USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 889 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 86 SER OG : rot -167:sc= 0.788 USER MOD Set 1.2: A 89 SER OG : rot 180:sc= 0.573 USER MOD Single : A 1 MET CE :methyl 171:sc= 0 (180deg=-0.0305) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0134 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 MET CE :methyl -156:sc= 0 (180deg=-0.615) USER MOD Single : A 29 LYS NZ :NH3+ -160:sc= 0.602 (180deg=-0.251) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.969 K(o=-0.97,f=-2.5!) USER MOD Single : A 64 LYS NZ :NH3+ 169:sc=-0.00476 (180deg=-0.144) USER MOD Single : A 65 SER OG : rot 165:sc= 0.984 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0114 USER MOD Single : A 92 SER OG : rot 180:sc= 0.058 USER MOD Single : A 101 GLN : amide:sc= 0.0141! C(o=0.014!,f=-4.9!) USER MOD Single : A 102 LYS NZ :NH3+ 172:sc= 2.11 (180deg=1.72) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.239 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0725) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.022 3.139 2.843 1.00 0.00 N ATOM 2 CA MET A 1 7.084 4.605 2.976 1.00 0.00 C ATOM 3 C MET A 1 6.420 5.295 1.787 1.00 0.00 C ATOM 4 O MET A 1 5.471 6.055 1.973 1.00 0.00 O ATOM 5 CB MET A 1 8.528 5.082 3.161 1.00 0.00 C ATOM 6 CG MET A 1 8.569 6.586 3.441 1.00 0.00 C ATOM 7 SD MET A 1 7.641 7.089 4.915 1.00 0.00 S ATOM 8 CE MET A 1 7.977 8.867 4.867 1.00 0.00 C ATOM 0 H1 MET A 1 7.481 2.696 3.665 1.00 0.00 H new ATOM 0 H2 MET A 1 6.028 2.836 2.796 1.00 0.00 H new ATOM 0 H3 MET A 1 7.514 2.848 1.974 1.00 0.00 H new ATOM 0 HA MET A 1 6.527 4.882 3.871 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.992 4.541 3.985 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.108 4.858 2.266 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.608 6.895 3.556 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.172 7.117 2.576 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.358 9.374 5.607 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.029 9.045 5.091 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.747 9.254 3.874 1.00 0.00 H new ATOM 20 N SER A 2 6.907 5.036 0.574 1.00 0.00 N ATOM 21 CA SER A 2 6.369 5.634 -0.642 1.00 0.00 C ATOM 22 C SER A 2 6.241 4.588 -1.745 1.00 0.00 C ATOM 23 O SER A 2 6.840 3.516 -1.668 1.00 0.00 O ATOM 24 CB SER A 2 7.265 6.793 -1.083 1.00 0.00 C ATOM 25 OG SER A 2 8.560 6.323 -1.382 1.00 0.00 O ATOM 0 H SER A 2 7.689 4.402 0.409 1.00 0.00 H new ATOM 0 HA SER A 2 5.371 6.022 -0.439 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.836 7.280 -1.959 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.316 7.543 -0.294 1.00 0.00 H new ATOM 0 HG SER A 2 9.123 7.074 -1.665 1.00 0.00 H new ATOM 31 N ALA A 3 5.454 4.906 -2.773 1.00 0.00 N ATOM 32 CA ALA A 3 5.188 4.001 -3.882 1.00 0.00 C ATOM 33 C ALA A 3 5.778 4.509 -5.199 1.00 0.00 C ATOM 34 O ALA A 3 5.715 3.810 -6.210 1.00 0.00 O ATOM 35 CB ALA A 3 3.677 3.845 -4.016 1.00 0.00 C ATOM 0 H ALA A 3 4.982 5.806 -2.856 1.00 0.00 H new ATOM 0 HA ALA A 3 5.663 3.043 -3.672 1.00 0.00 H new ATOM 0 HB1 ALA A 3 3.453 3.170 -4.842 1.00 0.00 H new ATOM 0 HB2 ALA A 3 3.270 3.435 -3.092 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.227 4.818 -4.210 1.00 0.00 H new ATOM 41 N LEU A 4 6.342 5.718 -5.185 1.00 0.00 N ATOM 42 CA LEU A 4 6.892 6.370 -6.364 1.00 0.00 C ATOM 43 C LEU A 4 5.920 6.343 -7.540 1.00 0.00 C ATOM 44 O LEU A 4 6.327 6.129 -8.679 1.00 0.00 O ATOM 45 CB LEU A 4 8.281 5.811 -6.687 1.00 0.00 C ATOM 46 CG LEU A 4 9.226 5.968 -5.490 1.00 0.00 C ATOM 47 CD1 LEU A 4 10.612 5.434 -5.825 1.00 0.00 C ATOM 48 CD2 LEU A 4 9.389 7.440 -5.138 1.00 0.00 C ATOM 0 H LEU A 4 6.429 6.277 -4.336 1.00 0.00 H new ATOM 0 HA LEU A 4 7.030 7.429 -6.146 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.200 4.758 -6.956 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.694 6.330 -7.552 1.00 0.00 H new ATOM 0 HG LEU A 4 8.793 5.413 -4.658 1.00 0.00 H new ATOM 0 HD11 LEU A 4 11.267 5.555 -4.962 1.00 0.00 H new ATOM 0 HD12 LEU A 4 10.542 4.377 -6.082 1.00 0.00 H new ATOM 0 HD13 LEU A 4 11.020 5.987 -6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.062 7.538 -4.286 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.804 7.975 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.417 7.863 -4.883 1.00 0.00 H new ATOM 60 N THR A 5 4.633 6.565 -7.265 1.00 0.00 N ATOM 61 CA THR A 5 3.599 6.700 -8.284 1.00 0.00 C ATOM 62 C THR A 5 3.162 8.150 -8.423 1.00 0.00 C ATOM 63 O THR A 5 2.450 8.478 -9.369 1.00 0.00 O ATOM 64 CB THR A 5 2.372 5.849 -7.940 1.00 0.00 C ATOM 65 OG1 THR A 5 2.342 5.510 -6.572 1.00 0.00 O ATOM 66 CG2 THR A 5 2.372 4.582 -8.781 1.00 0.00 C ATOM 0 H THR A 5 4.278 6.657 -6.313 1.00 0.00 H new ATOM 0 HA THR A 5 4.027 6.355 -9.225 1.00 0.00 H new ATOM 0 HB THR A 5 1.483 6.440 -8.160 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.546 4.969 -6.386 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.498 3.980 -8.533 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.342 4.847 -9.838 1.00 0.00 H new ATOM 0 HG23 THR A 5 3.277 4.009 -8.576 1.00 0.00 H new ATOM 74 N GLN A 6 3.580 9.016 -7.498 1.00 0.00 N ATOM 75 CA GLN A 6 3.167 10.407 -7.502 1.00 0.00 C ATOM 76 C GLN A 6 4.339 11.352 -7.277 1.00 0.00 C ATOM 77 O GLN A 6 5.005 11.284 -6.242 1.00 0.00 O ATOM 78 CB GLN A 6 2.116 10.583 -6.414 1.00 0.00 C ATOM 79 CG GLN A 6 0.855 9.823 -6.823 1.00 0.00 C ATOM 80 CD GLN A 6 -0.223 9.810 -5.757 1.00 0.00 C ATOM 81 OE1 GLN A 6 -0.290 10.678 -4.895 1.00 0.00 O ATOM 82 NE2 GLN A 6 -1.088 8.802 -5.822 1.00 0.00 N ATOM 0 H GLN A 6 4.209 8.769 -6.734 1.00 0.00 H new ATOM 0 HA GLN A 6 2.755 10.658 -8.479 1.00 0.00 H new ATOM 0 HB2 GLN A 6 2.491 10.208 -5.462 1.00 0.00 H new ATOM 0 HB3 GLN A 6 1.891 11.640 -6.273 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.450 10.271 -7.731 1.00 0.00 H new ATOM 0 HG3 GLN A 6 1.124 8.795 -7.067 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -0.998 8.099 -6.556 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -1.842 8.732 -5.138 1.00 0.00 H new ATOM 91 N ILE A 7 4.577 12.231 -8.253 1.00 0.00 N ATOM 92 CA ILE A 7 5.747 13.096 -8.267 1.00 0.00 C ATOM 93 C ILE A 7 5.327 14.566 -8.289 1.00 0.00 C ATOM 94 O ILE A 7 4.471 14.956 -9.083 1.00 0.00 O ATOM 95 CB ILE A 7 6.616 12.768 -9.493 1.00 0.00 C ATOM 96 CG1 ILE A 7 6.738 11.257 -9.766 1.00 0.00 C ATOM 97 CG2 ILE A 7 8.004 13.380 -9.302 1.00 0.00 C ATOM 98 CD1 ILE A 7 7.307 10.468 -8.585 1.00 0.00 C ATOM 0 H ILE A 7 3.960 12.359 -9.055 1.00 0.00 H new ATOM 0 HA ILE A 7 6.328 12.922 -7.361 1.00 0.00 H new ATOM 0 HB ILE A 7 6.122 13.198 -10.364 1.00 0.00 H new ATOM 0 HG12 ILE A 7 5.754 10.861 -10.017 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.376 11.103 -10.637 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.625 13.151 -10.168 1.00 0.00 H new ATOM 0 HG22 ILE A 7 7.914 14.461 -9.196 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.464 12.965 -8.405 1.00 0.00 H new ATOM 0 HD11 ILE A 7 7.365 9.412 -8.847 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.304 10.838 -8.347 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.658 10.591 -7.718 1.00 0.00 H new ATOM 110 N LEU A 8 5.932 15.379 -7.417 1.00 0.00 N ATOM 111 CA LEU A 8 5.689 16.813 -7.368 1.00 0.00 C ATOM 112 C LEU A 8 6.664 17.508 -8.316 1.00 0.00 C ATOM 113 O LEU A 8 7.811 17.086 -8.436 1.00 0.00 O ATOM 114 CB LEU A 8 5.851 17.301 -5.921 1.00 0.00 C ATOM 115 CG LEU A 8 4.919 18.451 -5.522 1.00 0.00 C ATOM 116 CD1 LEU A 8 5.276 18.897 -4.105 1.00 0.00 C ATOM 117 CD2 LEU A 8 5.020 19.671 -6.434 1.00 0.00 C ATOM 0 H LEU A 8 6.606 15.053 -6.725 1.00 0.00 H new ATOM 0 HA LEU A 8 4.674 17.050 -7.689 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.678 16.461 -5.248 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.883 17.620 -5.773 1.00 0.00 H new ATOM 0 HG LEU A 8 3.901 18.069 -5.600 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.622 19.716 -3.805 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.149 18.061 -3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.312 19.233 -4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.331 20.442 -6.088 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.039 20.058 -6.412 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.762 19.385 -7.454 1.00 0.00 H new ATOM 129 N ILE A 9 6.222 18.571 -8.991 1.00 0.00 N ATOM 130 CA ILE A 9 7.042 19.306 -9.942 1.00 0.00 C ATOM 131 C ILE A 9 7.344 20.701 -9.397 1.00 0.00 C ATOM 132 O ILE A 9 6.447 21.381 -8.905 1.00 0.00 O ATOM 133 CB ILE A 9 6.300 19.366 -11.280 1.00 0.00 C ATOM 134 CG1 ILE A 9 6.105 17.947 -11.829 1.00 0.00 C ATOM 135 CG2 ILE A 9 7.064 20.226 -12.287 1.00 0.00 C ATOM 136 CD1 ILE A 9 5.121 17.928 -12.997 1.00 0.00 C ATOM 0 H ILE A 9 5.278 18.944 -8.889 1.00 0.00 H new ATOM 0 HA ILE A 9 7.997 18.804 -10.095 1.00 0.00 H new ATOM 0 HB ILE A 9 5.324 19.823 -11.118 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.065 17.547 -12.155 1.00 0.00 H new ATOM 0 HG13 ILE A 9 5.741 17.295 -11.035 1.00 0.00 H new ATOM 0 HG21 ILE A 9 6.518 20.254 -13.230 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.166 21.239 -11.897 1.00 0.00 H new ATOM 0 HG23 ILE A 9 8.053 19.799 -12.453 1.00 0.00 H new ATOM 0 HD11 ILE A 9 5.007 16.907 -13.361 1.00 0.00 H new ATOM 0 HD12 ILE A 9 4.154 18.304 -12.664 1.00 0.00 H new ATOM 0 HD13 ILE A 9 5.499 18.559 -13.801 1.00 0.00 H new ATOM 148 N VAL A 10 8.607 21.127 -9.488 1.00 0.00 N ATOM 149 CA VAL A 10 9.027 22.451 -9.048 1.00 0.00 C ATOM 150 C VAL A 10 9.882 23.085 -10.141 1.00 0.00 C ATOM 151 O VAL A 10 10.964 22.585 -10.452 1.00 0.00 O ATOM 152 CB VAL A 10 9.807 22.360 -7.736 1.00 0.00 C ATOM 153 CG1 VAL A 10 10.038 23.765 -7.178 1.00 0.00 C ATOM 154 CG2 VAL A 10 9.047 21.540 -6.691 1.00 0.00 C ATOM 0 H VAL A 10 9.364 20.560 -9.870 1.00 0.00 H new ATOM 0 HA VAL A 10 8.149 23.071 -8.868 1.00 0.00 H new ATOM 0 HB VAL A 10 10.757 21.869 -7.947 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.594 23.698 -6.243 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.607 24.353 -7.898 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.077 24.246 -6.995 1.00 0.00 H new ATOM 0 HG21 VAL A 10 9.629 21.495 -5.770 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.085 22.010 -6.489 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.886 20.530 -7.068 1.00 0.00 H new ATOM 164 N GLU A 11 9.393 24.184 -10.720 1.00 0.00 N ATOM 165 CA GLU A 11 10.010 24.822 -11.876 1.00 0.00 C ATOM 166 C GLU A 11 9.833 26.340 -11.794 1.00 0.00 C ATOM 167 O GLU A 11 8.929 26.819 -11.110 1.00 0.00 O ATOM 168 CB GLU A 11 9.361 24.223 -13.129 1.00 0.00 C ATOM 169 CG GLU A 11 9.908 24.794 -14.438 1.00 0.00 C ATOM 170 CD GLU A 11 11.428 24.699 -14.523 1.00 0.00 C ATOM 171 OE1 GLU A 11 12.039 25.721 -14.898 1.00 0.00 O ATOM 172 OE2 GLU A 11 11.966 23.615 -14.212 1.00 0.00 O ATOM 0 H GLU A 11 8.550 24.657 -10.394 1.00 0.00 H new ATOM 0 HA GLU A 11 11.084 24.640 -11.909 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.510 23.143 -13.124 1.00 0.00 H new ATOM 0 HB3 GLU A 11 8.286 24.397 -13.089 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.466 24.258 -15.278 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.606 25.837 -14.531 1.00 0.00 H new ATOM 179 N ASP A 12 10.690 27.106 -12.483 1.00 0.00 N ATOM 180 CA ASP A 12 10.694 28.563 -12.381 1.00 0.00 C ATOM 181 C ASP A 12 10.121 29.259 -13.619 1.00 0.00 C ATOM 182 O ASP A 12 10.070 30.489 -13.658 1.00 0.00 O ATOM 183 CB ASP A 12 12.105 29.055 -12.064 1.00 0.00 C ATOM 184 CG ASP A 12 13.065 28.851 -13.232 1.00 0.00 C ATOM 185 OD1 ASP A 12 13.185 29.787 -14.053 1.00 0.00 O ATOM 186 OD2 ASP A 12 13.673 27.762 -13.297 1.00 0.00 O ATOM 0 H ASP A 12 11.393 26.732 -13.121 1.00 0.00 H new ATOM 0 HA ASP A 12 10.027 28.833 -11.562 1.00 0.00 H new ATOM 0 HB2 ASP A 12 12.069 30.114 -11.807 1.00 0.00 H new ATOM 0 HB3 ASP A 12 12.484 28.527 -11.189 1.00 0.00 H new ATOM 191 N GLU A 13 9.691 28.500 -14.630 1.00 0.00 N ATOM 192 CA GLU A 13 9.103 29.065 -15.836 1.00 0.00 C ATOM 193 C GLU A 13 7.915 28.218 -16.295 1.00 0.00 C ATOM 194 O GLU A 13 8.048 27.002 -16.414 1.00 0.00 O ATOM 195 CB GLU A 13 10.176 29.154 -16.923 1.00 0.00 C ATOM 196 CG GLU A 13 9.637 29.865 -18.163 1.00 0.00 C ATOM 197 CD GLU A 13 10.744 30.064 -19.193 1.00 0.00 C ATOM 198 OE1 GLU A 13 10.943 29.143 -20.016 1.00 0.00 O ATOM 199 OE2 GLU A 13 11.388 31.138 -19.156 1.00 0.00 O ATOM 0 H GLU A 13 9.742 27.481 -14.631 1.00 0.00 H new ATOM 0 HA GLU A 13 8.730 30.068 -15.629 1.00 0.00 H new ATOM 0 HB2 GLU A 13 11.044 29.690 -16.540 1.00 0.00 H new ATOM 0 HB3 GLU A 13 10.513 28.152 -17.190 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.827 29.281 -18.600 1.00 0.00 H new ATOM 0 HG3 GLU A 13 9.217 30.831 -17.881 1.00 0.00 H new ATOM 206 N PRO A 14 6.748 28.827 -16.557 1.00 0.00 N ATOM 207 CA PRO A 14 5.541 28.117 -16.956 1.00 0.00 C ATOM 208 C PRO A 14 5.715 27.273 -18.218 1.00 0.00 C ATOM 209 O PRO A 14 5.018 26.272 -18.387 1.00 0.00 O ATOM 210 CB PRO A 14 4.492 29.205 -17.203 1.00 0.00 C ATOM 211 CG PRO A 14 4.969 30.363 -16.331 1.00 0.00 C ATOM 212 CD PRO A 14 6.484 30.250 -16.439 1.00 0.00 C ATOM 0 HA PRO A 14 5.259 27.410 -16.176 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.446 29.487 -18.255 1.00 0.00 H new ATOM 0 HB3 PRO A 14 3.494 28.872 -16.918 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.606 31.324 -16.697 1.00 0.00 H new ATOM 0 HG3 PRO A 14 4.626 30.264 -15.301 1.00 0.00 H new ATOM 0 HD2 PRO A 14 6.859 30.794 -17.306 1.00 0.00 H new ATOM 0 HD3 PRO A 14 6.975 30.671 -15.561 1.00 0.00 H new ATOM 220 N LEU A 15 6.637 27.656 -19.105 1.00 0.00 N ATOM 221 CA LEU A 15 6.849 26.931 -20.348 1.00 0.00 C ATOM 222 C LEU A 15 7.470 25.568 -20.052 1.00 0.00 C ATOM 223 O LEU A 15 7.051 24.558 -20.615 1.00 0.00 O ATOM 224 CB LEU A 15 7.721 27.803 -21.265 1.00 0.00 C ATOM 225 CG LEU A 15 7.923 27.289 -22.699 1.00 0.00 C ATOM 226 CD1 LEU A 15 8.959 26.168 -22.775 1.00 0.00 C ATOM 227 CD2 LEU A 15 6.607 26.810 -23.314 1.00 0.00 C ATOM 0 H LEU A 15 7.246 28.465 -18.980 1.00 0.00 H new ATOM 0 HA LEU A 15 5.908 26.734 -20.861 1.00 0.00 H new ATOM 0 HB2 LEU A 15 7.276 28.797 -21.317 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.701 27.916 -20.800 1.00 0.00 H new ATOM 0 HG LEU A 15 8.297 28.137 -23.272 1.00 0.00 H new ATOM 0 HD11 LEU A 15 9.065 25.840 -23.809 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.919 26.534 -22.410 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.633 25.329 -22.160 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.788 26.454 -24.328 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.198 25.999 -22.712 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.896 27.636 -23.341 1.00 0.00 H new ATOM 239 N ILE A 16 8.470 25.536 -19.163 1.00 0.00 N ATOM 240 CA ILE A 16 9.135 24.295 -18.790 1.00 0.00 C ATOM 241 C ILE A 16 8.264 23.514 -17.810 1.00 0.00 C ATOM 242 O ILE A 16 8.362 22.291 -17.742 1.00 0.00 O ATOM 243 CB ILE A 16 10.513 24.610 -18.191 1.00 0.00 C ATOM 244 CG1 ILE A 16 11.384 25.408 -19.171 1.00 0.00 C ATOM 245 CG2 ILE A 16 11.229 23.318 -17.782 1.00 0.00 C ATOM 246 CD1 ILE A 16 11.669 24.655 -20.472 1.00 0.00 C ATOM 0 H ILE A 16 8.833 26.363 -18.690 1.00 0.00 H new ATOM 0 HA ILE A 16 9.283 23.674 -19.674 1.00 0.00 H new ATOM 0 HB ILE A 16 10.354 25.224 -17.305 1.00 0.00 H new ATOM 0 HG12 ILE A 16 10.888 26.350 -19.405 1.00 0.00 H new ATOM 0 HG13 ILE A 16 12.329 25.657 -18.688 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.204 23.560 -17.359 1.00 0.00 H new ATOM 0 HG22 ILE A 16 10.632 22.791 -17.038 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.361 22.682 -18.658 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.289 25.273 -21.122 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.192 23.726 -20.247 1.00 0.00 H new ATOM 0 HD13 ILE A 16 10.729 24.429 -20.975 1.00 0.00 H new ATOM 258 N ALA A 17 7.408 24.208 -17.052 1.00 0.00 N ATOM 259 CA ALA A 17 6.549 23.559 -16.077 1.00 0.00 C ATOM 260 C ALA A 17 5.445 22.762 -16.763 1.00 0.00 C ATOM 261 O ALA A 17 5.106 21.666 -16.319 1.00 0.00 O ATOM 262 CB ALA A 17 5.957 24.617 -15.148 1.00 0.00 C ATOM 0 H ALA A 17 7.297 25.221 -17.101 1.00 0.00 H new ATOM 0 HA ALA A 17 7.142 22.856 -15.492 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.311 24.136 -14.414 1.00 0.00 H new ATOM 0 HB2 ALA A 17 6.762 25.142 -14.634 1.00 0.00 H new ATOM 0 HB3 ALA A 17 5.374 25.329 -15.732 1.00 0.00 H new ATOM 268 N MET A 18 4.877 23.300 -17.849 1.00 0.00 N ATOM 269 CA MET A 18 3.836 22.604 -18.588 1.00 0.00 C ATOM 270 C MET A 18 4.444 21.486 -19.433 1.00 0.00 C ATOM 271 O MET A 18 3.773 20.498 -19.726 1.00 0.00 O ATOM 272 CB MET A 18 3.067 23.596 -19.460 1.00 0.00 C ATOM 273 CG MET A 18 2.270 24.565 -18.588 1.00 0.00 C ATOM 274 SD MET A 18 1.349 25.802 -19.533 1.00 0.00 S ATOM 275 CE MET A 18 0.632 26.733 -18.155 1.00 0.00 C ATOM 0 H MET A 18 5.125 24.213 -18.229 1.00 0.00 H new ATOM 0 HA MET A 18 3.138 22.151 -17.884 1.00 0.00 H new ATOM 0 HB2 MET A 18 3.762 24.151 -20.090 1.00 0.00 H new ATOM 0 HB3 MET A 18 2.393 23.058 -20.126 1.00 0.00 H new ATOM 0 HG2 MET A 18 1.572 23.997 -17.973 1.00 0.00 H new ATOM 0 HG3 MET A 18 2.953 25.074 -17.908 1.00 0.00 H new ATOM 0 HE1 MET A 18 0.022 27.548 -18.545 1.00 0.00 H new ATOM 0 HE2 MET A 18 0.010 26.071 -17.553 1.00 0.00 H new ATOM 0 HE3 MET A 18 1.431 27.141 -17.537 1.00 0.00 H new ATOM 285 N MET A 19 5.714 21.631 -19.821 1.00 0.00 N ATOM 286 CA MET A 19 6.411 20.589 -20.557 1.00 0.00 C ATOM 287 C MET A 19 6.808 19.465 -19.602 1.00 0.00 C ATOM 288 O MET A 19 6.999 18.328 -20.025 1.00 0.00 O ATOM 289 CB MET A 19 7.633 21.195 -21.256 1.00 0.00 C ATOM 290 CG MET A 19 8.188 20.224 -22.302 1.00 0.00 C ATOM 291 SD MET A 19 7.041 19.895 -23.666 1.00 0.00 S ATOM 292 CE MET A 19 8.046 18.735 -24.626 1.00 0.00 C ATOM 0 H MET A 19 6.275 22.462 -19.635 1.00 0.00 H new ATOM 0 HA MET A 19 5.759 20.164 -21.320 1.00 0.00 H new ATOM 0 HB2 MET A 19 7.357 22.135 -21.734 1.00 0.00 H new ATOM 0 HB3 MET A 19 8.403 21.426 -20.520 1.00 0.00 H new ATOM 0 HG2 MET A 19 9.115 20.630 -22.707 1.00 0.00 H new ATOM 0 HG3 MET A 19 8.439 19.282 -21.814 1.00 0.00 H new ATOM 0 HE1 MET A 19 7.723 18.748 -25.667 1.00 0.00 H new ATOM 0 HE2 MET A 19 9.094 19.027 -24.568 1.00 0.00 H new ATOM 0 HE3 MET A 19 7.927 17.730 -24.222 1.00 0.00 H new ATOM 302 N LEU A 20 6.933 19.783 -18.308 1.00 0.00 N ATOM 303 CA LEU A 20 7.252 18.793 -17.293 1.00 0.00 C ATOM 304 C LEU A 20 6.055 17.877 -17.073 1.00 0.00 C ATOM 305 O LEU A 20 6.220 16.685 -16.824 1.00 0.00 O ATOM 306 CB LEU A 20 7.611 19.519 -15.990 1.00 0.00 C ATOM 307 CG LEU A 20 8.970 19.105 -15.416 1.00 0.00 C ATOM 308 CD1 LEU A 20 9.015 17.605 -15.134 1.00 0.00 C ATOM 309 CD2 LEU A 20 10.095 19.515 -16.362 1.00 0.00 C ATOM 0 H LEU A 20 6.815 20.729 -17.945 1.00 0.00 H new ATOM 0 HA LEU A 20 8.098 18.187 -17.617 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.614 20.594 -16.171 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.837 19.323 -15.248 1.00 0.00 H new ATOM 0 HG LEU A 20 9.111 19.624 -14.468 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.991 17.340 -14.728 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.240 17.347 -14.413 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.847 17.055 -16.060 1.00 0.00 H new ATOM 0 HD21 LEU A 20 11.054 19.214 -15.940 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.955 19.028 -17.327 1.00 0.00 H new ATOM 0 HD23 LEU A 20 10.082 20.597 -16.496 1.00 0.00 H new ATOM 321 N GLU A 21 4.844 18.437 -17.163 1.00 0.00 N ATOM 322 CA GLU A 21 3.621 17.661 -17.020 1.00 0.00 C ATOM 323 C GLU A 21 3.351 16.851 -18.288 1.00 0.00 C ATOM 324 O GLU A 21 2.632 15.857 -18.243 1.00 0.00 O ATOM 325 CB GLU A 21 2.448 18.594 -16.715 1.00 0.00 C ATOM 326 CG GLU A 21 2.652 19.317 -15.382 1.00 0.00 C ATOM 327 CD GLU A 21 1.433 20.171 -15.042 1.00 0.00 C ATOM 328 OE1 GLU A 21 0.564 19.661 -14.300 1.00 0.00 O ATOM 329 OE2 GLU A 21 1.379 21.328 -15.523 1.00 0.00 O ATOM 0 H GLU A 21 4.691 19.431 -17.335 1.00 0.00 H new ATOM 0 HA GLU A 21 3.739 16.963 -16.191 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.343 19.325 -17.517 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.522 18.020 -16.683 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.825 18.589 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.540 19.946 -15.436 1.00 0.00 H new ATOM 336 N ASP A 22 3.926 17.267 -19.423 1.00 0.00 N ATOM 337 CA ASP A 22 3.767 16.537 -20.671 1.00 0.00 C ATOM 338 C ASP A 22 4.545 15.224 -20.620 1.00 0.00 C ATOM 339 O ASP A 22 4.044 14.196 -21.073 1.00 0.00 O ATOM 340 CB ASP A 22 4.224 17.410 -21.838 1.00 0.00 C ATOM 341 CG ASP A 22 3.951 16.733 -23.176 1.00 0.00 C ATOM 342 OD1 ASP A 22 4.914 16.191 -23.762 1.00 0.00 O ATOM 343 OD2 ASP A 22 2.774 16.762 -23.605 1.00 0.00 O ATOM 0 H ASP A 22 4.503 18.105 -19.495 1.00 0.00 H new ATOM 0 HA ASP A 22 2.715 16.292 -20.817 1.00 0.00 H new ATOM 0 HB2 ASP A 22 3.708 18.369 -21.801 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.290 17.618 -21.744 1.00 0.00 H new ATOM 348 N PHE A 23 5.767 15.236 -20.069 1.00 0.00 N ATOM 349 CA PHE A 23 6.538 14.012 -19.928 1.00 0.00 C ATOM 350 C PHE A 23 5.975 13.150 -18.800 1.00 0.00 C ATOM 351 O PHE A 23 6.200 11.942 -18.787 1.00 0.00 O ATOM 352 CB PHE A 23 8.008 14.349 -19.677 1.00 0.00 C ATOM 353 CG PHE A 23 8.777 14.655 -20.944 1.00 0.00 C ATOM 354 CD1 PHE A 23 9.056 15.980 -21.304 1.00 0.00 C ATOM 355 CD2 PHE A 23 9.214 13.603 -21.759 1.00 0.00 C ATOM 356 CE1 PHE A 23 9.760 16.250 -22.486 1.00 0.00 C ATOM 357 CE2 PHE A 23 9.926 13.874 -22.937 1.00 0.00 C ATOM 358 CZ PHE A 23 10.198 15.199 -23.301 1.00 0.00 C ATOM 0 H PHE A 23 6.231 16.075 -19.720 1.00 0.00 H new ATOM 0 HA PHE A 23 6.466 13.440 -20.853 1.00 0.00 H new ATOM 0 HB2 PHE A 23 8.068 15.207 -19.008 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.483 13.512 -19.165 1.00 0.00 H new ATOM 0 HD1 PHE A 23 8.729 16.792 -20.672 1.00 0.00 H new ATOM 0 HD2 PHE A 23 9.002 12.581 -21.480 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.965 17.272 -22.769 1.00 0.00 H new ATOM 0 HE2 PHE A 23 10.264 13.061 -23.563 1.00 0.00 H new ATOM 0 HZ PHE A 23 10.744 15.410 -24.208 1.00 0.00 H new ATOM 368 N LEU A 24 5.247 13.750 -17.853 1.00 0.00 N ATOM 369 CA LEU A 24 4.634 12.989 -16.776 1.00 0.00 C ATOM 370 C LEU A 24 3.472 12.154 -17.326 1.00 0.00 C ATOM 371 O LEU A 24 3.096 11.147 -16.730 1.00 0.00 O ATOM 372 CB LEU A 24 4.170 13.964 -15.688 1.00 0.00 C ATOM 373 CG LEU A 24 3.800 13.246 -14.387 1.00 0.00 C ATOM 374 CD1 LEU A 24 5.035 12.628 -13.731 1.00 0.00 C ATOM 375 CD2 LEU A 24 3.183 14.246 -13.413 1.00 0.00 C ATOM 0 H LEU A 24 5.072 14.754 -17.816 1.00 0.00 H new ATOM 0 HA LEU A 24 5.353 12.297 -16.338 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.961 14.687 -15.489 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.308 14.525 -16.049 1.00 0.00 H new ATOM 0 HG LEU A 24 3.090 12.454 -14.626 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.744 12.125 -12.809 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.486 11.906 -14.412 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.757 13.412 -13.504 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.919 13.736 -12.486 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.902 15.037 -13.200 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.287 14.680 -13.856 1.00 0.00 H new ATOM 387 N GLU A 25 2.904 12.565 -18.463 1.00 0.00 N ATOM 388 CA GLU A 25 1.825 11.830 -19.104 1.00 0.00 C ATOM 389 C GLU A 25 2.383 10.724 -20.000 1.00 0.00 C ATOM 390 O GLU A 25 1.729 9.702 -20.202 1.00 0.00 O ATOM 391 CB GLU A 25 0.962 12.816 -19.897 1.00 0.00 C ATOM 392 CG GLU A 25 -0.286 12.130 -20.455 1.00 0.00 C ATOM 393 CD GLU A 25 -1.191 13.140 -21.162 1.00 0.00 C ATOM 394 OE1 GLU A 25 -1.003 13.324 -22.387 1.00 0.00 O ATOM 395 OE2 GLU A 25 -2.061 13.718 -20.474 1.00 0.00 O ATOM 0 H GLU A 25 3.181 13.413 -18.958 1.00 0.00 H new ATOM 0 HA GLU A 25 1.206 11.345 -18.349 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.668 13.646 -19.254 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.545 13.238 -20.715 1.00 0.00 H new ATOM 0 HG2 GLU A 25 0.006 11.346 -21.153 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.834 11.648 -19.645 1.00 0.00 H new ATOM 402 N VAL A 26 3.593 10.916 -20.539 1.00 0.00 N ATOM 403 CA VAL A 26 4.246 9.905 -21.362 1.00 0.00 C ATOM 404 C VAL A 26 4.709 8.736 -20.489 1.00 0.00 C ATOM 405 O VAL A 26 4.876 7.620 -20.981 1.00 0.00 O ATOM 406 CB VAL A 26 5.419 10.542 -22.120 1.00 0.00 C ATOM 407 CG1 VAL A 26 6.223 9.501 -22.897 1.00 0.00 C ATOM 408 CG2 VAL A 26 4.897 11.565 -23.127 1.00 0.00 C ATOM 0 H VAL A 26 4.138 11.769 -20.416 1.00 0.00 H new ATOM 0 HA VAL A 26 3.540 9.512 -22.093 1.00 0.00 H new ATOM 0 HB VAL A 26 6.060 11.014 -21.375 1.00 0.00 H new ATOM 0 HG11 VAL A 26 7.044 9.991 -23.420 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.624 8.760 -22.205 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.575 9.007 -23.621 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.736 12.012 -23.660 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.237 11.070 -23.839 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.345 12.344 -22.601 1.00 0.00 H new ATOM 418 N LEU A 27 4.913 8.987 -19.190 1.00 0.00 N ATOM 419 CA LEU A 27 5.305 7.958 -18.236 1.00 0.00 C ATOM 420 C LEU A 27 4.086 7.315 -17.571 1.00 0.00 C ATOM 421 O LEU A 27 4.246 6.496 -16.668 1.00 0.00 O ATOM 422 CB LEU A 27 6.253 8.559 -17.191 1.00 0.00 C ATOM 423 CG LEU A 27 7.574 9.037 -17.805 1.00 0.00 C ATOM 424 CD1 LEU A 27 8.412 9.700 -16.714 1.00 0.00 C ATOM 425 CD2 LEU A 27 8.372 7.877 -18.397 1.00 0.00 C ATOM 0 H LEU A 27 4.809 9.913 -18.776 1.00 0.00 H new ATOM 0 HA LEU A 27 5.827 