USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 850 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 22 ASN : amide:sc= 0.432 K(o=0.76,f=-6!) USER MOD Set 1.2: A 25 THR OG1 : rot -64:sc= 0.333 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0.551 (180deg=0.218) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -96:sc= -0.788 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 CYS SG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -1.76! C(o=-1.8!,f=-7.2!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -3:sc= 0.561 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -95:sc= 1.25 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -20:sc= 0.181 USER MOD Single : A 50 SER OG : rot -86:sc= 1.22 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0.124 USER MOD Single : A 62 MET CE :methyl -140:sc= -0.153 (180deg=-0.71) USER MOD Single : A 68 GLN : amide:sc= -4.42! K(o=-4.4!,f=-0.4) USER MOD Single : A 70 GLN : amide:sc= -1.18! K(o=-1.2!,f=-0.015) USER MOD Single : A 75 GLN : amide:sc= -0.522 K(o=-0.52,f=-2.5) USER MOD Single : A 76 ASN : amide:sc= -0.962 K(o=-0.96,f=-0.3) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 ASN : amide:sc=-0.00548 K(o=-0.0055,f=-0.75) USER MOD Single : A 90 TYR OH : rot 180:sc= -0.425 USER MOD Single : A 94 GLN : amide:sc= -0.626 K(o=-0.63,f=-1.6) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.00323 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 GLN : amide:sc= 0.0678 K(o=0.068,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.607 0.899 0.493 1.00 0.00 N ATOM 2 CA MET A 1 2.397 0.595 -0.943 1.00 0.00 C ATOM 3 C MET A 1 1.261 1.439 -1.519 1.00 0.00 C ATOM 4 O MET A 1 0.724 1.133 -2.582 1.00 0.00 O ATOM 5 CB MET A 1 2.105 -0.900 -1.151 1.00 0.00 C ATOM 6 CG MET A 1 0.770 -1.371 -0.590 1.00 0.00 C ATOM 7 SD MET A 1 0.701 -1.338 1.211 1.00 0.00 S ATOM 8 CE MET A 1 -0.950 -1.977 1.484 1.00 0.00 C ATOM 0 H1 MET A 1 3.484 0.445 0.819 1.00 0.00 H new ATOM 0 H2 MET A 1 2.681 1.928 0.623 1.00 0.00 H new ATOM 0 H3 MET A 1 1.804 0.537 1.046 1.00 0.00 H new ATOM 0 HA MET A 1 3.316 0.845 -1.473 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.132 -1.116 -2.219 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.903 -1.480 -0.688 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.026 -0.742 -0.989 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.577 -2.387 -0.935 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.151 -2.020 2.554 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.677 -1.322 1.004 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.028 -2.978 1.060 1.00 0.00 H new ATOM 18 N SER A 2 0.903 2.509 -0.822 1.00 0.00 N ATOM 19 CA SER A 2 -0.127 3.419 -1.299 1.00 0.00 C ATOM 20 C SER A 2 0.515 4.587 -2.041 1.00 0.00 C ATOM 21 O SER A 2 1.728 4.792 -1.949 1.00 0.00 O ATOM 22 CB SER A 2 -0.964 3.928 -0.125 1.00 0.00 C ATOM 23 OG SER A 2 -1.502 2.845 0.618 1.00 0.00 O ATOM 0 H SER A 2 1.312 2.767 0.076 1.00 0.00 H new ATOM 0 HA SER A 2 -0.783 2.885 -1.987 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.348 4.550 0.524 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.773 4.558 -0.495 1.00 0.00 H new ATOM 0 HG SER A 2 -2.032 3.192 1.365 1.00 0.00 H