USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1065 hydrogens (21 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 Single : A 19 SER OG : rot 43:sc= 0.426 USER MOD Single : A 20 ASN : amide:sc= -0.036 K(o=-0.036,f=-1.5!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= -0.239 USER MOD Single : A 31 ASN : amide:sc= -1.79 K(o=-1.8,f=-4.1!) USER MOD Single : A 37 HIS : no HD1:sc= -9.69! C(o=-9.7!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc=-0.00915 (180deg=-0.313) USER MOD Single : B 19 SER OG : rot 42:sc= 0.422 USER MOD Single : B 20 ASN : amide:sc= -0.0274 K(o=-0.027,f=-1.5!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= -0.203 USER MOD Single : B 31 ASN : amide:sc= -0.654 K(o=-0.65,f=-3!) USER MOD Single : B 37 HIS : no HD1:sc= -10.2! C(o=-10!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ -163:sc= -0.0184 (180deg=-0.346) USER MOD Single : C 19 SER OG : rot 45:sc= 0.467 USER MOD Single : C 20 ASN : amide:sc= -0.0222 K(o=-0.022,f=-1.4!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= -0.247 USER MOD Single : C 31 ASN : amide:sc= -1.89 K(o=-1.9,f=-5!) USER MOD Single : C 37 HIS : no HD1:sc= -9.68! C(o=-9.7!,f=-12!) USER MOD Single : C 49 LYS NZ :NH3+ -163:sc= -0.0101 (180deg=-0.296) USER MOD Single : D 19 SER OG : rot 40:sc= 0.412 USER MOD Single : D 20 ASN : amide:sc= -0.0298 K(o=-0.03,f=-1.5!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= -0.254 USER MOD Single : D 31 ASN : amide:sc= -5.92! C(o=-5.9!,f=-7.9!) USER MOD Single : D 37 HIS : no HD1:sc= -9.98! C(o=-10!,f=-12!) USER MOD Single : D 49 LYS NZ :NH3+ -163:sc= -0.0379 (180deg=-0.322) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -3.287 28.028 2.396 1.00 0.00 N ATOM 2 CA SER A 19 -3.872 27.268 1.257 1.00 0.00 C ATOM 3 C SER A 19 -4.080 25.818 1.673 1.00 0.00 C ATOM 4 O SER A 19 -3.120 25.067 1.846 1.00 0.00 O ATOM 5 CB SER A 19 -2.923 27.335 0.061 1.00 0.00 C ATOM 6 OG SER A 19 -1.606 27.013 0.487 1.00 0.00 O ATOM 0 HA SER A 19 -4.831 27.703 0.978 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.247 26.640 -0.714 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.942 28.333 -0.377 1.00 0.00 H new ATOM 0 HG SER A 19 -1.638 26.246 1.097 1.00 0.00 H new ATOM 14 N ASN A 20 -5.342 25.428 1.838 1.00 0.00 N ATOM 15 CA ASN A 20 -5.666 24.061 2.241 1.00 0.00 C ATOM 16 C ASN A 20 -5.904 23.184 1.017 1.00 0.00 C ATOM 17 O ASN A 20 -6.272 22.017 1.140 1.00 0.00 O ATOM 18 CB ASN A 20 -6.917 24.061 3.121 1.00 0.00 C ATOM 19 CG ASN A 20 -6.616 24.738 4.454 1.00 0.00 C ATOM 20 OD1 ASN A 20 -5.473 24.733 4.911 1.00 0.00 O ATOM 21 ND2 ASN A 20 -7.580 25.326 5.109 1.00 0.00 N ATOM 0 H ASN A 20 -6.151 26.033 1.700 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.824 23.658 2.804 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -7.729 24.583 2.614 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -7.252 23.038 3.291 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -7.387 25.782 6.001 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -8.527 25.329 4.729 1.00 0.00 H new ATOM 28 N ASP A 21 -5.685 23.753 -0.165 1.00 0.00 N ATOM 29 CA ASP A 21 -5.874 23.010 -1.406 1.00 0.00 C ATOM 30 C ASP A 21 -4.746 22.004 -1.606 1.00 0.00 C ATOM 31 O ASP A 21 -4.804 21.163 -2.502 1.00 0.00 O ATOM 32 CB ASP A 21 -5.915 23.977 -2.591 1.00 0.00 C ATOM 33 CG ASP A 21 -7.215 24.773 -2.571 1.00 0.00 C ATOM 34 OD1 ASP A 21 -8.123 24.370 -1.864 1.00 0.00 O ATOM 35 OD2 ASP A 21 -7.284 25.776 -3.263 1.00 0.00 O ATOM 0 H ASP A 21 -5.379 24.718 -0.289 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.819 22.470 -1.344 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.063 24.655 -2.547 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.833 23.423 -3.526 1.00 0.00 H new ATOM 40 N SER A 22 -3.720 22.099 -0.765 1.00 0.00 N ATOM 41 CA SER A 22 -2.584 21.191 -0.861 1.00 0.00 C ATOM 42 C SER A 22 -3.030 19.750 -0.638 1.00 0.00 C ATOM 43 O SER A 22 -2.525 18.830 -1.279 1.00 0.00 O ATOM 44 CB SER A 22 -1.529 21.563 0.184 1.00 0.00 C ATOM 45 OG SER A 22 -2.103 21.480 1.482 1.00 0.00 O ATOM 0 H SER A 22 -3.653 22.789 -0.017 1.00 0.00 H new ATOM 0 HA SER A 22 -2.157 21.279 -1.860 1.00 0.00 H new ATOM 0 HB2 SER A 22 -0.674 20.892 0.109 1.00 0.00 H new ATOM 0 HB3 SER A 22 -1.160 22.572 0.001 1.00 0.00 H new ATOM 0 HG SER A 22 -1.429 21.716 2.153 1.00 0.00 H new ATOM 51 N SER A 23 -3.980 19.560 0.274 1.00 0.00 N ATOM 52 CA SER A 23 -4.486 18.224 0.575 1.00 0.00 C ATOM 53 C SER A 23 -5.693 17.904 -0.296 1.00 0.00 C ATOM 54 O SER A 23 -6.826 18.259 0.035 1.00 0.00 O ATOM 55 CB SER A 23 -4.883 18.137 2.048 1.00 0.00 C ATOM 56 OG SER A 23 -5.047 16.771 2.408 1.00 0.00 O ATOM 0 H SER A 23 -4.413 20.309 0.814 1.00 0.00 H new ATOM 0 HA SER A 23 -3.698 17.500 0.368 1.00 0.00 H new ATOM 0 HB2 SER A 23 -4.118 18.600 2.671 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.810 18.685 2.220 1.00 0.00 H new ATOM 0 HG SER A 23 -5.300 16.710 3.353 1.00 0.00 H new ATOM 62 N ASP A 24 -5.439 17.234 -1.417 1.00 0.00 N ATOM 63 CA ASP A 24 -6.509 16.877 -2.331 1.00 0.00 C ATOM 64 C ASP A 24 -7.308 15.685 -1.791 1.00 0.00 C ATOM 65 O ASP A 24 -6.770 14.847 -1.066 1.00 0.00 O ATOM 66 CB ASP A 24 -5.937 16.528 -3.711 1.00 0.00 C ATOM 67 CG ASP A 24 -5.612 17.806 -4.477 1.00 0.00 C ATOM 68 OD1 ASP A 24 -6.540 18.430 -4.968 1.00 0.00 O ATOM 69 OD2 ASP A 24 -4.445 18.143 -4.554 1.00 0.00 O ATOM 0 H ASP A 24 -4.509 16.932 -1.709 1.00 0.00 H new ATOM 0 HA ASP A 24 -7.175 17.735 -2.424 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.038 15.922 -3.599 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.656 15.931 -4.272 1.00 0.00 H new ATOM 74 N PRO A 25 -8.565 15.587 -2.146 1.00 0.00 N ATOM 75 CA PRO A 25 -9.439 14.464 -1.704 1.00 0.00 C ATOM 76 C PRO A 25 -8.749 13.107 -1.851 1.00 0.00 C ATOM 77 O PRO A 25 -8.899 12.227 -1.005 1.00 0.00 O ATOM 78 CB PRO A 25 -10.652 14.563 -2.641 1.00 0.00 C ATOM 79 CG PRO A 25 -10.718 15.998 -3.061 1.00 0.00 C ATOM 80 CD PRO A 25 -9.294 16.546 -2.995 1.00 0.00 C ATOM 0 HA PRO A 25 -9.700 14.537 -0.648 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.536 13.907 -3.504 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.567 14.261 -2.131 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -11.119 16.087 -4.071 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.380 16.562 -2.404 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.849 16.614 -3.988 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.275 17.548 -2.567 1.00 0.00 H new ATOM 88 N LEU A 26 -8.003 12.941 -2.936 1.00 0.00 N ATOM 89 CA LEU A 26 -7.304 11.688 -3.187 1.00 0.00 C ATOM 90 C LEU A 26 -6.244 11.446 -2.119 1.00 0.00 C ATOM 91 O LEU A 26 -6.046 10.317 -1.672 1.00 0.00 O ATOM 92 CB LEU A 26 -6.646 11.721 -4.573 1.00 0.00 C ATOM 93 CG LEU A 26 -7.691 11.406 -5.645 1.00 0.00 C ATOM 94 CD1 LEU A 26 -8.818 12.440 -5.580 1.00 0.00 C ATOM 95 CD2 LEU A 26 -7.034 11.452 -7.024 1.00 0.00 C ATOM 0 H LEU A 26 -7.867 13.654 -3.652 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.029 10.875 -3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.208 12.702 -4.755 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.834 10.996 -4.618 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.102 10.412 -5.471 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -9.562 12.215 -6.344 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -9.286 12.407 -4.596 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -8.409 13.435 -5.754 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.777 11.228 -7.789 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -6.623 12.446 -7.198 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.232 10.715 -7.070 1.00 0.00 H new ATOM 107 N VAL A 27 -5.542 12.510 -1.735 1.00 0.00 N ATOM 108 CA VAL A 27 -4.484 12.387 -0.740 1.00 0.00 C ATOM 109 C VAL A 27 -5.048 11.892 0.591 1.00 0.00 C ATOM 110 O VAL A 27 -4.548 10.921 1.167 1.00 0.00 O ATOM 111 CB VAL A 27 -3.810 13.749 -0.533 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.833 13.666 0.642 1.00 0.00 C ATOM 113 CG2 VAL A 27 -3.049 14.139 -1.803 1.00 0.00 C ATOM 0 H VAL A 27 -5.685 13.454 -2.093 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.753 11.664 -1.101 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.570 14.500 -0.318 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.355 14.635 0.787 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.375 13.389 1.547 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.072 12.915 0.430 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.570 15.107 -1.657 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.290 13.387 -2.018 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.745 14.201 -2.640 1.00 0.00 H new ATOM 123 N VAL A 28 -6.091 12.555 1.065 1.00 0.00 N ATOM 124 CA VAL A 28 -6.721 12.172 2.322 1.00 0.00 C ATOM 125 C VAL A 28 -7.363 10.794 2.201 1.00 0.00 C ATOM 126 O VAL A 28 -7.294 9.982 3.124 1.00 0.00 O ATOM 127 CB VAL A 28 -7.777 13.203 2.719 1.00 0.00 C ATOM 128 CG1 VAL A 28 -7.094 14.528 3.070 1.00 0.00 C ATOM 129 CG2 VAL A 28 -8.738 13.423 1.552 1.00 0.00 C ATOM 0 H VAL A 28 -6.519 13.357 0.602 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.952 12.134 3.094 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.330 12.838 3.585 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.848 15.262 3.353 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -6.407 14.374 3.902 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -6.540 14.892 2.205 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -9.491 14.158 1.835 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -8.183 13.786 0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -9.226 12.482 1.300 1.00 0.00 H new ATOM 139 N ALA A 29 -7.989 10.542 1.058 1.00 0.00 N ATOM 140 CA ALA A 29 -8.643 9.259 0.823 1.00 0.00 C ATOM 141 C ALA A 29 -7.611 8.138 0.774 1.00 0.00 C ATOM 142 O ALA A 29 -7.855 7.037 1.267 1.00 0.00 O ATOM 143 CB ALA A 29 -9.418 9.300 -0.496 1.00 0.00 C ATOM 0 H ALA A 29 -8.058 11.203 0.284 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.335 9.068 1.643 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.903 8.338 -0.663 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -10.174 10.084 -0.450 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.730 9.507 -1.316 1.00 0.00 H new ATOM 149 N ALA A 30 -6.462 8.424 0.175 1.00 0.00 N ATOM 150 CA ALA A 30 -5.403 7.425 0.064 1.00 0.00 C ATOM 151 C ALA A 30 -4.997 6.921 1.444 1.00 0.00 C ATOM 152 O ALA A 30 -4.839 5.718 1.652 1.00 0.00 O ATOM 153 CB ALA A 30 -4.184 8.035 -0.636 1.00 0.00 C ATOM 0 H ALA A 30 -6.239 9.330 -0.238 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.779 6.586 -0.522 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.397 7.285 -0.716 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.468 8.371 -1.633 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.819 8.884 -0.057 1.00 0.00 H new ATOM 159 N ASN A 31 -4.830 7.847 2.384 1.00 0.00 N ATOM 160 CA ASN A 31 -4.442 7.475 3.740 1.00 0.00 C ATOM 161 C ASN A 31 -5.522 6.617 4.392 1.00 0.00 C ATOM 162 O ASN A 31 -5.225 5.609 5.034 1.00 0.00 O ATOM 163 CB ASN A 31 -4.220 8.737 4.578 1.00 0.00 C ATOM 164 CG ASN A 31 -2.906 9.401 4.180 1.00 0.00 C ATOM 165 OD1 ASN A 31 -2.064 8.776 3.534 1.00 0.00 O ATOM 166 ND2 ASN A 31 -2.679 10.637 4.530 1.00 0.00 N ATOM 0 H ASN A 31 -4.955 8.848 2.235 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.518 6.899 3.690 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -5.047 9.431 4.431 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -4.202 8.482 5.638 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.802 11.088 4.269 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -3.378 11.152 5.065 1.00 0.00 H new ATOM 173 N ILE A 32 -6.777 7.018 4.218 1.00 0.00 N ATOM 174 CA ILE A 32 -7.893 6.274 4.791 1.00 0.00 C ATOM 175 C ILE A 32 -7.987 4.885 4.165 1.00 0.00 C ATOM 176 O ILE A 32 -8.187 3.890 4.863 1.00 0.00 O ATOM 177 CB ILE A 32 -9.202 7.033 4.557 1.00 0.00 C ATOM 178 CG1 ILE A 32 -9.191 8.327 5.373 1.00 0.00 C ATOM 179 CG2 ILE A 32 -10.384 6.165 4.995 1.00 0.00 C ATOM 180 CD1 ILE A 32 -10.339 9.228 4.914 1.00 0.00 C ATOM 0 H ILE A 32 -7.046 7.848 3.689 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.723 6.167 5.862 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.300 7.269 3.497 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.294 8.101 6.434 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.238 8.841 5.247 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.315 6.707 4.828 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -10.392 5.242 4.415 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.288 5.927 6.054 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.332 10.150 5.495 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.216 9.464 3.857 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.288 8.713 5.063 1.00 0.00 H new ATOM 192 N ILE A 33 -7.845 4.827 2.847 1.00 0.00 N ATOM 193 CA ILE A 33 -7.919 3.555 2.135 1.00 0.00 C ATOM 194 C ILE A 33 -6.784 2.633 2.571 1.00 0.00 C ATOM 195 O ILE A 33 -6.992 1.441 2.791 1.00 0.00 O ATOM 196 CB ILE A 33 -7.843 3.795 0.625 1.00 0.00 C ATOM 197 CG1 ILE A 33 -9.122 4.494 0.155 1.00 0.00 C ATOM 198 CG2 ILE A 33 -7.697 2.456 -0.101 1.00 0.00 C ATOM 199 CD1 ILE A 33 -8.918 5.027 -1.264 1.00 0.00 C ATOM 0 H ILE A 33 -7.679 5.639 2.252 1.00 0.00 H new ATOM 0 HA ILE A 33 -8.869 3.078 2.375 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.981 4.423 0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -9.959 3.797 0.176 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.371 5.312 0.830 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -7.643 2.629 -1.176 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.786 1.959 0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.558 1.825 0.122 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.828 5.525 -1.600 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -8.092 5.738 -1.270 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.689 4.199 -1.934 1.00 0.00 H new ATOM 211 N GLY A 34 -5.586 3.193 2.685 1.00 0.00 N ATOM 212 CA GLY A 34 -4.424 2.406 3.087 1.00 0.00 C ATOM 213 C GLY A 34 -4.646 1.768 4.453 1.00 0.00 C ATOM 214 O GLY A 34 -4.403 0.575 4.640 1.00 0.00 O ATOM 0 H GLY A 34 -5.393 4.179 2.507 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.231 1.630 2.346 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.541 3.044 3.118 1.00 0.00 H new ATOM 218 N ILE A 35 -5.121 2.565 5.401 1.00 0.00 N ATOM 219 CA ILE A 35 -5.382 2.065 6.745 1.00 0.00 C ATOM 220 C ILE A 35 -6.477 1.004 6.715 1.00 0.00 C ATOM 221 O ILE A 35 -6.384 -0.022 7.393 1.00 0.00 O ATOM 222 CB ILE A 35 -5.802 3.218 7.660 1.00 0.00 C ATOM 223 CG1 ILE A 35 -4.613 4.163 7.866 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.247 2.663 9.019 1.00 0.00 C ATOM 225 CD1 ILE A 35 -5.096 5.459 8.519 1.00 0.00 C ATOM 0 H ILE A 35 -5.332 3.554 5.266 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.468 1.615 7.132 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.628 3.760 7.200 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.861 3.686 8.494 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.138 4.381 6.909 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.545 3.486 9.668 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.091 1.988 8.878 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.421 