USER MOD reduce.3.24.130724 H: found=0, std=0, add=692, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 690 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 THR OG1 : rot 170:sc= -2.09! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.934 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc=-0.00909 USER MOD Single : A -2 LEU N :NH3+ -145:sc= -3.01! (180deg=-5.48!) USER MOD Single : A 10 SER OG : rot 97:sc= 0.183 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -150:sc= 0.0003 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -1.09 K(o=-1.1,f=-8.4!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 179:sc= -0.697 USER MOD Single : A 40 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0749) USER MOD Single : A 43 SER OG : rot 3:sc= -0.498 USER MOD Single : A 46 THR OG1 : rot 150:sc= 0.00808 USER MOD Single : A 51 THR OG1 : rot 105:sc= 1.04 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc=-0.00847 USER MOD Single : A 78 CYS SG : rot -57:sc= 0.398 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 154:sc= -0.174 (180deg=-0.899) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A -2 55.593 22.277 17.444 1.00 15.00 N ATOM 2 CA LEU A -2 54.754 21.252 16.752 1.00 15.00 C ATOM 3 C LEU A -2 55.085 19.823 17.192 1.00 15.00 C ATOM 4 O LEU A -2 56.235 19.423 17.207 1.00 15.00 O ATOM 5 CB LEU A -2 55.122 21.370 15.272 1.00 15.00 C ATOM 6 CG LEU A -2 54.498 22.639 14.687 1.00 15.00 C ATOM 7 CD1 LEU A -2 55.397 23.839 14.991 1.00 15.00 C ATOM 8 CD2 LEU A -2 54.354 22.484 13.171 1.00 15.00 C ATOM 0 H1 LEU A -2 55.028 23.134 17.609 1.00 15.00 H new ATOM 0 H2 LEU A -2 55.922 21.899 18.355 1.00 15.00 H new ATOM 0 H3 LEU A -2 56.414 22.512 16.850 1.00 15.00 H new ATOM 0 HA LEU A -2 53.702 21.428 16.976 1.00 15.00 H new ATOM 0 HB2 LEU A -2 56.206 21.400 15.158 1.00 15.00 H new ATOM 0 HB3 LEU A -2 54.768 20.494 14.728 1.00 15.00 H new ATOM 0 HG LEU A -2 53.516 22.798 15.133 1.00 15.00 H new ATOM 0 HD11 LEU A -2 54.952 24.742 14.574 1.00 15.00 H new ATOM 0 HD12 LEU A -2 55.502 23.951 16.070 1.00 15.00 H new ATOM 0 HD13 LEU A -2 56.379 23.680 14.546 1.00 15.00 H new ATOM 0 HD21 LEU A -2 53.910 23.387 12.753 1.00 15.00 H new ATOM 0 HD22 LEU A -2 55.336 22.324 12.727 1.00 15.00 H new ATOM 0 HD23 LEU A -2 53.713 21.630 12.952 1.00 15.00 H new ATOM 20 N GLU A -1 54.084 19.055 17.548 1.00 15.00 N ATOM 21 CA GLU A -1 54.326 17.645 17.979 1.00 15.00 C ATOM 22 C GLU A -1 53.299 16.677 17.378 1.00 15.00 C ATOM 23 O GLU A -1 52.240 16.455 17.938 1.00 15.00 O ATOM 24 CB GLU A -1 54.315 17.546 19.506 1.00 15.00 C ATOM 25 CG GLU A -1 54.757 16.194 20.043 1.00 15.00 C ATOM 26 CD GLU A -1 54.617 16.092 21.548 1.00 15.00 C ATOM 27 OE1 GLU A -1 53.568 16.517 22.079 1.00 15.00 O ATOM 28 OE2 GLU A -1 55.555 15.586 22.199 1.00 15.00 O ATOM 0 H GLU A -1 53.107 19.346 17.558 1.00 15.00 H new ATOM 0 HA GLU A -1 55.308 17.355 17.607 1.00 15.00 H new ATOM 0 HB2 GLU A -1 54.967 18.318 19.914 1.00 15.00 H new ATOM 0 HB3 GLU A -1 53.308 17.756 19.866 1.00 15.00 H new ATOM 0 HG2 GLU A -1 54.165 15.409 19.573 1.00 15.00 H new ATOM 0 HG3 GLU A -1 55.796 16.019 19.766 1.00 15.00 H new ATOM 35 N ASP A 0 53.610 16.104 16.241 1.00 15.00 N ATOM 36 CA ASP A 0 52.670 15.137 15.596 1.00 15.00 C ATOM 37 C ASP A 0 53.183 13.699 15.779 1.00 15.00 C ATOM 38 O ASP A 0 54.378 13.488 15.863 1.00 15.00 O ATOM 39 CB ASP A 0 52.663 15.519 14.116 1.00 15.00 C ATOM 40 CG ASP A 0 51.883 16.822 13.928 1.00 15.00 C ATOM 41 OD1 ASP A 0 50.792 16.918 14.465 1.00 15.00 O ATOM 42 OD2 ASP A 0 52.391 17.701 13.251 1.00 15.00 O ATOM 0 H ASP A 0 54.478 16.266 15.731 1.00 15.00 H new ATOM 0 HA ASP A 0 51.672 15.177 16.031 1.00 15.00 H new ATOM 0 HB2 ASP A 0 53.685 15.639 13.756 1.00 15.00 H new ATOM 0 HB3 ASP A 0 52.209 14.723 13.526 1.00 15.00 H new ATOM 47 N PRO A 1 52.267 12.747 15.839 1.00 15.00 N ATOM 48 CA PRO A 1 52.666 11.326 16.035 1.00 15.00 C ATOM 49 C PRO A 1 53.449 10.819 14.818 1.00 15.00 C ATOM 50 O PRO A 1 54.429 10.110 14.955 1.00 15.00 O ATOM 51 CB PRO A 1 51.336 10.582 16.180 1.00 15.00 C ATOM 52 CG PRO A 1 50.307 11.484 15.577 1.00 15.00 C ATOM 53 CD PRO A 1 50.806 12.894 15.732 1.00 15.00 C ATOM 0 HA PRO A 1 53.316 11.183 16.898 1.00 15.00 H new ATOM 0 HB2 PRO A 1 51.366 9.621 15.666 1.00 15.00 H new ATOM 0 HB3 PRO A 1 51.113 10.377 17.227 1.00 15.00 H new ATOM 0 HG2 PRO A 1 50.154 11.244 14.525 1.00 15.00 H new ATOM 0 HG3 PRO A 1 49.346 11.359 16.076 1.00 15.00 H new ATOM 0 HD2 PRO A 1 50.529 13.511 14.878 1.00 15.00 H new ATOM 0 HD3 PRO A 1 50.387 13.370 16.619 1.00 15.00 H new ATOM 61 N SER A 2 53.019 11.177 13.632 1.00 15.00 N ATOM 62 CA SER A 2 53.771 10.773 12.401 1.00 15.00 C ATOM 63 C SER A 2 55.067 11.580 12.296 1.00 15.00 C ATOM 64 O SER A 2 56.092 11.071 11.882 1.00 15.00 O ATOM 65 CB SER A 2 52.840 11.095 11.230 1.00 15.00 C ATOM 66 OG SER A 2 51.584 10.465 11.440 1.00 15.00 O ATOM 0 H SER A 2 52.180 11.732 13.463 1.00 15.00 H new ATOM 0 HA SER A 2 54.047 9.719 12.414 1.00 15.00 H new ATOM 0 HB2 SER A 2 52.708 12.173 11.141 1.00 15.00 H new ATOM 0 HB3 SER A 2 53.281 10.750 10.295 1.00 15.00 H new ATOM 0 HG SER A 2 50.985 10.671 10.692 1.00 15.00 H new ATOM 72 N GLY A 3 55.022 12.836 12.670 1.00 15.00 N ATOM 73 CA GLY A 3 56.250 13.686 12.635 1.00 15.00 C ATOM 74 C GLY A 3 57.236 13.228 13.717 1.00 15.00 C ATOM 75 O GLY A 3 58.435 13.399 13.580 1.00 15.00 O ATOM 0 H GLY A 3 54.181 13.310 13.000 1.00 15.00 H new ATOM 0 HA2 GLY A 3 56.719 13.622 11.653 1.00 15.00 H new ATOM 0 HA3 GLY A 3 55.984 14.731 12.793 1.00 15.00 H new ATOM 79 N GLY A 4 56.745 12.648 14.792 1.00 15.00 N ATOM 80 CA GLY A 4 57.646 12.210 15.904 1.00 15.00 C ATOM 81 C GLY A 4 58.641 11.163 15.396 1.00 15.00 C ATOM 82 O GLY A 4 59.774 11.110 15.838 1.00 15.00 O ATOM 0 H GLY A 4 55.754 12.460 14.944 1.00 15.00 H new ATOM 0 HA2 GLY A 4 58.184 13.069 16.306 1.00 15.00 H new ATOM 0 HA3 GLY A 4 57.054 11.794 16.719 1.00 15.00 H new ATOM 86 N THR A 5 58.223 10.330 14.472 1.00 15.00 N ATOM 87 CA THR A 5 59.147 9.299 13.909 1.00 15.00 C ATOM 88 C THR A 5 59.532 9.668 12.463 1.00 15.00 C ATOM 89 O THR A 5 58.659 9.823 11.629 1.00 15.00 O ATOM 90 CB THR A 5 58.345 7.998 13.931 1.00 15.00 C ATOM 91 OG1 THR A 5 57.785 7.812 15.223 1.00 15.00 O ATOM 92 CG2 THR A 5 59.263 6.823 13.596 1.00 15.00 C ATOM 0 H THR A 5 57.280 10.321 14.084 1.00 15.00 H new ATOM 0 HA THR A 5 60.074 9.218 14.477 1.00 15.00 H new ATOM 0 HB THR A 5 57.546 8.051 13.192 1.00 15.00 H new ATOM 0 HG1 THR A 5 57.269 6.979 15.239 1.00 15.00 H new ATOM 0 HG21 THR A 5 58.689 5.897 13.612 1.00 15.00 H new ATOM 0 HG22 THR A 5 59.691 6.967 12.604 1.00 15.00 H new ATOM 0 HG23 THR A 5 60.065 6.766 14.332 1.00 15.00 H new ATOM 100 N PRO A 6 60.823 9.799 12.200 1.00 15.00 N ATOM 101 CA PRO A 6 61.278 10.136 10.825 1.00 15.00 C ATOM 102 C PRO A 6 61.142 8.919 9.905 1.00 15.00 C ATOM 103 O PRO A 6 61.512 7.817 10.264 1.00 15.00 O ATOM 104 CB PRO A 6 62.746 10.514 11.011 1.00 15.00 C ATOM 105 CG PRO A 6 63.178 9.813 12.258 1.00 15.00 C ATOM 106 CD PRO A 6 61.959 9.656 13.129 1.00 15.00 C ATOM 0 HA PRO A 6 60.694 10.934 10.365 1.00 15.00 H new ATOM 0 HB2 PRO A 6 63.344 10.200 10.156 1.00 15.00 H new ATOM 0 HB3 PRO A 6 62.866 11.593 11.105 1.00 15.00 H new ATOM 0 HG2 PRO A 6 63.610 8.840 12.022 1.00 15.00 H new ATOM 0 HG3 PRO A 6 63.948 10.387 12.774 1.00 15.00 H new ATOM 0 HD2 PRO A 6 61.947 8.685 13.625 1.00 15.00 H new ATOM 0 HD3 PRO A 6 61.930 10.414 13.912 1.00 15.00 H new ATOM 114 N TYR A 7 60.613 9.115 8.720 1.00 15.00 N ATOM 115 CA TYR A 7 60.516 7.987 7.738 1.00 15.00 C ATOM 116 C TYR A 7 61.915 7.598 7.250 1.00 15.00 C ATOM 117 O TYR A 7 62.207 6.437 7.026 1.00 15.00 O ATOM 118 CB TYR A 7 59.674 8.525 6.578 1.00 15.00 C ATOM 119 CG TYR A 7 58.274 8.921 6.984 1.00 15.00 C ATOM 120 CD1 TYR A 7 57.990 10.265 7.326 1.00 15.00 C ATOM 121 CD2 TYR A 7 57.246 7.948 7.023 1.00 15.00 C ATOM 122 CE1 TYR A 7 56.677 10.637 7.707 1.00 15.00 C ATOM 123 CE2 TYR A 7 55.933 8.319 7.404 1.00 15.00 C ATOM 124 CZ TYR A 7 55.649 9.664 7.747 1.00 15.00 C ATOM 125 OH TYR A 7 54.370 10.026 8.118 1.00 15.00 O ATOM 0 H TYR A 7 60.244 10.007 8.390 1.00 15.00 H new ATOM 0 HA TYR A 7 60.068 7.097 8.179 1.00 15.00 H new ATOM 0 HB2 TYR A 7 60.177 9.390 6.145 1.00 15.00 H new ATOM 0 HB3 TYR A 7 59.617 7.766 5.798 1.00 15.00 H new ATOM 0 HD1 TYR A 7 58.774 11.007 7.296 1.00 15.00 H new ATOM 0 HD2 TYR A 7 57.463 6.923 6.762 1.00 15.00 H new ATOM 0 HE1 TYR A 7 56.460 11.663 7.967 1.00 15.00 H new ATOM 0 HE2 TYR A 7 55.149 7.577 7.433 1.00 15.00 H new ATOM 0 HH TYR A 7 53.787 9.239 8.091 1.00 15.00 H new ATOM 135 N ILE A 8 62.785 8.568 7.089 1.00 15.00 N ATOM 136 CA ILE A 8 64.178 8.264 6.620 1.00 15.00 C ATOM 137 C ILE A 8 64.911 7.441 7.690 1.00 15.00 C ATOM 138 O ILE A 8 64.846 7.742 8.867 1.00 15.00 O ATOM 139 CB ILE A 8 64.854 9.631 6.408 1.00 15.00 C ATOM 140 CG1 ILE A 8 64.096 10.423 5.335 1.00 15.00 C ATOM 141 CG2 ILE A 8 66.303 9.432 5.947 1.00 15.00 C ATOM 142 CD1 ILE A 8 64.553 11.882 5.357 1.00 15.00 C ATOM 0 H ILE A 8 62.592 9.555 7.261 1.00 15.00 H new ATOM 0 HA ILE A 8 64.190 7.679 5.701 1.00 15.00 H new ATOM 0 HB ILE A 8 64.841 10.179 7.350 1.00 15.00 H new ATOM 0 HG12 ILE A 8 64.278 9.989 4.352 1.00 15.00 H new ATOM 0 HG13 ILE A 8 63.023 10.365 5.516 1.00 15.00 H new ATOM 0 HG21 ILE A 8 66.774 10.404 5.799 1.00 15.00 H new ATOM 0 HG22 ILE A 8 66.852 8.874 6.705 1.00 15.00 H new ATOM 0 HG23 ILE A 8 66.313 8.877 5.009 1.00 15.00 H new ATOM 0 HD11 ILE A 8 64.014 12.444 4.594 1.00 15.00 H new ATOM 0 HD12 ILE A 8 64.348 12.313 6.337 1.00 15.00 H new ATOM 0 HD13 ILE A 8 65.623 11.931 5.155 1.00 15.00 H new ATOM 154 N GLY A 9 65.606 6.409 7.280 1.00 15.00 N ATOM 155 CA GLY A 9 66.271 5.498 8.261 1.00 15.00 C ATOM 156 C GLY A 9 65.406 4.251 8.524 1.00 15.00 C ATOM 157 O GLY A 9 65.803 3.375 9.270 1.00 15.00 O ATOM 0 H GLY A 9 65.742 6.157 6.301 1.00 15.00 H new ATOM 0 HA2 GLY A 9 67.246 5.196 7.880 1.00 15.00 H new ATOM 0 HA3 GLY A 9 66.445 6.029 9.197 1.00 15.00 H new ATOM 161 N SER A 10 64.234 4.156 7.927 1.00 15.00 N ATOM 162 CA SER A 10 63.396 2.929 8.103 1.00 15.00 C ATOM 163 C SER A 10 63.621 1.959 6.938 1.00 15.00 C ATOM 164 O SER A 10 63.917 2.367 5.831 1.00 15.00 O ATOM 165 CB SER A 10 61.952 3.430 8.111 1.00 15.00 C ATOM 166 OG SER A 10 61.785 4.364 9.170 1.00 15.00 O ATOM 0 H SER A 10 63.827 4.875 7.329 1.00 15.00 H new ATOM 0 HA SER A 10 63.645 2.390 