rot 165:sc= -2.24! USER MOD Set 2.2: A 87 HIS : no HE2:sc= 0.832 K(o=-1.4,f=-4.3!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 MET CE :methyl 164:sc= -0.0519 (180deg=-0.383) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.864 K(o=-0.86,f=-0.049) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 31 SER OG : rot 165:sc= -2.48! USER MOD Single : A 33 GLN : amide:sc= -0.198 X(o=-0.2,f=-0.62) USER MOD Single : A 43 LYS NZ :NH3+ -176:sc= 1.11 (180deg=1.03) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= 0.453 K(o=0.45,f=-4.1!) USER MOD Single : A 52 GLN : amide:sc= 0.0697 K(o=0.07,f=-4.3!) USER MOD Single : A 67 THR OG1 : rot 128:sc= 0.67 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= 1.11 K(o=1.1,f=-5.3!) USER MOD Single : A 90 HIS : no HE2:sc= -4.05! C(o=-4!,f=-13!) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.0239 X(o=-0.024,f=-0.51) USER MOD Single : A 101 HIS : no HE2:sc= 0.393 K(o=0.39,f=-5.6!) USER MOD Single : A 103 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-2.4) USER MOD Single : A 104 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.36) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= 0.0876 X(o=0.088,f=-0.36) USER MOD Single : A 131 MET CE :methyl -158:sc= -0.199 (180deg=-0.788) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -30.757 -14.847 -9.339 1.00 0.00 N ATOM 2 CA GLY A 1 -29.450 -14.857 -10.035 1.00 0.00 C ATOM 3 C GLY A 1 -28.474 -15.809 -9.378 1.00 0.00 C ATOM 4 O GLY A 1 -28.827 -16.950 -9.070 1.00 0.00 O ATOM 0 H1 GLY A 1 -31.400 -14.184 -9.817 1.00 0.00 H new ATOM 0 H2 GLY A 1 -31.168 -15.802 -9.358 1.00 0.00 H new ATOM 0 H3 GLY A 1 -30.622 -14.548 -8.352 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -29.594 -15.145 -11.076 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -29.031 -13.851 -10.038 1.00 0.00 H new ATOM 10 N PRO A 2 -27.231 -15.372 -9.149 1.00 0.00 N ATOM 11 CA PRO A 2 -26.242 -16.163 -8.422 1.00 0.00 C ATOM 12 C PRO A 2 -26.584 -16.229 -6.939 1.00 0.00 C ATOM 13 O PRO A 2 -27.182 -15.297 -6.393 1.00 0.00 O ATOM 14 CB PRO A 2 -24.924 -15.400 -8.634 1.00 0.00 C ATOM 15 CG PRO A 2 -25.216 -14.374 -9.684 1.00 0.00 C ATOM 16 CD PRO A 2 -26.684 -14.083 -9.583 1.00 0.00 C ATOM 0 HA PRO A 2 -26.196 -17.194 -8.772 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -24.590 -14.930 -7.709 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -24.129 -16.073 -8.954 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -24.627 -13.471 -9.521 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -24.960 -14.747 -10.676 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -26.893 -13.290 -8.864 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -27.102 -13.765 -10.538 1.00 0.00 H new ATOM 24 N LEU A 3 -26.223 -17.324 -6.292 1.00 0.00 N ATOM 25 CA LEU A 3 -26.470 -17.475 -4.868 1.00 0.00 C ATOM 26 C LEU A 3 -25.552 -16.541 -4.093 1.00 0.00 C ATOM 27 O LEU A 3 -25.975 -15.862 -3.155 1.00 0.00 O ATOM 28 CB LEU A 3 -26.244 -18.926 -4.433 1.00 0.00 C ATOM 29 CG LEU A 3 -26.499 -19.205 -2.951 1.00 0.00 C ATOM 30 CD1 LEU A 3 -27.943 -18.903 -2.592 1.00 0.00 C ATOM 31 CD2 LEU A 3 -26.154 -20.647 -2.618 1.00 0.00 C ATOM 0 H LEU A 3 -25.759 -18.120 -6.729 1.00 0.00 H new ATOM 0 HA LEU A 3 -27.508 -17.216 -4.658 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -26.892 -19.572 -5.025 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -25.216 -19.204 -4.668 1.00 0.00 H new ATOM 0 HG LEU A 3 -25.857 -18.552 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -28.105 -19.108 -1.534 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -28.157 -17.854 -2.796 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -28.605 -19.531 -3.188 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -26.341 -20.831 -1.560 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -26.771 -21.316 -3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -25.102 -20.830 -2.838 1.00 0.00 H new ATOM 43 N GLY A 4 -24.296 -16.507 -4.508 1.00 0.00 N ATOM 44 CA GLY A 4 -23.334 -15.614 -3.906 1.00 0.00 C ATOM 45 C GLY A 4 -22.805 -14.612 -4.907 1.00 0.00 C ATOM 46 O GLY A 4 -21.895 -14.922 -5.679 1.00 0.00 O ATOM 0 H GLY A 4 -23.924 -17.089 -5.259 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.798 -15.087 -3.072 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.506 -16.192 -3.496 1.00 0.00 H new ATOM 50 N SER A 5 -23.391 -13.417 -4.909 1.00 0.00 N ATOM 51 CA SER A 5 -22.995 -12.362 -5.834 1.00 0.00 C ATOM 52 C SER A 5 -21.509 -12.042 -5.695 1.00 0.00 C ATOM 53 O SER A 5 -20.781 -12.017 -6.693 1.00 0.00 O ATOM 54 CB SER A 5 -23.826 -11.105 -5.580 1.00 0.00 C ATOM 55 OG SER A 5 -25.213 -11.403 -5.563 1.00 0.00 O ATOM 0 H SER A 5 -24.146 -13.156 -4.275 1.00 0.00 H new ATOM 0 HA SER A 5 -23.175 -12.714 -6.850 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.535 -10.659 -4.629 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.619 -10.366 -6.354 1.00 0.00 H new ATOM 0 HG SER A 5 -25.722 -10.582 -5.397 1.00 0.00 H new ATOM 61 N MET A 6 -21.076 -11.822 -4.450 1.00 0.00 N ATOM 62 CA MET A 6 -19.681 -11.507 -4.135 1.00 0.00 C ATOM 63 C MET A 6 -19.284 -10.154 -4.709 1.00 0.00 C ATOM 64 O MET A 6 -19.044 -10.017 -5.911 1.00 0.00 O ATOM 65 CB MET A 6 -18.733 -12.590 -4.657 1.00 0.00 C ATOM 66 CG MET A 6 -18.917 -13.940 -3.990 1.00 0.00 C ATOM 67 SD MET A 6 -17.915 -15.223 -4.761 1.00 0.00 S ATOM 68 CE MET A 6 -18.264 -16.612 -3.685 1.00 0.00 C ATOM 0 H MET A 6 -21.684 -11.858 -3.632 1.00 0.00 H new ATOM 0 HA MET A 6 -19.596 -11.468 -3.049 1.00 0.00 H new ATOM 0 HB2 MET A 6 -18.882 -12.703 -5.731 1.00 0.00 H new ATOM 0 HB3 MET A 6 -17.704 -12.260 -4.511 1.00 0.00 H new ATOM 0 HG2 MET A 6 -18.654 -13.861 -2.935 1.00 0.00 H new ATOM 0 HG3 MET A 6 -19.968 -14.226 -4.036 1.00 0.00 H new ATOM 0 HE1 MET A 6 -17.715 -17.488 -4.031 1.00 0.00 H new ATOM 0 HE2 MET A 6 -17.957 -16.370 -2.668 1.00 0.00 H new ATOM 0 HE3 MET A 6 -19.333 -16.825 -3.700 1.00 0.00 H new ATOM 78 N LYS A 7 -19.208 -9.154 -3.848 1.00 0.00 N ATOM 79 CA LYS A 7 -18.812 -7.823 -4.269 1.00 0.00 C ATOM 80 C LYS A 7 -17.299 -7.694 -4.188 1.00 0.00 C ATOM 81 O LYS A 7 -16.673 -8.218 -3.262 1.00 0.00 O ATOM 82 CB LYS A 7 -19.481 -6.758 -3.392 1.00 0.00 C ATOM 83 CG LYS A 7 -20.994 -6.700 -3.534 1.00 0.00 C ATOM 84 CD LYS A 7 -21.410 -6.289 -4.937 1.00 0.00 C ATOM 85 CE LYS A 7 -22.920 -6.194 -5.061 1.00 0.00 C ATOM 86 NZ LYS A 7 -23.335 -5.739 -6.412 1.00 0.00 N ATOM 0 H LYS A 7 -19.416 -9.239 -2.853 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.133 -7.668 -5.299 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.232 -6.952 -2.349 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -19.065 -5.782 -3.643 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.420 -7.676 -3.299 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -21.401 -5.992 -2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -20.962 -5.327 -5.184 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -21.029 -7.012 -5.658 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -23.364 -7.168 -4.853 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -23.303 -5.502 -4.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -24.373 -5.687 -6.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -22.932 -4.799 -6.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -22.991 -6.412 -7.126 1.00 0.00 H new ATOM 100 N MET A 8 -16.713 -7.020 -5.160 1.00 0.00 N ATOM 101 CA MET A 8 -15.275 -6.835 -5.186 1.00 0.00 C ATOM 102 C MET A 8 -14.891 -5.514 -4.545 1.00 0.00 C ATOM 103 O MET A 8 -15.426 -4.458 -4.882 1.00 0.00 O ATOM 104 CB MET A 8 -14.736 -6.912 -6.613 1.00 0.00 C ATOM 105 CG MET A 8 -14.639 -8.333 -7.149 1.00 0.00 C ATOM 106 SD MET A 8 -14.115 -8.391 -8.875 1.00 0.00 S ATOM 107 CE MET A 8 -12.455 -7.723 -8.748 1.00 0.00 C ATOM 0 H MET A 8 -17.210 -6.592 -5.941 1.00 0.00 H new ATOM 0 HA MET A 8 -14.825 -7.643 -4.609 1.00 0.00 H new ATOM 0 HB2 MET A 8 -15.382 -6.328 -7.269 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.749 -6.452 -6.645 1.00 0.00 H new ATOM 0 HG2 MET A 8 -13.934 -8.899 -6.540 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.609 -8.821 -7.051 1.00 0.00 H new ATOM 0 HE1 MET A 8 -11.900 -7.952 -9.658 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.507 -6.642 -8.617 1.00 0.00 H new ATOM 0 HE3 MET A 8 -11.948 -8.169 -7.892 1.00 0.00 H new ATOM 117 N ILE A 9 -13.975 -5.599 -3.606 1.00 0.00 N ATOM 118 CA ILE A 9 -13.453 -4.447 -2.908 1.00 0.00 C ATOM 119 C ILE A 9 -12.029 -4.211 -3.378 1.00 0.00 C ATOM 120 O ILE A 9 -11.117 -4.943 -3.009 1.00 0.00 O ATOM 121 CB ILE A 9 -13.458 -4.691 -1.387 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.864 -5.063 -0.913 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.937 -3.488 -0.609 1.00 0.00 C ATOM 124 CD1 ILE A 9 -14.968 -5.246 0.583 1.00 0.00 C ATOM 0 H ILE A 9 -13.567 -6.483 -3.302 1.00 0.00 H new ATOM 0 HA ILE A 9 -14.076 -3.578 -3.119 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.781 -5.522 -1.190 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.561 -4.286 -1.225 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.173 -5.985 -1.406 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.960 -3.707 0.458 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.913 -3.273 -0.914 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.566 -2.622 -0.815 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.992 -5.508 0.847 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -14.296 -6.044 0.900 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.691 -4.318 1.083 1.00 0.00 H new ATOM 136 N GLU A 10 -11.839 -3.210 -4.202 1.00 0.00 N ATOM 137 CA GLU A 10 -10.537 -2.975 -4.797 1.00 0.00 C ATOM 138 C GLU A 10 -9.804 -1.914 -4.008 1.00 0.00 C ATOM 139 O GLU A 10 -10.262 -0.777 -3.891 1.00 0.00 O ATOM 140 CB GLU A 10 -10.661 -2.574 -6.268 1.00 0.00 C ATOM 141 CG GLU A 10 -11.255 -3.670 -7.140 1.00 0.00 C ATOM 142 CD GLU A 10 -10.377 -4.014 -8.328 1.00 0.00 C ATOM 143 OE1 GLU A 10 -9.491 -4.889 -8.190 1.00 0.00 O ATOM 144 OE2 GLU A 10 -10.566 -3.409 -9.407 1.00 0.00 O ATOM 0 H GLU A 10 -12.562 -2.546 -4.478 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.966 -3.903 -4.763 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.283 -1.682 -6.343 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.675 -2.309 -6.650 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.410 -4.565 -6.537 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.235 -3.353 -7.497 1.00 0.00 H new ATOM 151 N VAL A 11 -8.671 -2.295 -3.455 1.00 0.00 N ATOM 152 CA VAL A 11 -7.918 -1.424 -2.577 1.00 0.00 C ATOM 153 C VAL A 11 -6.551 -1.146 -3.182 1.00 0.00 C ATOM 154 O VAL A 11 -5.946 -2.025 -3.798 1.00 0.00 O ATOM 155 CB VAL A 11 -7.763 -2.064 -1.177 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.888 -1.217 -0.268 1.00 0.00 C ATOM 157 CG2 VAL A 11 -9.126 -2.285 -0.537 1.00 0.00 C ATOM 0 H VAL A 11 -8.248 -3.212 -3.600 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.459 -0.484 -2.465 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.273 -3.028 -1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.802 -1.698 0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.897 -1.113 -0.710 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.336 -0.231 -0.147 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -8.997 -2.736 0.447 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.639 -1.329 -0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.720 -2.949 -1.165 1.00 0.00 H new ATOM 167 N VAL A 12 -6.081 0.077 -3.045 1.00 0.00 N ATOM 168 CA VAL A 12 -4.767 0.439 -3.533 1.00 0.00 C ATOM 169 C VAL A 12 -3.836 0.765 -2.378 1.00 0.00 C ATOM 170 O VAL A 12 -4.191 1.515 -1.468 1.00 0.00 O ATOM 171 CB VAL A 12 -4.817 1.626 -4.516 1.00 0.00 C ATOM 172 CG1 VAL A 12 -5.134 1.135 -5.919 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.845 2.657 -4.067 1.00 0.00 C ATOM 0 H VAL A 12 -6.591 0.839 -2.598 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.382 -0.425 -4.074 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.838 2.105 -4.526 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.166 1.983 -6.603 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.362 0.437 -6.243 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.101 0.632 -5.919 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.863 3.485 -4.775 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.831 2.194 -4.025 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.578 3.031 -3.079 1.00 0.00 H new ATOM 183 N ALA A 13 -2.651 0.190 -2.420 1.00 0.00 N ATOM 184 CA ALA A 13 -1.662 0.390 -1.384 1.00 0.00 C ATOM 185 C ALA A 13 -0.490 1.167 -1.953 1.00 0.00 C ATOM 186 O ALA A 13 0.081 0.788 -2.976 1.00 0.00 O ATOM 187 CB ALA A 13 -1.200 -0.951 -0.824 1.00 0.00 C ATOM 0 H ALA A 13 -2.348 -0.428 -3.173 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.104 0.960 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.456 -0.783 -0.045 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.053 -1.482 -0.402 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.760 -1.547 -1.624 1.00 0.00 H new ATOM 193 N ALA A 14 -0.139 2.254 -1.302 1.00 0.00 N ATOM 194 CA ALA A 14 0.939 3.097 -1.768 1.00 0.00 C ATOM 195 C ALA A 14 2.181 2.852 -0.941 1.00 0.00 C ATOM 196 O ALA A 14 2.245 3.214 0.235 1.00 0.00 O ATOM 197 CB ALA A 14 0.548 4.563 -1.702 1.00 0.00 C ATOM 0 H ALA A 14 -0.587 2.576 -0.444 1.00 0.00 H new ATOM 0 HA ALA A 14 1.146 2.846 -2.808 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.376 5.177 -2.058 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.327 4.735 -2.329 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.314 4.831 -0.672 1.00 0.00 H new ATOM 203 N ILE A 15 3.162 2.230 -1.558 1.00 0.00 N ATOM 204 CA ILE A 15 4.413 1.967 -0.900 1.00 0.00 C ATOM 205 C ILE A 15 5.374 3.105 -1.186 1.00 0.00 C ATOM 206 O ILE A 15 5.891 3.236 -2.302 1.00 0.00 O ATOM 207 CB ILE A 15 5.020 0.624 -1.358 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.130 -0.530 -0.887 1.00 0.00 C ATOM 209 CG2 ILE A 15 6.439 0.463 -0.838 1.00 0.00 C ATOM 210 CD1 ILE A 15 4.804 -1.882 -0.943 1.00 0.00 C ATOM 0 H ILE A 15 3.112 1.897 -2.521 1.00 0.00 H new ATOM 0 HA ILE A 15 4.235 1.895 0.173 1.00 0.00 H new ATOM 0 HB ILE A 15 5.067 0.612 -2.447 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.811 -0.336 0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.230 -0.557 -1.502 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.844 -0.491 -1.175 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.060 1.275 -1.217 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.432 0.490 0.252 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.112 -2.648 -0.594 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.099 -2.099 -1.970 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.688 -1.875 -0.305 1.00 0.00 H new ATOM 222 N ILE A 16 5.582 3.953 -0.190 1.00 0.00 N ATOM 223 CA ILE A 16 6.470 5.089 -0.331 1.00 0.00 C ATOM 224 C ILE A 16 7.896 4.625 -0.110 1.00 0.00 C ATOM 225 O ILE A 16 8.303 4.404 1.024 1.00 0.00 O ATOM 226 CB ILE A 16 6.156 6.182 0.715 1.00 0.00 C ATOM 227 CG1 ILE A 16 4.643 6.313 0.948 1.00 0.00 C ATOM 228 CG2 ILE A 16 6.753 7.521 0.289 1.00 0.00 C ATOM 229 CD1 ILE A 16 3.910 7.094 -0.116 1.00 0.00 C ATOM 0 H ILE A 16 5.144 3.872 0.728 1.00 0.00 H new ATOM 0 HA ILE A 16 6.335 5.504 -1.330 1.00 0.00 H new ATOM 0 HB ILE A 16 6.614 5.883 1.658 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.210 5.315 1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.477 6.793 1.912 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.521 8.278 1.038 1.00 0.00 H new ATOM 0 HG22 ILE A 16 7.835 7.424 0.194 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.330 7.819 -0.670 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.849 7.136 0.129 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.311 8.106 -0.166 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.040 6.605 -1.081 1.00 0.00 H new ATOM 241 N GLU A 17 8.646 4.451 -1.178 1.00 0.00 N ATOM 242 CA GLU A 17 10.008 3.971 -1.052 1.00 0.00 C ATOM 243 C GLU A 17 10.968 5.028 -1.552 1.00 0.00 C ATOM 244 O GLU A 17 10.935 5.415 -2.724 1.00 0.00 O ATOM 245 CB GLU A 17 10.185 2.640 -1.789 1.00 0.00 C ATOM 246 CG GLU A 17 11.575 2.025 -1.666 1.00 0.00 C ATOM 247 CD GLU A 17 12.558 2.571 -2.683 1.00 0.00 C ATOM 248 OE1 GLU A 17 12.377 2.293 -3.885 1.00 0.00 O ATOM 249 OE2 GLU A 17 13.523 3.254 -2.281 1.00 0.00 O ATOM 0 H GLU A 17 8.341 4.632 -2.134 1.00 0.00 H new ATOM 0 HA GLU A 17 10.230 3.783 -0.001 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.452 1.929 -1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.962 2.792 -2.845 1.00 0.00 H new ATOM 0 HG2 GLU A 17 11.960 2.208 -0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.500 0.944 -1.786 1.00 0.00 H new ATOM 256 N ARG A 18 11.794 5.501 -0.643 1.00 0.00 N ATOM 257 CA ARG A 18 12.750 6.545 -0.925 1.00 0.00 C ATOM 258 C ARG A 18 14.087 6.189 -0.288 1.00 0.00 C ATOM 259 O ARG A 18 14.142 5.859 0.898 1.00 0.00 O ATOM 260 CB ARG A 18 12.232 7.882 -0.383 1.00 0.00 C ATOM 261 CG ARG A 18 13.178 9.043 -0.611 1.00 0.00 C ATOM 262 CD ARG A 18 13.298 9.401 -2.082 1.00 0.00 C ATOM 263 NE ARG A 18 14.444 10.272 -2.325 1.00 0.00 N ATOM 264 CZ ARG A 18 14.901 10.591 -3.534 1.00 0.00 C ATOM 265 NH1 ARG A 18 14.301 10.123 -4.622 1.00 0.00 N ATOM 266 NH2 ARG A 18 15.958 11.384 -3.649 1.00 0.00 N ATOM 0 H ARG A 18 11.819 5.167 0.320 1.00 0.00 H new ATOM 0 HA ARG A 18 12.886 6.639 -2.002 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.275 8.108 -0.854 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.046 7.782 0.686 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.826 9.912 -0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.163 8.790 -0.218 1.00 0.00 H new ATOM 0 HD2 ARG A 18 13.399 8.491 -2.673 1.00 0.00 H new ATOM 0 HD3 ARG A 18 12.385 9.896 -2.413 1.00 0.00 H new ATOM 0 HE ARG A 18 14.926 10.662 -1.515 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.486 9.516 -4.534 1.00 0.00 H new ATOM 0 HH12 ARG A 18 14.655 10.370 -5.546 1.00 0.00 H new ATOM 0 HH21 ARG A 18 16.417 11.747 -2.813 1.00 0.00 H new ATOM 0 HH22 ARG A 18 16.312 11.631 -4.573 1.00 0.00 H new ATOM 280 N ASP A 19 15.149 6.222 -1.092 1.00 0.00 N ATOM 281 CA ASP A 19 16.511 5.935 -0.623 1.00 0.00 C ATOM 282 C ASP A 19 16.656 4.472 -0.209 1.00 0.00 C ATOM 283 O ASP A 19 17.606 4.106 0.483 1.00 0.00 O ATOM 284 CB ASP A 19 16.916 6.843 0.553 1.00 0.00 C ATOM 285 CG ASP A 19 16.931 8.317 0.187 1.00 0.00 C ATOM 286 OD1 ASP A 19 17.803 8.731 -0.607 1.00 0.00 O ATOM 287 OD2 ASP A 19 16.080 9.076 0.706 1.00 0.00 O ATOM 0 H ASP A 19 15.094 6.448 -2.085 1.00 0.00 H new ATOM 0 HA ASP A 19 17.178 6.137 -1.461 1.00 0.00 H new ATOM 0 HB2 ASP A 19 16.224 6.687 1.380 1.00 0.00 H new ATOM 0 HB3 ASP A 19 17.905 6.552 0.906 1.00 0.00 H new ATOM 292 N GLY A 20 15.727 3.633 -0.650 1.00 0.00 N ATOM 293 CA GLY A 20 15.769 2.232 -0.295 1.00 0.00 C ATOM 294 C GLY A 20 14.963 1.939 0.949 1.00 0.00 C ATOM 295 O GLY A 20 14.967 0.818 1.456 1.00 0.00 O ATOM 0 H GLY A 20 14.945 3.901 -1.248 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.386 1.636 -1.124 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.804 1.929 -0.136 1.00 0.00 H new ATOM 299 N LYS A 21 14.279 2.956 1.452 1.00 0.00 N ATOM 300 CA LYS A 21 13.484 2.821 2.660 1.00 0.00 C ATOM 301 C LYS A 21 12.011 3.033 2.339 1.00 0.00 C ATOM 302 O LYS A 21 11.658 3.897 1.541 1.00 0.00 O ATOM 303 CB LYS A 21 13.941 3.841 3.701 1.00 0.00 C ATOM 304 CG LYS A 21 15.450 3.962 3.797 1.00 0.00 C ATOM 305 CD LYS A 21 16.020 3.057 4.867 1.00 0.00 C ATOM 306 CE LYS A 21 17.523 2.901 4.718 1.00 0.00 C ATOM 307 NZ LYS A 21 18.254 4.181 4.934 1.00 0.00 N ATOM 0 H LYS A 21 14.260 3.888 1.038 1.00 0.00 H new ATOM 0 HA LYS A 21 13.619 1.817 3.063 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.520 4.816 3.454 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.543 3.559 4.676 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.896 3.713 2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.719 4.996 4.015 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.791 3.466 5.851 1.00 0.00 H new ATOM 0 HD3 LYS A 21 15.544 2.078 4.810 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.880 2.158 5.431 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.749 2.521 3.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.275 4.021 4.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 17.935 4.885 4.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.063 4.532 5.894 1.00 0.00 H new ATOM 321 N ILE A 22 11.164 2.246 2.972 1.00 0.00 N ATOM 322 CA ILE A 22 9.734 2.316 2.753 1.00 0.00 C ATOM 323 C ILE A 22 9.065 3.032 3.918 1.00 0.00 C ATOM 324 O ILE A 22 9.505 2.920 5.063 1.00 0.00 O ATOM 325 CB ILE A 22 9.123 0.903 2.597 1.00 0.00 C ATOM 326 CG1 ILE A 22 9.866 0.121 1.514 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.637 0.980 2.266 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.345 -1.286 1.321 1.00 0.00 C ATOM 0 H ILE A 22 11.448 1.541 3.652 1.00 0.00 H new ATOM 0 HA ILE A 22 9.561 2.871 1.831 1.00 0.00 H new ATOM 0 HB ILE A 22 9.231 0.382 3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 22 9.790 0.661 0.570 1.00 0.00 H new ATOM 0 HG13 ILE A 22 10.924 0.076 1.771 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.235 -0.028 2.162 1.00 0.00 H new ATOM 0 HG22 ILE A 22 7.112 1.499 3.068 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.500 1.523 1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.918 -1.782 0.538 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.446 -1.843 2.253 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.294 -1.249 1.033 1.00 0.00 H new ATOM 340 N LEU A 23 8.029 3.787 3.608 1.00 0.00 N ATOM 341 CA LEU A 23 7.280 4.524 4.606 1.00 0.00 C ATOM 342 C LEU A 23 6.238 3.627 5.268 1.00 0.00 C ATOM 343 O LEU A 23 5.253 3.230 4.644 1.00 0.00 O ATOM 344 CB LEU A 23 6.606 5.733 3.950 1.00 0.00 C ATOM 345 CG LEU A 23 5.844 6.673 4.888 1.00 0.00 C ATOM 346 CD1 LEU A 23 6.800 7.325 5.872 1.00 0.00 C ATOM 347 CD2 LEU A 23 5.091 7.726 4.081 1.00 0.00 C ATOM 0 H LEU A 23 7.683 3.907 2.656 1.00 0.00 H new ATOM 0 HA LEU A 23 7.966 4.871 5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.370 6.312 3.431 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.913 5.369 3.192 1.00 0.00 H new ATOM 0 HG LEU A 23 5.116 6.092 5.455 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.244 7.991 6.533 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.294 6.555 6.465 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.549 7.898 5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.553 8.388 4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.799 8.308 3.491 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.382 7.235 3.415 1.00 0.00 H new ATOM 359 N LEU A 24 6.479 3.304 6.524 1.00 0.00 N ATOM 360 CA LEU A 24 5.527 2.540 7.315 1.00 0.00 C ATOM 361 C LEU A 24 4.726 3.498 8.182 1.00 0.00 C ATOM 362 O LEU A 24 5.302 4.323 8.894 1.00 0.00 O ATOM 363 CB LEU A 24 6.225 1.494 8.195 1.00 0.00 C ATOM 364 CG LEU A 24 6.813 0.280 7.466 1.00 0.00 C ATOM 365 CD1 LEU A 24 8.073 0.650 6.700 1.00 0.00 C ATOM 366 CD2 LEU A 24 7.107 -0.837 8.454 1.00 0.00 C ATOM 0 H LEU A 24 7.331 3.560 7.023 1.00 0.00 H new ATOM 0 HA LEU A 24 4.866 2.002 6.635 1.00 0.00 H new ATOM 0 HB2 LEU A 24 7.028 1.987 8.742 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.509 1.136 8.935 1.00 0.00 H new ATOM 0 HG LEU A 24 6.073 -0.068 6.746 1.00 0.00 H new ATOM 0 HD11 LEU A 24 8.464 -0.233 6.195 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.838 1.416 5.961 1.00 0.00 H new ATOM 0 HD13 LEU A 24 8.822 1.032 7.394 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.524 -1.692 7.923 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.824 -0.487 9.197 1.00 0.00 H new ATOM 0 HD23 LEU A 24 6.184 -1.134 8.952 1.00 0.00 H new ATOM 378 N ALA A 25 3.407 3.402 8.118 1.00 0.00 N ATOM 379 CA ALA A 25 2.547 4.305 8.858 1.00 0.00 C ATOM 380 C ALA A 25 1.701 3.535 9.860 1.00 0.00 C ATOM 381 O ALA A 25 0.829 2.762 9.479 1.00 0.00 O ATOM 382 CB ALA A 25 1.664 5.086 7.900 1.00 0.00 C ATOM 0 H ALA A 25 2.911 2.707 7.560 1.00 0.00 H new ATOM 0 HA ALA A 25 3.170 5.009 9.410 1.00 0.00 H new ATOM 0 HB1 ALA A 25 1.022 5.761 8.465 1.00 0.00 H new ATOM 0 HB2 ALA A 25 2.288 5.664 7.219 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.047 4.394 7.327 1.00 0.00 H new ATOM 388 N GLN A 26 1.962 3.760 11.136 1.00 0.00 N ATOM 389 CA GLN A 26 1.283 3.023 12.198 1.00 0.00 C ATOM 390 C GLN A 26 -0.186 3.419 12.316 1.00 0.00 C ATOM 391 O GLN A 26 -0.488 4.542 12.735 1.00 0.00 O ATOM 392 CB GLN A 26 1.990 3.258 13.539 1.00 0.00 C ATOM 393 CG GLN A 26 1.268 2.641 14.730 1.00 0.00 C ATOM 394 CD GLN A 26 2.010 2.826 16.041 1.00 0.00 C ATOM 395 OE1 GLN A 26 1.394 2.931 17.100 1.00 0.00 O ATOM 396 NE2 GLN A 26 3.334 2.846 15.985 1.00 0.00 N ATOM 0 H GLN A 26 2.639 4.447 11.466 1.00 0.00 H new ATOM 0 HA GLN A 26 1.325 1.965 11.939 1.00 0.00 H new ATOM 0 HB2 GLN A 26 2.998 2.848 13.485 1.00 0.00 H new ATOM 0 HB3 GLN A 26 2.091 4.331 13.703 1.00 0.00 H new ATOM 0 HG2 GLN A 26 0.276 3.085 14.815 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.125 1.576 14.548 1.00 0.00 H new ATOM 0 HE21 GLN A 26 3.808 2.756 15.086 1.00 0.00 H new ATOM 0 HE22 GLN A 26 3.879 2.951 16.841 1.00 0.00 H new ATOM 405 N ARG A 27 -1.072 2.503 11.900 1.00 0.00 N ATOM 406 CA ARG A 27 -2.516 2.587 12.159 1.00 0.00 C ATOM 407 C ARG A 27 -3.286 1.657 11.228 1.00 0.00 C ATOM 408 O ARG A 27 -3.313 1.871 10.017 1.00 0.00 O ATOM 409 CB ARG A 27 -3.093 3.994 11.989 1.00 0.00 C ATOM 410 CG ARG A 27 -4.475 4.127 12.608 1.00 0.00 C ATOM 411 CD ARG A 27 -5.168 5.406 12.194 1.00 0.00 C ATOM 412 NE ARG A 27 -6.351 5.666 13.008 1.00 0.00 N ATOM 413 CZ ARG A 27 -7.550 5.982 12.518 1.00 0.00 C ATOM 414 NH1 ARG A 27 -7.755 6.053 11.205 1.00 0.00 N ATOM 415 NH2 ARG A 27 -8.552 6.228 13.351 1.00 0.00 N ATOM 0 H ARG A 27 -0.803 1.675 11.369 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.633 2.294 13.202 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.420 4.719 12.448 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.147 4.237 10.928 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -5.086 3.274 12.314 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.389 4.098 13.694 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -4.474 6.242 12.283 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.455 5.341 11.145 1.00 0.00 H new ATOM 0 HE ARG A 27 -6.254 5.602 14.021 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.989 5.864 10.558 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.678 6.296 10.845 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -8.402 6.175 14.359 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -9.472 6.470 12.984 1.00 0.00 H new ATOM 429 N PRO A 28 -3.934 0.626 11.789 1.00 0.00 N ATOM 430 CA PRO A 28 -4.823 -0.271 11.032 1.00 0.00 C ATOM 431 C PRO A 28 -6.023 0.475 10.482 1.00 0.00 C ATOM 432 O PRO A 28 -6.758 -0.019 9.624 1.00 0.00 O ATOM 433 CB PRO A 28 -5.291 -1.273 12.078 1.00 0.00 C ATOM 434 CG PRO A 28 -5.057 -0.612 13.387 1.00 0.00 C ATOM 435 CD PRO A 28 -3.836 0.232 13.199 1.00 0.00 C ATOM 0 HA PRO A 28 -4.319 -0.722 10.178 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.345 -1.518 11.944 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.735 -2.207 12.004 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -5.913 -0.003 13.677 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -4.907 -1.348 14.177 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -3.835 1.097 13.862 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -2.922 -0.326 13.401 1.00 0.00 H new ATOM 443 N ALA A 29 -6.233 1.637 11.073 1.00 0.00 N ATOM 444 CA ALA A 29 -7.242 2.604 10.649 1.00 0.00 C ATOM 445 C ALA A 29 -8.626 2.236 11.157 1.00 0.00 C ATOM 446 O ALA A 29 -9.114 2.832 12.113 1.00 0.00 O ATOM 447 CB ALA A 29 -7.245 2.788 9.134 1.00 0.00 C ATOM 0 H ALA A 29 -5.695 1.947 11.882 1.00 0.00 H new ATOM 0 HA ALA A 29 -6.971 3.560 11.098 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.009 3.515 8.857 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.268 3.147 8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -7.460 1.834 8.652 1.00 0.00 H new ATOM 453 N GLN A 30 -9.247 1.241 10.541 1.00 0.00 N ATOM 454 CA GLN A 30 -10.618 0.879 10.887 1.00 0.00 C ATOM 455 C GLN A 30 -10.657 -0.089 12.066 1.00 0.00 C ATOM 456 O GLN A 30 -11.724 -0.543 12.480 1.00 0.00 O ATOM 457 CB GLN A 30 -11.335 0.288 9.674 1.00 0.00 C ATOM 458 CG GLN A 30 -11.439 1.263 8.512 1.00 0.00 C ATOM 459 CD GLN A 30 -12.319 0.756 7.389 1.00 0.00 C ATOM 460 OE1 GLN A 30 -12.432 -0.449 7.163 1.00 0.00 O ATOM 461 NE2 GLN A 30 -12.947 1.674 6.674 1.00 0.00 N ATOM 0 H GLN A 30 -8.829 0.672 9.804 1.00 0.00 H new ATOM 0 HA GLN A 30 -11.140 1.787 11.190 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.804 -0.605 9.345 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -12.336 -0.026 9.968 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -11.834 2.212 8.876 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -10.441 1.462 8.122 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -12.826 2.663 6.894 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -13.552 1.394 5.902 1.00 0.00 H new ATOM 470 N SER A 31 -9.490 -0.393 12.612 1.00 0.00 N ATOM 471 CA SER A 31 -9.406 -1.223 13.799 1.00 0.00 C ATOM 472 C SER A 31 -9.102 -0.348 15.009 1.00 0.00 C ATOM 473 O SER A 31 -8.491 0.715 14.878 1.00 0.00 O ATOM 474 CB SER A 31 -8.336 -2.309 13.635 1.00 0.00 C ATOM 475 OG SER A 31 -8.334 -3.197 14.738 1.00 0.00 O ATOM 0 H SER A 31 -8.590 -0.077 12.251 1.00 0.00 H new ATOM 0 HA SER A 31 -10.363 -1.723 13.948 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.518 -2.867 12.716 1.00 0.00 H new ATOM 0 HB3 SER A 31 -7.355 -1.845 13.537 1.00 0.00 H new ATOM 0 HG SER A 31 -7.826 -4.003 14.508 1.00 0.00 H new ATOM 481 N ASP A 32 -9.531 -0.797 16.180 1.00 0.00 N ATOM 482 CA ASP A 32 -9.393 -0.011 17.401 1.00 0.00 C ATOM 483 C ASP A 32 -8.034 -0.224 18.053 1.00 0.00 C ATOM 484 O ASP A 32 -7.682 0.460 19.016 1.00 0.00 O ATOM 485 CB ASP A 32 -10.503 -0.372 18.388 1.00 0.00 C ATOM 486 CG ASP A 32 -11.879 0.025 17.888 1.00 0.00 C ATOM 487 OD1 ASP A 32 -12.515 -0.782 17.173 1.00 0.00 O ATOM 488 OD2 ASP A 32 -12.335 1.140 18.216 1.00 0.00 O ATOM 0 H ASP A 32 -9.979 -1.704 16.312 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.476 1.041 17.129 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.484 -1.446 18.574 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.311 0.120 19.341 1.00 0.00 H new ATOM 493 N GLN A 33 -7.278 -1.173 17.528 1.00 0.00 N ATOM 494 CA GLN A 33 -5.958 -1.484 18.057 1.00 0.00 C ATOM 495 C GLN A 33 -4.891 -0.635 17.372 1.00 0.00 C ATOM 496 O GLN A 33 -5.133 -0.057 16.316 1.00 0.00 O ATOM 497 CB GLN A 33 -5.659 -2.971 17.867 1.00 0.00 C ATOM 498 CG GLN A 33 -5.827 -3.451 16.433 1.00 0.00 C ATOM 499 CD GLN A 33 -5.542 -4.932 16.270 1.00 0.00 C ATOM 500 OE1 GLN A 33 -5.748 -5.722 17.191 1.00 0.00 O ATOM 501 NE2 GLN A 33 -5.082 -5.322 15.093 1.00 0.00 N ATOM 0 H GLN A 33 -7.557 -1.745 16.731 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.944 -1.253 19.122 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -4.637 -3.171 18.190 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -6.318 -3.550 18.514 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -6.845 -3.243 16.102 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.159 -2.884 15.785 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -4.924 -4.636 14.354 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -4.885 -6.308 14.924 1.00 0.00 H new ATOM 510 N ALA A 34 -3.719 -0.555 17.981 1.00 0.00 N ATOM 511 CA ALA A 34 -2.610 0.193 17.409 1.00 0.00 C ATOM 512 C ALA A 34 -1.295 -0.541 17.640 1.00 0.00 C ATOM 513 O ALA A 34 -1.287 -1.666 18.136 1.00 0.00 O ATOM 514 CB ALA A 34 -2.555 1.596 18.000 1.00 0.00 C ATOM 0 H ALA A 34 -3.510 -1.000 18.875 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.768 0.279 16.334 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.720 2.143 17.562 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.486 2.119 17.782 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.420 1.531 19.080 1.00 0.00 H new ATOM 520 N GLY A 35 -0.190 0.091 17.270 1.00 0.00 N ATOM 521 CA GLY A 35 1.113 -0.524 17.449 1.00 0.00 C ATOM 522 C GLY A 35 1.628 -1.160 16.176 1.00 0.00 C ATOM 523 O GLY A 35 2.836 -1.281 15.975 1.00 0.00 O ATOM 0 H GLY A 35 -0.171 1.020 16.848 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.824 0.229 17.790 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.051 -1.281 18.231 1.00 0.00 H new ATOM 527 N LEU A 36 0.704 -1.578 15.331 1.00 0.00 N ATOM 528 CA LEU A 36 1.030 -2.170 14.048 1.00 0.00 C ATOM 529 C LEU A 36 1.410 -1.094 13.041 1.00 0.00 C ATOM 530 O LEU A 36 0.997 0.057 13.170 1.00 0.00 O ATOM 531 CB LEU A 36 -0.175 -2.954 13.534 1.00 0.00 C ATOM 532 CG LEU A 36 -0.813 -3.905 14.548 1.00 0.00 C ATOM 533 CD1 LEU A 36 -2.096 -4.482 13.986 1.00 0.00 C ATOM 534 CD2 LEU A 36 0.147 -5.021 14.930 1.00 0.00 C ATOM 0 H LEU A 36 -0.297 -1.516 15.516 1.00 0.00 H new ATOM 0 HA LEU A 36 1.881 -2.840 14.174 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.932 -2.246 13.197 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.132 -3.531 12.662 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.045 -3.337 15.449 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.542 -5.158 14.716 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.793 -3.673 13.767 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.878 -5.031 13.070 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.332 -5.682 15.652 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.416 -5.590 14.040 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.046 -4.592 15.372 1.00 0.00 H new ATOM 546 N TRP A 37 2.207 -1.469 12.057 1.00 0.00 N ATOM 547 CA TRP A 37 2.571 -0.564 10.977 1.00 0.00 C ATOM 548 C TRP A 37 1.972 -1.066 9.672 1.00 0.00 C ATOM 549 O TRP A 37 1.948 -2.270 9.425 1.00 0.00 O ATOM 550 CB TRP A 37 4.094 -0.462 10.845 1.00 0.00 C ATOM 551 CG TRP A 37 4.773 -0.010 12.102 1.00 0.00 C ATOM 552 CD1 TRP A 37 5.160 -0.795 13.144 1.00 0.00 C ATOM 553 CD2 TRP A 37 5.147 1.329 12.446 1.00 0.00 C ATOM 554 NE1 TRP A 37 5.748 -0.033 14.119 1.00 0.00 N ATOM 555 CE2 TRP A 37 5.754 1.276 13.716 1.00 0.00 C ATOM 556 CE3 TRP A 37 5.028 2.568 11.808 1.00 0.00 C ATOM 557 CZ2 TRP A 37 6.240 2.413 14.357 1.00 0.00 C ATOM 558 CZ3 TRP A 37 5.511 3.695 12.446 1.00 0.00 C ATOM 559 CH2 TRP A 37 6.111 3.611 13.709 1.00 0.00 C ATOM 0 H TRP A 37 2.618 -2.400 11.982 1.00 0.00 H new ATOM 0 HA TRP A 37 2.179 0.428 11.203 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.492 -1.435 10.556 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.336 0.233 10.041 1.00 0.00 H new ATOM 0 HD1 TRP A 37 5.023 -1.865 13.195 1.00 0.00 H new ATOM 0 HE1 TRP A 37 6.121 -0.383 15.001 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.567 2.643 10.834 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 6.702 2.351 15.