2.120 9.478 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.250 6.130 8.665 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.833 5.939 7.874 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.550 5.233 9.484 1.00 0.00 H new ATOM 237 N LEU A 36 -7.525 1.266 5.944 1.00 0.00 N ATOM 238 CA LEU A 36 -8.640 0.336 5.856 1.00 0.00 C ATOM 239 C LEU A 36 -8.162 -1.017 5.325 1.00 0.00 C ATOM 240 O LEU A 36 -8.590 -2.068 5.795 1.00 0.00 O ATOM 241 CB LEU A 36 -9.722 0.909 4.918 1.00 0.00 C ATOM 242 CG LEU A 36 -11.108 0.450 5.388 1.00 0.00 C ATOM 243 CD1 LEU A 36 -12.176 1.019 4.459 1.00 0.00 C ATOM 244 CD2 LEU A 36 -11.175 -1.083 5.380 1.00 0.00 C ATOM 0 H LEU A 36 -7.625 2.107 5.376 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.060 0.195 6.852 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.672 1.998 4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.545 0.575 3.896 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.284 0.810 6.402 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -13.161 0.692 4.793 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.130 2.108 4.475 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.002 0.664 3.443 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.161 -1.406 5.714 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.997 -1.450 4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.415 -1.484 6.051 1.00 0.00 H new ATOM 256 N HIS A 37 -7.276 -0.975 4.337 1.00 0.00 N ATOM 257 CA HIS A 37 -6.752 -2.200 3.745 1.00 0.00 C ATOM 258 C HIS A 37 -6.057 -3.047 4.801 1.00 0.00 C ATOM 259 O HIS A 37 -6.203 -4.269 4.830 1.00 0.00 O ATOM 260 CB HIS A 37 -5.762 -1.862 2.630 1.00 0.00 C ATOM 261 CG HIS A 37 -5.264 -3.135 2.001 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.470 -3.430 0.665 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.568 -4.200 2.512 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.908 -4.628 0.423 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.344 -5.139 1.514 1.00 0.00 N ATOM 0 H HIS A 37 -6.908 -0.114 3.932 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.586 -2.765 3.330 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.243 -1.236 1.879 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.925 -1.291 3.032 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.243 -4.294 3.537 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.914 -5.116 -0.540 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.853 -6.029 1.599 1.00 0.00 H new ATOM 273 N LEU A 38 -5.297 -2.394 5.669 1.00 0.00 N ATOM 274 CA LEU A 38 -4.579 -3.105 6.717 1.00 0.00 C ATOM 275 C LEU A 38 -5.539 -3.836 7.634 1.00 0.00 C ATOM 276 O LEU A 38 -5.249 -4.940 8.075 1.00 0.00 O ATOM 277 CB LEU A 38 -3.732 -2.113 7.538 1.00 0.00 C ATOM 278 CG LEU A 38 -2.317 -2.014 6.943 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.676 -0.688 7.339 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.455 -3.172 7.474 1.00 0.00 C ATOM 0 H LEU A 38 -5.162 -1.383 5.669 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.927 -3.839 6.245 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.205 -1.131 7.538 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.677 -2.441 8.576 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.384 -2.071 5.857 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.674 -0.627 6.913 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.282 0.136 6.962 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.613 -0.624 8.425 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.452 -3.102 7.053 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.397 -3.114 8.561 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.904 -4.122 7.185 1.00 0.00 H new ATOM 292 N ILE A 39 -6.661 -3.204 7.936 1.00 0.00 N ATOM 293 CA ILE A 39 -7.640 -3.806 8.830 1.00 0.00 C ATOM 294 C ILE A 39 -8.169 -5.109 8.239 1.00 0.00 C ATOM 295 O ILE A 39 -8.296 -6.109 8.936 1.00 0.00 O ATOM 296 CB ILE A 39 -8.803 -2.834 9.046 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.308 -1.612 9.826 1.00 0.00 C ATOM 298 CG2 ILE A 39 -9.913 -3.530 9.843 1.00 0.00 C ATOM 299 CD1 ILE A 39 -9.413 -0.553 9.880 1.00 0.00 C ATOM 0 H ILE A 39 -6.917 -2.283 7.580 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.159 -4.021 9.784 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.194 -2.517 8.079 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.022 -1.905 10.836 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.419 -1.200 9.349 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -10.740 -2.837 9.996 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.266 -4.401 9.291 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.522 -3.848 10.810 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.058 0.315 10.435 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.678 -0.252 8.867 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.290 -0.968 10.377 1.00 0.00 H new ATOM 311 N LEU A 40 -8.487 -5.087 6.953 1.00 0.00 N ATOM 312 CA LEU A 40 -9.003 -6.274 6.285 1.00 0.00 C ATOM 313 C LEU A 40 -7.892 -7.285 6.035 1.00 0.00 C ATOM 314 O LEU A 40 -8.077 -8.488 6.225 1.00 0.00 O ATOM 315 CB LEU A 40 -9.651 -5.882 4.956 1.00 0.00 C ATOM 316 CG LEU A 40 -10.907 -5.044 5.225 1.00 0.00 C ATOM 317 CD1 LEU A 40 -11.413 -4.449 3.910 1.00 0.00 C ATOM 318 CD2 LEU A 40 -12.005 -5.924 5.853 1.00 0.00 C ATOM 0 H LEU A 40 -8.398 -4.266 6.354 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.749 -6.734 6.934 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.946 -5.314 4.349 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.912 -6.776 4.389 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.659 -4.240 5.918 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -12.306 -3.853 4.100 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.640 -3.816 3.476 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.655 -5.254 3.216 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.893 -5.320 6.040 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -12.256 -6.736 5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.644 -6.340 6.794 1.00 0.00 H new ATOM 330 N TRP A 41 -6.746 -6.788 5.584 1.00 0.00 N ATOM 331 CA TRP A 41 -5.618 -7.658 5.287 1.00 0.00 C ATOM 332 C TRP A 41 -5.090 -8.323 6.553 1.00 0.00 C ATOM 333 O TRP A 41 -4.835 -9.529 6.576 1.00 0.00 O ATOM 334 CB TRP A 41 -4.503 -6.855 4.606 1.00 0.00 C ATOM 335 CG TRP A 41 -3.271 -7.698 4.512 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.025 -8.610 3.542 1.00 0.00 C ATOM 337 CD2 TRP A 41 -2.104 -7.705 5.382 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.794 -9.192 3.779 1.00 0.00 N ATOM 339 CE2 TRP A 41 -1.184 -8.658 4.897 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.758 -6.980 6.537 1.00 0.00 C ATOM 341 CZ2 TRP A 41 0.030 -8.891 5.535 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.530 -7.209 7.179 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.361 -8.159 6.678 1.00 0.00 C ATOM 0 H TRP A 41 -6.575 -5.796 5.418 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.959 -8.442 4.611 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.820 -6.543 3.611 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.294 -5.948 5.173 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.683 -8.844 2.718 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.386 -9.926 3.199 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.441 -6.243 6.932 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.713 -9.633 5.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.274 -6.647 8.065 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.306 -8.328 7.173 1.00 0.00 H new ATOM 354 N ILE A 42 -4.907 -7.523 7.592 1.00 0.00 N ATOM 355 CA ILE A 42 -4.388 -8.037 8.850 1.00 0.00 C ATOM 356 C ILE A 42 -5.405 -8.969 9.503 1.00 0.00 C ATOM 357 O ILE A 42 -5.043 -9.985 10.096 1.00 0.00 O ATOM 358 CB ILE A 42 -4.063 -6.874 9.796 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.139 -7.368 10.913 1.00 0.00 C ATOM 360 CG2 ILE A 42 -5.358 -6.326 10.414 1.00 0.00 C ATOM 361 CD1 ILE A 42 -2.714 -6.184 11.781 1.00 0.00 C ATOM 0 H ILE A 42 -5.108 -6.523 7.590 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.477 -8.600 8.648 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.569 -6.082 9.233 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.652 -8.113 11.521 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.262 -7.854 10.486 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.120 -5.500 11.085 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.018 -5.972 9.622 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -5.857 -7.117 10.975 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.056 -6.534 12.577 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.185 -5.454 11.168 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.597 -5.718 12.219 1.00 0.00 H new ATOM 373 N LEU A 43 -6.677 -8.602 9.404 1.00 0.00 N ATOM 374 CA LEU A 43 -7.734 -9.399 9.997 1.00 0.00 C ATOM 375 C LEU A 43 -7.779 -10.783 9.365 1.00 0.00 C ATOM 376 O LEU A 43 -7.963 -11.786 10.056 1.00 0.00 O ATOM 377 CB LEU A 43 -9.081 -8.700 9.809 1.00 0.00 C ATOM 378 CG LEU A 43 -10.219 -9.609 10.332 1.00 0.00 C ATOM 379 CD1 LEU A 43 -11.223 -8.777 11.133 1.00 0.00 C ATOM 380 CD2 LEU A 43 -10.938 -10.267 9.147 1.00 0.00 C ATOM 0 H LEU A 43 -6.996 -7.762 8.921 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.530 -9.508 11.062 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.086 -7.750 10.344 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.240 -8.473 8.755 1.00 0.00 H new ATOM 0 HG LEU A 43 -9.792 -10.379 10.975 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.021 -9.423 11.498 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.717 -8.312 11.979 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.647 -8.003 10.493 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -11.739 -10.907 9.517 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.359 -9.495 8.502 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.228 -10.867 8.578 1.00 0.00 H new ATOM 392 N ASP A 44 -7.620 -10.830 8.046 1.00 0.00 N ATOM 393 CA ASP A 44 -7.652 -12.099 7.328 1.00 0.00 C ATOM 394 C ASP A 44 -6.565 -13.033 7.843 1.00 0.00 C ATOM 395 O ASP A 44 -6.810 -14.214 8.088 1.00 0.00 O ATOM 396 CB ASP A 44 -7.451 -11.855 5.832 1.00 0.00 C ATOM 397 CG ASP A 44 -7.382 -13.185 5.092 1.00 0.00 C ATOM 398 OD1 ASP A 44 -8.431 -13.746 4.825 1.00 0.00 O ATOM 399 OD2 ASP A 44 -6.280 -13.625 4.808 1.00 0.00 O ATOM 0 H ASP A 44 -7.469 -10.011 7.457 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.623 -12.565 7.494 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.271 -11.253 5.440 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.534 -11.290 5.667 1.00 0.00 H new ATOM 404 N ARG A 45 -5.362 -12.495 8.013 1.00 0.00 N ATOM 405 CA ARG A 45 -4.245 -13.290 8.508 1.00 0.00 C ATOM 406 C ARG A 45 -4.489 -13.714 9.954 1.00 0.00 C ATOM 407 O ARG A 45 -3.876 -14.663 10.444 1.00 0.00 O ATOM 408 CB ARG A 45 -2.946 -12.487 8.418 1.00 0.00 C ATOM 409 CG ARG A 45 -2.502 -12.396 6.958 1.00 0.00 C ATOM 410 CD ARG A 45 -1.223 -11.562 6.865 1.00 0.00 C ATOM 411 NE ARG A 45 -0.780 -11.478 5.476 1.00 0.00 N ATOM 412 CZ ARG A 45 -0.007 -12.418 4.941 1.00 0.00 C ATOM 413 NH1 ARG A 45 0.366 -13.440 5.659 1.00 0.00 N ATOM 414 NH2 ARG A 45 0.378 -12.317 3.698 1.00 0.00 N ATOM 0 H ARG A 45 -5.137 -11.520 7.817 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.158 -14.183 7.889 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.095 -11.488 8.827 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.169 -12.964 9.016 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.328 -13.394 6.557 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.289 -11.943 6.355 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.402 -10.562 7.259 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -0.441 -12.011 7.478 1.00 0.00 H new ATOM 0 HE ARG A 45 -1.069 -10.683 4.906 1.00 0.00 H new ATOM 0 HH11 ARG A 45 0.065 -13.518 6.630 1.00 0.00 H new ATOM 0 HH12 ARG A 45 0.959 -14.162 5.249 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.086 -11.517 3.137 1.00 0.00 H new ATOM 0 HH22 ARG A 45 0.971 -13.038 3.288 1.00 0.00 H new ATOM 428 N LEU A 46 -5.374 -12.998 10.634 1.00 0.00 N ATOM 429 CA LEU A 46 -5.671 -13.307 12.025 1.00 0.00 C ATOM 430 C LEU A 46 -6.247 -14.718 12.150 1.00 0.00 C ATOM 431 O LEU A 46 -5.790 -15.521 12.962 1.00 0.00 O ATOM 432 CB LEU A 46 -6.684 -12.285 12.574 1.00 0.00 C ATOM 433 CG LEU A 46 -6.508 -12.142 14.091 1.00 0.00 C ATOM 434 CD1 LEU A 46 -7.472 -11.085 14.622 1.00 0.00 C ATOM 435 CD2 LEU A 46 -6.785 -13.488 14.777 1.00 0.00 C ATOM 0 H LEU A 46 -5.893 -12.208 10.250 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.747 -13.255 12.601 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.539 -11.319 12.089 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.700 -12.607 12.345 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.484 -11.836 14.306 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.345 -10.985 15.700 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.264 -10.129 14.142 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.497 -11.385 14.404 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.658 -13.380 15.854 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.806 -13.803 14.561 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.087 -14.237 14.403 1.00 0.00 H new ATOM 447 N PHE A 47 -7.245 -15.016 11.327 1.00 0.00 N ATOM 448 CA PHE A 47 -7.866 -16.335 11.348 1.00 0.00 C ATOM 449 C PHE A 47 -6.872 -17.402 10.922 1.00 0.00 C ATOM 450 O PHE A 47 -6.797 -18.466 11.534 1.00 0.00 O ATOM 451 CB PHE A 47 -9.079 -16.358 10.416 1.00 0.00 C ATOM 452 CG PHE A 47 -10.211 -15.575 11.039 1.00 0.00 C ATOM 453 CD1 PHE A 47 -10.285 -14.190 10.862 1.00 0.00 C ATOM 454 CD2 PHE A 47 -11.186 -16.238 11.795 1.00 0.00 C ATOM 455 CE1 PHE A 47 -11.332 -13.465 11.440 1.00 0.00 C ATOM 456 CE2 PHE A 47 -12.234 -15.513 12.373 1.00 0.00 C ATOM 457 CZ PHE A 47 -12.309 -14.128 12.195 1.00 0.00 C ATOM 0 H PHE A 47 -7.639 -14.370 10.643 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.190 -16.546 12.367 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.816 -15.929 9.449 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.391 -17.386 10.234 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.533 -13.680 10.278 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -11.129 -17.308 11.932 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -11.388 -12.395 11.305 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -12.986 -16.023 12.957 1.00 0.00 H new ATOM 0 HZ PHE A 47 -13.120 -13.569 12.639 1.00 0.00 H new ATOM 467 N PHE A 48 -6.113 -17.114 9.867 1.00 0.00 N ATOM 468 CA PHE A 48 -5.120 -18.064 9.360 1.00 0.00 C ATOM 469 C PHE A 48 -3.720 -17.476 9.469 1.00 0.00 C ATOM 470 O PHE A 48 -3.436 -16.416 8.916 1.00 0.00 O ATOM 471 CB PHE A 48 -5.426 -18.398 7.900 1.00 0.00 C ATOM 472 CG PHE A 48 -6.914 -18.616 7.731 1.00 0.00 C ATOM 473 CD1 PHE A 48 -7.594 -19.518 8.562 1.00 0.00 C ATOM 474 CD2 PHE A 48 -7.617 -17.914 6.743 1.00 0.00 C ATOM 475 CE1 PHE A 48 -8.967 -19.716 8.406 1.00 0.00 C ATOM 476 CE2 PHE A 48 -8.993 -18.113 6.588 1.00 0.00 C ATOM 477 CZ PHE A 48 -9.668 -19.015 7.418 1.00 0.00 C ATOM 0 H PHE A 48 -6.164 -16.237 9.348 1.00 0.00 H new ATOM 0 HA PHE A 48 -5.166 -18.974 9.959 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -5.091 -17.587 7.253 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -4.881 -19.292 7.599 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.054 -20.061 9.324 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.096 -17.219 6.101 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -9.489 -20.410 9.048 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -9.535 -17.570 5.827 1.00 0.00 H new ATOM 0 HZ PHE A 48 -10.730 -19.170 7.296 1.00 0.00 H new ATOM 487 N LYS A 49 -2.847 -18.178 10.184 1.00 0.00 N ATOM 488 CA LYS A 49 -1.473 -17.720 10.358 1.00 0.00 C ATOM 489 C LYS A 49 -0.613 -18.152 9.173 1.00 0.00 C ATOM 490 O LYS A 49 -0.877 -19.212 8.629 1.00 0.00 O ATOM 491 CB LYS A 49 -0.891 -18.296 11.649 1.00 0.00 C ATOM 492 CG LYS A 49 -1.627 -17.699 12.850 1.00 0.00 C ATOM 493 CD LYS A 49 -1.056 -18.284 14.143 1.00 0.00 C ATOM 494 CE LYS A 49 -1.840 -17.743 15.340 1.00 0.00 C ATOM 495 NZ LYS A 49 -1.607 -16.276 15.463 1.00 0.00 N ATOM 496 OXT LYS A 49 0.297 -17.416 8.830 1.00 0.00 O ATOM 0 H LYS A 49 -3.064 -19.060 10.649 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.475 -16.631 10.415 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.988 -19.382 11.652 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.174 -18.071 11.713 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.521 -16.614 12.852 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.693 -17.915 12.781 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.114 -19.372 14.119 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.002 -18.023 14.238 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.904 -17.944 15.213 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.527 -18.250 16.