USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 559 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 NoAdj : A 151 ASNHD21 : A 151 ASN OD1 : A 502 CACA :(metal ligand) USER MOD NoAdj : A 151 ASNHD22 : A 151 ASN OD1 : A 502 CACA :(metal ligand) USER MOD Set 1.1: A 113 THR OG1 : rot 180:sc= -0.596 USER MOD Set 1.2: A 114 ASN : amide:sc= -4.74! C(o=-5.3!,f=-10!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0.00608 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.121 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl 157:sc= 0 (180deg=-0.555) USER MOD Single : A 130 LYS NZ :NH3+ -117:sc= -2.01! (180deg=-9.47!) USER MOD Single : A 134 HIS : no HD1:sc= -0.772 K(o=-0.77,f=-1.7!) USER MOD Single : A 135 GLN : amide:sc= -0.165 X(o=-0.16,f=0) USER MOD Single : A 138 HIS : no HD1:sc= -3.28! C(o=-3.3!,f=-7.9!) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 165 MET CE :methyl 168:sc= -1.59 (180deg=-1.76) USER MOD Single : A 166 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 96 0.340 -9.142 2.720 1.00 0.00 N ATOM 2 CA ALA A 96 -0.011 -10.368 1.965 1.00 0.00 C ATOM 3 C ALA A 96 0.074 -11.599 2.860 1.00 0.00 C ATOM 4 O ALA A 96 -0.343 -12.676 2.479 1.00 0.00 O ATOM 5 CB ALA A 96 0.988 -10.528 0.808 1.00 0.00 C ATOM 0 HA ALA A 96 -1.031 -10.277 1.593 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.746 -11.426 0.240 1.00 0.00 H new ATOM 0 HB2 ALA A 96 0.930 -9.658 0.154 1.00 0.00 H new ATOM 0 HB3 ALA A 96 1.998 -10.614 1.209 1.00 0.00 H new ATOM 11 N ASP A 97 0.612 -11.419 4.035 1.00 0.00 N ATOM 12 CA ASP A 97 0.731 -12.569 4.965 1.00 0.00 C ATOM 13 C ASP A 97 -0.507 -12.691 5.845 1.00 0.00 C ATOM 14 O ASP A 97 -1.195 -11.721 6.093 1.00 0.00 O ATOM 15 CB ASP A 97 1.955 -12.339 5.867 1.00 0.00 C ATOM 16 CG ASP A 97 1.738 -11.074 6.701 1.00 0.00 C ATOM 17 OD1 ASP A 97 0.826 -10.345 6.351 1.00 0.00 O ATOM 18 OD2 ASP A 97 2.499 -10.909 7.640 1.00 0.00 O ATOM 0 H ASP A 97 0.971 -10.531 4.386 1.00 0.00 H new ATOM 0 HA ASP A 97 0.836 -13.484 4.383 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.106 -13.198 6.521 1.00 0.00 H new ATOM 0 HB3 ASP A 97 2.855 -12.238 5.260 1.00 0.00 H new ATOM 23 N MET A 98 -0.767 -13.886 6.300 1.00 0.00 N ATOM 24 CA MET A 98 -1.954 -14.096 7.165 1.00 0.00 C ATOM 25 C MET A 98 -1.783 -13.373 8.494 1.00 0.00 C ATOM 26 O MET A 98 -0.839 -13.621 9.217 1.00 0.00 O ATOM 27 CB MET A 98 -2.093 -15.603 7.435 1.00 0.00 C ATOM 28 CG MET A 98 -3.515 -15.902 7.914 1.00 0.00 C ATOM 29 SD MET A 98 -4.869 -15.563 6.763 1.00 0.00 S ATOM 30 CE MET A 98 -5.978 -16.876 7.328 1.00 0.00 C ATOM 0 H MET A 98 -0.210 -14.719 6.110 1.00 0.00 H new ATOM 0 HA MET A 98 -2.839 -13.704 6.664 1.00 0.00 H new ATOM 0 HB2 MET A 98 -1.876 -16.168 6.528 1.00 0.00 H new ATOM 0 HB3 MET A 98 -1.370 -15.918 8.187 1.00 0.00 H new ATOM 0 HG2 MET A 98 -3.563 -16.955 8.190 1.00 0.00 H new ATOM 0 HG3 MET A 98 -3.693 -15.326 8.822 1.00 0.00 H new ATOM 0 HE1 MET A 98 -6.897 -16.853 6.743 1.00 0.00 H new ATOM 0 HE2 MET A 98 -5.491 -17.843 7.201 1.00 0.00 H new ATOM 0 HE3 MET A 98 -6.215 -16.724 8.381 1.00 0.00 H new ATOM 40 N ILE A 99 -2.696 -12.491 8.793 1.00 0.00 N ATOM 41 CA ILE A 99 -2.590 -11.751 10.073 1.00 0.00 C ATOM 42 C ILE A 99 -2.633 -12.718 11.248 1.00 0.00 C ATOM 43 O ILE A 99 -2.540 -13.916 11.069 1.00 0.00 O ATOM 44 CB ILE A 99 -3.774 -10.774 10.193 1.00 0.00 C ATOM 45 CG1 ILE A 99 -5.059 -11.540 10.488 1.00 0.00 C ATOM 46 CG2 ILE A 99 -3.947 -10.011 8.861 1.00 0.00 C ATOM 47 CD1 ILE A 99 -5.272 -12.614 9.420 1.00 0.00 C ATOM 0 H ILE A 99 -3.500 -12.255 8.212 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.645 -11.207 10.088 1.00 0.00 H new ATOM 0 HB ILE A 99 -3.572 -10.075 11.005 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -5.002 -12.000 11.475 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.907 -10.855 10.504 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -4.785 -9.319 8.944 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -3.037 -9.454 8.640 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -4.142 -10.721 8.057 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.191 -13.161 9.632 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -5.348 -12.143 8.440 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -4.429 -13.305 9.426 1.00 0.00 H new ATOM 59 N GLY A 100 -2.771 -12.186 12.430 1.00 0.00 N ATOM 60 CA GLY A 100 -2.820 -13.076 13.626 1.00 0.00 C ATOM 61 C GLY A 100 -2.200 -12.381 14.841 1.00 0.00 C ATOM 62 O GLY A 100 -2.793 -12.335 15.899 1.00 0.00 O ATOM 0 H GLY A 100 -2.851 -11.187 12.620 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -3.854 -13.346 13.843 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -2.285 -14.003 13.418 1.00 0.00 H new ATOM 66 N VAL A 101 -1.012 -11.858 14.662 1.00 0.00 N ATOM 67 CA VAL A 101 -0.337 -11.163 15.792 1.00 0.00 C ATOM 68 C VAL A 101 -1.324 -10.303 16.562 1.00 0.00 C ATOM 69 O VAL A 101 -1.120 -9.995 17.731 1.00 0.00 O ATOM 70 CB VAL A 101 0.758 -10.256 15.220 1.00 0.00 C ATOM 71 CG1 VAL A 101 0.146 -9.345 14.153 1.00 0.00 C ATOM 72 CG2 VAL A 101 1.334 -9.396 16.345 1.00 0.00 C ATOM 0 H VAL A 101 -0.487 -11.884 13.788 1.00 0.00 H new ATOM 0 HA VAL A 101 0.083 -11.909 16.467 1.00 0.00 H new ATOM 0 HB VAL A 101 1.549 -10.863 14.778 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.919 -8.696 13.741 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.280 -9.954 13.355 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.638 -8.735 14.602 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.114 -8.748 15.945 1.00 0.00 H new ATOM 0 HG22 VAL A 101 0.542 -8.785 16.778 1.00 0.00 H new ATOM 0 HG23 VAL A 101 1.758 -10.041 17.115 1.00 0.00 H new ATOM 82 N LYS A 102 -2.378 -9.918 15.904 1.00 0.00 N ATOM 83 CA LYS A 102 -3.369 -9.086 16.595 1.00 0.00 C ATOM 84 C LYS A 102 -3.704 -9.716 17.932 1.00 0.00 C ATOM 85 O LYS A 102 -3.970 -9.023 18.893 1.00 0.00 O ATOM 86 CB LYS A 102 -4.640 -9.000 15.734 1.00 0.00 C ATOM 87 CG LYS A 102 -4.977 -7.527 15.493 1.00 0.00 C ATOM 88 CD LYS A 102 -6.213 -7.432 14.598 1.00 0.00 C ATOM 89 CE LYS A 102 -6.729 -5.993 14.614 1.00 0.00 C ATOM 90 NZ LYS A 102 -7.620 -5.771 15.786 1.00 0.00 N ATOM 0 H LYS A 102 -2.586 -10.144 14.931 1.00 0.00 H new ATOM 0 HA LYS A 102 -2.967 -8.085 16.756 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -4.487 -9.512 14.784 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -5.469 -9.499 16.235 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -5.162 -7.024 16.442 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -4.134 -7.021 15.023 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -5.965 -7.732 13.580 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -6.987 -8.114 14.951 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -5.889 -5.300 14.652 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -7.272 -5.785 13.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -7.961 -4.789 15.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -8.431 -6.420 15.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -7.091 -5.949 16.663 1.00 0.00 H new ATOM 104 N GLU A 103 -3.694 -11.037 17.974 1.00 0.00 N ATOM 105 CA GLU A 103 -4.008 -11.705 19.253 1.00 0.00 C ATOM 106 C GLU A 103 -3.188 -11.040 20.328 1.00 0.00 C ATOM 107 O GLU A 103 -3.682 -10.710 21.393 1.00 0.00 O ATOM 108 CB GLU A 103 -3.624 -13.199 19.154 1.00 0.00 C ATOM 109 CG GLU A 103 -2.113 -13.360 19.363 1.00 0.00 C ATOM 110 CD GLU A 103 -1.728 -14.826 19.157 1.00 0.00 C ATOM 111 OE1 GLU A 103 -1.600 -15.196 18.002 1.00 0.00 O ATOM 112 OE2 GLU A 103 -1.584 -15.495 20.168 1.00 0.00 O ATOM 0 H GLU A 103 -3.485 -11.654 17.189 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.071 -11.628 19.482 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -4.168 -13.774 19.903 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.910 -13.594 18.179 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -1.568 -12.727 18.663 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.837 -13.037 20.367 1.00 0.00 H new ATOM 119 N LEU A 104 -1.930 -10.848 20.023 1.00 0.00 N ATOM 120 CA LEU A 104 -1.051 -10.202 20.994 1.00 0.00 C ATOM 121 C LEU A 104 -1.691 -8.894 21.373 1.00 0.00 C ATOM 122 O LEU A 104 -1.710 -8.510 22.523 1.00 0.00 O ATOM 123 CB LEU A 104 0.297 -9.937 20.322 1.00 0.00 C ATOM 124 CG LEU A 104 1.415 -10.164 21.333 1.00 0.00 C ATOM 125 CD1 LEU A 104 1.238 -9.196 22.502 1.00 0.00 C ATOM 126 CD2 LEU A 104 1.359 -11.605 21.847 1.00 0.00 C ATOM 0 H LEU A 104 -1.491 -11.116 19.142 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.900 -10.824 21.877 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.426 -10.598 19.465 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.334 -8.915 19.945 1.00 0.00 H new ATOM 0 HG LEU A 104 2.380 -9.991 20.856 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.035 -9.354 23.229 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.279 -8.171 22.135 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.273 -9.372 22.978 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.159 -11.765 22.570 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.396 -11.783 22.326 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.481 -12.294 21.012 1.00 0.00 H new ATOM 138 N ARG A 105 -2.222 -8.227 20.376 1.00 0.00 N ATOM 139 CA ARG A 105 -2.880 -6.932 20.643 1.00 0.00 C ATOM 140 C ARG A 105 -4.019 -7.148 21.619 1.00 0.00 C ATOM 141 O ARG A 105 -4.271 -6.326 22.477 1.00 0.00 O ATOM 142 CB ARG A 105 -3.443 -6.375 19.323 1.00 0.00 C ATOM 143 CG ARG A 105 -3.402 -4.844 19.369 1.00 0.00 C ATOM 144 CD ARG A 105 -3.758 -4.286 17.990 1.00 0.00 C ATOM 145 NE ARG A 105 -3.911 -2.804 18.091 1.00 0.00 N ATOM 146 CZ ARG A 105 -2.948 -2.092 18.616 1.00 0.00 C ATOM 147 NH1 ARG A 105 -1.817 -1.986 17.971 1.00 0.00 N ATOM 148 NH2 ARG A 105 -3.149 -1.508 19.765 1.00 0.00 N ATOM 0 H ARG A 105 -2.223 -8.529 19.402 1.00 0.00 H new ATOM 0 HA ARG A 105 -2.162 -6.229 21.065 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -2.858 -6.742 18.480 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -4.466 -6.720 19.175 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -4.103 -4.472 20.116 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -2.410 -4.504 19.666 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -2.979 -4.536 17.270 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -4.682 -4.736 17.629 1.00 0.00 H new ATOM 0 HE ARG A 105 -4.760 -2.351 17.753 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -1.696 -2.454 17.073 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -1.055 -1.435 18.365 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -4.046 -1.611 20.239 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -2.409 -0.949 20.189 1.00 0.00 H new ATOM 162 N ASP A 106 -4.700 -8.261 21.469 1.00 0.00 N ATOM 163 CA ASP A 106 -5.820 -8.540 22.387 1.00 0.00 C ATOM 164 C ASP A 106 -5.336 -8.354 23.807 1.00 0.00 C ATOM 165 O ASP A 106 -5.958 -7.675 24.597 1.00 0.00 O ATOM 166 CB ASP A 106 -6.271 -9.997 22.188 1.00 0.00 C ATOM 167 CG ASP A 106 -7.789 -10.085 22.365 1.00 0.00 C ATOM 168 OD1 ASP A 106 -8.319 -9.162 22.963 1.00 0.00 O ATOM 169 OD2 ASP A 106 -8.332 -11.071 21.894 1.00 0.00 O ATOM 0 H ASP A 106 -4.523 -8.971 20.758 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.654 -7.867 22.188 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -5.988 -10.345 21.194 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.771 -10.646 22.907 1.00 0.00 H new ATOM 174 N ALA A 107 -4.225 -8.967 24.115 1.00 0.00 N ATOM 175 CA ALA A 107 -3.690 -8.824 25.481 1.00 0.00 C ATOM 176 C ALA A 107 -3.498 -7.347 25.761 1.00 0.00 C ATOM 177 O ALA A 107 -4.010 -6.818 26.726 1.00 0.00 O ATOM 178 CB ALA A 107 -2.322 -9.533 25.554 1.00 0.00 C ATOM 0 H ALA A 107 -3.677 -9.551 23.483 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.372 -9.262 26.209 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -1.915 -9.435 26.560 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -2.446 -10.589 25.314 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -1.637 -9.077 24.839 1.00 0.00 H new ATOM 184 N PHE A 108 -2.755 -6.710 24.890 1.00 0.00 N ATOM 185 CA PHE A 108 -2.494 -5.265 25.044 1.00 0.00 C ATOM 186 C PHE A 108 -3.748 -4.529 25.500 1.00 0.00 C ATOM 187 O PHE A 108 -3.685 -3.642 26.328 1.00 0.00 O ATOM 188 CB PHE A 108 -2.085 -4.724 23.669 1.00 0.00 C ATOM 189 CG PHE A 108 -1.095 -3.574 23.831 1.00 0.00 C ATOM 190 CD1 PHE A 108 0.081 -3.746 24.539 1.00 0.00 C ATOM 191 CD2 PHE A 108 -1.349 -2.352 23.236 1.00 0.00 C ATOM 192 CE1 PHE A 108 0.989 -2.713 24.645 1.00 0.00 C ATOM 193 CE2 PHE A 108 -0.440 -1.322 23.344 1.00 0.00 C ATOM 194 CZ PHE A 108 0.728 -1.504 24.047 1.00 0.00 C ATOM 0 H PHE A 108 -2.319 -7.142 24.075 1.00 0.00 H new ATOM 0 HA PHE A 108 -1.714 -5.113 25.791 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -1.636 -5.520 23.075 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -2.967 -4.381 23.127 1.00 0.00 H new ATOM 0 HD1 PHE A 108 0.289 -4.695 25.011 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -2.265 -2.204 22.683 1.00 0.00 H new ATOM 0 HE1 PHE A 108 1.906 -2.855 25.198 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -0.645 -0.371 22.876 1.00 0.00 H new ATOM 0 HZ PHE A 108 1.440 -0.696 24.129 1.00 0.00 H new ATOM 204 N ARG A 109 -4.873 -4.906 24.945 1.00 0.00 N ATOM 205 CA ARG A 109 -6.133 -4.230 25.345 1.00 0.00 C ATOM 206 C ARG A 109 -6.425 -4.497 26.811 1.00 0.00 C ATOM 207 O ARG A 109 -6.456 -3.583 27.611 1.00 0.00 O ATOM 208 CB ARG A 109 -7.290 -4.777 24.490 1.00 0.00 C ATOM 209 CG ARG A 109 -6.993 -4.508 23.014 1.00 0.00 C ATOM 210 CD ARG A 109 -7.429 -3.082 22.668 1.00 0.00 C ATOM 211 NE ARG A 109 -8.868 -3.096 22.285 1.00 0.00 N ATOM 212 CZ ARG A 109 -9.777 -2.936 23.207 1.00 0.00 C ATOM 213 NH1 ARG A 109 -9.927 -1.756 23.747 1.00 0.00 N ATOM 214 NH2 ARG A 109 -10.507 -3.958 23.559 1.00 0.00 N ATOM 0 H ARG A 109 -4.968 -5.641 24.244 1.00 0.00 H new ATOM 0 HA ARG A 109 -6.029 -3.156 25.192 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -7.410 -5.847 24.660 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.228 -4.301 24.778 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -5.929 -4.635 22.815 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.522 -5.226 22.387 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.273 -2.423 23.522 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.825 -2.692 21.849 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.140 -3.229 21.311 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.339 -0.979 23.446 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.633 -1.612 24.469 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.363 -4.865 23.115 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.222 -3.850 24.278 1.00 0.00 H new ATOM 228 N GLU A 110 -6.635 -5.744 27.150 1.00 0.00 N ATOM 229 CA GLU A 110 -6.920 -6.052 28.568 1.00 0.00 C ATOM 230 C GLU A 110 -5.849 -5.410 29.431 1.00 0.00 C ATOM 231 O GLU A 110 -6.061 -5.106 30.588 1.00 0.00 O ATOM 232 CB GLU A 110 -6.878 -7.576 28.759 1.00 0.00 C ATOM 233 CG GLU A 110 -7.828 -8.230 27.754 1.00 0.00 C ATOM 234 CD GLU A 110 -9.160 -8.538 28.442 1.00 0.00 C ATOM 235 OE1 GLU A 110 -9.118 -9.322 29.375 1.00 0.00 O ATOM 236 OE2 GLU A 110 -10.144 -7.970 27.995 1.00 0.00 O ATOM 0 H GLU A 110 -6.621 -6.542 26.515 1.00 0.00 H new ATOM 0 HA GLU A 110 -7.901 -5.670 28.850 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -5.863 -7.946 28.613 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -7.169 -7.836 29.777 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -7.989 -7.567 26.904 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -7.387 -9.147 27.363 1.00 0.00 H new ATOM 243 N PHE A 111 -4.710 -5.215 28.825 1.00 0.00 N ATOM 244 CA PHE A 111 -3.571 -4.594 29.540 1.00 0.00 C ATOM 245 C PHE A 111 -3.874 -3.126 29.829 1.00 0.00 C ATOM 246 O PHE A 111 -3.738 -2.665 30.945 1.00 0.00 O ATOM 247 CB PHE A 111 -2.357 -4.662 28.596 1.00 0.00 C ATOM 248 CG PHE A 111 -1.173 -5.354 29.269 1.00 0.00 C ATOM 249 CD1 PHE A 111 -0.298 -4.636 30.059 1.00 0.00 C ATOM 250 CD2 PHE A 111 -0.909 -6.689 29.023 1.00 0.00 C ATOM 251 CE1 PHE A 111 0.820 -5.233 30.583 1.00 0.00 C ATOM 252 CE2 PHE A 111 0.211 -7.286 29.551 1.00 0.00 C ATOM 253 CZ PHE A 111 1.076 -6.559 30.333 1.00 0.00 C ATOM 0 H PHE A 111 -4.523 -5.464 27.854 1.00 0.00 H new ATOM 0 HA PHE A 111 -3.385 -5.111 30.481 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.629 -5.201 27.688 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.070 -3.654 28.295 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.496 -3.595 30.266 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.587 -7.266 28.412 1.00 0.00 H new ATOM 0 HE1 PHE A 111 1.501 -4.659 31.194 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.411 -8.328 29.351 1.00 0.00 H new ATOM 0 HZ PHE A 111 1.955 -7.029 30.750 1.00 0.00 H new ATOM 263 N ASP A 112 -4.281 -2.423 28.792 1.00 0.00 N ATOM 