7.167 -18.774 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.761 9.397 -16.698 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.461 7.814 -16.423 1.00 0.00 H new ATOM 0 HG LEU A 27 7.343 9.739 -18.606 1.00 0.00 H new ATOM 0 HD11 LEU A 27 9.355 10.045 -17.138 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.867 10.550 -16.303 1.00 0.00 H new ATOM 0 HD13 LEU A 27 8.613 8.980 -15.921 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.302 8.255 -18.823 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.599 7.154 -17.613 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.786 7.393 -19.178 1.00 0.00 H new ATOM 437 N ASP A 28 2.873 7.679 -18.007 1.00 0.00 N ATOM 438 CA ASP A 28 1.626 7.177 -17.436 1.00 0.00 C ATOM 439 C ASP A 28 1.615 7.322 -15.910 1.00 0.00 C ATOM 440 O ASP A 28 1.083 6.474 -15.191 1.00 0.00 O ATOM 441 CB ASP A 28 1.366 5.748 -17.917 1.00 0.00 C ATOM 442 CG ASP A 28 -0.031 5.259 -17.544 1.00 0.00 C ATOM 443 OD1 ASP A 28 -0.993 6.032 -17.750 1.00 0.00 O ATOM 444 OD2 ASP A 28 -0.132 4.110 -17.056 1.00 0.00 O ATOM 0 H ASP A 28 2.733 8.337 -18.774 1.00 0.00 H new ATOM 0 HA ASP A 28 0.795 7.786 -17.792 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.488 5.703 -18.999 1.00 0.00 H new ATOM 0 HB3 ASP A 28 2.111 5.080 -17.484 1.00 0.00 H new ATOM 449 N LYS A 29 2.211 8.410 -15.413 1.00 0.00 N ATOM 450 CA LYS A 29 2.372 8.672 -13.991 1.00 0.00 C ATOM 451 C LYS A 29 1.137 9.355 -13.415 1.00 0.00 C ATOM 452 O LYS A 29 0.377 9.992 -14.144 1.00 0.00 O ATOM 453 CB LYS A 29 3.616 9.548 -13.802 1.00 0.00 C ATOM 454 CG LYS A 29 4.736 8.805 -13.078 1.00 0.00 C ATOM 455 CD LYS A 29 4.333 8.570 -11.627 1.00 0.00 C ATOM 456 CE LYS A 29 5.496 7.968 -10.854 1.00 0.00 C ATOM 457 NZ LYS A 29 5.804 6.603 -11.329 1.00 0.00 N ATOM 0 H LYS A 29 2.601 9.144 -16.005 1.00 0.00 H new ATOM 0 HA LYS A 29 2.495 7.730 -13.457 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.974 9.884 -14.775 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.348 10.440 -13.236 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.933 7.853 -13.571 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.659 9.384 -13.121 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.029 9.511 -11.168 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.473 7.902 -11.584 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.376 8.601 -10.964 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.254 7.940 -9.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.343 6.095 -10.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.918 6.094 -11.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.369 6.658 -12.201 1.00 0.00 H new ATOM 471 N THR A 30 0.934 9.229 -12.099 1.00 0.00 N ATOM 472 CA THR A 30 -0.166 9.903 -11.424 1.00 0.00 C ATOM 473 C THR A 30 0.315 11.268 -10.923 1.00 0.00 C ATOM 474 O THR A 30 1.253 11.334 -10.129 1.00 0.00 O ATOM 475 CB THR A 30 -0.703 9.034 -10.280 1.00 0.00 C ATOM 476 OG1 THR A 30 -1.168 7.809 -10.803 1.00 0.00 O ATOM 477 CG2 THR A 30 -1.872 9.724 -9.576 1.00 0.00 C ATOM 0 H THR A 30 1.521 8.665 -11.485 1.00 0.00 H new ATOM 0 HA THR A 30 -0.989 10.061 -12.121 1.00 0.00 H new ATOM 0 HB THR A 30 0.105 8.872 -9.567 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.510 7.251 -10.074 1.00 0.00 H new ATOM 0 HG21 THR A 30 -2.236 9.089 -8.768 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.538 10.677 -9.166 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.676 9.898 -10.291 1.00 0.00 H new ATOM 485 N PRO A 31 -0.307 12.366 -11.374 1.00 0.00 N ATOM 486 CA PRO A 31 0.071 13.714 -10.985 1.00 0.00 C ATOM 487 C PRO A 31 -0.450 14.060 -9.594 1.00 0.00 C ATOM 488 O PRO A 31 -1.355 13.398 -9.087 1.00 0.00 O ATOM 489 CB PRO A 31 -0.566 14.613 -12.044 1.00 0.00 C ATOM 490 CG PRO A 31 -1.847 13.860 -12.387 1.00 0.00 C ATOM 491 CD PRO A 31 -1.415 12.398 -12.311 1.00 0.00 C ATOM 0 HA PRO A 31 1.153 13.834 -10.933 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -0.773 15.611 -11.658 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.079 14.735 -12.914 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.647 14.082 -11.681 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.216 14.121 -13.379 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -2.234 11.764 -11.971 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -1.111 12.028 -13.290 1.00 0.00 H new ATOM 499 N VAL A 32 0.119 15.104 -8.980 1.00 0.00 N ATOM 500 CA VAL A 32 -0.340 15.596 -7.687 1.00 0.00 C ATOM 501 C VAL A 32 -0.370 17.121 -7.655 1.00 0.00 C ATOM 502 O VAL A 32 -1.215 17.702 -6.975 1.00 0.00 O ATOM 503 CB VAL A 32 0.550 15.065 -6.556 1.00 0.00 C ATOM 504 CG1 VAL A 32 0.450 13.547 -6.475 1.00 0.00 C ATOM 505 CG2 VAL A 32 2.031 15.407 -6.747 1.00 0.00 C ATOM 0 H VAL A 32 0.906 15.625 -9.367 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.356 15.230 -7.538 1.00 0.00 H new ATOM 0 HB VAL A 32 0.189 15.545 -5.646 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.086 13.183 -5.668 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.583 13.260 -6.280 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.775 13.110 -7.419 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.608 15.004 -5.914 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.388 14.971 -7.680 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.153 16.490 -6.782 1.00 0.00 H new ATOM 515 N GLY A 33 0.536 17.777 -8.381 1.00 0.00 N ATOM 516 CA GLY A 33 0.547 19.225 -8.464 1.00 0.00 C ATOM 517 C GLY A 33 1.863 19.758 -9.017 1.00 0.00 C ATOM 518 O GLY A 33 2.798 19.002 -9.269 1.00 0.00 O ATOM 0 H GLY A 33 1.272 17.320 -8.920 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.274 19.557 -9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.374 19.646 -7.474 1.00 0.00 H new ATOM 522 N THR A 34 1.914 21.080 -9.198 1.00 0.00 N ATOM 523 CA THR A 34 3.106 21.800 -9.623 1.00 0.00 C ATOM 524 C THR A 34 3.176 23.105 -8.838 1.00 0.00 C ATOM 525 O THR A 34 2.142 23.719 -8.577 1.00 0.00 O ATOM 526 CB THR A 34 3.057 22.068 -11.130 1.00 0.00 C ATOM 527 OG1 THR A 34 2.991 20.847 -11.831 1.00 0.00 O ATOM 528 CG2 THR A 34 4.302 22.822 -11.596 1.00 0.00 C ATOM 0 H THR A 34 1.109 21.688 -9.049 1.00 0.00 H new ATOM 0 HA THR A 34 3.998 21.205 -9.427 1.00 0.00 H new ATOM 0 HB THR A 34 2.173 22.673 -11.331 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.958 21.024 -12.794 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.240 22.998 -12.670 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.365 23.777 -11.074 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.190 22.229 -11.377 1.00 0.00 H new ATOM 536 N VAL A 35 4.385 23.533 -8.464 1.00 0.00 N ATOM 537 CA VAL A 35 4.576 24.750 -7.688 1.00 0.00 C ATOM 538 C VAL A 35 5.729 25.578 -8.254 1.00 0.00 C ATOM 539 O VAL A 35 6.626 25.048 -8.912 1.00 0.00 O ATOM 540 CB VAL A 35 4.798 24.418 -6.205 1.00 0.00 C ATOM 541 CG1 VAL A 35 3.544 23.790 -5.595 1.00 0.00 C ATOM 542 CG2 VAL A 35 5.964 23.450 -6.008 1.00 0.00 C ATOM 0 H VAL A 35 5.251 23.045 -8.692 1.00 0.00 H new ATOM 0 HA VAL A 35 3.670 25.352 -7.761 1.00 0.00 H new ATOM 0 HB VAL A 35 5.027 25.360 -5.707 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.725 23.563 -4.544 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.711 24.488 -5.677 1.00 0.00 H new ATOM 0 HG13 VAL A 35 3.301 22.871 -6.128 1.00 0.00 H new ATOM 0 HG21 VAL A 35 6.088 23.241 -4.945 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.759 22.521 -6.539 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.878 23.897 -6.399 1.00 0.00 H new ATOM 552 N ASP A 36 5.694 26.889 -7.992 1.00 0.00 N ATOM 553 CA ASP A 36 6.685 27.833 -8.490 1.00 0.00 C ATOM 554 C ASP A 36 7.721 28.185 -7.421 1.00 0.00 C ATOM 555 O ASP A 36 8.615 28.992 -7.671 1.00 0.00 O ATOM 556 CB ASP A 36 5.978 29.088 -9.006 1.00 0.00 C ATOM 557 CG ASP A 36 4.995 28.753 -10.125 1.00 0.00 C ATOM 558 OD1 ASP A 36 5.457 28.632 -11.282 1.00 0.00 O ATOM 559 OD2 ASP A 36 3.791 28.616 -9.814 1.00 0.00 O ATOM 0 H ASP A 36 4.968 27.323 -7.422 1.00 0.00 H new ATOM 0 HA ASP A 36 7.228 27.364 -9.311 1.00 0.00 H new ATOM 0 HB2 ASP A 36 5.447 29.572 -8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 36 6.718 29.800 -9.371 1.00 0.00 H new ATOM 564 N THR A 37 7.610 27.585 -6.231 1.00 0.00 N ATOM 565 CA THR A 37 8.535 27.820 -5.129 1.00 0.00 C ATOM 566 C THR A 37 8.892 26.499 -4.460 1.00 0.00 C ATOM 567 O THR A 37 8.120 25.539 -4.505 1.00 0.00 O ATOM 568 CB THR A 37 7.930 28.790 -4.106 1.00 0.00 C ATOM 569 OG1 THR A 37 6.735 28.248 -3.583 1.00 0.00 O ATOM 570 CG2 THR A 37 7.629 30.147 -4.739 1.00 0.00 C ATOM 0 H THR A 37 6.870 26.919 -6.009 1.00 0.00 H new ATOM 0 HA THR A 37 9.442 28.272 -5.529 1.00 0.00 H new ATOM 0 HB THR A 37 8.658 28.933 -3.308 1.00 0.00 H new ATOM 0 HG1 THR A 37 6.353 28.870 -2.929 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.201 30.812 -3.988 1.00 0.00 H new ATOM 0 HG22 THR A 37 8.551 30.581 -5.125 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.919 30.018 -5.556 1.00 0.00 H new ATOM 578 N VAL A 38 10.069 26.444 -3.830 1.00 0.00 N ATOM 579 CA VAL A 38 10.533 25.234 -3.159 1.00 0.00 C ATOM 580 C VAL A 38 9.895 25.082 -1.782 1.00 0.00 C ATOM 581 O VAL A 38 9.828 23.971 -1.255 1.00 0.00 O ATOM 582 CB VAL A 38 12.059 25.232 -3.056 1.00 0.00 C ATOM 583 CG1 VAL A 38 12.691 25.282 -4.444 1.00 0.00 C ATOM 584 CG2 VAL A 38 12.573 26.420 -2.238 1.00 0.00 C ATOM 0 H VAL A 38 10.718 27.229 -3.773 1.00 0.00 H new ATOM 0 HA VAL A 38 10.226 24.378 -3.759 1.00 0.00 H new ATOM 0 HB VAL A 38 12.342 24.308 -2.551 1.00 0.00 H new ATOM 0 HG11 VAL A 38 13.777 25.280 -4.350 1.00 0.00 H new ATOM 0 HG12 VAL A 38 12.375 24.412 -5.019 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.373 26.190 -4.956 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.661 26.383 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.263 27.351 -2.713 1.00 0.00 H new ATOM 0 HG23 VAL A 38 12.161 26.373 -1.230 1.00 0.00 H new ATOM 594 N ALA A 39 9.424 26.186 -1.193 1.00 0.00 N ATOM 595 CA ALA A 39 8.806 26.147 0.121 1.00 0.00 C ATOM 596 C ALA A 39 7.421 25.507 0.045 1.00 0.00 C ATOM 597 O ALA A 39 6.944 24.948 1.031 1.00 0.00 O ATOM 598 CB ALA A 39 8.724 27.573 0.668 1.00 0.00 C ATOM 0 H ALA A 39 9.463 27.115 -1.612 1.00 0.00 H new ATOM 0 HA ALA A 39 9.409 25.538 0.794 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.262 27.558 1.655 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.727 27.992 0.744 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.124 28.187 -0.004 1.00 0.00 H new ATOM 604 N GLY A 40 6.772 25.583 -1.119 1.00 0.00 N ATOM 605 CA GLY A 40 5.477 24.957 -1.327 1.00 0.00 C ATOM 606 C GLY A 40 5.629 23.454 -1.555 1.00 0.00 C ATOM 607 O GLY A 40 4.689 22.695 -1.326 1.00 0.00 O ATOM 0 H GLY A 40 7.132 26.078 -1.935 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.839 25.135 -0.461 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.983 25.411 -2.186 1.00 0.00 H new ATOM 611 N ALA A 41 6.809 23.016 -2.003 1.00 0.00 N ATOM 612 CA ALA A 41 7.066 21.607 -2.242 1.00 0.00 C ATOM 613 C ALA A 41 7.405 20.893 -0.937 1.00 0.00 C ATOM 614 O ALA A 41 7.148 19.702 -0.797 1.00 0.00 O ATOM 615 CB ALA A 41 8.209 21.479 -3.247 1.00 0.00 C ATOM 0 H ALA A 41 7.600 23.627 -2.206 1.00 0.00 H new ATOM 0 HA ALA A 41 6.172 21.135 -2.650 1.00 0.00 H new ATOM 0 HB1 ALA A 41 8.412 20.425 -3.435 1.00 0.00 H new ATOM 0 HB2 ALA A 41 7.929 21.967 -4.181 1.00 0.00 H new ATOM 0 HB3 ALA A 41 9.103 21.954 -2.844 1.00 0.00 H new ATOM 621 N LEU A 42 7.982 21.616 0.027 1.00 0.00 N ATOM 622 CA LEU A 42 8.321 21.048 1.319 1.00 0.00 C ATOM 623 C LEU A 42 7.053 20.919 2.157 1.00 0.00 C ATOM 624 O LEU A 42 6.875 19.934 2.870 1.00 0.00 O ATOM 625 CB LEU A 42 9.391 21.947 1.962 1.00 0.00 C ATOM 626 CG LEU A 42 10.021 21.435 3.266 1.00 0.00 C ATOM 627 CD1 LEU A 42 9.122 21.664 4.477 1.00 0.00 C ATOM 628 CD2 LEU A 42 10.380 19.954 3.174 1.00 0.00 C ATOM 0 H LEU A 42 8.222 22.602 -0.072 1.00 0.00 H new ATOM 0 HA LEU A 42 8.737 20.044 1.232 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.189 22.102 1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.945 22.922 2.158 1.00 0.00 H new ATOM 0 HG LEU A 42 10.933 22.016 3.404 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.614 21.284 5.372 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.932 22.731 4.592 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.177 21.141 4.333 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.823 19.628 4.115 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.479 19.373 2.976 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.094 19.802 2.365 1.00 0.00 H new ATOM 640 N ALA A 43 6.162 21.911 2.071 1.00 0.00 N ATOM 641 CA ALA A 43 4.942 21.928 2.859 1.00 0.00 C ATOM 642 C ALA A 43 3.914 20.907 2.360 1.00 0.00 C ATOM 643 O ALA A 43 3.087 20.443 3.146 1.00 0.00 O ATOM 644 CB ALA A 43 4.364 23.342 2.826 1.00 0.00 C