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.889 -15.958 16.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.598 -16.071 15.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.171 -15.774 14.748 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 0.461 27.263 -7.315 1.00 0.00 N ATOM 512 CA SER B 19 1.501 26.314 -7.801 1.00 0.00 C ATOM 513 C SER B 19 0.936 24.900 -7.787 1.00 0.00 C ATOM 514 O SER B 19 0.717 24.320 -6.724 1.00 0.00 O ATOM 515 CB SER B 19 2.726 26.395 -6.892 1.00 0.00 C ATOM 516 OG SER B 19 2.310 26.319 -5.536 1.00 0.00 O ATOM 0 HA SER B 19 1.793 26.575 -8.818 1.00 0.00 H new ATOM 0 HB2 SER B 19 3.416 25.582 -7.119 1.00 0.00 H new ATOM 0 HB3 SER B 19 3.263 27.327 -7.068 1.00 0.00 H new ATOM 0 HG SER B 19 1.614 25.635 -5.445 1.00 0.00 H new ATOM 524 N ASN B 20 0.697 24.348 -8.974 1.00 0.00 N ATOM 525 CA ASN B 20 0.149 22.999 -9.086 1.00 0.00 C ATOM 526 C ASN B 20 1.271 21.974 -9.210 1.00 0.00 C ATOM 527 O ASN B 20 1.019 20.782 -9.386 1.00 0.00 O ATOM 528 CB ASN B 20 -0.761 22.908 -10.312 1.00 0.00 C ATOM 529 CG ASN B 20 -2.014 23.751 -10.093 1.00 0.00 C ATOM 530 OD1 ASN B 20 -2.436 23.954 -8.956 1.00 0.00 O ATOM 531 ND2 ASN B 20 -2.634 24.261 -11.122 1.00 0.00 N ATOM 0 H ASN B 20 0.873 24.810 -9.866 1.00 0.00 H new ATOM 0 HA ASN B 20 -0.427 22.785 -8.186 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -0.229 23.256 -11.197 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -1.038 21.870 -10.494 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -3.470 24.829 -10.984 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -2.283 24.092 -12.064 1.00 0.00 H new ATOM 538 N ASP B 21 2.510 22.443 -9.106 1.00 0.00 N ATOM 539 CA ASP B 21 3.663 21.555 -9.202 1.00 0.00 C ATOM 540 C ASP B 21 3.795 20.712 -7.936 1.00 0.00 C ATOM 541 O ASP B 21 4.597 19.782 -7.879 1.00 0.00 O ATOM 542 CB ASP B 21 4.939 22.375 -9.405 1.00 0.00 C ATOM 543 CG ASP B 21 4.953 22.981 -10.805 1.00 0.00 C ATOM 544 OD1 ASP B 21 4.178 22.527 -11.631 1.00 0.00 O ATOM 545 OD2 ASP B 21 5.735 23.888 -11.029 1.00 0.00 O ATOM 0 H ASP B 21 2.741 23.425 -8.956 1.00 0.00 H new ATOM 0 HA ASP B 21 3.518 20.892 -10.055 1.00 0.00 H new ATOM 0 HB2 ASP B 21 4.996 23.166 -8.657 1.00 0.00 H new ATOM 0 HB3 ASP B 21 5.815 21.741 -9.266 1.00 0.00 H new ATOM 550 N SER B 22 3.001 21.047 -6.923 1.00 0.00 N ATOM 551 CA SER B 22 3.040 20.315 -5.664 1.00 0.00 C ATOM 552 C SER B 22 2.656 18.855 -5.881 1.00 0.00 C ATOM 553 O SER B 22 3.203 17.959 -5.242 1.00 0.00 O ATOM 554 CB SER B 22 2.078 20.950 -4.660 1.00 0.00 C ATOM 555 OG SER B 22 0.756 20.909 -5.182 1.00 0.00 O ATOM 0 H SER B 22 2.329 21.814 -6.949 1.00 0.00 H new ATOM 0 HA SER B 22 4.056 20.359 -5.273 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.122 20.417 -3.710 1.00 0.00 H new ATOM 0 HB3 SER B 22 2.371 21.981 -4.461 1.00 0.00 H new ATOM 0 HG SER B 22 0.138 21.314 -4.539 1.00 0.00 H new ATOM 561 N SER B 23 1.708 18.623 -6.787 1.00 0.00 N ATOM 562 CA SER B 23 1.258 17.266 -7.081 1.00 0.00 C ATOM 563 C SER B 23 2.050 16.680 -8.239 1.00 0.00 C ATOM 564 O SER B 23 1.722 16.899 -9.408 1.00 0.00 O ATOM 565 CB SER B 23 -0.229 17.280 -7.434 1.00 0.00 C ATOM 566 OG SER B 23 -0.734 15.952 -7.378 1.00 0.00 O ATOM 0 H SER B 23 1.240 19.352 -7.326 1.00 0.00 H new ATOM 0 HA SER B 23 1.418 16.648 -6.198 1.00 0.00 H new ATOM 0 HB2 SER B 23 -0.774 17.919 -6.739 1.00 0.00 H new ATOM 0 HB3 SER B 23 -0.375 17.696 -8.431 1.00 0.00 H new ATOM 0 HG SER B 23 -1.688 15.955 -7.602 1.00 0.00 H new ATOM 572 N ASP B 24 3.104 15.940 -7.908 1.00 0.00 N ATOM 573 CA ASP B 24 3.942 15.335 -8.927 1.00 0.00 C ATOM 574 C ASP B 24 3.261 14.098 -9.526 1.00 0.00 C ATOM 575 O ASP B 24 2.473 13.431 -8.855 1.00 0.00 O ATOM 576 CB ASP B 24 5.300 14.934 -8.333 1.00 0.00 C ATOM 577 CG ASP B 24 6.198 16.161 -8.218 1.00 0.00 C ATOM 578 OD1 ASP B 24 6.720 16.587 -9.236 1.00 0.00 O ATOM 579 OD2 ASP B 24 6.343 16.661 -7.117 1.00 0.00 O ATOM 0 H ASP B 24 3.393 15.748 -6.949 1.00 0.00 H new ATOM 0 HA ASP B 24 4.097 16.071 -9.716 1.00 0.00 H new ATOM 0 HB2 ASP B 24 5.158 14.483 -7.351 1.00 0.00 H new ATOM 0 HB3 ASP B 24 5.775 14.182 -8.964 1.00 0.00 H new ATOM 584 N PRO B 25 3.561 13.780 -10.759 1.00 0.00 N ATOM 585 CA PRO B 25 2.979 12.591 -11.447 1.00 0.00 C ATOM 586 C PRO B 25 3.016 11.342 -10.564 1.00 0.00 C ATOM 587 O PRO B 25 2.082 10.541 -10.566 1.00 0.00 O ATOM 588 CB PRO B 25 3.879 12.413 -12.678 1.00 0.00 C ATOM 589 CG PRO B 25 4.435 13.772 -12.968 1.00 0.00 C ATOM 590 CD PRO B 25 4.480 14.524 -11.640 1.00 0.00 C ATOM 0 HA PRO B 25 1.927 12.733 -11.696 1.00 0.00 H new ATOM 0 HB2 PRO B 25 4.677 11.697 -12.480 1.00 0.00 H new ATOM 0 HB3 PRO B 25 3.312 12.032 -13.527 1.00 0.00 H new ATOM 0 HG2 PRO B 25 5.431 13.697 -13.403 1.00 0.00 H new ATOM 0 HG3 PRO B 25 3.811 14.299 -13.690 1.00 0.00 H new ATOM 0 HD2 PRO B 25 5.490 14.546 -11.231 1.00 0.00 H new ATOM 0 HD3 PRO B 25 4.162 15.560 -11.760 1.00 0.00 H new ATOM 598 N LEU B 26 4.101 11.182 -9.819 1.00 0.00 N ATOM 599 CA LEU B 26 4.246 10.026 -8.942 1.00 0.00 C ATOM 600 C LEU B 26 3.192 10.056 -7.841 1.00 0.00 C ATOM 601 O LEU B 26 2.640 9.021 -7.471 1.00 0.00 O ATOM 602 CB LEU B 26 5.649 10.015 -8.318 1.00 0.00 C ATOM 603 CG LEU B 26 6.652 9.446 -9.323 1.00 0.00 C ATOM 604 CD1 LEU B 26 6.654 10.309 -10.586 1.00 0.00 C ATOM 605 CD2 LEU B 26 8.049 9.446 -8.701 1.00 0.00 C ATOM 0 H LEU B 26 4.888 11.831 -9.803 1.00 0.00 H new ATOM 0 HA LEU B 26 4.108 9.121 -9.534 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.939 11.026 -8.032 1.00 0.00 H new ATOM 0 HB3 LEU B 26 5.649 9.414 -7.409 1.00 0.00 H new ATOM 0 HG LEU B 26 6.370 8.426 -9.583 1.00 0.00 H new ATOM 0 HD11 LEU B 26 7.369 9.904 -11.302 1.00 0.00 H new ATOM 0 HD12 LEU B 26 5.658 10.309 -11.028 1.00 0.00 H new ATOM 0 HD13 LEU B 26 6.937 11.330 -10.329 1.00 0.00 H new ATOM 0 HD21 LEU B 26 8.765 9.041 -9.416 1.00 0.00 H new ATOM 0 HD22 LEU B 26 8.332 10.466 -8.442 1.00 0.00 H new ATOM 0 HD23 LEU B 26 8.047 8.831 -7.801 1.00 0.00 H new ATOM 617 N VAL B 27 2.938 11.246 -7.300 1.00 0.00 N ATOM 618 CA VAL B 27 1.968 11.383 -6.221 1.00 0.00 C ATOM 619 C VAL B 27 0.579 10.949 -6.683 1.00 0.00 C ATOM 620 O VAL B 27 -0.073 10.124 -6.041 1.00 0.00 O ATOM 621 CB VAL B 27 1.917 12.844 -5.757 1.00 0.00 C ATOM 622 CG1 VAL B 27 0.771 13.029 -4.761 1.00 0.00 C ATOM 623 CG2 VAL B 27 3.244 13.212 -5.085 1.00 0.00 C ATOM 0 H VAL B 27 3.385 12.117 -7.588 1.00 0.00 H new ATOM 0 HA VAL B 27 2.277 10.742 -5.395 1.00 0.00 H new ATOM 0 HB VAL B 27 1.753 13.491 -6.618 1.00 0.00 H new ATOM 0 HG11 VAL B 27 0.738 14.068 -4.433 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.173 12.769 -5.240 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.930 12.382 -3.899 1.00 0.00 H new ATOM 0 HG21 VAL B 27 3.209 14.250 -4.755 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.409 12.563 -4.225 1.00 0.00 H new ATOM 0 HG23 VAL B 27 4.060 13.085 -5.797 1.00 0.00 H new ATOM 633 N VAL B 28 0.139 11.501 -7.804 1.00 0.00 N ATOM 634 CA VAL B 28 -1.169 11.162 -8.350 1.00 0.00 C ATOM 635 C VAL B 28 -1.206 9.699 -8.779 1.00 0.00 C ATOM 636 O VAL B 28 -2.199 9.004 -8.568 1.00 0.00 O ATOM 637 CB VAL B 28 -1.492 12.060 -9.546 1.00 0.00 C ATOM 638 CG1 VAL B 28 -1.691 13.498 -9.066 1.00 0.00 C ATOM 639 CG2 VAL B 28 -0.335 12.012 -10.544 1.00 0.00 C ATOM 0 H VAL B 28 0.664 12.182 -8.352 1.00 0.00 H new ATOM 0 HA VAL B 28 -1.917 11.320 -7.573 1.00 0.00 H new ATOM 0 HB VAL B 28 -2.404 11.709 -10.028 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -1.921 14.137 -9.918 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.515 13.533 -8.353 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -0.779 13.850 -8.584 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -0.563 12.651 -11.397 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.577 12.363 -10.061 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -0.192 10.987 -10.887 1.00 0.00 H new ATOM 649 N ALA B 29 -0.117 9.241 -9.384 1.00 0.00 N ATOM 650 CA ALA B 29 -0.032 7.859 -9.840 1.00 0.00 C ATOM 651 C ALA B 29 -0.063 6.902 -8.654 1.00 0.00 C ATOM 652 O ALA B 29 -0.667 5.833 -8.723 1.00 0.00 O ATOM 653 CB ALA B 29 1.261 7.647 -10.634 1.00 0.00 C ATOM 0 H ALA B 29 0.715 9.802 -9.569 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.889 7.655 -10.482 1.00 0.00 H new ATOM 0 HB1 ALA B 29 1.316 6.612 -10.971 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.270 8.311 -11.499 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.119 7.868 -9.998 1.00 0.00 H new ATOM 659 N ALA B 30 0.592 7.292 -7.566 1.00 0.00 N ATOM 660 CA ALA B 30 0.634 6.457 -6.371 1.00 0.00 C ATOM 661 C ALA B 30 -0.777 6.167 -5.874 1.00 0.00 C ATOM 662 O ALA B 30 -1.100 5.029 -5.528 1.00 0.00 O ATOM 663 CB ALA B 30 1.430 7.161 -5.271 1.00 0.00 C ATOM 0 H ALA B 30 1.098 8.174 -7.486 1.00 0.00 H new ATOM 0 HA ALA B 30 1.120 5.515 -6.624 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.457 6.531 -4.382 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.447 7.343 -5.618 1.00 0.00 H new ATOM 0 HB3 ALA B 30 0.954 8.111 -5.029 1.00 0.00 H new ATOM 669 N ASN B 31 -1.612 7.200 -5.836 1.00 0.00 N ATOM 670 CA ASN B 31 -2.987 7.037 -5.374 1.00 0.00 C ATOM 671 C ASN B 31 -3.756 6.102 -6.303 1.00 0.00 C ATOM 672 O ASN B 31 -4.498 5.231 -5.845 1.00 0.00 O ATOM 673 CB ASN B 31 -3.683 8.401 -5.329 1.00 0.00 C ATOM 674 CG ASN B 31 -3.180 9.201 -4.133 1.00 0.00 C ATOM 675 OD1 ASN B 31 -2.577 8.640 -3.218 1.00 0.00 O ATOM 676 ND2 ASN B 31 -3.393 10.488 -4.085 1.00 0.00 N ATOM 0 H ASN B 31 -1.365 8.149 -6.116 1.00 0.00 H new ATOM 0 HA ASN B 31 -2.969 6.603 -4.374 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.489 8.949 -6.251 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -4.762 8.266 -5.259 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -3.060 11.031 -3.288 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -3.893 10.951 -4.844 1.00 0.00 H new ATOM 683 N ILE B 32 -3.574 6.286 -7.606 1.00 0.00 N ATOM 684 CA ILE B 32 -4.255 5.449 -8.587 1.00 0.00 C ATOM 685 C ILE B 32 -3.777 4.004 -8.483 1.00 0.00 C ATOM 686 O ILE B 32 -4.578 3.070 -8.520 1.00 0.00 O ATOM 687 CB ILE B 32 -3.988 5.978 -10.000 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.672 7.337 -10.169 1.00 0.00 C ATOM 689 CG2 ILE B 32 -4.548 4.994 -11.031 1.00 0.00 C ATOM 690 CD1 ILE B 32 -4.167 8.005 -11.449 1.00 0.00 C ATOM 0 H ILE B 32 -2.966 7.001 -8.005 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.325 5.480 -8.384 1.00 0.00 H new ATOM 0 HB ILE B 32 -2.914 6.087 -10.151 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.753 7.209 -10.215 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -4.463 7.971 -9.308 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -4.357 5.372 -12.036 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -4.064 4.025 -10.910 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -5.622 4.884 -10.883 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.653 8.973 -11.571 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -3.088 8.147 -11.384 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.399 7.372 -12.306 1.00 0.00 H new ATOM 702 N ILE B 33 -2.468 3.829 -8.356 1.00 0.00 N ATOM 703 CA ILE B 33 -1.893 2.494 -8.250 1.00 0.00 C ATOM 704 C ILE B 33 -2.384 1.799 -6.984 1.00 0.00 C ATOM 705 O ILE B 33 -2.728 0.618 -7.007 1.00 0.00 O ATOM 706 CB ILE B 33 -0.364 2.582 -8.236 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.135 3.030 -9.613 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.228 1.210 -7.905 1.00 0.00 C ATOM 709 CD1 ILE B 33 1.602 3.449 -9.511 1.00 0.00 C ATOM 0 H ILE B 33 -1.788 4.589 -8.324 1.00 0.00 H new ATOM 0 HA ILE B 33 -2.211 1.910 -9.114 1.00 0.00 H new ATOM 0 HB ILE B 33 -0.052 3.304 -7.481 1.00 0.00 H new ATOM 0 HG12 ILE B 33 0.026 2.219 -10.333 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -0.468 3.862 -9.977 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.316 1.276 -7.896 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -0.124 0.889 -6.925 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -0.085 0.487 -8.658 1.00 0.00 H new ATOM 0 HD11 ILE B 33 1.958 3.768 -10.491 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.697 4.273 -8.804 1.00 0.00 H new ATOM 0 HD13 ILE B 33 2.198 2.605 -9.165 1.00 0.00 H new ATOM 721 N GLY B 34 -2.401 2.537 -5.881 1.00 0.00 N ATOM 722 CA GLY B 34 -2.840 1.977 -4.610 1.00 0.00 C ATOM 723 C GLY B 34 -4.272 1.460 -4.708 1.00 0.00 C ATOM 724 O GLY B 34 -4.572 0.345 -4.278 1.00 0.00 O ATOM 0 H GLY B 34 -2.118 3.516 -5.841 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -2.175 1.164 -4.317 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.776 2.737 -3.832 1.00 0.00 H new ATOM 728 N ILE B 35 -5.147 2.271 -5.287 1.00 0.00 N ATOM 729 CA ILE B 35 -6.543 1.883 -5.448 1.00 0.00 C ATOM 730 C ILE B 35 -6.656 0.673 -6.373 1.00 0.00 C ATOM 731 O ILE B 35 -7.431 -0.249 -6.116 1.00 0.00 O ATOM 732 CB ILE B 35 -7.349 3.051 -6.021 1.00 0.00 C ATOM 733 CG1 ILE B 35 -7.419 4.177 -4.984 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.770 2.581 -6.354 1.00 0.00 C ATOM 735 CD1 ILE B 35 -7.965 5.447 -5.642 1.00 0.00 C ATOM 0 H ILE B 35 -4.918 3.196 -5.651 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.944 1.616 -4.470 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.865 3.415 -6.927 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -8.060 3.881 -4.154 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -6.428 4.366 -4.570 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.343 3.414 -6.762 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.725 1.777 -7.089 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -9.254 2.217 -5.448 