9.017 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.712 3.898 7.156 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.265 2.593 8.237 1.00 15.00 H new ATOM 0 HG SER A 10 61.868 5.275 8.819 1.00 15.00 H new ATOM 172 N LYS A 11 63.482 0.678 7.186 1.00 15.00 N ATOM 173 CA LYS A 11 63.677 -0.334 6.100 1.00 15.00 C ATOM 174 C LYS A 11 62.391 -0.495 5.279 1.00 15.00 C ATOM 175 O LYS A 11 61.315 -0.680 5.823 1.00 15.00 O ATOM 176 CB LYS A 11 64.020 -1.640 6.821 1.00 15.00 C ATOM 177 CG LYS A 11 64.483 -2.682 5.802 1.00 15.00 C ATOM 178 CD LYS A 11 64.763 -4.007 6.516 1.00 15.00 C ATOM 179 CE LYS A 11 65.404 -4.991 5.534 1.00 15.00 C ATOM 180 NZ LYS A 11 65.418 -6.295 6.254 1.00 15.00 N ATOM 0 H LYS A 11 63.241 0.289 8.098 1.00 15.00 H new ATOM 0 HA LYS A 11 64.461 -0.037 5.404 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.803 -1.465 7.559 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.148 -2.008 7.362 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.719 -2.823 5.038 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.382 -2.334 5.293 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.425 -3.841 7.366 1.00 15.00 H new ATOM 0 HD3 LYS A 11 63.836 -4.423 6.911 1.00 15.00 H new ATOM 0 HE2 LYS A 11 64.831 -5.056 4.609 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.412 -4.678 5.263 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 65.844 -7.023 5.645 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 65.976 -6.204 7.127 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 64.444 -6.570 6.493 1.00 15.00 H new ATOM 194 N ILE A 12 62.502 -0.428 3.974 1.00 15.00 N ATOM 195 CA ILE A 12 61.289 -0.518 3.103 1.00 15.00 C ATOM 196 C ILE A 12 61.520 -1.548 1.991 1.00 15.00 C ATOM 197 O ILE A 12 62.636 -1.752 1.543 1.00 15.00 O ATOM 198 CB ILE A 12 61.098 0.891 2.516 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.876 1.900 3.653 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.875 0.907 1.589 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.929 3.325 3.097 1.00 15.00 C ATOM 0 H ILE A 12 63.384 -0.314 3.474 1.00 15.00 H new ATOM 0 HA ILE A 12 60.406 -0.839 3.656 1.00 15.00 H new ATOM 0 HB ILE A 12 61.990 1.162 1.951 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.912 1.721 4.128 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.639 1.771 4.421 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.744 1.907 1.176 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.025 0.196 0.777 1.00 15.00 H new ATOM 0 HG23 ILE A 12 58.986 0.629 2.155 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.771 4.038 3.907 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.904 3.502 2.643 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.150 3.451 2.345 1.00 15.00 H new ATOM 213 N SER A 13 60.469 -2.194 1.552 1.00 15.00 N ATOM 214 CA SER A 13 60.577 -3.143 0.408 1.00 15.00 C ATOM 215 C SER A 13 59.821 -2.580 -0.799 1.00 15.00 C ATOM 216 O SER A 13 58.704 -2.114 -0.677 1.00 15.00 O ATOM 217 CB SER A 13 59.922 -4.434 0.897 1.00 15.00 C ATOM 218 OG SER A 13 60.055 -5.437 -0.102 1.00 15.00 O ATOM 0 H SER A 13 59.532 -2.101 1.944 1.00 15.00 H new ATOM 0 HA SER A 13 61.609 -3.308 0.097 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.390 -4.764 1.824 1.00 15.00 H new ATOM 0 HB3 SER A 13 58.868 -4.260 1.116 1.00 15.00 H new ATOM 0 HG SER A 13 59.296 -6.054 -0.049 1.00 15.00 H new ATOM 224 N LEU A 14 60.427 -2.623 -1.958 1.00 15.00 N ATOM 225 CA LEU A 14 59.798 -2.018 -3.170 1.00 15.00 C ATOM 226 C LEU A 14 59.658 -3.067 -4.276 1.00 15.00 C ATOM 227 O LEU A 14 60.585 -3.802 -4.562 1.00 15.00 O ATOM 228 CB LEU A 14 60.767 -0.916 -3.599 1.00 15.00 C ATOM 229 CG LEU A 14 60.041 0.085 -4.498 1.00 15.00 C ATOM 230 CD1 LEU A 14 59.253 1.068 -3.630 1.00 15.00 C ATOM 231 CD2 LEU A 14 61.066 0.854 -5.337 1.00 15.00 C ATOM 0 H LEU A 14 61.337 -3.055 -2.117 1.00 15.00 H new ATOM 0 HA LEU A 14 58.797 -1.634 -2.971 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.167 -0.408 -2.722 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.614 -1.350 -4.131 1.00 15.00 H new ATOM 0 HG LEU A 14 59.357 -0.448 -5.159 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.734 1.783 -4.269 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.524 0.521 -3.031 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.938 1.601 -2.971 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.549 1.568 -5.978 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.750 1.388 -4.677 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.630 0.154 -5.954 1.00 15.00 H new ATOM 243 N ILE A 15 58.505 -3.140 -4.894 1.00 15.00 N ATOM 244 CA ILE A 15 58.311 -4.092 -6.031 1.00 15.00 C ATOM 245 C ILE A 15 58.246 -3.300 -7.341 1.00 15.00 C ATOM 246 O ILE A 15 57.415 -2.420 -7.497 1.00 15.00 O ATOM 247 CB ILE A 15 56.975 -4.802 -5.749 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.057 -5.549 -4.411 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.676 -5.809 -6.866 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.655 -5.994 -3.986 1.00 15.00 C ATOM 0 H ILE A 15 57.687 -2.579 -4.659 1.00 15.00 H new ATOM 0 HA ILE A 15 59.124 -4.812 -6.123 1.00 15.00 H new ATOM 0 HB ILE A 15 56.181 -4.056 -5.705 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.712 -6.415 -4.506 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.492 -4.903 -3.648 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.729 -6.309 -6.661 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.611 -5.286 -7.820 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.475 -6.549 -6.912 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.714 -6.524 -3.036 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.014 -5.120 -3.874 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.237 -6.655 -4.745 1.00 15.00 H new ATOM 262 N SER A 16 59.113 -3.609 -8.276 1.00 15.00 N ATOM 263 CA SER A 16 59.230 -2.773 -9.513 1.00 15.00 C ATOM 264 C SER A 16 58.371 -3.348 -10.645 1.00 15.00 C ATOM 265 O SER A 16 57.814 -4.423 -10.532 1.00 15.00 O ATOM 266 CB SER A 16 60.713 -2.826 -9.887 1.00 15.00 C ATOM 267 OG SER A 16 61.418 -1.836 -9.148 1.00 15.00 O ATOM 0 H SER A 16 59.747 -4.407 -8.235 1.00 15.00 H new ATOM 0 HA SER A 16 58.882 -1.753 -9.348 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.119 -3.815 -9.673 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.837 -2.655 -10.956 1.00 15.00 H new ATOM 0 HG SER A 16 62.369 -1.868 -9.383 1.00 15.00 H new ATOM 273 N LYS A 17 58.268 -2.631 -11.741 1.00 15.00 N ATOM 274 CA LYS A 17 57.412 -3.094 -12.887 1.00 15.00 C ATOM 275 C LYS A 17 57.883 -4.454 -13.428 1.00 15.00 C ATOM 276 O LYS A 17 57.137 -5.150 -14.093 1.00 15.00 O ATOM 277 CB LYS A 17 57.561 -2.017 -13.966 1.00 15.00 C ATOM 278 CG LYS A 17 56.526 -2.250 -15.069 1.00 15.00 C ATOM 279 CD LYS A 17 56.716 -1.209 -16.175 1.00 15.00 C ATOM 280 CE LYS A 17 55.576 -1.327 -17.190 1.00 15.00 C ATOM 281 NZ LYS A 17 55.551 -0.014 -17.892 1.00 15.00 N ATOM 0 H LYS A 17 58.742 -1.741 -11.893 1.00 15.00 H new ATOM 0 HA LYS A 17 56.377 -3.229 -12.574 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.425 -1.028 -13.528 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.567 -2.044 -14.385 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.634 -3.255 -15.478 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.519 -2.180 -14.658 1.00 15.00 H new ATOM 0 HD2 LYS A 17 56.733 -0.207 -15.747 1.00 15.00 H new ATOM 0 HD3 LYS A 17 57.675 -1.360 -16.670 1.00 15.00 H new ATOM 0 HE2 LYS A 17 55.752 -2.145 -17.888 1.00 15.00 H new ATOM 0 HE3 LYS A 17 54.626 -1.529 -16.695 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 54.794 -0.016 -18.605 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 55.375 0.745 -17.203 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 56.466 0.148 -18.359 1.00 15.00 H new ATOM 295 N ALA A 18 59.110 -4.839 -13.151 1.00 15.00 N ATOM 296 CA ALA A 18 59.632 -6.140 -13.680 1.00 15.00 C ATOM 297 C ALA A 18 59.338 -7.297 -12.709 1.00 15.00 C ATOM 298 O ALA A 18 59.917 -8.359 -12.822 1.00 15.00 O ATOM 299 CB ALA A 18 61.142 -5.935 -13.816 1.00 15.00 C ATOM 0 H ALA A 18 59.770 -4.308 -12.582 1.00 15.00 H new ATOM 0 HA ALA A 18 59.159 -6.405 -14.626 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.600 -6.847 -14.199 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.337 -5.113 -14.505 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.566 -5.698 -12.840 1.00 15.00 H new ATOM 305 N GLU A 19 58.445 -7.099 -11.755 1.00 15.00 N ATOM 306 CA GLU A 19 58.075 -8.191 -10.788 1.00 15.00 C ATOM 307 C GLU A 19 59.313 -8.691 -10.030 1.00 15.00 C ATOM 308 O GLU A 19 59.369 -9.828 -9.602 1.00 15.00 O ATOM 309 CB GLU A 19 57.452 -9.320 -11.626 1.00 15.00 C ATOM 310 CG GLU A 19 56.172 -8.815 -12.299 1.00 15.00 C ATOM 311 CD GLU A 19 55.492 -9.968 -13.041 1.00 15.00 C ATOM 312 OE1 GLU A 19 54.279 -10.068 -12.953 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.194 -10.730 -13.686 1.00 15.00 O ATOM 0 H GLU A 19 57.954 -6.218 -11.606 1.00 15.00 H new ATOM 0 HA GLU A 19 57.374 -7.829 -10.036 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.161 -9.660 -12.380 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.227 -10.176 -10.990 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.495 -8.401 -11.552 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.408 -8.010 -12.995 1.00 15.00 H new ATOM 320 N ILE A 20 60.302 -7.845 -9.866 1.00 15.00 N ATOM 321 CA ILE A 20 61.476 -8.203 -9.012 1.00 15.00 C ATOM 322 C ILE A 20 61.364 -7.463 -7.674 1.00 15.00 C ATOM 323 O ILE A 20 60.838 -6.365 -7.610 1.00 15.00 O ATOM 324 CB ILE A 20 62.714 -7.736 -9.795 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.792 -8.478 -11.134 1.00 15.00 C ATOM 326 CG2 ILE A 20 63.982 -8.034 -8.987 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.808 -7.786 -12.045 1.00 15.00 C ATOM 0 H ILE A 20 60.345 -6.918 -10.289 1.00 15.00 H new ATOM 0 HA ILE A 20 61.531 -9.270 -8.796 1.00 15.00 H new ATOM 0 HB ILE A 20 62.634 -6.664 -9.973 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.083 -9.516 -10.970 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.812 -8.493 -11.611 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.856 -7.701 -9.546 1.00 15.00 H new ATOM 0 HG22 ILE A 20 63.938 -7.507 -8.034 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.054 -9.106 -8.805 