ATOM 0 H ALA A 43 6.271 22.717 1.455 1.00 0.00 H new ATOM 0 HA ALA A 43 5.183 21.643 3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.446 23.374 3.413 1.00 0.00 H new ATOM 0 HB2 ALA A 43 5.088 24.041 3.246 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.145 23.622 1.795 1.00 0.00 H new ATOM 650 N ARG A 44 3.953 20.550 1.072 1.00 0.00 N ATOM 651 CA ARG A 44 3.024 19.566 0.526 1.00 0.00 C ATOM 652 C ARG A 44 3.547 18.140 0.688 1.00 0.00 C ATOM 653 O ARG A 44 2.747 17.207 0.727 1.00 0.00 O ATOM 654 CB ARG A 44 2.729 19.879 -0.941 1.00 0.00 C ATOM 655 CG ARG A 44 1.879 21.144 -1.060 1.00 0.00 C ATOM 656 CD ARG A 44 1.517 21.413 -2.522 1.00 0.00 C ATOM 657 NE ARG A 44 0.681 20.334 -3.061 1.00 0.00 N ATOM 658 CZ ARG A 44 0.087 20.362 -4.256 1.00 0.00 C ATOM 659 NH1 ARG A 44 0.228 21.407 -5.065 1.00 0.00 N ATOM 660 NH2 ARG A 44 -0.656 19.329 -4.643 1.00 0.00 N ATOM 0 H ARG A 44 4.616 20.928 0.395 1.00 0.00 H new ATOM 0 HA ARG A 44 2.095 19.630 1.093 1.00 0.00 H new ATOM 0 HB2 ARG A 44 3.664 20.010 -1.486 1.00 0.00 H new ATOM 0 HB3 ARG A 44 2.207 19.039 -1.400 1.00 0.00 H new ATOM 0 HG2 ARG A 44 0.970 21.035 -0.469 1.00 0.00 H new ATOM 0 HG3 ARG A 44 2.424 21.995 -0.652 1.00 0.00 H new ATOM 0 HD2 ARG A 44 0.988 22.363 -2.601 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.427 21.505 -3.115 1.00 0.00 H new ATOM 0 HE ARG A 44 0.544 19.505 -2.482 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.797 22.203 -4.776 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.232 21.413 -5.975 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.769 18.523 -4.028 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.113 19.343 -5.555 1.00 0.00 H new ATOM 674 N VAL A 45 4.864 17.952 0.787 1.00 0.00 N ATOM 675 CA VAL A 45 5.431 16.625 0.997 1.00 0.00 C ATOM 676 C VAL A 45 5.406 16.264 2.481 1.00 0.00 C ATOM 677 O VAL A 45 5.366 15.084 2.831 1.00 0.00 O ATOM 678 CB VAL A 45 6.844 16.565 0.407 1.00 0.00 C ATOM 679 CG1 VAL A 45 7.538 15.254 0.772 1.00 0.00 C ATOM 680 CG2 VAL A 45 6.758 16.637 -1.120 1.00 0.00 C ATOM 0 H VAL A 45 5.554 18.701 0.725 1.00 0.00 H new ATOM 0 HA VAL A 45 4.825 15.882 0.479 1.00 0.00 H new ATOM 0 HB VAL A 45 7.412 17.402 0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 45 8.539 15.239 0.340 1.00 0.00 H new ATOM 0 HG12 VAL A 45 7.610 15.170 1.856 1.00 0.00 H new ATOM 0 HG13 VAL A 45 6.962 14.416 0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.762 16.595 -1.543 1.00 0.00 H new ATOM 0 HG22 VAL A 45 6.172 15.797 -1.491 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.279 17.571 -1.414 1.00 0.00 H new ATOM 690 N GLU A 46 5.426 17.270 3.362 1.00 0.00 N ATOM 691 CA GLU A 46 5.339 17.046 4.801 1.00 0.00 C ATOM 692 C GLU A 46 3.898 16.709 5.199 1.00 0.00 C ATOM 693 O GLU A 46 3.649 16.190 6.287 1.00 0.00 O ATOM 694 CB GLU A 46 5.854 18.292 5.523 1.00 0.00 C ATOM 695 CG GLU A 46 5.921 18.081 7.035 1.00 0.00 C ATOM 696 CD GLU A 46 6.586 19.270 7.720 1.00 0.00 C ATOM 697 OE1 GLU A 46 5.883 20.282 7.942 1.00 0.00 O ATOM 698 OE2 GLU A 46 7.797 19.159 8.019 1.00 0.00 O ATOM 0 H GLU A 46 5.502 18.252 3.097 1.00 0.00 H new ATOM 0 HA GLU A 46 5.957 16.196 5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.845 18.547 5.147 1.00 0.00 H new ATOM 0 HB3 GLU A 46 5.202 19.137 5.302 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.915 17.943 7.432 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.478 17.171 7.255 1.00 0.00 H new ATOM 705 N ASP A 47 2.943 17.004 4.313 1.00 0.00 N ATOM 706 CA ASP A 47 1.537 16.700 4.523 1.00 0.00 C ATOM 707 C ASP A 47 1.197 15.296 4.012 1.00 0.00 C ATOM 708 O ASP A 47 0.122 14.769 4.303 1.00 0.00 O ATOM 709 CB ASP A 47 0.690 17.770 3.832 1.00 0.00 C ATOM 710 CG ASP A 47 -0.796 17.590 4.127 1.00 0.00 C ATOM 711 OD1 ASP A 47 -1.165 17.690 5.319 1.00 0.00 O ATOM 712 OD2 ASP A 47 -1.555 17.354 3.162 1.00 0.00 O ATOM 0 H ASP A 47 3.133 17.465 3.423 1.00 0.00 H new ATOM 0 HA ASP A 47 1.317 16.709 5.591 1.00 0.00 H new ATOM 0 HB2 ASP A 47 1.010 18.758 4.164 1.00 0.00 H new ATOM 0 HB3 ASP A 47 0.855 17.726 2.756 1.00 0.00 H new ATOM 717 N GLY A 48 2.111 14.688 3.251 1.00 0.00 N ATOM 718 CA GLY A 48 1.910 13.371 2.665 1.00 0.00 C ATOM 719 C GLY A 48 1.108 13.457 1.368 1.00 0.00 C ATOM 720 O GLY A 48 0.855 14.545 0.852 1.00 0.00 O ATOM 0 H GLY A 48 3.015 15.103 3.026 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.876 12.907 2.467 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.388 12.730 3.376 1.00 0.00 H new ATOM 724 N GLY A 49 0.705 12.300 0.834 1.00 0.00 N ATOM 725 CA GLY A 49 -0.048 12.240 -0.413 1.00 0.00 C ATOM 726 C GLY A 49 0.857 12.401 -1.635 1.00 0.00 C ATOM 727 O GLY A 49 0.358 12.590 -2.745 1.00 0.00 O ATOM 0 H GLY A 49 0.892 11.389 1.253 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.574 11.287 -0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.806 13.023 -0.417 1.00 0.00 H new ATOM 731 N ILE A 50 2.179 12.335 -1.437 1.00 0.00 N ATOM 732 CA ILE A 50 3.167 12.445 -2.501 1.00 0.00 C ATOM 733 C ILE A 50 4.283 11.439 -2.233 1.00 0.00 C ATOM 734 O ILE A 50 4.623 11.194 -1.076 1.00 0.00 O ATOM 735 CB ILE A 50 3.709 13.883 -2.560 1.00 0.00 C ATOM 736 CG1 ILE A 50 2.555 14.867 -2.793 1.00 0.00 C ATOM 737 CG2 ILE A 50 4.753 14.011 -3.675 1.00 0.00 C ATOM 738 CD1 ILE A 50 3.031 16.314 -2.901 1.00 0.00 C ATOM 0 H ILE A 50 2.593 12.201 -0.514 1.00 0.00 H new ATOM 0 HA ILE A 50 2.716 12.222 -3.468 1.00 0.00 H new ATOM 0 HB ILE A 50 4.187 14.121 -1.610 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.027 14.593 -3.706 1.00 0.00 H new ATOM 0 HG13 ILE A 50 1.840 14.784 -1.974 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.129 15.034 -3.706 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.579 13.327 -3.480 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.295 13.764 -4.633 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.174 16.968 -3.066 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.535 16.601 -1.978 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.724 16.408 -3.737 1.00 0.00 H new ATOM 750 N ASP A 51 4.853 10.852 -3.292 1.00 0.00 N ATOM 751 CA ASP A 51 5.882 9.829 -3.137 1.00 0.00 C ATOM 752 C ASP A 51 7.286 10.379 -3.383 1.00 0.00 C ATOM 753 O ASP A 51 8.245 9.886 -2.790 1.00 0.00 O ATOM 754 CB ASP A 51 5.619 8.677 -4.107 1.00 0.00 C ATOM 755 CG ASP A 51 4.323 7.936 -3.813 1.00 0.00 C ATOM 756 OD1 ASP A 51 4.154 7.510 -2.650 1.00 0.00 O ATOM 757 OD2 ASP A 51 3.515 7.799 -4.756 1.00 0.00 O ATOM 0 H ASP A 51 4.617 11.070 -4.260 1.00 0.00 H new ATOM 0 HA ASP A 51 5.834 9.478 -2.106 1.00 0.00 H new ATOM 0 HB2 ASP A 51 5.585 9.067 -5.124 1.00 0.00 H new ATOM 0 HB3 ASP A 51 6.451 7.974 -4.062 1.00 0.00 H new ATOM 762 N ALA A 52 7.418 11.388 -4.247 1.00 0.00 N ATOM 763 CA ALA A 52 8.705 12.011 -4.543 1.00 0.00 C ATOM 764 C ALA A 52 8.498 13.372 -5.210 1.00 0.00 C ATOM 765 O ALA A 52 7.364 13.768 -5.471 1.00 0.00 O ATOM 766 CB ALA A 52 9.504 11.090 -5.465 1.00 0.00 C ATOM 0 H ALA A 52 6.635 11.794 -4.759 1.00 0.00 H new ATOM 0 HA ALA A 52 9.254 12.166 -3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 52 10.467 11.548 -5.691 1.00 0.00 H new ATOM 0 HB2 ALA A 52 9.665 10.132 -4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.951 10.933 -6.391 1.00 0.00 H new ATOM 772 N ALA A 53 9.586 14.094 -5.490 1.00 0.00 N ATOM 773 CA ALA A 53 9.498 15.393 -6.141 1.00 0.00 C ATOM 774 C ALA A 53 10.712 15.685 -7.021 1.00 0.00 C ATOM 775 O ALA A 53 11.762 15.057 -6.879 1.00 0.00 O ATOM 776 CB ALA A 53 9.345 16.472 -5.068 1.00 0.00 C ATOM 0 H ALA A 53 10.537 13.796 -5.274 1.00 0.00 H new ATOM 0 HA ALA A 53 8.630 15.388 -6.800 1.00 0.00 H new ATOM 0 HB1 ALA A 53 9.278 17.451 -5.543 1.00 0.00 H new ATOM 0 HB2 ALA A 53 8.439 16.286 -4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 53 10.209 16.450 -4.404 1.00 0.00 H new ATOM 782 N ILE A 54 10.557 16.651 -7.928 1.00 0.00 N ATOM 783 CA ILE A 54 11.619 17.142 -8.798 1.00 0.00 C ATOM 784 C ILE A 54 11.869 18.601 -8.429 1.00 0.00 C ATOM 785 O ILE A 54 10.938 19.404 -8.445 1.00 0.00 O ATOM 786 CB ILE A 54 11.202 17.000 -10.266 1.00 0.00 C ATOM 787 CG1 ILE A 54 10.967 15.520 -10.597 1.00 0.00 C ATOM 788 CG2 ILE A 54 12.278 17.600 -11.177 1.00 0.00 C ATOM 789 CD1 ILE A 54 10.461 15.325 -12.030 1.00 0.00 C ATOM 0 H ILE A 54 9.666 17.123 -8.079 1.00 0.00 H new ATOM 0 HA ILE A 54 12.535 16.565 -8.668 1.00 0.00 H new ATOM 0 HB ILE A 54 10.272 17.544 -10.433 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.896 14.967 -10.462 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.243 15.103 -9.897 1.00 0.00 H new ATOM 0 HG21 ILE A 54 11.973 17.495 -12.218 1.00 0.00 H new ATOM 0 HG22 ILE A 54 12.406 18.657 -10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 54 13.221 17.076 -11.020 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.308 14.263 -12.221 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.518 15.856 -12.158 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.196 15.718 -12.732 1.00 0.00 H new ATOM 801 N LEU A 55 13.116 18.948 -8.104 1.00 0.00 N ATOM 802 CA LEU A 55 13.447 20.269 -7.591 1.00 0.00 C ATOM 803 C LEU A 55 14.349 21.036 -8.552 1.00 0.00 C ATOM 804 O LEU A 55 15.423 20.563 -8.919 1.00 0.00 O ATOM 805 CB LEU A 55 14.149 20.126 -6.232 1.00 0.00 C ATOM 806 CG LEU A 55 13.224 19.958 -5.017 1.00 0.00 C ATOM 807 CD1 LEU A 55 12.460 21.255 -4.755 1.00 0.00 C ATOM 808 CD2 LEU A 55 12.226 18.812 -5.178 1.00 0.00 C ATOM 0 H LEU A 55 13.917 18.322 -8.190 1.00 0.00 H new ATOM 0 HA LEU A 55 12.520 20.831 -7.480 1.00 0.00 H new ATOM 0 HB2 LEU A 55 14.817 19.266 -6.278 1.00 0.00 H new ATOM 0 HB3 LEU A 55 14.772 21.006 -6.072 1.00 0.00 H new ATOM 0 HG LEU A 55 13.867 19.715 -4.171 1.00 0.00 H new ATOM 0 HD11 LEU A 55 11.807 21.125 -3.892 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.167 22.060 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.859 21.506 -5.629 1.00 0.00 H new ATOM 0 HD21 LEU A 55 11.602 18.745 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.597 18.997 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU A 55 12.766 17.875 -5.313 1.00 0.00 H new ATOM 820 N ASP A 56 13.911 22.230 -8.953 1.00 0.00 N ATOM 821 CA ASP A 56 14.754 23.166 -9.684 1.00 0.00 C ATOM 822 C ASP A 56 15.717 23.854 -8.716 1.00 0.00 C ATOM 823 O ASP A 56 15.312 24.266 -7.628 1.00 0.00 O ATOM 824 CB ASP A 56 13.873 24.202 -10.385 1.00 0.00 C ATOM 825 CG ASP A 56 14.692 25.393 -10.875 1.00 0.00 C ATOM 826 OD1 ASP A 56 15.639 25.159 -11.657 1.00 0.00 O ATOM 827 OD2 ASP A 56 14.366 26.529 -10.466 1.00 0.00 O ATOM 0 H ASP A 56 12.965 22.571 -8.779 1.00 0.00 H new ATOM 0 HA ASP A 56 15.335 22.629 -10.434 1.00 0.00 H new ATOM 0 HB2 ASP A 56 13.364 23.737 -11.229 1.00 0.00 H new ATOM 0 HB3 ASP A 56 13.100 24.548 -9.699 1.00 0.00 H new ATOM 832 N VAL A 57 16.989 23.979 -9.107 1.00 0.00 N ATOM 833 CA VAL A 57 17.995 24.652 -8.292 1.00 0.00 C ATOM 834 C VAL A 57 18.205 26.093 -8.762 1.00 0.00 C ATOM 835 O VAL A 57 18.813 26.891 -8.051 1.00 0.00 O ATOM 836 CB VAL A 57 19.287 23.825 -8.289 1.00 0.00 C ATOM 837 CG1 VAL A 57 19.958 23.825 -9.662 1.00 0.00 C ATOM 838 CG2 VAL A 57 20.276 24.349 -7.251 1.00 0.00 C ATOM 0 H VAL A 57 17.345 23.618 -9.992 1.00 0.00 H new ATOM 0 HA VAL A 57 17.649 24.722 -7.261 1.00 0.00 H new ATOM 0 HB VAL A 57 19.004 22.804 -8.034 1.00 0.00 H new ATOM 0 HG11 VAL A 57 20.870 23.229 -9.621 1.00 0.00 H new ATOM 0 HG12 VAL A 57 19.278 23.398 -10.399 1.00 0.00 H new ATOM 0 HG13 VAL A 57 20.205 24.848 -9.946 1.00 0.00 H new ATOM 0 HG21 VAL A 57 21.182 23.743 -7.273 1.00 0.00 H new ATOM 0 HG22 VAL A 57 20.527 25.385 -7.478 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.826 24.294 -6.260 1.00 0.00 H new ATOM 848 N ASN A 58 17.701 26.422 -9.956 1.00 0.00 N ATOM 849 CA ASN A 58 17.845 27.733 -10.574 1.00 0.00 C ATOM 850 C ASN A 58 19.312 28.167 -10.687 1.00 0.00 C ATOM 851 O ASN A 58 20.223 27.377 -10.444 1.00 0.00 O ATOM 852 CB ASN A 58 16.969 28.737 -9.820 1.00 0.00 C ATOM 853 CG ASN A 58 16.599 29.924 -10.694 1.00 0.00 C ATOM 854 OD1 ASN A 58 17.151 31.011 -10.551 1.00 0.00 O ATOM 855 ND2 ASN A 58 15.656 29.721 -11.612 1.00 0.00 N ATOM 0 H ASN A 58 17.170 25.765 -10.528 1.00 0.00 H new ATOM 0 HA ASN A 58 17.496 27.686 -11.606 1.00 0.00 H new ATOM 0 HB2 ASN A 58 16.061 28.242 -9.475 1.00 0.00 H new ATOM 0 HB3 ASN A 58 17.497 29.088 -8.934 1.00 0.00 H new ATOM 0 HD21 ASN A 58 15.370 30.483 -12.226 1.00 0.00 H new ATOM 0 HD22 ASN A 58 15.220 28.803 -11.701 1.00 0.00 H new ATOM 862 N LEU A 59 19.548 29.428 -11.060 1.00 0.00 N ATOM 863 CA LEU A 59 20.894 29.967 -11.197 1.00 0.00 C ATOM 864 C LEU A 59 21.472 30.322 -9.826 1.00 0.00 C ATOM 865 O LEU A 59 20.733 30.507 -8.860 1.00 0.00 O ATOM 866 CB LEU A 59 20.876 31.188 -12.122 1.00 0.00 C ATOM 867 CG LEU A 59 20.348 30.860 -13.522 1.00 0.00 C ATOM 868 CD1 LEU A 59 20.356 32.134 -14.369 1.00 0.00 C ATOM 869 CD2 LEU A 59 21.213 29.808 -14.215 