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -8.014 6.247 -4.903 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -7.307 5.746 -6.458 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -8.963 5.253 -6.034 1.00 0.00 H new ATOM 747 N LEU B 36 -5.892 0.694 -7.458 1.00 0.00 N ATOM 748 CA LEU B 36 -5.932 -0.396 -8.422 1.00 0.00 C ATOM 749 C LEU B 36 -5.523 -1.709 -7.752 1.00 0.00 C ATOM 750 O LEU B 36 -6.110 -2.759 -8.005 1.00 0.00 O ATOM 751 CB LEU B 36 -4.979 -0.089 -9.593 1.00 0.00 C ATOM 752 CG LEU B 36 -5.532 -0.705 -10.884 1.00 0.00 C ATOM 753 CD1 LEU B 36 -4.585 -0.400 -12.040 1.00 0.00 C ATOM 754 CD2 LEU B 36 -5.674 -2.224 -10.715 1.00 0.00 C ATOM 0 H LEU B 36 -5.244 1.446 -7.690 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.949 -0.496 -8.801 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.868 0.989 -9.711 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.988 -0.490 -9.383 1.00 0.00 H new ATOM 0 HG LEU B 36 -6.512 -0.277 -11.098 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -4.978 -0.838 -12.958 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -4.496 0.679 -12.162 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -3.603 -0.823 -11.828 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -6.067 -2.657 -11.635 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.698 -2.659 -10.497 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -6.357 -2.436 -9.893 1.00 0.00 H new ATOM 766 N HIS B 37 -4.508 -1.638 -6.900 1.00 0.00 N ATOM 767 CA HIS B 37 -4.027 -2.826 -6.206 1.00 0.00 C ATOM 768 C HIS B 37 -5.145 -3.446 -5.378 1.00 0.00 C ATOM 769 O HIS B 37 -5.303 -4.667 -5.347 1.00 0.00 O ATOM 770 CB HIS B 37 -2.859 -2.461 -5.291 1.00 0.00 C ATOM 771 CG HIS B 37 -2.346 -3.700 -4.611 1.00 0.00 C ATOM 772 ND1 HIS B 37 -1.050 -4.152 -4.774 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.946 -4.598 -3.764 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.914 -5.271 -4.045 1.00 0.00 C ATOM 775 NE2 HIS B 37 -2.039 -5.587 -3.408 1.00 0.00 N ATOM 0 H HIS B 37 -4.006 -0.779 -6.674 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.692 -3.549 -6.950 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -2.062 -1.995 -5.870 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.180 -1.732 -4.547 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.970 -4.543 -3.425 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -0.002 -5.846 -3.983 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.200 -6.384 -2.792 1.00 0.00 H new ATOM 783 N LEU B 38 -5.914 -2.604 -4.704 1.00 0.00 N ATOM 784 CA LEU B 38 -7.007 -3.089 -3.875 1.00 0.00 C ATOM 785 C LEU B 38 -8.019 -3.856 -4.702 1.00 0.00 C ATOM 786 O LEU B 38 -8.553 -4.857 -4.244 1.00 0.00 O ATOM 787 CB LEU B 38 -7.701 -1.902 -3.177 1.00 0.00 C ATOM 788 CG LEU B 38 -7.072 -1.664 -1.793 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.322 -0.229 -1.348 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.703 -2.628 -0.773 1.00 0.00 C ATOM 0 H LEU B 38 -5.803 -1.590 -4.714 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.593 -3.764 -3.126 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.606 -1.004 -3.788 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.767 -2.104 -3.071 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.998 -1.840 -1.854 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.874 -0.069 -0.367 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.876 0.458 -2.067 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.395 -0.048 -1.290 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.259 -2.461 0.208 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.777 -2.450 -0.720 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.521 -3.657 -1.084 1.00 0.00 H new ATOM 802 N ILE B 39 -8.298 -3.364 -5.898 1.00 0.00 N ATOM 803 CA ILE B 39 -9.277 -4.009 -6.760 1.00 0.00 C ATOM 804 C ILE B 39 -8.835 -5.428 -7.099 1.00 0.00 C ATOM 805 O ILE B 39 -9.630 -6.360 -7.062 1.00 0.00 O ATOM 806 CB ILE B 39 -9.431 -3.201 -8.054 1.00 0.00 C ATOM 807 CG1 ILE B 39 -10.073 -1.847 -7.735 1.00 0.00 C ATOM 808 CG2 ILE B 39 -10.324 -3.967 -9.036 1.00 0.00 C ATOM 809 CD1 ILE B 39 -10.044 -0.956 -8.982 1.00 0.00 C ATOM 0 H ILE B 39 -7.866 -2.528 -6.292 1.00 0.00 H new ATOM 0 HA ILE B 39 -10.231 -4.053 -6.235 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.450 -3.045 -8.502 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -11.101 -1.990 -7.402 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -9.538 -1.363 -6.918 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -10.432 -3.391 -9.955 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -9.871 -4.932 -9.264 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -11.306 -4.124 -8.589 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -10.501 0.006 -8.752 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -9.011 -0.802 -9.295 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.599 -1.438 -9.787 1.00 0.00 H new ATOM 821 N LEU B 40 -7.565 -5.585 -7.440 1.00 0.00 N ATOM 822 CA LEU B 40 -7.036 -6.899 -7.784 1.00 0.00 C ATOM 823 C LEU B 40 -6.854 -7.756 -6.539 1.00 0.00 C ATOM 824 O LEU B 40 -7.170 -8.946 -6.539 1.00 0.00 O ATOM 825 CB LEU B 40 -5.694 -6.747 -8.502 1.00 0.00 C ATOM 826 CG LEU B 40 -5.916 -6.078 -9.865 1.00 0.00 C ATOM 827 CD1 LEU B 40 -4.563 -5.702 -10.475 1.00 0.00 C ATOM 828 CD2 LEU B 40 -6.662 -7.039 -10.812 1.00 0.00 C ATOM 0 H LEU B 40 -6.885 -4.826 -7.486 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.751 -7.393 -8.443 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -5.012 -6.149 -7.898 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.228 -7.723 -8.636 1.00 0.00 H new ATOM 0 HG LEU B 40 -6.517 -5.179 -9.728 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -4.720 -5.227 -11.443 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.044 -5.010 -9.811 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.960 -6.601 -10.605 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.814 -6.554 -11.776 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.072 -7.945 -10.950 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.628 -7.299 -10.380 1.00 0.00 H new ATOM 840 N TRP B 41 -6.323 -7.145 -5.486 1.00 0.00 N ATOM 841 CA TRP B 41 -6.081 -7.866 -4.244 1.00 0.00 C ATOM 842 C TRP B 41 -7.392 -8.309 -3.605 1.00 0.00 C ATOM 843 O TRP B 41 -7.532 -9.456 -3.172 1.00 0.00 O ATOM 844 CB TRP B 41 -5.292 -6.983 -3.273 1.00 0.00 C ATOM 845 CG TRP B 41 -5.248 -7.639 -1.928 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.367 -8.600 -1.564 1.00 0.00 C ATOM 847 CD2 TRP B 41 -6.081 -7.382 -0.764 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.628 -8.966 -0.254 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.667 -8.235 0.283 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.146 -6.499 -0.514 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.293 -8.216 1.527 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.772 -6.475 0.742 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.345 -7.331 1.758 1.00 0.00 C ATOM 0 H TRP B 41 -6.054 -6.161 -5.468 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.498 -8.758 -4.473 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.280 -6.826 -3.647 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.759 -6.001 -3.196 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.590 -9.013 -2.191 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -4.115 -9.688 0.252 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.485 -5.834 -1.294 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.965 -8.884 2.309 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.588 -5.791 0.923 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.829 -7.308 2.723 1.00 0.00 H new ATOM 864 N ILE B 42 -8.340 -7.387 -3.527 1.00 0.00 N ATOM 865 CA ILE B 42 -9.626 -7.684 -2.919 1.00 0.00 C ATOM 866 C ILE B 42 -10.402 -8.683 -3.772 1.00 0.00 C ATOM 867 O ILE B 42 -11.090 -9.561 -3.251 1.00 0.00 O ATOM 868 CB ILE B 42 -10.440 -6.393 -2.758 1.00 0.00 C ATOM 869 CG1 ILE B 42 -11.579 -6.626 -1.761 1.00 0.00 C ATOM 870 CG2 ILE B 42 -11.030 -5.978 -4.115 1.00 0.00 C ATOM 871 CD1 ILE B 42 -12.303 -5.307 -1.497 1.00 0.00 C ATOM 0 H ILE B 42 -8.243 -6.433 -3.875 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.453 -8.124 -1.937 1.00 0.00 H new ATOM 0 HB ILE B 42 -9.787 -5.602 -2.390 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -12.277 -7.364 -2.156 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -11.184 -7.029 -0.829 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -11.607 -5.061 -3.996 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -10.222 -5.808 -4.826 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -11.680 -6.770 -4.487 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -13.114 -5.473 -0.787 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -11.601 -4.583 -1.083 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -12.712 -4.923 -2.432 1.00 0.00 H new ATOM 883 N LEU B 43 -10.296 -8.528 -5.086 1.00 0.00 N ATOM 884 CA LEU B 43 -10.997 -9.408 -6.003 1.00 0.00 C ATOM 885 C LEU B 43 -10.508 -10.841 -5.849 1.00 0.00 C ATOM 886 O LEU B 43 -11.298 -11.785 -5.869 1.00 0.00 O ATOM 887 CB LEU B 43 -10.783 -8.938 -7.442 1.00 0.00 C ATOM 888 CG LEU B 43 -11.435 -9.947 -8.422 1.00 0.00 C ATOM 889 CD1 LEU B 43 -12.188 -9.190 -9.517 1.00 0.00 C ATOM 890 CD2 LEU B 43 -10.346 -10.819 -9.061 1.00 0.00 C ATOM 0 H LEU B 43 -9.734 -7.805 -5.535 1.00 0.00 H new ATOM 0 HA LEU B 43 -12.061 -9.377 -5.768 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -11.218 -7.948 -7.580 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -9.717 -8.849 -7.651 1.00 0.00 H new ATOM 0 HG LEU B 43 -12.134 -10.579 -7.874 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -12.645 -9.903 -10.204 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -12.965 -8.573 -9.065 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -11.492 -8.554 -10.064 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -10.805 -11.528 -9.750 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -9.646 -10.186 -9.606 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.812 -11.364 -8.282 1.00 0.00 H new ATOM 902 N ASP B 44 -9.194 -10.999 -5.704 1.00 0.00 N ATOM 903 CA ASP B 44 -8.606 -12.326 -5.556 1.00 0.00 C ATOM 904 C ASP B 44 -9.179 -13.030 -4.332 1.00 0.00 C ATOM 905 O ASP B 44 -9.534 -14.207 -4.392 1.00 0.00 O ATOM 906 CB ASP B 44 -7.089 -12.207 -5.414 1.00 0.00 C ATOM 907 CG ASP B 44 -6.480 -13.584 -5.169 1.00 0.00 C ATOM 908 OD1 ASP B 44 -6.291 -14.306 -6.133 1.00 0.00 O ATOM 909 OD2 ASP B 44 -6.214 -13.895 -4.020 1.00 0.00 O ATOM 0 H ASP B 44 -8.522 -10.231 -5.686 1.00 0.00 H new ATOM 0 HA ASP B 44 -8.844 -12.913 -6.443 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -6.664 -11.767 -6.316 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.844 -11.539 -4.588 1.00 0.00 H new ATOM 914 N ARG B 45 -9.273 -12.301 -3.225 1.00 0.00 N ATOM 915 CA ARG B 45 -9.813 -12.868 -1.995 1.00 0.00 C ATOM 916 C ARG B 45 -11.298 -13.173 -2.150 1.00 0.00 C ATOM 917 O ARG B 45 -11.862 -13.964 -1.394 1.00 0.00 O ATOM 918 CB ARG B 45 -9.601 -11.895 -0.831 1.00 0.00 C ATOM 919 CG ARG B 45 -8.127 -11.894 -0.428 1.00 0.00 C ATOM 920 CD ARG B 45 -7.908 -10.895 0.708 1.00 0.00 C ATOM 921 NE ARG B 45 -6.506 -10.894 1.114 1.00 0.00 N ATOM 922 CZ ARG B 45 -6.047 -11.765 2.005 1.00 0.00 C ATOM 923 NH1 ARG B 45 -6.853 -12.645 2.532 1.00 0.00 N ATOM 924 NH2 ARG B 45 -4.789 -11.741 2.354 1.00 0.00 N ATOM 0 H ARG B 45 -8.985 -11.325 -3.154 1.00 0.00 H new ATOM 0 HA ARG B 45 -9.287 -13.799 -1.785 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -9.910 -10.891 -1.122 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -10.221 -12.186 0.017 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -7.825 -12.892 -0.111 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -7.506 -11.630 -1.284 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -8.202 -9.896 0.385 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -8.540 -11.154 1.557 1.00 0.00 H new ATOM 0 HE ARG B 45 -5.867 -10.212 0.706 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -7.836 -12.664 2.260 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -6.500 -13.314 3.216 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -4.159 -11.053 1.942 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -4.437 -12.410 3.038 1.00 0.00 H new ATOM 938 N LEU B 46 -11.933 -12.528 -3.123 1.00 0.00 N ATOM 939 CA LEU B 46 -13.356 -12.734 -3.347 1.00 0.00 C ATOM 940 C LEU B 46 -13.636 -14.193 -3.702 1.00 0.00 C ATOM 941 O LEU B 46 -14.510 -14.833 -3.115 1.00 0.00 O ATOM 942 CB LEU B 46 -13.831 -11.824 -4.498 1.00 0.00 C ATOM 943 CG LEU B 46 -15.316 -11.494 -4.318 1.00 0.00 C ATOM 944 CD1 LEU B 46 -15.765 -10.537 -5.418 1.00 0.00 C ATOM 945 CD2 LEU B 46 -16.146 -12.785 -4.379 1.00 0.00 C ATOM 0 H LEU B 46 -11.490 -11.867 -3.761 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.895 -12.486 -2.433 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.244 -10.906 -4.514 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -13.673 -12.320 -5.455 1.00 0.00 H new ATOM 0 HG LEU B 46 -15.465 -11.020 -3.348 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -16.822 -10.304 -5.288 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -15.181 -9.618 -5.362 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.614 -11.004 -6.391 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -17.202 -12.545 -4.250 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -15.998 -13.267 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -15.828 -13.460 -3.584 1.00 0.00 H new ATOM 957 N PHE B 47 -12.879 -14.720 -4.657 1.00 0.00 N ATOM 958 CA PHE B 47 -13.050 -16.106 -5.074 1.00 0.00 C ATOM 959 C PHE B 47 -12.701 -17.052 -3.939 1.00 0.00 C ATOM 960 O PHE B 47 -13.408 -18.032 -3.699 1.00 0.00 O ATOM 961 CB PHE B 47 -12.163 -16.404 -6.286 1.00 0.00 C ATOM 962 CG PHE B 47 -12.741 -15.734 -7.509 1.00 0.00 C ATOM 963 CD1 PHE B 47 -12.430 -14.400 -7.790 1.00 0.00 C ATOM 964 CD2 PHE B 47 -13.588 -16.451 -8.364 1.00 0.00 C ATOM 965 CE1 PHE B 47 -12.968 -13.782 -8.927 1.00 0.00 C ATOM 966 CE2 PHE B 47 -14.125 -15.834 -9.499 1.00 0.00 C ATOM 967 CZ PHE B 47 -13.814 -14.499 -9.780 1.00 0.00 C ATOM 0 H PHE B 47 -12.146 -14.213 -5.154 1.00 0.00 H new ATOM 0 HA PHE B 47 -14.095 -16.256 -5.347 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -11.150 -16.045 -6.106 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -12.096 -17.480 -6.445 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -11.776 -13.847 -7.132 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -13.827 -17.482 -8.147 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -12.729 -12.751 -9.145 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -14.779 -16.387 -10.157 1.00 0.00 H new ATOM 0 HZ PHE B 47 -14.227 -14.022 -10.656 1.00 0.00 H new ATOM 977 N PHE B 48 -11.602 -16.761 -3.243 1.00 0.00 N ATOM 978 CA PHE B 48 -11.163 -17.601 -2.126 1.00 0.00 C ATOM 979 C PHE B 48 -11.167 -16.805 -0.831 1.00 0.00 C ATOM 980 O PHE B 48 -10.502 -15.777 -0.718 1.00 0.00 O ATOM 981 CB PHE B 48 -9.752 -18.126 -2.402 1.00 0.00 C ATOM 982 CG PHE B 48 -9.653 -18.580 -3.844 1.00 0.00 C ATOM 983 CD1 PHE B 48 -10.596 -19.477 -4.368 1.00 0.00 C ATOM 984 CD2 PHE B 48 -8.620 -18.100 -4.658 1.00 0.00 C ATOM 985 CE1 PHE B 48 -10.502 -19.891 -5.698 1.00 0.00 C