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.424 4.657 11.962 1.00 0.00 H new ATOM 0 HH2 TRP A 37 6.479 4.510 14.181 1.00 0.00 H new ATOM 570 N GLU A 38 1.493 -0.151 8.845 1.00 0.00 N ATOM 571 CA GLU A 38 0.854 -0.518 7.591 1.00 0.00 C ATOM 572 C GLU A 38 1.232 0.476 6.499 1.00 0.00 C ATOM 573 O GLU A 38 1.783 1.547 6.788 1.00 0.00 O ATOM 574 CB GLU A 38 -0.676 -0.576 7.742 1.00 0.00 C ATOM 575 CG GLU A 38 -1.174 -1.627 8.729 1.00 0.00 C ATOM 576 CD GLU A 38 -1.389 -1.100 10.142 1.00 0.00 C ATOM 577 OE1 GLU A 38 -0.867 -0.013 10.479 1.00 0.00 O ATOM 578 OE2 GLU A 38 -2.096 -1.784 10.920 1.00 0.00 O ATOM 0 H GLU A 38 1.535 0.853 9.020 1.00 0.00 H new ATOM 0 HA GLU A 38 1.206 -1.511 7.312 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.034 0.403 8.061 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.118 -0.774 6.765 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.113 -2.041 8.360 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.456 -2.447 8.764 1.00 0.00 H new ATOM 585 N PHE A 39 0.962 0.123 5.251 1.00 0.00 N ATOM 586 CA PHE A 39 1.211 1.026 4.135 1.00 0.00 C ATOM 587 C PHE A 39 0.047 2.000 3.984 1.00 0.00 C ATOM 588 O PHE A 39 -1.051 1.754 4.484 1.00 0.00 O ATOM 589 CB PHE A 39 1.422 0.255 2.824 1.00 0.00 C ATOM 590 CG PHE A 39 2.597 -0.666 2.827 1.00 0.00 C ATOM 591 CD1 PHE A 39 3.883 -0.182 2.965 1.00 0.00 C ATOM 592 CD2 PHE A 39 2.406 -2.026 2.686 1.00 0.00 C ATOM 593 CE1 PHE A 39 4.958 -1.042 2.963 1.00 0.00 C ATOM 594 CE2 PHE A 39 3.473 -2.889 2.685 1.00 0.00 C ATOM 595 CZ PHE A 39 4.756 -2.400 2.826 1.00 0.00 C ATOM 0 H PHE A 39 0.571 -0.781 4.985 1.00 0.00 H new ATOM 0 HA PHE A 39 2.125 1.580 4.349 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.524 -0.324 2.610 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.541 0.972 2.011 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.047 0.880 3.075 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.405 -2.415 2.575 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.960 -0.653 3.069 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.309 -3.951 2.574 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.598 -3.077 2.829 1.00 0.00 H new ATOM 605 N ALA A 40 0.288 3.114 3.313 1.00 0.00 N ATOM 606 CA ALA A 40 -0.761 4.092 3.081 1.00 0.00 C ATOM 607 C ALA A 40 -1.497 3.779 1.787 1.00 0.00 C ATOM 608 O ALA A 40 -1.131 2.851 1.069 1.00 0.00 O ATOM 609 CB ALA A 40 -0.181 5.497 3.043 1.00 0.00 C ATOM 0 H ALA A 40 1.196 3.363 2.921 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.474 4.040 3.904 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.981 6.216 2.868 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.303 5.717 3.995 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.551 5.567 2.239 1.00 0.00 H new ATOM 615 N GLY A 41 -2.536 4.542 1.491 1.00 0.00 N ATOM 616 CA GLY A 41 -3.288 4.319 0.278 1.00 0.00 C ATOM 617 C GLY A 41 -4.767 4.514 0.498 1.00 0.00 C ATOM 618 O GLY A 41 -5.174 5.470 1.158 1.00 0.00 O ATOM 0 H GLY A 41 -2.872 5.312 2.070 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.941 5.003 -0.497 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.104 3.308 -0.084 1.00 0.00 H new ATOM 622 N GLY A 42 -5.566 3.604 -0.030 1.00 0.00 N ATOM 623 CA GLY A 42 -6.999 3.708 0.121 1.00 0.00 C ATOM 624 C GLY A 42 -7.738 2.713 -0.744 1.00 0.00 C ATOM 625 O GLY A 42 -7.255 1.615 -0.992 1.00 0.00 O ATOM 0 H GLY A 42 -5.247 2.794 -0.561 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.265 3.547 1.166 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.317 4.718 -0.137 1.00 0.00 H new ATOM 629 N LYS A 43 -8.887 3.118 -1.240 1.00 0.00 N ATOM 630 CA LYS A 43 -9.745 2.233 -2.005 1.00 0.00 C ATOM 631 C LYS A 43 -10.050 2.851 -3.363 1.00 0.00 C ATOM 632 O LYS A 43 -10.031 4.069 -3.514 1.00 0.00 O ATOM 633 CB LYS A 43 -11.024 1.924 -1.210 1.00 0.00 C ATOM 634 CG LYS A 43 -12.137 1.277 -2.017 1.00 0.00 C ATOM 635 CD LYS A 43 -13.195 0.669 -1.109 1.00 0.00 C ATOM 636 CE LYS A 43 -14.512 0.463 -1.839 1.00 0.00 C ATOM 637 NZ LYS A 43 -15.226 1.747 -2.056 1.00 0.00 N ATOM 0 H LYS A 43 -9.253 4.063 -1.127 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.233 1.287 -2.182 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -10.768 1.267 -0.379 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.400 2.852 -0.779 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.597 2.021 -2.668 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -11.720 0.504 -2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.839 -0.287 -0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.354 1.319 -0.249 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.324 -0.016 -2.800 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -15.145 -0.213 -1.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -16.150 1.560 -2.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -15.367 2.224 -1.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -14.662 2.356 -2.682 1.00 0.00 H new ATOM 651 N VAL A 44 -10.313 2.005 -4.346 1.00 0.00 N ATOM 652 CA VAL A 44 -10.533 2.463 -5.705 1.00 0.00 C ATOM 653 C VAL A 44 -12.019 2.618 -5.966 1.00 0.00 C ATOM 654 O VAL A 44 -12.761 1.631 -5.959 1.00 0.00 O ATOM 655 CB VAL A 44 -9.952 1.471 -6.736 1.00 0.00 C ATOM 656 CG1 VAL A 44 -10.166 1.974 -8.157 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.477 1.229 -6.476 1.00 0.00 C ATOM 0 H VAL A 44 -10.379 0.994 -4.226 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.027 3.422 -5.814 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.482 0.525 -6.626 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.748 1.257 -8.864 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.233 2.089 -8.345 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.670 2.937 -8.281 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.088 0.527 -7.214 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.935 2.172 -6.551 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.347 0.814 -5.477 1.00 0.00 H new ATOM 667 N GLU A 45 -12.462 3.844 -6.176 1.00 0.00 N ATOM 668 CA GLU A 45 -13.840 4.070 -6.536 1.00 0.00 C ATOM 669 C GLU A 45 -13.997 3.844 -8.027 1.00 0.00 C ATOM 670 O GLU A 45 -13.109 4.196 -8.802 1.00 0.00 O ATOM 671 CB GLU A 45 -14.281 5.479 -6.147 1.00 0.00 C ATOM 672 CG GLU A 45 -14.218 5.738 -4.653 1.00 0.00 C ATOM 673 CD GLU A 45 -14.992 4.714 -3.850 1.00 0.00 C ATOM 674 OE1 GLU A 45 -16.241 4.768 -3.850 1.00 0.00 O ATOM 675 OE2 GLU A 45 -14.356 3.846 -3.219 1.00 0.00 O ATOM 0 H GLU A 45 -11.891 4.686 -6.103 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.477 3.372 -5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.650 6.204 -6.661 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.301 5.641 -6.494 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.177 5.734 -4.331 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.613 6.732 -4.444 1.00 0.00 H new ATOM 682 N PRO A 46 -15.111 3.233 -8.451 1.00 0.00 N ATOM 683 CA PRO A 46 -15.346 2.898 -9.857 1.00 0.00 C ATOM 684 C PRO A 46 -15.124 4.088 -10.787 1.00 0.00 C ATOM 685 O PRO A 46 -14.596 3.939 -11.890 1.00 0.00 O ATOM 686 CB PRO A 46 -16.817 2.451 -9.893 1.00 0.00 C ATOM 687 CG PRO A 46 -17.386 2.798 -8.557 1.00 0.00 C ATOM 688 CD PRO A 46 -16.231 2.815 -7.599 1.00 0.00 C ATOM 0 HA PRO A 46 -14.652 2.133 -10.206 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.359 2.958 -10.691 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -16.895 1.381 -10.084 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -17.882 3.768 -8.586 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -18.134 2.067 -8.251 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -16.397 3.512 -6.777 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -16.058 1.834 -7.155 1.00 0.00 H new ATOM 696 N ASP A 47 -15.507 5.268 -10.322 1.00 0.00 N ATOM 697 CA ASP A 47 -15.419 6.475 -11.137 1.00 0.00 C ATOM 698 C ASP A 47 -14.000 7.037 -11.200 1.00 0.00 C ATOM 699 O ASP A 47 -13.755 8.024 -11.896 1.00 0.00 O ATOM 700 CB ASP A 47 -16.378 7.555 -10.630 1.00 0.00 C ATOM 701 CG ASP A 47 -17.829 7.120 -10.658 1.00 0.00 C ATOM 702 OD1 ASP A 47 -18.315 6.708 -11.731 1.00 0.00 O ATOM 703 OD2 ASP A 47 -18.486 7.183 -9.600 1.00 0.00 O ATOM 0 H ASP A 47 -15.882 5.417 -9.385 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.707 6.182 -12.147 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.105 7.825 -9.610 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.262 8.451 -11.239 1.00 0.00 H new ATOM 708 N GLU A 48 -13.064 6.421 -10.496 1.00 0.00 N ATOM 709 CA GLU A 48 -11.686 6.898 -10.516 1.00 0.00 C ATOM 710 C GLU A 48 -10.705 5.763 -10.813 1.00 0.00 C ATOM 711 O GLU A 48 -11.093 4.600 -10.927 1.00 0.00 O ATOM 712 CB GLU A 48 -11.333 7.624 -9.207 1.00 0.00 C ATOM 713 CG GLU A 48 -11.367 6.774 -7.954 1.00 0.00 C ATOM 714 CD GLU A 48 -11.233 7.633 -6.712 1.00 0.00 C ATOM 715 OE1 GLU A 48 -10.096 8.015 -6.367 1.00 0.00 O ATOM 716 OE2 GLU A 48 -12.274 7.956 -6.101 1.00 0.00 O ATOM 0 H GLU A 48 -13.227 5.601 -9.911 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.597 7.620 -11.327 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.335 8.050 -9.307 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -12.024 8.457 -9.077 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.302 6.215 -7.915 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.559 6.043 -7.984 1.00 0.00 H new ATOM 723 N SER A 49 -9.441 6.122 -10.974 1.00 0.00 N ATOM 724 CA SER A 49 -8.415 5.163 -11.356 1.00 0.00 C ATOM 725 C SER A 49 -7.525 4.813 -10.165 1.00 0.00 C ATOM 726 O SER A 49 -7.517 5.524 -9.162 1.00 0.00 O ATOM 727 CB SER A 49 -7.577 5.727 -12.509 1.00 0.00 C ATOM 728 OG SER A 49 -6.754 4.728 -13.083 1.00 0.00 O ATOM 0 H SER A 49 -9.100 7.075 -10.846 1.00 0.00 H new ATOM 0 HA SER A 49 -8.902 4.247 -11.689 1.00 0.00 H new ATOM 0 HB2 SER A 49 -8.236 6.141 -13.272 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.958 6.546 -12.144 1.00 0.00 H new ATOM 0 HG SER A 49 -6.232 5.116 -13.817 1.00 0.00 H new ATOM 734 N GLN A 50 -6.765 3.722 -10.290 1.00 0.00 N ATOM 735 CA GLN A 50 -5.892 3.254 -9.213 1.00 0.00 C ATOM 736 C GLN A 50 -4.853 4.308 -8.843 1.00 0.00 C ATOM 737 O GLN A 50 -4.752 4.711 -7.682 1.00 0.00 O ATOM 738 CB GLN A 50 -5.179 1.959 -9.610 1.00 0.00 C ATOM 739 CG GLN A 50 -6.115 0.796 -9.884 1.00 0.00 C ATOM 740 CD GLN A 50 -5.362 -0.503 -10.095 1.00 0.00 C ATOM 741 OE1 GLN A 50 -4.290 -0.711 -9.526 1.00 0.00 O ATOM 742 NE2 GLN A 50 -5.915 -1.387 -10.910 1.00 0.00 N ATOM 0 H GLN A 50 -6.738 3.145 -11.131 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.525 3.064 -8.346 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.578 2.146 -10.500 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.490 1.677 -8.814 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.806 0.683 -9.049 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.715 1.014 -10.767 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.805 -1.177 -11.362 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.452 -2.278 -11.086 1.00 0.00 H new ATOM 751 N ARG A 51 -4.088 4.762 -9.836 1.00 0.00 N ATOM 752 CA ARG A 51 -3.063 5.778 -9.598 1.00 0.00 C ATOM 753 C ARG A 51 -3.704 7.061 -9.090 1.00 0.00 C ATOM 754 O ARG A 51 -3.132 7.767 -8.269 1.00 0.00 O ATOM 755 CB ARG A 51 -2.263 6.083 -10.869 1.00 0.00 C ATOM 756 CG ARG A 51 -1.673 4.856 -11.546 1.00 0.00 C ATOM 757 CD ARG A 51 -0.785 5.242 -12.719 1.00 0.00 C ATOM 758 NE ARG A 51 -0.389 4.078 -13.516 1.00 0.00 N ATOM 759 CZ ARG A 51 0.783 3.958 -14.143 1.00 0.00 C ATOM 760 NH1 ARG A 51 1.713 4.898 -14.027 1.00 0.00 N ATOM 761 NH2 ARG A 51 1.023 2.883 -14.879 1.00 0.00 N ATOM 0 H ARG A 51 -4.157 4.446 -10.803 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.379 5.382 -8.848 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.911 6.598 -11.578 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.454 6.770 -10.619 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.094 4.283 -10.822 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.478 4.209 -11.895 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.313 5.953 -13.354 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.107 5.747 -12.348 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.053 3.308 -13.597 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.536 5.723 -13.454 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.605 4.795 -14.511 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.314 2.154 -14.963 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.916 2.784 -15.361 1.00 0.00 H new ATOM 775 N GLN A 52 -4.918 7.328 -9.555 1.00 0.00 N ATOM 776 CA GLN A 52 -5.624 8.548 -9.198 1.00 0.00 C ATOM 777 C GLN A 52 -6.060 8.498 -7.739 1.00 0.00 C ATOM 778 O GLN A 52 -5.859 9.456 -6.991 1.00 0.00 O ATOM 779 CB GLN A 52 -6.833 8.738 -10.122 1.00 0.00 C ATOM 780 CG GLN A 52 -7.815 9.796 -9.647 1.00 0.00 C ATOM 781 CD GLN A 52 -8.948 10.030 -10.625 1.00 0.00 C ATOM 782 OE1 GLN A 52 -9.347 9.125 -11.362 1.00 0.00 O ATOM 783 NE2 GLN A 52 -9.475 11.246 -10.643 1.00 0.00 N ATOM 0 H GLN A 52 -5.434 6.712 -10.183 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.954 9.399 -9.323 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.478 9.007 -11.117 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.357 7.787 -10.217 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.229 9.495 -8.685 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.282 10.733 -9.485 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.116 11.967 -10.017 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.240 11.461 -11.283 1.00 0.00 H new ATOM 792 N ALA A 53 -6.630 7.365 -7.345 1.00 0.00 N ATOM 793 CA ALA A 53 -7.092 7.167 -5.980 1.00 0.00 C ATOM 794 C ALA A 53 -5.942 7.319 -4.994 1.00 0.00 C ATOM 795 O ALA A 53 -6.060 8.021 -3.992 1.00 0.00 O ATOM 796 CB ALA A 53 -7.746 5.802 -5.838 1.00 0.00 C ATOM 0 H ALA A 53 -6.783 6.565 -7.959 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.835 7.932 -5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.087 5.667 -4.812 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.597 5.734 -6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.023 5.025 -6.085 1.00 0.00 H new ATOM 802 N LEU A 54 -4.815 6.687 -5.301 1.00 0.00 N ATOM 803 CA LEU A 54 -3.638 6.780 -4.449 1.00 0.00 C ATOM 804 C LEU A 54 -3.152 8.217 -4.337 1.00 0.00 C ATOM 805 O LEU A 54 -2.866 8.698 -3.243 1.00 0.00 O ATOM 806 CB LEU A 54 -2.507 5.898 -4.979 1.00 0.00 C ATOM 807 