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.863 -8.315 -12.997 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.498 -6.756 -12.219 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.788 -7.794 -11.569 1.00 15.00 H new ATOM 339 N ARG A 21 61.854 -8.056 -6.611 1.00 15.00 N ATOM 340 CA ARG A 21 61.714 -7.427 -5.263 1.00 15.00 C ATOM 341 C ARG A 21 63.061 -6.873 -4.785 1.00 15.00 C ATOM 342 O ARG A 21 64.032 -7.598 -4.664 1.00 15.00 O ATOM 343 CB ARG A 21 61.247 -8.559 -4.348 1.00 15.00 C ATOM 344 CG ARG A 21 60.506 -7.972 -3.144 1.00 15.00 C ATOM 345 CD ARG A 21 59.655 -9.062 -2.487 1.00 15.00 C ATOM 346 NE ARG A 21 60.633 -9.940 -1.773 1.00 15.00 N ATOM 347 CZ ARG A 21 61.170 -9.585 -0.621 1.00 15.00 C ATOM 348 NH1 ARG A 21 60.885 -8.436 -0.052 1.00 15.00 N ATOM 349 NH2 ARG A 21 62.010 -10.394 -0.034 1.00 15.00 N ATOM 0 H ARG A 21 62.345 -8.950 -6.621 1.00 15.00 H new ATOM 0 HA ARG A 21 61.016 -6.590 -5.272 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.592 -9.237 -4.896 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.102 -9.145 -4.011 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.220 -7.570 -2.425 1.00 15.00 H new ATOM 0 HG3 ARG A 21 59.873 -7.144 -3.462 1.00 15.00 H new ATOM 0 HD2 ARG A 21 58.931 -8.633 -1.794 1.00 15.00 H new ATOM 0 HD3 ARG A 21 59.090 -9.624 -3.231 1.00 15.00 H new ATOM 0 HE ARG A 21 60.891 -10.836 -2.187 1.00 15.00 H new ATOM 0 HH11 ARG A 21 60.234 -7.792 -0.501 1.00 15.00 H new ATOM 0 HH12 ARG A 21 61.315 -8.188 0.839 1.00 15.00 H new ATOM 0 HH21 ARG A 21 62.244 -11.288 -0.466 1.00 15.00 H new ATOM 0 HH22 ARG A 21 62.432 -10.132 0.857 1.00 15.00 H new ATOM 363 N TYR A 22 63.116 -5.592 -4.515 1.00 15.00 N ATOM 364 CA TYR A 22 64.361 -4.981 -3.958 1.00 15.00 C ATOM 365 C TYR A 22 64.114 -4.529 -2.516 1.00 15.00 C ATOM 366 O TYR A 22 63.074 -3.982 -2.208 1.00 15.00 O ATOM 367 CB TYR A 22 64.641 -3.765 -4.840 1.00 15.00 C ATOM 368 CG TYR A 22 65.033 -4.107 -6.258 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.401 -4.210 -6.610 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.033 -4.317 -7.239 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.768 -4.521 -7.942 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.399 -4.628 -8.570 1.00 15.00 C ATOM 373 CZ TYR A 22 65.767 -4.731 -8.923 1.00 15.00 C ATOM 374 OH TYR A 22 66.125 -5.034 -10.220 1.00 15.00 O ATOM 0 H TYR A 22 62.345 -4.939 -4.658 1.00 15.00 H new ATOM 0 HA TYR A 22 65.195 -5.683 -3.950 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.753 -3.134 -4.863 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.438 -3.177 -4.386 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.164 -4.051 -5.863 1.00 15.00 H new ATOM 0 HD2 TYR A 22 62.990 -4.240 -6.971 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.811 -4.598 -8.210 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.635 -4.787 -9.317 1.00 15.00 H new ATOM 0 HH TYR A 22 65.318 -5.148 -10.764 1.00 15.00 H new ATOM 384 N GLU A 23 65.056 -4.752 -1.635 1.00 15.00 N ATOM 385 CA GLU A 23 64.929 -4.213 -0.245 1.00 15.00 C ATOM 386 C GLU A 23 66.102 -3.281 0.061 1.00 15.00 C ATOM 387 O GLU A 23 67.226 -3.545 -0.322 1.00 15.00 O ATOM 388 CB GLU A 23 64.969 -5.441 0.665 1.00 15.00 C ATOM 389 CG GLU A 23 63.677 -6.244 0.496 1.00 15.00 C ATOM 390 CD GLU A 23 63.540 -7.248 1.644 1.00 15.00 C ATOM 391 OE1 GLU A 23 63.125 -8.366 1.380 1.00 15.00 O ATOM 392 OE2 GLU A 23 63.846 -6.884 2.768 1.00 15.00 O ATOM 0 H GLU A 23 65.907 -5.284 -1.817 1.00 15.00 H new ATOM 0 HA GLU A 23 64.015 -3.636 -0.106 1.00 15.00 H new ATOM 0 HB2 GLU A 23 65.830 -6.062 0.418 1.00 15.00 H new ATOM 0 HB3 GLU A 23 65.085 -5.133 1.704 1.00 15.00 H new ATOM 0 HG2 GLU A 23 62.819 -5.572 0.483 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.686 -6.768 -0.460 1.00 15.00 H new ATOM 399 N GLY A 24 65.843 -2.196 0.749 1.00 15.00 N ATOM 400 CA GLY A 24 66.933 -1.233 1.087 1.00 15.00 C ATOM 401 C GLY A 24 66.444 -0.286 2.181 1.00 15.00 C ATOM 402 O GLY A 24 65.327 -0.400 2.649 1.00 15.00 O ATOM 0 H GLY A 24 64.918 -1.936 1.092 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.819 -1.771 1.424 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.222 -0.667 0.202 1.00 15.00 H new ATOM 406 N ILE A 25 67.266 0.649 2.592 1.00 15.00 N ATOM 407 CA ILE A 25 66.844 1.597 3.672 1.00 15.00 C ATOM 408 C ILE A 25 66.584 2.982 3.073 1.00 15.00 C ATOM 409 O ILE A 25 67.362 3.481 2.282 1.00 15.00 O ATOM 410 CB ILE A 25 68.012 1.647 4.674 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.409 0.223 5.124 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.598 2.470 5.900 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.214 -0.501 5.762 1.00 15.00 C ATOM 0 H ILE A 25 68.207 0.797 2.228 1.00 15.00 H new ATOM 0 HA ILE A 25 65.924 1.276 4.160 1.00 15.00 H new ATOM 0 HB ILE A 25 68.869 2.111 4.185 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.770 -0.346 4.267 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.230 0.278 5.839 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.424 2.506 6.610 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.343 3.483 5.589 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.732 2.007 6.374 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.517 -1.501 6.071 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.871 0.059 6.632 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.404 -0.575 5.036 1.00 15.00 H new ATOM 425 N LEU A 26 65.492 3.604 3.451 1.00 15.00 N ATOM 426 CA LEU A 26 65.126 4.938 2.868 1.00 15.00 C ATOM 427 C LEU A 26 66.208 5.975 3.184 1.00 15.00 C ATOM 428 O LEU A 26 66.392 6.355 4.324 1.00 15.00 O ATOM 429 CB LEU A 26 63.808 5.324 3.545 1.00 15.00 C ATOM 430 CG LEU A 26 63.133 6.446 2.758 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.457 5.864 1.516 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.080 7.120 3.639 1.00 15.00 C ATOM 0 H LEU A 26 64.834 3.244 4.142 1.00 15.00 H new ATOM 0 HA LEU A 26 65.032 4.896 1.783 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.149 4.458 3.599 1.00 15.00 H new ATOM 0 HB3 LEU A 26 63.995 5.647 4.569 1.00 15.00 H new ATOM 0 HG LEU A 26 63.881 7.179 2.455 1.00 15.00 H new ATOM 0 HD11 LEU A 26 61.976 6.665 0.955 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.205 5.380 0.888 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.708 5.132 1.819 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.597 7.921 3.080 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.333 6.385 3.940 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.559 7.534 4.526 1.00 15.00 H new ATOM 444 N TYR A 27 66.919 6.429 2.180 1.00 15.00 N ATOM 445 CA TYR A 27 68.022 7.409 2.418 1.00 15.00 C ATOM 446 C TYR A 27 67.511 8.842 2.236 1.00 15.00 C ATOM 447 O TYR A 27 67.689 9.682 3.098 1.00 15.00 O ATOM 448 CB TYR A 27 69.081 7.079 1.366 1.00 15.00 C ATOM 449 CG TYR A 27 70.335 7.911 1.495 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.108 7.844 2.680 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.737 8.758 0.434 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.283 8.626 2.804 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.912 9.539 0.558 1.00 15.00 C ATOM 454 CZ TYR A 27 72.685 9.473 1.744 1.00 15.00 C ATOM 455 OH TYR A 27 73.829 10.234 1.865 1.00 15.00 O ATOM 0 H TYR A 27 66.782 6.162 1.205 1.00 15.00 H new ATOM 0 HA TYR A 27 68.419 7.342 3.431 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.344 6.024 1.445 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.655 7.228 0.374 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.802 7.197 3.489 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.148 8.809 -0.470 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.872 8.576 3.708 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.219 10.185 -0.251 1.00 15.00 H new ATOM 0 HH TYR A 27 73.961 10.758 1.047 1.00 15.00 H new ATOM 465 N THR A 28 66.878 9.122 1.121 1.00 15.00 N ATOM 466 CA THR A 28 66.379 10.510 0.867 1.00 15.00 C ATOM 467 C THR A 28 65.042 10.472 0.122 1.00 15.00 C ATOM 468 O THR A 28 64.819 9.627 -0.725 1.00 15.00 O ATOM 469 CB THR A 28 67.455 11.173 0.004 1.00 15.00 C ATOM 470 OG1 THR A 28 67.822 10.296 -1.052 1.00 15.00 O ATOM 471 CG2 THR A 28 68.682 11.485 0.862 1.00 15.00 C ATOM 0 H THR A 28 66.686 8.450 0.378 1.00 15.00 H new ATOM 0 HA THR A 28 66.207 11.056 1.794 1.00 15.00 H new ATOM 0 HB THR A 28 67.063 12.100 -0.414 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.387 10.775 -1.694 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.447 11.957 0.245 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.399 12.160 1.669 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.076 10.560 1.284 1.00 15.00 H new ATOM 479 N ILE A 29 64.155 11.386 0.436 1.00 15.00 N ATOM 480 CA ILE A 29 62.815 11.411 -0.232 1.00 15.00 C ATOM 481 C ILE A 29 62.658 12.715 -1.026 1.00 15.00 C ATOM 482 O ILE A 29 62.809 13.796 -0.487 1.00 15.00 O ATOM 483 CB ILE A 29 61.787 11.347 0.911 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.003 10.080 1.751 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.368 11.320 0.329 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.195 10.179 3.049 1.00 15.00 C ATOM 0 H ILE A 29 64.303 12.119 1.130 1.00 15.00 H new ATOM 0 HA ILE A 29 62.685 10.586 -0.932 1.00 15.00 H new ATOM 0 HB ILE A 29 61.915 12.226 1.542 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.696 9.200 1.186 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.062 9.959 1.979 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.642 11.275 1.141 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.199 12.222 -0.259 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.253 10.444 -0.309 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.350 9.279 3.644 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.524 11.050 3.617 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.136 10.279 2.812 1.00 15.00 H new ATOM 498 N ASP A 30 62.357 12.617 -2.300 1.00 15.00 N ATOM 499 CA ASP A 30 62.134 13.844 -3.123 1.00 15.00 C ATOM 500 C ASP A 30 60.662 13.933 -3.534 1.00 15.00 C ATOM 501 O ASP A 30 60.246 13.325 -4.503 1.00 15.00 O ATOM 502 CB ASP A 30 63.029 13.667 -4.350 1.00 15.00 C ATOM 503 CG ASP A 30 63.111 14.987 -5.121 1.00 15.00 C ATOM 504 OD1 ASP A 30 63.278 16.013 -4.483 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.005 14.948 -6.335 1.00 15.00 O ATOM 0 