1.00 0.00 C ATOM 0 H LEU A 59 18.810 30.099 -11.274 1.00 0.00 H new ATOM 0 HA LEU A 59 21.537 29.208 -11.642 1.00 0.00 H new ATOM 0 HB2 LEU A 59 20.256 31.967 -11.677 1.00 0.00 H new ATOM 0 HB3 LEU A 59 21.885 31.592 -12.204 1.00 0.00 H new ATOM 0 HG LEU A 59 19.337 30.465 -13.419 1.00 0.00 H new ATOM 0 HD11 LEU A 59 19.981 31.909 -15.368 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.718 32.885 -13.903 1.00 0.00 H new ATOM 0 HD13 LEU A 59 21.374 32.517 -14.441 1.00 0.00 H new ATOM 0 HD21 LEU A 59 20.809 29.600 -15.206 1.00 0.00 H new ATOM 0 HD22 LEU A 59 22.233 30.181 -14.310 1.00 0.00 H new ATOM 0 HD23 LEU A 59 21.215 28.892 -13.624 1.00 0.00 H new ATOM 881 N ARG A 60 22.802 30.417 -9.745 1.00 0.00 N ATOM 882 CA ARG A 60 23.498 30.723 -8.503 1.00 0.00 C ATOM 883 C ARG A 60 23.508 32.219 -8.210 1.00 0.00 C ATOM 884 O ARG A 60 23.452 33.042 -9.123 1.00 0.00 O ATOM 885 CB ARG A 60 24.917 30.151 -8.528 1.00 0.00 C ATOM 886 CG ARG A 60 24.916 28.618 -8.583 1.00 0.00 C ATOM 887 CD ARG A 60 24.174 27.990 -7.397 1.00 0.00 C ATOM 888 NE ARG A 60 24.705 28.482 -6.116 1.00 0.00 N ATOM 889 CZ ARG A 60 23.986 29.128 -5.191 1.00 0.00 C ATOM 890 NH1 ARG A 60 22.681 29.328 -5.345 1.00 0.00 N ATOM 891 NH2 ARG A 60 24.572 29.584 -4.088 1.00 0.00 N ATOM 0 H ARG A 60 23.423 30.283 -10.543 1.00 0.00 H new ATOM 0 HA ARG A 60 22.951 30.246 -7.690 1.00 0.00 H new ATOM 0 HB2 ARG A 60 25.452 30.545 -9.392 1.00 0.00 H new ATOM 0 HB3 ARG A 60 25.457 30.482 -7.641 1.00 0.00 H new ATOM 0 HG2 ARG A 60 24.451 28.291 -9.513 1.00 0.00 H new ATOM 0 HG3 ARG A 60 25.944 28.257 -8.597 1.00 0.00 H new ATOM 0 HD2 ARG A 60 23.111 28.221 -7.466 1.00 0.00 H new ATOM 0 HD3 ARG A 60 24.267 26.905 -7.440 1.00 0.00 H new ATOM 0 HE ARG A 60 25.692 28.319 -5.919 1.00 0.00 H new ATOM 0 HH11 ARG A 60 22.208 28.986 -6.182 1.00 0.00 H new ATOM 0 HH12 ARG A 60 22.153 29.823 -4.627 1.00 0.00 H new ATOM 0 HH21 ARG A 60 25.572 29.442 -3.946 1.00 0.00 H new ATOM 0 HH22 ARG A 60 24.022 30.076 -3.384 1.00 0.00 H new ATOM 905 N GLY A 61 23.580 32.559 -6.921 1.00 0.00 N ATOM 906 CA GLY A 61 23.575 33.936 -6.455 1.00 0.00 C ATOM 907 C GLY A 61 23.999 34.009 -4.990 1.00 0.00 C ATOM 908 O GLY A 61 24.619 33.080 -4.473 1.00 0.00 O ATOM 0 H GLY A 61 23.644 31.874 -6.168 1.00 0.00 H new ATOM 0 HA2 GLY A 61 24.251 34.535 -7.065 1.00 0.00 H new ATOM 0 HA3 GLY A 61 22.578 34.362 -6.572 1.00 0.00 H new ATOM 912 N GLY A 62 23.664 35.116 -4.323 1.00 0.00 N ATOM 913 CA GLY A 62 24.006 35.336 -2.921 1.00 0.00 C ATOM 914 C GLY A 62 23.160 34.491 -1.963 1.00 0.00 C ATOM 915 O GLY A 62 23.296 34.626 -0.747 1.00 0.00 O ATOM 0 H GLY A 62 23.146 35.887 -4.745 1.00 0.00 H new ATOM 0 HA2 GLY A 62 25.060 35.104 -2.768 1.00 0.00 H new ATOM 0 HA3 GLY A 62 23.874 36.391 -2.681 1.00 0.00 H new ATOM 919 N GLU A 63 22.290 33.630 -2.498 1.00 0.00 N ATOM 920 CA GLU A 63 21.410 32.781 -1.707 1.00 0.00 C ATOM 921 C GLU A 63 21.562 31.314 -2.106 1.00 0.00 C ATOM 922 O GLU A 63 22.187 31.000 -3.121 1.00 0.00 O ATOM 923 CB GLU A 63 19.961 33.259 -1.859 1.00 0.00 C ATOM 924 CG GLU A 63 19.481 33.152 -3.309 1.00 0.00 C ATOM 925 CD GLU A 63 18.062 33.691 -3.456 1.00 0.00 C ATOM 926 OE1 GLU A 63 17.118 32.894 -3.257 1.00 0.00 O ATOM 927 OE2 GLU A 63 17.930 34.897 -3.764 1.00 0.00 O ATOM 0 H GLU A 63 22.180 33.505 -3.504 1.00 0.00 H new ATOM 0 HA GLU A 63 21.691 32.857 -0.656 1.00 0.00 H new ATOM 0 HB2 GLU A 63 19.312 32.665 -1.216 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.881 34.293 -1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 63 20.155 33.708 -3.961 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.514 32.111 -3.631 1.00 0.00 H new ATOM 934 N LYS A 64 20.988 30.411 -1.308 1.00 0.00 N ATOM 935 CA LYS A 64 21.044 28.976 -1.553 1.00 0.00 C ATOM 936 C LYS A 64 19.659 28.436 -1.895 1.00 0.00 C ATOM 937 O LYS A 64 18.645 29.052 -1.568 1.00 0.00 O ATOM 938 CB LYS A 64 21.639 28.261 -0.339 1.00 0.00 C ATOM 939 CG LYS A 64 23.086 28.702 -0.104 1.00 0.00 C ATOM 940 CD LYS A 64 23.678 27.940 1.082 1.00 0.00 C ATOM 941 CE LYS A 64 25.148 28.313 1.295 1.00 0.00 C ATOM 942 NZ LYS A 64 25.290 29.732 1.669 1.00 0.00 N ATOM 0 H LYS A 64 20.468 30.662 -0.467 1.00 0.00 H new ATOM 0 HA LYS A 64 21.691 28.786 -2.409 1.00 0.00 H new ATOM 0 HB2 LYS A 64 21.040 28.477 0.546 1.00 0.00 H new ATOM 0 HB3 LYS A 64 21.603 27.182 -0.493 1.00 0.00 H new ATOM 0 HG2 LYS A 64 23.681 28.518 -0.999 1.00 0.00 H new ATOM 0 HG3 LYS A 64 23.122 29.774 0.088 1.00 0.00 H new ATOM 0 HD2 LYS A 64 23.108 28.164 1.984 1.00 0.00 H new ATOM 0 HD3 LYS A 64 23.593 26.867 0.909 1.00 0.00 H new ATOM 0 HE2 LYS A 64 25.576 27.684 2.076 1.00 0.00 H new ATOM 0 HE3 LYS A 64 25.711 28.117 0.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 26.264 29.912 1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 25.078 30.331 0.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 24.628 29.956 2.439 1.00 0.00 H new ATOM 956 N SER A 65 19.623 27.279 -2.556 1.00 0.00 N ATOM 957 CA SER A 65 18.382 26.653 -3.000 1.00 0.00 C ATOM 958 C SER A 65 18.459 25.126 -2.946 1.00 0.00 C ATOM 959 O SER A 65 17.548 24.448 -3.419 1.00 0.00 O ATOM 960 CB SER A 65 18.081 27.120 -4.421 1.00 0.00 C ATOM 961 OG SER A 65 19.157 26.780 -5.266 1.00 0.00 O ATOM 0 H SER A 65 20.460 26.748 -2.799 1.00 0.00 H new ATOM 0 HA SER A 65 17.580 26.953 -2.325 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.162 26.657 -4.780 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.921 28.198 -4.435 1.00 0.00 H new ATOM 0 HG SER A 65 18.874 26.852 -6.201 1.00 0.00 H new ATOM 967 N THR A 66 19.537 24.580 -2.374 1.00 0.00 N ATOM 968 CA THR A 66 19.746 23.136 -2.288 1.00 0.00 C ATOM 969 C THR A 66 19.428 22.529 -0.916 1.00 0.00 C ATOM 970 O THR A 66 19.093 21.347 -0.870 1.00 0.00 O ATOM 971 CB THR A 66 21.185 22.804 -2.687 1.00 0.00 C ATOM 972 OG1 THR A 66 22.091 23.502 -1.863 1.00 0.00 O ATOM 973 CG2 THR A 66 21.441 23.185 -4.144 1.00 0.00 C ATOM 0 H THR A 66 20.289 25.130 -1.958 1.00 0.00 H new ATOM 0 HA THR A 66 19.035 22.684 -2.980 1.00 0.00 H new ATOM 0 HB THR A 66 21.331 21.731 -2.566 1.00 0.00 H new ATOM 0 HG1 THR A 66 23.009 23.281 -2.126 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.470 22.941 -4.408 1.00 0.00 H new ATOM 0 HG22 THR A 66 20.759 22.632 -4.790 1.00 0.00 H new ATOM 0 HG23 THR A 66 21.277 24.255 -4.275 1.00 0.00 H new ATOM 981 N PRO A 67 19.507 23.263 0.210 1.00 0.00 N ATOM 982 CA PRO A 67 19.190 22.716 1.525 1.00 0.00 C ATOM 983 C PRO A 67 17.762 22.184 1.641 1.00 0.00 C ATOM 984 O PRO A 67 17.468 21.392 2.537 1.00 0.00 O ATOM 985 CB PRO A 67 19.401 23.867 2.512 1.00 0.00 C ATOM 986 CG PRO A 67 20.386 24.780 1.792 1.00 0.00 C ATOM 987 CD PRO A 67 19.944 24.641 0.340 1.00 0.00 C ATOM 0 HA PRO A 67 19.830 21.856 1.724 1.00 0.00 H new ATOM 0 HB2 PRO A 67 18.466 24.381 2.734 1.00 0.00 H new ATOM 0 HB3 PRO A 67 19.803 23.513 3.461 1.00 0.00 H new ATOM 0 HG2 PRO A 67 20.318 25.810 2.142 1.00 0.00 H new ATOM 0 HG3 PRO A 67 21.418 24.461 1.937 1.00 0.00 H new ATOM 0 HD2 PRO A 67 19.137 25.335 0.105 1.00 0.00 H new ATOM 0 HD3 PRO A 67 20.763 24.861 -0.345 1.00 0.00 H new ATOM 995 N VAL A 68 16.863 22.610 0.747 1.00 0.00 N ATOM 996 CA VAL A 68 15.471 22.180 0.783 1.00 0.00 C ATOM 997 C VAL A 68 15.327 20.741 0.289 1.00 0.00 C ATOM 998 O VAL A 68 14.393 20.045 0.682 1.00 0.00 O ATOM 999 CB VAL A 68 14.624 23.159 -0.037 1.00 0.00 C ATOM 1000 CG1 VAL A 68 14.978 23.092 -1.522 1.00 0.00 C ATOM 1001 CG2 VAL A 68 13.135 22.866 0.150 1.00 0.00 C ATOM 0 H VAL A 68 17.082 23.255 -0.012 1.00 0.00 H new ATOM 0 HA VAL A 68 15.112 22.189 1.812 1.00 0.00 H new ATOM 0 HB VAL A 68 14.842 24.164 0.324 1.00 0.00 H new ATOM 0 HG11 VAL A 68 14.360 23.798 -2.076 1.00 0.00 H new ATOM 0 HG12 VAL A 68 16.029 23.346 -1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 68 14.798 22.083 -1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 68 12.549 23.571 -0.440 1.00 0.00 H new ATOM 0 HG22 VAL A 68 12.920 21.850 -0.180 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.874 22.968 1.203 1.00 0.00 H new ATOM 1011 N ALA A 69 16.245 20.285 -0.567 1.00 0.00 N ATOM 1012 CA ALA A 69 16.193 18.921 -1.067 1.00 0.00 C ATOM 1013 C ALA A 69 16.624 17.956 0.034 1.00 0.00 C ATOM 1014 O ALA A 69 16.169 16.817 0.074 1.00 0.00 O ATOM 1015 CB ALA A 69 17.106 18.803 -2.286 1.00 0.00 C ATOM 0 H ALA A 69 17.024 20.839 -0.922 1.00 0.00 H new ATOM 0 HA ALA A 69 15.176 18.667 -1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 69 17.073 17.783 -2.668 1.00 0.00 H new ATOM 0 HB2 ALA A 69 16.769 19.491 -3.061 1.00 0.00 H new ATOM 0 HB3 ALA A 69 18.128 19.051 -2.000 1.00 0.00 H new ATOM 1021 N GLU A 70 17.500 18.412 0.930 1.00 0.00 N ATOM 1022 CA GLU A 70 17.973 17.595 2.034 1.00 0.00 C ATOM 1023 C GLU A 70 16.936 17.560 3.155 1.00 0.00 C ATOM 1024 O GLU A 70 16.990 16.688 4.017 1.00 0.00 O ATOM 1025 CB GLU A 70 19.327 18.120 2.507 1.00 0.00 C ATOM 1026 CG GLU A 70 20.356 17.950 1.388 1.00 0.00 C ATOM 1027 CD GLU A 70 21.692 18.568 1.785 1.00 0.00 C ATOM 1028 OE1 GLU A 70 22.571 17.815 2.264 1.00 0.00 O ATOM 1029 OE2 GLU A 70 21.833 19.799 1.606 1.00 0.00 O ATOM 0 H GLU A 70 17.896 19.352 0.907 1.00 0.00 H new ATOM 0 HA GLU A 70 18.111 16.565 1.703 1.00 0.00 H new ATOM 0 HB2 GLU A 70 19.245 19.171 2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 70 19.648 17.579 3.397 1.00 0.00 H new ATOM 0 HG2 GLU A 70 20.491 16.891 1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 70 19.989 18.420 0.476 1.00 0.00 H new ATOM 1036 N ALA A 71 15.986 18.501 3.148 1.00 0.00 N ATOM 1037 CA ALA A 71 14.865 18.451 4.072 1.00 0.00 C ATOM 1038 C ALA A 71 13.898 17.357 3.619 1.00 0.00 C ATOM 1039 O ALA A 71 13.256 16.716 4.446 1.00 0.00 O ATOM 1040 CB ALA A 71 14.180 19.818 4.109 1.00 0.00 C ATOM 0 H ALA A 71 15.977 19.300 2.514 1.00 0.00 H new ATOM 0 HA ALA A 71 15.208 18.215 5.079 1.00 0.00 H new ATOM 0 HB1 ALA A 71 13.338 19.785 4.801 1.00 0.00 H new ATOM 0 HB2 ALA A 71 14.893 20.573 4.440 1.00 0.00 H new ATOM 0 HB3 ALA A 71 13.820 20.072 3.112 1.00 0.00 H new ATOM 1046 N LEU A 72 13.794 17.135 2.302 1.00 0.00 N ATOM 1047 CA LEU A 72 12.997 16.033 1.781 1.00 0.00 C ATOM 1048 C LEU A 72 13.684 14.709 2.108 1.00 0.00 C ATOM 1049 O LEU A 72 13.014 13.689 2.251 1.00 0.00 O ATOM 1050 CB LEU A 72 12.812 16.190 0.268 1.00 0.00 C ATOM 1051 CG LEU A 72 12.069 17.478 -0.102 1.00 0.00 C ATOM 1052 CD1 LEU A 72 12.025 17.620 -1.621 1.00 0.00 C ATOM 1053 CD2 LEU A 72 10.634 17.470 0.421 1.00 0.00 C ATOM 0 H LEU A 72 14.251 17.703 1.588 1.00 0.00 H new ATOM 0 HA LEU A 72 12.012 16.042 2.248 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.788 16.186 -0.216 1.00 0.00 H new ATOM 0 HB3 LEU A 72 12.261 15.333 -0.118 1.00 0.00 H new ATOM 0 HG LEU A 72 12.604 18.311 0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 72 11.497 18.536 -1.886 1.00 0.00 H new ATOM 0 HD12 LEU A 72 13.042 17.662 -2.012 1.00 0.00 H new ATOM 0 HD13 LEU A 72 11.505 16.764 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 72 10.139 18.399 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 72 10.095 16.626 -0.010 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.643 17.379 1.507 1.00 0.00 H new ATOM 1065 N ALA A 73 15.016 14.716 2.233 1.00 0.00 N ATOM 1066 CA ALA A 73 15.763 13.534 2.634 1.00 0.00 C ATOM 1067 C ALA A 73 15.575 13.274 4.129 1.00 0.00 C ATOM 1068 O ALA A 73 15.757 12.149 4.590 1.00 0.00 O ATOM 1069 CB ALA A 73 17.240 13.720 2.291 1.00 0.00 C ATOM 0 H ALA A 73 15.596 15.537 2.059 1.00 0.00 H new ATOM 0 HA ALA A 73 15.388 12.666 2.092 1.00 0.00 H new ATOM 0 HB1 ALA A 73 17.798 12.833 2.592 1.00 0.00 H new ATOM 0 HB2 ALA A 73 17.348 13.869 1.217 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.629 14.590 2.819 1.00 0.00 H new ATOM 1075 N ALA A 74 15.211 14.310 4.896 1.00 0.00 N ATOM 1076 CA ALA A 74 14.899 14.164 6.309 1.00 0.00 C ATOM 1077 C ALA A 74 13.473 13.638 6.482 1.00 0.00 C ATOM 1078 O ALA A 74 13.098 13.207 7.572 1.00 0.00 O ATOM 1079 CB ALA A 74 15.097 15.505 7.012 1.00 0.00 C ATOM 0 H ALA A 74 15.127 15.266 4.549 1.00 0.00 H new ATOM 0 HA ALA A 74 15.572 13.438 6.765 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.864 15.398 8.071 1.00 0.00 H new ATOM 0 HB2 ALA A 74 16.133 15.826 6.899 1.00 0.00 H new ATOM 0 HB3 ALA A 74 14.436 16.250 6.568 1.00 0.00 H new ATOM 1085 N ARG A 75 12.680 13.672 5.403 1.00 0.00 N ATOM 1086 CA ARG A 75 11.356 13.060 5.349 1.00 0.00 C ATOM 1087 C ARG A 75 11.417 11.713 4.628 1.00 0.00 C ATOM 1088 O ARG A 75 10.381 11.099 4.385 1.00 0.00 O ATOM 1089 CB ARG A 75 10.369 14.011 4.662 1.00 0.00 C ATOM 1090 CG ARG A 75 10.225 15.348 5.400 1.00 0.00 C ATOM 1091 CD ARG A 75 9.657 15.158 6.807 1.00 0.00 C ATOM 1092 NE ARG A 75 9.523 16.450 7.491 1.00 0.00 N ATOM 1093 CZ ARG A 75 10.453 16.984 8.287 1.00 0.00 C ATOM 1094 NH1 ARG A 75 11.597 16.347 8.534 1.00 0.00 N ATOM 1095 NH2 ARG A 75 10.236 18.171 8.844 1.00 0.00 N ATOM 0 H ARG A 