264 CA ASP A 112 -4.608 -0.976 28.942 1.00 0.00 C ATOM 265 C ASP A 112 -6.085 -0.725 28.657 1.00 0.00 C ATOM 266 O ASP A 112 -6.501 -0.685 27.516 1.00 0.00 O ATOM 267 CB ASP A 112 -3.775 -0.189 27.918 1.00 0.00 C ATOM 268 CG ASP A 112 -3.820 1.304 28.261 1.00 0.00 C ATOM 269 OD1 ASP A 112 -4.926 1.780 28.459 1.00 0.00 O ATOM 270 OD2 ASP A 112 -2.747 1.883 28.303 1.00 0.00 O ATOM 0 H ASP A 112 -4.399 -2.796 27.850 1.00 0.00 H new ATOM 0 HA ASP A 112 -4.386 -0.662 29.962 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -2.744 -0.543 27.923 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.164 -0.354 26.913 1.00 0.00 H new ATOM 275 N THR A 113 -6.851 -0.561 29.697 1.00 0.00 N ATOM 276 CA THR A 113 -8.286 -0.313 29.511 1.00 0.00 C ATOM 277 C THR A 113 -8.522 1.007 28.785 1.00 0.00 C ATOM 278 O THR A 113 -9.327 1.083 27.877 1.00 0.00 O ATOM 279 CB THR A 113 -8.920 -0.239 30.892 1.00 0.00 C ATOM 280 OG1 THR A 113 -8.384 0.925 31.489 1.00 0.00 O ATOM 281 CG2 THR A 113 -8.425 -1.391 31.778 1.00 0.00 C ATOM 0 H THR A 113 -6.535 -0.590 30.666 1.00 0.00 H new ATOM 0 HA THR A 113 -8.722 -1.113 28.912 1.00 0.00 H new ATOM 0 HB THR A 113 -10.006 -0.263 30.803 1.00 0.00 H new ATOM 0 HG1 THR A 113 -8.757 1.033 32.389 1.00 0.00 H new ATOM 0 HG21 THR A 113 -8.890 -1.320 32.761 1.00 0.00 H new ATOM 0 HG22 THR A 113 -8.691 -2.343 31.319 1.00 0.00 H new ATOM 0 HG23 THR A 113 -7.342 -1.329 31.884 1.00 0.00 H new ATOM 289 N ASN A 114 -7.816 2.026 29.196 1.00 0.00 N ATOM 290 CA ASN A 114 -7.989 3.343 28.538 1.00 0.00 C ATOM 291 C ASN A 114 -7.937 3.195 27.028 1.00 0.00 C ATOM 292 O ASN A 114 -8.689 3.825 26.312 1.00 0.00 O ATOM 293 CB ASN A 114 -6.841 4.264 28.982 1.00 0.00 C ATOM 294 CG ASN A 114 -6.293 3.777 30.321 1.00 0.00 C ATOM 295 OD1 ASN A 114 -5.113 3.516 30.465 1.00 0.00 O ATOM 296 ND2 ASN A 114 -7.113 3.639 31.324 1.00 0.00 N ATOM 0 H ASN A 114 -7.133 2.000 29.953 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.956 3.760 28.820 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -6.050 4.266 28.232 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -7.197 5.290 29.073 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -6.765 3.313 32.226 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -8.103 3.857 31.207 1.00 0.00 H new ATOM 303 N GLY A 115 -7.049 2.360 26.570 1.00 0.00 N ATOM 304 CA GLY A 115 -6.931 2.155 25.105 1.00 0.00 C ATOM 305 C GLY A 115 -6.054 3.246 24.491 1.00 0.00 C ATOM 306 O GLY A 115 -6.282 3.675 23.378 1.00 0.00 O ATOM 0 H GLY A 115 -6.405 1.815 27.143 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -6.501 1.174 24.901 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -7.920 2.172 24.647 1.00 0.00 H new ATOM 310 N ASP A 116 -5.070 3.674 25.233 1.00 0.00 N ATOM 311 CA ASP A 116 -4.174 4.730 24.712 1.00 0.00 C ATOM 312 C ASP A 116 -3.198 4.156 23.693 1.00 0.00 C ATOM 313 O ASP A 116 -3.317 4.401 22.509 1.00 0.00 O ATOM 314 CB ASP A 116 -3.378 5.314 25.888 1.00 0.00 C ATOM 315 CG ASP A 116 -3.010 4.190 26.859 1.00 0.00 C ATOM 316 OD1 ASP A 116 -1.964 3.603 26.636 1.00 0.00 O ATOM 317 OD2 ASP A 116 -3.797 3.981 27.768 1.00 0.00 O ATOM 0 H ASP A 116 -4.853 3.337 26.171 1.00 0.00 H new ATOM 0 HA ASP A 116 -4.774 5.499 24.226 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -2.476 5.805 25.523 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -3.969 6.073 26.400 1.00 0.00 H new ATOM 322 N GLY A 117 -2.246 3.402 24.172 1.00 0.00 N ATOM 323 CA GLY A 117 -1.249 2.801 23.241 1.00 0.00 C ATOM 324 C GLY A 117 -0.068 2.216 24.021 1.00 0.00 C ATOM 325 O GLY A 117 0.728 1.476 23.478 1.00 0.00 O ATOM 0 H GLY A 117 -2.116 3.178 25.158 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -1.723 2.019 22.647 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -0.892 3.559 22.544 1.00 0.00 H new ATOM 329 N GLU A 118 0.020 2.559 25.277 1.00 0.00 N ATOM 330 CA GLU A 118 1.139 2.032 26.101 1.00 0.00 C ATOM 331 C GLU A 118 0.709 1.861 27.559 1.00 0.00 C ATOM 332 O GLU A 118 -0.078 2.639 28.072 1.00 0.00 O ATOM 333 CB GLU A 118 2.301 3.040 26.035 1.00 0.00 C ATOM 334 CG GLU A 118 1.775 4.442 26.348 1.00 0.00 C ATOM 335 CD GLU A 118 0.855 4.900 25.216 1.00 0.00 C ATOM 336 OE1 GLU A 118 1.321 4.858 24.090 1.00 0.00 O ATOM 337 OE2 GLU A 118 -0.263 5.262 25.542 1.00 0.00 O ATOM 0 H GLU A 118 -0.630 3.177 25.763 1.00 0.00 H new ATOM 0 HA GLU A 118 1.442 1.059 25.715 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.078 2.763 26.748 1.00 0.00 H new ATOM 0 HB3 GLU A 118 2.756 3.023 25.045 1.00 0.00 H new ATOM 0 HG2 GLU A 118 1.233 4.437 27.294 1.00 0.00 H new ATOM 0 HG3 GLU A 118 2.606 5.138 26.461 1.00 0.00 H new ATOM 344 N ILE A 119 1.230 0.838 28.205 1.00 0.00 N ATOM 345 CA ILE A 119 0.860 0.604 29.626 1.00 0.00 C ATOM 346 C ILE A 119 1.925 1.137 30.583 1.00 0.00 C ATOM 347 O ILE A 119 3.101 1.136 30.271 1.00 0.00 O ATOM 348 CB ILE A 119 0.735 -0.896 29.840 1.00 0.00 C ATOM 349 CG1 ILE A 119 -0.118 -1.508 28.718 1.00 0.00 C ATOM 350 CG2 ILE A 119 0.048 -1.133 31.207 1.00 0.00 C ATOM 351 CD1 ILE A 119 0.663 -2.652 28.056 1.00 0.00 C ATOM 0 H ILE A 119 1.887 0.167 27.807 1.00 0.00 H new ATOM 0 HA ILE A 119 -0.076 1.124 29.830 1.00 0.00 H new ATOM 0 HB ILE A 119 1.720 -1.363 29.827 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -1.059 -1.881 29.123 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -0.368 -0.747 27.979 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -0.053 -2.204 31.383 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.652 -0.690 31.999 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.939 -0.672 31.203 1.00 0.00 H new ATOM 0 HD11 ILE A 119 0.062 -3.090 27.259 1.00 0.00 H new ATOM 0 HD12 ILE A 119 1.592 -2.264 27.638 1.00 0.00 H new ATOM 0 HD13 ILE A 119 0.890 -3.416 28.800 1.00 0.00 H new ATOM 363 N SER A 120 1.477 1.569 31.743 1.00 0.00 N ATOM 364 CA SER A 120 2.418 2.112 32.763 1.00 0.00 C ATOM 365 C SER A 120 2.331 1.301 34.055 1.00 0.00 C ATOM 366 O SER A 120 1.368 0.596 34.279 1.00 0.00 O ATOM 367 CB SER A 120 2.015 3.563 33.068 1.00 0.00 C ATOM 368 OG SER A 120 0.612 3.500 33.270 1.00 0.00 O ATOM 0 H SER A 120 0.496 1.566 32.021 1.00 0.00 H new ATOM 0 HA SER A 120 3.436 2.059 32.378 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.528 3.941 33.952 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.269 4.229 32.243 1.00 0.00 H new ATOM 0 HG SER A 120 0.270 4.396 33.474 1.00 0.00 H new ATOM 374 N THR A 121 3.347 1.413 34.879 1.00 0.00 N ATOM 375 CA THR A 121 3.344 0.655 36.164 1.00 0.00 C ATOM 376 C THR A 121 1.962 0.652 36.799 1.00 0.00 C ATOM 377 O THR A 121 1.336 -0.383 36.921 1.00 0.00 O ATOM 378 CB THR A 121 4.328 1.333 37.125 1.00 0.00 C ATOM 379 OG1 THR A 121 3.942 2.692 37.160 1.00 0.00 O ATOM 380 CG2 THR A 121 5.746 1.349 36.533 1.00 0.00 C ATOM 0 H THR A 121 4.170 1.993 34.716 1.00 0.00 H new ATOM 0 HA THR A 121 3.632 -0.377 35.965 1.00 0.00 H new ATOM 0 HB THR A 121 4.320 0.817 38.085 1.00 0.00 H new ATOM 0 HG1 THR A 121 4.536 3.185 37.764 1.00 0.00 H new ATOM 0 HG21 THR A 121 6.427 1.835 37.232 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.078 0.326 36.355 1.00 0.00 H new ATOM 0 HG23 THR A 121 5.741 1.898 35.591 1.00 0.00 H new ATOM 388 N SER A 122 1.508 1.806 37.195 1.00 0.00 N ATOM 389 CA SER A 122 0.168 1.879 37.820 1.00 0.00 C ATOM 390 C SER A 122 -0.837 1.061 37.024 1.00 0.00 C ATOM 391 O SER A 122 -1.464 0.160 37.547 1.00 0.00 O ATOM 392 CB SER A 122 -0.286 3.342 37.822 1.00 0.00 C ATOM 393 OG SER A 122 -1.284 3.394 38.831 1.00 0.00 O ATOM 0 H SER A 122 2.004 2.693 37.113 1.00 0.00 H new ATOM 0 HA SER A 122 0.224 1.484 38.834 1.00 0.00 H new ATOM 0 HB2 SER A 122 0.541 4.016 38.045 1.00 0.00 H new ATOM 0 HB3 SER A 122 -0.685 3.637 36.851 1.00 0.00 H new ATOM 0 HG SER A 122 -1.632 4.308 38.901 1.00 0.00 H new ATOM 399 N GLU A 123 -0.971 1.391 35.769 1.00 0.00 N ATOM 400 CA GLU A 123 -1.929 0.646 34.923 1.00 0.00 C ATOM 401 C GLU A 123 -1.577 -0.826 34.878 1.00 0.00 C ATOM 402 O GLU A 123 -2.442 -1.674 34.976 1.00 0.00 O ATOM 403 CB GLU A 123 -1.860 1.208 33.497 1.00 0.00 C ATOM 404 CG GLU A 123 -2.635 2.524 33.434 1.00 0.00 C ATOM 405 CD GLU A 123 -3.101 2.767 31.998 1.00 0.00 C ATOM 406 OE1 GLU A 123 -3.580 1.808 31.414 1.00 0.00 O ATOM 407 OE2 GLU A 123 -2.950 3.897 31.564 1.00 0.00 O ATOM 0 H GLU A 123 -0.460 2.139 35.301 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.929 0.757 35.342 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -0.822 1.370 33.208 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.280 