H ASP A 30 62.256 11.736 -2.804 1.00 15.00 H new ATOM 0 HA ASP A 30 62.370 14.760 -2.581 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.026 13.351 -4.043 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.630 12.883 -4.993 1.00 15.00 H new ATOM 510 N THR A 31 59.877 14.686 -2.803 1.00 15.00 N ATOM 511 CA THR A 31 58.412 14.766 -3.101 1.00 15.00 C ATOM 512 C THR A 31 58.172 15.542 -4.399 1.00 15.00 C ATOM 513 O THR A 31 57.288 15.216 -5.169 1.00 15.00 O ATOM 514 CB THR A 31 57.795 15.509 -1.912 1.00 15.00 C ATOM 515 OG1 THR A 31 58.236 14.912 -0.702 1.00 15.00 O ATOM 516 CG2 THR A 31 56.269 15.432 -1.995 1.00 15.00 C ATOM 0 H THR A 31 60.188 15.250 -2.012 1.00 15.00 H new ATOM 0 HA THR A 31 57.971 13.778 -3.235 1.00 15.00 H new ATOM 0 HB THR A 31 58.105 16.554 -1.936 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.843 15.388 0.060 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.831 15.961 -1.148 1.00 15.00 H new ATOM 0 HG22 THR A 31 55.931 15.892 -2.924 1.00 15.00 H new ATOM 0 HG23 THR A 31 55.956 14.388 -1.972 1.00 15.00 H new ATOM 524 N GLU A 32 58.961 16.559 -4.652 1.00 15.00 N ATOM 525 CA GLU A 32 58.678 17.479 -5.806 1.00 15.00 C ATOM 526 C GLU A 32 58.654 16.707 -7.134 1.00 15.00 C ATOM 527 O GLU A 32 57.965 17.086 -8.063 1.00 15.00 O ATOM 528 CB GLU A 32 59.824 18.495 -5.803 1.00 15.00 C ATOM 529 CG GLU A 32 59.505 19.630 -6.780 1.00 15.00 C ATOM 530 CD GLU A 32 60.696 20.587 -6.859 1.00 15.00 C ATOM 531 OE1 GLU A 32 61.230 20.926 -5.816 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.055 20.964 -7.962 1.00 15.00 O ATOM 0 H GLU A 32 59.792 16.794 -4.109 1.00 15.00 H new ATOM 0 HA GLU A 32 57.703 17.957 -5.706 1.00 15.00 H new ATOM 0 HB2 GLU A 32 59.967 18.895 -4.799 1.00 15.00 H new ATOM 0 HB3 GLU A 32 60.757 18.008 -6.088 1.00 15.00 H new ATOM 0 HG2 GLU A 32 59.286 19.223 -7.767 1.00 15.00 H new ATOM 0 HG3 GLU A 32 58.615 20.167 -6.452 1.00 15.00 H new ATOM 539 N ASN A 33 59.400 15.633 -7.226 1.00 15.00 N ATOM 540 CA ASN A 33 59.472 14.871 -8.515 1.00 15.00 C ATOM 541 C ASN A 33 58.901 13.451 -8.365 1.00 15.00 C ATOM 542 O ASN A 33 59.102 12.611 -9.222 1.00 15.00 O ATOM 543 CB ASN A 33 60.963 14.809 -8.849 1.00 15.00 C ATOM 544 CG ASN A 33 61.478 16.212 -9.191 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.977 17.198 -8.688 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.469 16.341 -10.031 1.00 15.00 N ATOM 0 H ASN A 33 59.962 15.250 -6.466 1.00 15.00 H new ATOM 0 HA ASN A 33 58.884 15.353 -9.296 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.518 14.404 -8.003 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.129 14.136 -9.690 1.00 15.00 H new ATOM 0 HD21 ASN A 33 62.822 17.269 -10.265 1.00 15.00 H new ATOM 0 HD22 ASN A 33 62.890 15.514 -10.454 1.00 15.00 H new ATOM 553 N SER A 34 58.189 13.173 -7.288 1.00 15.00 N ATOM 554 CA SER A 34 57.659 11.785 -7.040 1.00 15.00 C ATOM 555 C SER A 34 58.769 10.728 -7.193 1.00 15.00 C ATOM 556 O SER A 34 58.594 9.720 -7.857 1.00 15.00 O ATOM 557 CB SER A 34 56.563 11.579 -8.091 1.00 15.00 C ATOM 558 OG SER A 34 55.389 12.272 -7.688 1.00 15.00 O ATOM 0 H SER A 34 57.952 13.854 -6.566 1.00 15.00 H new ATOM 0 HA SER A 34 57.277 11.677 -6.025 1.00 15.00 H new ATOM 0 HB2 SER A 34 56.900 11.945 -9.061 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.350 10.516 -8.207 1.00 15.00 H new ATOM 0 HG SER A 34 54.687 12.144 -8.359 1.00 15.00 H new ATOM 564 N THR A 35 59.907 10.955 -6.579 1.00 15.00 N ATOM 565 CA THR A 35 61.044 9.991 -6.711 1.00 15.00 C ATOM 566 C THR A 35 61.634 9.666 -5.335 1.00 15.00 C ATOM 567 O THR A 35 61.633 10.488 -4.437 1.00 15.00 O ATOM 568 CB THR A 35 62.081 10.711 -7.579 1.00 15.00 C ATOM 569 OG1 THR A 35 62.278 12.029 -7.086 1.00 15.00 O ATOM 570 CG2 THR A 35 61.596 10.776 -9.031 1.00 15.00 C ATOM 0 H THR A 35 60.096 11.767 -5.992 1.00 15.00 H new ATOM 0 HA THR A 35 60.727 9.045 -7.151 1.00 15.00 H new ATOM 0 HB THR A 35 63.021 10.161 -7.541 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.956 12.483 -7.629 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.340 11.290 -9.640 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.450 9.765 -9.412 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.652 11.320 -9.075 1.00 15.00 H new ATOM 578 N VAL A 36 62.140 8.468 -5.169 1.00 15.00 N ATOM 579 CA VAL A 36 62.745 8.072 -3.858 1.00 15.00 C ATOM 580 C VAL A 36 64.122 7.439 -4.097 1.00 15.00 C ATOM 581 O VAL A 36 64.308 6.679 -5.031 1.00 15.00 O ATOM 582 CB VAL A 36 61.768 7.051 -3.254 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.284 6.579 -1.890 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.390 7.697 -3.067 1.00 15.00 C ATOM 0 H VAL A 36 62.160 7.745 -5.888 1.00 15.00 H new ATOM 0 HA VAL A 36 62.894 8.921 -3.191 1.00 15.00 H new ATOM 0 HB VAL A 36 61.687 6.200 -3.931 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.587 5.856 -1.468 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.261 6.112 -2.012 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.371 7.433 -1.219 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.702 6.968 -2.639 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.477 8.552 -2.397 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.010 8.030 -4.033 1.00 15.00 H new ATOM 594 N ALA A 37 65.082 7.749 -3.260 1.00 15.00 N ATOM 595 CA ALA A 37 66.443 7.145 -3.411 1.00 15.00 C ATOM 596 C ALA A 37 66.733 6.209 -2.235 1.00 15.00 C ATOM 597 O ALA A 37 66.589 6.585 -1.084 1.00 15.00 O ATOM 598 CB ALA A 37 67.417 8.329 -3.412 1.00 15.00 C ATOM 0 H ALA A 37 64.982 8.395 -2.477 1.00 15.00 H new ATOM 0 HA ALA A 37 66.532 6.553 -4.322 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.437 7.961 -3.520 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.181 8.993 -4.243 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.326 8.876 -2.474 1.00 15.00 H new ATOM 604 N LEU A 38 67.145 4.997 -2.523 1.00 15.00 N ATOM 605 CA LEU A 38 67.425 4.008 -1.438 1.00 15.00 C ATOM 606 C LEU A 38 68.905 3.622 -1.454 1.00 15.00 C ATOM 607 O LEU A 38 69.486 3.419 -2.504 1.00 15.00 O ATOM 608 CB LEU A 38 66.560 2.790 -1.770 1.00 15.00 C ATOM 609 CG LEU A 38 65.106 3.057 -1.379 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.197 2.038 -2.068 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.952 2.923 0.137 1.00 15.00 C ATOM 0 H LEU A 38 67.300 4.650 -3.470 1.00 15.00 H new ATOM 0 HA LEU A 38 67.202 4.409 -0.449 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.624 2.568 -2.835 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.933 1.914 -1.239 1.00 15.00 H new ATOM 0 HG LEU A 38 64.828 4.065 -1.688 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.160 2.228 -1.789 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.304 2.127 -3.149 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.477 1.032 -1.757 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.916 3.113 0.416 1.00 15.00 H new ATOM 0 HD22 LEU A 38 65.231 1.915 0.443 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.600 3.645 0.634 1.00 15.00 H new ATOM 623 N ALA A 39 69.514 3.521 -0.299 1.00 15.00 N ATOM 624 CA ALA A 39 70.954 3.130 -0.233 1.00 15.00 C ATOM 625 C ALA A 39 71.095 1.783 0.482 1.00 15.00 C ATOM 626 O ALA A 39 70.180 1.331 1.149 1.00 15.00 O ATOM 627 CB ALA A 39 71.633 4.240 0.570 1.00 15.00 C ATOM 0 H ALA A 39 69.073 3.693 0.604 1.00 15.00 H new ATOM 0 HA ALA A 39 71.400 3.017 -1.221 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.697 4.024 0.662 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.499 5.193 0.058 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.187 4.296 1.563 1.00 15.00 H new ATOM 633 N LYS A 40 72.238 1.140 0.347 1.00 15.00 N ATOM 634 CA LYS A 40 72.448 -0.216 0.966 1.00 15.00 C ATOM 635 C LYS A 40 71.304 -1.167 0.578 1.00 15.00 C ATOM 636 O LYS A 40 70.608 -1.702 1.424 1.00 15.00 O ATOM 637 CB LYS A 40 72.477 0.023 2.483 1.00 15.00 C ATOM 638 CG LYS A 40 73.709 0.855 2.847 1.00 15.00 C ATOM 639 CD LYS A 40 73.798 0.994 4.368 1.00 15.00 C ATOM 640 CE LYS A 40 74.969 1.910 4.730 1.00 15.00 C ATOM 641 NZ LYS A 40 74.433 3.292 4.584 1.00 15.00 N ATOM 0 H LYS A 40 73.040 1.500 -0.170 1.00 15.00 H new ATOM 0 HA LYS A 40 73.370 -0.683 0.620 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.570 0.540 2.797 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.500 -0.930 3.011 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.610 0.378 2.461 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.646 1.840 2.384 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.867 1.403 4.761 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.934 0.014 4.826 1.00 15.00 H new ATOM 0 HE2 LYS A 40 75.315 1.726 5.747 1.00 15.00 H new ATOM 0 HE3 LYS A 40 75.820 1.744 4.069 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 75.137 3.888 4.104 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 73.558 3.268 4.022 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 74.229 3.686 5.524 1.00 15.00 H new ATOM 655 N VAL A 41 71.113 -1.378 -0.702 1.00 15.00 N ATOM 656 CA VAL A 41 69.932 -2.165 -1.173 1.00 15.00 C ATOM 657 C VAL A 41 70.393 -3.384 -1.987 1.00 15.00 C ATOM 658 O VAL A 41 71.411 -3.348 -2.653 1.00 15.00 O ATOM 659 CB VAL A 41 69.117 -1.180 -2.033 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.915 -0.754 -3.271 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.807 -1.844 -2.478 1.00 15.00 C ATOM 0 H VAL A 41 71.727 -1.038 -1.442 1.00 15.00 H new ATOM 0 HA VAL A 41 69.336 -2.561 -0.351 1.00 15.00 H new ATOM 0 HB VAL A 41 68.899 -0.296 -1.433 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.322 -0.059 -3.865 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.839 -0.268 -2.959 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.152 -1.633 -3.871 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.233 -1.145 -3.086 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.032 -2.735 -3.064 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.225 -2.124 -1.600 1.00 15.00 H new ATOM 671 N ARG A 42 69.643 -4.455 -1.930 1.00 15.00 N ATOM 672 CA ARG A 42 70.002 -5.678 -2.710 1.00 15.00 C ATOM 673 C ARG A 42 68.747 -6.277 -3.354 1.00 15.00 C ATOM 674 O ARG A 42 67.659 -6.172 -2.819 1.00 15.00 O ATOM 675 CB ARG A 42 70.592 -6.645 -1.683 1.00 15.00 C ATOM 676 CG ARG A 42 71.202 -7.850 -2.403 1.00 15.00 C ATOM 677 CD ARG A 42 71.636 -8.899 -1.373 1.00 15.00 C ATOM 