75 12.949 14.133 4.534 1.00 0.00 H new ATOM 0 HA ARG A 75 11.007 12.877 6.365 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.702 14.198 3.641 1.00 0.00 H new ATOM 0 HB3 ARG A 75 9.393 13.530 4.596 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.198 15.836 5.463 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.573 16.010 4.830 1.00 0.00 H new ATOM 0 HD2 ARG A 75 8.685 14.669 6.749 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.310 14.502 7.383 1.00 0.00 H new ATOM 0 HE ARG A 75 8.661 16.976 7.349 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.774 15.435 8.112 1.00 0.00 H new ATOM 0 HH12 ARG A 75 12.295 16.771 9.145 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.364 18.668 8.662 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.942 18.585 9.453 1.00 0.00 H new ATOM 1109 N ASP A 76 12.628 11.258 4.291 1.00 0.00 N ATOM 1110 CA ASP A 76 12.869 10.020 3.561 1.00 0.00 C ATOM 1111 C ASP A 76 12.148 9.976 2.209 1.00 0.00 C ATOM 1112 O ASP A 76 11.712 8.916 1.763 1.00 0.00 O ATOM 1113 CB ASP A 76 12.581 8.815 4.461 1.00 0.00 C ATOM 1114 CG ASP A 76 13.105 7.511 3.859 1.00 0.00 C ATOM 1115 OD1 ASP A 76 12.362 6.506 3.914 1.00 0.00 O ATOM 1116 OD2 ASP A 76 14.249 7.529 3.348 1.00 0.00 O ATOM 0 H ASP A 76 13.486 11.757 4.527 1.00 0.00 H new ATOM 0 HA ASP A 76 13.925 9.976 3.296 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.040 8.974 5.437 1.00 0.00 H new ATOM 0 HB3 ASP A 76 11.506 8.733 4.624 1.00 0.00 H new ATOM 1121 N ILE A 77 12.018 11.134 1.553 1.00 0.00 N ATOM 1122 CA ILE A 77 11.384 11.248 0.243 1.00 0.00 C ATOM 1123 C ILE A 77 12.450 11.532 -0.819 1.00 0.00 C ATOM 1124 O ILE A 77 13.163 12.528 -0.709 1.00 0.00 O ATOM 1125 CB ILE A 77 10.323 12.357 0.282 1.00 0.00 C ATOM 1126 CG1 ILE A 77 9.210 12.044 1.295 1.00 0.00 C ATOM 1127 CG2 ILE A 77 9.717 12.560 -1.105 1.00 0.00 C ATOM 1128 CD1 ILE A 77 8.473 10.728 1.018 1.00 0.00 C ATOM 0 H ILE A 77 12.354 12.023 1.923 1.00 0.00 H new ATOM 0 HA ILE A 77 10.888 10.312 -0.016 1.00 0.00 H new ATOM 0 HB ILE A 77 10.820 13.274 0.599 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.642 12.004 2.295 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.489 12.861 1.292 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.966 13.349 -1.062 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.501 12.843 -1.807 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.250 11.633 -1.437 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.703 10.576 1.774 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.010 10.771 0.032 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.182 9.900 1.050 1.00 0.00 H new ATOM 1140 N PRO A 78 12.574 10.679 -1.849 1.00 0.00 N ATOM 1141 CA PRO A 78 13.528 10.851 -2.936 1.00 0.00 C ATOM 1142 C PRO A 78 13.315 12.139 -3.730 1.00 0.00 C ATOM 1143 O PRO A 78 12.202 12.666 -3.795 1.00 0.00 O ATOM 1144 CB PRO A 78 13.350 9.629 -3.843 1.00 0.00 C ATOM 1145 CG PRO A 78 12.713 8.586 -2.930 1.00 0.00 C ATOM 1146 CD PRO A 78 11.831 9.445 -2.028 1.00 0.00 C ATOM 0 HA PRO A 78 14.537 10.932 -2.531 1.00 0.00 H new ATOM 0 HB2 PRO A 78 12.712 9.855 -4.698 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.304 9.283 -4.240 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.132 7.854 -3.491 1.00 0.00 H new ATOM 0 HG3 PRO A 78 13.460 8.032 -2.361 1.00 0.00 H new ATOM 0 HD2 PRO A 78 10.860 9.631 -2.486 1.00 0.00 H new ATOM 0 HD3 PRO A 78 11.644 8.954 -1.073 1.00 0.00 H new ATOM 1154 N PHE A 79 14.395 12.641 -4.339 1.00 0.00 N ATOM 1155 CA PHE A 79 14.352 13.837 -5.165 1.00 0.00 C ATOM 1156 C PHE A 79 15.439 13.798 -6.235 1.00 0.00 C ATOM 1157 O PHE A 79 16.371 12.995 -6.162 1.00 0.00 O ATOM 1158 CB PHE A 79 14.534 15.075 -4.287 1.00 0.00 C ATOM 1159 CG PHE A 79 15.904 15.184 -3.649 1.00 0.00 C ATOM 1160 CD1 PHE A 79 16.987 15.693 -4.384 1.00 0.00 C ATOM 1161 CD2 PHE A 79 16.095 14.775 -2.322 1.00 0.00 C ATOM 1162 CE1 PHE A 79 18.253 15.795 -3.792 1.00 0.00 C ATOM 1163 CE2 PHE A 79 17.359 14.890 -1.729 1.00 0.00 C ATOM 1164 CZ PHE A 79 18.435 15.403 -2.459 1.00 0.00 C ATOM 0 H PHE A 79 15.323 12.223 -4.268 1.00 0.00 H new ATOM 0 HA PHE A 79 13.383 13.880 -5.662 1.00 0.00 H new ATOM 0 HB2 PHE A 79 14.354 15.965 -4.890 1.00 0.00 H new ATOM 0 HB3 PHE A 79 13.779 15.064 -3.501 1.00 0.00 H new ATOM 0 HD1 PHE A 79 16.844 16.006 -5.408 1.00 0.00 H new ATOM 0 HD2 PHE A 79 15.268 14.371 -1.757 1.00 0.00 H new ATOM 0 HE1 PHE A 79 19.087 16.175 -4.362 1.00 0.00 H new ATOM 0 HE2 PHE A 79 17.503 14.581 -0.704 1.00 0.00 H new ATOM 0 HZ PHE A 79 19.406 15.497 -1.996 1.00 0.00 H new ATOM 1174 N VAL A 80 15.313 14.674 -7.235 1.00 0.00 N ATOM 1175 CA VAL A 80 16.312 14.860 -8.283 1.00 0.00 C ATOM 1176 C VAL A 80 16.421 16.343 -8.618 1.00 0.00 C ATOM 1177 O VAL A 80 15.503 17.110 -8.334 1.00 0.00 O ATOM 1178 CB VAL A 80 15.954 14.046 -9.533 1.00 0.00 C ATOM 1179 CG1 VAL A 80 15.896 12.553 -9.214 1.00 0.00 C ATOM 1180 CG2 VAL A 80 14.603 14.471 -10.111 1.00 0.00 C ATOM 0 H VAL A 80 14.500 15.282 -7.338 1.00 0.00 H new ATOM 0 HA VAL A 80 17.276 14.501 -7.922 1.00 0.00 H new ATOM 0 HB VAL A 80 16.736 14.238 -10.267 1.00 0.00 H new ATOM 0 HG11 VAL A 80 15.640 11.998 -10.116 1.00 0.00 H new ATOM 0 HG12 VAL A 80 16.867 12.221 -8.847 1.00 0.00 H new ATOM 0 HG13 VAL A 80 15.139 12.373 -8.451 1.00 0.00 H new ATOM 0 HG21 VAL A 80 14.381 13.874 -10.995 1.00 0.00 H new ATOM 0 HG22 VAL A 80 13.823 14.317 -9.365 1.00 0.00 H new ATOM 0 HG23 VAL A 80 14.640 15.525 -10.385 1.00 0.00 H new ATOM 1190 N PHE A 81 17.540 16.748 -9.221 1.00 0.00 N ATOM 1191 CA PHE A 81 17.776 18.146 -9.551 1.00 0.00 C ATOM 1192 C PHE A 81 17.375 18.470 -10.990 1.00 0.00 C ATOM 1193 O PHE A 81 17.274 17.584 -11.837 1.00 0.00 O ATOM 1194 CB PHE A 81 19.255 18.478 -9.355 1.00 0.00 C ATOM 1195 CG PHE A 81 19.806 18.272 -7.961 1.00 0.00 C ATOM 1196 CD1 PHE A 81 19.122 18.749 -6.831 1.00 0.00 C ATOM 1197 CD2 PHE A 81 21.036 17.613 -7.803 1.00 0.00 C ATOM 1198 CE1 PHE A 81 19.680 18.587 -5.553 1.00 0.00 C ATOM 1199 CE2 PHE A 81 21.596 17.459 -6.529 1.00 0.00 C ATOM 1200 CZ PHE A 81 20.919 17.946 -5.404 1.00 0.00 C ATOM 0 H PHE A 81 18.298 16.121 -9.490 1.00 0.00 H new ATOM 0 HA PHE A 81 17.159 18.749 -8.885 1.00 0.00 H new ATOM 0 HB2 PHE A 81 19.837 17.870 -10.047 1.00 0.00 H new ATOM 0 HB3 PHE A 81 19.413 19.519 -9.635 1.00 0.00 H new ATOM 0 HD1 PHE A 81 18.167 19.240 -6.945 1.00 0.00 H new ATOM 0 HD2 PHE A 81 21.552 17.223 -8.668 1.00 0.00 H new ATOM 0 HE1 PHE A 81 19.155 18.956 -4.684 1.00 0.00 H new ATOM 0 HE2 PHE A 81 22.549 16.965 -6.414 1.00 0.00 H new ATOM 0 HZ PHE A 81 21.351 17.828 -4.421 1.00 0.00 H new ATOM 1210 N ALA A 82 17.151 19.757 -11.254 1.00 0.00 N ATOM 1211 CA ALA A 82 16.923 20.285 -12.588 1.00 0.00 C ATOM 1212 C ALA A 82 17.595 21.652 -12.680 1.00 0.00 C ATOM 1213 O ALA A 82 17.482 22.453 -11.754 1.00 0.00 O ATOM 1214 CB ALA A 82 15.421 20.378 -12.861 1.00 0.00 C ATOM 0 H ALA A 82 17.124 20.472 -10.527 1.00 0.00 H new ATOM 0 HA ALA A 82 17.351 19.626 -13.343 1.00 0.00 H new ATOM 0 HB1 ALA A 82 15.257 20.775 -13.863 1.00 0.00 H new ATOM 0 HB2 ALA A 82 14.975 19.386 -12.786 1.00 0.00 H new ATOM 0 HB3 ALA A 82 14.958 21.040 -12.129 1.00 0.00 H new ATOM 1220 N THR A 83 18.291 21.927 -13.787 1.00 0.00 N ATOM 1221 CA THR A 83 19.040 23.166 -13.939 1.00 0.00 C ATOM 1222 C THR A 83 19.235 23.528 -15.407 1.00 0.00 C ATOM 1223 O THR A 83 19.146 22.668 -16.281 1.00 0.00 O ATOM 1224 CB THR A 83 20.402 23.021 -13.246 1.00 0.00 C ATOM 1225 OG1 THR A 83 21.122 24.234 -13.322 1.00 0.00 O ATOM 1226 CG2 THR A 83 21.250 21.909 -13.862 1.00 0.00 C ATOM 0 H THR A 83 18.348 21.302 -14.591 1.00 0.00 H new ATOM 0 HA THR A 83 18.470 23.972 -13.476 1.00 0.00 H new ATOM 0 HB THR A 83 20.199 22.763 -12.207 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.988 24.129 -12.875 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.204 21.846 -13.338 1.00 0.00 H new ATOM 0 HG22 THR A 83 20.724 20.959 -13.774 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.429 22.128 -14.915 1.00 0.00 H new ATOM 1234 N GLY A 84 19.503 24.810 -15.676 1.00 0.00 N ATOM 1235 CA GLY A 84 19.862 25.272 -17.006 1.00 0.00 C ATOM 1236 C GLY A 84 21.341 24.988 -17.268 1.00 0.00 C ATOM 1237 O GLY A 84 22.042 24.481 -16.393 1.00 0.00 O ATOM 0 H GLY A 84 19.475 25.550 -14.974 1.00 0.00 H new ATOM 0 HA2 GLY A 84 19.247 24.771 -17.754 1.00 0.00 H new ATOM 0 HA3 GLY A 84 19.665 26.340 -17.096 1.00 0.00 H new ATOM 1241 N GLY A 85 21.821 25.313 -18.469 1.00 0.00 N ATOM 1242 CA GLY A 85 23.216 25.104 -18.813 1.00 0.00 C ATOM 1243 C GLY A 85 24.106 26.056 -18.022 1.00 0.00 C ATOM 1244 O GLY A 85 24.014 27.273 -18.182 1.00 0.00 O ATOM 0 H GLY A 85 21.259 25.722 -19.216 1.00 0.00 H new ATOM 0 HA2 GLY A 85 23.499 24.072 -18.603 1.00 0.00 H new ATOM 0 HA3 GLY A 85 23.362 25.263 -19.881 1.00 0.00 H new ATOM 1248 N SER A 86 24.966 25.498 -17.168 1.00 0.00 N ATOM 1249 CA SER A 86 25.878 26.269 -16.335 1.00 0.00 C ATOM 1250 C SER A 86 27.108 25.442 -15.974 1.00 0.00 C ATOM 1251 O SER A 86 27.055 24.213 -15.982 1.00 0.00 O ATOM 1252 CB SER A 86 25.146 26.703 -15.066 1.00 0.00 C ATOM 1253 OG SER A 86 26.022 27.420 -14.217 1.00 0.00 O ATOM 0 H SER A 86 25.046 24.490 -17.037 1.00 0.00 H new ATOM 0 HA SER A 86 26.212 27.148 -16.887 1.00 0.00 H new ATOM 0 HB2 SER A 86 24.290 27.325 -15.326 1.00 0.00 H new ATOM 0 HB3 SER A 86 24.757 25.828 -14.544 1.00 0.00 H new ATOM 0 HG SER A 86 25.612 27.519 -13.332 1.00 0.00 H new ATOM 1259 N ASP A 87 28.214 26.122 -15.659 1.00 0.00 N ATOM 1260 CA ASP A 87 29.455 25.480 -15.244 1.00 0.00 C ATOM 1261 C ASP A 87 29.687 25.630 -13.738 1.00 0.00 C ATOM 1262 O ASP A 87 30.687 25.140 -13.223 1.00 0.00 O ATOM 1263 CB ASP A 87 30.620 26.058 -16.049 1.00 0.00 C ATOM 1264 CG ASP A 87 30.443 25.806 -17.542 1.00 0.00 C ATOM 1265 OD1 ASP A 87 30.114 26.775 -18.263 1.00 0.00 O ATOM 1266 OD2 ASP A 87 30.637 24.642 -17.958 1.00 0.00 O ATOM 0 H ASP A 87 28.269 27.140 -15.686 1.00 0.00 H new ATOM 0 HA ASP A 87 29.383 24.411 -15.445 1.00 0.00 H new ATOM 0 HB2 ASP A 87 30.695 27.130 -15.866 1.00 0.00 H new ATOM 0 HB3 ASP A 87 31.555 25.611 -15.711 1.00 0.00 H new ATOM 1271 N ASP A 88 28.771 26.304 -13.030 1.00 0.00 N ATOM 1272 CA ASP A 88 28.928 26.577 -11.605 1.00 0.00 C ATOM 1273 C ASP A 88 27.654 26.283 -10.808 1.00 0.00 C ATOM 1274 O ASP A 88 27.658 26.421 -9.586 1.00 0.00 O ATOM 1275 CB ASP A 88 29.352 28.034 -11.413 1.00 0.00 C ATOM 1276 CG ASP A 88 30.707 28.320 -12.056 1.00 0.00 C ATOM 1277 OD1 ASP A 88 30.716 28.907 -13.160 1.00 0.00 O ATOM 1278 OD2 ASP A 88 31.730 27.949 -11.436 1.00 0.00 O ATOM 0 H ASP A 88 27.908 26.671 -13.430 1.00 0.00 H new ATOM 0 HA ASP A 88 29.699 25.909 -11.220 1.00 0.00 H new ATOM 0 HB2 ASP A 88 28.598 28.692 -11.846 1.00 0.00 H new ATOM 0 HB3 ASP A 88 29.400 28.261 -10.348 1.00 0.00 H new ATOM 1283 N SER A 89 26.567 25.881 -11.472 1.00 0.00 N ATOM 1284 CA SER A 89 25.311 25.575 -10.798 1.00 0.00 C ATOM 1285 C SER A 89 25.247 24.108 -10.360 1.00 0.00 C ATOM 1286 O SER A 89 24.198 23.653 -9.909 1.00 0.00 O ATOM 1287 CB SER A 89 24.118 25.936 -11.683 1.00 0.00 C ATOM 1288 OG SER A 89 24.171 27.308 -12.023 1.00 0.00 O ATOM 0 H SER A 89 26.536 25.760 -12.484 1.00 0.00 H new ATOM 0 HA SER A 89 25.264 26.185 -9.896 1.00 0.00 H new ATOM 0 HB2 SER A 89 24.127 25.327 -12.587 1.00 0.00 H new ATOM 0 HB3 SER A 89 23.187 25.717 -11.161 1.00 0.00 H new ATOM 0 HG SER A 89 23.405 27.534 -12.592 1.00 0.00 H new ATOM 1294 N VAL A 90 26.355 23.375 -10.490 1.00 0.00 N ATOM 1295 CA VAL A 90 26.429 21.966 -10.128 1.00 0.00 C ATOM 1296 C VAL A 90 27.698 21.667 -9.338 1.00 0.00 C ATOM 1297 O VAL A 90 28.702 22.367 -9.457 1.00 0.00 O ATOM 1298 CB VAL A 90 26.327 21.068 -11.368 1.00 0.00 C ATOM 1299 CG1 VAL A 90 24.929 21.169 -11.978 1.00 0.00 C ATOM 1300 CG2 VAL A 90 27.363 21.446 -12.426 1.00 0.00 C ATOM 0 H VAL A 90 27.231 23.750 -10.853 1.00 0.00 H new ATOM 0 HA VAL A 90 25.576 21.744 -9.486 1.00 0.00 H new ATOM 0 HB VAL A 90 26.521 20.045 -11.046 1.00 0.00 H new ATOM 0 HG11 VAL A 90 24.868 20.528 -12.857 1.00 0.00 H new ATOM 0 HG12 VAL A 90 24.188 20.850 -11.245 1.00 0.00 H new ATOM 0 HG13 VAL A 90 24.732 22.201 -12.268 1.00 0.00 H new ATOM 0 HG21 VAL A 90 27.259 20.788 -13.289 1.00 0.00 H new ATOM 0 HG22 VAL A 90 27.206 22.479 -12.737 1.00 0.00 H new ATOM 0 HG23 VAL A 90 28.364 21.341 -12.008 1.00 0.00 H new ATOM 1310 N ASP A 91 27.635 20.616 -8.521 1.00 0.00 N ATOM 1311 CA ASP A 91 28.700 20.193 -7.624 1.00 0.00 C ATOM 1312 C ASP A 91 28.662 18.664 -7.504 1.00 0.00 C ATOM 1313 O ASP A 91 27.830 18.018 -8.141 1.00 0.00 O ATOM 1314 CB ASP A 91 28.472 20.870 -6.269 1.00 0.00 C ATOM 1315 CG ASP A 91 29.609 20.582 -5.292 1.00 0.00 C ATOM 1316 OD1 ASP A 91 30.755 20.979 -5.603 1.00 0.00 O ATOM 1317 OD2 ASP A 91 29.323 19.963 -4.245 1.00 0.00 O ATOM 0 H ASP A 91 26.811 20.018 -8.467 1.00 0.00 H new ATOM 0 HA ASP A 91 29.682 20.479 -8.000 1.00 0.00 