CG LEU A 54 -2.664 4.403 -4.704 1.00 0.00 C ATOM 808 CD1 LEU A 54 -1.464 3.630 -5.229 1.00 0.00 C ATOM 809 CD2 LEU A 54 -2.846 4.164 -3.213 1.00 0.00 C ATOM 0 H LEU A 54 -4.693 6.107 -6.131 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.927 6.429 -3.458 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.426 6.046 -6.056 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.568 6.235 -4.539 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.551 4.044 -5.227 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.597 2.568 -5.023 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.375 3.782 -6.305 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.559 3.985 -4.736 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.957 3.096 -3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.974 4.537 -2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.737 4.687 -2.867 1.00 0.00 H new ATOM 821 N VAL A 55 -3.090 8.906 -5.466 1.00 0.00 N ATOM 822 CA VAL A 55 -2.589 10.274 -5.494 1.00 0.00 C ATOM 823 C VAL A 55 -3.459 11.194 -4.639 1.00 0.00 C ATOM 824 O VAL A 55 -2.945 11.971 -3.833 1.00 0.00 O ATOM 825 CB VAL A 55 -2.497 10.825 -6.936 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.257 12.329 -6.932 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.386 10.122 -7.697 1.00 0.00 C ATOM 0 H VAL A 55 -3.379 8.542 -6.374 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.582 10.251 -5.077 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.447 10.632 -7.433 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.196 12.691 -7.959 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.080 12.827 -6.420 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.323 12.547 -6.415 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.332 10.519 -8.711 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.436 10.289 -7.190 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.593 9.052 -7.737 1.00 0.00 H new ATOM 837 N ARG A 56 -4.776 11.075 -4.779 1.00 0.00 N ATOM 838 CA ARG A 56 -5.689 11.956 -4.066 1.00 0.00 C ATOM 839 C ARG A 56 -5.709 11.634 -2.571 1.00 0.00 C ATOM 840 O ARG A 56 -5.751 12.541 -1.737 1.00 0.00 O ATOM 841 CB ARG A 56 -7.096 11.903 -4.691 1.00 0.00 C ATOM 842 CG ARG A 56 -7.781 10.549 -4.616 1.00 0.00 C ATOM 843 CD ARG A 56 -8.692 10.457 -3.407 1.00 0.00 C ATOM 844 NE ARG A 56 -9.850 11.340 -3.529 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.587 11.756 -2.499 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.327 11.324 -1.273 1.00 0.00 N ATOM 847 NH2 ARG A 56 -11.597 12.594 -2.702 1.00 0.00 N ATOM 0 H ARG A 56 -5.230 10.383 -5.375 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.329 12.980 -4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.726 12.640 -4.194 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.024 12.199 -5.737 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.361 10.382 -5.524 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.029 9.761 -4.568 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.031 9.428 -3.285 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.131 10.716 -2.509 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.111 11.658 -4.462 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.560 10.670 -1.115 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.894 11.645 -0.488 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.808 12.919 -3.645 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.161 12.913 -1.914 1.00 0.00 H new ATOM 861 N GLU A 57 -5.671 10.347 -2.233 1.00 0.00 N ATOM 862 CA GLU A 57 -5.631 9.926 -0.835 1.00 0.00 C ATOM 863 C GLU A 57 -4.352 10.370 -0.138 1.00 0.00 C ATOM 864 O GLU A 57 -4.404 10.909 0.963 1.00 0.00 O ATOM 865 CB GLU A 57 -5.796 8.407 -0.718 1.00 0.00 C ATOM 866 CG GLU A 57 -7.177 7.924 -1.110 1.00 0.00 C ATOM 867 CD GLU A 57 -8.248 8.471 -0.194 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.566 9.674 -0.295 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.769 7.706 0.637 1.00 0.00 O ATOM 0 H GLU A 57 -5.667 9.580 -2.906 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.467 10.414 -0.333 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -5.054 7.918 -1.350 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.590 8.104 0.309 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.389 8.225 -2.136 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.201 6.835 -1.086 1.00 0.00 H new ATOM 876 N LEU A 58 -3.203 10.165 -0.773 1.00 0.00 N ATOM 877 CA LEU A 58 -1.936 10.528 -0.141 1.00 0.00 C ATOM 878 C LEU A 58 -1.837 12.035 0.030 1.00 0.00 C ATOM 879 O LEU A 58 -1.255 12.517 0.997 1.00 0.00 O ATOM 880 CB LEU A 58 -0.734 10.028 -0.937 1.00 0.00 C ATOM 881 CG LEU A 58 -0.742 8.542 -1.294 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.590 8.136 -1.896 1.00 0.00 C ATOM 883 CD2 LEU A 58 -1.063 7.685 -0.079 1.00 0.00 C ATOM 0 H LEU A 58 -3.120 9.758 -1.705 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.920 10.045 0.836 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.669 10.603 -1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.170 10.240 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.525 8.377 -2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.569 7.075 -2.145 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.773 8.717 -2.800 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.387 8.324 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.061 6.633 -0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.312 7.852 0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.046 7.954 0.307 1.00 0.00 H new ATOM 895 N ARG A 59 -2.401 12.776 -0.913 1.00 0.00 N ATOM 896 CA ARG A 59 -2.473 14.227 -0.802 1.00 0.00 C ATOM 897 C ARG A 59 -3.189 14.636 0.485 1.00 0.00 C ATOM 898 O ARG A 59 -2.849 15.643 1.106 1.00 0.00 O ATOM 899 CB ARG A 59 -3.191 14.814 -2.022 1.00 0.00 C ATOM 900 CG ARG A 59 -3.537 16.289 -1.884 1.00 0.00 C ATOM 901 CD ARG A 59 -4.118 16.856 -3.169 1.00 0.00 C ATOM 902 NE ARG A 59 -4.700 18.181 -2.964 1.00 0.00 N ATOM 903 CZ ARG A 59 -4.463 19.236 -3.742 1.00 0.00 C ATOM 904 NH1 ARG A 59 -3.536 19.174 -4.691 1.00 0.00 N ATOM 905 NH2 ARG A 59 -5.130 20.368 -3.539 1.00 0.00 N ATOM 0 H ARG A 59 -2.816 12.397 -1.764 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.458 14.622 -0.767 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.561 14.680 -2.901 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.108 14.251 -2.197 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.253 16.420 -1.073 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.642 16.848 -1.612 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.336 16.916 -3.926 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.882 16.179 -3.552 1.00 0.00 H new ATOM 0 HE ARG A 59 -5.330 18.306 -2.172 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.002 18.316 -4.827 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.358 19.985 -5.284 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -5.820 20.426 -2.790 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -4.952 21.178 -4.132 1.00 0.00 H new ATOM 919 N GLU A 60 -4.168 13.841 0.884 1.00 0.00 N ATOM 920 CA GLU A 60 -4.949 14.149 2.070 1.00 0.00 C ATOM 921 C GLU A 60 -4.335 13.547 3.328 1.00 0.00 C ATOM 922 O GLU A 60 -4.265 14.203 4.368 1.00 0.00 O ATOM 923 CB GLU A 60 -6.392 13.675 1.917 1.00 0.00 C ATOM 924 CG GLU A 60 -7.106 14.270 0.717 1.00 0.00 C ATOM 925 CD GLU A 60 -8.581 14.493 0.974 1.00 0.00 C ATOM 926 OE1 GLU A 60 -8.923 15.490 1.645 1.00 0.00 O ATOM 927 OE2 GLU A 60 -9.406 13.685 0.499 1.00 0.00 O ATOM 0 H GLU A 60 -4.440 12.982 0.407 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.943 15.234 2.177 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.401 12.588 1.832 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.946 13.929 2.821 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -6.639 15.219 0.453 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.986 13.607 -0.139 1.00 0.00 H new ATOM 934 N GLU A 61 -3.887 12.303 3.233 1.00 0.00 N ATOM 935 CA GLU A 61 -3.421 11.581 4.407 1.00 0.00 C ATOM 936 C GLU A 61 -1.941 11.784 4.659 1.00 0.00 C ATOM 937 O GLU A 61 -1.514 11.874 5.812 1.00 0.00 O ATOM 938 CB GLU A 61 -3.706 10.089 4.281 1.00 0.00 C ATOM 939 CG GLU A 61 -5.173 9.772 4.122 1.00 0.00 C ATOM 940 CD GLU A 61 -6.005 10.412 5.212 1.00 0.00 C ATOM 941 OE1 GLU A 61 -5.491 10.568 6.339 1.00 0.00 O ATOM 942 OE2 GLU A 61 -7.160 10.795 4.946 1.00 0.00 O ATOM 0 H GLU A 61 -3.837 11.776 2.361 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.971 11.990 5.255 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.161 9.693 3.424 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.325 9.578 5.165 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.517 10.121 3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.316 8.692 4.142 1.00 0.00 H new ATOM 949 N LEU A 62 -1.147 11.831 3.605 1.00 0.00 N ATOM 950 CA LEU A 62 0.286 11.931 3.780 1.00 0.00 C ATOM 951 C LEU A 62 0.780 13.351 3.557 1.00 0.00 C ATOM 952 O LEU A 62 1.870 13.700 4.002 1.00 0.00 O ATOM 953 CB LEU A 62 1.004 10.955 2.851 1.00 0.00 C ATOM 954 CG LEU A 62 0.605 9.488 3.030 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.473 8.600 2.159 1.00 0.00 C ATOM 956 CD2 LEU A 62 0.711 9.068 4.491 1.00 0.00 C ATOM 0 H LEU A 62 -1.464 11.802 2.636 1.00 0.00 H new ATOM 0 HA LEU A 62 0.516 11.665 4.812 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.809 11.247 1.819 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.078 11.047 3.010 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.435 9.376 2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.180 7.559 2.295 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.345 8.879 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.518 8.723 2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.422 8.022 4.591 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.738 9.195 4.832 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.049 9.687 5.096 1.00 0.00 H new ATOM 968 N GLY A 63 -0.009 14.175 2.868 1.00 0.00 N ATOM 969 CA GLY A 63 0.382 15.553 2.666 1.00 0.00 C ATOM 970 C GLY A 63 1.323 15.707 1.489 1.00 0.00 C ATOM 971 O GLY A 63 1.973 16.741 1.332 1.00 0.00 O ATOM 0 H GLY A 63 -0.902 13.912 2.452 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -0.507 16.162 2.502 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.864 15.929 3.568 1.00 0.00 H new ATOM 975 N ILE A 64 1.396 14.677 0.654 1.00 0.00 N ATOM 976 CA ILE A 64 2.300 14.685 -0.486 1.00 0.00 C ATOM 977 C ILE A 64 1.543 14.462 -1.791 1.00 0.00 C ATOM 978 O ILE A 64 0.564 13.715 -1.834 1.00 0.00 O ATOM 979 CB ILE A 64 3.402 13.601 -0.368 1.00 0.00 C ATOM 980 CG1 ILE A 64 2.785 12.200 -0.357 1.00 0.00 C ATOM 981 CG2 ILE A 64 4.254 13.815 0.875 1.00 0.00 C ATOM 982 CD1 ILE A 64 3.817 11.090 -0.381 1.00 0.00 C ATOM 0 H ILE A 64 0.840 13.827 0.746 1.00 0.00 H new ATOM 0 HA ILE A 64 2.770 15.668 -0.491 1.00 0.00 H new ATOM 0 HB ILE A 64 4.049 13.689 -1.241 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.165 12.091 0.533 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.127 12.094 -1.219 1.00 0.00 H new ATOM 0 HG21 ILE A 64 5.018 13.039 0.930 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.733 14.793 0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.622 13.766 1.762 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.312 10.124 -0.372 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.422 11.175 -1.284 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.460 11.172 0.495 1.00 0.00 H new ATOM 994 N GLU A 65 1.994 15.126 -2.845 1.00 0.00 N ATOM 995 CA GLU A 65 1.496 14.868 -4.188 1.00 0.00 C ATOM 996 C GLU A 65 2.304 13.727 -4.786 1.00 0.00 C ATOM 997 O GLU A 65 3.434 13.925 -5.239 1.00 0.00 O ATOM 998 CB GLU A 65 1.627 16.111 -5.070 1.00 0.00 C ATOM 999 CG GLU A 65 0.962 17.348 -4.494 1.00 0.00 C ATOM 1000 CD GLU A 65 -0.554 17.270 -4.470 1.00 0.00 C ATOM 1001 OE1 GLU A 65 -1.146 16.643 -5.374 1.00 0.00 O ATOM 1002 OE2 GLU A 65 -1.159 17.873 -3.557 1.00 0.00 O ATOM 0 H GLU A 65 2.709 15.852 -2.795 1.00 0.00 H new ATOM 0 HA GLU A 65 0.440 14.604 -4.136 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.685 16.321 -5.230 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.192 15.899 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.325 17.505 -3.478 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.263 18.217 -5.079 1.00 0.00 H new ATOM 1009 N ALA A 66 1.745 12.533 -4.754 1.00 0.00 N ATOM 1010 CA ALA A 66 2.482 11.347 -5.149 1.00 0.00 C ATOM 1011 C ALA A 66 2.433 11.121 -6.652 1.00 0.00 C ATOM 1012 O ALA A 66 1.454 11.458 -7.318 1.00 0.00 O ATOM 1013 CB ALA A 66 1.941 10.132 -4.419 1.00 0.00 C ATOM 0 H ALA A 66 0.784 12.358 -4.459 1.00 0.00 H new ATOM 0 HA ALA A 66 3.526 11.501 -4.875 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.500 9.247 -4.722 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.046 10.277 -3.344 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.888 9.998 -4.666 1.00 0.00 H new ATOM 1019 N THR A 67 3.503 10.552 -7.173 1.00 0.00 N ATOM 1020 CA THR A 67 3.574 10.167 -8.566 1.00 0.00 C ATOM 1021 C THR A 67 3.603 8.645 -8.660 1.00 0.00 C ATOM 1022 O THR A 67 4.605 8.018 -8.328 1.00 0.00 O ATOM 1023 CB THR A 67 4.829 10.753 -9.245 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.867 12.175 -9.059 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.842 10.437 -10.732 1.00 0.00 C ATOM 0 H THR A 67 4.348 10.344 -6.640 1.00 0.00 H new ATOM 0 HA THR A 67 2.698 10.561 -9.081 1.00 0.00 H new ATOM 0 HB THR A 67 5.706 10.298 -8.785 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.740 12.434 -8.696 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.737 10.862 -11.186 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.840 9.356 -10.874 1.00 0.00 H new ATOM 0 HG23 THR A 67 3.958 10.866 -11.203 1.00 0.00 H new ATOM 1033 N VAL A 68 2.497 8.054 -9.077 1.00 0.00 N ATOM 1034 CA VAL A 68 2.390 6.603 -9.147 1.00 0.00 C ATOM 1035 C VAL A 68 2.779 6.115 -10.538 1.00 0.00 C ATOM 1036 O VAL A 68 2.200 6.550 -11.536 1.00 0.00 O ATOM 1037 CB VAL A 68 0.958 6.126 -8.818 1.00 0.00 C ATOM 1038 CG1 VAL A 68 0.896 4.610 -8.753 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.469 6.735 -7.512 1.00 0.00 C ATOM 0 H VAL A 68 1.659 8.555 -9.373 1.00 0.00 H new ATOM 0 HA VAL A 68 3.071 6.185 -8.406 1.00 0.00 H new ATOM 0 HB VAL A 68 0.300 6.463 -9.619 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.122 4.297 -8.520 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.193 4.192 -9.715 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.572 4.251 -7.977 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.541 6.384 -7.303 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.132 6.436 -6.700 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.465 7.822 -7.596 1.00 0.00 H new ATOM 1049 N GLY A 69 3.748 5.207 -10.611 1.00 0.00 N ATOM 1050 CA GLY A 69 4.221 4.759 -11.906 1.00 0.00 C ATOM 1051 C GLY A 69 5.175 3.582 -11.840 1.00 0.00 C ATOM 1052 O GLY A 69 6.349 3.735 -12.180 1.00 0.00 O ATOM 0 H GLY A 69 4.208 4.779 -9.808 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.363 4.484 -12.520 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.719 5.589 -12.407 1.00 0.00 H new ATOM 1056 N GLU A 70 4.647 2.410 -11.440 1.00 0.00 N ATOM 1057 CA GLU A 70 5.390 1.138 -11.350 1.00 0.00 C ATOM 1058 C GLU A 70 4.672 0.200 -10.370 1.00 0.00 C ATOM 1059 O GLU A 70 4.702 0.396 -9.151 1.00 0.00 O ATOM 1060 CB GLU A 70 6.876 1.294 -10.969 1.00 0.00 C ATOM 1061 CG GLU A 70 7.152 2.062 -9.690 1.00 0.00 C ATOM 1062 CD GLU A 70 8.633 2.314 -9.502 1.00 0.00 C ATOM 1063 OE1 GLU A 70 9.329 1.425 -8.965 1.00 0.00 O ATOM 1064 OE2 GLU A 70 9.110 3.399 -9.884 1.00 0.00 O ATOM 0 H GLU A 70 3.669 2.319 -11.164 1.00 0.00 H new ATOM 0 HA GLU A 70 5.399 0.710 -12.352 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.314 0.300 -10.876 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.391 1.794 -11.789 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.620 3.013 -9.714 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.766 1.502 -8.838 1.00 0.00 H new ATOM 1071 N TYR A 71 3.979 -0.788 -10.921 1.00 0.00 N ATOM 1072 CA TYR A 71 3.171 -1.716 -10.132 1.00 0.00 C ATOM 1073 C TYR A 71 4.044 -2.796 -9.495 1.00 0.00 C ATOM 1074 O TYR A 71 4.849 -3.429 -10.177 1.00 0.00 O ATOM 1075 CB TYR A 71 2.120 -2.349 -11.047 1.00 0.00 C ATOM 1076 CG TYR A 71 1.019 -3.101 -10.334 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.392 -2.567 -9.218 1.00 0.00 C ATOM 1078 CD2 TYR A 71 0.582 -4.332 -10.804 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.638 -3.237 -8.590 1.00 0.00 C ATOM 1080 CE2 TYR A 71 -0.443 -5.010 -10.178 1.00 0.00 C ATOM 1081 CZ TYR A 71 -1.050 -4.457 -9.073 1.00 0.00 C ATOM 1082 OH TYR A 71 -2.082 -5.123 -8.457 1.00 0.00 O ATOM 0 H TYR A 71 3.959 -0.971 -11.924 1.00 0.00 H new ATOM 0 HA TYR A 71 2.681 -1.172 -9.325 1.00 0.00 H new ATOM 0 HB2 TYR A 71 1.669 -1.564 -11.654 1.00 0.00 H new ATOM 0 HB3 TYR A 71 2.621 -3.033 -11.732 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.715 -1.611 -8.834 1.00 0.00 H new ATOM 0 HD2 TYR A 71 1.052 -4.766 -11.674 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.118 -2.806 -7.724 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.768 -5.970 -10.553 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.409 -5.836 -9.045 1.00 0.00 H new ATOM 1092 N VAL A 72 3.887 -3.000 -8.189 1.00 0.00 N ATOM 1093 CA VAL A 72 4.711 -3.967 -7.474 1.00 0.00 C ATOM 1094 C VAL A 72 3.995 -5.295 -7.243 1.00 0.00 C ATOM 1095 O VAL A 72 4.341 -6.305 -7.856 1.00 0.00 O ATOM 1096 CB VAL A 72 5.162 -3.410 -6.108 1.00 0.00 C ATOM 1097 CG1 VAL A 72 5.873 -4.482 -5.290 1.00 0.00 C ATOM 1098 CG2 VAL A 72 6.054 -2.193 -6.297 1.00 0.00 C ATOM 0 H VAL A 72 3.203 -2.513 -7.610 1.00 0.00 H new ATOM 0 HA VAL A 72 5.577 -4.147 -8.111 1.00 0.00 H new ATOM 0 HB VAL A 72 4.274 -3.102 -5.556 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.181 -4.064 -4.332 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.196 -5.319 -5.120 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.752 -4.831 -5.833 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.363 -1.813 -5.323 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.936 -2.474 -6.873 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.504 -1.418 -6.831 1.00 0.00 H new ATOM 1108 N ALA A 73 2.988 -5.295 -6.377 1.00 0.00 N ATOM 1109 CA ALA A 73 2.361 -6.545 -5.975 1.00 0.00 C ATOM 1110 C ALA A 73 0.844 -6.448 -5.922 1.00 0.00 C ATOM 1111 O ALA A 73 0.262 -5.405 -6.212 1.00 0.00 O ATOM 1112 CB ALA A 73 2.899 -6.980 -4.623 1.00 0.00 C ATOM 0 H ALA A 73 2.595 -4.458 -5.947 1.00 0.00 H new ATOM 0 HA ALA A 73 2.609 -7.288 -6.733 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.426 -7.916 -4.327 1.00 0.00 H new ATOM 0 HB2 ALA A 73 3.977 -7.124 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 73 2.680 -6.213 -3.880 1.00 0.00 H new ATOM 1118 N SER A 74 0.217 -7.545 -5.519 1.00 0.00 N ATOM 1119 CA SER A 74 -1.229 -7.627 -5.425 1.00 0.00 C ATOM 1120 C SER A 74 -1.630 -8.813 -4.559 1.00 0.00 C ATOM 1121 O SER A 74 -1.052 -9.894 -4.679 1.00 0.00 O ATOM 1122 CB SER A 74 -1.849 -7.758 -6.817 1.00 0.00 C ATOM 1123 OG SER A 74 -1.242 -8.806 -7.559 1.00 0.00 O ATOM 0 H SER A 74 0.699 -8.402 -5.249 1.00 0.00 H new ATOM 0 HA SER A 74 -1.600 -6.711 -4.965 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.918 -7.948 -6.724 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.738 -6.817 -7.356 1.00 0.00 H new ATOM 0 HG SER A 74 -1.661 -8.866 -8.443 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.600 -8.611 -3.684 1.00 0.00 N ATOM 1130 CA HIS A 75 -3.088 -9.686 -2.836 1.00 0.00 C ATOM 1131 C HIS A 75 -4.605 -9.675 -2.797 1.00 0.00 C ATOM 1132 O HIS A 75 -5.224 -8.631 -2.577 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.522 -9.568 -1.415 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.872 -10.731 -0.533 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -2.214 -11.941 -0.592 1.00 0.00 N ATOM 1136 CD2 HIS A 75 -3.821 -10.869 0.425 1.00 0.00 C ATOM 1137 CE1 HIS A 75 -2.743 -12.771 0.288 1.00 0.00 C ATOM 1138 NE2 HIS A 75 -3.718 -12.146 0.917 1.00 0.00 N ATOM 0 H HIS A 75 -3.065 -7.714 -3.542 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.749 -10.632 -3.259 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.437 -9.478 -1.471 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.895 -8.651 -0.959 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -4.526 -10.115 0.742 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -2.430 -13.790 0.463 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -4.302 -12.547 1.651 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.196 -10.834 -3.027 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.631 -10.985 -2.983 1.00 0.00 C ATOM 1149 C GLN A 76 -7.038 -11.775 -1.746 1.00 0.00 C ATOM 1150 O GLN A 76 -6.410 -12.776 -1.401 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.114 -11.699 -4.241 1.00 0.00 C ATOM 1152 CG GLN A 76 -8.507 -11.286 -4.655 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.939 -11.918 -5.964 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -8.718 -11.358 -7.036 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -9.562 -13.084 -5.886 1.00 0.00 N ATOM 0 H GLN A 76 -4.692 -11.693 -3.249 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.090 -9.998 -2.935 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.422 -11.493 -5.058 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.095 -12.776 -4.071 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -9.212 -11.564 -3.872 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -8.547 -10.201 -4.749 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -9.726 -13.515 -4.976 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -9.878 -13.551 -6.736 1.00 0.00 H new ATOM 1164 N ARG A 77 -8.073 -11.309 -1.078 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.598 -11.970 0.105 1.00 0.00 C ATOM 1166 C ARG A 77 -10.067 -11.621 0.237 1.00 0.00 C ATOM 1167 O ARG A 77 -10.582 -10.860 -0.567 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.833 -11.554 1.366 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.953 -10.081 1.709 1.00 0.00 C ATOM 1170 CD ARG A 77 -7.443 -9.808 3.112 1.00 0.00 C ATOM 1171 NE ARG A 77 -8.339 -10.364 4.132 1.00 0.00 N ATOM 1172 CZ ARG A 77 -8.458 -9.881 5.374 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -7.714 -8.845 5.760 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -9.313 -10.439 6.226 1.00 0.00 N ATOM 0 H ARG A 77 -8.576 -10.461 -1.338 1.00 0.00 H new ATOM 0 HA ARG A 77 -8.475 -13.048 -0.003 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.196 -12.142 2.208 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.779 -11.801 1.236 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.386 -9.489 0.990 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.994 -9.769 1.629 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -6.448 -10.238 3.228 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -7.345 -8.733 3.261 1.00 0.00 H new ATOM 0 HE ARG A 77 -8.908 -11.171 3.878 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -7.054 -8.420 5.109 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -7.805 -8.477 6.707 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -9.878 -11.236 5.933 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -9.403 -10.070 7.173 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.750 -12.177 1.216 1.00 0.00 N ATOM 1189 CA GLU A 78 -12.161 -11.880 1.382 1.00 0.00 C ATOM 1190 C GLU A 78 -12.415 -11.187 2.720 1.00 0.00 C ATOM 1191 O GLU A 78 -11.659 -11.362 3.679 1.00 0.00 O ATOM 1192 CB GLU A 78 -13.012 -13.150 1.280 1.00 0.00 C ATOM 1193 CG GLU A 78 -13.051 -13.960 2.561 1.00 0.00 C ATOM 1194 CD GLU A 78 -14.048 -15.092 2.507 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -15.261 -14.821 2.605 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -13.623 -16.259 2.389 1.00 0.00 O ATOM 0 H GLU A 78 -10.361 -12.827 1.899 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.452 -11.207 0.576 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -14.030 -12.874 1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.622 -13.775 0.477 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -12.059 -14.365 2.760 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -13.300 -13.302 3.394 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.461 -10.379 2.758 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.946 -9.795 3.992 1.00 0.00 C ATOM 1205 C VAL A 79 -15.438 -10.097 4.117 1.00 0.00 C ATOM 1206 O VAL A 79 -16.279 -9.409 3.537 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.685 -8.268 4.081 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -14.157 -7.539 2.833 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -14.332 -7.676 5.327 1.00 0.00 C ATOM 0 H VAL A 79 -13.997 -10.111 1.932 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.395 -10.241 4.820 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.606 -8.129 4.153 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.956 -6.473 2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.626 -7.926 1.963 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.228 -7.695 2.704 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.134 -6.605 5.366 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.408 -7.845 5.294 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.917 -8.154 6.214 1.00 0.00 H new ATOM 1219 N SER A 80 -15.747 -11.170 4.834 1.00 0.00 N ATOM 1220 CA SER A 80 -17.122 -11.620 5.014 1.00 0.00 C ATOM 1221 C SER A 80 -17.847 -11.733 3.664 1.00 0.00 C ATOM 1222 O SER A 80 -18.808 -11.005 3.396 1.00 0.00 O ATOM 1223 CB SER A 80 -17.874 -10.669 5.957 1.00 0.00 C ATOM 1224 OG SER A 80 -19.151 -11.186 6.307 1.00 0.00 O ATOM 0 H SER A 80 -15.054 -11.751 5.306 1.00 0.00 H new ATOM 0 HA SER A 80 -17.101 -12.612 5.465 1.00 0.00 H new ATOM 0 HB2 SER A 80 -17.285 -10.509 6.860 1.00 0.00 H new ATOM 0 HB3 SER A 80 -17.992 -9.697 5.477 1.00 0.00 H new ATOM 0 HG SER A 80 -19.604 -10.559 6.909 1.00 0.00 H new ATOM 1230 N GLY A 81 -17.368 -12.633 2.807 1.00 0.00 N ATOM 1231 CA GLY A 81 -18.019 -12.877 1.532 1.00 0.00 C ATOM 1232 C GLY A 81 -17.607 -11.918 0.421 1.00 0.00 C ATOM 1233 O GLY A 81 -17.799 -12.219 -0.757 1.00 0.00 O ATOM 0 H GLY A 81 -16.537 -13.199 2.975 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.800 -13.897 1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -19.098 -12.811 1.670 1.00 0.00 H new ATOM 1237 N ARG A 82 -17.054 -10.767 0.779 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.648 -9.786 -0.224 1.00 0.00 C ATOM 1239 C ARG A 82 -15.162 -9.907 -0.529 1.00 0.00 C ATOM 1240 O ARG A 82 -14.343 -9.992 0.373 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.996 -8.365 0.230 1.00 0.00 C ATOM 1242 CG ARG A 82 -18.489 -8.141 0.370 1.00 0.00 C ATOM 1243 CD ARG A 82 -18.845 -6.669 0.502 1.00 0.00 C ATOM 1244 NE ARG A 82 -20.294 -6.473 0.444 1.00 0.00 N ATOM 1245 CZ ARG A 82 -20.895 -5.285 0.372 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -20.190 -4.163 0.425 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -22.213 -5.213 0.257 1.00 0.00 N ATOM 0 H ARG A 82 -16.877 -10.490 1.744 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.200 -9.993 -1.141 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -16.512 -8.165 1.186 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.592 -7.650 -0.487 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.999 -8.559 -0.498 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.854 -8.680 1.244 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -18.459 -6.281 1.445 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.365 -6.102 -0.296 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.886 -7.304 0.460 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -19.175 -4.202 0.522 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -20.662 -3.261 0.369 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -22.769 -6.067 0.223 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -22.671 -4.303 0.202 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.819 -9.909 -1.805 1.00 0.00 N ATOM 1262 CA ILE A 83 -13.447 -10.158 -2.227 1.00 0.00 C ATOM 1263 C ILE A 83 -12.664 -8.854 -2.323 1.00 0.00 C ATOM 1264 O ILE A 83 -12.979 -7.990 -3.138 1.00 0.00 O ATOM 1265 CB ILE A 83 -13.399 -10.902 -3.588 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -13.774 -12.384 -3.426 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -12.025 -10.781 -4.231 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -15.208 -12.634 -3.004 1.00 0.00 C ATOM 0 H ILE A 83 -15.472 -9.741 -2.571 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.986 -10.794 -1.471 1.00 0.00 H new ATOM 0 HB ILE A 83 -14.132 -10.429 -4.242 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.594 -12.895 -4.372 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -13.109 -12.834 -2.689 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.021 -11.312 -5.183 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.794 -9.729 -4.401 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.275 -11.215 -3.570 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.379 -13.707 -2.916 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.393 -12.156 -2.042 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.885 -12.219 -3.751 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.656 -8.715 -1.476 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.782 -7.557 -1.510 1.00 0.00 C ATOM 1282 C ILE A 84 -9.577 -7.827 -2.394 1.00 0.00 C ATOM 1283 O ILE A 84 -8.956 -8.890 -2.320 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.278 -7.133 -0.115 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.893 -7.976 0.996 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.593 -5.674 0.137 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.861 -7.270 2.332 1.00 0.00 C ATOM 0 H ILE A 84 -11.424 -9.396 -0.753 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.384 -6.742 -1.912 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.199 -7.289 -0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.924 -8.217 0.739 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.355 -8.921 1.073 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -10.232 -5.389 1.125 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -10.104 -5.060 -0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.671 -5.521 0.087 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -11.310 -7.909 3.092 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.828 -7.053 2.604 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.422 -6.338 2.264 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.254 -6.859 -3.228 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.145 -6.975 -4.157 1.00 0.00 C ATOM 1301 C HIS A 85 -7.193 -5.796 -3.973 1.00 0.00 C ATOM 1302 O HIS A 85 -7.446 -4.699 -4.471 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.692 -7.024 -5.588 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.676 -7.351 -6.637 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -7.678 -6.765 -7.884 1.00 0.00 N ATOM 1306 CD2 HIS A 85 -6.642 -8.226 -6.637 1.00 0.00 C ATOM 1307 CE1 HIS A 85 -6.692 -7.265 -8.606 1.00 0.00 C ATOM 1308 NE2 HIS A 85 -6.050 -8.154 -7.872 1.00 0.00 N ATOM 0 H HIS A 85 -9.752 -5.970 -3.282 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.589 -7.892 -3.964 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.490 -7.765 -5.632 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -9.140 -6.059 -5.824 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -8.339 -6.055 -8.200 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -6.340 -8.862 -5.818 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -6.452 -6.993 -9.623 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.115 -6.025 -3.232 1.00 0.00 N ATOM 1318 CA LEU A 86 -5.159 -4.967 -2.921 1.00 0.00 C ATOM 1319 C LEU A 86 -4.085 -4.850 -3.994 1.00 0.00 C ATOM 1320 O LEU A 86 -3.523 -5.851 -4.440 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.510 -5.200 -1.550 1.00 0.00 C ATOM 1322 CG LEU A 86 -5.400 -4.887 -0.348 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.315 -6.056 -0.019 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -4.549 -4.507 0.851 1.00 0.00 C ATOM 0 H LEU A 86 -5.880 -6.935 -2.835 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.714 -4.029 -2.892 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.195 -6.242 -1.487 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.609 -4.590 -1.484 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.034 -4.039 -0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.935 -5.802 0.841 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.953 -6.271 -0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.713 -6.934 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.195 -4.286 1.701 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.887 -5.335 1.104 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.953 -3.627 0.610 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.823 -3.617 -4.410 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.816 -3.325 -5.426 1.00 0.00 C ATOM 1338 C HIS A 87 -1.655 -2.569 -4.796 1.00 0.00 C ATOM 1339 O HIS A 87 -1.828 -1.440 -4.351 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.414 -2.456 -6.538 1.00 0.00 C ATOM 1341 CG HIS A 87 -4.678 -2.988 -7.142 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -5.911 -2.836 -6.549 1.00 0.00 N ATOM 1343 CD2 HIS A 87 -4.901 -3.639 -8.307 1.00 0.00 C ATOM 1344 CE1 HIS A 87 -6.836 -3.367 -7.324 1.00 0.00 C ATOM 1345 NE2 HIS A 87 -6.254 -3.862 -8.401 1.00 0.00 N ATOM 0 H HIS A 87 -4.302 -2.790 -4.053 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.469 -4.269 -5.846 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -3.610 -1.462 -6.137 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -2.672 -2.340 -7.328 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -6.082 -2.384 -5.651 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -4.153 -3.930 -9.030 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -7.895 -3.393 -7.113 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.484 -3.180 -4.751 1.00 0.00 N ATOM 1355 CA ALA A 88 0.680 -2.530 -4.167 1.00 0.00 C ATOM 1356 C ALA A 88 1.463 -1.761 -5.225 1.00 0.00 C ATOM 1357 O ALA A 88 2.090 -2.357 -6.102 1.00 0.00 O ATOM 1358 CB ALA A 88 1.574 -3.546 -3.473 1.00 0.00 C ATOM 0 H ALA A 88 -0.313 -4.120 -5.109 1.00 0.00 H new ATOM 0 HA ALA A 88 0.328 -1.818 -3.421 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.438 -3.038 -3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.014 -4.042 -2.680 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.912 -4.288 -4.197 1.00 0.00 H new ATOM 1364 N TRP A 89 1.410 -0.444 -5.139 1.00 0.00 N ATOM 1365 CA TRP A 89 2.128 0.419 -6.066 1.00 0.00 C ATOM 1366 C TRP A 89 3.316 1.075 -5.377 1.00 0.00 C ATOM 1367 O TRP A 89 3.272 1.367 -4.184 1.00 0.00 O ATOM 1368 CB TRP A 89 1.207 1.511 -6.615 1.00 0.00 C ATOM 1369 CG TRP A 89 0.143 1.018 -7.551 1.00 0.00 C ATOM 1370 CD1 TRP A 89 -1.084 0.517 -7.219 1.00 0.00 C ATOM 1371 CD2 TRP A 89 0.208 1.000 -8.982 1.00 0.00 C ATOM 1372 NE1 TRP A 89 -1.783 0.189 -8.357 1.00 0.00 N ATOM 1373 CE2 TRP A 89 -1.012 0.478 -9.448 1.00 0.00 C ATOM 1374 CE3 TRP A 89 1.179 1.376 -9.913 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 -1.287 0.323 -10.802 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 0.906 1.222 -11.259 1.00 0.00 C ATOM 1377 CH2 TRP A 89 -0.319 0.701 -11.692 1.00 0.00 C ATOM 0 H TRP A 89 0.873 0.057 -4.431 1.00 0.00 H new ATOM 0 HA TRP A 89 2.482 -0.202 -6.889 1.00 0.00 H new ATOM 0 HB2 TRP A 89 0.729 2.020 -5.778 1.00 0.00 H new ATOM 0 HB3 TRP A 89 1.814 2.253 -7.134 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -1.451 0.396 -6.211 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -2.723 -0.206 -8.383 1.00 0.00 H new ATOM 0 HE3 TRP A 89 2.126 1.780 -9.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -2.230 -0.081 -11.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 1.649 1.508 -11.988 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -0.504 0.595 -12.751 1.00 0.00 H new ATOM 1388 N HIS A 90 4.377 1.303 -6.131 1.00 0.00 N ATOM 1389 CA HIS A 90 5.514 2.054 -5.632 1.00 0.00 C ATOM 1390 C HIS A 90 5.461 3.464 -6.194 1.00 0.00 C ATOM 1391 O HIS A 90 5.308 3.650 -7.400 1.00 0.00 O ATOM 1392 CB HIS A 90 6.835 1.366 -6.014 1.00 0.00 C ATOM 1393 CG HIS A 90 8.077 2.160 -5.691 1.00 0.00 C ATOM 1394 ND1 HIS A 90 9.168 2.217 -6.529 1.00 0.00 N ATOM 1395 CD2 HIS A 90 8.400 2.924 -4.619 1.00 0.00 C ATOM 1396 CE1 HIS A 90 10.104 2.975 -5.993 1.00 0.00 C ATOM 1397 NE2 HIS A 90 9.666 3.418 -4.832 1.00 0.00 N ATOM 0 H HIS A 90 4.474 0.978 -7.093 1.00 0.00 H new ATOM 0 HA HIS A 90 5.468 2.095 -4.544 1.00 0.00 H new ATOM 0 HB2 HIS A 90 6.890 0.406 -5.501 1.00 0.00 H new ATOM 0 HB3 HIS A 90 6.823 1.155 -7.083 1.00 0.00 H new ATOM 0 HD1 HIS A 90 9.241 1.744 -7.430 1.00 0.00 H new ATOM 0 HD2 HIS A 90 7.778 3.111 -3.756 1.00 0.00 H new ATOM 0 HE1 HIS A 90 11.066 3.195 -6.431 1.00 0.00 H new ATOM 1406 N VAL A 91 5.545 4.450 -5.321 1.00 0.00 N ATOM 1407 CA VAL A 91 5.617 5.833 -5.758 1.00 0.00 C ATOM 1408 C VAL A 91 7.077 6.270 -5.892 1.00 0.00 C ATOM 1409 O VAL A 91 7.773 6.481 -4.900 1.00 0.00 O ATOM 1410 CB VAL A 91 4.849 6.782 -4.808 1.00 0.00 C ATOM 1411 CG1 VAL A 91 3.349 6.582 -4.962 1.00 0.00 C ATOM 1412 CG2 VAL A 91 5.263 6.561 -3.360 1.00 0.00 C ATOM 0 H VAL A 91 5.565 4.321 -4.309 1.00 0.00 H new ATOM 0 HA VAL A 91 5.136 5.896 -6.734 1.00 0.00 H new ATOM 0 HB VAL A 91 5.100 7.807 -5.080 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.821 7.256 -4.288 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.057 6.795 -5.990 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.093 5.551 -4.719 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.707 7.241 -2.715 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.048 5.532 -3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.331 6.751 -3.254 1.00 0.00 H new ATOM 1422 N PRO A 92 7.567 6.363 -7.137 1.00 0.00 N ATOM 1423 CA PRO A 92 8.954 6.750 -7.426 1.00 0.00 C ATOM 1424 C PRO A 92 9.219 8.232 -7.169 1.00 0.00 C ATOM 1425 O PRO A 92 10.365 8.683 -7.213 1.00 0.00 O ATOM 1426 CB PRO A 92 9.101 6.436 -8.918 1.00 0.00 C ATOM 1427 CG PRO A 92 7.720 6.550 -9.463 1.00 0.00 C ATOM 1428 CD PRO A 92 6.812 6.072 -8.369 1.00 0.00 C ATOM 0 HA PRO A 92 9.662 6.223 -6.787 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.779 7.137 -9.406 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.508 5.437 -9.075 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.492 7.579 -9.740 1.00 0.00 H new ATOM 0 HG3 PRO A 92 7.602 5.945 -10.362 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.856 6.594 -8.385 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.596 5.008 -8.464 1.00 0.00 H new ATOM 1436 N ASP A 93 8.159 8.985 -6.910 1.00 0.00 N ATOM 1437 CA ASP A 93 8.277 10.419 -6.677 1.00 0.00 C ATOM 1438 C ASP A 93 7.086 10.943 -5.889 1.00 0.00 C ATOM 1439 O ASP A 93 5.967 10.448 -6.030 1.00 0.00 O ATOM 1440 CB ASP A 93 8.373 11.166 -8.009 1.00 0.00 C ATOM 1441 CG ASP A 93 8.399 12.672 -7.844 1.00 0.00 C ATOM 1442 OD1 ASP A 93 9.488 13.227 -7.580 1.00 0.00 O ATOM 1443 OD2 ASP A 93 7.332 13.311 -7.991 1.00 0.00 O ATOM 0 H ASP A 93 7.206 8.627 -6.856 1.00 0.00 H new ATOM 0 HA ASP A 93 9.184 10.590 -6.097 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.274 10.848 -8.533 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.525 10.890 -8.636 1.00 0.00 H new ATOM 1448 N PHE A 94 7.346 11.921 -5.038 1.00 0.00 N ATOM 1449 CA PHE A 94 6.294 12.607 -4.301 1.00 0.00 C ATOM 1450 C PHE A 94 6.715 14.041 -3.992 1.00 0.00 C ATOM 1451 O PHE A 94 7.894 14.313 -3.759 1.00 0.00 O ATOM 1452 CB PHE A 94 5.944 11.849 -3.014 1.00 0.00 C ATOM 1453 CG PHE A 94 7.127 11.554 -2.132 1.00 0.00 C ATOM 1454 CD1 PHE A 94 7.849 10.381 -2.286 1.00 0.00 C ATOM 1455 CD2 PHE A 94 7.519 12.452 -1.154 1.00 0.00 C ATOM 1456 CE1 PHE A 94 8.939 10.111 -1.482 1.00 0.00 C ATOM 1457 CE2 PHE A 94 8.608 12.189 -0.346 1.00 0.00 C ATOM 1458 CZ PHE A 94 9.320 11.016 -0.512 1.00 0.00 C ATOM 0 H PHE A 94 8.286 12.262 -4.838 1.00 0.00 H new ATOM 0 HA PHE A 94 5.399 12.637 -4.923 1.00 0.00 H new ATOM 0 HB2 PHE A 94 5.219 12.433 -2.447 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.459 10.909 -3.279 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.556 9.670 -3.044 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.966 13.370 -1.021 1.00 0.00 H new ATOM 0 HE1 PHE A 94 9.493 9.193 -1.612 1.00 0.00 H new ATOM 0 HE2 PHE A 94 8.902 12.898 0.414 1.00 0.00 H new ATOM 0 HZ PHE A 94 10.173 10.808 0.116 1.00 0.00 H new ATOM 1468 N HIS A 95 5.756 14.957 -4.008 1.00 0.00 N ATOM 1469 CA HIS A 95 6.033 16.362 -3.721 1.00 0.00 C ATOM 1470 C HIS A 95 5.395 16.774 -2.399 1.00 0.00 C ATOM 1471 O HIS A 95 4.189 16.623 -2.216 1.00 0.00 O ATOM 1472 CB HIS A 95 5.510 17.253 -4.855 1.00 0.00 C ATOM 1473 CG HIS A 95 5.824 18.710 -4.679 1.00 0.00 C ATOM 1474 ND1 HIS A 95 4.881 19.647 -4.315 1.00 0.00 N ATOM 1475 CD2 HIS A 95 6.985 19.391 -4.822 1.00 0.00 C ATOM 1476 CE1 HIS A 95 5.445 20.834 -4.242 1.00 0.00 C ATOM 1477 NE2 HIS A 95 6.722 20.709 -4.543 1.00 0.00 N ATOM 0 H HIS A 95 4.778 14.754 -4.217 1.00 0.00 H new ATOM 0 HA HIS A 95 7.113 16.488 -3.643 1.00 0.00 H new ATOM 0 HB2 HIS A 95 5.936 16.911 -5.798 1.00 0.00 H new ATOM 0 HB3 HIS A 95 4.429 17.131 -4.931 1.00 0.00 H new ATOM 0 HD2 HIS A 95 7.941 18.975 -5.103 1.00 0.00 H new ATOM 0 HE1 HIS A 95 4.946 21.755 -3.980 1.00 0.00 H new ATOM 0 HE2 HIS A 95 7.403 21.468 -4.565 1.00 0.00 H new ATOM 1486 N GLY A 96 6.207 17.292 -1.488 1.00 0.00 N ATOM 1487 CA GLY A 96 5.712 17.718 -0.190 1.00 0.00 C ATOM 1488 C GLY A 96 6.456 17.040 0.938 1.00 0.00 C ATOM 1489 O GLY A 96 7.566 16.547 0.741 1.00 0.00 O ATOM 0 H GLY A 96 7.209 17.426 -1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.816 18.799 -0.097 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.648 17.492 -0.113 1.00 0.00 H new ATOM 1493 N THR A 97 5.864 17.014 2.122 1.00 0.00 N ATOM 1494 CA THR A 97 6.470 16.331 3.243 1.00 0.00 C ATOM 1495 C THR A 97 5.514 15.275 3.769 1.00 0.00 C ATOM 1496 O THR A 97 4.362 15.570 4.080 1.00 0.00 O ATOM 1497 CB THR A 97 6.845 17.313 4.370 1.00 0.00 C ATOM 1498 OG1 THR A 97 7.682 18.358 3.850 1.00 0.00 O ATOM 1499 CG2 THR A 97 7.571 16.598 5.502 1.00 0.00 C ATOM 0 H THR A 97 4.968 17.457 2.326 1.00 0.00 H new ATOM 0 HA THR A 97 7.389 15.858 2.898 1.00 0.00 H new ATOM 0 HB THR A 97 5.924 17.741 4.765 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.915 18.980 4.571 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.823 17.315 6.283 1.00 0.00 H new ATOM 0 HG22 THR A 97 6.926 15.823 5.916 1.00 0.00 H new ATOM 0 HG23 THR A 97 8.484 16.143 5.118 1.00 0.00 H new ATOM 1507 N LEU A 98 5.998 14.049 3.852 1.00 0.00 N ATOM 1508 CA LEU A 98 5.157 12.936 4.256 1.00 0.00 C ATOM 1509 C LEU A 98 4.906 12.968 5.752 1.00 0.00 C ATOM 1510 O LEU A 98 5.834 12.976 6.565 1.00 0.00 O ATOM 1511 CB LEU A 98 5.744 11.598 3.805 1.00 0.00 C ATOM 1512 CG LEU A 98 7.270 11.522 3.759 1.00 0.00 C ATOM 1513 CD1 LEU A 98 7.838 11.024 5.083 1.00 0.00 C ATOM 1514 CD2 LEU A 98 7.698 10.636 2.604 1.00 0.00 C ATOM 0 H LEU A 98 6.965 13.799 3.646 1.00 0.00 H new ATOM 0 HA LEU A 98 4.194 13.042 3.757 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.380 10.819 4.475 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.358 11.370 2.812 1.00 0.00 H new ATOM 0 HG LEU A 98 7.670 12.523 3.599 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.925 10.981 5.019 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.548 11.706 5.883 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.447 10.029 5.295 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.786 10.582 2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 98 7.289 9.635 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.327 11.054 1.668 1.00 0.00 H new ATOM 1526 N GLN A 99 3.638 13.023 6.096 1.00 0.00 N ATOM 1527 CA GLN A 99 3.214 13.138 7.471 1.00 0.00 C ATOM 1528 C GLN A 99 1.983 12.271 7.680 1.00 0.00 C ATOM 1529 O GLN A 99 1.387 11.801 6.714 1.00 0.00 O ATOM 1530 CB GLN A 99 2.930 14.607 7.796 1.00 0.00 C ATOM 1531 CG GLN A 99 1.779 15.207 7.008 1.00 0.00 C ATOM 1532 CD GLN A 99 1.596 16.685 7.288 1.00 0.00 C ATOM 1533 OE1 GLN A 99 1.868 17.161 8.394 1.00 0.00 O ATOM 1534 NE2 GLN A 99 1.149 17.427 6.287 1.00 0.00 N ATOM 0 H GLN A 99 2.870 12.989 5.426 1.00 0.00 H new ATOM 0 HA GLN A 99 3.998 12.792 8.145 1.00 0.00 H new ATOM 0 HB2 GLN A 99 2.713 14.697 8.860 1.00 0.00 H new ATOM 0 HB3 GLN A 99 3.830 15.191 7.604 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.957 15.061 5.943 1.00 0.00 H new ATOM 0 HG3 GLN A 99 0.859 14.677 7.253 1.00 0.00 H new ATOM 0 HE21 GLN A 99 0.936 16.995 5.388 1.00 0.00 H new ATOM 0 HE22 GLN A 99 1.018 18.430 6.415 1.00 0.00 H new ATOM 1543 N ALA A 100 1.612 12.039 8.925 1.00 0.00 N ATOM 1544 CA ALA A 100 0.474 11.186 9.210 1.00 0.00 C ATOM 1545 C ALA A 100 -0.756 12.007 9.561 1.00 0.00 C ATOM 1546 O ALA A 100 -0.806 12.650 10.610 1.00 0.00 O ATOM 1547 CB ALA A 100 0.800 10.214 10.332 1.00 0.00 C ATOM 0 H ALA A 100 2.076 12.425 9.747 1.00 0.00 H new ATOM 0 HA ALA A 100 0.252 10.616 8.308 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.067 9.583 10.530 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.644 9.589 10.039 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.057 10.771 11.233 1.00 0.00 H new ATOM 1553 N HIS A 101 -1.736 12.000 8.674 1.00 0.00 N ATOM 1554 CA HIS A 101 -3.014 12.643 8.942 1.00 0.00 C ATOM 1555 C HIS A 101 -3.909 11.693 9.731 1.00 0.00 C ATOM 1556 O HIS A 101 -4.236 11.955 10.889 1.00 0.00 O ATOM 1557 CB HIS A 101 -3.675 13.045 7.620 1.00 0.00 C ATOM 1558 CG HIS A 101 -5.064 13.596 7.742 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -6.171 12.916 7.291 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -5.520 14.776 8.225 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -7.247 13.650 7.488 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -6.883 14.785 8.054 1.00 0.00 N ATOM 0 H HIS A 101 -1.672 11.555 7.758 1.00 0.00 H new ATOM 0 HA HIS A 101 -2.857 13.543 9.536 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.048 13.790 7.130 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -3.703 12.173 6.967 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -6.161 11.987 6.869 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -4.924 15.563 8.663 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -8.258 13.370 7.230 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.289 10.584 9.106 1.00 0.00 N ATOM 1572 CA GLU A 102 -5.120 9.596 9.771 1.00 0.00 C ATOM 1573 C GLU A 102 -4.260 8.647 10.603 1.00 0.00 C ATOM 1574 O GLU A 102 -4.652 8.252 11.697 1.00 0.00 O ATOM 1575 CB GLU A 102 -5.980 8.842 8.740 1.00 0.00 C ATOM 1576 CG GLU A 102 -5.289 7.697 8.015 1.00 0.00 C ATOM 1577 CD GLU A 102 -5.517 6.360 8.690 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -6.669 5.890 8.702 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -4.549 5.789 9.224 1.00 0.00 O ATOM 0 H GLU A 102 -4.035 10.350 8.146 1.00 0.00 H new ATOM 0 HA GLU A 102 -5.799 10.103 10.457 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.860 8.448 9.248 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.334 9.557 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -5.653 7.649 6.989 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -4.219 7.897 7.964 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.067 8.316 10.100 1.00 0.00 N ATOM 1587 CA HIS A 103 -2.166 7.407 10.812 1.00 0.00 C ATOM 1588 C HIS A 103 -1.511 8.122 11.993 1.00 0.00 C ATOM 1589 O HIS A 103 -1.696 9.326 12.184 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.082 6.837 9.882 1.00 0.00 C ATOM 1591 CG HIS A 103 -1.581 5.856 8.859 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -1.575 4.490 9.050 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.088 6.054 7.621 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -2.058 3.897 7.975 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -2.380 4.822 7.090 1.00 0.00 N ATOM 0 H HIS A 103 -2.706 8.661 9.211 1.00 0.00 H new ATOM 0 HA HIS A 103 -2.767 6.575 11.180 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -0.596 7.664 9.365 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -0.320 6.350 10.491 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -2.236 7.008 7.138 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -2.171 2.831 7.841 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -2.779 4.650 6.167 1.00 0.00 H new ATOM 1604 N GLN A 104 -0.746 7.389 12.789 1.00 0.00 N ATOM 1605 CA GLN A 104 -0.104 7.975 13.955 1.00 0.00 C ATOM 1606 C GLN A 104 1.330 8.406 13.649 1.00 0.00 C ATOM 1607 O GLN A 104 1.613 9.595 13.525 1.00 0.00 O ATOM 1608 CB GLN A 104 -0.126 6.996 15.131 1.00 0.00 C ATOM 1609 CG GLN A 104 0.389 7.600 16.428 1.00 0.00 C ATOM 1610 CD GLN A 104 -0.339 8.878 16.797 1.00 0.00 C ATOM 1611 OE1 GLN A 104 0.068 9.974 16.411 1.00 0.00 O ATOM 1612 NE2 GLN A 104 -1.424 8.749 17.539 1.00 0.00 N ATOM 0 H GLN A 104 -0.556 6.396 12.650 1.00 0.00 H new ATOM 0 HA GLN A 104 -0.669 8.866 14.229 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -1.146 6.644 15.282 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.478 