678 NE ARG A 42 72.766 -8.269 -0.615 1.00 15.00 N ATOM 679 CZ ARG A 42 73.168 -8.752 0.544 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.603 -9.806 1.087 1.00 15.00 N ATOM 681 NH2 ARG A 42 74.156 -8.169 1.168 1.00 15.00 N ATOM 0 H ARG A 42 68.792 -4.535 -1.373 1.00 15.00 H new ATOM 0 HA ARG A 42 70.704 -5.464 -3.516 1.00 15.00 H new ATOM 0 HB2 ARG A 42 71.354 -6.140 -1.089 1.00 15.00 H new ATOM 0 HB3 ARG A 42 69.816 -6.976 -0.992 1.00 15.00 H new ATOM 0 HG2 ARG A 42 70.475 -8.281 -3.092 1.00 15.00 H new ATOM 0 HG3 ARG A 42 72.058 -7.535 -2.999 1.00 15.00 H new ATOM 0 HD2 ARG A 42 70.813 -9.160 -0.707 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.955 -9.820 -1.861 1.00 15.00 H new ATOM 0 HE ARG A 42 73.233 -7.450 -1.004 1.00 15.00 H new ATOM 0 HH11 ARG A 42 71.832 -10.273 0.611 1.00 15.00 H new ATOM 0 HH12 ARG A 42 72.936 -10.157 1.985 1.00 15.00 H new ATOM 0 HH21 ARG A 42 74.606 -7.351 0.758 1.00 15.00 H new ATOM 0 HH22 ARG A 42 74.477 -8.532 2.065 1.00 15.00 H new ATOM 695 N SER A 43 68.897 -6.899 -4.498 1.00 15.00 N ATOM 696 CA SER A 43 67.732 -7.565 -5.157 1.00 15.00 C ATOM 697 C SER A 43 67.727 -9.058 -4.809 1.00 15.00 C ATOM 698 O SER A 43 68.739 -9.727 -4.915 1.00 15.00 O ATOM 699 CB SER A 43 67.953 -7.348 -6.657 1.00 15.00 C ATOM 700 OG SER A 43 68.994 -8.202 -7.116 1.00 15.00 O ATOM 0 H SER A 43 69.779 -6.974 -5.005 1.00 15.00 H new ATOM 0 HA SER A 43 66.773 -7.162 -4.832 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.033 -7.554 -7.204 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.212 -6.307 -6.850 1.00 15.00 H new ATOM 0 HG SER A 43 69.307 -8.764 -6.376 1.00 15.00 H new ATOM 706 N PHE A 44 66.597 -9.581 -4.396 1.00 15.00 N ATOM 707 CA PHE A 44 66.565 -10.991 -3.887 1.00 15.00 C ATOM 708 C PHE A 44 66.688 -11.986 -5.045 1.00 15.00 C ATOM 709 O PHE A 44 67.370 -12.989 -4.934 1.00 15.00 O ATOM 710 CB PHE A 44 65.208 -11.142 -3.192 1.00 15.00 C ATOM 711 CG PHE A 44 65.242 -10.784 -1.725 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.064 -11.793 -0.747 1.00 15.00 C ATOM 713 CD2 PHE A 44 65.451 -9.442 -1.328 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.097 -11.459 0.628 1.00 15.00 C ATOM 715 CE2 PHE A 44 65.485 -9.108 0.048 1.00 15.00 C ATOM 716 CZ PHE A 44 65.307 -10.116 1.026 1.00 15.00 C ATOM 0 H PHE A 44 65.700 -9.096 -4.389 1.00 15.00 H new ATOM 0 HA PHE A 44 67.394 -11.194 -3.209 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.478 -10.509 -3.696 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.866 -12.171 -3.299 1.00 15.00 H new ATOM 0 HD1 PHE A 44 64.903 -12.817 -1.050 1.00 15.00 H new ATOM 0 HD2 PHE A 44 65.585 -8.673 -2.074 1.00 15.00 H new ATOM 0 HE1 PHE A 44 64.962 -12.228 1.374 1.00 15.00 H new ATOM 0 HE2 PHE A 44 65.647 -8.084 0.351 1.00 15.00 H new ATOM 0 HZ PHE A 44 65.331 -9.861 2.075 1.00 15.00 H new ATOM 726 N GLY A 45 66.036 -11.719 -6.150 1.00 15.00 N ATOM 727 CA GLY A 45 66.155 -12.627 -7.331 1.00 15.00 C ATOM 728 C GLY A 45 65.085 -12.280 -8.365 1.00 15.00 C ATOM 729 O GLY A 45 64.213 -11.465 -8.123 1.00 15.00 O ATOM 0 H GLY A 45 65.427 -10.912 -6.284 1.00 15.00 H new ATOM 0 HA2 GLY A 45 67.146 -12.532 -7.775 1.00 15.00 H new ATOM 0 HA3 GLY A 45 66.045 -13.664 -7.015 1.00 15.00 H new ATOM 733 N THR A 46 65.149 -12.898 -9.519 1.00 15.00 N ATOM 734 CA THR A 46 64.071 -12.725 -10.543 1.00 15.00 C ATOM 735 C THR A 46 63.320 -14.049 -10.773 1.00 15.00 C ATOM 736 O THR A 46 62.208 -14.054 -11.268 1.00 15.00 O ATOM 737 CB THR A 46 64.803 -12.303 -11.819 1.00 15.00 C ATOM 738 OG1 THR A 46 65.815 -13.254 -12.117 1.00 15.00 O ATOM 739 CG2 THR A 46 65.440 -10.924 -11.626 1.00 15.00 C ATOM 0 H THR A 46 65.908 -13.520 -9.798 1.00 15.00 H new ATOM 0 HA THR A 46 63.327 -11.992 -10.230 1.00 15.00 H new ATOM 0 HB THR A 46 64.090 -12.254 -12.642 1.00 15.00 H new ATOM 0 HG1 THR A 46 65.951 -13.294 -13.087 1.00 15.00 H new ATOM 0 HG21 THR A 46 65.959 -10.632 -12.539 1.00 15.00 H new ATOM 0 HG22 THR A 46 64.664 -10.193 -11.400 1.00 15.00 H new ATOM 0 HG23 THR A 46 66.152 -10.964 -10.801 1.00 15.00 H new ATOM 747 N GLU A 47 63.917 -15.168 -10.416 1.00 15.00 N ATOM 748 CA GLU A 47 63.268 -16.498 -10.673 1.00 15.00 C ATOM 749 C GLU A 47 61.934 -16.607 -9.926 1.00 15.00 C ATOM 750 O GLU A 47 61.023 -17.282 -10.368 1.00 15.00 O ATOM 751 CB GLU A 47 64.259 -17.543 -10.149 1.00 15.00 C ATOM 752 CG GLU A 47 63.808 -18.940 -10.584 1.00 15.00 C ATOM 753 CD GLU A 47 64.730 -19.991 -9.963 1.00 15.00 C ATOM 754 OE1 GLU A 47 65.933 -19.794 -10.003 1.00 15.00 O ATOM 755 OE2 GLU A 47 64.217 -20.976 -9.459 1.00 15.00 O ATOM 0 H GLU A 47 64.827 -15.216 -9.957 1.00 15.00 H new ATOM 0 HA GLU A 47 63.048 -16.638 -11.731 1.00 15.00 H new ATOM 0 HB2 GLU A 47 65.258 -17.336 -10.533 1.00 15.00 H new ATOM 0 HB3 GLU A 47 64.318 -17.491 -9.062 1.00 15.00 H new ATOM 0 HG2 GLU A 47 62.778 -19.115 -10.272 1.00 15.00 H new ATOM 0 HG3 GLU A 47 63.830 -19.019 -11.671 1.00 15.00 H new ATOM 762 N ASP A 48 61.814 -15.948 -8.795 1.00 15.00 N ATOM 763 CA ASP A 48 60.522 -15.980 -8.028 1.00 15.00 C ATOM 764 C ASP A 48 59.383 -15.412 -8.886 1.00 15.00 C ATOM 765 O ASP A 48 58.244 -15.828 -8.775 1.00 15.00 O ATOM 766 CB ASP A 48 60.755 -15.097 -6.798 1.00 15.00 C ATOM 767 CG ASP A 48 59.626 -15.317 -5.790 1.00 15.00 C ATOM 768 OD1 ASP A 48 59.928 -15.461 -4.616 1.00 15.00 O ATOM 769 OD2 ASP A 48 58.480 -15.338 -6.206 1.00 15.00 O ATOM 0 H ASP A 48 62.554 -15.389 -8.369 1.00 15.00 H new ATOM 0 HA ASP A 48 60.239 -16.995 -7.749 1.00 15.00 H new ATOM 0 HB2 ASP A 48 61.716 -15.337 -6.342 1.00 15.00 H new ATOM 0 HB3 ASP A 48 60.795 -14.048 -7.092 1.00 15.00 H new ATOM 774 N ARG A 49 59.692 -14.463 -9.736 1.00 15.00 N ATOM 775 CA ARG A 49 58.667 -13.910 -10.670 1.00 15.00 C ATOM 776 C ARG A 49 59.128 -14.111 -12.127 1.00 15.00 C ATOM 777 O ARG A 49 59.869 -13.299 -12.647 1.00 15.00 O ATOM 778 CB ARG A 49 58.590 -12.420 -10.330 1.00 15.00 C ATOM 779 CG ARG A 49 57.564 -12.198 -9.215 1.00 15.00 C ATOM 780 CD ARG A 49 58.203 -12.508 -7.857 1.00 15.00 C ATOM 781 NE ARG A 49 57.414 -11.719 -6.857 1.00 15.00 N ATOM 782 CZ ARG A 49 57.865 -11.514 -5.634 1.00 15.00 C ATOM 783 NH1 ARG A 49 59.023 -11.991 -5.237 1.00 15.00 N ATOM 784 NH2 ARG A 49 57.142 -10.822 -4.797 1.00 15.00 N ATOM 0 H ARG A 49 60.619 -14.046 -9.822 1.00 15.00 H new ATOM 0 HA ARG A 49 57.698 -14.400 -10.569 1.00 15.00 H new ATOM 0 HB2 ARG A 49 59.569 -12.058 -10.014 1.00 15.00 H new ATOM 0 HB3 ARG A 49 58.309 -11.849 -11.215 1.00 15.00 H new ATOM 0 HG2 ARG A 49 57.209 -11.168 -9.234 1.00 15.00 H new ATOM 0 HG3 ARG A 49 56.696 -12.837 -9.374 1.00 15.00 H new ATOM 0 HD2 ARG A 49 58.161 -13.575 -7.637 1.00 15.00 H new ATOM 0 HD3 ARG A 49 59.254 -12.221 -7.843 1.00 15.00 H new ATOM 0 HE ARG A 49 56.510 -11.332 -7.127 1.00 15.00 H new ATOM 0 HH11 ARG A 49 59.598 -12.535 -5.880 1.00 15.00 H new ATOM 0 HH12 ARG A 49 59.347 -11.817 -4.286 1.00 15.00 H new ATOM 0 HH21 ARG A 49 56.240 -10.447 -5.091 1.00 15.00 H new ATOM 0 HH22 ARG A 49 57.479 -10.656 -3.849 1.00 15.00 H new ATOM 798 N PRO A 50 58.676 -15.190 -12.747 1.00 15.00 N ATOM 799 CA PRO A 50 59.151 -15.537 -14.119 1.00 15.00 C ATOM 800 C PRO A 50 58.912 -14.380 -15.100 1.00 15.00 C ATOM 801 O PRO A 50 57.840 -13.806 -15.146 1.00 15.00 O ATOM 802 CB PRO A 50 58.315 -16.760 -14.505 1.00 15.00 C ATOM 803 CG PRO A 50 57.807 -17.319 -13.215 1.00 15.00 C ATOM 804 CD PRO A 50 57.700 -16.172 -12.247 1.00 15.00 C ATOM 0 HA PRO A 50 60.223 -15.734 -14.149 1.00 15.00 H new ATOM 0 HB2 PRO A 50 57.492 -16.481 -15.163 1.00 15.00 H new ATOM 0 HB3 PRO A 50 58.917 -17.494 -15.041 1.00 15.00 H new ATOM 0 HG2 PRO A 50 56.837 -17.795 -13.357 1.00 15.00 H new ATOM 0 HG3 PRO A 50 58.484 -18.083 -12.833 1.00 15.00 H new ATOM 0 HD2 PRO A 50 56.692 -15.758 -12.229 1.00 15.00 H new ATOM 0 HD3 PRO A 50 57.935 -16.485 -11.230 1.00 15.00 H new ATOM 812 N THR A 51 59.911 -14.043 -15.880 1.00 15.00 N ATOM 813 CA THR A 51 59.763 -12.939 -16.878 1.00 15.00 C ATOM 814 C THR A 51 59.957 -13.484 -18.293 1.00 15.00 C ATOM 815 O THR A 51 60.455 -14.580 -18.480 1.00 15.00 O ATOM 816 CB THR A 51 60.869 -11.941 -16.531 1.00 15.00 C ATOM 817 OG1 THR A 51 62.116 -12.621 -16.470 1.00 15.00 O ATOM 818 CG2 THR A 51 60.571 -11.293 -15.179 1.00 15.00 C ATOM 0 H THR A 51 60.828 -14.489 -15.867 1.00 15.00 H new ATOM 0 HA THR A 51 58.775 -12.479 -16.845 1.00 15.00 H new ATOM 0 HB THR A 51 60.914 -11.167 -17.298 1.00 15.00 H new ATOM 0 HG1 THR A 51 62.641 -12.414 -17.271 1.00 15.00 H new ATOM 0 HG21 THR A 51 61.360 -10.582 -14.934 1.00 15.00 H new ATOM 0 HG22 THR A 51 59.615 -10.771 -15.228 1.00 15.00 H new ATOM 0 HG23 THR A 51 60.524 -12.063 -14.409 1.00 15.00 H new ATOM 826 N ASP A 52 59.568 -12.726 -19.288 1.00 15.00 N ATOM 827 CA ASP A 52 59.782 -13.171 -20.703 1.00 15.00 C ATOM 828 C ASP A 52 61.245 -12.964 -21.137 1.00 15.00 C ATOM 829 O ASP A 52 61.664 -13.486 -22.153 1.00 15.00 O ATOM 830 CB ASP A 52 58.849 -12.296 -21.547 1.00 15.00 C ATOM 831 CG ASP A 52 57.393 -12.638 -21.224 1.00 15.00 C ATOM 832 OD1 ASP A 52 56.609 -11.715 -21.073 1.00 15.00 O ATOM 833 OD2 ASP A 52 57.085 -13.815 -21.135 1.00 15.00 O ATOM 0 H ASP A 52 59.112 -11.820 -19.184 1.00 15.00 H new ATOM 0 HA ASP A 52 59.572 -14.234 -20.821 1.00 15.00 H new ATOM 0 HB2 ASP A 52 59.039 -11.242 -21.343 1.00 15.00 H new ATOM 0 HB3 ASP A 52 59.044 -12.456 -22.607 1.00 15.00 H new ATOM 838 N ARG A 53 62.024 -12.213 -20.383 1.00 15.00 N ATOM 839 CA ARG A 53 63.469 -12.033 -20.734 1.00 15.00 C ATOM 840 C ARG A 53 64.362 -12.586 -19.603 1.00 15.00 C ATOM 841 O ARG A 53 64.056 -12.388 -18.441 1.00 15.00 O ATOM 842 CB ARG A 53 63.673 -10.517 -20.909 1.00 15.00 C ATOM 843 CG ARG A 53 63.252 -9.756 -19.642 1.00 15.00 C ATOM 844 CD ARG A 53 63.643 -8.279 -19.777 1.00 15.00 C ATOM 845 NE ARG A 53 62.551 -7.519 -19.089 1.00 15.00 N ATOM 846 CZ ARG A 53 62.467 -7.470 -17.773 1.00 15.00 C ATOM 847 NH1 ARG A 53 63.328 -8.095 -17.004 1.00 15.00 N ATOM 848 NH2 ARG A 53 61.501 -6.785 -17.224 1.00 15.00 N ATOM 0 H ARG A 53 61.719 -11.720 -19.544 1.00 15.00 H new ATOM 0 HA ARG A 53 63.739 -12.572 -21.642 1.00 15.00 H new ATOM 0 HB2 ARG A 53 64.720 -10.310 -21.131 1.00 15.00 H new ATOM 0 HB3 ARG A 53 63.091 -10.164 -21.760 1.00 15.00 H new ATOM 0 HG2 ARG A 53 62.176 -9.846 -19.492 1.00 15.00 H new ATOM 0 HG3 ARG A 53 63.733 -10.192 -18.767 1.00 15.00 H new ATOM 0 HD2 ARG A 53 64.610 -8.084 -19.314 1.00 15.00 H new ATOM 0 