H new ATOM 0 HB2 ASP A 91 28.380 21.947 -6.412 1.00 0.00 H new ATOM 0 HB3 ASP A 91 27.530 20.523 -5.843 1.00 0.00 H new ATOM 1322 N SER A 92 29.540 18.066 -6.699 1.00 0.00 N ATOM 1323 CA SER A 92 29.578 16.616 -6.526 1.00 0.00 C ATOM 1324 C SER A 92 28.254 16.067 -5.992 1.00 0.00 C ATOM 1325 O SER A 92 28.006 14.867 -6.078 1.00 0.00 O ATOM 1326 CB SER A 92 30.732 16.248 -5.593 1.00 0.00 C ATOM 1327 OG SER A 92 31.953 16.694 -6.156 1.00 0.00 O ATOM 0 H SER A 92 30.239 18.569 -6.153 1.00 0.00 H new ATOM 0 HA SER A 92 29.737 16.159 -7.503 1.00 0.00 H new ATOM 0 HB2 SER A 92 30.582 16.704 -4.614 1.00 0.00 H new ATOM 0 HB3 SER A 92 30.761 15.169 -5.441 1.00 0.00 H new ATOM 0 HG SER A 92 32.694 16.460 -5.558 1.00 0.00 H new ATOM 1333 N ARG A 93 27.397 16.935 -5.442 1.00 0.00 N ATOM 1334 CA ARG A 93 26.060 16.549 -5.001 1.00 0.00 C ATOM 1335 C ARG A 93 25.215 16.145 -6.208 1.00 0.00 C ATOM 1336 O ARG A 93 24.333 15.299 -6.092 1.00 0.00 O ATOM 1337 CB ARG A 93 25.416 17.742 -4.291 1.00 0.00 C ATOM 1338 CG ARG A 93 26.121 18.047 -2.968 1.00 0.00 C ATOM 1339 CD ARG A 93 25.680 19.411 -2.433 1.00 0.00 C ATOM 1340 NE ARG A 93 24.220 19.503 -2.308 1.00 0.00 N ATOM 1341 CZ ARG A 93 23.552 19.573 -1.155 1.00 0.00 C ATOM 1342 NH1 ARG A 93 24.183 19.538 0.017 1.00 0.00 N ATOM 1343 NH2 ARG A 93 22.230 19.685 -1.163 1.00 0.00 N ATOM 0 H ARG A 93 27.614 17.920 -5.292 1.00 0.00 H new ATOM 0 HA ARG A 93 26.123 15.702 -4.318 1.00 0.00 H new ATOM 0 HB2 ARG A 93 25.457 18.618 -4.938 1.00 0.00 H new ATOM 0 HB3 ARG A 93 24.363 17.532 -4.105 1.00 0.00 H new ATOM 0 HG2 ARG A 93 25.891 17.271 -2.238 1.00 0.00 H new ATOM 0 HG3 ARG A 93 27.201 18.038 -3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 93 26.140 19.585 -1.460 1.00 0.00 H new ATOM 0 HD3 ARG A 93 26.038 20.196 -3.100 1.00 0.00 H new ATOM 0 HE ARG A 93 23.674 19.514 -3.169 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.199 19.456 0.047 1.00 0.00 H new ATOM 0 HH12 ARG A 93 23.650 19.593 0.885 1.00 0.00 H new ATOM 0 HH21 ARG A 93 21.726 19.717 -2.049 1.00 0.00 H new ATOM 0 HH22 ARG A 93 21.717 19.739 -0.283 1.00 0.00 H new ATOM 1357 N PHE A 94 25.488 16.751 -7.365 1.00 0.00 N ATOM 1358 CA PHE A 94 24.789 16.495 -8.616 1.00 0.00 C ATOM 1359 C PHE A 94 25.493 15.377 -9.384 1.00 0.00 C ATOM 1360 O PHE A 94 24.941 14.833 -10.337 1.00 0.00 O ATOM 1361 CB PHE A 94 24.773 17.779 -9.449 1.00 0.00 C ATOM 1362 CG PHE A 94 24.161 18.977 -8.751 1.00 0.00 C ATOM 1363 CD1 PHE A 94 22.937 19.497 -9.194 1.00 0.00 C ATOM 1364 CD2 PHE A 94 24.821 19.574 -7.666 1.00 0.00 C ATOM 1365 CE1 PHE A 94 22.367 20.599 -8.544 1.00 0.00 C ATOM 1366 CE2 PHE A 94 24.250 20.676 -7.015 1.00 0.00 C ATOM 1367 CZ PHE A 94 23.020 21.186 -7.452 1.00 0.00 C ATOM 0 H PHE A 94 26.223 17.452 -7.455 1.00 0.00 H new ATOM 0 HA PHE A 94 23.765 16.183 -8.410 1.00 0.00 H new ATOM 0 HB2 PHE A 94 25.796 18.025 -9.734 1.00 0.00 H new ATOM 0 HB3 PHE A 94 24.222 17.592 -10.371 1.00 0.00 H new ATOM 0 HD1 PHE A 94 22.433 19.048 -10.037 1.00 0.00 H new ATOM 0 HD2 PHE A 94 25.771 19.183 -7.332 1.00 0.00 H new ATOM 0 HE1 PHE A 94 21.423 20.997 -8.885 1.00 0.00 H new ATOM 0 HE2 PHE A 94 24.757 21.132 -6.178 1.00 0.00 H new ATOM 0 HZ PHE A 94 22.576 22.031 -6.947 1.00 0.00 H new ATOM 1377 N ARG A 95 26.715 15.040 -8.961 1.00 0.00 N ATOM 1378 CA ARG A 95 27.464 13.919 -9.510 1.00 0.00 C ATOM 1379 C ARG A 95 27.132 12.634 -8.753 1.00 0.00 C ATOM 1380 O ARG A 95 27.512 11.549 -9.183 1.00 0.00 O ATOM 1381 CB ARG A 95 28.961 14.233 -9.462 1.00 0.00 C ATOM 1382 CG ARG A 95 29.253 15.564 -10.163 1.00 0.00 C ATOM 1383 CD ARG A 95 30.753 15.857 -10.135 1.00 0.00 C ATOM 1384 NE ARG A 95 31.040 17.151 -10.766 1.00 0.00 N ATOM 1385 CZ ARG A 95 31.595 18.204 -10.156 1.00 0.00 C ATOM 1386 NH1 ARG A 95 31.953 18.153 -8.875 1.00 0.00 N ATOM 1387 NH2 ARG A 95 31.795 19.329 -10.837 1.00 0.00 N ATOM 0 H ARG A 95 27.210 15.543 -8.224 1.00 0.00 H new ATOM 0 HA ARG A 95 27.180 13.764 -10.551 1.00 0.00 H new ATOM 0 HB2 ARG A 95 29.296 14.280 -8.426 1.00 0.00 H new ATOM 0 HB3 ARG A 95 29.522 13.431 -9.942 1.00 0.00 H new ATOM 0 HG2 ARG A 95 28.902 15.525 -11.194 1.00 0.00 H new ATOM 0 HG3 ARG A 95 28.708 16.370 -9.671 1.00 0.00 H new ATOM 0 HD2 ARG A 95 31.109 15.862 -9.105 1.00 0.00 H new ATOM 0 HD3 ARG A 95 31.293 15.066 -10.655 1.00 0.00 H new ATOM 0 HE ARG A 95 30.796 17.256 -11.751 1.00 0.00 H new ATOM 0 HH11 ARG A 95 31.806 17.298 -8.338 1.00 0.00 H new ATOM 0 HH12 ARG A 95 32.375 18.968 -8.430 1.00 0.00 H new ATOM 0 HH21 ARG A 95 31.525 19.385 -11.819 1.00 0.00 H new ATOM 0 HH22 ARG A 95 32.218 20.135 -10.377 1.00 0.00 H new ATOM 1401 N ASP A 96 26.424 12.760 -7.622 1.00 0.00 N ATOM 1402 CA ASP A 96 26.011 11.626 -6.805 1.00 0.00 C ATOM 1403 C ASP A 96 24.489 11.453 -6.816 1.00 0.00 C ATOM 1404 O ASP A 96 23.989 10.403 -6.417 1.00 0.00 O ATOM 1405 CB ASP A 96 26.543 11.829 -5.384 1.00 0.00 C ATOM 1406 CG ASP A 96 26.241 10.632 -4.488 1.00 0.00 C ATOM 1407 OD1 ASP A 96 26.760 9.535 -4.792 1.00 0.00 O ATOM 1408 OD2 ASP A 96 25.494 10.819 -3.501 1.00 0.00 O ATOM 0 H ASP A 96 26.123 13.661 -7.251 1.00 0.00 H new ATOM 0 HA ASP A 96 26.428 10.708 -7.220 1.00 0.00 H new ATOM 0 HB2 ASP A 96 27.620 11.994 -5.419 1.00 0.00 H new ATOM 0 HB3 ASP A 96 26.097 12.726 -4.954 1.00 0.00 H new ATOM 1413 N ARG A 97 23.748 12.473 -7.268 1.00 0.00 N ATOM 1414 CA ARG A 97 22.294 12.417 -7.385 1.00 0.00 C ATOM 1415 C ARG A 97 21.883 12.784 -8.810 1.00 0.00 C ATOM 1416 O ARG A 97 22.579 13.561 -9.458 1.00 0.00 O ATOM 1417 CB ARG A 97 21.642 13.371 -6.375 1.00 0.00 C ATOM 1418 CG ARG A 97 22.012 13.041 -4.926 1.00 0.00 C ATOM 1419 CD ARG A 97 21.476 11.666 -4.521 1.00 0.00 C ATOM 1420 NE ARG A 97 21.828 11.355 -3.131 1.00 0.00 N ATOM 1421 CZ ARG A 97 21.479 10.227 -2.509 1.00 0.00 C ATOM 1422 NH1 ARG A 97 20.768 9.295 -3.140 1.00 0.00 N ATOM 1423 NH2 ARG A 97 21.837 10.021 -1.245 1.00 0.00 N ATOM 0 H ARG A 97 24.148 13.364 -7.563 1.00 0.00 H new ATOM 0 HA ARG A 97 21.954 11.405 -7.166 1.00 0.00 H new ATOM 0 HB2 ARG A 97 21.945 14.394 -6.599 1.00 0.00 H new ATOM 0 HB3 ARG A 97 20.559 13.328 -6.488 1.00 0.00 H new ATOM 0 HG2 ARG A 97 23.096 13.061 -4.810 1.00 0.00 H new ATOM 0 HG3 ARG A 97 21.606 13.803 -4.261 1.00 0.00 H new ATOM 0 HD2 ARG A 97 20.393 11.644 -4.639 1.00 0.00 H new ATOM 0 HD3 ARG A 97 21.884 10.903 -5.183 1.00 0.00 H new ATOM 0 HE ARG A 97 22.372 12.042 -2.609 1.00 0.00 H new ATOM 0 HH11 ARG A 97 20.484 9.439 -4.109 1.00 0.00 H new ATOM 0 HH12 ARG A 97 20.507 8.437 -2.654 1.00 0.00 H new ATOM 0 HH21 ARG A 97 22.380 10.726 -0.747 1.00 0.00 H new ATOM 0 HH22 ARG A 97 21.568 9.158 -0.773 1.00 0.00 H new ATOM 1437 N PRO A 98 20.768 12.242 -9.317 1.00 0.00 N ATOM 1438 CA PRO A 98 20.311 12.490 -10.677 1.00 0.00 C ATOM 1439 C PRO A 98 20.041 13.970 -10.944 1.00 0.00 C ATOM 1440 O PRO A 98 19.616 14.706 -10.053 1.00 0.00 O ATOM 1441 CB PRO A 98 19.039 11.659 -10.847 1.00 0.00 C ATOM 1442 CG PRO A 98 19.159 10.582 -9.771 1.00 0.00 C ATOM 1443 CD PRO A 98 19.882 11.312 -8.644 1.00 0.00 C ATOM 0 HA PRO A 98 21.081 12.208 -11.395 1.00 0.00 H new ATOM 0 HB2 PRO A 98 18.144 12.265 -10.708 1.00 0.00 H new ATOM 0 HB3 PRO A 98 18.977 11.223 -11.844 1.00 0.00 H new ATOM 0 HG2 PRO A 98 18.182 10.215 -9.455 1.00 0.00 H new ATOM 0 HG3 PRO A 98 19.725 9.719 -10.123 1.00 0.00 H new ATOM 0 HD2 PRO A 98 19.179 11.834 -7.995 1.00 0.00 H new ATOM 0 HD3 PRO A 98 20.440 10.617 -8.016 1.00 0.00 H new ATOM 1451 N VAL A 99 20.288 14.396 -12.185 1.00 0.00 N ATOM 1452 CA VAL A 99 20.070 15.768 -12.626 1.00 0.00 C ATOM 1453 C VAL A 99 19.738 15.767 -14.115 1.00 0.00 C ATOM 1454 O VAL A 99 20.197 14.893 -14.848 1.00 0.00 O ATOM 1455 CB VAL A 99 21.309 16.620 -12.313 1.00 0.00 C ATOM 1456 CG1 VAL A 99 22.556 16.089 -13.024 1.00 0.00 C ATOM 1457 CG2 VAL A 99 21.094 18.077 -12.724 1.00 0.00 C ATOM 0 H VAL A 99 20.650 13.786 -12.918 1.00 0.00 H new ATOM 0 HA VAL A 99 19.229 16.209 -12.091 1.00 0.00 H new ATOM 0 HB VAL A 99 21.461 16.561 -11.235 1.00 0.00 H new ATOM 0 HG11 VAL A 99 23.411 16.718 -12.777 1.00 0.00 H new ATOM 0 HG12 VAL A 99 22.752 15.067 -12.700 1.00 0.00 H new ATOM 0 HG13 VAL A 99 22.394 16.103 -14.102 1.00 0.00 H new ATOM 0 HG21 VAL A 99 21.987 18.656 -12.491 1.00 0.00 H new ATOM 0 HG22 VAL A 99 20.898 18.128 -13.795 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.243 18.487 -12.180 1.00 0.00 H new ATOM 1467 N LEU A 100 18.945 16.741 -14.569 1.00 0.00 N ATOM 1468 CA LEU A 100 18.580 16.852 -15.977 1.00 0.00 C ATOM 1469 C LEU A 100 18.483 18.327 -16.380 1.00 0.00 C ATOM 1470 O LEU A 100 18.162 19.178 -15.553 1.00 0.00 O ATOM 1471 CB LEU A 100 17.257 16.111 -16.193 1.00 0.00 C ATOM 1472 CG LEU A 100 16.900 15.913 -17.669 1.00 0.00 C ATOM 1473 CD1 LEU A 100 17.948 15.062 -18.382 1.00 0.00 C ATOM 1474 CD2 LEU A 100 15.562 15.186 -17.770 1.00 0.00 C ATOM 0 H LEU A 100 18.543 17.466 -13.975 1.00 0.00 H new ATOM 0 HA LEU A 100 19.343 16.398 -16.609 1.00 0.00 H new ATOM 0 HB2 LEU A 100 17.312 15.137 -15.707 1.00 0.00 H new ATOM 0 HB3 LEU A 100 16.456 16.666 -15.705 1.00 0.00 H new ATOM 0 HG LEU A 100 16.853 16.896 -18.137 1.00 0.00 H new ATOM 0 HD11 LEU A 100 17.667 14.939 -19.428 1.00 0.00 H new ATOM 0 HD12 LEU A 100 18.918 15.555 -18.323 1.00 0.00 H new ATOM 0 HD13 LEU A 100 18.008 14.084 -17.905 1.00 0.00 H new ATOM 0 HD21 LEU A 100 15.304 15.043 -18.819 1.00 0.00 H new ATOM 0 HD22 LEU A 100 15.637 14.216 -17.279 1.00 0.00 H new ATOM 0 HD23 LEU A 100 14.788 15.779 -17.284 1.00 0.00 H new ATOM 1486 N GLN A 101 18.763 18.626 -17.653 1.00 0.00 N ATOM 1487 CA GLN A 101 18.715 19.991 -18.165 1.00 0.00 C ATOM 1488 C GLN A 101 17.269 20.448 -18.378 1.00 0.00 C ATOM 1489 O GLN A 101 16.357 19.624 -18.380 1.00 0.00 O ATOM 1490 CB GLN A 101 19.549 20.114 -19.447 1.00 0.00 C ATOM 1491 CG GLN A 101 18.926 19.386 -20.644 1.00 0.00 C ATOM 1492 CD GLN A 101 19.031 17.865 -20.563 1.00 0.00 C ATOM 1493 OE1 GLN A 101 19.888 17.319 -19.874 1.00 0.00 O ATOM 1494 NE2 GLN A 101 18.153 17.166 -21.272 1.00 0.00 N ATOM 0 H GLN A 101 19.027 17.930 -18.350 1.00 0.00 H new ATOM 0 HA GLN A 101 19.154 20.656 -17.421 1.00 0.00 H new ATOM 0 HB2 GLN A 101 19.670 21.169 -19.694 1.00 0.00 H new ATOM 0 HB3 GLN A 101 20.546 19.713 -19.264 1.00 0.00 H new ATOM 0 HG2 GLN A 101 17.875 19.665 -20.720 1.00 0.00 H new ATOM 0 HG3 GLN A 101 19.413 19.726 -21.558 1.00 0.00 H new ATOM 0 HE21 GLN A 101 17.453 17.648 -21.835 1.00 0.00 H new ATOM 0 HE22 GLN A 101 18.179 16.146 -21.254 1.00 0.00 H new ATOM 1503 N LYS A 102 17.054 21.758 -18.563 1.00 0.00 N ATOM 1504 CA LYS A 102 15.718 22.318 -18.736 1.00 0.00 C ATOM 1505 C LYS A 102 14.967 21.713 -19.925 1.00 0.00 C ATOM 1506 O LYS A 102 13.827 21.292 -19.741 1.00 0.00 O ATOM 1507 CB LYS A 102 15.802 23.844 -18.869 1.00 0.00 C ATOM 1508 CG LYS A 102 16.243 24.513 -17.566 1.00 0.00 C ATOM 1509 CD LYS A 102 15.166 24.399 -16.488 1.00 0.00 C ATOM 1510 CE LYS A 102 15.636 25.112 -15.219 1.00 0.00 C ATOM 1511 NZ LYS A 102 14.597 25.077 -14.176 1.00 0.00 N ATOM 0 H LYS A 102 17.801 22.451 -18.596 1.00 0.00 H new ATOM 0 HA LYS A 102 15.144 22.060 -17.846 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.504 24.100 -19.663 1.00 0.00 H new ATOM 0 HB3 LYS A 102 14.829 24.236 -19.165 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.165 24.051 -17.212 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.464 25.564 -17.752 1.00 0.00 H new ATOM 0 HD2 LYS A 102 14.234 24.840 -16.842 1.00 0.00 H new ATOM 0 HD3 LYS A 102 14.961 23.350 -16.274 1.00 0.00 H new ATOM 0 HE2 LYS A 102 16.545 24.639 -14.847 1.00 0.00 H new ATOM 0 HE3 LYS A 102 15.888 26.147 -15.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.987 25.445 -13.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.790 25.664 -14.