ATOM 986 CE2 PHE B 48 -8.528 -18.515 -5.992 1.00 0.00 C ATOM 987 CZ PHE B 48 -9.470 -19.411 -6.511 1.00 0.00 C ATOM 0 H PHE B 48 -11.003 -15.957 -3.430 1.00 0.00 H new ATOM 0 HA PHE B 48 -11.852 -18.440 -2.025 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -9.017 -17.345 -2.204 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -9.524 -18.955 -1.732 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -11.395 -19.847 -3.742 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -7.893 -17.409 -4.257 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -11.227 -20.583 -6.100 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -7.731 -18.144 -6.620 1.00 0.00 H new ATOM 0 HZ PHE B 48 -9.400 -19.732 -7.540 1.00 0.00 H new ATOM 997 N LYS B 49 -11.920 -17.293 0.151 1.00 0.00 N ATOM 998 CA LYS B 49 -12.004 -16.619 1.444 1.00 0.00 C ATOM 999 C LYS B 49 -10.844 -17.041 2.340 1.00 0.00 C ATOM 1000 O LYS B 49 -10.420 -18.180 2.231 1.00 0.00 O ATOM 1001 CB LYS B 49 -13.329 -16.965 2.126 1.00 0.00 C ATOM 1002 CG LYS B 49 -14.486 -16.366 1.321 1.00 0.00 C ATOM 1003 CD LYS B 49 -15.813 -16.724 1.993 1.00 0.00 C ATOM 1004 CE LYS B 49 -16.973 -16.177 1.158 1.00 0.00 C ATOM 1005 NZ LYS B 49 -16.939 -14.687 1.179 1.00 0.00 N ATOM 1006 OXT LYS B 49 -10.399 -16.218 3.123 1.00 0.00 O ATOM 0 H LYS B 49 -12.476 -18.145 0.078 1.00 0.00 H new ATOM 0 HA LYS B 49 -11.950 -15.543 1.279 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -13.443 -18.047 2.197 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -13.340 -16.576 3.144 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -14.378 -15.283 1.259 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -14.469 -16.747 0.300 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -15.902 -17.806 2.093 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -15.847 -16.307 2.999 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -16.900 -16.539 0.132 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -17.922 -16.536 1.555 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -17.859 -14.314 0.870 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -16.739 -14.358 2.145 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -16.195 -14.348 0.537 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 9.564 26.302 -3.782 1.00 0.00 N ATOM 1022 CA SER C 19 9.950 25.491 -2.590 1.00 0.00 C ATOM 1023 C SER C 19 9.808 24.011 -2.921 1.00 0.00 C ATOM 1024 O SER C 19 8.696 23.500 -3.055 1.00 0.00 O ATOM 1025 CB SER C 19 9.041 25.853 -1.416 1.00 0.00 C ATOM 1026 OG SER C 19 7.687 25.818 -1.842 1.00 0.00 O ATOM 0 HA SER C 19 10.985 25.700 -2.319 1.00 0.00 H new ATOM 0 HB2 SER C 19 9.194 25.154 -0.594 1.00 0.00 H new ATOM 0 HB3 SER C 19 9.291 26.845 -1.041 1.00 0.00 H new ATOM 0 HG SER C 19 7.533 25.011 -2.376 1.00 0.00 H new ATOM 1034 N ASN C 20 10.938 23.326 -3.058 1.00 0.00 N ATOM 1035 CA ASN C 20 10.929 21.900 -3.380 1.00 0.00 C ATOM 1036 C ASN C 20 10.959 21.064 -2.105 1.00 0.00 C ATOM 1037 O ASN C 20 11.030 19.837 -2.160 1.00 0.00 O ATOM 1038 CB ASN C 20 12.140 21.556 -4.246 1.00 0.00 C ATOM 1039 CG ASN C 20 12.002 22.205 -5.620 1.00 0.00 C ATOM 1040 OD1 ASN C 20 10.887 22.436 -6.089 1.00 0.00 O ATOM 1041 ND2 ASN C 20 13.075 22.518 -6.294 1.00 0.00 N ATOM 0 H ASN C 20 11.868 23.731 -2.952 1.00 0.00 H new ATOM 0 HA ASN C 20 10.014 21.674 -3.927 1.00 0.00 H new ATOM 0 HB2 ASN C 20 13.053 21.902 -3.762 1.00 0.00 H new ATOM 0 HB3 ASN C 20 12.225 20.475 -4.353 1.00 0.00 H new ATOM 0 HD21 ASN C 20 12.991 22.955 -7.212 1.00 0.00 H new ATOM 0 HD22 ASN C 20 13.997 22.325 -5.903 1.00 0.00 H new ATOM 1048 N ASP C 21 10.900 21.737 -0.959 1.00 0.00 N ATOM 1049 CA ASP C 21 10.916 21.042 0.322 1.00 0.00 C ATOM 1050 C ASP C 21 9.584 20.344 0.572 1.00 0.00 C ATOM 1051 O ASP C 21 9.445 19.573 1.522 1.00 0.00 O ATOM 1052 CB ASP C 21 11.193 22.039 1.452 1.00 0.00 C ATOM 1053 CG ASP C 21 12.644 22.503 1.393 1.00 0.00 C ATOM 1054 OD1 ASP C 21 13.427 21.856 0.719 1.00 0.00 O ATOM 1055 OD2 ASP C 21 12.951 23.500 2.025 1.00 0.00 O ATOM 0 H ASP C 21 10.841 22.753 -0.892 1.00 0.00 H new ATOM 0 HA ASP C 21 11.706 20.291 0.297 1.00 0.00 H new ATOM 0 HB2 ASP C 21 10.525 22.896 1.364 1.00 0.00 H new ATOM 0 HB3 ASP C 21 10.990 21.574 2.417 1.00 0.00 H new ATOM 1060 N SER C 22 8.607 20.622 -0.283 1.00 0.00 N ATOM 1061 CA SER C 22 7.288 20.015 -0.144 1.00 0.00 C ATOM 1062 C SER C 22 7.379 18.500 -0.285 1.00 0.00 C ATOM 1063 O SER C 22 6.663 17.762 0.392 1.00 0.00 O ATOM 1064 CB SER C 22 6.343 20.570 -1.208 1.00 0.00 C ATOM 1065 OG SER C 22 6.873 20.296 -2.498 1.00 0.00 O ATOM 0 H SER C 22 8.701 21.259 -1.074 1.00 0.00 H new ATOM 0 HA SER C 22 6.901 20.255 0.846 1.00 0.00 H new ATOM 0 HB2 SER C 22 5.356 20.119 -1.105 1.00 0.00 H new ATOM 0 HB3 SER C 22 6.218 21.645 -1.075 1.00 0.00 H new ATOM 0 HG SER C 22 6.267 20.650 -3.182 1.00 0.00 H new ATOM 1071 N SER C 23 8.261 18.040 -1.167 1.00 0.00 N ATOM 1072 CA SER C 23 8.436 16.607 -1.390 1.00 0.00 C ATOM 1073 C SER C 23 9.537 16.061 -0.494 1.00 0.00 C ATOM 1074 O SER C 23 10.720 16.111 -0.837 1.00 0.00 O ATOM 1075 CB SER C 23 8.793 16.348 -2.854 1.00 0.00 C ATOM 1076 OG SER C 23 8.631 14.964 -3.135 1.00 0.00 O ATOM 0 H SER C 23 8.863 18.634 -1.737 1.00 0.00 H new ATOM 0 HA SER C 23 7.501 16.102 -1.149 1.00 0.00 H new ATOM 0 HB2 SER C 23 8.154 16.942 -3.507 1.00 0.00 H new ATOM 0 HB3 SER C 23 9.821 16.654 -3.050 1.00 0.00 H new ATOM 0 HG SER C 23 8.857 14.792 -4.073 1.00 0.00 H new ATOM 1082 N ASP C 24 9.139 15.539 0.665 1.00 0.00 N ATOM 1083 CA ASP C 24 10.099 14.991 1.605 1.00 0.00 C ATOM 1084 C ASP C 24 10.589 13.616 1.139 1.00 0.00 C ATOM 1085 O ASP C 24 9.864 12.890 0.455 1.00 0.00 O ATOM 1086 CB ASP C 24 9.469 14.864 2.999 1.00 0.00 C ATOM 1087 CG ASP C 24 9.460 16.224 3.690 1.00 0.00 C ATOM 1088 OD1 ASP C 24 10.512 16.637 4.154 1.00 0.00 O ATOM 1089 OD2 ASP C 24 8.408 16.832 3.741 1.00 0.00 O ATOM 0 H ASP C 24 8.167 15.487 0.968 1.00 0.00 H new ATOM 0 HA ASP C 24 10.949 15.672 1.654 1.00 0.00 H new ATOM 0 HB2 ASP C 24 8.451 14.482 2.914 1.00 0.00 H new ATOM 0 HB3 ASP C 24 10.030 14.146 3.597 1.00 0.00 H new ATOM 1094 N PRO C 25 11.788 13.242 1.509 1.00 0.00 N ATOM 1095 CA PRO C 25 12.368 11.920 1.137 1.00 0.00 C ATOM 1096 C PRO C 25 11.379 10.774 1.360 1.00 0.00 C ATOM 1097 O PRO C 25 11.316 9.834 0.569 1.00 0.00 O ATOM 1098 CB PRO C 25 13.578 11.781 2.074 1.00 0.00 C ATOM 1099 CG PRO C 25 13.987 13.183 2.403 1.00 0.00 C ATOM 1100 CD PRO C 25 12.729 14.043 2.314 1.00 0.00 C ATOM 0 HA PRO C 25 12.629 11.870 0.080 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.316 11.226 2.975 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.390 11.238 1.590 1.00 0.00 H new ATOM 0 HG2 PRO C 25 14.421 13.235 3.402 1.00 0.00 H new ATOM 0 HG3 PRO C 25 14.747 13.537 1.707 1.00 0.00 H new ATOM 0 HD2 PRO C 25 12.323 14.256 3.303 1.00 0.00 H new ATOM 0 HD3 PRO C 25 12.937 15.003 1.842 1.00 0.00 H new ATOM 1108 N LEU C 26 10.620 10.856 2.444 1.00 0.00 N ATOM 1109 CA LEU C 26 9.644 9.821 2.757 1.00 0.00 C ATOM 1110 C LEU C 26 8.550 9.776 1.696 1.00 0.00 C ATOM 1111 O LEU C 26 8.093 8.700 1.309 1.00 0.00 O ATOM 1112 CB LEU C 26 9.020 10.090 4.135 1.00 0.00 C ATOM 1113 CG LEU C 26 9.966 9.596 5.230 1.00 0.00 C ATOM 1114 CD1 LEU C 26 11.304 10.331 5.119 1.00 0.00 C ATOM 1115 CD2 LEU C 26 9.344 9.870 6.601 1.00 0.00 C ATOM 0 H LEU C 26 10.660 11.622 3.117 1.00 0.00 H new ATOM 0 HA LEU C 26 10.154 8.858 2.773 1.00 0.00 H new ATOM 0 HB2 LEU C 26 8.830 11.156 4.258 1.00 0.00 H new ATOM 0 HB3 LEU C 26 8.058 9.584 4.215 1.00 0.00 H new ATOM 0 HG LEU C 26 10.131 8.525 5.113 1.00 0.00 H new ATOM 0 HD11 LEU C 26 11.978 9.979 5.900 1.00 0.00 H new ATOM 0 HD12 LEU C 26 11.746 10.136 4.142 1.00 0.00 H new ATOM 0 HD13 LEU C 26 11.141 11.402 5.236 1.00 0.00 H new ATOM 0 HD21 LEU C 26 10.017 9.518 7.383 1.00 0.00 H new ATOM 0 HD22 LEU C 26 9.180 10.941 6.718 1.00 0.00 H new ATOM 0 HD23 LEU C 26 8.391 9.346 6.680 1.00 0.00 H new ATOM 1127 N VAL C 27 8.116 10.952 1.247 1.00 0.00 N ATOM 1128 CA VAL C 27 7.055 11.023 0.249 1.00 0.00 C ATOM 1129 C VAL C 27 7.480 10.331 -1.042 1.00 0.00 C ATOM 1130 O VAL C 27 6.769 9.470 -1.563 1.00 0.00 O ATOM 1131 CB VAL C 27 6.726 12.491 -0.044 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.745 12.574 -1.216 1.00 0.00 C ATOM 1133 CG2 VAL C 27 6.096 13.132 1.195 1.00 0.00 C ATOM 0 H VAL C 27 8.477 11.855 1.554 1.00 0.00 H new ATOM 0 HA VAL C 27 6.174 10.516 0.642 1.00 0.00 H new ATOM 0 HB VAL C 27 7.643 13.022 -0.301 1.00 0.00 H new ATOM 0 HG11 VAL C 27 5.512 13.619 -1.423 1.00 0.00 H new ATOM 0 HG12 VAL C 27 6.194 12.121 -2.100 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.828 12.042 -0.962 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.862 14.176 0.986 1.00 0.00 H new ATOM 0 HG22 VAL C 27 5.180 12.600 1.454 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.796 13.077 2.029 1.00 0.00 H new ATOM 1143 N VAL C 28 8.647 10.703 -1.547 1.00 0.00 N ATOM 1144 CA VAL C 28 9.166 10.110 -2.774 1.00 0.00 C ATOM 1145 C VAL C 28 9.467 8.630 -2.565 1.00 0.00 C ATOM 1146 O VAL C 28 9.199 7.801 -3.437 1.00 0.00 O ATOM 1147 CB VAL C 28 10.434 10.837 -3.218 1.00 0.00 C ATOM 1148 CG1 VAL C 28 10.080 12.259 -3.660 1.00 0.00 C ATOM 1149 CG2 VAL C 28 11.424 10.899 -2.053 1.00 0.00 C ATOM 0 H VAL C 28 9.252 11.410 -1.129 1.00 0.00 H new ATOM 0 HA VAL C 28 8.408 10.210 -3.551 1.00 0.00 H new ATOM 0 HB VAL C 28 10.886 10.298 -4.051 1.00 0.00 H new ATOM 0 HG11 VAL C 28 10.985 12.777 -3.977 1.00 0.00 H new ATOM 0 HG12 VAL C 28 9.376 12.217 -4.491 1.00 0.00 H new ATOM 0 HG13 VAL C 28 9.626 12.797 -2.827 1.00 0.00 H new ATOM 0 HG21 VAL C 28 12.328 11.418 -2.371 1.00 0.00 H new ATOM 0 HG22 VAL C 28 10.972 11.436 -1.219 1.00 0.00 H new ATOM 0 HG23 VAL C 28 11.678 9.887 -1.737 1.00 0.00 H new ATOM 1159 N ALA C 29 10.029 8.304 -1.408 1.00 0.00 N ATOM 1160 CA ALA C 29 10.363 6.920 -1.091 1.00 0.00 C ATOM 1161 C ALA C 29 9.097 6.076 -0.986 1.00 0.00 C ATOM 1162 O ALA C 29 9.078 4.918 -1.398 1.00 0.00 O ATOM 1163 CB ALA C 29 11.133 6.856 0.228 1.00 0.00 C ATOM 0 H ALA C 29 10.263 8.975 -0.676 1.00 0.00 H new ATOM 0 HA ALA C 29 10.986 6.523 -1.893 1.00 0.00 H new ATOM 0 HB1 ALA C 29 11.378 5.819 0.456 1.00 0.00 H new ATOM 0 HB2 ALA C 29 12.052 7.435 0.141 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.519 7.268 1.028 1.00 0.00 H new ATOM 1169 N ALA C 30 8.044 6.663 -0.431 1.00 0.00 N ATOM 1170 CA ALA C 30 6.782 5.950 -0.272 1.00 0.00 C ATOM 1171 C ALA C 30 6.261 5.476 -1.623 1.00 0.00 C ATOM 1172 O ALA C 30 5.827 4.333 -1.766 1.00 0.00 O ATOM 1173 CB ALA C 30 5.745 6.865 0.384 1.00 0.00 C ATOM 0 H ALA C 30 8.037 7.623 -0.086 1.00 0.00 H new ATOM 0 HA ALA C 30 6.954 5.081 0.363 1.00 0.00 H new ATOM 0 HB1 ALA C 30 4.805 6.325 0.499 1.00 0.00 H new ATOM 0 HB2 ALA C 30 6.105 7.180 1.363 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.585 7.742 -0.243 1.00 0.00 H new ATOM 1179 N ASN C 31 6.308 6.361 -2.617 1.00 0.00 N ATOM 1180 CA ASN C 31 5.836 6.015 -3.953 1.00 0.00 C ATOM 1181 C ASN C 31 6.680 4.891 -4.543 1.00 0.00 C ATOM 1182 O ASN C 31 6.151 3.950 -5.136 1.00 0.00 O ATOM 1183 CB ASN C 31 5.912 7.245 -4.862 1.00 0.00 C ATOM 1184 CG ASN C 31 4.788 8.215 -4.523 1.00 0.00 C ATOM 1185 OD1 ASN C 31 3.816 7.837 -3.869 1.00 0.00 O ATOM 1186 ND2 ASN C 31 4.864 9.455 -4.924 1.00 0.00 N ATOM 0 H ASN C 31 6.664 7.312 -2.523 1.00 0.00 H new ATOM 0 HA ASN C 31 4.802 5.677 -3.881 1.00 0.00 H new ATOM 0 HB2 ASN C 31 6.877 7.737 -4.741 1.00 0.00 H new ATOM 0 HB3 ASN C 31 5.838 6.941 -5.906 1.00 0.00 H new ATOM 0 HD21 ASN C 31 4.118 10.112 -4.695 1.00 0.00 H new ATOM 0 HD22 ASN C 31 5.670 9.767 -5.466 1.00 0.00 H new ATOM 1193 N ILE C 32 7.996 4.994 -4.379 1.00 0.00 N ATOM 1194 CA ILE C 32 8.901 3.977 -4.900 1.00 0.00 C ATOM 1195 C ILE C 32 8.670 2.641 -4.199 1.00 0.00 C ATOM 1196 O ILE C 32 8.629 1.590 -4.841 1.00 0.00 O ATOM 1197 CB ILE C 32 10.354 4.419 -4.698 1.00 0.00 C ATOM 1198 CG1 ILE C 32 10.646 5.628 -5.591 1.00 0.00 C ATOM 1199 CG2 ILE C 32 11.297 3.270 -5.070 1.00 0.00 C ATOM 1200 CD1 ILE C 32 11.977 6.258 -5.175 1.00 0.00 C ATOM 0 H ILE C 32 8.455 5.765 -3.894 1.00 0.00 H new ATOM 0 HA ILE C 32 8.703 3.853 -5.965 1.00 0.00 H new ATOM 0 HB ILE C 32 10.509 4.690 -3.654 1.00 0.00 H new ATOM 0 HG12 ILE C 32 10.688 5.321 -6.636 1.00 0.00 H new ATOM 0 HG13 ILE C 32 9.842 6.360 -5.506 1.00 0.00 H new ATOM 0 HG21 ILE C 32 12.330 3.586 -4.926 1.00 0.00 H new ATOM 0 HG22 ILE C 32 11.089 2.409 -4.435 1.00 0.00 H new ATOM 0 HG23 ILE C 32 11.144 2.997 -6.114 1.00 0.00 H new ATOM 0 HD11 ILE C 32 12.186 7.119 -5.810 1.00 0.00 H new ATOM 0 HD12 ILE C 32 11.918 6.580 -4.135 1.00 0.00 H new ATOM 0 HD13 ILE C 32 12.776 5.525 -5.283 1.00 0.00 H new ATOM 1212 N ILE C 33 8.526 2.689 -2.880 1.00 0.00 N ATOM 1213 CA ILE C 33 8.304 1.478 -2.101 1.00 0.00 C ATOM 1214 C ILE C 33 6.983 0.824 -2.494 1.00 0.00 C ATOM 1215 O ILE C 33 6.904 -0.394 -2.648 1.00 0.00 O ATOM 1216 CB ILE C 33 8.297 1.812 -0.607 1.00 0.00 C ATOM 1217 CG1 ILE C 33 9.706 2.212 -0.166 1.00 0.00 C ATOM 1218 CG2 ILE C 33 7.845 0.584 0.191 1.00 0.00 C ATOM 1219 CD1 ILE C 33 9.641 2.865 1.217 1.00 0.00 C ATOM 0 H ILE C 33 8.559 3.548 -2.331 1.00 0.00 H new ATOM 0 HA ILE C 33 9.114 0.778 -2.308 1.00 0.00 H new ATOM 0 HB ILE C 33 7.609 2.638 -0.425 1.00 0.00 H new ATOM 0 HG12 ILE C 33 10.352 1.335 -0.136 1.00 0.00 H new ATOM 0 HG13 ILE C 33 10.142 2.904 -0.887 1.00 0.00 H new ATOM 0 HG21 ILE C 33 7.840 0.823 1.255 1.00 0.00 H new ATOM 0 HG22 ILE C 33 6.841 0.297 -0.121 1.00 0.00 H new ATOM 0 HG23 ILE C 33 8.532 -0.242 0.008 1.00 0.00 H new ATOM 0 HD11 ILE C 33 10.645 3.150 1.532 1.00 0.00 H new ATOM 0 HD12 ILE C 33 9.009 3.752 1.171 1.00 0.00 H new ATOM 0 HD13 ILE C 33 9.223 2.158 1.934 1.00 0.00 H new ATOM 1231 N GLY C 34 5.947 1.640 -2.644 1.00 0.00 N ATOM 1232 CA GLY C 34 4.632 1.127 -3.008 1.00 0.00 C ATOM 1233 C GLY C 34 4.690 0.380 -4.335 1.00 0.00 C ATOM 1234 O GLY C 34 4.166 -0.729 -4.459 1.00 0.00 O ATOM 0 H GLY C 34 5.990 2.652 -2.520 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.268 0.461 -2.226 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.923 1.951 -3.080 1.00 0.00 H new ATOM 1238 N ILE C 35 5.338 0.986 -5.321 1.00 0.00 N ATOM 1239 CA ILE C 35 5.469 0.366 -6.633 1.00 0.00 C ATOM 1240 C ILE C 35 6.283 -0.921 -6.535 1.00 0.00 C ATOM 1241 O ILE C 35 5.951 -1.930 -7.157 1.00 0.00 O ATOM 1242 CB ILE C 35 6.144 1.334 -7.606 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.211 2.519 -7.872 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.435 0.615 -8.928 1.00 0.00 C ATOM 1245 CD1 ILE C 35 5.978 3.623 -8.604 1.00 0.00 C ATOM 0 H ILE C 35 5.779 1.902 -5.238 1.00 0.00 H new ATOM 0 HA ILE C 35 4.473 0.124 -7.003 1.00 0.00 H new ATOM 0 HB ILE C 35 7.078 1.690 -7.172 1.00 0.00 H new ATOM 0 HG12 ILE C 35 4.359 2.197 -8.470 1.00 0.00 H new ATOM 0 HG13 ILE C 35 4.814 2.901 -6.931 1.00 0.00 H new ATOM 0 HG21 ILE C 35 6.916 1.306 -9.620 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.096 -0.232 -8.744 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.501 0.259 -9.362 1.00 0.00 H new ATOM 0 HD11 ILE C 35 5.312 4.465 -8.792 1.00 0.00 H new ATOM 0 HD12 ILE C 35 6.816 3.953 -7.990 1.00 0.00 H new ATOM 0 HD13 ILE C 35 6.353 3.238 -9.552 1.00 0.00 H new ATOM 1257 N LEU C 36 7.365 -0.871 -5.766 1.00 0.00 N ATOM 1258 CA LEU C 36 8.230 -2.030 -5.614 1.00 0.00 C ATOM 1259 C LEU C 36 7.451 -3.199 -5.012 1.00 0.00 C ATOM 1260 O LEU C 36 7.618 -4.349 -5.414 1.00 0.00 O ATOM 