0.492 32.791 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -3.493 2.487 34.106 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -2.004 3.348 33.768 1.00 0.00 H new ATOM 414 N LEU A 124 -0.314 -1.117 34.732 1.00 0.00 N ATOM 415 CA LEU A 124 0.073 -2.536 34.683 1.00 0.00 C ATOM 416 C LEU A 124 -0.215 -3.197 36.018 1.00 0.00 C ATOM 417 O LEU A 124 -0.790 -4.264 36.073 1.00 0.00 O ATOM 418 CB LEU A 124 1.558 -2.642 34.366 1.00 0.00 C ATOM 419 CG LEU A 124 2.051 -4.063 34.687 1.00 0.00 C ATOM 420 CD1 LEU A 124 1.195 -5.102 33.946 1.00 0.00 C ATOM 421 CD2 LEU A 124 3.488 -4.197 34.216 1.00 0.00 C ATOM 0 H LEU A 124 0.446 -0.442 34.647 1.00 0.00 H new ATOM 0 HA LEU A 124 -0.502 -3.041 33.907 1.00 0.00 H new ATOM 0 HB2 LEU A 124 1.733 -2.414 33.315 1.00 0.00 H new ATOM 0 HB3 LEU A 124 2.118 -1.911 34.949 1.00 0.00 H new ATOM 0 HG LEU A 124 1.977 -4.234 35.761 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.554 -6.104 34.181 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.155 -5.006 34.259 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.268 -4.934 32.872 1.00 0.00 H new ATOM 0 HD21 LEU A 124 3.851 -5.201 34.437 1.00 0.00 H new ATOM 0 HD22 LEU A 124 3.536 -4.022 33.141 1.00 0.00 H new ATOM 0 HD23 LEU A 124 4.109 -3.464 34.731 1.00 0.00 H new ATOM 433 N ARG A 125 0.178 -2.543 37.079 1.00 0.00 N ATOM 434 CA ARG A 125 -0.071 -3.123 38.416 1.00 0.00 C ATOM 435 C ARG A 125 -1.502 -3.630 38.496 1.00 0.00 C ATOM 436 O ARG A 125 -1.769 -4.662 39.080 1.00 0.00 O ATOM 437 CB ARG A 125 0.133 -2.025 39.471 1.00 0.00 C ATOM 438 CG ARG A 125 0.289 -2.672 40.849 1.00 0.00 C ATOM 439 CD ARG A 125 0.960 -1.673 41.795 1.00 0.00 C ATOM 440 NE ARG A 125 0.521 -1.957 43.191 1.00 0.00 N ATOM 441 CZ ARG A 125 -0.715 -1.715 43.537 1.00 0.00 C ATOM 442 NH1 ARG A 125 -1.113 -0.476 43.631 1.00 0.00 N ATOM 443 NH2 ARG A 125 -1.510 -2.721 43.778 1.00 0.00 N ATOM 0 H ARG A 125 0.655 -1.642 37.072 1.00 0.00 H new ATOM 0 HA ARG A 125 0.615 -3.952 38.593 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.017 -1.434 39.232 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.717 -1.342 39.471 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -0.685 -2.965 41.240 1.00 0.00 H new ATOM 0 HG3 ARG A 125 0.888 -3.580 40.773 1.00 0.00 H new ATOM 0 HD2 ARG A 125 2.044 -1.751 41.718 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.694 -0.653 41.517 1.00 0.00 H new ATOM 0 HE ARG A 125 1.180 -2.337 43.870 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -0.462 0.285 43.436 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -2.075 -0.268 43.900 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -1.163 -3.677 43.695 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.479 -2.552 44.049 1.00 0.00 H new ATOM 457 N GLU A 126 -2.404 -2.890 37.901 1.00 0.00 N ATOM 458 CA GLU A 126 -3.822 -3.313 37.930 1.00 0.00 C ATOM 459 C GLU A 126 -4.026 -4.502 37.004 1.00 0.00 C ATOM 460 O GLU A 126 -4.867 -5.347 37.242 1.00 0.00 O ATOM 461 CB GLU A 126 -4.689 -2.145 37.434 1.00 0.00 C ATOM 462 CG GLU A 126 -6.130 -2.355 37.903 1.00 0.00 C ATOM 463 CD GLU A 126 -6.270 -1.865 39.345 1.00 0.00 C ATOM 464 OE1 GLU A 126 -6.111 -0.669 39.528 1.00 0.00 O ATOM 465 OE2 GLU A 126 -6.526 -2.713 40.183 1.00 0.00 O ATOM 0 H GLU A 126 -2.215 -2.020 37.403 1.00 0.00 H new ATOM 0 HA GLU A 126 -4.099 -3.595 38.946 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.303 -1.201 37.818 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -4.653 -2.086 36.346 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -6.818 -1.813 37.254 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -6.395 -3.410 37.838 1.00 0.00 H new ATOM 472 N ALA A 127 -3.242 -4.545 35.960 1.00 0.00 N ATOM 473 CA ALA A 127 -3.361 -5.664 34.996 1.00 0.00 C ATOM 474 C ALA A 127 -2.700 -6.922 35.546 1.00 0.00 C ATOM 475 O ALA A 127 -3.046 -8.022 35.168 1.00 0.00 O ATOM 476 CB ALA A 127 -2.649 -5.257 33.698 1.00 0.00 C ATOM 0 H ALA A 127 -2.527 -3.852 35.738 1.00 0.00 H new ATOM 0 HA ALA A 127 -4.415 -5.874 34.817 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.724 -6.067 32.973 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.118 -4.361 33.291 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.599 -5.054 33.907 1.00 0.00 H new ATOM 482 N MET A 128 -1.759 -6.736 36.432 1.00 0.00 N ATOM 483 CA MET A 128 -1.069 -7.912 37.014 1.00 0.00 C ATOM 484 C MET A 128 -1.899 -8.521 38.139 1.00 0.00 C ATOM 485 O MET A 128 -1.846 -9.711 38.378 1.00 0.00 O ATOM 486 CB MET A 128 0.284 -7.449 37.586 1.00 0.00 C ATOM 487 CG MET A 128 1.410 -8.224 36.898 1.00 0.00 C ATOM 488 SD MET A 128 1.576 -8.031 35.105 1.00 0.00 S ATOM 489 CE MET A 128 3.349 -8.383 35.001 1.00 0.00 C ATOM 0 H MET A 128 -1.444 -5.828 36.773 1.00 0.00 H new ATOM 0 HA MET A 128 -0.927 -8.664 36.238 1.00 0.00 H new ATOM 0 HB2 MET A 128 0.413 -6.378 37.427 1.00 0.00 H new ATOM 0 HB3 MET A 128 0.315 -7.618 38.662 1.00 0.00 H new ATOM 0 HG2 MET A 128 2.353 -7.928 37.358 1.00 0.00 H new ATOM 0 HG3 MET A 128 1.270 -9.284 37.112 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.595 -8.719 33.994 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.913 -7.479 35.230 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.608 -9.163 35.717 1.00 0.00 H new ATOM 499 N ARG A 129 -2.652 -7.690 38.808 1.00 0.00 N ATOM 500 CA ARG A 129 -3.492 -8.203 39.917 1.00 0.00 C ATOM 501 C ARG A 129 -4.747 -8.880 39.381 1.00 0.00 C ATOM 502 O ARG A 129 -5.216 -9.852 39.939 1.00 0.00 O ATOM 503 CB ARG A 129 -3.908 -7.016 40.798 1.00 0.00 C ATOM 504 CG ARG A 129 -4.377 -7.541 42.158 1.00 0.00 C ATOM 505 CD ARG A 129 -5.155 -6.439 42.880 1.00 0.00 C ATOM 506 NE ARG A 129 -6.545 -6.397 42.344 1.00 0.00 N ATOM 507 CZ ARG A 129 -7.409 -7.295 42.733 1.00 0.00 C ATOM 508 NH1 ARG A 129 -7.811 -7.287 43.974 1.00 0.00 N ATOM 509 NH2 ARG A 129 -7.843 -8.171 41.867 1.00 0.00 N ATOM 0 H ARG A 129 -2.719 -6.687 38.633 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.919 -8.934 40.487 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.069 -6.332 40.928 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -4.707 -6.452 40.317 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -5.007 -8.420 42.024 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -3.521 -7.851 42.757 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -5.171 -6.630 43.953 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -4.666 -5.476 42.735 1.00 0.00 H new ATOM 0 HE ARG A 129 -6.819 -5.673 41.679 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -7.451 -6.587 44.622 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -8.486 -7.981 44.296 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -7.507 -8.146 40.904 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -8.518 -8.880 42.153 1.00 0.00 H new ATOM 523 N LYS A 130 -5.270 -8.356 38.304 1.00 0.00 N ATOM 524 CA LYS A 130 -6.494 -8.962 37.724 1.00 0.00 C ATOM 525 C LYS A 130 -6.214 -10.380 37.244 1.00 0.00 C ATOM 526 O LYS A 130 -7.127 -11.143 36.995 1.00 0.00 O ATOM 527 CB LYS A 130 -6.937 -8.105 36.525 1.00 0.00 C ATOM 528 CG LYS A 130 -8.477 -8.034 36.481 1.00 0.00 C ATOM 529 CD LYS A 130 -8.998 -7.072 37.568 1.00 0.00 C ATOM 530 CE LYS A 130 -8.313 -5.712 37.425 1.00 0.00 C ATOM 531 NZ LYS A 130 -7.076 -5.664 38.256 1.00 0.00 N ATOM 0 H LYS A 130 -4.904 -7.543 37.808 1.00 0.00 H new ATOM 0 HA LYS A 130 -7.274 -8.999 38.485 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -6.519 -7.102 36.608 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -6.556 -8.534 35.598 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -8.805 -7.695 35.498 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -8.898 -9.028 36.632 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -10.078 -6.957 37.478 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -8.803 -7.486 38.557 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -8.064 -5.531 36.379 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -8.996 -4.920 37.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -7.177 -4.931 38.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -6.927 -6.588 38.