6.124 14.880 1.00 0.00 H new ATOM 0 HG2 GLN A 104 0.276 6.875 17.234 1.00 0.00 H new ATOM 0 HG3 GLN A 104 1.455 7.807 16.332 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -1.729 7.823 17.839 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -1.957 9.575 17.812 1.00 0.00 H new ATOM 1621 N ALA A 105 2.230 7.442 13.524 1.00 0.00 N ATOM 1622 CA ALA A 105 3.639 7.745 13.313 1.00 0.00 C ATOM 1623 C ALA A 105 4.140 7.150 12.004 1.00 0.00 C ATOM 1624 O ALA A 105 3.501 6.259 11.436 1.00 0.00 O ATOM 1625 CB ALA A 105 4.465 7.227 14.482 1.00 0.00 C ATOM 0 H ALA A 105 2.012 6.446 13.565 1.00 0.00 H new ATOM 0 HA ALA A 105 3.749 8.828 13.252 1.00 0.00 H new ATOM 0 HB1 ALA A 105 5.517 7.458 14.315 1.00 0.00 H new ATOM 0 HB2 ALA A 105 4.130 7.704 15.403 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.340 6.147 14.566 1.00 0.00 H new ATOM 1631 N LEU A 106 5.285 7.641 11.534 1.00 0.00 N ATOM 1632 CA LEU A 106 5.888 7.158 10.298 1.00 0.00 C ATOM 1633 C LEU A 106 7.289 6.647 10.589 1.00 0.00 C ATOM 1634 O LEU A 106 8.032 7.265 11.351 1.00 0.00 O ATOM 1635 CB LEU A 106 6.005 8.269 9.235 1.00 0.00 C ATOM 1636 CG LEU A 106 4.707 8.932 8.755 1.00 0.00 C ATOM 1637 CD1 LEU A 106 3.640 7.896 8.449 1.00 0.00 C ATOM 1638 CD2 LEU A 106 4.215 9.955 9.765 1.00 0.00 C ATOM 0 H LEU A 106 5.816 8.379 11.997 1.00 0.00 H new ATOM 0 HA LEU A 106 5.243 6.369 9.912 1.00 0.00 H new ATOM 0 HB2 LEU A 106 6.653 9.049 9.634 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.510 7.850 8.365 1.00 0.00 H new ATOM 0 HG LEU A 106 4.923 9.460 7.826 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.733 8.397 8.111 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.997 7.226 7.667 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.423 7.320 9.349 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.294 10.411 9.402 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.025 9.462 10.719 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.973 10.727 9.900 1.00 0.00 H new ATOM 1650 N VAL A 107 7.650 5.524 9.999 1.00 0.00 N ATOM 1651 CA VAL A 107 9.017 5.045 10.078 1.00 0.00 C ATOM 1652 C VAL A 107 9.494 4.582 8.706 1.00 0.00 C ATOM 1653 O VAL A 107 8.790 3.861 7.998 1.00 0.00 O ATOM 1654 CB VAL A 107 9.184 3.914 11.128 1.00 0.00 C ATOM 1655 CG1 VAL A 107 8.452 2.643 10.718 1.00 0.00 C ATOM 1656 CG2 VAL A 107 10.656 3.630 11.383 1.00 0.00 C ATOM 0 H VAL A 107 7.020 4.928 9.462 1.00 0.00 H new ATOM 0 HA VAL A 107 9.637 5.879 10.408 1.00 0.00 H new ATOM 0 HB VAL A 107 8.731 4.263 12.056 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.596 1.878 11.481 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.388 2.854 10.612 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.848 2.286 9.767 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.750 2.834 12.122 1.00 0.00 H new ATOM 0 HG22 VAL A 107 11.133 3.320 10.453 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.141 4.532 11.757 1.00 0.00 H new ATOM 1666 N TRP A 108 10.663 5.052 8.310 1.00 0.00 N ATOM 1667 CA TRP A 108 11.252 4.635 7.053 1.00 0.00 C ATOM 1668 C TRP A 108 12.302 3.558 7.286 1.00 0.00 C ATOM 1669 O TRP A 108 13.268 3.751 8.026 1.00 0.00 O ATOM 1670 CB TRP A 108 11.838 5.832 6.289 1.00 0.00 C ATOM 1671 CG TRP A 108 12.638 6.779 7.135 1.00 0.00 C ATOM 1672 CD1 TRP A 108 13.948 6.653 7.495 1.00 0.00 C ATOM 1673 CD2 TRP A 108 12.181 8.009 7.710 1.00 0.00 C ATOM 1674 NE1 TRP A 108 14.328 7.720 8.272 1.00 0.00 N ATOM 1675 CE2 TRP A 108 13.263 8.568 8.415 1.00 0.00 C ATOM 1676 CE3 TRP A 108 10.961 8.691 7.702 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 13.162 9.774 9.103 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 10.862 9.890 8.383 1.00 0.00 C ATOM 1679 CH2 TRP A 108 11.958 10.420 9.075 1.00 0.00 C ATOM 0 H TRP A 108 11.221 5.721 8.840 1.00 0.00 H new ATOM 0 HA TRP A 108 10.463 4.209 6.433 1.00 0.00 H new ATOM 0 HB2 TRP A 108 12.472 5.458 5.485 1.00 0.00 H new ATOM 0 HB3 TRP A 108 11.022 6.383 5.821 1.00 0.00 H new ATOM 0 HD1 TRP A 108 14.592 5.834 7.211 1.00 0.00 H new ATOM 0 HE1 TRP A 108 15.254 7.858 8.677 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.110 8.288 7.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 14.005 10.184 9.640 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 9.925 10.426 8.381 1.00 0.00 H new ATOM 0 HH2 TRP A 108 11.850 11.359 9.598 1.00 0.00 H new ATOM 1690 N CYS A 109 12.081 2.413 6.670 1.00 0.00 N ATOM 1691 CA CYS A 109 12.997 1.285 6.777 1.00 0.00 C ATOM 1692 C CYS A 109 13.027 0.530 5.464 1.00 0.00 C ATOM 1693 O CYS A 109 12.078 0.585 4.694 1.00 0.00 O ATOM 1694 CB CYS A 109 12.594 0.331 7.905 1.00 0.00 C ATOM 1695 SG CYS A 109 12.347 1.133 9.506 1.00 0.00 S ATOM 0 H CYS A 109 11.266 2.235 6.083 1.00 0.00 H new ATOM 0 HA CYS A 109 13.987 1.679 7.008 1.00 0.00 H new ATOM 0 HB2 CYS A 109 11.673 -0.179 7.622 1.00 0.00 H new ATOM 0 HB3 CYS A 109 13.363 -0.434 8.010 1.00 0.00 H new ATOM 0 HG CYS A 109 12.793 2.353 9.454 1.00 0.00 H new ATOM 1701 N SER A 110 14.101 -0.192 5.228 1.00 0.00 N ATOM 1702 CA SER A 110 14.267 -0.926 3.982 1.00 0.00 C ATOM 1703 C SER A 110 13.226 -2.049 3.899 1.00 0.00 C ATOM 1704 O SER A 110 12.724 -2.500 4.929 1.00 0.00 O ATOM 1705 CB SER A 110 15.682 -1.505 3.907 1.00 0.00 C ATOM 1706 OG SER A 110 16.660 -0.490 4.072 1.00 0.00 O ATOM 0 H SER A 110 14.878 -0.290 5.882 1.00 0.00 H new ATOM 0 HA SER A 110 14.120 -0.249 3.141 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.808 -2.265 4.678 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.825 -1.999 2.946 1.00 0.00 H new ATOM 0 HG SER A 110 17.555 -0.887 4.021 1.00 0.00 H new ATOM 1712 N PRO A 111 12.881 -2.506 2.681 1.00 0.00 N ATOM 1713 CA PRO A 111 11.876 -3.558 2.476 1.00 0.00 C ATOM 1714 C PRO A 111 12.115 -4.788 3.352 1.00 0.00 C ATOM 1715 O PRO A 111 11.182 -5.329 3.937 1.00 0.00 O ATOM 1716 CB PRO A 111 12.012 -3.924 0.989 1.00 0.00 C ATOM 1717 CG PRO A 111 13.224 -3.202 0.495 1.00 0.00 C ATOM 1718 CD PRO A 111 13.421 -2.026 1.406 1.00 0.00 C ATOM 0 HA PRO A 111 10.880 -3.208 2.749 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.120 -5.001 0.861 1.00 0.00 H new ATOM 0 HB3 PRO A 111 11.125 -3.624 0.431 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.097 -3.855 0.510 1.00 0.00 H new ATOM 0 HG3 PRO A 111 13.088 -2.875 -0.536 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.473 -1.752 1.490 1.00 0.00 H new ATOM 0 HD3 PRO A 111 12.889 -1.144 1.048 1.00 0.00 H new ATOM 1726 N GLU A 112 13.371 -5.202 3.464 1.00 0.00 N ATOM 1727 CA GLU A 112 13.722 -6.379 4.254 1.00 0.00 C ATOM 1728 C GLU A 112 13.471 -6.136 5.745 1.00 0.00 C ATOM 1729 O GLU A 112 13.114 -7.055 6.482 1.00 0.00 O ATOM 1730 CB GLU A 112 15.186 -6.760 3.998 1.00 0.00 C ATOM 1731 CG GLU A 112 16.161 -5.609 4.196 1.00 0.00 C ATOM 1732 CD GLU A 112 17.510 -5.868 3.554 1.00 0.00 C ATOM 1733 OE1 GLU A 112 17.663 -5.575 2.351 1.00 0.00 O ATOM 1734 OE2 GLU A 112 18.423 -6.364 4.242 1.00 0.00 O ATOM 0 H GLU A 112 14.165 -4.741 3.018 1.00 0.00 H new ATOM 0 HA GLU A 112 13.085 -7.208 3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 112 15.462 -7.577 4.665 1.00 0.00 H new ATOM 0 HB3 GLU A 112 15.282 -7.135 2.979 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.732 -4.699 3.777 1.00 0.00 H new ATOM 0 HG3 GLU A 112 16.299 -5.434 5.263 1.00 0.00 H new ATOM 1741 N GLU A 113 13.661 -4.896 6.179 1.00 0.00 N ATOM 1742 CA GLU A 113 13.393 -4.509 7.559 1.00 0.00 C ATOM 1743 C GLU A 113 11.890 -4.447 7.820 1.00 0.00 C ATOM 1744 O GLU A 113 11.416 -4.890 8.864 1.00 0.00 O ATOM 1745 CB GLU A 113 14.010 -3.138 7.857 1.00 0.00 C ATOM 1746 CG GLU A 113 15.453 -2.990 7.398 1.00 0.00 C ATOM 1747 CD GLU A 113 16.411 -3.904 8.132 1.00 0.00 C ATOM 1748 OE1 GLU A 113 16.919 -3.510 9.204 1.00 0.00 O ATOM 1749 OE2 GLU A 113 16.690 -5.006 7.623 1.00 0.00 O ATOM 0 H GLU A 113 14.002 -4.136 5.590 1.00 0.00 H new ATOM 0 HA GLU A 113 13.839 -5.260 8.211 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.407 -2.368 7.376 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.962 -2.956 8.931 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.510 -3.198 6.329 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.768 -1.956 7.539 1.00 0.00 H new ATOM 1756 N ALA A 114 11.151 -3.914 6.848 1.00 0.00 N ATOM 1757 CA ALA A 114 9.717 -3.657 6.994 1.00 0.00 C ATOM 1758 C ALA A 114 8.934 -4.918 7.333 1.00 0.00 C ATOM 1759 O ALA A 114 8.009 -4.880 8.141 1.00 0.00 O ATOM 1760 CB ALA A 114 9.160 -3.034 5.722 1.00 0.00 C ATOM 0 H ALA A 114 11.528 -3.648 5.938 1.00 0.00 H new ATOM 0 HA ALA A 114 9.601 -2.963 7.826 1.00 0.00 H new ATOM 0 HB1 ALA A 114 8.093 -2.848 5.845 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.672 -2.092 5.524 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.316 -3.715 4.885 1.00 0.00 H new ATOM 1766 N LEU A 115 9.314 -6.033 6.730 1.00 0.00 N ATOM 1767 CA LEU A 115 8.578 -7.280 6.904 1.00 0.00 C ATOM 1768 C LEU A 115 8.792 -7.847 8.306 1.00 0.00 C ATOM 1769 O LEU A 115 8.073 -8.747 8.740 1.00 0.00 O ATOM 1770 CB LEU A 115 9.000 -8.286 5.829 1.00 0.00 C ATOM 1771 CG LEU A 115 7.867 -9.128 5.224 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.550 -10.335 6.088 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.614 -8.284 5.041 1.00 0.00 C ATOM 0 H LEU A 115 10.126 -6.103 6.116 1.00 0.00 H new ATOM 0 HA LEU A 115 7.512 -7.080 6.792 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.494 -7.743 5.023 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.740 -8.961 6.259 1.00 0.00 H new ATOM 0 HG LEU A 115 8.207 -9.483 4.251 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.744 -10.908 5.630 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.437 -10.962 6.176 1.00 0.00 H new ATOM 0 HD13 LEU A 115 7.241 -10.002 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.822 -8.897 4.611 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.290 -7.899 6.008 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.831 -7.451 4.373 1.00 0.00 H new ATOM 1785 N GLN A 116 9.774 -7.304 9.015 1.00 0.00 N ATOM 1786 CA GLN A 116 10.051 -7.715 10.384 1.00 0.00 C ATOM 1787 C GLN A 116 9.183 -6.929 11.360 1.00 0.00 C ATOM 1788 O GLN A 116 9.132 -7.231 12.553 1.00 0.00 O ATOM 1789 CB GLN A 116 11.527 -7.492 10.710 1.00 0.00 C ATOM 1790 CG GLN A 116 12.472 -8.191 9.746 1.00 0.00 C ATOM 1791 CD GLN A 116 13.931 -7.916 10.044 1.00 0.00 C ATOM 1792 OE1 GLN A 116 14.319 -7.741 11.199 1.00 0.00 O ATOM 1793 NE2 GLN A 116 14.746 -7.854 9.002 1.00 0.00 N ATOM 0 H GLN A 116 10.394 -6.575 8.662 1.00 0.00 H new ATOM 0 HA GLN A 116 9.819 -8.776 10.481 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.736 -6.422 10.700 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.725 -7.846 11.722 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.295 -9.266 9.787 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.248 -7.870 8.729 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.383 -8.005 8.061 1.00 0.00 H new ATOM 0 HE22 GLN A 116 15.737 -7.655 9.141 1.00 0.00 H new ATOM 1802 N TYR A 117 8.493 -5.923 10.839 1.00 0.00 N ATOM 1803 CA TYR A 117 7.617 -5.094 11.651 1.00 0.00 C ATOM 1804 C TYR A 117 6.222 -5.701 11.689 1.00 0.00 C ATOM 1805 O TYR A 117 5.912 -6.594 10.896 1.00 0.00 O ATOM 1806 CB TYR A 117 7.543 -3.669 11.087 1.00 0.00 C ATOM 1807 CG TYR A 117 8.736 -2.804 11.424 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.939 -2.956 10.757 1.00 0.00 C ATOM 1809 CD2 TYR A 117 8.646 -1.822 12.402 1.00 0.00 C ATOM 1810 CE1 TYR A 117 11.027 -2.157 11.053 1.00 0.00 C ATOM 1811 CE2 TYR A 117 9.729 -1.020 12.707 1.00 0.00 C ATOM 1812 CZ TYR A 117 10.917 -1.191 12.028 1.00 0.00 C ATOM 1813 OH TYR A 117 11.998 -0.392 12.325 1.00 0.00 O ATOM 0 H TYR A 117 8.525 -5.662 9.853 1.00 0.00 H new ATOM 0 HA TYR A 117 8.023 -5.049 12.661 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.444 -3.725 10.003 1.00 0.00 H new ATOM 0 HB3 TYR A 117 6.641 -3.187 11.465 1.00 0.00 H new ATOM 0 HD1 TYR A 117 10.029 -3.713 9.992 1.00 0.00 H new ATOM 0 HD2 TYR A 117 7.715 -1.683 12.932 1.00 0.00 H new ATOM 0 HE1 TYR A 117 11.958 -2.290 10.523 1.00 0.00 H new ATOM 0 HE2 TYR A 117 9.646 -0.263 13.473 1.00 0.00 H new ATOM 0 HH TYR A 117 12.221 0.159 11.546 1.00 0.00 H new ATOM 1823 N PRO A 118 5.360 -5.242 12.610 1.00 0.00 N ATOM 1824 CA PRO A 118 3.978 -5.714 12.685 1.00 0.00 C ATOM 1825 C PRO A 118 3.123 -5.148 11.553 1.00 0.00 C ATOM 1826 O PRO A 118 2.314 -4.249 11.764 1.00 0.00 O ATOM 1827 CB PRO A 118 3.501 -5.187 14.038 1.00 0.00 C ATOM 1828 CG PRO A 118 4.296 -3.949 14.249 1.00 0.00 C ATOM 1829 CD PRO A 118 5.651 -4.233 13.653 1.00 0.00 C ATOM 0 HA PRO A 118 3.902 -6.797 12.588 1.00 0.00 H new ATOM 0 HB2 PRO A 118 2.432 -4.977 14.029 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.676 -5.913 14.832 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.826 -3.093 13.764 1.00 0.00 H new ATOM 0 HG3 PRO A 118 4.376 -3.710 15.309 1.00 0.00 H new ATOM 0 HD2 PRO A 118 6.100 -3.335 13.229 1.00 0.00 H new ATOM 0 HD3 PRO A 118 6.347 -4.616 14.400 1.00 0.00 H new ATOM 1837 N LEU A 119 3.337 -5.658 10.349 1.00 0.00 N ATOM 1838 CA LEU A 119 2.574 -5.227 9.188 1.00 0.00 C ATOM 1839 C LEU A 119 1.224 -5.930 9.154 1.00 0.00 C ATOM 1840 O LEU A 119 1.084 -7.046 9.660 1.00 0.00 O ATOM 1841 CB LEU A 119 3.345 -5.523 7.893 1.00 0.00 C ATOM 1842 CG LEU A 119 4.612 -4.691 7.656 1.00 0.00 C ATOM 1843 CD1 LEU A 119 5.281 -5.114 6.358 1.00 0.00 C ATOM 1844 CD2 LEU A 119 4.280 -3.209 7.612 1.00 0.00 C ATOM 0 H LEU A 119 4.036 -6.374 10.151 1.00 0.00 H new ATOM 0 HA LEU A 119 2.416 -4.151 9.264 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.622 -6.577 7.892 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.671 -5.370 7.050 1.00 0.00 H new ATOM 0 HG LEU A 119 5.299 -4.867 8.484 1.00 0.00 H new ATOM 0 HD11 LEU A 119 6.179 -4.517 6.200 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.552 -6.168 6.415 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.593 -4.961 5.527 1.00 0.00 H new ATOM 0 HD21 LEU A 119 5.192 -2.637 7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.576 -3.018 6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.833 -2.908 8.559 1.00 0.00 H new ATOM 1856 N ALA A 120 0.233 -5.266 8.577 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.096 -5.843 8.430 1.00 0.00 C ATOM 1858 C ALA A 120 -1.046 -7.128 7.603 1.00 0.00 C ATOM 1859 O ALA A 120 -0.165 -7.296 6.758 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.033 -4.833 7.789 1.00 0.00 C ATOM 0 H ALA A 120 0.325 -4.322 8.201 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.474 -6.096 9.421 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.025 -5.273 7.683 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.095 -3.945 8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.652 -4.556 6.806 1.00 0.00 H new ATOM 1866 N PRO A 121 -1.996 -8.054 7.831 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.034 -9.352 7.139 1.00 0.00 C ATOM 1868 C PRO A 121 -2.215 -9.225 5.626 1.00 0.00 C ATOM 1869 O PRO A 121 -2.069 -10.200 4.890 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.240 -10.061 7.761 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.070 -8.973 8.346 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.099 -7.922 8.799 1.00 0.00 C ATOM 0 HA PRO A 121 -1.093 -9.889 7.260 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -3.797 -10.622 7.011 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.928 -10.773 8.525 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.766 -8.572 7.609 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.667 -9.341 9.181 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.541 -6.926 8.774 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -2.763 -8.096 9.821 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.551 -8.029 5.165 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.667 -7.772 3.738 1.00 0.00 C ATOM 1882 C ALA A 122 -1.366 -7.181 3.210 1.00 0.00 C ATOM 1883 O ALA A 122 -1.021 -7.350 2.042 1.00 0.00 O ATOM 1884 CB ALA A 122 -3.826 -6.829 3.453 1.00 0.00 C ATOM 0 H ALA A 122 -2.748 -7.223 5.758 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.862 -8.716 3.230 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.894 -6.650 2.380 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.755 -7.277 3.806 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.660 -5.883 3.968 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.637 -6.528 4.104 1.00 0.00 N ATOM 1891 CA ASP A 123 0.576 -5.794 3.753 1.00 0.00 C ATOM 1892 C ASP A 123 1.773 -6.720 3.672 1.00 0.00 C ATOM 1893 O