1261 CB LEU C 36 9.422 -1.675 -4.707 1.00 0.00 C ATOM 1262 CG LEU C 36 10.657 -2.476 -5.135 1.00 0.00 C ATOM 1263 CD1 LEU C 36 11.835 -2.126 -4.229 1.00 0.00 C ATOM 1264 CD2 LEU C 36 10.358 -3.979 -5.040 1.00 0.00 C ATOM 0 H LEU C 36 7.661 -0.047 -5.243 1.00 0.00 H new ATOM 0 HA LEU C 36 8.599 -2.324 -6.597 1.00 0.00 H new ATOM 0 HB2 LEU C 36 9.631 -0.607 -4.767 1.00 0.00 H new ATOM 0 HB3 LEU C 36 9.178 -1.894 -3.668 1.00 0.00 H new ATOM 0 HG LEU C 36 10.909 -2.226 -6.165 1.00 0.00 H new ATOM 0 HD11 LEU C 36 12.712 -2.697 -4.535 1.00 0.00 H new ATOM 0 HD12 LEU C 36 12.050 -1.060 -4.307 1.00 0.00 H new ATOM 0 HD13 LEU C 36 11.585 -2.371 -3.197 1.00 0.00 H new ATOM 0 HD21 LEU C 36 11.238 -4.545 -5.345 1.00 0.00 H new ATOM 0 HD22 LEU C 36 10.100 -4.234 -4.012 1.00 0.00 H new ATOM 0 HD23 LEU C 36 9.523 -4.226 -5.695 1.00 0.00 H new ATOM 1276 N HIS C 37 6.599 -2.893 -4.040 1.00 0.00 N ATOM 1277 CA HIS C 37 5.805 -3.925 -3.385 1.00 0.00 C ATOM 1278 C HIS C 37 4.923 -4.641 -4.398 1.00 0.00 C ATOM 1279 O HIS C 37 4.772 -5.862 -4.353 1.00 0.00 O ATOM 1280 CB HIS C 37 4.931 -3.301 -2.299 1.00 0.00 C ATOM 1281 CG HIS C 37 4.149 -4.381 -1.601 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.287 -4.641 -0.249 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.217 -5.278 -2.058 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.459 -5.657 0.053 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.783 -6.080 -1.011 1.00 0.00 N ATOM 0 H HIS C 37 6.441 -1.948 -3.691 1.00 0.00 H new ATOM 0 HA HIS C 37 6.484 -4.648 -2.933 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.552 -2.765 -1.581 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.251 -2.572 -2.739 1.00 0.00 H new ATOM 0 HD2 HIS C 37 2.873 -5.350 -3.079 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.356 -6.079 1.042 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.094 -6.831 -1.050 1.00 0.00 H new ATOM 1293 N LEU C 38 4.336 -3.877 -5.309 1.00 0.00 N ATOM 1294 CA LEU C 38 3.466 -4.454 -6.323 1.00 0.00 C ATOM 1295 C LEU C 38 4.221 -5.441 -7.190 1.00 0.00 C ATOM 1296 O LEU C 38 3.678 -6.469 -7.570 1.00 0.00 O ATOM 1297 CB LEU C 38 2.873 -3.337 -7.203 1.00 0.00 C ATOM 1298 CG LEU C 38 1.522 -2.880 -6.631 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.203 -1.469 -7.113 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.414 -3.840 -7.104 1.00 0.00 C ATOM 0 H LEU C 38 4.445 -2.865 -5.367 1.00 0.00 H new ATOM 0 HA LEU C 38 2.661 -4.986 -5.817 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.562 -2.494 -7.248 1.00 0.00 H new ATOM 0 HB3 LEU C 38 2.742 -3.697 -8.223 1.00 0.00 H new ATOM 0 HG LEU C 38 1.576 -2.885 -5.542 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.244 -1.153 -6.703 1.00 0.00 H new ATOM 0 HD12 LEU C 38 1.984 -0.785 -6.779 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.153 -1.459 -8.202 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.545 -3.517 -6.699 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.368 -3.834 -8.193 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.634 -4.849 -6.755 1.00 0.00 H new ATOM 1312 N ILE C 39 5.460 -5.108 -7.519 1.00 0.00 N ATOM 1313 CA ILE C 39 6.266 -5.973 -8.367 1.00 0.00 C ATOM 1314 C ILE C 39 6.476 -7.328 -7.700 1.00 0.00 C ATOM 1315 O ILE C 39 6.362 -8.369 -8.339 1.00 0.00 O ATOM 1316 CB ILE C 39 7.625 -5.317 -8.628 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.429 -4.064 -9.484 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.539 -6.301 -9.367 1.00 0.00 C ATOM 1319 CD1 ILE C 39 8.752 -3.295 -9.586 1.00 0.00 C ATOM 0 H ILE C 39 5.926 -4.253 -7.215 1.00 0.00 H new ATOM 0 HA ILE C 39 5.742 -6.122 -9.311 1.00 0.00 H new ATOM 0 HB ILE C 39 8.082 -5.043 -7.677 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.081 -4.342 -10.479 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.661 -3.428 -9.044 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.505 -5.832 -9.551 1.00 0.00 H new ATOM 0 HG22 ILE C 39 8.680 -7.194 -8.758 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.083 -6.578 -10.317 1.00 0.00 H new ATOM 0 HD11 ILE C 39 8.608 -2.403 -10.196 1.00 0.00 H new ATOM 0 HD12 ILE C 39 9.081 -3.003 -8.589 1.00 0.00 H new ATOM 0 HD13 ILE C 39 9.508 -3.931 -10.046 1.00 0.00 H new ATOM 1331 N LEU C 40 6.795 -7.309 -6.414 1.00 0.00 N ATOM 1332 CA LEU C 40 7.020 -8.546 -5.677 1.00 0.00 C ATOM 1333 C LEU C 40 5.704 -9.250 -5.382 1.00 0.00 C ATOM 1334 O LEU C 40 5.599 -10.473 -5.505 1.00 0.00 O ATOM 1335 CB LEU C 40 7.746 -8.242 -4.364 1.00 0.00 C ATOM 1336 CG LEU C 40 9.161 -7.734 -4.670 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.794 -7.190 -3.386 1.00 0.00 C ATOM 1338 CD2 LEU C 40 10.025 -8.882 -5.228 1.00 0.00 C ATOM 0 H LEU C 40 6.903 -6.458 -5.862 1.00 0.00 H new ATOM 0 HA LEU C 40 7.634 -9.204 -6.292 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.194 -7.494 -3.795 1.00 0.00 H new ATOM 0 HB3 LEU C 40 7.795 -9.139 -3.747 1.00 0.00 H new ATOM 0 HG LEU C 40 9.104 -6.940 -5.415 1.00 0.00 H new ATOM 0 HD11 LEU C 40 10.800 -6.828 -3.601 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.188 -6.370 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU C 40 9.845 -7.984 -2.641 1.00 0.00 H new ATOM 0 HD21 LEU C 40 11.028 -8.512 -5.442 1.00 0.00 H new ATOM 0 HD22 LEU C 40 10.084 -9.684 -4.492 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.575 -9.263 -6.145 1.00 0.00 H new ATOM 1350 N TRP C 41 4.708 -8.475 -4.967 1.00 0.00 N ATOM 1351 CA TRP C 41 3.409 -9.036 -4.632 1.00 0.00 C ATOM 1352 C TRP C 41 2.733 -9.626 -5.865 1.00 0.00 C ATOM 1353 O TRP C 41 2.202 -10.740 -5.827 1.00 0.00 O ATOM 1354 CB TRP C 41 2.516 -7.957 -4.007 1.00 0.00 C ATOM 1355 CG TRP C 41 1.120 -8.480 -3.879 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.671 -9.252 -2.862 1.00 0.00 C ATOM 1357 CD2 TRP C 41 -0.017 -8.262 -4.760 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.665 -9.541 -3.079 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.135 -8.944 -4.231 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.187 -7.545 -5.958 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.372 -8.918 -4.870 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.436 -7.514 -6.597 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.524 -8.198 -6.051 1.00 0.00 C ATOM 0 H TRP C 41 4.776 -7.463 -4.856 1.00 0.00 H new ATOM 0 HA TRP C 41 3.560 -9.839 -3.910 1.00 0.00 H new ATOM 0 HB2 TRP C 41 2.901 -7.673 -3.028 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.525 -7.059 -4.625 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.258 -9.587 -2.020 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.232 -10.124 -2.463 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.649 -7.015 -6.389 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.210 -9.455 -4.451 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.556 -6.959 -7.515 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.484 -8.168 -6.545 1.00 0.00 H new ATOM 1374 N ILE C 42 2.741 -8.866 -6.949 1.00 0.00 N ATOM 1375 CA ILE C 42 2.111 -9.312 -8.182 1.00 0.00 C ATOM 1376 C ILE C 42 2.875 -10.492 -8.772 1.00 0.00 C ATOM 1377 O ILE C 42 2.281 -11.422 -9.318 1.00 0.00 O ATOM 1378 CB ILE C 42 2.068 -8.158 -9.193 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.062 -8.488 -10.300 1.00 0.00 C ATOM 1380 CG2 ILE C 42 3.459 -7.958 -9.815 1.00 0.00 C ATOM 1381 CD1 ILE C 42 0.915 -7.284 -11.230 1.00 0.00 C ATOM 0 H ILE C 42 3.174 -7.944 -7.001 1.00 0.00 H new ATOM 0 HA ILE C 42 1.093 -9.632 -7.959 1.00 0.00 H new ATOM 0 HB ILE C 42 1.766 -7.244 -8.681 1.00 0.00 H new ATOM 0 HG12 ILE C 42 1.398 -9.358 -10.864 1.00 0.00 H new ATOM 0 HG13 ILE C 42 0.096 -8.744 -9.864 1.00 0.00 H new ATOM 0 HG21 ILE C 42 3.423 -7.138 -10.532 1.00 0.00 H new ATOM 0 HG22 ILE C 42 4.178 -7.723 -9.030 1.00 0.00 H new ATOM 0 HG23 ILE C 42 3.764 -8.872 -10.325 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.199 -7.518 -12.018 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.559 -6.425 -10.660 1.00 0.00 H new ATOM 0 HD13 ILE C 42 1.881 -7.049 -11.676 1.00 0.00 H new ATOM 1393 N LEU C 43 4.198 -10.435 -8.675 1.00 0.00 N ATOM 1394 CA LEU C 43 5.035 -11.492 -9.212 1.00 0.00 C ATOM 1395 C LEU C 43 4.753 -12.809 -8.503 1.00 0.00 C ATOM 1396 O LEU C 43 4.689 -13.864 -9.135 1.00 0.00 O ATOM 1397 CB LEU C 43 6.509 -11.120 -9.052 1.00 0.00 C ATOM 1398 CG LEU C 43 7.397 -12.302 -9.515 1.00 0.00 C ATOM 1399 CD1 LEU C 43 8.565 -11.774 -10.352 1.00 0.00 C ATOM 1400 CD2 LEU C 43 7.946 -13.043 -8.289 1.00 0.00 C ATOM 0 H LEU C 43 4.709 -9.671 -8.232 1.00 0.00 H new ATOM 0 HA LEU C 43 4.807 -11.612 -10.271 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.736 -10.230 -9.639 1.00 0.00 H new ATOM 0 HB3 LEU C 43 6.722 -10.878 -8.011 1.00 0.00 H new ATOM 0 HG LEU C 43 6.798 -12.985 -10.118 1.00 0.00 H new ATOM 0 HD11 LEU C 43 9.187 -12.608 -10.676 1.00 0.00 H new ATOM 0 HD12 LEU C 43 8.179 -11.249 -11.226 1.00 0.00 H new ATOM 0 HD13 LEU C 43 9.162 -11.088 -9.751 1.00 0.00 H new ATOM 0 HD21 LEU C 43 8.571 -13.874 -8.616 1.00 0.00 H new ATOM 0 HD22 LEU C 43 8.541 -12.357 -7.686 1.00 0.00 H new ATOM 0 HD23 LEU C 43 7.117 -13.425 -7.693 1.00 0.00 H new ATOM 1412 N ASP C 44 4.599 -12.744 -7.184 1.00 0.00 N ATOM 1413 CA ASP C 44 4.336 -13.941 -6.395 1.00 0.00 C ATOM 1414 C ASP C 44 3.057 -14.619 -6.866 1.00 0.00 C ATOM 1415 O ASP C 44 3.015 -15.839 -7.036 1.00 0.00 O ATOM 1416 CB ASP C 44 4.204 -13.570 -4.916 1.00 0.00 C ATOM 1417 CG ASP C 44 3.831 -14.804 -4.102 1.00 0.00 C ATOM 1418 OD1 ASP C 44 4.721 -15.576 -3.792 1.00 0.00 O ATOM 1419 OD2 ASP C 44 2.657 -14.960 -3.808 1.00 0.00 O ATOM 0 H ASP C 44 4.651 -11.881 -6.643 1.00 0.00 H new ATOM 0 HA ASP C 44 5.169 -14.632 -6.524 1.00 0.00 H new ATOM 0 HB2 ASP C 44 5.143 -13.154 -4.551 1.00 0.00 H new ATOM 0 HB3 ASP C 44 3.444 -12.799 -4.792 1.00 0.00 H new ATOM 1424 N ARG C 45 2.017 -13.824 -7.081 1.00 0.00 N ATOM 1425 CA ARG C 45 0.741 -14.361 -7.541 1.00 0.00 C ATOM 1426 C ARG C 45 0.872 -14.914 -8.956 1.00 0.00 C ATOM 1427 O ARG C 45 0.051 -15.721 -9.396 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.332 -13.270 -7.510 1.00 0.00 C ATOM 1429 CG ARG C 45 -0.734 -12.990 -6.061 1.00 0.00 C ATOM 1430 CD ARG C 45 -1.793 -11.888 -6.029 1.00 0.00 C ATOM 1431 NE ARG C 45 -2.197 -11.618 -4.652 1.00 0.00 N ATOM 1432 CZ ARG C 45 -3.170 -12.314 -4.070 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -3.781 -13.258 -4.733 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -3.514 -12.052 -2.840 1.00 0.00 N ATOM 0 H ARG C 45 2.030 -12.813 -6.946 1.00 0.00 H new ATOM 0 HA ARG C 45 0.448 -15.171 -6.873 1.00 0.00 H new ATOM 0 HB2 ARG C 45 0.046 -12.360 -7.976 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -1.202 -13.585 -8.086 1.00 0.00 H new ATOM 0 HG2 ARG C 45 -1.124 -13.897 -5.599 1.00 0.00 H new ATOM 0 HG3 ARG C 45 0.139 -12.687 -5.482 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -1.398 -10.980 -6.485 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -2.660 -12.189 -6.618 1.00 0.00 H new ATOM 0 HE ARG C 45 -1.725 -10.882 -4.127 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -3.512 -13.461 -5.696 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -4.527 -13.793 -4.288 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -3.037 -11.313 -2.323 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -4.260 -12.586 -2.394 1.00 0.00 H new ATOM 1448 N LEU C 46 1.894 -14.465 -9.673 1.00 0.00 N ATOM 1449 CA LEU C 46 2.101 -14.916 -11.041 1.00 0.00 C ATOM 1450 C LEU C 46 2.327 -16.428 -11.077 1.00 0.00 C ATOM 1451 O LEU C 46 1.687 -17.146 -11.845 1.00 0.00 O ATOM 1452 CB LEU C 46 3.328 -14.199 -11.638 1.00 0.00 C ATOM 1453 CG LEU C 46 3.179 -14.101 -13.160 1.00 0.00 C ATOM 1454 CD1 LEU C 46 4.361 -13.327 -13.739 1.00 0.00 C ATOM 1455 CD2 LEU C 46 3.131 -15.509 -13.769 1.00 0.00 C ATOM 0 H LEU C 46 2.585 -13.796 -9.334 1.00 0.00 H new ATOM 0 HA LEU C 46 1.213 -14.679 -11.627 1.00 0.00 H new ATOM 0 HB2 LEU C 46 3.424 -13.202 -11.207 1.00 0.00 H new ATOM 0 HB3 LEU C 46 4.238 -14.744 -11.386 1.00 0.00 H new ATOM 0 HG LEU C 46 2.253 -13.578 -13.399 1.00 0.00 H new ATOM 0 HD11 LEU C 46 4.255 -13.257 -14.822 1.00 0.00 H new ATOM 0 HD12 LEU C 46 4.384 -12.325 -13.311 1.00 0.00 H new ATOM 0 HD13 LEU C 46 5.289 -13.846 -13.498 1.00 0.00 H new ATOM 0 HD21 LEU C 46 3.025 -15.434 -14.851 1.00 0.00 H new ATOM 0 HD22 LEU C 46 4.053 -16.040 -13.531 1.00 0.00 H new ATOM 0 HD23 LEU C 46 2.281 -16.054 -13.358 1.00 0.00 H new ATOM 1467 N PHE C 47 3.232 -16.906 -10.234 1.00 0.00 N ATOM 1468 CA PHE C 47 3.526 -18.332 -10.172 1.00 0.00 C ATOM 1469 C PHE C 47 2.310 -19.108 -9.694 1.00 0.00 C ATOM 1470 O PHE C 47 1.984 -20.161 -10.240 1.00 0.00 O ATOM 1471 CB PHE C 47 4.704 -18.587 -9.229 1.00 0.00 C ATOM 1472 CG PHE C 47 5.984 -18.130 -9.888 1.00 0.00 C ATOM 1473 CD1 PHE C 47 6.382 -16.793 -9.790 1.00 0.00 C ATOM 1474 CD2 PHE C 47 6.770 -19.046 -10.597 1.00 0.00 C ATOM 1475 CE1 PHE C 47 7.568 -16.370 -10.402 1.00 0.00 C ATOM 1476 CE2 PHE C 47 7.958 -18.624 -11.205 1.00 0.00 C ATOM 1477 CZ PHE C 47 8.357 -17.286 -11.109 1.00 0.00 C ATOM 0 H PHE C 47 3.773 -16.332 -9.587 1.00 0.00 H new ATOM 0 HA PHE C 47 3.788 -18.672 -11.174 1.00 0.00 H new ATOM 0 HB2 PHE C 47 4.555 -18.053 -8.291 1.00 0.00 H new ATOM 0 HB3 PHE C 47 4.766 -19.648 -8.986 1.00 0.00 H new ATOM 0 HD1 PHE C 47 5.775 -16.087 -9.243 1.00 0.00 H new ATOM 0 HD2 PHE C 47 6.460 -20.078 -10.675 1.00 0.00 H new ATOM 0 HE1 PHE C 47 7.875 -15.337 -10.329 1.00 0.00 H new ATOM 0 HE2 PHE C 47 8.567 -19.331 -11.748 1.00 0.00 H new ATOM 0 HZ PHE C 47 9.273 -16.960 -11.580 1.00 0.00 H new ATOM 1487 N PHE C 48 1.643 -18.586 -8.666 1.00 0.00 N ATOM 1488 CA PHE C 48 0.456 -19.244 -8.113 1.00 0.00 C ATOM 1489 C PHE C 48 -0.765 -18.351 -8.266 1.00 0.00 C ATOM 1490 O PHE C 48 -0.788 -17.225 -7.776 1.00 0.00 O ATOM 1491 CB PHE C 48 0.683 -19.556 -6.633 1.00 0.00 C ATOM 1492 CG PHE C 48 2.079 -20.112 -6.442 1.00 0.00 C ATOM 1493 CD1 PHE C 48 2.522 -21.193 -7.216 1.00 0.00 C ATOM 1494 CD2 PHE C 48 2.934 -19.541 -5.488 1.00 0.00 C ATOM 1495 CE1 PHE C 48 3.811 -21.701 -7.036 1.00 0.00 C ATOM 1496 CE2 PHE C 48 4.224 -20.050 -5.310 1.00 0.00 C ATOM 1497 CZ PHE C 48 4.662 -21.131 -6.083 1.00 0.00 C ATOM 0 H PHE C 48 1.900 -17.716 -8.200 1.00 0.00 H new ATOM 0 HA PHE C 48 0.283 -20.172 -8.659 1.00 0.00 H new ATOM 0 HB2 PHE C 48 0.555 -18.653 -6.036 1.00 0.00 H new ATOM 0 HB3 PHE C 48 -0.057 -20.276 -6.284 1.00 0.00 H new ATOM 0 HD1 PHE C 48 1.866 -21.634 -7.952 1.00 0.00 H new ATOM 0 HD2 PHE C 48 2.596 -18.707 -4.890 1.00 0.00 H new ATOM 0 HE1 PHE C 48 4.151 -22.534 -7.633 1.00 0.00 H new ATOM 0 HE2 PHE C 48 4.882 -19.609 -4.576 1.00 0.00 H new ATOM 0 HZ PHE C 48 5.658 -21.526 -5.944 1.00 0.00 H new ATOM 1507 N LYS C 49 -1.784 -18.868 -8.947 1.00 0.00 N ATOM 1508 CA LYS C 49 -3.014 -18.110 -9.157 1.00 0.00 C ATOM 1509 C LYS C 49 -3.944 -18.260 -7.958 1.00 0.00 C ATOM 1510 O LYS C 49 -3.944 -19.323 -7.361 1.00 0.00 O ATOM 1511 CB LYS C 49 -3.720 -18.603 -10.420 1.00 0.00 C ATOM 1512 CG LYS C 49 -2.867 -18.265 -11.646 1.00 0.00 C ATOM 1513 CD LYS C 49 -3.567 -18.773 -12.909 1.00 0.00 C ATOM 1514 CE LYS C 49 -2.679 -18.505 -14.125 1.00 0.00 C ATOM 1515 NZ LYS C 49 -2.565 -17.036 -14.343 1.00 0.00 N ATOM 1516 OXT LYS C 49 -4.646 -17.307 -7.655 1.00 0.00 O ATOM 0 H LYS C 49 -1.783 -19.801 -9.360 1.00 0.00 H new ATOM 0 HA LYS C 49 -2.757 -17.057 -9.273 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -3.882 -19.679 -10.362 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -4.701 -18.137 -10.507 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -2.714 -17.188 -11.710 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -1.882 -18.722 -11.554 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -3.770 -19.840 -12.821 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -4.529 -18.275 -13.030 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -1.691 -18.938 -13.969 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -3.101 -18.983 -15.009 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -2.217 -16.854 -15.306 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -3.499 -16.594 -14.223 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -1.900 -16.633 -13.653 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 6.109 26.979 5.888 1.00 0.00 N ATOM 1532 CA SER D 19 4.870 26.338 6.407 1.00 0.00 C ATOM 1533 C SER D 19 5.074 24.829 6.476 1.00 0.00 C ATOM 1534 O SER D 19 5.141 24.155 5.450 1.00 0.00 O ATOM 1535 CB SER D 19 3.700 26.662 5.477 1.00 0.00 C ATOM 1536 OG SER D 19 4.088 26.411 4.132 1.00 0.00 O ATOM 0 HA SER D 19 4.650 26.718 7.405 1.00 0.00 H new ATOM 0 HB2 SER D 19 2.834 26.054 5.738 1.00 0.00 H new ATOM 0 HB3 SER D 19 3.405 27.705 5.594 1.00 0.00 H new ATOM 0 HG SER D 19 4.623 25.591 4.093 1.00 0.00 H new ATOM 1544 N ASN D 20 5.176 24.304 7.694 1.00 0.00 N ATOM 1545 CA ASN D 20 5.377 22.870 7.887 1.00 0.00 C ATOM 1546 C ASN D 20 4.037 22.161 8.051 1.00 0.00 C ATOM 1547 O ASN D 20 3.988 20.957 8.301 1.00 0.00 O ATOM 1548 CB ASN D 20 6.239 22.627 9.127 1.00 0.00 C ATOM 1549 CG ASN D 20 7.659 23.123 8.879 1.00 0.00 C ATOM 1550 OD1 ASN D 20 8.120 23.149 7.739 1.00 0.00 O ATOM 1551 ND2 ASN D 20 8.386 23.525 9.887 1.00 0.00 N ATOM 0 H ASN D 20 5.123 24.845 8.557 1.00 0.00 H new ATOM 0 HA ASN D 20 5.883 22.470 7.008 1.00 0.00 H new ATOM 0 HB2 ASN D 20 5.809 23.143 9.986 1.00 0.00 H new ATOM 0 HB3 ASN D 20 6.253 21.564 9.368 1.00 0.00 H new ATOM 0 HD21 ASN D 20 9.336 23.861 9.729 1.00 0.00 H new ATOM 0 HD22 ASN D 20 8.004 23.503 10.832 1.00 0.00 H new ATOM 1558 N ASP D 21 2.952 22.915 7.903 1.00 0.00 N ATOM 1559 CA ASP D 21 1.615 22.345 8.034 1.00 0.00 C ATOM 1560 C ASP D 21 1.276 21.491 6.818 1.00 0.00 C ATOM 1561 O ASP D 21 0.262 20.792 6.802 1.00 0.00 O ATOM 1562 CB ASP D 21 0.582 23.466 8.178 1.00 0.00 C ATOM 1563 CG ASP D 21 0.722 24.132 9.542 1.00 0.00 C ATOM 1564 OD1 ASP D 21 1.353 23.544 10.404 1.00 0.00 O ATOM 1565 OD2 ASP D 21 0.200 25.223 9.702 1.00 0.00 O ATOM 0 H ASP D 21 2.971 23.913 7.694 1.00 0.00 H new ATOM 0 HA ASP D 21 1.594 21.715 8.923 1.00 0.00 H new ATOM 0 HB2 ASP D 21 0.721 24.204 7.388 1.00 0.00 H new ATOM 0 HB3 ASP D 21 -0.424 23.062 8.063 1.00 0.00 H new ATOM 1570 N SER D 22 2.131 21.550 5.802 1.00 0.00 N ATOM 1571 CA SER D 22 1.910 20.776 4.586 1.00 0.00 C ATOM 1572 C SER D 22 1.925 19.283 4.891 1.00 0.00 C ATOM 1573 O SER D 22 1.166 18.513 4.303 1.00 0.00 O ATOM 1574 CB SER D 22 2.995 21.098 3.558 1.00 0.00 C ATOM 1575 OG SER D 22 4.269 20.791 4.110 1.00 0.00 O ATOM 0 H SER D 22 2.976 22.121 5.796 1.00 0.00 H new ATOM 0 HA SER D 22 0.934 21.043 4.181 1.00 0.00 H new ATOM 0 HB2 SER D 22 2.832 20.522 2.647 1.00 0.00 H new ATOM 0 HB3 SER D 22 2.950 22.151 3.282 1.00 0.00 H new ATOM 0 HG SER D 22 4.968 20.994 3.453 1.00 0.00 H new ATOM 1581 N SER D 23 2.791 18.878 5.816 1.00 0.00 N ATOM 1582 CA SER D 23 2.895 17.470 6.193 1.00 0.00 C ATOM 1583 C SER D 23 1.983 17.167 7.372 1.00 0.00 C ATOM 1584 O SER D 23 2.356 17.364 8.530 1.00 0.00 O ATOM 1585 CB SER D 23 4.338 17.138 6.566 1.00 0.00 C ATOM 1586 OG SER D 23 4.498 15.725 6.601 1.00 0.00 O ATOM 0 H SER D 23 3.427 19.499 6.316 1.00 0.00 H new ATOM 0 HA SER D 23 2.589 16.860 5.343 1.00 0.00 H new ATOM 0 HB2 SER D 23 5.024 17.576 5.841 1.00 0.00 H new ATOM 0 HB3 SER D 23 4.584 17.568 7.537 1.00 0.00 H new ATOM 0 HG SER D 23 5.423 15.506 6.839 1.00 0.00 H new ATOM 1592 N ASP D 24 0.778 16.693 7.069 1.00 0.00 N ATOM 1593 CA ASP D 24 -0.182 16.375 8.108 1.00 0.00 C ATOM 1594 C ASP D 24 0.175 15.049 8.791 1.00 0.00 C ATOM 1595 O ASP D 24 0.776 14.169 8.171 1.00 0.00 O ATOM 1596 CB ASP D 24 -1.596 16.284 7.519 1.00 0.00 C ATOM 1597 CG ASP D 24 -2.168 17.683 7.322 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -2.574 18.282 8.307 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -2.183 18.140 6.193 1.00 0.00 O ATOM 0 H ASP D 24 0.450 16.523 6.118 1.00 0.00 H new ATOM 0 HA ASP D 24 -0.152 17.173 8.850 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -1.569 15.755 6.566 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -2.240 15.709 8.184 1.00 0.00 H new ATOM 1604 N PRO D 25 -0.198 14.886 10.035 1.00 0.00 N ATOM 1605 CA PRO D 25 0.075 13.635 10.798 1.00 0.00 C ATOM 1606 C PRO D 25 -0.261 12.382 9.988 1.00 0.00 C ATOM 1607 O PRO D 25 0.456 11.382 10.044 1.00 0.00 O ATOM 1608 CB PRO D 25 -0.843 13.754 12.022 1.00 0.00 C ATOM 1609 CG PRO D 25 -1.048 15.222 12.226 1.00 0.00 C ATOM 1610 CD PRO D 25 -0.906 15.883 10.857 1.00 0.00 C ATOM 0 HA PRO D 25 1.129 13.532 11.055 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -1.792 13.245 11.852 1.00 0.00 H new ATOM 0 HB3 PRO D 25 -0.388 13.295 12.900 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -2.033 15.419 12.650 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -0.314 15.621 12.926 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -1.879 16.128 10.432 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -0.343 16.814 10.923 1.00 0.00 H new ATOM 1618 N LEU D 26 -1.357 12.442 9.243 1.00 0.00 N ATOM 1619 CA LEU D 26 -1.777 11.306 8.431 1.00 0.00 C ATOM 1620 C LEU D 26 -0.746 11.016 7.346 1.00 0.00 C ATOM 1621 O LEU D 26 -0.454 9.859 7.051 1.00 0.00 O ATOM 1622 CB LEU D 26 -3.140 11.599 7.787 1.00 0.00 C ATOM 1623 CG LEU D 26 -4.253 11.353 8.807 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -4.045 12.263 10.019 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -5.606 11.659 8.165 1.00 0.00 C ATOM 0 H LEU D 26 -1.967 13.257 9.184 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.863 10.431 9.075 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -3.174 12.631 7.438 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -3.286 10.962 6.914 1.00 0.00 H new ATOM 0 HG LEU D 26 -4.230 10.312 9.128 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -4.838 12.088 10.746 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -3.080 12.046 10.476 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -4.069 13.305 9.700 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -6.401 11.484 8.890 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -5.630 12.701 7.845 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -5.754 11.011 7.301 1.00 0.00 H new ATOM 1637 N VAL D 27 -0.219 12.074 6.736 1.00 0.00 N ATOM 1638 CA VAL D 27 0.755 11.909 5.663 1.00 0.00 C ATOM 1639 C VAL D 27 1.996 11.179 6.169 1.00 0.00 C ATOM 1640 O VAL D 27 2.427 10.183 5.585 1.00 0.00 O ATOM 1641 CB VAL D 27 1.158 13.285 5.120 1.00 0.00 C ATOM 1642 CG1 VAL D 27 2.312 13.128 4.128 1.00 0.00 C ATOM 1643 CG2 VAL D 27 -0.038 13.926 4.412 1.00 0.00 C ATOM 0 H VAL D 27 -0.446 13.042 6.963 1.00 0.00 H new ATOM 0 HA VAL D 27 0.300 11.316 4.869 1.00 0.00 H new ATOM 0 HB VAL D 27 1.475 13.920 5.947 1.00 0.00 H new ATOM 0 HG11 VAL D 27 2.597 14.107 3.743 1.00 0.00 H new ATOM 0 HG12 VAL D 27 3.165 12.674 4.631 1.00 0.00 H new ATOM 0 HG13 VAL D 27 1.997 12.491 3.301 1.00 0.00 H new ATOM 0 HG21 VAL D 27 0.249 14.904 4.026 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -0.356 13.289 3.586 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -0.860 14.042 5.119 1.00 0.00 H new ATOM 1653 N VAL D 28 2.558 11.673 7.262 1.00 0.00 N ATOM 1654 CA VAL D 28 3.745 11.058 7.846 1.00 0.00 C ATOM 1655 C VAL D 28 3.424 9.659 8.358 1.00 0.00 C ATOM 1656 O VAL D 28 4.221 8.732 8.207 1.00 0.00 O ATOM 1657 CB VAL D 28 4.277 11.919 8.992 1.00 0.00 C ATOM 1658 CG1 VAL D 28 4.822 13.236 8.431 1.00 0.00 C ATOM 1659 CG2 VAL D 28 3.144 12.218 9.973 1.00 0.00 C ATOM 0 H VAL D 28 2.215 12.493 7.762 1.00 0.00 H new ATOM 0 HA VAL D 28 4.509 10.983 7.072 1.00 0.00 H new ATOM 0 HB VAL D 28 5.075 11.384 9.507 1.00 0.00 H new ATOM 0 HG11 VAL D 28 5.201 13.850 9.248 1.00 0.00 H new ATOM 0 HG12 VAL D 28 5.629 13.026 7.729 1.00 0.00 H new ATOM 0 HG13 VAL D 28 4.024 13.770 7.916 1.00 0.00 H new ATOM 0 HG21 VAL D 28 3.523 12.832 10.790 1.00 0.00 H new ATOM 0 HG22 VAL D 28 2.347 12.753 9.456 1.00 0.00 H new ATOM 0 HG23 VAL D 28 2.753 11.283 10.373 1.00 0.00 H new ATOM 1669 N ALA D 29 2.255 9.515 8.969 1.00 0.00 N ATOM 1670 CA ALA D 29 1.834 8.225 9.504 1.00 0.00 C ATOM 1671 C ALA D 29 1.631 7.220 8.375 1.00 0.00 C ATOM 1672 O ALA D 29 1.954 6.044 8.512 1.00 0.00 O ATOM 1673 CB ALA D 29 0.531 8.382 10.292 1.00 0.00 C ATOM 0 H ALA D 29 1.584 10.271 9.106 1.00 0.00 H new ATOM 0 HA ALA D 29 2.615 7.857 10.169 1.00 0.00 H new ATOM 0 HB1 ALA D 29 0.226 7.413 10.687 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.686 9.078 11.117 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.248 8.767 9.634 1.00 0.00 H new ATOM 1679 N ALA D 30 1.090 7.696 7.257 1.00 0.00 N ATOM 1680 CA ALA D 30 0.844 6.826 6.113 1.00 0.00 C ATOM 1681 C ALA D 30 2.138 6.168 5.653 1.00 0.00 C ATOM 1682 O ALA D 30 2.173 4.964 5.386 1.00 0.00 O ATOM 1683 CB ALA D 30 0.248 7.639 4.961 1.00 0.00 C ATOM 0 H ALA D 30 0.816 8.669 7.120 1.00 0.00 H new ATOM 0 HA ALA D 30 0.141 6.049 6.415 1.00 0.00 H new ATOM 0 HB1 ALA D 30 0.066 6.984 4.109 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.693 8.088 5.281 1.00 0.00 H new ATOM 0 HB3 ALA D 30 0.945 8.425 4.672 1.00 0.00 H new ATOM 1689 N ASN D 31 3.202 6.960 5.563 1.00 0.00 N ATOM 1690 CA ASN D 31 4.495 6.435 5.133 1.00 0.00 C ATOM 1691 C ASN D 31 5.007 5.395 6.126 1.00 0.00 C ATOM 1692 O ASN D 31 5.504 4.339 5.733 1.00 0.00 O ATOM 1693 CB ASN D 31 5.508 7.578 5.021 1.00 0.00 C ATOM 1694 CG ASN D 31 5.222 8.406 3.775 1.00 0.00 C ATOM 1695 OD1 ASN D 31 4.518 7.951 2.873 1.00 0.00 O ATOM 1696 ND2 ASN D 31 5.726 9.605 3.669 1.00 0.00 N ATOM 0 H ASN D 31 3.197 7.957 5.779 1.00 0.00 H new ATOM 0 HA ASN D 31 4.371 5.961 4.159 1.00 0.00 H new ATOM 0 HB2 ASN D 31 5.456 8.210 5.908 1.00 0.00 H new ATOM 0 HB3 ASN D 31 6.520 7.175 4.976 1.00 0.00 H new ATOM 0 HD21 ASN D 31 5.537 10.166 2.838 1.00 0.00 H new ATOM 0 HD22 ASN D 31 6.309 9.981 4.417 1.00 0.00 H new ATOM 1703 N ILE D 32 4.882 5.698 7.413 1.00 0.00 N ATOM 1704 CA ILE D 32 5.333 4.781 8.453 1.00 0.00 C ATOM 1705 C ILE D 32 4.514 3.494 8.421 1.00 0.00 C ATOM 1706 O ILE D 32 5.059 2.394 8.523 1.00 0.00 O ATOM 1707 CB ILE D 32 5.201 5.441 9.827 1.00 0.00 C ATOM 1708 CG1 ILE D 32 6.195 6.602 9.930 1.00 0.00 C ATOM 1709 CG2 ILE D 32 5.506 4.414 10.920 1.00 0.00 C ATOM 1710 CD1 ILE D 32 5.874 7.438 11.171 1.00 0.00 C ATOM 0 H ILE D 32 4.475 6.566 7.760 1.00 0.00 H new ATOM 0 HA ILE D 32 6.379 4.538 8.269 1.00 0.00 H new ATOM 0 HB ILE D 32 4.185 5.815 9.954 1.00 0.00 H new ATOM 0 HG12 ILE D 32 7.214 6.219 9.990 1.00 0.00 H new ATOM 0 HG13 ILE D 32 6.140 7.223 9.036 1.00 0.00 H new ATOM 0 HG21 ILE D 32 5.412 4.885 11.898 1.00 0.00 H new ATOM 0 HG22 ILE D 32 4.802 3.585 10.847 1.00 0.00 H new ATOM 0 HG23 ILE D 32 6.522 4.039 10.794 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.581 8.265 11.246 1.00 0.00 H new ATOM 0 HD12 ILE D 32 4.861 7.833 11.092 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.951 6.813 12.061 1.00 0.00 H new ATOM 1722 N ILE D 33 3.200 3.639 8.286 1.00 0.00 N ATOM 1723 CA ILE D 33 2.313 2.482 8.248 1.00 0.00 C ATOM 1724 C ILE D 33 2.619 1.616 7.030 1.00 0.00 C ATOM 1725 O ILE D 33 2.665 0.389 7.127 1.00 0.00 O ATOM 1726 CB ILE D 33 0.853 2.943 8.206 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.479 3.579 9.546 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.057 1.744 7.941 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -0.850 4.324 9.404 1.00 0.00 C ATOM 0 H ILE D 33 2.728 4.539 8.202 1.00 0.00 H new ATOM 0 HA ILE D 33 2.476 1.889 9.148 1.00 0.00 H new ATOM 0 HB ILE D 33 0.729 3.675 7.408 1.00 0.00 H new ATOM 0 HG12 ILE D 33 0.397 2.811 10.315 1.00 0.00 H new ATOM 0 HG13 ILE D 33 1.262 4.267 9.865 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.095 2.075 7.912 1.00 0.00 H new ATOM 0 HG22 ILE D 33 0.207 1.291 6.985 1.00 0.00 H new ATOM 0 HG23 ILE D 33 0.068 1.010 8.737 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -1.117 4.777 10.359 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -0.752 5.103 8.648 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -1.630 3.624 9.105 1.00 0.00 H new ATOM 1741 N GLY D 34 2.816 2.260 5.886 1.00 0.00 N ATOM 1742 CA GLY D 34 3.103 1.534 4.655 1.00 0.00 C ATOM 1743 C GLY D 34 4.365 0.690 4.803 1.00 0.00 C ATOM 1744 O GLY D 34 4.383 -0.488 4.443 1.00 0.00 O ATOM 0 H GLY D 34 2.783 3.274 5.785 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.259 0.892 4.401 1.00 0.00 H new ATOM 0 HA3 GLY D 34 3.226 2.239 3.833 1.00 0.00 H new ATOM 1748 N ILE D 35 5.414 1.296 5.348 1.00 0.00 N ATOM 1749 CA ILE D 35 6.671 0.588 5.549 1.00 0.00 C ATOM 1750 C ILE D 35 6.485 -0.556 6.541 1.00 0.00 C ATOM 1751 O ILE D 35 7.008 -1.654 6.347 1.00 0.00 O ATOM 1752 CB ILE D 35 7.738 1.555 6.067 1.00 0.00 C ATOM 1753 CG1 ILE D 35 8.084 2.567 4.969 1.00 0.00 C ATOM 1754 CG2 ILE D 35 8.999 0.774 6.450 1.00 0.00 C ATOM 1755 CD1 ILE D 35 8.915 3.705 5.565 1.00 0.00 C ATOM 0 H ILE D 35 5.419 2.268 5.656 1.00 0.00 H new ATOM 0 HA ILE D 35 6.994 0.175 4.594 1.00 0.00 H new ATOM 0 HB ILE D 35 7.355 2.079 6.943 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.640 2.076 4.170 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.171 2.964 4.525 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.757 1.465 6.818 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.757 0.052 7.230 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.382 0.249 5.575 1.00 0.00 H new ATOM 0 HD11 ILE D 35 9.161 4.424 4.784 1.00 0.00 H new ATOM 0 HD12 ILE D 35 8.343 4.202 6.348 1.00 0.00 H new ATOM 0 HD13 ILE D 35 9.835 3.301 5.988 1.00 0.00 H new ATOM 1767 N LEU D 36 5.754 -0.286 7.615 1.00 0.00 N ATOM 1768 CA LEU D 36 5.527 -1.295 8.640 1.00 0.00 C ATOM 1769 C LEU D 36 4.810 -2.506 8.042 1.00 0.00 C ATOM 1770 O LEU D 36 5.120 -3.650 8.367 1.00 0.00 O ATOM 1771 CB LEU D 36 4.679 -0.697 9.779 1.00 0.00 C ATOM 1772 CG LEU D 36 5.070 -1.347 11.111 1.00 0.00 C ATOM 1773 CD1 LEU D 36 4.230 -0.748 12.236 1.00 0.00 C ATOM 1774 CD2 LEU D 36 4.836 -2.861 11.036 1.00 0.00 C ATOM 0 H LEU D 36 5.312 0.615 7.798 1.00 0.00 H new ATOM 0 HA LEU D 36 6.490 -1.617 9.037 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.831 0.381 9.831 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.620 -0.860 9.581 1.00 0.00 H new ATOM 0 HG LEU D 36 6.125 -1.159 11.310 1.00 0.00 H new ATOM 0 HD11 LEU D 36 4.508 -1.210 13.183 1.00 0.00 H new ATOM 0 HD12 LEU D 36 4.408 0.326 12.290 1.00 0.00 H new ATOM 0 HD13 LEU D 36 3.174 -0.932 12.039 1.00 0.00 H new ATOM 0 HD21 LEU D 36 5.115 -3.320 11.985 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.783 -3.057 10.834 1.00 0.00 H new ATOM 0 HD23 LEU D 36 5.444 -3.284 10.236 1.00 0.00 H new ATOM 1786 N HIS D 37 3.846 -2.240 7.169 1.00 0.00 N ATOM 1787 CA HIS D 37 3.088 -3.313 6.538 1.00 0.00 C ATOM 1788 C HIS D 37 4.015 -4.237 5.760 1.00 0.00 C ATOM 1789 O HIS D 37 3.865 -5.457 5.793 1.00 0.00 O ATOM 1790 CB HIS D 37 2.040 -2.728 5.594 1.00 0.00 C ATOM 1791 CG HIS D 37 