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -6.260 -5.440 37.651 1.00 0.00 H new ATOM 545 N LEU A 131 -4.949 -10.704 37.127 1.00 0.00 N ATOM 546 CA LEU A 131 -4.569 -12.066 36.666 1.00 0.00 C ATOM 547 C LEU A 131 -3.969 -12.871 37.812 1.00 0.00 C ATOM 548 O LEU A 131 -4.315 -14.018 38.016 1.00 0.00 O ATOM 549 CB LEU A 131 -3.513 -11.923 35.559 1.00 0.00 C ATOM 550 CG LEU A 131 -4.216 -11.862 34.200 1.00 0.00 C ATOM 551 CD1 LEU A 131 -5.320 -10.804 34.251 1.00 0.00 C ATOM 552 CD2 LEU A 131 -3.198 -11.478 33.125 1.00 0.00 C ATOM 0 H LEU A 131 -4.167 -10.081 37.332 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.456 -12.582 36.299 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -2.922 -11.021 35.717 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -2.822 -12.766 35.587 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.650 -12.834 33.965 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -5.824 -10.757 33.285 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -6.042 -11.068 35.024 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -4.882 -9.832 34.480 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -3.693 -11.433 32.155 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.771 -10.503 33.360 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -2.404 -12.224 33.093 1.00 0.00 H new ATOM 564 N LEU A 132 -3.080 -12.251 38.542 1.00 0.00 N ATOM 565 CA LEU A 132 -2.445 -12.959 39.680 1.00 0.00 C ATOM 566 C LEU A 132 -3.182 -12.657 40.979 1.00 0.00 C ATOM 567 O LEU A 132 -4.386 -12.803 41.057 1.00 0.00 O ATOM 568 CB LEU A 132 -0.995 -12.467 39.806 1.00 0.00 C ATOM 569 CG LEU A 132 -0.270 -12.694 38.479 1.00 0.00 C ATOM 570 CD1 LEU A 132 1.115 -12.047 38.544 1.00 0.00 C ATOM 571 CD2 LEU A 132 -0.112 -14.198 38.244 1.00 0.00 C ATOM 0 H LEU A 132 -2.771 -11.290 38.397 1.00 0.00 H new ATOM 0 HA LEU A 132 -2.479 -14.033 39.500 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -0.979 -11.409 40.067 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -0.486 -13.001 40.608 1.00 0.00 H new ATOM 0 HG LEU A 132 -0.845 -12.252 37.665 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.636 -12.206 37.600 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.009 -10.977 38.724 1.00 0.00 H new ATOM 0 HD13 LEU A 132 1.689 -12.496 39.355 1.00 0.00 H new ATOM 0 HD21 LEU A 132 0.404 -14.366 37.299 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.468 -14.634 39.057 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -1.096 -14.666 38.208 1.00 0.00 H new ATOM 583 N GLY A 133 -2.442 -12.240 41.977 1.00 0.00 N ATOM 584 CA GLY A 133 -3.081 -11.920 43.291 1.00 0.00 C ATOM 585 C GLY A 133 -2.248 -12.482 44.445 1.00 0.00 C ATOM 586 O GLY A 133 -2.556 -12.262 45.600 1.00 0.00 O ATOM 0 H GLY A 133 -1.431 -12.108 41.940 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -3.181 -10.840 43.400 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -4.087 -12.338 43.324 1.00 0.00 H new ATOM 590 N HIS A 134 -1.207 -13.196 44.108 1.00 0.00 N ATOM 591 CA HIS A 134 -0.346 -13.777 45.169 1.00 0.00 C ATOM 592 C HIS A 134 0.836 -12.864 45.467 1.00 0.00 C ATOM 593 O HIS A 134 0.928 -12.293 46.536 1.00 0.00 O ATOM 594 CB HIS A 134 0.188 -15.128 44.670 1.00 0.00 C ATOM 595 CG HIS A 134 1.200 -15.675 45.678 1.00 0.00 C ATOM 596 ND1 HIS A 134 1.308 -15.291 46.861 1.00 0.00 N ATOM 597 CD2 HIS A 134 2.160 -16.654 45.520 1.00 0.00 C ATOM 598 CE1 HIS A 134 2.227 -15.916 47.471 1.00 0.00 C ATOM 599 NE2 HIS A 134 2.833 -16.813 46.692 1.00 0.00 N ATOM 0 H HIS A 134 -0.920 -13.399 43.150 1.00 0.00 H new ATOM 0 HA HIS A 134 -0.933 -13.897 46.080 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -0.634 -15.833 44.544 1.00 0.00 H new ATOM 0 HB3 HIS A 134 0.658 -15.008 43.694 1.00 0.00 H new ATOM 0 HD2 HIS A 134 2.347 -17.206 44.611 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.489 -15.742 48.504 1.00 0.00 H new ATOM 0 HE2 HIS A 134 3.598 -17.449 46.915 1.00 0.00 H new ATOM 607 N GLN A 135 1.720 -12.741 44.515 1.00 0.00 N ATOM 608 CA GLN A 135 2.900 -11.869 44.728 1.00 0.00 C ATOM 609 C GLN A 135 2.523 -10.403 44.561 1.00 0.00 C ATOM 610 O GLN A 135 1.493 -10.084 44.000 1.00 0.00 O ATOM 611 CB GLN A 135 3.964 -12.230 43.678 1.00 0.00 C ATOM 612 CG GLN A 135 4.078 -13.752 43.581 1.00 0.00 C ATOM 613 CD GLN A 135 5.424 -14.119 42.955 1.00 0.00 C ATOM 614 OE1 GLN A 135 6.068 -15.071 43.351 1.00 0.00 O ATOM 615 NE2 GLN A 135 5.888 -13.391 41.977 1.00 0.00 N ATOM 0 H GLN A 135 1.674 -13.204 43.607 1.00 0.00 H new ATOM 0 HA GLN A 135 3.280 -12.020 45.739 1.00 0.00 H new ATOM 0 HB2 GLN A 135 3.693 -11.811 42.709 1.00 0.00 H new ATOM 0 HB3 GLN A 135 4.926 -11.798 43.954 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.991 -14.199 44.571 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.263 -14.152 42.978 1.00 0.00 H new ATOM 0 HE21 GLN A 135 5.354 -12.591 41.639 1.00 0.00 H new ATOM 0 HE22 GLN A 135 6.785 -13.622 41.550 1.00 0.00 H new ATOM 624 N VAL A 136 3.364 -9.534 45.051 1.00 0.00 N ATOM 625 CA VAL A 136 3.066 -8.084 44.929 1.00 0.00 C ATOM 626 C VAL A 136 4.351 -7.274 44.796 1.00 0.00 C ATOM 627 O VAL A 136 4.362 -6.083 45.033 1.00 0.00 O ATOM 628 CB VAL A 136 2.332 -7.636 46.202 1.00 0.00 C ATOM 629 CG1 VAL A 136 0.934 -8.257 46.223 1.00 0.00 C ATOM 630 CG2 VAL A 136 3.113 -8.115 47.428 1.00 0.00 C ATOM 0 H VAL A 136 4.237 -9.765 45.526 1.00 0.00 H new ATOM 0 HA VAL A 136 2.456 -7.919 44.041 1.00 0.00 H new ATOM 0 HB VAL A 136 2.252 -6.549 46.217 1.00 0.00 H new ATOM 0 HG11 VAL A 136 0.409 -7.942 47.125 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.377 -7.929 45.346 1.00 0.00 H new ATOM 0 HG13 VAL A 136 1.018 -9.344 46.214 1.00 0.00 H new ATOM 0 HG21 VAL A 136 2.596 -7.800 48.335 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.185 -9.202 47.411 1.00 0.00 H new ATOM 0 HG23 VAL A 136 4.114 -7.684 47.413 1.00 0.00 H new ATOM 640 N GLY A 137 5.409 -7.936 44.418 1.00 0.00 N ATOM 641 CA GLY A 137 6.706 -7.214 44.263 1.00 0.00 C ATOM 642 C GLY A 137 6.518 -5.946 43.427 1.00 0.00 C ATOM 643 O GLY A 137 5.950 -5.984 42.354 1.00 0.00 O ATOM 0 H GLY A 137 5.434 -8.935 44.211 1.00 0.00 H new ATOM 0 HA2 GLY A 137 7.104 -6.954 45.244 1.00 0.00 H new ATOM 0 HA3 GLY A 137 7.437 -7.866 43.785 1.00 0.00 H new ATOM 647 N HIS A 138 7.004 -4.844 43.936 1.00 0.00 N ATOM 648 CA HIS A 138 6.863 -3.571 43.186 1.00 0.00 C ATOM 649 C HIS A 138 7.987 -3.415 42.169 1.00 0.00 C ATOM 650 O HIS A 138 7.746 -3.311 40.987 1.00 0.00 O ATOM 651 CB HIS A 138 6.941 -2.405 44.184 1.00 0.00 C ATOM 652 CG HIS A 138 5.975 -2.664 45.341 1.00 0.00 C ATOM 653 ND1 HIS A 138 5.516 -3.782 45.651 1.00 0.00 N ATOM 654 CD2 HIS A 138 5.427 -1.776 46.246 1.00 0.00 C ATOM 655 CE1 HIS A 138 4.739 -3.705 46.650 1.00 0.00 C ATOM 656 NE2 HIS A 138 4.617 -2.457 47.103 1.00 0.00 N ATOM 0 H HIS A 138 7.488 -4.775 44.831 1.00 0.00 H new ATOM 0 HA HIS A 138 5.909 -3.575 42.659 1.00 0.00 H new ATOM 0 HB2 HIS A 138 7.958 -2.301 44.561 1.00 0.00 H new ATOM 0 HB3 HIS A 138 6.688 -1.468 43.687 1.00 0.00 H new ATOM 0 HD2 HIS A 138 5.611 -0.712 46.270 1.00 0.00 H new ATOM 0 HE1 HIS A 138 4.233 -4.554 47.085 1.00 0.00 H new ATOM 0 HE2 HIS A 138 4.064 -2.105 47.884 1.00 0.00 H new ATOM 664 N ARG A 139 9.198 -3.399 42.648 1.00 0.00 N ATOM 665 CA ARG A 139 10.341 -3.252 41.717 1.00 0.00 C ATOM 666 C ARG A 139 10.273 -4.300 40.611 1.00 0.00 C ATOM 667 O ARG A 139 10.910 -4.170 39.590 1.00 0.00 O ATOM 668 CB ARG A 139 11.645 -3.449 42.513 1.00 0.00 C ATOM 669 CG ARG A 139 12.844 -3.200 41.591 1.00 0.00 C ATOM 670 CD ARG A 139 14.129 -3.216 42.419 1.00 0.00 C ATOM 671 NE ARG A 139 15.270 -3.584 41.533 1.00 0.00 N ATOM 672 CZ ARG A 139 15.423 -4.830 41.171 1.00 0.00 C ATOM 673 NH1 ARG A 139 15.443 -5.756 42.089 1.00 0.00 N ATOM 674 NH2 ARG A 139 15.549 -5.107 39.901 1.00 0.00 N ATOM 0 H ARG A 139 9.441 -3.481 43.635 1.00 0.00 H new ATOM 0 HA ARG A 139 10.308 -2.262 41.262 1.00 0.00 H new ATOM 0 HB2 ARG A 139 11.675 -2.764 43.360 1.00 0.00 H new ATOM 0 HB3 ARG A 139 11.688 -4.460 42.919 1.00 0.00 H new ATOM 0 HG2 ARG A 139 12.887 -3.966 40.816 1.00 0.00 H new ATOM 0 HG3 ARG A 139 12.735 -2.241 41.085 1.00 0.00 H new ATOM 0 HD2 ARG A 139 14.301 -2.238 42.868 1.00 0.00 H new ATOM 0 HD3 ARG A 139 14.041 -3.931 43.237 1.00 0.00 H new ATOM 0 HE ARG A 139 15.925 -2.870 41.213 1.00 0.00 H new ATOM 0 HH11 ARG A 139 15.340 -5.502 43.072 1.00 0.00 H new ATOM 0 HH12 ARG A 139 15.562 -6.734 41.824 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.527 -4.356 39.211 1.00 0.00 H new ATOM 0 HH22 ARG A 139 15.669 -6.074 39.599 1.00 0.00 H new ATOM 688 N ASP A 140 9.489 -5.317 40.833 1.00 0.00 N ATOM 689 CA ASP A 140 9.367 -6.380 39.806 1.00 0.00 C ATOM 690 C ASP A 140 8.680 -5.863 38.542 1.00 0.00 C ATOM 691 O ASP A 140 9.304 -5.727 37.508 1.00 0.00 O ATOM 692 CB ASP A 140 8.526 -7.524 40.392 