HD3 ARG A 53 63.726 -7.988 -20.824 1.00 15.00 H new ATOM 0 HE ARG A 53 61.856 -7.028 -19.651 1.00 15.00 H new ATOM 0 HH11 ARG A 53 64.086 -8.636 -17.421 1.00 15.00 H new ATOM 0 HH12 ARG A 53 63.239 -8.040 -15.989 1.00 15.00 H new ATOM 0 HH21 ARG A 53 60.824 -6.297 -17.811 1.00 15.00 H new ATOM 0 HH22 ARG A 53 61.423 -6.738 -16.208 1.00 15.00 H new ATOM 862 N PRO A 54 65.441 -13.265 -19.963 1.00 15.00 N ATOM 863 CA PRO A 54 66.383 -13.784 -18.935 1.00 15.00 C ATOM 864 C PRO A 54 67.101 -12.624 -18.233 1.00 15.00 C ATOM 865 O PRO A 54 67.329 -11.582 -18.819 1.00 15.00 O ATOM 866 CB PRO A 54 67.382 -14.643 -19.724 1.00 15.00 C ATOM 867 CG PRO A 54 66.821 -14.770 -21.106 1.00 15.00 C ATOM 868 CD PRO A 54 65.881 -13.617 -21.321 1.00 15.00 C ATOM 0 HA PRO A 54 65.877 -14.353 -18.155 1.00 15.00 H new ATOM 0 HB2 PRO A 54 68.366 -14.176 -19.745 1.00 15.00 H new ATOM 0 HB3 PRO A 54 67.504 -15.622 -19.262 1.00 15.00 H new ATOM 0 HG2 PRO A 54 67.620 -14.756 -21.847 1.00 15.00 H new ATOM 0 HG3 PRO A 54 66.297 -15.719 -21.221 1.00 15.00 H new ATOM 0 HD2 PRO A 54 66.380 -12.780 -21.809 1.00 15.00 H new ATOM 0 HD3 PRO A 54 65.039 -13.900 -21.954 1.00 15.00 H new ATOM 876 N ILE A 55 67.458 -12.804 -16.983 1.00 15.00 N ATOM 877 CA ILE A 55 68.247 -11.757 -16.260 1.00 15.00 C ATOM 878 C ILE A 55 69.645 -12.298 -15.940 1.00 15.00 C ATOM 879 O ILE A 55 69.803 -13.448 -15.572 1.00 15.00 O ATOM 880 CB ILE A 55 67.463 -11.466 -14.965 1.00 15.00 C ATOM 881 CG1 ILE A 55 66.020 -11.024 -15.298 1.00 15.00 C ATOM 882 CG2 ILE A 55 68.168 -10.360 -14.166 1.00 15.00 C ATOM 883 CD1 ILE A 55 66.018 -9.770 -16.189 1.00 15.00 C ATOM 0 H ILE A 55 67.236 -13.633 -16.432 1.00 15.00 H new ATOM 0 HA ILE A 55 68.376 -10.852 -16.853 1.00 15.00 H new ATOM 0 HB ILE A 55 67.425 -12.377 -14.368 1.00 15.00 H new ATOM 0 HG12 ILE A 55 65.495 -11.835 -15.804 1.00 15.00 H new ATOM 0 HG13 ILE A 55 65.477 -10.820 -14.375 1.00 15.00 H new ATOM 0 HG21 ILE A 55 67.609 -10.159 -13.252 1.00 15.00 H new ATOM 0 HG22 ILE A 55 69.177 -10.683 -13.911 1.00 15.00 H new ATOM 0 HG23 ILE A 55 68.219 -9.452 -14.768 1.00 15.00 H new ATOM 0 HD11 ILE A 55 64.990 -9.481 -16.408 1.00 15.00 H new ATOM 0 HD12 ILE A 55 66.522 -8.954 -15.670 1.00 15.00 H new ATOM 0 HD13 ILE A 55 66.541 -9.985 -17.121 1.00 15.00 H new ATOM 895 N ALA A 56 70.658 -11.476 -16.077 1.00 15.00 N ATOM 896 CA ALA A 56 72.056 -11.948 -15.819 1.00 15.00 C ATOM 897 C ALA A 56 72.252 -12.230 -14.319 1.00 15.00 C ATOM 898 O ALA A 56 71.588 -11.626 -13.498 1.00 15.00 O ATOM 899 CB ALA A 56 72.964 -10.800 -16.270 1.00 15.00 C ATOM 0 H ALA A 56 70.577 -10.498 -16.356 1.00 15.00 H new ATOM 0 HA ALA A 56 72.279 -12.872 -16.352 1.00 15.00 H new ATOM 0 HB1 ALA A 56 74.006 -11.076 -16.110 1.00 15.00 H new ATOM 0 HB2 ALA A 56 72.800 -10.601 -17.329 1.00 15.00 H new ATOM 0 HB3 ALA A 56 72.733 -9.905 -15.692 1.00 15.00 H new ATOM 905 N PRO A 57 73.159 -13.139 -14.000 1.00 15.00 N ATOM 906 CA PRO A 57 73.432 -13.469 -12.573 1.00 15.00 C ATOM 907 C PRO A 57 73.997 -12.248 -11.835 1.00 15.00 C ATOM 908 O PRO A 57 74.759 -11.477 -12.389 1.00 15.00 O ATOM 909 CB PRO A 57 74.472 -14.596 -12.634 1.00 15.00 C ATOM 910 CG PRO A 57 74.479 -15.071 -14.052 1.00 15.00 C ATOM 911 CD PRO A 57 73.999 -13.934 -14.909 1.00 15.00 C ATOM 0 HA PRO A 57 72.532 -13.764 -12.034 1.00 15.00 H new ATOM 0 HB2 PRO A 57 75.457 -14.235 -12.338 1.00 15.00 H new ATOM 0 HB3 PRO A 57 74.211 -15.405 -11.952 1.00 15.00 H new ATOM 0 HG2 PRO A 57 75.482 -15.379 -14.349 1.00 15.00 H new ATOM 0 HG3 PRO A 57 73.831 -15.940 -14.169 1.00 15.00 H new ATOM 0 HD2 PRO A 57 74.831 -13.348 -15.299 1.00 15.00 H new ATOM 0 HD3 PRO A 57 73.431 -14.292 -15.768 1.00 15.00 H new ATOM 919 N ARG A 58 73.623 -12.073 -10.591 1.00 15.00 N ATOM 920 CA ARG A 58 74.157 -10.926 -9.793 1.00 15.00 C ATOM 921 C ARG A 58 74.030 -11.217 -8.291 1.00 15.00 C ATOM 922 O ARG A 58 72.992 -11.646 -7.822 1.00 15.00 O ATOM 923 CB ARG A 58 73.302 -9.713 -10.196 1.00 15.00 C ATOM 924 CG ARG A 58 71.820 -9.971 -9.887 1.00 15.00 C ATOM 925 CD ARG A 58 70.973 -8.826 -10.452 1.00 15.00 C ATOM 926 NE ARG A 58 69.589 -9.058 -9.924 1.00 15.00 N ATOM 927 CZ ARG A 58 68.687 -8.095 -9.910 1.00 15.00 C ATOM 928 NH1 ARG A 58 68.953 -6.894 -10.373 1.00 15.00 N ATOM 929 NH2 ARG A 58 67.500 -8.342 -9.431 1.00 15.00 N ATOM 0 H ARG A 58 72.969 -12.677 -10.093 1.00 15.00 H new ATOM 0 HA ARG A 58 75.215 -10.748 -9.987 1.00 15.00 H new ATOM 0 HB2 ARG A 58 73.642 -8.827 -9.660 1.00 15.00 H new ATOM 0 HB3 ARG A 58 73.427 -9.510 -11.260 1.00 15.00 H new ATOM 0 HG2 ARG A 58 71.506 -10.919 -10.324 1.00 15.00 H new ATOM 0 HG3 ARG A 58 71.671 -10.051 -8.810 1.00 15.00 H new ATOM 0 HD2 ARG A 58 71.358 -7.858 -10.133 1.00 15.00 H new ATOM 0 HD3 ARG A 58 70.984 -8.830 -11.542 1.00 15.00 H new ATOM 0 HE ARG A 58 69.339 -9.981 -9.568 1.00 15.00 H new ATOM 0 HH11 ARG A 58 69.876 -6.688 -10.756 1.00 15.00 H new ATOM 0 HH12 ARG A 58 68.237 -6.168 -10.350 1.00 15.00 H new ATOM 0 HH21 ARG A 58 67.278 -9.271 -9.073 1.00 15.00 H new ATOM 0 HH22 ARG A 58 66.794 -7.606 -9.414 1.00 15.00 H new ATOM 943 N ASP A 59 75.081 -10.986 -7.542 1.00 15.00 N ATOM 944 CA ASP A 59 75.038 -11.251 -6.072 1.00 15.00 C ATOM 945 C ASP A 59 75.827 -10.178 -5.316 1.00 15.00 C ATOM 946 O ASP A 59 76.428 -10.446 -4.290 1.00 15.00 O ATOM 947 CB ASP A 59 75.691 -12.623 -5.897 1.00 15.00 C ATOM 948 CG ASP A 59 74.802 -13.700 -6.525 1.00 15.00 C ATOM 949 OD1 ASP A 59 73.602 -13.649 -6.312 1.00 15.00 O ATOM 950 OD2 ASP A 59 75.337 -14.556 -7.210 1.00 15.00 O ATOM 0 H ASP A 59 75.970 -10.624 -7.888 1.00 15.00 H new ATOM 0 HA ASP A 59 74.022 -11.231 -5.679 1.00 15.00 H new ATOM 0 HB2 ASP A 59 76.675 -12.631 -6.366 1.00 15.00 H new ATOM 0 HB3 ASP A 59 75.841 -12.833 -4.838 1.00 15.00 H new ATOM 955 N GLU A 60 75.830 -8.966 -5.816 1.00 15.00 N ATOM 956 CA GLU A 60 76.587 -7.867 -5.143 1.00 15.00 C ATOM 957 C GLU A 60 75.616 -6.864 -4.515 1.00 15.00 C ATOM 958 O GLU A 60 74.422 -6.917 -4.746 1.00 15.00 O ATOM 959 CB GLU A 60 77.399 -7.203 -6.256 1.00 15.00 C ATOM 960 CG GLU A 60 78.467 -8.175 -6.763 1.00 15.00 C ATOM 961 CD GLU A 60 79.356 -7.474 -7.792 1.00 15.00 C ATOM 962 OE1 GLU A 60 80.560 -7.663 -7.732 1.00 15.00 O ATOM 963 OE2 GLU A 60 78.819 -6.762 -8.625 1.00 15.00 O ATOM 0 H GLU A 60 75.338 -8.691 -6.666 1.00 15.00 H new ATOM 0 HA GLU A 60 77.225 -8.237 -4.340 1.00 15.00 H new ATOM 0 HB2 GLU A 60 76.741 -6.910 -7.075 1.00 15.00 H new ATOM 0 HB3 GLU A 60 77.869 -6.293 -5.884 1.00 15.00 H new ATOM 0 HG2 GLU A 60 79.072 -8.533 -5.930 1.00 15.00 H new ATOM 0 HG3 GLU A 60 77.994 -9.048 -7.212 1.00 15.00 H new ATOM 970 N THR A 61 76.123 -5.951 -3.723 1.00 15.00 N ATOM 971 CA THR A 61 75.241 -4.936 -3.071 1.00 15.00 C ATOM 972 C THR A 61 75.361 -3.592 -3.794 1.00 15.00 C ATOM 973 O THR A 61 76.429 -3.215 -4.241 1.00 15.00 O ATOM 974 CB THR A 61 75.761 -4.822 -1.636 1.00 15.00 C ATOM 975 OG1 THR A 61 75.892 -6.121 -1.078 1.00 15.00 O ATOM 976 CG2 THR A 61 74.780 -4.000 -0.800 1.00 15.00 C ATOM 0 H THR A 61 77.115 -5.866 -3.500 1.00 15.00 H new ATOM 0 HA THR A 61 74.189 -5.221 -3.101 1.00 15.00 H new ATOM 0 HB THR A 61 76.733 -4.328 -1.639 1.00 15.00 H new ATOM 0 HG1 THR A 61 76.227 -6.050 -0.160 1.00 15.00 H new ATOM 0 HG21 THR A 61 75.151 -3.919 0.222 1.00 15.00 H new ATOM 0 HG22 THR A 61 74.682 -3.003 -1.230 1.00 15.00 H new ATOM 0 HG23 THR A 61 73.807 -4.490 -0.795 1.00 15.00 H new ATOM 984 N PHE A 62 74.272 -2.870 -3.910 1.00 15.00 N ATOM 985 CA PHE A 62 74.311 -1.547 -4.603 1.00 15.00 C ATOM 986 C PHE A 62 74.320 -0.415 -3.572 1.00 15.00 C ATOM 987 O PHE A 62 73.481 -0.366 -2.689 1.00 15.00 O ATOM 988 CB PHE A 62 73.034 -1.502 -5.439 1.00 15.00 C ATOM 989 CG PHE A 62 73.027 -2.492 -6.581 1.00 15.00 C ATOM 990 CD1 PHE A 62 72.500 -3.792 -6.386 1.00 15.00 C ATOM 991 CD2 PHE A 62 73.544 -2.118 -7.845 1.00 15.00 C ATOM 992 CE1 PHE A 62 72.492 -4.719 -7.456 1.00 15.00 C ATOM 993 CE2 PHE A 62 73.536 -3.046 -8.915 1.00 15.00 C ATOM 994 CZ PHE A 62 73.011 -4.347 -8.721 1.00 15.00 C ATOM 0 H PHE A 62 73.356 -3.142 -3.553 1.00 15.00 H new ATOM 0 HA PHE A 62 75.203 -1.425 -5.217 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.179 -1.699 -4.793 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.906 -0.496 -5.839 1.00 15.00 H new ATOM 0 HD1 PHE A 62 72.105 -4.076 -5.422 1.00 15.00 H new ATOM 0 HD2 PHE A 62 73.944 -1.126 -7.993 1.00 15.00 H new ATOM 0 HE1 PHE A 62 72.090 -5.710 -7.308 1.00 15.00 H new ATOM 0 HE2 PHE A 62 73.930 -2.761 -9.879 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.006 -5.055 -9.537 1.00 15.00 H new ATOM 1004 N GLU A 63 75.262 0.490 -3.683 1.00 15.00 N ATOM 1005 CA GLU A 63 75.368 1.603 -2.684 1.00 15.00 C ATOM 1006 C GLU A 63 74.176 2.556 -2.812 1.00 15.00 C ATOM 1007 O GLU A 63 73.595 2.965 -1.822 1.00 15.00 O ATOM 1008 CB GLU A 63 76.673 2.330 -3.024 1.00 15.00 C ATOM 1009 CG GLU A 63 77.001 3.338 -1.920 1.00 15.00 C ATOM 1010 CD GLU A 63 78.214 4.174 -2.334 1.00 15.00 C ATOM 1011 OE1 GLU A 63 79.087 4.367 -1.505 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.249 4.609 -3.474 1.00 15.00 O ATOM 0 H GLU A 63 75.964 0.507 -4.423 1.00 15.00 H new ATOM 0 HA GLU A 63 75.365 1.229 -1.660 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.486 1.611 -3.127 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.577 2.842 -3.981 1.00 15.00 H new ATOM 0 HG2 GLU A 63 76.144 3.987 -1.739 1.00 15.00 H new ATOM 0 HG3 GLU A 63 77.208 2.816 -0.986 1.00 15.00 H new ATOM 1019 N TYR A 64 73.807 2.911 -4.020 1.00 15.00 N ATOM 1020 CA TYR A 64 72.699 3.896 -4.213 1.00 15.00 C ATOM 1021 C TYR A 64 71.961 3.625 -5.527 1.00 15.00 C ATOM 1022 O TYR A 64 72.551 3.630 -6.591 1.00 15.00 O ATOM 1023 CB TYR A 64 73.397 5.256 -4.262 1.00 15.00 C ATOM 1024 CG TYR A 64 72.461 6.430 -4.090 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.483 6.711 -5.075 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.567 7.256 -2.944 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.613 7.816 -4.914 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.695 8.360 -2.783 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.718 8.639 -3.768 1.00 15.00 C ATOM 1030 OH TYR A 64 69.869 9.717 -3.612 1.00 15.00 O ATOM 0 H TYR A 64 74.227 2.560 -4.881 1.00 15.00 H new ATOM 0 HA TYR A 64 71.953 3.840 -3.420 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.157 5.292 -3.481 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.915 