ASP A 123 2.731 -6.454 2.944 1.00 0.00 O ATOM 1894 CB ASP A 123 0.857 -4.712 4.799 1.00 0.00 C ATOM 1895 CG ASP A 123 -0.192 -3.614 4.808 1.00 0.00 C ATOM 1896 OD1 ASP A 123 -1.392 -3.941 4.920 1.00 0.00 O ATOM 1897 OD2 ASP A 123 0.186 -2.427 4.726 1.00 0.00 O ATOM 0 H ASP A 123 -0.869 -6.491 5.097 1.00 0.00 H new ATOM 0 HA ASP A 123 0.416 -5.337 2.776 1.00 0.00 H new ATOM 0 HB2 ASP A 123 0.904 -5.171 5.786 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.835 -4.272 4.606 1.00 0.00 H new ATOM 1902 N ILE A 124 1.708 -7.822 4.406 1.00 0.00 N ATOM 1903 CA ILE A 124 2.814 -8.764 4.468 1.00 0.00 C ATOM 1904 C ILE A 124 3.101 -9.362 3.083 1.00 0.00 C ATOM 1905 O ILE A 124 4.211 -9.222 2.573 1.00 0.00 O ATOM 1906 CB ILE A 124 2.554 -9.890 5.498 1.00 0.00 C ATOM 1907 CG1 ILE A 124 2.368 -9.293 6.898 1.00 0.00 C ATOM 1908 CG2 ILE A 124 3.698 -10.896 5.493 1.00 0.00 C ATOM 1909 CD1 ILE A 124 2.042 -10.322 7.962 1.00 0.00 C ATOM 0 H ILE A 124 0.898 -8.085 4.968 1.00 0.00 H new ATOM 0 HA ILE A 124 3.692 -8.209 4.798 1.00 0.00 H new ATOM 0 HB ILE A 124 1.640 -10.413 5.218 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.279 -8.766 7.182 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.569 -8.553 6.864 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.497 -11.680 6.223 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.789 -11.339 4.501 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.628 -10.390 5.751 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.925 -9.825 8.925 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.115 -10.833 7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.852 -11.049 8.025 1.00 0.00 H new ATOM 1921 N PRO A 125 2.104 -10.007 2.434 1.00 0.00 N ATOM 1922 CA PRO A 125 2.287 -10.593 1.098 1.00 0.00 C ATOM 1923 C PRO A 125 2.601 -9.544 0.030 1.00 0.00 C ATOM 1924 O PRO A 125 3.169 -9.862 -1.017 1.00 0.00 O ATOM 1925 CB PRO A 125 0.944 -11.271 0.807 1.00 0.00 C ATOM 1926 CG PRO A 125 -0.031 -10.602 1.710 1.00 0.00 C ATOM 1927 CD PRO A 125 0.738 -10.236 2.943 1.00 0.00 C ATOM 0 HA PRO A 125 3.135 -11.277 1.076 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.660 -11.151 -0.238 1.00 0.00 H new ATOM 0 HB3 PRO A 125 0.992 -12.342 1.003 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.457 -9.717 1.238 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.861 -11.266 1.950 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.332 -9.345 3.421 1.00 0.00 H new ATOM 0 HD3 PRO A 125 0.713 -11.034 3.685 1.00 0.00 H new ATOM 1935 N LEU A 126 2.237 -8.295 0.297 1.00 0.00 N ATOM 1936 CA LEU A 126 2.525 -7.204 -0.625 1.00 0.00 C ATOM 1937 C LEU A 126 3.988 -6.798 -0.516 1.00 0.00 C ATOM 1938 O LEU A 126 4.660 -6.581 -1.524 1.00 0.00 O ATOM 1939 CB LEU A 126 1.625 -5.997 -0.340 1.00 0.00 C ATOM 1940 CG LEU A 126 0.130 -6.219 -0.585 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.654 -4.957 -0.263 1.00 0.00 C ATOM 1942 CD2 LEU A 126 -0.120 -6.643 -2.022 1.00 0.00 C ATOM 0 H LEU A 126 1.742 -8.013 1.143 1.00 0.00 H new ATOM 0 HA LEU A 126 2.325 -7.552 -1.638 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.765 -5.698 0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 126 1.957 -5.164 -0.959 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.210 -7.018 0.074 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.715 -5.132 -0.443 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.502 -4.691 0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.308 -4.142 -0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.188 -6.796 -2.176 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.236 -5.866 -2.698 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.412 -7.572 -2.225 1.00 0.00 H new ATOM 1954 N LEU A 127 4.479 -6.718 0.714 1.00 0.00 N ATOM 1955 CA LEU A 127 5.874 -6.380 0.953 1.00 0.00 C ATOM 1956 C LEU A 127 6.761 -7.538 0.516 1.00 0.00 C ATOM 1957 O LEU A 127 7.854 -7.325 -0.017 1.00 0.00 O ATOM 1958 CB LEU A 127 6.101 -6.034 2.433 1.00 0.00 C ATOM 1959 CG LEU A 127 7.455 -5.389 2.779 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.582 -6.410 2.782 1.00 0.00 C ATOM 1961 CD2 LEU A 127 7.766 -4.266 1.805 1.00 0.00 C ATOM 0 H LEU A 127 3.932 -6.882 1.559 1.00 0.00 H new ATOM 0 HA LEU A 127 6.136 -5.500 0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.308 -5.358 2.753 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.997 -6.947 3.019 1.00 0.00 H new ATOM 0 HG LEU A 127 7.378 -4.980 3.786 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.521 -5.915 3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.372 -7.182 3.522 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.663 -6.866 1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.726 -3.818 2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.810 -4.665 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.985 -3.508 1.863 1.00 0.00 H new ATOM 1973 N GLU A 128 6.277 -8.763 0.731 1.00 0.00 N ATOM 1974 CA GLU A 128 6.968 -9.965 0.281 1.00 0.00 C ATOM 1975 C GLU A 128 7.403 -9.834 -1.173 1.00 0.00 C ATOM 1976 O GLU A 128 8.540 -10.146 -1.519 1.00 0.00 O ATOM 1977 CB GLU A 128 6.048 -11.179 0.427 1.00 0.00 C ATOM 1978 CG GLU A 128 5.975 -11.742 1.835 1.00 0.00 C ATOM 1979 CD GLU A 128 7.254 -12.440 2.241 1.00 0.00 C ATOM 1980 OE1 GLU A 128 7.766 -13.254 1.442 1.00 0.00 O ATOM 1981 OE2 GLU A 128 7.738 -12.203 3.364 1.00 0.00 O ATOM 0 H GLU A 128 5.400 -8.945 1.219 1.00 0.00 H new ATOM 0 HA GLU A 128 7.856 -10.097 0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.044 -10.900 0.107 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.391 -11.963 -0.248 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.766 -10.934 2.536 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.144 -12.444 1.901 1.00 0.00 H new ATOM 1988 N ALA A 129 6.498 -9.353 -2.018 1.00 0.00 N ATOM 1989 CA ALA A 129 6.794 -9.216 -3.435 1.00 0.00 C ATOM 1990 C ALA A 129 7.525 -7.921 -3.742 1.00 0.00 C ATOM 1991 O ALA A 129 8.088 -7.777 -4.821 1.00 0.00 O ATOM 1992 CB ALA A 129 5.542 -9.297 -4.279 1.00 0.00 C ATOM 0 H ALA A 129 5.561 -9.054 -1.747 1.00 0.00 H new ATOM 0 HA ALA A 129 7.446 -10.052 -3.689 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.805 -9.190 -5.331 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.059 -10.261 -4.122 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.858 -8.498 -3.993 1.00 0.00 H new ATOM 1998 N PHE A 130 7.533 -6.979 -2.807 1.00 0.00 N ATOM 1999 CA PHE A 130 8.253 -5.736 -3.020 1.00 0.00 C ATOM 2000 C PHE A 130 9.733 -6.006 -2.857 1.00 0.00 C ATOM 2001 O PHE A 130 10.554 -5.598 -3.680 1.00 0.00 O ATOM 2002 CB PHE A 130 7.796 -4.655 -2.036 1.00 0.00 C ATOM 2003 CG PHE A 130 8.374 -3.301 -2.333 1.00 0.00 C ATOM 2004 CD1 PHE A 130 7.740 -2.452 -3.221 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.549 -2.880 -1.733 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.266 -1.208 -3.509 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.081 -1.636 -2.016 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.437 -0.800 -2.905 1.00 0.00 C ATOM 0 H PHE A 130 7.056 -7.052 -1.908 1.00 0.00 H new ATOM 0 HA PHE A 130 8.047 -5.368 -4.025 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.708 -4.591 -2.057 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.079 -4.950 -1.025 1.00 0.00 H new ATOM 0 HD1 PHE A 130 6.822 -2.766 -3.695 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.055 -3.531 -1.036 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.761 -0.556 -4.206 1.00 0.00 H new ATOM 0 HE2 PHE A 130 10.998 -1.319 -1.542 1.00 0.00 H new ATOM 0 HZ PHE A 130 9.849 0.173 -3.128 1.00 0.00 H new ATOM 2018 N MET A 131 10.067 -6.716 -1.788 1.00 0.00 N ATOM 2019 CA MET A 131 11.434 -7.142 -1.571 1.00 0.00 C ATOM 2020 C MET A 131 11.811 -8.213 -2.589 1.00 0.00 C ATOM 2021 O MET A 131 12.949 -8.254 -3.045 1.00 0.00 O ATOM 2022 CB MET A 131 11.647 -7.638 -0.131 1.00 0.00 C ATOM 2023 CG MET A 131 10.872 -8.898 0.224 1.00 0.00 C ATOM 2024 SD MET A 131 11.197 -9.458 1.909 1.00 0.00 S ATOM 2025 CE MET A 131 12.957 -9.783 1.828 1.00 0.00 C ATOM 0 H MET A 131 9.410 -7.006 -1.063 1.00 0.00 H new ATOM 0 HA MET A 131 12.090 -6.283 -1.711 1.00 0.00 H new ATOM 0 HB2 MET A 131 12.710 -7.825 0.022 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.361 -6.844 0.559 1.00 0.00 H new ATOM 0 HG2 MET A 131 9.805 -8.709 0.107 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.134 -9.691 -0.476 1.00 0.00 H new ATOM 0 HE1 MET A 131 13.235 -10.479 2.619 1.00 0.00 H new ATOM 0 HE2 MET A 131 13.203 -10.218 0.859 1.00 0.00 H new ATOM 0 HE3 MET A 131 13.506 -8.850 1.956 1.00 0.00 H new ATOM 2035 N ALA A 132 10.853 -9.067 -2.963 1.00 0.00 N ATOM 2036 CA ALA A 132 11.065 -10.027 -4.039 1.00 0.00 C ATOM 2037 C ALA A 132 11.390 -9.319 -5.346 1.00 0.00 C ATOM 2038 O ALA A 132 12.272 -9.741 -6.082 1.00 0.00 O ATOM 2039 CB ALA A 132 9.829 -10.904 -4.216 1.00 0.00 C ATOM 0 H ALA A 132 9.928 -9.109 -2.535 1.00 0.00 H new ATOM 0 HA ALA A 132 11.914 -10.655 -3.768 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.001 -11.616 -5.023 1.00 0.00 H new ATOM 0 HB2 ALA A 132 9.631 -11.445 -3.291 1.00 0.00 H new ATOM 0 HB3 ALA A 132 8.971 -10.278 -4.461 1.00 0.00 H new ATOM 2045 N LEU A 133 10.689 -8.230 -5.617 1.00 0.00 N ATOM 2046 CA LEU A 133 10.867 -7.494 -6.861 1.00 0.00 C ATOM 2047 C LEU A 133 12.239 -6.843 -6.915 1.00 0.00 C ATOM 2048 O LEU A 133 12.832 -6.728 -7.977 1.00 0.00 O ATOM 2049 CB LEU A 133 9.786 -6.427 -7.010 1.00 0.00 C ATOM 2050 CG LEU A 133 9.020 -6.470 -8.330 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.251 -7.777 -8.458 1.00 0.00 C ATOM 2052 CD2 LEU A 133 8.088 -5.276 -8.446 1.00 0.00 C ATOM 0 H LEU A 133 9.988 -7.834 -4.990 1.00 0.00 H new ATOM 0 HA LEU A 133 10.784 -8.204 -7.684 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.075 -6.533 -6.190 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.248 -5.445 -6.906 1.00 0.00 H new ATOM 0 HG LEU A 133 9.738 -6.418 -9.149 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.711 -7.790 -9.405 1.00 0.00 H new ATOM 0 HD12 LEU A 133 8.948 -8.614 -8.426 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.542 -7.864 -7.635 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.551 -5.324 -9.393 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.374 -5.291 -7.623 1.00 0.00 H new ATOM 0 HD23 LEU A 133 8.670 -4.355 -8.405 1.00 0.00 H new ATOM 2064 N ARG A 134 12.741 -6.424 -5.767 1.00 0.00 N ATOM 2065 CA ARG A 134 14.056 -5.802 -5.698 1.00 0.00 C ATOM 2066 C ARG A 134 15.154 -6.845 -5.538 1.00 0.00 C ATOM 2067 O ARG A 134 16.340 -6.529 -5.628 1.00 0.00 O ATOM 2068 CB ARG A 134 14.101 -4.804 -4.545 1.00 0.00 C ATOM 2069 CG ARG A 134 13.220 -3.588 -4.767 1.00 0.00 C ATOM 2070 CD ARG A 134 13.036 -2.784 -3.490 1.00 0.00 C ATOM 2071 NE ARG A 134 14.306 -2.375 -2.885 1.00 0.00 N ATOM 2072 CZ ARG A 134 14.704 -1.109 -2.763 1.00 0.00 C ATOM 2073 NH1 ARG A 134 13.981 -0.128 -3.295 1.00 0.00 N ATOM 2074 NH2 ARG A 134 15.829 -0.823 -2.119 1.00 0.00 N ATOM 0 H ARG A 134 12.261 -6.502 -4.870 1.00 0.00 H new ATOM 0 HA ARG A 134 14.232 -5.274 -6.635 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.792 -5.305 -3.628 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.130 -4.476 -4.398 1.00 0.00 H new ATOM 0 HG2 ARG A 134 13.662 -2.954 -5.535 1.00 0.00 H new ATOM 0 HG3 ARG A 134 12.246 -3.907 -5.139 1.00 0.00 H new ATOM 0 HD2 ARG A 134 12.441 -1.897 -3.708 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.472 -3.378 -2.771 1.00 0.00 H new ATOM 0 HE ARG A 134 14.925 -3.106 -2.535 1.00 0.00 H new ATOM 0 HH11 ARG A 134 13.120 -0.344 -3.798 1.00 0.00 H new ATOM 0 HH12 ARG A 134 14.287 0.840 -3.200 1.00 0.00 H new ATOM 0 HH21 ARG A 134 16.391 -1.573 -1.716 1.00 0.00 H new ATOM 0 HH22 ARG A 134 16.132 0.147 -2.027 1.00 0.00 H new ATOM 2088 N ALA A 135 14.761 -8.086 -5.284 1.00 0.00 N ATOM 2089 CA ALA A 135 15.717 -9.181 -5.204 1.00 0.00 C ATOM 2090 C ALA A 135 15.796 -9.914 -6.538 1.00 0.00 C ATOM 2091 O ALA A 135 16.873 -10.306 -6.985 1.00 0.00 O ATOM 2092 CB ALA A 135 15.335 -10.145 -4.092 1.00 0.00 C ATOM 0 H ALA A 135 13.790 -8.359 -5.130 1.00 0.00 H new ATOM 0 HA ALA A 135 16.698 -8.765 -4.976 1.00 0.00 H new ATOM 0 HB1 ALA A 135 16.062 -10.956 -4.048 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.324 -9.616 -3.139 1.00 0.00 H new ATOM 0 HB3 ALA A 135 14.345 -10.555 -4.290 1.00 0.00 H new ATOM 2098 N ALA A 136 14.645 -10.085 -7.174 1.00 0.00 N ATOM 2099 CA ALA A 136 14.566 -10.732 -8.474 1.00 0.00 C ATOM 2100 C ALA A 136 14.826 -9.727 -9.584 1.00 0.00 C ATOM 2101 O ALA A 136 15.260 -10.098 -10.676 1.00 0.00 O ATOM 2102 CB ALA A 136 13.207 -11.392 -8.656 1.00 0.00 C ATOM 0 H ALA A 136 13.744 -9.780 -6.804 1.00 0.00 H new ATOM 0 HA ALA A 136 15.333 -11.505 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 136 13.164 -11.872 -9.634 1.00 0.00 H new ATOM 0 HB2 ALA A 136 13.059 -12.140 -7.878 1.00 0.00 H new ATOM 0 HB3 ALA A 136 12.424 -10.637 -8.587 1.00 0.00 H new ATOM 2108 N ARG A 137 14.561 -8.456 -9.275 1.00 0.00 N ATOM 2109 CA ARG A 137 14.763 -7.339 -10.195 1.00 0.00 C ATOM 2110 C ARG A 137 13.698 -7.330 -11.291 1.00 0.00 C ATOM 2111 O ARG A 137 13.522 -8.307 -12.021 1.00 0.00 O ATOM 2112 CB ARG A 137 16.180 -7.366 -10.778 1.00 0.00 C ATOM 2113 CG ARG A 137 16.490 -6.225 -11.733 1.00 0.00 C ATOM 2114 CD ARG A 137 17.921 -6.308 -12.239 1.00 0.00 C ATOM 2115 NE ARG A 137 18.160 -7.521 -13.026 1.00 0.00 N ATOM 2116 CZ ARG A 137 19.126 -8.403 -12.770 1.00 0.00 C ATOM 2117 NH1 ARG A 137 19.915 -8.240 -11.713 1.00 0.00 N ATOM 2118 NH2 ARG A 137 19.298 -9.455 -13.564 1.00 0.00 N ATOM 0 H ARG A 137 14.195 -8.172 -8.366 1.00 0.00 H new ATOM 0 HA ARG A 137 14.656 -6.410 -9.635 1.00 0.00 H new ATOM 0 HB2 ARG A 137 16.897 -7.342 -9.958 1.00 0.00 H new ATOM 0 HB3 ARG A 137 16.326 -8.311 -11.301 1.00 0.00 H new ATOM 0 HG2 ARG A 137 15.800 -6.255 -12.577 1.00 0.00 H new ATOM 0 HG3 ARG A 137 16.334 -5.272 -11.228 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.140 -5.432 -12.849 1.00 0.00 H new ATOM 0 HD3 ARG A 137 18.606 -6.286 -11.392 1.00 0.00 H new ATOM 0 HE ARG A 137 17.547 -7.702 -13.821 1.00 0.00 H new ATOM 0 HH11 ARG A 137 19.782 -7.439 -11.096 1.00 0.00 H new ATOM 0 HH12 ARG A 137 20.654 -8.916 -11.519 1.00 0.00 H new ATOM 0 HH21 ARG A 137 18.690 -9.589 -14.372 1.00 0.00 H new ATOM 0 HH22 ARG A 137 20.038 -10.128 -13.365 1.00 0.00 H new ATOM 2132 N PRO A 138 12.954 -6.217 -11.398 1.00 0.00 N ATOM 2133 CA PRO A 138 11.865 -6.080 -12.364 1.00 0.00 C ATOM 2134 C PRO A 138 12.358 -6.109 -13.804 1.00 0.00 C ATOM 2135 O PRO A 138 13.107 -5.234 -14.249 1.00 0.00 O ATOM 2136 CB PRO A 138 11.255 -4.717 -12.032 1.00 0.00 C ATOM 2137 CG PRO A 138 12.361 -3.971 -11.383 1.00 0.00 C ATOM 2138 CD PRO A 138 13.120 -4.996 -10.592 1.00 0.00 C ATOM 0 HA PRO A 138 11.155 -6.904 -12.292 1.00 0.00 H new ATOM 0 HB2 PRO A 138 10.905 -4.208 -12.930 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.397 -4.816 -11.367 1.00 0.00 H new ATOM 0 HG2 PRO A 138 13.001 -3.493 -12.124 1.00 0.00 H new ATOM 0 HG3 PRO A 138 11.977 -3.181 -10.737 1.00 0.00 H new ATOM 0 HD2 PRO A 138 14.170 -4.725 -10.480 1.00 0.00 H new ATOM 0 HD3 PRO A 138 12.713 -5.115 -9.588 1.00 0.00 H new ATOM 2146 N ALA A 139 11.945 -7.139 -14.511 1.00 0.00 N ATOM 2147 CA ALA A 139 12.252 -7.294 -15.925 1.00 0.00 C ATOM 2148 C ALA A 139 11.015 -7.784 -16.660 1.00 0.00 C ATOM 2149 O ALA A 139 11.071 -8.182 -17.824 1.00 0.00 O ATOM 2150 CB ALA A 139 13.410 -8.264 -16.113 1.00 0.00 C ATOM 0 H ALA A 139 11.384 -7.898 -14.124 1.00 0.00 H new ATOM 0 HA ALA A 139 12.550 -6.330 -16.337 1.00 0.00 H new ATOM 0 HB1 ALA A 139 13.628 -8.369 -17.176 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.292 -7.882 -15.598 1.00 0.00 H new ATOM 0 HB3 ALA A 139 13.141 -9.236 -15.700 1.00 0.00 H new ATOM 2156 N ASP A 140 9.895 -7.735 -15.956 1.00 0.00 N ATOM 2157 CA ASP A 140 8.624 -8.225 -16.465 1.00 0.00 C ATOM 2158 C ASP A 140 7.479 -7.505 -15.766 1.00 0.00 C ATOM 2159 O ASP A 140 7.314 -7.705 -14.543 1.00 0.00 O ATOM 2160 CB ASP A 140 8.519 -9.738 -16.251 1.00 0.00 C ATOM 2161 CG ASP A 140 7.116 -10.270 -16.462 1.00 0.00 C ATOM 2162 OD1 ASP A 140 6.703 -10.442 -17.627 1.00 0.00 O ATOM 2163 OD2 ASP A 140 6.424 -10.538 -15.458 1.00 0.00 O ATOM 2164 OXT ASP A 140 6.766 -6.730 -16.428 1.00 0.00 O ATOM 0 H ASP A 140 9.842 -7.353 -15.012 1.00 0.00 H new ATOM 0 HA ASP A 140 8.564 -8.024 -17.535 1.00 0.00 H new ATOM 0 HB2 ASP A 140 9.200 -10.244 -16.935 1.00 0.00 H new ATOM 0 HB3 ASP A 140 8.845 -9.980 -15.239 1.00 0.00 H new TER 2169 ASP A 140