1.00 0.00 C ATOM 693 CG ASP A 140 8.392 -8.637 39.352 1.00 0.00 C ATOM 694 OD1 ASP A 140 7.530 -8.483 38.502 1.00 0.00 O ATOM 695 OD2 ASP A 140 9.158 -9.580 39.464 1.00 0.00 O ATOM 0 H ASP A 140 8.932 -5.455 41.676 1.00 0.00 H new ATOM 0 HA ASP A 140 10.367 -6.719 39.536 1.00 0.00 H new ATOM 0 HB2 ASP A 140 8.996 -7.910 41.296 1.00 0.00 H new ATOM 0 HB3 ASP A 140 7.540 -7.157 40.677 1.00 0.00 H new ATOM 700 N ILE A 141 7.407 -5.584 38.645 1.00 0.00 N ATOM 701 CA ILE A 141 6.673 -5.078 37.457 1.00 0.00 C ATOM 702 C ILE A 141 7.290 -3.795 36.915 1.00 0.00 C ATOM 703 O ILE A 141 7.441 -3.634 35.721 1.00 0.00 O ATOM 704 CB ILE A 141 5.242 -4.794 37.857 1.00 0.00 C ATOM 705 CG1 ILE A 141 5.224 -3.898 39.065 1.00 0.00 C ATOM 706 CG2 ILE A 141 4.561 -6.126 38.223 1.00 0.00 C ATOM 707 CD1 ILE A 141 3.850 -3.973 39.683 1.00 0.00 C ATOM 0 H ILE A 141 6.851 -5.685 39.494 1.00 0.00 H new ATOM 0 HA ILE A 141 6.724 -5.837 36.677 1.00 0.00 H new ATOM 0 HB ILE A 141 4.720 -4.309 37.032 1.00 0.00 H new ATOM 0 HG12 ILE A 141 5.982 -4.212 39.783 1.00 0.00 H new ATOM 0 HG13 ILE A 141 5.458 -2.872 38.782 1.00 0.00 H new ATOM 0 HG21 ILE A 141 3.527 -5.938 38.514 1.00 0.00 H new ATOM 0 HG22 ILE A 141 4.580 -6.793 37.361 1.00 0.00 H new ATOM 0 HG23 ILE A 141 5.093 -6.591 39.053 1.00 0.00 H new ATOM 0 HD11 ILE A 141 3.811 -3.331 40.563 1.00 0.00 H new ATOM 0 HD12 ILE A 141 3.106 -3.641 38.958 1.00 0.00 H new ATOM 0 HD13 ILE A 141 3.638 -5.002 39.975 1.00 0.00 H new ATOM 719 N GLU A 142 7.633 -2.900 37.797 1.00 0.00 N ATOM 720 CA GLU A 142 8.239 -1.625 37.339 1.00 0.00 C ATOM 721 C GLU A 142 9.491 -1.881 36.508 1.00 0.00 C ATOM 722 O GLU A 142 9.599 -1.420 35.390 1.00 0.00 O ATOM 723 CB GLU A 142 8.628 -0.798 38.575 1.00 0.00 C ATOM 724 CG GLU A 142 7.369 -0.484 39.386 1.00 0.00 C ATOM 725 CD GLU A 142 7.710 0.536 40.474 1.00 0.00 C ATOM 726 OE1 GLU A 142 8.607 0.230 41.243 1.00 0.00 O ATOM 727 OE2 GLU A 142 7.054 1.564 40.476 1.00 0.00 O ATOM 0 H GLU A 142 7.521 -2.996 38.806 1.00 0.00 H new ATOM 0 HA GLU A 142 7.515 -1.093 36.722 1.00 0.00 H new ATOM 0 HB2 GLU A 142 9.341 -1.350 39.187 1.00 0.00 H new ATOM 0 HB3 GLU A 142 9.118 0.126 38.270 1.00 0.00 H new ATOM 0 HG2 GLU A 142 6.591 -0.090 38.733 1.00 0.00 H new ATOM 0 HG3 GLU A 142 6.976 -1.395 39.836 1.00 0.00 H new ATOM 734 N GLU A 143 10.417 -2.612 37.066 1.00 0.00 N ATOM 735 CA GLU A 143 11.662 -2.900 36.311 1.00 0.00 C ATOM 736 C GLU A 143 11.340 -3.445 34.928 1.00 0.00 C ATOM 737 O GLU A 143 12.009 -3.130 33.964 1.00 0.00 O ATOM 738 CB GLU A 143 12.472 -3.952 37.082 1.00 0.00 C ATOM 739 CG GLU A 143 13.823 -4.143 36.391 1.00 0.00 C ATOM 740 CD GLU A 143 14.751 -2.988 36.772 1.00 0.00 C ATOM 741 OE1 GLU A 143 14.298 -2.167 37.552 1.00 0.00 O ATOM 742 OE2 GLU A 143 15.859 -2.993 36.263 1.00 0.00 O ATOM 0 H GLU A 143 10.364 -3.017 38.001 1.00 0.00 H new ATOM 0 HA GLU A 143 12.230 -1.977 36.201 1.00 0.00 H new ATOM 0 HB2 GLU A 143 12.618 -3.633 38.114 1.00 0.00 H new ATOM 0 HB3 GLU A 143 11.929 -4.896 37.115 1.00 0.00 H new ATOM 0 HG2 GLU A 143 14.266 -5.094 36.688 1.00 0.00 H new ATOM 0 HG3 GLU A 143 13.690 -4.177 35.310 1.00 0.00 H new ATOM 749 N ILE A 144 10.318 -4.258 34.851 1.00 0.00 N ATOM 750 CA ILE A 144 9.946 -4.829 33.534 1.00 0.00 C ATOM 751 C ILE A 144 9.404 -3.745 32.609 1.00 0.00 C ATOM 752 O ILE A 144 9.537 -3.830 31.405 1.00 0.00 O ATOM 753 CB ILE A 144 8.864 -5.888 33.753 1.00 0.00 C ATOM 754 CG1 ILE A 144 9.481 -7.140 34.376 1.00 0.00 C ATOM 755 CG2 ILE A 144 8.251 -6.258 32.390 1.00 0.00 C ATOM 756 CD1 ILE A 144 10.119 -8.007 33.279 1.00 0.00 C ATOM 0 H ILE A 144 9.734 -4.545 35.637 1.00 0.00 H new ATOM 0 HA ILE A 144 10.830 -5.269 33.072 1.00 0.00 H new ATOM 0 HB ILE A 144 8.098 -5.493 34.420 1.00 0.00 H new ATOM 0 HG12 ILE A 144 10.233 -6.858 35.113 1.00 0.00 H new ATOM 0 HG13 ILE A 144 8.716 -7.710 34.904 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.478 -7.013 32.532 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.812 -5.370 31.935 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.029 -6.654 31.737 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.557 -8.898 33.728 1.00 0.00 H new ATOM 0 HD12 ILE A 144 9.356 -8.302 32.559 1.00 0.00 H new ATOM 0 HD13 ILE A 144 10.897 -7.437 32.771 1.00 0.00 H new ATOM 768 N ILE A 145 8.798 -2.741 33.188 1.00 0.00 N ATOM 769 CA ILE A 145 8.245 -1.646 32.353 1.00 0.00 C ATOM 770 C ILE A 145 9.321 -0.598 32.081 1.00 0.00 C ATOM 771 O ILE A 145 9.278 0.100 31.088 1.00 0.00 O ATOM 772 CB ILE A 145 7.068 -1.005 33.110 1.00 0.00 C ATOM 773 CG1 ILE A 145 5.860 -1.947 33.043 1.00 0.00 C ATOM 774 CG2 ILE A 145 6.697 0.343 32.435 1.00 0.00 C ATOM 775 CD1 ILE A 145 4.546 -1.156 33.174 1.00 0.00 C ATOM 0 H ILE A 145 8.665 -2.636 34.194 1.00 0.00 H new ATOM 0 HA ILE A 145 7.904 -2.044 31.397 1.00 0.00 H new ATOM 0 HB ILE A 145 7.349 -0.831 34.149 1.00 0.00 H new ATOM 0 HG12 ILE A 145 5.870 -2.492 32.099 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.925 -2.688 33.840 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.864 0.800 32.969 1.00 0.00 H new ATOM 0 HG22 ILE A 145 7.557 1.013 32.463 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.410 0.164 31.399 1.00 0.00 H new ATOM 0 HD11 ILE A 145 3.701 -1.843 33.124 1.00 0.00 H new ATOM 0 HD12 ILE A 145 4.531 -0.631 34.129 1.00 0.00 H new ATOM 0 HD13 ILE A 145 4.474 -0.433 32.362 1.00 0.00 H new ATOM 787 N ARG A 146 10.276 -0.517 32.970 1.00 0.00 N ATOM 788 CA ARG A 146 11.363 0.476 32.785 1.00 0.00 C ATOM 789 C ARG A 146 12.514 -0.116 31.975 1.00 0.00 C ATOM 790 O ARG A 146 13.203 0.589 31.265 1.00 0.00 O ATOM 791 CB ARG A 146 11.894 0.874 34.172 1.00 0.00 C ATOM 792 CG ARG A 146 11.012 1.986 34.750 1.00 0.00 C ATOM 793 CD ARG A 146 11.315 2.146 36.243 1.00 0.00 C ATOM 794 NE ARG A 146 11.691 3.562 36.512 1.00 0.00 N ATOM 795 CZ ARG A 146 10.761 4.479 36.535 1.00 0.00 C ATOM 796 NH1 ARG A 146 9.689 4.274 37.250 1.00 0.00 N ATOM 797 NH2 ARG A 146 10.937 5.570 35.841 1.00 0.00 N ATOM 0 H ARG A 146 10.346 -1.093 33.809 1.00 0.00 H new ATOM 0 HA ARG A 146 10.967 1.338 32.249 1.00 0.00 H new ATOM 0 HB2 ARG A 146 11.893 0.010 34.837 1.00 0.00 H new ATOM 0 HB3 ARG A 146 12.926 1.215 34.095 1.00 0.00 H new ATOM 0 HG2 ARG A 146 11.199 2.924 34.226 1.00 0.00 H new ATOM 0 HG3 ARG A 146 9.959 1.744 34.604 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.443 1.869 36.836 1.00 0.00 H new ATOM 0 HD3 ARG A 146 12.126 1.479 36.536 1.00 0.00 H new ATOM 0 HE ARG A 146 12.666 3.813 36.677 1.00 0.00 H new ATOM 0 HH11 ARG A 146 9.587 3.408 37.780 1.00 0.00 H new ATOM 0 HH12 ARG A 146 8.953 4.979 37.279 1.00 0.00 H new ATOM 0 HH21 ARG A 146 11.789 5.695 35.294 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.223 6.298 35.846 1.00 0.00 H new ATOM 811 N ASP A 147 12.699 -1.405 32.093 1.00 0.00 N ATOM 812 CA ASP A 147 13.800 -2.058 31.336 1.00 0.00 C ATOM 813 C ASP A 147 13.414 -2.276 29.878 1.00 0.00 C ATOM 814 O ASP A 147 14.104 -1.836 28.980 1.00 0.00 O ATOM 815 CB ASP A 147 14.083 -3.424 31.976 1.00 0.00 C ATOM 816 CG ASP A 147 15.382 -3.992 31.402 1.00 0.00 C ATOM 817 OD1 ASP A 147 16.342 -3.238 31.386 1.00 0.00 O ATOM 818 OD2 ASP A 147 15.341 -5.145 31.010 1.00 0.00 O ATOM 0 H ASP A 147 12.139 -2.027 32.676 1.00 0.00 H new ATOM 0 HA ASP A 147 14.678 -1.413 31.369 1.00 0.00 H new ATOM 0 HB2 ASP A 147 14.164 -3.322 33.058 1.00 0.00 H new ATOM 0 HB3 ASP A 147 13.257 -4.108 31.782 1.00 0.00 H new ATOM 823 N VAL A 148 12.319 -2.960 29.669 1.00 0.00 N ATOM 824 CA VAL A 148 11.873 -3.218 28.276 1.00 0.00 C ATOM 825 C VAL A 148 12.038 -1.974 27.413 1.00 0.00 C ATOM 826 O VAL A 148 12.474 -2.055 26.282 1.00 0.00 O ATOM 827 CB VAL A 148 10.387 -3.603 28.309 1.00 0.00 C ATOM 828 CG1 VAL A 148 9.545 -2.339 28.479 1.00 0.00 C ATOM 829 CG2 VAL A 148 10.014 -4.285 26.991 1.00 0.00 C ATOM 0 H VAL A 148 11.721 -3.347 30.399 1.00 0.00 H new ATOM 0 HA VAL A 148 12.478 -4.019 27.851 1.00 0.00 H new ATOM 0 HB VAL A 148 10.201 -4.284 29.140 1.00 0.00 H new ATOM 0 HG11 VAL A 148 8.489 -2.606 28.503 1.00 0.00 H new ATOM 0 HG12 VAL A 148 9.816 -1.844 29.412 1.00 0.00 H new ATOM 0 HG13 VAL A 148 9.730 -1.664 27.643 1.00 0.00 H new ATOM 0 HG21 VAL A 148 8.960 -4.560 27.010 1.00 0.00 H new ATOM 0 HG22 VAL A 148 10.196 -3.600 26.163 1.00 0.00 H new ATOM 0 HG23 VAL A 148 10.621 -5.181 26.861 1.00 0.00 H new ATOM 839 N ASP A 149 11.686 -0.846 27.961 1.00 0.00 N ATOM 840 CA ASP A 149 11.818 0.410 27.187 1.00 0.00 C ATOM 841 C ASP A 149 13.162 0.464 26.473 1.00 0.00 C ATOM 