5.354 -5.216 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.401 6.082 -5.949 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.313 7.044 -2.193 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.869 8.031 -5.666 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.776 8.989 -1.909 1.00 15.00 H new ATOM 0 HH TYR A 64 70.074 10.176 -2.771 1.00 15.00 H new ATOM 1040 N ILE A 65 70.672 3.389 -5.455 1.00 15.00 N ATOM 1041 CA ILE A 65 69.852 3.251 -6.702 1.00 15.00 C ATOM 1042 C ILE A 65 68.610 4.150 -6.605 1.00 15.00 C ATOM 1043 O ILE A 65 68.062 4.350 -5.536 1.00 15.00 O ATOM 1044 CB ILE A 65 69.458 1.765 -6.781 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.724 0.907 -6.908 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.562 1.526 -8.007 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.376 -0.576 -6.725 1.00 15.00 C ATOM 0 H ILE A 65 70.151 3.286 -4.584 1.00 15.00 H new ATOM 0 HA ILE A 65 70.399 3.556 -7.594 1.00 15.00 H new ATOM 0 HB ILE A 65 68.915 1.491 -5.877 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.182 1.063 -7.885 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.456 1.212 -6.160 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.287 0.472 -8.057 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.660 2.133 -7.923 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.102 1.803 -8.912 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.281 -1.176 -6.817 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.939 -0.728 -5.738 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.661 -0.879 -7.490 1.00 15.00 H new ATOM 1059 N ILE A 66 68.170 4.689 -7.717 1.00 15.00 N ATOM 1060 CA ILE A 66 66.991 5.610 -7.704 1.00 15.00 C ATOM 1061 C ILE A 66 65.786 4.928 -8.362 1.00 15.00 C ATOM 1062 O ILE A 66 65.910 4.294 -9.395 1.00 15.00 O ATOM 1063 CB ILE A 66 67.429 6.844 -8.514 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.636 7.507 -7.841 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.282 7.859 -8.583 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.278 8.502 -8.810 1.00 15.00 C ATOM 0 H ILE A 66 68.580 4.529 -8.637 1.00 15.00 H new ATOM 0 HA ILE A 66 66.690 5.882 -6.692 1.00 15.00 H new ATOM 0 HB ILE A 66 67.697 6.523 -9.521 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.323 8.020 -6.931 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.363 6.750 -7.546 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.600 8.729 -9.158 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.419 7.401 -9.066 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.010 8.170 -7.574 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.136 8.974 -8.332 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.606 7.976 -9.707 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.550 9.266 -9.083 1.00 15.00 H new ATOM 1078 N PHE A 67 64.625 5.055 -7.767 1.00 15.00 N ATOM 1079 CA PHE A 67 63.385 4.499 -8.390 1.00 15.00 C ATOM 1080 C PHE A 67 62.307 5.584 -8.461 1.00 15.00 C ATOM 1081 O PHE A 67 62.158 6.377 -7.550 1.00 15.00 O ATOM 1082 CB PHE A 67 62.946 3.366 -7.461 1.00 15.00 C ATOM 1083 CG PHE A 67 63.872 2.173 -7.486 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.928 1.344 -8.634 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.684 1.882 -6.363 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.795 0.225 -8.657 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.550 0.763 -6.386 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.606 -0.067 -7.533 1.00 15.00 C ATOM 0 H PHE A 67 64.483 5.523 -6.872 1.00 15.00 H new ATOM 0 HA PHE A 67 63.553 4.145 -9.407 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.884 3.746 -6.441 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.944 3.044 -7.743 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.309 1.566 -9.491 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.642 2.514 -5.488 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.838 -0.406 -9.532 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.169 0.542 -5.529 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.266 -0.921 -7.550 1.00 15.00 H new ATOM 1098 N ARG A 68 61.559 5.621 -9.537 1.00 15.00 N ATOM 1099 CA ARG A 68 60.486 6.652 -9.677 1.00 15.00 C ATOM 1100 C ARG A 68 59.110 6.004 -9.500 1.00 15.00 C ATOM 1101 O ARG A 68 58.928 4.833 -9.772 1.00 15.00 O ATOM 1102 CB ARG A 68 60.640 7.205 -11.096 1.00 15.00 C ATOM 1103 CG ARG A 68 61.977 7.940 -11.220 1.00 15.00 C ATOM 1104 CD ARG A 68 62.080 8.586 -12.604 1.00 15.00 C ATOM 1105 NE ARG A 68 63.484 9.095 -12.693 1.00 15.00 N ATOM 1106 CZ ARG A 68 64.502 8.283 -12.911 1.00 15.00 C ATOM 1107 NH1 ARG A 68 64.334 6.986 -13.041 1.00 15.00 N ATOM 1108 NH2 ARG A 68 65.706 8.779 -12.991 1.00 15.00 N ATOM 0 H ARG A 68 61.646 4.980 -10.325 1.00 15.00 H new ATOM 0 HA ARG A 68 60.570 7.438 -8.927 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.592 6.392 -11.821 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.818 7.884 -11.323 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.058 8.702 -10.445 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.802 7.244 -11.070 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.872 7.863 -13.393 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.359 9.396 -12.716 1.00 15.00 H new ATOM 0 HE ARG A 68 63.659 10.094 -12.583 1.00 15.00 H new ATOM 0 HH11 ARG A 68 63.399 6.584 -12.974 1.00 15.00 H new ATOM 0 HH12 ARG A 68 65.138 6.382 -13.209 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.852 9.783 -12.885 1.00 15.00 H new ATOM 0 HH22 ARG A 68 66.501 8.163 -13.159 1.00 15.00 H new ATOM 1122 N GLY A 69 58.138 6.763 -9.045 1.00 15.00 N ATOM 1123 CA GLY A 69 56.769 6.199 -8.814 1.00 15.00 C ATOM 1124 C GLY A 69 56.215 5.568 -10.103 1.00 15.00 C ATOM 1125 O GLY A 69 55.386 4.678 -10.054 1.00 15.00 O ATOM 0 H GLY A 69 58.236 7.754 -8.823 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.808 5.449 -8.024 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.099 6.988 -8.472 1.00 15.00 H new ATOM 1129 N SER A 70 56.666 6.024 -11.249 1.00 15.00 N ATOM 1130 CA SER A 70 56.137 5.479 -12.542 1.00 15.00 C ATOM 1131 C SER A 70 56.535 4.007 -12.715 1.00 15.00 C ATOM 1132 O SER A 70 55.720 3.179 -13.076 1.00 15.00 O ATOM 1133 CB SER A 70 56.777 6.335 -13.637 1.00 15.00 C ATOM 1134 OG SER A 70 56.189 6.012 -14.890 1.00 15.00 O ATOM 0 H SER A 70 57.377 6.749 -11.345 1.00 15.00 H new ATOM 0 HA SER A 70 55.048 5.517 -12.578 1.00 15.00 H new ATOM 0 HB2 SER A 70 56.634 7.393 -13.417 1.00 15.00 H new ATOM 0 HB3 SER A 70 57.852 6.159 -13.671 1.00 15.00 H new ATOM 0 HG SER A 70 56.596 6.560 -15.593 1.00 15.00 H new ATOM 1140 N ASP A 71 57.780 3.680 -12.460 1.00 15.00 N ATOM 1141 CA ASP A 71 58.251 2.273 -12.677 1.00 15.00 C ATOM 1142 C ASP A 71 57.883 1.387 -11.478 1.00 15.00 C ATOM 1143 O ASP A 71 57.627 0.207 -11.628 1.00 15.00 O ATOM 1144 CB ASP A 71 59.777 2.366 -12.849 1.00 15.00 C ATOM 1145 CG ASP A 71 60.430 2.930 -11.580 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.647 4.128 -11.533 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.700 2.151 -10.680 1.00 15.00 O ATOM 0 H ASP A 71 58.490 4.325 -12.112 1.00 15.00 H new ATOM 0 HA ASP A 71 57.781 1.820 -13.550 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.185 1.379 -13.066 1.00 15.00 H new ATOM 0 HB3 ASP A 71 60.014 3.003 -13.701 1.00 15.00 H new ATOM 1152 N ILE A 72 57.854 1.951 -10.294 1.00 15.00 N ATOM 1153 CA ILE A 72 57.512 1.143 -9.076 1.00 15.00 C ATOM 1154 C ILE A 72 56.045 0.698 -9.142 1.00 15.00 C ATOM 1155 O ILE A 72 55.183 1.440 -9.577 1.00 15.00 O ATOM 1156 CB ILE A 72 57.747 2.075 -7.875 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.219 2.506 -7.833 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.406 1.341 -6.571 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.383 3.668 -6.852 1.00 15.00 C ATOM 0 H ILE A 72 58.052 2.936 -10.117 1.00 15.00 H new ATOM 0 HA ILE A 72 58.119 0.241 -8.998 1.00 15.00 H new ATOM 0 HB ILE A 72 57.109 2.952 -7.980 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.846 1.668 -7.528 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.549 2.806 -8.827 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.575 2.006 -5.724 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.360 1.034 -6.589 1.00 15.00 H new ATOM 0 HG23 ILE A 72 58.041 0.460 -6.472 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.429 3.974 -6.822 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.768 4.508 -7.176 1.00 15.00 H new ATOM 0 HD13 ILE A 72 59.069 3.351 -5.857 1.00 15.00 H new ATOM 1171 N LYS A 73 55.764 -0.508 -8.713 1.00 15.00 N ATOM 1172 CA LYS A 73 54.360 -1.014 -8.738 1.00 15.00 C ATOM 1173 C LYS A 73 53.738 -0.918 -7.343 1.00 15.00 C ATOM 1174 O LYS A 73 52.595 -0.526 -7.192 1.00 15.00 O ATOM 1175 CB LYS A 73 54.474 -2.474 -9.179 1.00 15.00 C ATOM 1176 CG LYS A 73 53.078 -3.029 -9.474 1.00 15.00 C ATOM 1177 CD LYS A 73 52.579 -2.471 -10.808 1.00 15.00 C ATOM 1178 CE LYS A 73 51.242 -3.125 -11.167 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.168 -3.058 -12.653 1.00 15.00 N ATOM 0 H LYS A 73 56.452 -1.165 -8.345 1.00 15.00 H new ATOM 0 HA LYS A 73 53.723 -0.436 -9.407 1.00 15.00 H new ATOM 0 HB2 LYS A 73 55.102 -2.549 -10.067 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.954 -3.064 -8.399 1.00 15.00 H new ATOM 0 HG2 LYS A 73 53.108 -4.118 -9.512 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.390 -2.757 -8.674 1.00 15.00 H new ATOM 0 HD2 LYS A 73 52.460 -1.390 -10.740 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.312 -2.663 -11.592 1.00 15.00 H new ATOM 0 HE2 LYS A 73 51.200 -4.156 -10.816 1.00 15.00 H new ATOM 0 HE3 LYS A 73 50.408 -2.597 -10.706 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.278 -3.488 -12.976 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 51.204 -2.064 -12.958 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 51.971 -3.575 -13.064 1.00 15.00 H new ATOM 1193 N ASP A 74 54.483 -1.275 -6.324 1.00 15.00 N ATOM 1194 CA ASP A 74 53.925 -1.246 -4.934 1.00 15.00 C ATOM 1195 C ASP A 74 55.020 -0.913 -3.916 1.00 15.00 C ATOM 1196 O ASP A 74 56.157 -1.317 -4.062 1.00 15.00 O ATOM 1197 CB ASP A 74 53.385 -2.657 -4.696 1.00 15.00 C ATOM 1198 CG ASP A 74 52.554 -2.678 -3.412 1.00 15.00 C ATOM 1199 OD1 ASP A 74 52.734 -3.595 -2.629 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.751 -1.775 -3.233 1.00 15.00 O ATOM 0 H ASP A 74 55.452 -1.585 -6.394 1.00 15.00 H new ATOM 0 HA ASP A 74 53.153 -0.485 -4.821 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.774 -2.971 -5.542 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.210 -3.365 -4.619 1.00 15.00 H new ATOM 1205 N LEU A 75 54.676 -0.177 -2.884 1.00 15.00 N ATOM 1206 CA LEU A 75 55.672 0.159 -1.818 1.00 15.00 C ATOM 1207 C LEU A 75 55.113 -0.218 -0.442 1.00 15.00 C ATOM 1208 O LEU A 75 54.012 0.164 -0.089 1.00 15.00 O ATOM 1209 CB LEU A 75 55.862 1.674 -1.923 1.00 15.00 C ATOM 1210 CG LEU A 75 57.095 2.098 -1.119 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.621 3.431 -1.657 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.713 2.264 0.355 1.00 15.00 C ATOM 0 H LEU A 75 53.743 0.207 -2.735 1.00 15.00 H new ATOM 0 HA LEU A 75 56.612 -0.380 -1.940 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.980 1.964 -2.967 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.977 2.188 -1.548 1.00 15.00 H new ATOM 0 HG LEU A 75 57.867 1.335 -1.212 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.498 3.733 -1.085 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.893 3.318 -2.706 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.847 4.192 -1.563 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.591 2.566 0.927 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.940 3.027 0.447 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.336 1.317 0.742 1.00 15.00 H new ATOM 1224 N THR A 76 55.863 -0.964 0.335 1.00 15.00 N ATOM 1225 CA THR A 76 55.380 -1.369 1.693 1.00 15.00 C ATOM 1226 C THR A 76 56.498 -1.208 2.731 1.00 15.00 C ATOM 1227 O THR A 76 57.652 -1.472 2.455 1.00 15.00 O ATOM 1228 CB THR A 76 54.990 -2.841 1.550 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.143 -2.996 0.420 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.255 -3.302 2.809 1.00 15.00 C ATOM 0 H THR A 76 56.790 -1.310 0.086 1.00 15.00 H new ATOM 0 HA THR A 76 54.546 -0.754 2.032 1.00 15.00 H new ATOM 0 HB THR A 76 55.888 -3.444 1.417 1.00 15.00 H new ATOM 0 HG1 THR A 76 53.893 -3.939 0.325 1.00 15.00 H new ATOM 0 HG21 THR A 76 53.978 -4.351 2.705 1.00 15.00 H new ATOM 0 HG22 THR A 76 54.906 -3.183 3.675 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.356 -2.701 2.946 1.00 15.00 H new ATOM 1238 N VAL A 77 56.156 -0.777 3.922 1.00 15.00 N ATOM 1239 CA VAL A 77 57.183 -0.627 5.004 1.00 15.00 C ATOM 1240 C VAL A 77 57.193 -1.888 5.879 1.00 15.00 C ATOM 1241 O VAL A 77 56.161 -2.485 6.125 1.00 15.00 O ATOM 1242 CB VAL A 77 56.744 0.602 5.816 1.00 15.00 C ATOM 1243 CG1 VAL A 77 57.744 0.864 6.948 1.00 15.00 C ATOM 1244 CG2 VAL A 77 56.690 1.834 4.906 1.00 15.00 C ATOM 0 H VAL A 77 55.206 -0.522 4.193 1.00 15.00 H new ATOM 0 HA VAL A 77 58.191 -0.499 4.610 1.00 15.00 H new ATOM 0 HB VAL A 77 55.756 0.410 6.236 1.00 15.00 H new ATOM 0 HG11 VAL A 77 57.427 1.736 7.519 1.00 15.00 H new ATOM 0 HG12 VAL A 77 57.785 -0.005 7.605 1.00 15.00 H new ATOM 0 HG13 VAL A 77 58.732 1.047 6.526 1.00 15.00 H new ATOM 0 HG21 VAL A 77 56.378 2.702 5.487 1.00 15.00 H new ATOM 0 HG22 VAL A 77 57.677 2.017 4.482 1.00 15.00 H new ATOM 0 HG23 VAL A 77 55.976 1.661 4.101 1.00 15.00 H new ATOM 1254 N CYS A 78 58.350 -2.294 6.349 1.00 15.00 N ATOM 1255 CA CYS A 78 58.443 -3.569 7.134 1.00 15.00 C ATOM 1256 C CYS A 78 58.851 -3.291 8.588 1.00 15.00 C ATOM 1257 O CYS A 78 58.486 -4.025 9.488 1.00 15.00 O ATOM 1258 CB CYS A 78 59.498 -4.428 6.410 1.00 15.00 C ATOM 1259 SG CYS A 78 61.120 -3.609 6.403 1.00 15.00 S ATOM 0 H CYS A 78 59.233 -1.799 6.223 1.00 15.00 H new ATOM 0 HA CYS A 78 57.482 -4.081 7.184 1.00 15.00 H new ATOM 0 HB2 CYS A 78 59.580 -5.398 6.900 1.00 15.00 H new ATOM 0 HB3 CYS A 78 59.178 -4.615 5.385 1.00 15.00 H new ATOM 0 HG CYS A 78 61.013 -2.439 5.847 1.00 15.00 H new ATOM 1265 N GLU A 79 59.603 -2.240 8.820 1.00 15.00 N ATOM 1266 CA GLU A 79 60.048 -1.927 10.215 1.00 15.00 C ATOM 1267 C GLU A 79 58.955 -1.132 10.954 1.00 15.00 C ATOM 1268 O GLU A 79 58.626 -0.035 10.544 1.00 15.00 O ATOM 1269 CB GLU A 79 61.307 -1.073 10.051 1.00 15.00 C ATOM 1270 CG GLU A 79 62.097 -1.069 11.361 1.00 15.00 C ATOM 1271 CD GLU A 79 63.087 0.097 11.357 1.00 15.00 C ATOM 1272 OE1 GLU A 79 64.161 -0.065 10.803 1.00 15.00 O ATOM 1273 OE2 GLU A 79 62.754 1.134 11.908 1.00 15.00 O ATOM 0 H GLU A 79 59.927 -1.588 8.106 1.00 15.00 H new ATOM 0 HA GLU A 79 60.240 -2.828 10.797 1.00 15.00 H new ATOM 0 HB2 GLU A 79 61.924 -1.467 9.244 1.00 15.00 H new ATOM 0 HB3 GLU A 79 61.035 -0.054 9.775 1.00 15.00 H new ATOM 0 HG2 GLU A 79 61.417 -0.979 12.208 1.00 15.00 H new ATOM 0 HG3 GLU A 79 62.630 -2.012 11.479 1.00 15.00 H new ATOM 1280 N PRO A 80 58.419 -1.702 12.023 1.00 15.00 N ATOM 1281 CA PRO A 80 57.386 -0.988 12.816 1.00 15.00 C ATOM 1282 C PRO A 80 58.037 0.091 13.698 1.00 15.00 C ATOM 1283 O PRO A 80 59.230 0.048 13.930 1.00 15.00 O ATOM 1284 CB PRO A 80 56.765 -2.087 13.674 1.00 15.00 C ATOM 1285 CG PRO A 80 57.831 -3.127 13.807 1.00 15.00 C ATOM 1286 CD PRO A 80 58.710 -3.033 12.585 1.00 15.00 C ATOM 0 HA PRO A 80 56.652 -0.473 12.196 1.00 15.00 H new ATOM 0 HB2 PRO A 80 56.465 -1.703 14.649 1.00 15.00 H new ATOM 0 HB3 PRO A 80 55.871 -2.497 13.204 1.00 15.00 H new ATOM 0 HG2 PRO A 80 58.415 -2.964 14.713 1.00 15.00 H new ATOM 0 HG3 PRO A 80 57.390 -4.121 13.887 1.00 15.00 H new ATOM 0 HD2 PRO A 80 59.764 -3.132 12.845 1.00 15.00 H new ATOM 0 HD3 PRO A 80 58.482 -3.824 11.870 1.00 15.00 H new ATOM 1294 N PRO A 81 57.234 1.028 14.164 1.00 15.00 N ATOM 1295 CA PRO A 81 57.754 2.090 15.067 1.00 15.00 C ATOM 1296 C PRO A 81 58.153 1.486 16.419 1.00 15.00 C ATOM 1297 O PRO A 81 57.617 0.475 16.836 1.00 15.00 O ATOM 1298 CB PRO A 81 56.577 3.053 15.224 1.00 15.00 C ATOM 1299 CG PRO A 81 55.361 2.259 14.870 1.00 15.00 C ATOM 1300 CD PRO A 81 55.794 1.191 13.902 1.00 15.00 C ATOM 0 HA PRO A 81 58.643 2.585 14.676 1.00 15.00 H new ATOM 0 HB2 PRO A 81 56.514 3.433 16.244 1.00 15.00 H new ATOM 0 HB3 PRO A 81 56.686 3.917 14.568 1.00 15.00 H new ATOM 0 HG2 PRO A 81 54.919 1.814 15.761 1.00 15.00 H new ATOM 0 HG3 PRO A 81 54.600 2.899 14.422 1.00 15.00 H new ATOM 0 HD2 PRO A 81 55.251 0.260 14.067 1.00 15.00 H new ATOM 0 HD3 PRO A 81 55.608 1.490 12.870 1.00 15.00 H new ATOM 1308 N LYS A 82 59.086 2.102 17.103 1.00 15.00 N ATOM 1309 CA LYS A 82 59.535 1.564 18.425 1.00 15.00 C ATOM 1310 C LYS A 82 58.627 2.090 19.549 1.00 15.00 C ATOM 1311 O LYS A 82 58.036 3.144 19.410 1.00 15.00 O ATOM 1312 CB LYS A 82 60.966 2.078 18.606 1.00 15.00 C ATOM 1313 CG LYS A 82 61.887 1.391 17.595 1.00 15.00 C ATOM 1314 CD LYS A 82 63.288 1.997 17.688 1.00 15.00 C ATOM 1315 CE LYS A 82 63.310 3.346 16.965 1.00 15.00 C ATOM 1316 NZ LYS A 82 64.484 4.066 17.531 1.00 15.00 N ATOM 0 H LYS A 82 59.557 2.955 16.802 1.00 15.00 H new ATOM 0 HA LYS A 82 59.489 0.476 18.461 1.00 15.00 H new ATOM 0 HB2 LYS A 82 60.996 3.159 18.466 1.00 15.00 H new ATOM 0 HB3 LYS A 82 61.310 1.879 19.621 1.00 15.00 H new ATOM 0 HG2 LYS A 82 61.928 0.320 17.794 1.00 15.00 H new ATOM 0 HG3 LYS A 82 61.493 1.513 16.586 1.00 15.00 H new ATOM 0 HD2 LYS A 82 63.571 2.128 18.733 1.00 15.00 H new ATOM 0 HD3 LYS A 82 64.018 1.322 17.242 1.00 15.00 H new ATOM 0 HE2 LYS A 82 63.409 3.215 15.887 1.00 15.00 H new ATOM 0 HE3 LYS A 82 62.387 3.900 17.135 1.00 15.00 H new ATOM 0 HZ1 LYS A 82 64.566 5.002 17.084 1.00 15.00 H new ATOM 0 HZ2 LYS A 82 64.359 4.182 18.557 1.00 15.00 H new ATOM 0 HZ3 LYS A 82 65.349 3.518 17.348 1.00 15.00 H new ATOM 1330 N PRO A 83 58.541 1.340 20.633 1.00 15.00 N ATOM 1331 CA PRO A 83 57.682 1.756 21.774 1.00 15.00 C ATOM 1332 C PRO A 83 58.263 3.001 22.453 1.00 15.00 C ATOM 1333 O PRO A 83 59.466 3.171 22.529 1.00 15.00 O ATOM 1334 CB PRO A 83 57.713 0.554 22.719 1.00 15.00 C ATOM 1335 CG PRO A 83 58.947 -0.206 22.354 1.00 15.00 C ATOM 1336 CD PRO A 83 59.220 0.060 20.899 1.00 15.00 C ATOM 0 HA PRO A 83 56.669 2.019 21.469 1.00 15.00 H new ATOM 0 HB2 PRO A 83 57.742 0.874 23.761 1.00 15.00 H new ATOM 0 HB3 PRO A 83 56.822 -0.063 22.600 1.00 15.00 H new ATOM 0 HG2 PRO A 83 59.790 0.112 22.968 1.00 15.00 H new ATOM 0 HG3 PRO A 83 58.808 -1.273 22.531 1.00 15.00 H new ATOM 0 HD2 PRO A 83 60.290 0.128 20.700 1.00 15.00 H new ATOM 0 HD3 PRO A 83 58.828 -0.738 20.268 1.00 15.00 H new ATOM 1344 N ILE A 84 57.413 3.870 22.945 1.00 15.00 N ATOM 1345 CA ILE A 84 57.900 5.108 23.634 1.00 15.00 C ATOM 1346 C ILE A 84 57.325 5.186 25.054 1.00 15.00 C ATOM 1347 O ILE A 84 56.261 4.663 25.328 1.00 15.00 O ATOM 1348 CB ILE A 84 57.405 6.287 22.777 1.00 15.00 C ATOM 1349 CG1 ILE A 84 55.877 6.231 22.621 1.00 15.00 C ATOM 1350 CG2 ILE A 84 58.057 6.224 21.394 1.00 15.00 C ATOM 1351 CD1 ILE A 84 55.373 7.560 22.053 1.00 15.00 C ATOM 0 H ILE A 84 56.398 3.775 22.899 1.00 15.00 H new ATOM 0 HA ILE A 84 58.986 5.118 23.731 1.00 15.00 H new ATOM 0 HB ILE A 84 57.677 7.219 23.272 1.00 15.00 H new ATOM 0 HG12 ILE A 84 55.598 5.411 21.959 1.00 15.00 H new ATOM 0 HG13 ILE A 84 55.409 6.035 23.586 1.00 15.00 H new ATOM 0 HG21 ILE A 84 57.706 7.059 20.788 1.00 15.00 H new ATOM 0 HG22 ILE A 84 59.140 6.282 21.499 1.00 15.00 H new ATOM 0 HG23 ILE A 84 57.790 5.286 20.908 1.00 15.00 H new ATOM 0 HD11 ILE A 84 54.289 7.521 21.942 1.00 15.00 H new ATOM 0 HD12 ILE A 84 55.639 8.370 22.732 1.00 15.00 H new ATOM 0 HD13 ILE A 84 55.831 7.737 21.080 1.00 15.00 H new ATOM 1363 N MET A 85 58.026 5.836 25.952 1.00 15.00 N ATOM 1364 CA MET A 85 57.531 5.956 27.357 1.00 15.00 C ATOM 1365 C MET A 85 57.911 7.323 27.935 1.00 15.00 C ATOM 1366 O MET A 85 59.096 7.596 28.026 1.00 15.00 O ATOM 1367 CB MET A 85 58.233 4.836 28.124 1.00 15.00 C ATOM 1368 CG MET A 85 57.712 3.480 27.643 1.00 15.00 C ATOM 1369 SD MET A 85 58.344 2.173 28.722 1.00 15.00 S ATOM 1370 CE MET A 85 57.286 2.524 30.148 1.00 15.00 C ATOM 1371 OXT MET A 85 57.010 8.071 28.276 1.00 15.00 O ATOM 0 H MET A 85 58.922 6.289 25.770 1.00 15.00 H new ATOM 0 HA MET A 85 56.446 5.873 27.421 1.00 15.00 H new ATOM 0 HB2 MET A 85 59.311 4.898 27.972 1.00 15.00 H new ATOM 0 HB3 MET A 85 58.055 4.947 29.194 1.00 15.00 H new ATOM 0 HG2 MET A 85 56.622 3.475 27.648 1.00 15.00 H new ATOM 0 HG3 MET A 85 58.027 3.301 26.615 1.00 15.00 H new ATOM 0 HE1 MET A 85 57.156 1.616 30.737 1.00 15.00 H new ATOM 0 HE2 MET A 85 57.750 3.293 30.765 1.00 15.00 H new ATOM 0 HE3 MET A 85 56.314 2.874 29.802 1.00 15.00 H new TER 1381 MET A 85