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.279 24.097 -14.036 1.00 0.00 H new ATOM 1525 N PRO A 103 15.548 21.646 -21.134 1.00 0.00 N ATOM 1526 CA PRO A 103 14.894 20.991 -22.255 1.00 0.00 C ATOM 1527 C PRO A 103 14.905 19.476 -22.056 1.00 0.00 C ATOM 1528 O PRO A 103 15.952 18.835 -22.134 1.00 0.00 O ATOM 1529 CB PRO A 103 15.693 21.410 -23.490 1.00 0.00 C ATOM 1530 CG PRO A 103 17.098 21.639 -22.935 1.00 0.00 C ATOM 1531 CD PRO A 103 16.831 22.197 -21.540 1.00 0.00 C ATOM 0 HA PRO A 103 13.847 21.276 -22.355 1.00 0.00 H new ATOM 0 HB2 PRO A 103 15.684 20.636 -24.257 1.00 0.00 H new ATOM 0 HB3 PRO A 103 15.287 22.314 -23.945 1.00 0.00 H new ATOM 0 HG2 PRO A 103 17.672 20.713 -22.896 1.00 0.00 H new ATOM 0 HG3 PRO A 103 17.665 22.340 -23.548 1.00 0.00 H new ATOM 0 HD2 PRO A 103 17.619 21.907 -20.845 1.00 0.00 H new ATOM 0 HD3 PRO A 103 16.803 23.287 -21.553 1.00 0.00 H new ATOM 1539 N PHE A 104 13.728 18.899 -21.799 1.00 0.00 N ATOM 1540 CA PHE A 104 13.587 17.467 -21.582 1.00 0.00 C ATOM 1541 C PHE A 104 13.516 16.722 -22.913 1.00 0.00 C ATOM 1542 O PHE A 104 13.094 17.281 -23.926 1.00 0.00 O ATOM 1543 CB PHE A 104 12.342 17.196 -20.735 1.00 0.00 C ATOM 1544 CG PHE A 104 12.517 17.360 -19.238 1.00 0.00 C ATOM 1545 CD1 PHE A 104 13.580 18.108 -18.705 1.00 0.00 C ATOM 1546 CD2 PHE A 104 11.599 16.745 -18.373 1.00 0.00 C ATOM 1547 CE1 PHE A 104 13.731 18.225 -17.317 1.00 0.00 C ATOM 1548 CE2 PHE A 104 11.759 16.855 -16.986 1.00 0.00 C ATOM 1549 CZ PHE A 104 12.824 17.596 -16.454 1.00 0.00 C ATOM 0 H PHE A 104 12.851 19.415 -21.737 1.00 0.00 H new ATOM 0 HA PHE A 104 14.463 17.101 -21.046 1.00 0.00 H new ATOM 0 HB2 PHE A 104 11.548 17.866 -21.065 1.00 0.00 H new ATOM 0 HB3 PHE A 104 12.004 16.179 -20.934 1.00 0.00 H new ATOM 0 HD1 PHE A 104 14.282 18.594 -19.366 1.00 0.00 H new ATOM 0 HD2 PHE A 104 10.768 16.186 -18.777 1.00 0.00 H new ATOM 0 HE1 PHE A 104 14.549 18.802 -16.911 1.00 0.00 H new ATOM 0 HE2 PHE A 104 11.059 16.367 -16.324 1.00 0.00 H new ATOM 0 HZ PHE A 104 12.945 17.681 -15.384 1.00 0.00 H new ATOM 1559 N THR A 105 13.933 15.455 -22.898 1.00 0.00 N ATOM 1560 CA THR A 105 13.905 14.574 -24.060 1.00 0.00 C ATOM 1561 C THR A 105 13.465 13.184 -23.618 1.00 0.00 C ATOM 1562 O THR A 105 13.558 12.843 -22.438 1.00 0.00 O ATOM 1563 CB THR A 105 15.285 14.500 -24.721 1.00 0.00 C ATOM 1564 OG1 THR A 105 16.230 13.990 -23.806 1.00 0.00 O ATOM 1565 CG2 THR A 105 15.746 15.878 -25.195 1.00 0.00 C ATOM 0 H THR A 105 14.306 15.007 -22.061 1.00 0.00 H new ATOM 0 HA THR A 105 13.201 14.972 -24.791 1.00 0.00 H new ATOM 0 HB THR A 105 15.206 13.840 -25.585 1.00 0.00 H new ATOM 0 HG1 THR A 105 17.110 13.944 -24.236 1.00 0.00 H new ATOM 0 HG21 THR A 105 16.728 15.793 -25.660 1.00 0.00 H new ATOM 0 HG22 THR A 105 15.034 16.270 -25.921 1.00 0.00 H new ATOM 0 HG23 THR A 105 15.805 16.555 -24.343 1.00 0.00 H new ATOM 1573 N MET A 106 12.982 12.367 -24.557 1.00 0.00 N ATOM 1574 CA MET A 106 12.483 11.041 -24.227 1.00 0.00 C ATOM 1575 C MET A 106 13.611 10.149 -23.706 1.00 0.00 C ATOM 1576 O MET A 106 13.351 9.213 -22.952 1.00 0.00 O ATOM 1577 CB MET A 106 11.840 10.405 -25.462 1.00 0.00 C ATOM 1578 CG MET A 106 10.559 11.129 -25.880 1.00 0.00 C ATOM 1579 SD MET A 106 10.792 12.788 -26.572 1.00 0.00 S ATOM 1580 CE MET A 106 9.056 13.231 -26.841 1.00 0.00 C ATOM 0 H MET A 106 12.928 12.604 -25.548 1.00 0.00 H new ATOM 0 HA MET A 106 11.734 11.140 -23.441 1.00 0.00 H new ATOM 0 HB2 MET A 106 12.551 10.420 -26.288 1.00 0.00 H new ATOM 0 HB3 MET A 106 11.614 9.359 -25.255 1.00 0.00 H new ATOM 0 HG2 MET A 106 10.040 10.516 -26.617 1.00 0.00 H new ATOM 0 HG3 MET A 106 9.905 11.205 -25.011 1.00 0.00 H new ATOM 0 HE1 MET A 106 8.998 14.232 -27.268 1.00 0.00 H new ATOM 0 HE2 MET A 106 8.600 12.517 -27.527 1.00 0.00 H new ATOM 0 HE3 MET A 106 8.524 13.211 -25.890 1.00 0.00 H new ATOM 1590 N ASP A 107 14.857 10.427 -24.100 1.00 0.00 N ATOM 1591 CA ASP A 107 16.005 9.662 -23.636 1.00 0.00 C ATOM 1592 C ASP A 107 16.516 10.174 -22.288 1.00 0.00 C ATOM 1593 O ASP A 107 16.945 9.384 -21.450 1.00 0.00 O ATOM 1594 CB ASP A 107 17.105 9.729 -24.694 1.00 0.00 C ATOM 1595 CG ASP A 107 18.312 8.878 -24.299 1.00 0.00 C ATOM 1596 OD1 ASP A 107 19.347 9.477 -23.935 1.00 0.00 O ATOM 1597 OD2 ASP A 107 18.188 7.635 -24.365 1.00 0.00 O ATOM 0 H ASP A 107 15.091 11.183 -24.744 1.00 0.00 H new ATOM 0 HA ASP A 107 15.701 8.626 -23.487 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.713 9.385 -25.651 1.00 0.00 H new ATOM 0 HB3 ASP A 107 17.417 10.764 -24.831 1.00 0.00 H new ATOM 1602 N GLY A 108 16.467 11.493 -22.074 1.00 0.00 N ATOM 1603 CA GLY A 108 16.996 12.092 -20.858 1.00 0.00 C ATOM 1604 C GLY A 108 16.047 11.907 -19.680 1.00 0.00 C ATOM 1605 O GLY A 108 16.493 11.794 -18.538 1.00 0.00 O ATOM 0 H GLY A 108 16.065 12.161 -22.731 1.00 0.00 H new ATOM 0 HA2 GLY A 108 17.961 11.644 -20.622 1.00 0.00 H new ATOM 0 HA3 GLY A 108 17.170 13.156 -21.022 1.00 0.00 H new ATOM 1609 N VAL A 109 14.739 11.870 -19.947 1.00 0.00 N ATOM 1610 CA VAL A 109 13.741 11.688 -18.903 1.00 0.00 C ATOM 1611 C VAL A 109 13.647 10.216 -18.520 1.00 0.00 C ATOM 1612 O VAL A 109 13.340 9.902 -17.371 1.00 0.00 O ATOM 1613 CB VAL A 109 12.397 12.226 -19.395 1.00 0.00 C ATOM 1614 CG1 VAL A 109 11.275 11.927 -18.400 1.00 0.00 C ATOM 1615 CG2 VAL A 109 12.476 13.744 -19.564 1.00 0.00 C ATOM 0 H VAL A 109 14.350 11.965 -20.885 1.00 0.00 H new ATOM 0 HA VAL A 109 14.030 12.242 -18.010 1.00 0.00 H new ATOM 0 HB VAL A 109 12.180 11.736 -20.344 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.334 12.324 -18.782 1.00 0.00 H new ATOM 0 HG12 VAL A 109 11.186 10.849 -18.265 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.504 12.395 -17.442 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.516 14.122 -19.915 1.00 0.00 H new ATOM 0 HG22 VAL A 109 12.719 14.205 -18.606 1.00 0.00 H new ATOM 0 HG23 VAL A 109 13.250 13.989 -20.291 1.00 0.00 H new ATOM 1625 N ALA A 110 13.908 9.305 -19.463 1.00 0.00 N ATOM 1626 CA ALA A 110 13.829 7.884 -19.176 1.00 0.00 C ATOM 1627 C ALA A 110 14.946 7.462 -18.226 1.00 0.00 C ATOM 1628 O ALA A 110 14.767 6.535 -17.442 1.00 0.00 O ATOM 1629 CB ALA A 110 13.913 7.107 -20.487 1.00 0.00 C ATOM 0 H ALA A 110 14.173 9.531 -20.422 1.00 0.00 H new ATOM 0 HA ALA A 110 12.880 7.666 -18.686 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.854 6.038 -20.281 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.086 7.397 -21.136 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.858 7.330 -20.982 1.00 0.00 H new ATOM 1635 N LYS A 111 16.101 8.137 -18.286 1.00 0.00 N ATOM 1636 CA LYS A 111 17.229 7.810 -17.424 1.00 0.00 C ATOM 1637 C LYS A 111 17.117 8.506 -16.070 1.00 0.00 C ATOM 1638 O LYS A 111 17.572 7.965 -15.067 1.00 0.00 O ATOM 1639 CB LYS A 111 18.532 8.194 -18.132 1.00 0.00 C ATOM 1640 CG LYS A 111 18.743 7.330 -19.379 1.00 0.00 C ATOM 1641 CD LYS A 111 19.993 7.764 -20.152 1.00 0.00 C ATOM 1642 CE LYS A 111 21.267 7.640 -19.310 1.00 0.00 C ATOM 1643 NZ LYS A 111 21.542 6.236 -18.945 1.00 0.00 N ATOM 0 H LYS A 111 16.273 8.913 -18.926 1.00 0.00 H new ATOM 0 HA LYS A 111 17.226 6.737 -17.232 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.503 9.247 -18.413 1.00 0.00 H new ATOM 0 HB3 LYS A 111 19.373 8.069 -17.450 1.00 0.00 H new ATOM 0 HG2 LYS A 111 18.838 6.284 -19.087 1.00 0.00 H new ATOM 0 HG3 LYS A 111 17.869 7.402 -20.026 1.00 0.00 H new ATOM 0 HD2 LYS A 111 20.092 7.154 -21.050 1.00 0.00 H new ATOM 0 HD3 LYS A 111 19.875 8.797 -20.479 1.00 0.00 H new ATOM 0 HE2 LYS A 111 22.113 8.044 -19.867 1.00 0.00 H new ATOM 0 HE3 LYS A 111 21.165 8.239 -18.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 22.470 6.174 -18.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 20.805 5.895 -18.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 21.546 5.649 -19.803 1.00 0.00 H new ATOM 1657 N ALA A 112 16.517 9.698 -16.028 1.00 0.00 N ATOM 1658 CA ALA A 112 16.396 10.443 -14.786 1.00 0.00 C ATOM 1659 C ALA A 112 15.313 9.840 -13.893 1.00 0.00 C ATOM 1660 O ALA A 112 15.473 9.785 -12.675 1.00 0.00 O ATOM 1661 CB ALA A 112 16.084 11.904 -15.113 1.00 0.00 C ATOM 0 H ALA A 112 16.110 10.162 -16.841 1.00 0.00 H new ATOM 0 HA ALA A 112 17.336 10.389 -14.238 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.991 12.472 -14.187 1.00 0.00 H new ATOM 0 HB2 ALA A 112 16.890 12.322 -15.716 1.00 0.00 H new ATOM 0 HB3 ALA A 112 15.148 11.961 -15.669 1.00 0.00 H new ATOM 1667 N LEU A 113 14.208 9.383 -14.488 1.00 0.00 N ATOM 1668 CA LEU A 113 13.125 8.787 -13.720 1.00 0.00 C ATOM 1669 C LEU A 113 13.415 7.313 -13.441 1.00 0.00 C ATOM 1670 O LEU A 113 12.842 6.752 -12.513 1.00 0.00 O ATOM 1671 CB LEU A 113 11.791 8.980 -14.445 1.00 0.00 C ATOM 1672 CG LEU A 113 11.158 10.362 -14.221 1.00 0.00 C ATOM 1673 CD1 LEU A 113 10.701 10.524 -12.773 1.00 0.00 C ATOM 1674 CD2 LEU A 113 12.108 11.513 -14.552 1.00 0.00 C ATOM 0 H LEU A 113 14.045 9.416 -15.494 1.00 0.00 H new ATOM 0 HA LEU A 113 13.052 9.292 -12.757 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.944 8.830 -15.514 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.093 8.212 -14.112 1.00 0.00 H new ATOM 0 HG LEU A 113 10.307 10.409 -14.900 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.256 11.510 -12.640 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.962 9.758 -12.537 1.00 0.00 H new ATOM 0 HD13 LEU A 113 11.558 10.419 -12.107 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.604 12.463 -14.374 1.00 0.00 H new ATOM 0 HD22 LEU A 113 12.993 11.447 -13.919 1.00 0.00 H new ATOM 0 HD23 LEU A 113 12.405 11.450 -15.599 1.00 0.00 H new ATOM 1686 N ALA A 114 14.294 6.671 -14.217 1.00 0.00 N ATOM 1687 CA ALA A 114 14.705 5.311 -13.905 1.00 0.00 C ATOM 1688 C ALA A 114 15.658 5.314 -12.710 1.00 0.00 C ATOM 1689 O ALA A 114 15.795 4.297 -12.032 1.00 0.00 O ATOM 1690 CB ALA A 114 15.362 4.673 -15.128 1.00 0.00 C ATOM 0 H ALA A 114 14.725 7.069 -15.051 1.00 0.00 H new ATOM 0 HA ALA A 114 13.828 4.720 -13.640 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.667 3.655 -14.887 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.651 4.653 -15.954 1.00 0.00 H new ATOM 0 HB3 ALA A 114 16.237 5.256 -15.416 1.00 0.00 H new ATOM 1696 N ALA A 115 16.316 6.449 -12.447 1.00 0.00 N ATOM 1697 CA ALA A 115 17.176 6.603 -11.283 1.00 0.00 C ATOM 1698 C ALA A 115 16.384 7.071 -10.059 1.00 0.00 C ATOM 1699 O ALA A 115 16.847 6.912 -8.930 1.00 0.00 O ATOM 1700 CB ALA A 115 18.296 7.584 -11.627 1.00 0.00 C ATOM 0 H ALA A 115 16.263 7.280 -13.037 1.00 0.00 H new ATOM 0 HA ALA A 115 17.607 5.636 -11.024 1.00 0.00 H new ATOM 0 HB1 ALA A 115 18.948 7.709 -10.763 1.00 0.00 H new ATOM 0 HB2 ALA A 115 18.875 7.196 -12.466 1.00 0.00 H new ATOM 0 HB3 ALA A 115 17.865 8.548 -11.898 1.00 0.00 H new ATOM 1706 N LEU A 116 15.196 7.649 -10.271 1.00 0.00 N ATOM 1707 CA LEU A 116 14.346 8.119 -9.186 1.00 0.00 C ATOM 1708 C LEU A 116 13.370 7.027 -8.743 1.00 0.00 C ATOM 1709 O LEU A 116 13.358 6.637 -7.577 1.00 0.00 O ATOM 1710 CB LEU A 116 13.624 9.388 -9.657 1.00 0.00 C ATOM 1711 CG LEU A 116 13.059 10.249 -8.523 1.00 0.00 C ATOM 1712 CD1 LEU A 116 12.378 11.473 -9.136 1.00 0.00 C ATOM 1713 CD2 LEU A 116 12.021 9.526 -7.670 1.00 0.00 C ATOM 0 H LEU A 116 14.803 7.801 -11.200 1.00 0.00 H new ATOM 0 HA LEU A 116 14.949 8.359 -8.310 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.318 9.990 -10.244 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.809 9.103 -10.322 1.00 0.00 H new ATOM 0 HG LEU A 116 13.898 10.510 -7.878 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.969 12.098 -8.342 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.107 12.046 -9.710 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.572 11.149 -9.794 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.664 10.195 -6.887 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.183 9.222 -8.297 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.473 8.644 -7.216 1.00 0.00 H new ATOM 1725 N LEU A 117 12.549 6.539 -9.680 1.00 0.00 N ATOM 1726 CA LEU A 117 11.467 5.599 -9.428 1.00 0.00 C ATOM 1727 C LEU A 117 11.956 4.201 -9.037 1.00 0.00 C ATOM 1728 O LEU A 117 11.131 3.323 -8.776 1.00 0.00 O ATOM 1729 CB LEU A 117 10.576 5.523 -10.672 1.00 0.00 C ATOM 1730 CG LEU A 117 10.041 6.893 -11.113 1.00 0.00 C ATOM 1731 CD1 LEU A 117 9.199 6.719 -12.374 1.00 0.00 C ATOM 1732 CD2 LEU A 117 9.168 7.529 -10.033 1.00 0.00 C ATOM 0 H LEU A 117 12.627 6.800 -10.663 1.00 0.00 H new ATOM 0 HA LEU A 117 10.903 5.970 -8.572 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.142 5.080 -11.491 1.00 0.00 H new ATOM 0 HB3 LEU A 117 9.736 4.859 -10.470 1.00 0.00 H new ATOM 0 HG LEU A 117 10.896 7.544 -11.298 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.816 7.689 -12.692 1.00 0.00 H new ATOM 0 HD12 LEU A 117 9.815 6.294 -13.167 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.364 6.050 -12.165 1.00 0.00 H new ATOM 0 HD21 LEU A 117 8.807 8.497 -10.380 1.00 0.00 H new ATOM 0 HD22 LEU A 117 8.318 6.879 -9.823 1.00 0.00 H new ATOM 0 HD23 LEU A 117 9.755 7.665 -9.124 1.00 0.00 H new ATOM 1744 N VAL A 118 13.274 3.982 -8.994 1.00 0.00 N ATOM 1745 CA VAL A 118 13.856 2.691 -8.639 1.00 0.00 C ATOM 1746 C VAL A 118 15.012 2.891 -7.666 1.00 0.00 C ATOM 1747 O VAL A 118 14.910 2.359 -6.540 1.00 0.00 O ATOM 1748 CB VAL A 118 14.322 1.948 -9.895 1.00 0.00 C ATOM 1749 CG1 VAL A 118 14.854 0.563 -9.523 1.00 0.00 C ATOM 1750 CG2 VAL A 118 13.174 1.778 -10.886 1.00 0.00 C ATOM 0 H VAL A 118 13.967 4.700 -9.206 1.00 0.00 H new ATOM 0 HA VAL A 118 13.094 2.082 -8.152 1.00 0.00 H new ATOM 0 HB VAL A 118 15.112 2.541 -10.356 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.182 0.045 -10.424 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.696 0.668 -8.838 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.064 -0.013 -9.041 1.00 0.00 H new ATOM 0 HG21 VAL A 118 13.531 1.248 -11.769 1.00 0.00 H new ATOM 0 HG22 VAL A 118 12.372 1.207 -10.419 1.00 0.00 H new ATOM 0 HG23 VAL A 118 12.798 2.758 -11.179 1.00 0.00 H new TER 1760 VAL A 118