842 O ASP A 149 14.171 0.061 27.018 1.00 0.00 O ATOM 843 CB ASP A 149 11.729 1.592 28.165 1.00 0.00 C ATOM 844 CG ASP A 149 11.908 2.901 27.396 1.00 0.00 C ATOM 845 OD1 ASP A 149 11.158 3.081 26.451 1.00 0.00 O ATOM 846 OD2 ASP A 149 12.785 3.648 27.796 1.00 0.00 O ATOM 0 H ASP A 149 11.315 -0.743 28.906 1.00 0.00 H new ATOM 0 HA ASP A 149 11.024 0.457 26.442 1.00 0.00 H new ATOM 0 HB2 ASP A 149 10.765 1.585 28.674 1.00 0.00 H new ATOM 0 HB3 ASP A 149 12.496 1.501 28.934 1.00 0.00 H new ATOM 851 N LEU A 150 13.152 0.961 25.260 1.00 0.00 N ATOM 852 CA LEU A 150 14.419 1.050 24.493 1.00 0.00 C ATOM 853 C LEU A 150 14.477 2.345 23.692 1.00 0.00 C ATOM 854 O LEU A 150 15.331 2.510 22.842 1.00 0.00 O ATOM 855 CB LEU A 150 14.493 -0.143 23.517 1.00 0.00 C ATOM 856 CG LEU A 150 13.081 -0.659 23.220 1.00 0.00 C ATOM 857 CD1 LEU A 150 12.304 0.410 22.450 1.00 0.00 C ATOM 858 CD2 LEU A 150 13.180 -1.924 22.363 1.00 0.00 C ATOM 0 H LEU A 150 12.323 1.305 24.776 1.00 0.00 H new ATOM 0 HA LEU A 150 15.256 1.032 25.192 1.00 0.00 H new ATOM 0 HB2 LEU A 150 14.981 0.162 22.591 1.00 0.00 H new ATOM 0 HB3 LEU A 150 15.098 -0.940 23.948 1.00 0.00 H new ATOM 0 HG LEU A 150 12.567 -0.884 24.154 1.00 0.00 H new ATOM 0 HD11 LEU A 150 11.299 0.046 22.237 1.00 0.00 H new ATOM 0 HD12 LEU A 150 12.242 1.318 23.050 1.00 0.00 H new ATOM 0 HD13 LEU A 150 12.817 0.629 21.513 1.00 0.00 H new ATOM 0 HD21 LEU A 150 12.179 -2.297 22.148 1.00 0.00 H new ATOM 0 HD22 LEU A 150 13.689 -1.691 21.428 1.00 0.00 H new ATOM 0 HD23 LEU A 150 13.743 -2.686 22.903 1.00 0.00 H new ATOM 870 N ASN A 151 13.566 3.243 23.985 1.00 0.00 N ATOM 871 CA ASN A 151 13.543 4.542 23.256 1.00 0.00 C ATOM 872 C ASN A 151 14.036 5.670 24.152 1.00 0.00 C ATOM 873 O ASN A 151 14.935 6.404 23.796 1.00 0.00 O ATOM 874 CB ASN A 151 12.092 4.844 22.841 1.00 0.00 C ATOM 875 CG ASN A 151 11.327 3.531 22.668 1.00 0.00 C ATOM 876 OD1 ASN A 151 10.662 3.062 23.574 1.00 0.00 O ATOM 877 ND2 ASN A 151 11.386 2.910 21.524 1.00 0.00 N ATOM 0 H ASN A 151 12.842 3.129 24.695 1.00 0.00 H new ATOM 0 HA ASN A 151 14.194 4.472 22.384 1.00 0.00 H new ATOM 0 HB2 ASN A 151 11.608 5.463 23.597 1.00 0.00 H new ATOM 0 HB3 ASN A 151 12.079 5.410 21.910 1.00 0.00 H new ATOM 0 HD21 ASN A 151 10.877 2.036 21.391 1.00 0.00 H new ATOM 0 HD22 ASN A 151 11.941 3.298 20.761 1.00 0.00 H new ATOM 884 N GLY A 152 13.435 5.785 25.305 1.00 0.00 N ATOM 885 CA GLY A 152 13.853 6.862 26.245 1.00 0.00 C ATOM 886 C GLY A 152 12.689 7.250 27.157 1.00 0.00 C ATOM 887 O GLY A 152 12.793 8.170 27.944 1.00 0.00 O ATOM 0 H GLY A 152 12.679 5.185 25.634 1.00 0.00 H new ATOM 0 HA2 GLY A 152 14.697 6.523 26.845 1.00 0.00 H new ATOM 0 HA3 GLY A 152 14.191 7.733 25.684 1.00 0.00 H new ATOM 891 N ASP A 153 11.600 6.538 27.028 1.00 0.00 N ATOM 892 CA ASP A 153 10.420 6.842 27.871 1.00 0.00 C ATOM 893 C ASP A 153 10.402 5.950 29.110 1.00 0.00 C ATOM 894 O ASP A 153 11.439 5.554 29.603 1.00 0.00 O ATOM 895 CB ASP A 153 9.155 6.572 27.041 1.00 0.00 C ATOM 896 CG ASP A 153 9.545 6.386 25.573 1.00 0.00 C ATOM 897 OD1 ASP A 153 9.915 7.387 24.980 1.00 0.00 O ATOM 898 OD2 ASP A 153 9.450 5.256 25.126 1.00 0.00 O ATOM 0 H ASP A 153 11.483 5.763 26.376 1.00 0.00 H new ATOM 0 HA ASP A 153 10.462 7.883 28.192 1.00 0.00 H new ATOM 0 HB2 ASP A 153 8.647 5.681 27.410 1.00 0.00 H new ATOM 0 HB3 ASP A 153 8.456 7.402 27.141 1.00 0.00 H new ATOM 903 N GLY A 154 9.225 5.648 29.591 1.00 0.00 N ATOM 904 CA GLY A 154 9.136 4.778 30.800 1.00 0.00 C ATOM 905 C GLY A 154 7.885 3.895 30.744 1.00 0.00 C ATOM 906 O GLY A 154 7.335 3.535 31.764 1.00 0.00 O ATOM 0 H GLY A 154 8.334 5.961 29.206 1.00 0.00 H new ATOM 0 HA2 GLY A 154 10.026 4.152 30.869 1.00 0.00 H new ATOM 0 HA3 GLY A 154 9.110 5.396 31.697 1.00 0.00 H new ATOM 910 N ARG A 155 7.466 3.563 29.549 1.00 0.00 N ATOM 911 CA ARG A 155 6.256 2.705 29.399 1.00 0.00 C ATOM 912 C ARG A 155 6.433 1.717 28.251 1.00 0.00 C ATOM 913 O ARG A 155 7.272 1.903 27.393 1.00 0.00 O ATOM 914 CB ARG A 155 5.053 3.605 29.094 1.00 0.00 C ATOM 915 CG ARG A 155 4.385 4.022 30.406 1.00 0.00 C ATOM 916 CD ARG A 155 4.026 5.511 30.327 1.00 0.00 C ATOM 917 NE ARG A 155 5.201 6.318 30.758 1.00 0.00 N ATOM 918 CZ ARG A 155 5.335 6.633 32.017 1.00 0.00 C ATOM 919 NH1 ARG A 155 4.510 6.114 32.886 1.00 0.00 N ATOM 920 NH2 ARG A 155 6.288 7.453 32.365 1.00 0.00 N ATOM 0 H ARG A 155 7.909 3.848 28.675 1.00 0.00 H new ATOM 0 HA ARG A 155 6.101 2.147 30.322 1.00 0.00 H new ATOM 0 HB2 ARG A 155 5.376 4.487 28.541 1.00 0.00 H new ATOM 0 HB3 ARG A 155 4.340 3.076 28.462 1.00 0.00 H new ATOM 0 HG2 ARG A 155 3.489 3.426 30.579 1.00 0.00 H new ATOM 0 HG3 ARG A 155 5.056 3.840 31.246 1.00 0.00 H new ATOM 0 HD2 ARG A 155 3.741 5.776 29.309 1.00 0.00 H new ATOM 0 HD3 ARG A 155 3.168 5.725 30.964 1.00 0.00 H new ATOM 0 HE ARG A 155 5.895 6.622 30.075 1.00 0.00 H new ATOM 0 HH11 ARG A 155 3.778 5.475 32.576 1.00 0.00 H new ATOM 0 HH12 ARG A 155 4.598 6.347 33.875 1.00 0.00 H new ATOM 0 HH21 ARG A 155 6.914 7.837 31.657 1.00 0.00 H new ATOM 0 HH22 ARG A 155 6.407 7.710 33.345 1.00 0.00 H new ATOM 934 N VAL A 156 5.635 0.679 28.255 1.00 0.00 N ATOM 935 CA VAL A 156 5.746 -0.334 27.168 1.00 0.00 C ATOM 936 C VAL A 156 4.757 -0.055 26.038 1.00 0.00 C ATOM 937 O VAL A 156 3.637 0.355 26.276 1.00 0.00 O ATOM 938 CB VAL A 156 5.427 -1.712 27.763 1.00 0.00 C ATOM 939 CG1 VAL A 156 6.020 -2.799 26.862 1.00 0.00 C ATOM 940 CG2 VAL A 156 6.051 -1.816 29.155 1.00 0.00 C ATOM 0 H VAL A 156 4.919 0.492 28.957 1.00 0.00 H new ATOM 0 HA VAL A 156 6.755 -0.295 26.758 1.00 0.00 H new ATOM 0 HB VAL A 156 4.347 -1.841 27.834 1.00 0.00 H new ATOM 0 HG11 VAL A 156 5.796 -3.780 27.280 1.00 0.00 H new ATOM 0 HG12 VAL A 156 5.586 -2.722 25.865 1.00 0.00 H new ATOM 0 HG13 VAL A 156 7.100 -2.669 26.798 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.827 -2.794 29.582 1.00 0.00 H new ATOM 0 HG22 VAL A 156 7.131 -1.692 29.080 1.00 0.00 H new ATOM 0 HG23 VAL A 156 5.640 -1.037 29.797 1.00 0.00 H new ATOM 950 N ASP A 157 5.202 -0.291 24.822 1.00 0.00 N ATOM 951 CA ASP A 157 4.323 -0.055 23.641 1.00 0.00 C ATOM 952 C ASP A 157 4.033 -1.371 22.925 1.00 0.00 C ATOM 953 O ASP A 157 4.753 -2.337 23.087 1.00 0.00 O ATOM 954 CB ASP A 157 5.059 0.879 22.667 1.00 0.00 C ATOM 955 CG ASP A 157 4.034 1.646 21.829 1.00 0.00 C ATOM 956 OD1 ASP A 157 3.559 2.648 22.339 1.00 0.00 O ATOM 957 OD2 ASP A 157 3.783 1.188 20.726 1.00 0.00 O ATOM 0 H ASP A 157 6.136 -0.637 24.603 1.00 0.00 H new ATOM 0 HA ASP A 157 3.384 0.387 23.973 1.00 0.00 H new ATOM 0 HB2 ASP A 157 5.689 1.576 23.220 1.00 0.00 H new ATOM 0 HB3 ASP A 157 5.717 0.301 22.018 1.00 0.00 H new ATOM 962 N PHE A 158 2.987 -1.390 22.143 1.00 0.00 N ATOM 963 CA PHE A 158 2.648 -2.641 21.418 1.00 0.00 C ATOM 964 C PHE A 158 3.894 -3.241 20.784 1.00 0.00 C ATOM 965 O PHE A 158 3.977 -4.436 20.584 1.00 0.00 O ATOM 966 CB PHE A 158 1.618 -2.304 20.314 1.00 0.00 C ATOM 967 CG PHE A 158 1.109 -3.595 19.629 1.00 0.00 C ATOM 968 CD1 PHE A 158 0.642 -4.670 20.377 1.00 0.00 C ATOM 969 CD2 PHE A 158 1.075 -3.683 18.245 1.00 0.00 C ATOM 970 CE1 PHE A 158 0.153 -5.805 19.747 1.00 0.00 C ATOM 971 CE2 PHE A 158 0.583 -4.819 17.623 1.00 0.00 C ATOM 972 CZ PHE A 158 0.121 -5.876 18.374 1.00 0.00 C ATOM 0 H PHE A 158 2.361 -0.602 21.978 1.00 0.00 H new ATOM 0 HA PHE A 158 2.232 -3.366 22.118 1.00 0.00 H new ATOM 0 HB2 PHE A 158 0.778 -1.761 20.747 1.00 0.00 H new ATOM 0 HB3 PHE A 158 2.074 -1.648 19.572 1.00 0.00 H new ATOM 0 HD1 PHE A 158 0.660 -4.621 21.456 1.00 0.00 H new ATOM 0 HD2 PHE A 158 1.435 -2.859 17.647 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -0.204 -6.636 20.337 1.00 0.00 H new ATOM 0 HE2 PHE A 158 0.562 -4.875 16.545 1.00 0.00 H new ATOM 0 HZ PHE A 158 -0.266 -6.759 17.886 1.00 0.00 H new ATOM 982 N GLU A 159 4.842 -2.400 20.476 1.00 0.00 N ATOM 983 CA GLU A 159 6.085 -2.911 19.858 1.00 0.00 C ATOM 984 C GLU A 159 6.943 -3.582 20.916 1.00 0.00 C ATOM 985 O GLU A 159 7.228 -4.761 20.831 1.00 0.00 O ATOM 986 CB GLU A 159 6.859 -1.727 19.256 1.00 0.00 C ATOM 987 CG GLU A 159 6.222 -1.343 17.918 1.00 0.00 C ATOM 988 CD GLU A 159 7.140 -0.365 17.182 1.00 0.00 C ATOM 989 OE1 GLU A 159 8.283 -0.278 17.598 1.00 0.00 O ATOM 990 OE2 GLU A 159 6.646 0.238 16.243 1.00 0.00 O ATOM 0 H GLU A 159 4.806 -1.392 20.626 1.00 0.00 H new ATOM 0 HA GLU A 159 5.840 -3.635 19.081 1.00 0.00 H new ATOM 0 HB2 GLU A 159 6.840 -0.878 19.939 1.00 0.00 H new ATOM 0 HB3 GLU A 159 7.905 -1.996 19.111 1.00 0.00 H new ATOM 0 HG2 