1.236 -3.844 4.982 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.130 -3.962 5.168 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.594 -4.902 4.187 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.537 -5.054 4.499 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.473 -5.663 3.882 1.00 0.00 N ATOM 0 H HIS D 37 3.572 -1.300 6.884 1.00 0.00 H new ATOM 0 HA HIS D 37 2.591 -3.888 7.319 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.384 -2.049 6.138 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.525 -2.144 4.812 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.598 -5.112 3.848 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.561 -5.396 4.466 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.432 -6.506 3.309 1.00 0.00 H new ATOM 1803 N LEU D 38 4.971 -3.649 5.057 1.00 0.00 N ATOM 1804 CA LEU D 38 5.910 -4.433 4.268 1.00 0.00 C ATOM 1805 C LEU D 38 6.706 -5.375 5.148 1.00 0.00 C ATOM 1806 O LEU D 38 6.982 -6.500 4.754 1.00 0.00 O ATOM 1807 CB LEU D 38 6.871 -3.495 3.511 1.00 0.00 C ATOM 1808 CG LEU D 38 6.307 -3.181 2.115 1.00 0.00 C ATOM 1809 CD1 LEU D 38 6.903 -1.878 1.594 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.666 -4.327 1.149 1.00 0.00 C ATOM 0 H LEU D 38 5.117 -2.640 5.016 1.00 0.00 H new ATOM 0 HA LEU D 38 5.340 -5.027 3.553 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.009 -2.571 4.073 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.852 -3.962 3.420 1.00 0.00 H new ATOM 0 HG LEU D 38 5.224 -3.079 2.182 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.499 -1.663 0.605 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.650 -1.065 2.274 1.00 0.00 H new ATOM 0 HD13 LEU D 38 7.987 -1.974 1.530 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.267 -4.107 0.159 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.750 -4.427 1.090 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.235 -5.259 1.514 1.00 0.00 H new ATOM 1822 N ILE D 39 7.091 -4.899 6.322 1.00 0.00 N ATOM 1823 CA ILE D 39 7.883 -5.713 7.232 1.00 0.00 C ATOM 1824 C ILE D 39 7.108 -6.959 7.645 1.00 0.00 C ATOM 1825 O ILE D 39 7.650 -8.060 7.667 1.00 0.00 O ATOM 1826 CB ILE D 39 8.233 -4.896 8.479 1.00 0.00 C ATOM 1827 CG1 ILE D 39 9.185 -3.759 8.092 1.00 0.00 C ATOM 1828 CG2 ILE D 39 8.915 -5.798 9.514 1.00 0.00 C ATOM 1829 CD1 ILE D 39 9.384 -2.824 9.289 1.00 0.00 C ATOM 0 H ILE D 39 6.871 -3.964 6.665 1.00 0.00 H new ATOM 0 HA ILE D 39 8.797 -6.018 6.722 1.00 0.00 H new ATOM 0 HB ILE D 39 7.320 -4.482 8.906 1.00 0.00 H new ATOM 0 HG12 ILE D 39 10.144 -4.167 7.773 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.779 -3.203 7.247 1.00 0.00 H new ATOM 0 HG21 ILE D 39 9.162 -5.213 10.400 1.00 0.00 H new ATOM 0 HG22 ILE D 39 8.241 -6.608 9.791 1.00 0.00 H new ATOM 0 HG23 ILE D 39 9.828 -6.215 9.088 1.00 0.00 H new ATOM 0 HD11 ILE D 39 10.061 -2.016 9.011 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.423 -2.405 9.587 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.810 -3.384 10.122 1.00 0.00 H new ATOM 1841 N LEU D 40 5.838 -6.781 7.981 1.00 0.00 N ATOM 1842 CA LEU D 40 5.004 -7.901 8.390 1.00 0.00 C ATOM 1843 C LEU D 40 4.616 -8.758 7.192 1.00 0.00 C ATOM 1844 O LEU D 40 4.627 -9.988 7.264 1.00 0.00 O ATOM 1845 CB LEU D 40 3.739 -7.383 9.080 1.00 0.00 C ATOM 1846 CG LEU D 40 4.120 -6.709 10.404 1.00 0.00 C ATOM 1847 CD1 LEU D 40 2.900 -5.976 10.970 1.00 0.00 C ATOM 1848 CD2 LEU D 40 4.606 -7.764 11.416 1.00 0.00 C ATOM 0 H LEU D 40 5.365 -5.877 7.979 1.00 0.00 H new ATOM 0 HA LEU D 40 5.576 -8.516 9.085 1.00 0.00 H new ATOM 0 HB2 LEU D 40 3.223 -6.673 8.433 1.00 0.00 H new ATOM 0 HB3 LEU D 40 3.049 -8.206 9.264 1.00 0.00 H new ATOM 0 HG LEU D 40 4.925 -5.996 10.224 1.00 0.00 H new ATOM 0 HD11 LEU D 40 3.168 -5.496 11.911 1.00 0.00 H new ATOM 0 HD12 LEU D 40 2.568 -5.220 10.259 1.00 0.00 H new ATOM 0 HD13 LEU D 40 2.095 -6.690 11.143 1.00 0.00 H new ATOM 0 HD21 LEU D 40 4.874 -7.274 12.352 1.00 0.00 H new ATOM 0 HD22 LEU D 40 3.810 -8.486 11.599 1.00 0.00 H new ATOM 0 HD23 LEU D 40 5.478 -8.279 11.014 1.00 0.00 H new ATOM 1860 N TRP D 41 4.252 -8.097 6.099 1.00 0.00 N ATOM 1861 CA TRP D 41 3.841 -8.808 4.898 1.00 0.00 C ATOM 1862 C TRP D 41 5.002 -9.594 4.299 1.00 0.00 C ATOM 1863 O TRP D 41 4.855 -10.763 3.935 1.00 0.00 O ATOM 1864 CB TRP D 41 3.289 -7.814 3.867 1.00 0.00 C ATOM 1865 CG TRP D 41 3.084 -8.516 2.560 1.00 0.00 C ATOM 1866 CD1 TRP D 41 1.996 -9.253 2.238 1.00 0.00 C ATOM 1867 CD2 TRP D 41 3.952 -8.537 1.393 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.156 -9.746 0.957 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.342 -9.322 0.392 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.200 -7.954 1.109 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 3.950 -9.527 -0.843 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.811 -8.157 -0.140 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.185 -8.939 -1.112 1.00 0.00 C ATOM 0 H TRP D 41 4.233 -7.080 6.021 1.00 0.00 H new ATOM 0 HA TRP D 41 3.059 -9.517 5.171 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.347 -7.394 4.219 1.00 0.00 H new ATOM 0 HB3 TRP D 41 3.981 -6.982 3.741 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.143 -9.427 2.877 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.481 -10.349 0.487 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.691 -7.347 1.855 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.467 -10.139 -1.590 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.770 -7.706 -0.349 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.657 -9.088 -2.072 1.00 0.00 H new ATOM 1884 N ILE D 42 6.146 -8.938 4.183 1.00 0.00 N ATOM 1885 CA ILE D 42 7.321 -9.576 3.610 1.00 0.00 C ATOM 1886 C ILE D 42 7.827 -10.680 4.530 1.00 0.00 C ATOM 1887 O ILE D 42 8.273 -11.733 4.072 1.00 0.00 O ATOM 1888 CB ILE D 42 8.424 -8.535 3.387 1.00 0.00 C ATOM 1889 CG1 ILE D 42 9.470 -9.098 2.421 1.00 0.00 C ATOM 1890 CG2 ILE D 42 9.101 -8.198 4.725 1.00 0.00 C ATOM 1891 CD1 ILE D 42 10.498 -8.015 2.094 1.00 0.00 C ATOM 0 H ILE D 42 6.286 -7.971 4.476 1.00 0.00 H new ATOM 0 HA ILE D 42 7.047 -10.018 2.652 1.00 0.00 H new ATOM 0 HB ILE D 42 7.983 -7.631 2.966 1.00 0.00 H new ATOM 0 HG12 ILE D 42 9.965 -9.961 2.867 1.00 0.00 H new ATOM 0 HG13 ILE D 42 8.987 -9.444 1.507 1.00 0.00 H new ATOM 0 HG21 ILE D 42 9.884 -7.458 4.560 1.00 0.00 H new ATOM 0 HG22 ILE D 42 8.361 -7.795 5.416 1.00 0.00 H new ATOM 0 HG23 ILE D 42 9.539 -9.102 5.149 1.00 0.00 H new ATOM 0 HD11 ILE D 42 11.243 -8.416 1.406 1.00 0.00 H new ATOM 0 HD12 ILE D 42 9.996 -7.165 1.631 1.00 0.00 H new ATOM 0 HD13 ILE D 42 10.989 -7.690 3.011 1.00 0.00 H new ATOM 1903 N LEU D 43 7.769 -10.426 5.832 1.00 0.00 N ATOM 1904 CA LEU D 43 8.233 -11.396 6.807 1.00 0.00 C ATOM 1905 C LEU D 43 7.406 -12.673 6.726 1.00 0.00 C ATOM 1906 O LEU D 43 7.942 -13.778 6.805 1.00 0.00 O ATOM 1907 CB LEU D 43 8.136 -10.806 8.214 1.00 0.00 C ATOM 1908 CG LEU D 43 8.517 -11.883 9.258 1.00 0.00 C ATOM 1909 CD1 LEU D 43 9.425 -11.271 10.328 1.00 0.00 C ATOM 1910 CD2 LEU D 43 7.246 -12.428 9.923 1.00 0.00 C ATOM 0 H LEU D 43 7.407 -9.560 6.232 1.00 0.00 H new ATOM 0 HA LEU D 43 9.273 -11.639 6.588 1.00 0.00 H new ATOM 0 HB2 LEU D 43 8.800 -9.946 8.305 1.00 0.00 H new ATOM 0 HB3 LEU D 43 7.123 -10.448 8.400 1.00 0.00 H new ATOM 0 HG LEU D 43 9.044 -12.694 8.757 1.00 0.00 H new ATOM 0 HD11 LEU D 43 9.690 -12.034 11.060 1.00 0.00 H new ATOM 0 HD12 LEU D 43 10.331 -10.887 9.860 1.00 0.00 H new ATOM 0 HD13 LEU D 43 8.901 -10.456 10.827 1.00 0.00 H new ATOM 0 HD21 LEU D 43 7.516 -13.186 10.658 1.00 0.00 H new ATOM 0 HD22 LEU D 43 6.717 -11.614 10.419 1.00 0.00 H new ATOM 0 HD23 LEU D 43 6.600 -12.871 9.165 1.00 0.00 H new ATOM 1922 N ASP D 44 6.095 -12.512 6.578 1.00 0.00 N ATOM 1923 CA ASP D 44 5.201 -13.661 6.497 1.00 0.00 C ATOM 1924 C ASP D 44 5.581 -14.554 5.325 1.00 0.00 C ATOM 1925 O ASP D 44 5.644 -15.777 5.456 1.00 0.00 O ATOM 1926 CB ASP D 44 3.757 -13.183 6.327 1.00 0.00 C ATOM 1927 CG ASP D 44 2.830 -14.382 6.147 1.00 0.00 C ATOM 1928 OD1 ASP D 44 2.473 -14.983 7.146 1.00 0.00 O ATOM 1929 OD2 ASP D 44 2.498 -14.682 5.013 1.00 0.00 O ATOM 0 H ASP D 44 5.631 -11.606 6.512 1.00 0.00 H new ATOM 0 HA ASP D 44 5.291 -14.235 7.419 1.00 0.00 H new ATOM 0 HB2 ASP D 44 3.452 -12.604 7.198 1.00 0.00 H new ATOM 0 HB3 ASP D 44 3.683 -12.522 5.463 1.00 0.00 H new ATOM 1934 N ARG D 45 5.844 -13.937 4.179 1.00 0.00 N ATOM 1935 CA ARG D 45 6.229 -14.690 2.990 1.00 0.00 C ATOM 1936 C ARG D 45 7.594 -15.340 3.182 1.00 0.00 C ATOM 1937 O ARG D 45 7.949 -16.285 2.476 1.00 0.00 O ATOM 1938 CB ARG D 45 6.262 -13.765 1.770 1.00 0.00 C ATOM 1939 CG ARG D 45 4.832 -13.423 1.349 1.00 0.00 C ATOM 1940 CD ARG D 45 4.866 -12.469 0.154 1.00 0.00 C ATOM 1941 NE ARG D 45 3.506 -12.146 -0.269 1.00 0.00 N ATOM 1942 CZ ARG D 45 2.847 -12.929 -1.116 1.00 0.00 C ATOM 1943 NH1 ARG D 45 3.410 -14.010 -1.580 1.00 0.00 N ATOM 1944 NH2 ARG D 45 1.633 -12.618 -1.483 1.00 0.00 N ATOM 0 H ARG D 45 5.799 -12.927 4.047 1.00 0.00 H new ATOM 0 HA ARG D 45 5.490 -15.474 2.827 1.00 0.00 H new ATOM 0 HB2 ARG D 45 6.810 -12.853 2.007 1.00 0.00 H new ATOM 0 HB3 ARG D 45 6.788 -14.249 0.948 1.00 0.00 H new ATOM 0 HG2 ARG D 45 4.292 -14.332 1.086 1.00 0.00 H new ATOM 0 HG3 ARG D 45 4.297 -12.963 2.180 1.00 0.00 H new ATOM 0 HD2 ARG D 45 5.398 -11.556 0.422 1.00 0.00 H new ATOM 0 HD3 ARG D 45 5.413 -12.926 -0.671 1.00 0.00 H new ATOM 0 HE ARG D 45 3.055 -11.305 0.092 1.00 0.00 H new ATOM 0 HH11 ARG D 45 4.357 -14.255 -1.293 1.00 0.00 H new ATOM 0 HH12 ARG D 45 2.903 -14.610 -2.230 1.00 0.00 H new ATOM 0 HH21 ARG D 45 1.191 -11.774 -1.119 1.00 0.00 H new ATOM 0 HH22 ARG D 45 1.127 -13.219 -2.133 1.00 0.00 H new ATOM 1958 N LEU D 46 8.366 -14.816 4.127 1.00 0.00 N ATOM 1959 CA LEU D 46 9.696 -15.348 4.382 1.00 0.00 C ATOM 1960 C LEU D 46 9.609 -16.810 4.825 1.00 0.00 C ATOM 1961 O LEU D 46 10.304 -17.676 4.293 1.00 0.00 O ATOM 1962 CB LEU D 46 10.382 -14.515 5.482 1.00 0.00 C ATOM 1963 CG LEU D 46 11.903 -14.576 5.306 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.576 -13.706 6.365 1.00 0.00 C ATOM 1965 CD2 LEU D 46 12.386 -16.026 5.443 1.00 0.00 C ATOM 0 H LEU D 46 8.097 -14.033 4.722 1.00 0.00 H new ATOM 0 HA LEU D 46 10.280 -15.293 3.463 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.042 -13.481 5.433 1.00 0.00 H new ATOM 0 HB3 LEU D 46 10.105 -14.895 6.465 1.00 0.00 H new ATOM 0 HG LEU D 46 12.165 -14.206 4.315 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.658 -13.750 6.239 1.00 0.00 H new ATOM 0 HD12 LEU D 46 12.240 -12.675 6.256 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.311 -14.071 7.357 1.00 0.00 H new ATOM 0 HD21 LEU D 46 13.468 -16.063 5.317 1.00 0.00 H new ATOM 0 HD22 LEU D 46 12.123 -16.405 6.430 1.00 0.00 H new ATOM 0 HD23 LEU D 46 11.911 -16.642 4.679 1.00 0.00 H new ATOM 1977 N PHE D 47 8.745 -17.078 5.795 1.00 0.00 N ATOM 1978 CA PHE D 47 8.570 -18.438 6.293 1.00 0.00 C ATOM 1979 C PHE D 47 8.001 -19.335 5.209 1.00 0.00 C ATOM 1980 O PHE D 47 8.452 -20.465 5.030 1.00 0.00 O ATOM 1981 CB PHE D 47 7.637 -18.436 7.504 1.00 0.00 C ATOM 1982 CG PHE D 47 8.360 -17.861 8.699 1.00 0.00 C ATOM 1983 CD1 PHE D 47 8.385 -16.478 8.905 1.00 0.00 C ATOM 1984 CD2 PHE D 47 9.007 -18.715 9.601 1.00 0.00 C ATOM 1985 CE1 PHE D 47 9.057 -15.946 10.011 1.00 0.00 C ATOM 1986 CE2 PHE D 47 9.679 -18.183 10.708 1.00 0.00 C ATOM 1987 CZ PHE D 47 9.703 -16.800 10.915 1.00 0.00 C ATOM 0 H PHE D 47 8.158 -16.379 6.250 1.00 0.00 H new ATOM 0 HA PHE D 47 9.545 -18.824 6.590 1.00 0.00 H new ATOM 0 HB2 PHE D 47 6.745 -17.848 7.288 1.00 0.00 H new ATOM 0 HB3 PHE D 47 7.304 -19.451 7.721 1.00 0.00 H new ATOM 0 HD1 PHE D 47 7.885 -15.820 8.210 1.00 0.00 H new ATOM 0 HD2 PHE D 47 8.988 -19.783 9.443 1.00 0.00 H new ATOM 0 HE1 PHE D 47 9.078 -14.878 10.168 1.00 0.00 H new ATOM 0 HE2 PHE D 47 10.179 -18.841 11.403 1.00 0.00 H new ATOM 0 HZ PHE D 47 10.219 -16.391 11.771 1.00 0.00 H new ATOM 1997 N PHE D 48 7.005 -18.827 4.484 1.00 0.00 N ATOM 1998 CA PHE D 48 6.372 -19.598 3.411 1.00 0.00 C ATOM 1999 C PHE D 48 6.573 -18.904 2.072 1.00 0.00 C ATOM 2000 O PHE D 48 6.186 -17.753 1.893 1.00 0.00 O ATOM 2001 CB PHE D 48 4.877 -19.746 3.694 1.00 0.00 C ATOM 2002 CG PHE D 48 4.669 -20.074 5.159 1.00 0.00 C ATOM 2003 CD1 PHE D 48 5.356 -21.146 5.746 1.00 0.00 C ATOM 2004 CD2 PHE D 48 3.790 -19.303 5.930 1.00 0.00 C ATOM 2005 CE1 PHE D 48 5.163 -21.444 7.097 1.00 0.00 C ATOM 2006 CE2 PHE D 48 3.597 -19.603 7.283 1.00 0.00 C ATOM 2007 CZ PHE D 48 4.284 -20.673 7.867 1.00 0.00 C ATOM 0 H PHE D 48 6.620 -17.892 4.617 1.00 0.00 H new ATOM 0 HA PHE D 48 6.833 -20.585 3.369 1.00 0.00 H new ATOM 0 HB2 PHE D 48 4.355 -18.824 3.439 1.00 0.00 H new ATOM 0 HB3 PHE D 48 4.454 -20.534 3.071 1.00 0.00 H new ATOM 0 HD1 PHE D 48 6.035 -21.742 5.153 1.00 0.00 H new ATOM 0 HD2 PHE D 48 3.261 -18.476 5.480 1.00 0.00 H new ATOM 0 HE1 PHE D 48 5.693 -22.270 7.548 1.00 0.00 H new ATOM 0 HE2 PHE D 48 2.918 -19.009 7.876 1.00 0.00 H new ATOM 0 HZ PHE D 48 4.136 -20.904 8.912 1.00 0.00 H new ATOM 2017 N LYS D 49 7.178 -19.622 1.129 1.00 0.00 N ATOM 2018 CA LYS D 49 7.423 -19.067 -0.198 1.00 0.00 C ATOM 2019 C LYS D 49 6.195 -19.245 -1.085 1.00 0.00 C ATOM 2020 O LYS D 49 5.501 -20.233 -0.913 1.00 0.00 O ATOM 2021 CB LYS D 49 8.624 -19.765 -0.841 1.00 0.00 C ATOM 2022 CG LYS D 49 9.893 -19.419 -0.059 1.00 0.00 C ATOM 2023 CD LYS D 49 11.091 -20.131 -0.689 1.00 0.00 C ATOM 2024 CE LYS D 49 12.347 -19.842 0.133 1.00 0.00 C ATOM 2025 NZ LYS D 49 12.688 -18.395 0.029 1.00 0.00 N ATOM 2026 OXT LYS D 49 5.967 -18.390 -1.926 1.00 0.00 O ATOM 0 H LYS D 49 7.505 -20.580 1.257 1.00 0.00 H new ATOM 0 HA LYS D 49 7.633 -18.002 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS D 49 8.471 -20.844 -0.847 1.00 0.00 H new ATOM 0 HB3 LYS D 49 8.727 -19.452 -1.880 1.00 0.00 H new ATOM 0 HG2 LYS D 49 10.053 -18.341 -0.064 1.00 0.00 H new ATOM 0 HG3 LYS D 49 9.784 -19.720 0.983 1.00 0.00 H new ATOM 0 HD2 LYS D 49 10.909 -21.205 -0.729 1.00 0.00 H new ATOM 0 HD3 LYS D 49 11.230 -19.793 -1.716 1.00 0.00 H new ATOM 0 HE2 LYS D 49 12.182 -20.114 1.176 1.00 0.00 H new ATOM 0 HE3 LYS D 49 13.178 -20.449 -0.227 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 13.671 -18.247 0.333 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 12.580 -18.083 -0.957 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 12.051 -17.843 0.638 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 2.772 8.696 0.735 1.00 0.00 S HETATM 2042 BR 3LW C 100 4.484 10.939 1.623 1.00 0.00 BR HETATM 2043 C1 3LW C 100 2.979 10.140 0.788 1.00 0.00 C HETATM 2044 C2 3LW C 100 1.997 10.821 0.189 1.00 0.00 C HETATM 2045 N2 3LW C 100 1.576 6.302 -0.030 1.00 0.00 N HETATM 2046 C3 3LW C 100 1.109 9.947 -0.288 1.00 0.00 C HETATM 2047 C5 3LW C 100 0.758 7.467 -0.380 1.00 0.00 C HETATM 2048 C10 3LW C 100 0.934 4.985 -0.035 1.00 0.00 C HETATM 2049 C12 3LW C 100 1.499 8.700 -0.004 1.00 0.00 C HETATM 2050 C61 3LW C 100 -0.191 4.893 1.036 1.00 0.00 C HETATM 2051 C62 3LW C 100 1.965 3.863 0.291 1.00 0.00 C HETATM 2052 C63 3LW C 100 0.292 4.633 -1.418 1.00 0.00 C HETATM 2053 C71 3LW C 100 -0.848 3.508 1.039 1.00 0.00 C HETATM 2054 C72 3LW C 100 1.296 2.480 0.301 1.00 0.00 C HETATM 2055 C73 3LW C 100 -0.360 3.249 -1.393 1.00 0.00 C HETATM 2056 C81 3LW C 100 0.193 2.442 1.366 1.00 0.00 C HETATM 2057 C82 3LW C 100 0.693 2.184 -1.075 1.00 0.00 C HETATM 2058 C83 3LW C 100 -1.466 3.225 -0.332 1.00 0.00 C