GLU A 159 6.059 -2.234 17.311 1.00 0.00 H new ATOM 0 HG3 GLU A 159 5.246 -0.888 18.084 1.00 0.00 H new ATOM 997 N GLU A 160 7.341 -2.821 21.900 1.00 0.00 N ATOM 998 CA GLU A 160 8.177 -3.408 22.970 1.00 0.00 C ATOM 999 C GLU A 160 7.418 -4.540 23.642 1.00 0.00 C ATOM 1000 O GLU A 160 7.999 -5.505 24.097 1.00 0.00 O ATOM 1001 CB GLU A 160 8.473 -2.318 24.014 1.00 0.00 C ATOM 1002 CG GLU A 160 9.336 -1.228 23.374 1.00 0.00 C ATOM 1003 CD GLU A 160 8.934 0.133 23.946 1.00 0.00 C ATOM 1004 OE1 GLU A 160 9.064 0.273 25.151 1.00 0.00 O ATOM 1005 OE2 GLU A 160 8.518 0.955 23.146 1.00 0.00 O ATOM 0 H GLU A 160 7.123 -1.830 22.004 1.00 0.00 H new ATOM 0 HA GLU A 160 9.105 -3.792 22.547 1.00 0.00 H new ATOM 0 HB2 GLU A 160 7.541 -1.890 24.384 1.00 0.00 H new ATOM 0 HB3 GLU A 160 8.989 -2.750 24.872 1.00 0.00 H new ATOM 0 HG2 GLU A 160 10.391 -1.421 23.570 1.00 0.00 H new ATOM 0 HG3 GLU A 160 9.206 -1.234 22.292 1.00 0.00 H new ATOM 1012 N PHE A 161 6.119 -4.396 23.684 1.00 0.00 N ATOM 1013 CA PHE A 161 5.280 -5.437 24.313 1.00 0.00 C ATOM 1014 C PHE A 161 5.415 -6.740 23.543 1.00 0.00 C ATOM 1015 O PHE A 161 5.641 -7.796 24.115 1.00 0.00 O ATOM 1016 CB PHE A 161 3.826 -4.943 24.235 1.00 0.00 C ATOM 1017 CG PHE A 161 2.850 -6.017 24.713 1.00 0.00 C ATOM 1018 CD1 PHE A 161 3.025 -6.652 25.931 1.00 0.00 C ATOM 1019 CD2 PHE A 161 1.736 -6.323 23.953 1.00 0.00 C ATOM 1020 CE1 PHE A 161 2.092 -7.571 26.377 1.00 0.00 C ATOM 1021 CE2 PHE A 161 0.810 -7.236 24.401 1.00 0.00 C ATOM 1022 CZ PHE A 161 0.985 -7.859 25.607 1.00 0.00 C ATOM 0 H PHE A 161 5.609 -3.597 23.306 1.00 0.00 H new ATOM 0 HA PHE A 161 5.583 -5.614 25.345 1.00 0.00 H new ATOM 0 HB2 PHE A 161 3.711 -4.046 24.844 1.00 0.00 H new ATOM 0 HB3 PHE A 161 3.589 -4.664 23.208 1.00 0.00 H new ATOM 0 HD1 PHE A 161 3.892 -6.429 26.535 1.00 0.00 H new ATOM 0 HD2 PHE A 161 1.592 -5.840 22.998 1.00 0.00 H new ATOM 0 HE1 PHE A 161 2.231 -8.063 27.328 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -0.058 -7.462 23.799 1.00 0.00 H new ATOM 0 HZ PHE A 161 0.256 -8.576 25.955 1.00 0.00 H new ATOM 1032 N VAL A 162 5.289 -6.640 22.249 1.00 0.00 N ATOM 1033 CA VAL A 162 5.405 -7.849 21.412 1.00 0.00 C ATOM 1034 C VAL A 162 6.848 -8.328 21.365 1.00 0.00 C ATOM 1035 O VAL A 162 7.110 -9.500 21.182 1.00 0.00 O ATOM 1036 CB VAL A 162 4.953 -7.488 19.988 1.00 0.00 C ATOM 1037 CG1 VAL A 162 5.569 -8.475 18.995 1.00 0.00 C ATOM 1038 CG2 VAL A 162 3.427 -7.574 19.911 1.00 0.00 C ATOM 0 H VAL A 162 5.111 -5.772 21.743 1.00 0.00 H new ATOM 0 HA VAL A 162 4.787 -8.643 21.831 1.00 0.00 H new ATOM 0 HB VAL A 162 5.277 -6.477 19.743 1.00 0.00 H new ATOM 0 HG11 VAL A 162 5.250 -8.221 17.984 1.00 0.00 H new ATOM 0 HG12 VAL A 162 6.656 -8.422 19.056 1.00 0.00 H new ATOM 0 HG13 VAL A 162 5.241 -9.486 19.236 1.00 0.00 H new ATOM 0 HG21 VAL A 162 3.099 -7.319 18.903 1.00 0.00 H new ATOM 0 HG22 VAL A 162 3.107 -8.588 20.151 1.00 0.00 H new ATOM 0 HG23 VAL A 162 2.987 -6.876 20.623 1.00 0.00 H new ATOM 1048 N ARG A 163 7.764 -7.412 21.535 1.00 0.00 N ATOM 1049 CA ARG A 163 9.190 -7.802 21.503 1.00 0.00 C ATOM 1050 C ARG A 163 9.600 -8.417 22.827 1.00 0.00 C ATOM 1051 O ARG A 163 10.479 -9.254 22.877 1.00 0.00 O ATOM 1052 CB ARG A 163 10.033 -6.542 21.263 1.00 0.00 C ATOM 1053 CG ARG A 163 11.514 -6.923 21.232 1.00 0.00 C ATOM 1054 CD ARG A 163 12.339 -5.696 20.838 1.00 0.00 C ATOM 1055 NE ARG A 163 13.670 -6.146 20.340 1.00 0.00 N ATOM 1056 CZ ARG A 163 14.541 -5.256 19.950 1.00 0.00 C ATOM 1057 NH1 ARG A 163 14.734 -4.196 20.687 1.00 0.00 N ATOM 1058 NH2 ARG A 163 15.193 -5.457 18.839 1.00 0.00 N ATOM 0 H ARG A 163 7.582 -6.421 21.693 1.00 0.00 H new ATOM 0 HA ARG A 163 9.346 -8.532 20.709 1.00 0.00 H new ATOM 0 HB2 ARG A 163 9.747 -6.073 20.322 1.00 0.00 H new ATOM 0 HB3 ARG A 163 9.850 -5.812 22.052 1.00 0.00 H new ATOM 0 HG2 ARG A 163 11.828 -7.289 22.209 1.00 0.00 H new ATOM 0 HG3 ARG A 163 11.679 -7.732 20.520 1.00 0.00 H new ATOM 0 HD2 ARG A 163 11.821 -5.126 20.066 1.00 0.00 H new ATOM 0 HD3 ARG A 163 12.462 -5.034 21.695 1.00 0.00 H new ATOM 0 HE ARG A 163 13.898 -7.140 20.304 1.00 0.00 H new ATOM 0 HH11 ARG A 163 14.208 -4.074 21.552 1.00 0.00 H new ATOM 0 HH12 ARG A 163 15.411 -3.490 20.398 1.00 0.00 H new ATOM 0 HH21 ARG A 163 15.018 -6.299 18.290 1.00 0.00 H new ATOM 0 HH22 ARG A 163 15.878 -4.772 18.518 1.00 0.00 H new ATOM 1072 N MET A 164 8.956 -7.996 23.887 1.00 0.00 N ATOM 1073 CA MET A 164 9.315 -8.563 25.207 1.00 0.00 C ATOM 1074 C MET A 164 8.883 -10.009 25.279 1.00 0.00 C ATOM 1075 O MET A 164 9.556 -10.834 25.866 1.00 0.00 O ATOM 1076 CB MET A 164 8.586 -7.772 26.303 1.00 0.00 C ATOM 1077 CG MET A 164 9.339 -7.947 27.624 1.00 0.00 C ATOM 1078 SD MET A 164 11.123 -7.642 27.607 1.00 0.00 S ATOM 1079 CE MET A 164 11.365 -7.598 29.400 1.00 0.00 C ATOM 0 H MET A 164 8.213 -7.298 23.890 1.00 0.00 H new ATOM 0 HA MET A 164 10.394 -8.499 25.347 1.00 0.00 H new ATOM 0 HB2 MET A 164 8.534 -6.717 26.035 1.00 0.00 H new ATOM 0 HB3 MET A 164 7.560 -8.126 26.404 1.00 0.00 H new ATOM 0 HG2 MET A 164 8.889 -7.280 28.360 1.00 0.00 H new ATOM 0 HG3 MET A 164 9.174 -8.966 27.974 1.00 0.00 H new ATOM 0 HE1 MET A 164 12.417 -7.418 29.621 1.00 0.00 H new ATOM 0 HE2 MET A 164 10.762 -6.798 29.829 1.00 0.00 H new ATOM 0 HE3 MET A 164 11.062 -8.552 29.832 1.00 0.00 H new ATOM 1089 N MET A 165 7.758 -10.301 24.676 1.00 0.00 N ATOM 1090 CA MET A 165 7.271 -11.698 24.703 1.00 0.00 C ATOM 1091 C MET A 165 8.306 -12.629 24.092 1.00 0.00 C ATOM 1092 O MET A 165 8.417 -13.778 24.473 1.00 0.00 O ATOM 1093 CB MET A 165 5.981 -11.779 23.875 1.00 0.00 C ATOM 1094 CG MET A 165 4.846 -11.110 24.650 1.00 0.00 C ATOM 1095 SD MET A 165 4.527 -11.703 26.330 1.00 0.00 S ATOM 1096 CE MET A 165 3.461 -10.337 26.853 1.00 0.00 C ATOM 0 H MET A 165 7.168 -9.637 24.175 1.00 0.00 H new ATOM 0 HA MET A 165 7.089 -11.998 25.735 1.00 0.00 H new ATOM 0 HB2 MET A 165 6.120 -11.287 22.913 1.00 0.00 H new ATOM 0 HB3 MET A 165 5.732 -12.820 23.667 1.00 0.00 H new ATOM 0 HG2 MET A 165 5.058 -10.042 24.704 1.00 0.00 H new ATOM 0 HG3 MET A 165 3.929 -11.225 24.072 1.00 0.00 H new ATOM 0 HE1 MET A 165 2.971 -10.596 27.792 1.00 0.00 H new ATOM 0 HE2 MET A 165 4.063 -9.439 26.994 1.00 0.00 H new ATOM 0 HE3 MET A 165 2.706 -10.152 26.089 1.00 0.00 H new ATOM 1106 N SER A 166 9.049 -12.105 23.149 1.00 0.00 N ATOM 1107 CA SER A 166 10.091 -12.925 22.482 1.00 0.00 C ATOM 1108 C SER A 166 11.476 -12.596 23.031 1.00 0.00 C ATOM 1109 O SER A 166 11.680 -12.555 24.229 1.00 0.00 O ATOM 1110 CB SER A 166 10.062 -12.598 20.980 1.00 0.00 C ATOM 1111 OG SER A 166 8.806 -13.095 20.543 1.00 0.00 O ATOM 0 H SER A 166 8.974 -11.144 22.816 1.00 0.00 H new ATOM 0 HA SER A 166 9.890 -13.981 22.663 1.00 0.00 H new ATOM 0 HB2 SER A 166 10.150 -11.526 20.803 1.00 0.00 H new ATOM 0 HB3 SER A 166 10.886 -13.077 20.452 1.00 0.00 H new ATOM 0 HG SER A 166 8.703 -12.924 19.584 1.00 0.00 H new ATOM 1117 N ARG A 167 12.406 -12.366 22.142 1.00 0.00 N ATOM 1118 CA ARG A 167 13.781 -12.038 22.590 1.00 0.00 C ATOM 1119 C ARG A 167 13.839 -10.633 23.178 1.00 0.00 C ATOM 1120 O ARG A 167 13.007 -9.840 22.768 1.00 0.00 O ATOM 1121 CB ARG A 167 14.711 -12.103 21.368 1.00 0.00 C ATOM 1122 CG ARG A 167 16.107 -11.624 21.769 1.00 0.00 C ATOM 1123 CD ARG A 167 17.047 -11.763 20.569 1.00 0.00 C ATOM 1124 NE ARG A 167 17.635 -13.133 20.572 1.00 0.00 N ATOM 1125 CZ ARG A 167 18.187 -13.595 19.483 1.00 0.00 C ATOM 1126 NH1 ARG A 167 17.442 -14.224 18.615 1.00 0.00 N ATOM 1127 NH2 ARG A 167 19.466 -13.413 19.298 1.00 0.00 N ATOM 1128 OXT ARG A 167 14.712 -10.428 24.006 1.00 0.00 O ATOM 0 H ARG A 167 12.269 -12.392 21.132 1.00 0.00 H new ATOM 0 HA ARG A 167 14.088 -12.748 23.358 1.00 0.00 H new ATOM 0 HB2 ARG A 167 14.759 -13.123 20.987 1.00 0.00 H new ATOM 0 HB3 ARG A 167 14.318 -11.481 20.564 1.00 0.00 H new ATOM 0 HG2 ARG A 167 16.068 -10.586 22.098 1.00 0.00 H new ATOM 0 HG3 ARG A 167 16.479 -12.211 22.609 1.00 0.00 H new ATOM 0 HD2 ARG A 167 16.502 -11.589 19.641 1.00 0.00 H new ATOM 0 HD3 ARG A 167 17.837 -11.014 20.620 1.00 0.00 H new ATOM 0 HE ARG A 167 17.606 -13.704 21.417 1.00 0.00 H new ATOM 0 HH11 ARG A 167 16.445 -14.348 18.793 1.00 0.00 H new ATOM 0 HH12 ARG A 167 17.857 -14.592 17.759 1.00 0.00 H new ATOM 0 HH21 ARG A 167 20.017 -12.917 19.998 1.00 0.00 H new ATOM 0 HH22 ARG A 167 19.915 -13.767 18.453 1.00 0.00 H new TER 1142 ARG A 167 HETATM 1143 CA CA A 501 -2.460 2.923 29.629 1.00 0.00 CA HETATM 1144 CA CA A 502 8.792 2.664 25.363 1.00 0.00 CA