new ATOM 29 N ILE A 3 -0.290 5.352 -2.766 1.00 0.00 N ATOM 30 CA ILE A 3 0.225 6.466 -3.551 1.00 0.00 C ATOM 31 C ILE A 3 0.680 7.594 -2.631 1.00 0.00 C ATOM 32 O ILE A 3 -0.001 7.930 -1.659 1.00 0.00 O ATOM 33 CB ILE A 3 -0.831 6.999 -4.546 1.00 0.00 C ATOM 34 CG1 ILE A 3 -1.401 5.854 -5.394 1.00 0.00 C ATOM 35 CG2 ILE A 3 -0.227 8.071 -5.442 1.00 0.00 C ATOM 36 CD1 ILE A 3 -0.365 5.129 -6.226 1.00 0.00 C ATOM 0 H ILE A 3 -1.300 5.222 -2.827 1.00 0.00 H new ATOM 0 HA ILE A 3 1.075 6.098 -4.125 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.646 7.443 -3.974 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.890 5.136 -4.735 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -2.169 6.254 -6.056 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.985 8.435 -6.136 1.00 0.00 H new ATOM 0 HG22 ILE A 3 0.131 8.898 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.606 7.649 -6.003 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.847 4.335 -6.796 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.108 5.832 -6.912 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.391 4.697 -5.570 1.00 0.00 H new ATOM 48 N THR A 4 1.831 8.167 -2.938 1.00 0.00 N ATOM 49 CA THR A 4 2.428 9.189 -2.099 1.00 0.00 C ATOM 50 C THR A 4 2.028 10.593 -2.547 1.00 0.00 C ATOM 51 O THR A 4 1.285 10.762 -3.516 1.00 0.00 O ATOM 52 CB THR A 4 3.958 9.060 -2.121 1.00 0.00 C ATOM 53 OG1 THR A 4 4.424 9.085 -3.477 1.00 0.00 O ATOM 54 CG2 THR A 4 4.398 7.765 -1.454 1.00 0.00 C ATOM 0 H THR A 4 2.374 7.938 -3.770 1.00 0.00 H new ATOM 0 HA THR A 4 2.058 9.039 -1.085 1.00 0.00 H new ATOM 0 HB THR A 4 4.385 9.898 -1.570 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.545 8.167 -3.798 1.00 0.00 H new ATOM 0 HG21 THR A 4 5.485 7.693 -1.480 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.059 7.756 -0.418 1.00 0.00 H new ATOM 0 HG23 THR A 4 3.966 6.917 -1.985 1.00 0.00 H new ATOM 62 N SER A 5 2.531 11.590 -1.833 1.00 0.00 N ATOM 63 CA SER A 5 2.267 12.988 -2.141 1.00 0.00 C ATOM 64 C SER A 5 3.187 13.483 -3.262 1.00 0.00 C ATOM 65 O SER A 5 3.887 12.686 -3.893 1.00 0.00 O ATOM 66 CB SER A 5 2.458 13.825 -0.878 1.00 0.00 C ATOM 67 OG SER A 5 1.687 13.306 0.194 1.00 0.00 O ATOM 0 H SER A 5 3.135 11.452 -1.022 1.00 0.00 H new ATOM 0 HA SER A 5 1.239 13.089 -2.489 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.512 13.837 -0.601 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.168 14.857 -1.074 1.00 0.00 H new ATOM 0 HG SER A 5 1.826 13.856 0.993 1.00 0.00 H new ATOM 73 N THR A 6 3.175 14.799 -3.500 1.00 0.00 N ATOM 74 CA THR A 6 3.977 15.436 -4.553 1.00 0.00 C ATOM 75 C THR A 6 5.457 15.038 -4.479 1.00 0.00 C ATOM 76 O THR A 6 6.173 15.088 -5.484 1.00 0.00 O ATOM 77 CB THR A 6 3.857 16.974 -4.469 1.00 0.00 C ATOM 78 OG1 THR A 6 2.474 17.347 -4.442 1.00 0.00 O ATOM 79 CG2 THR A 6 4.542 17.654 -5.649 1.00 0.00 C ATOM 0 H THR A 6 2.606 15.456 -2.966 1.00 0.00 H new ATOM 0 HA THR A 6 3.581 15.084 -5.506 1.00 0.00 H new ATOM 0 HB THR A 6 4.352 17.301 -3.555 1.00 0.00 H new ATOM 0 HG1 THR A 6 2.399 18.323 -4.387 1.00 0.00 H new ATOM 0 HG21 THR A 6 4.437 18.735 -5.557 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.600 17.391 -5.657 1.00 0.00 H new ATOM 0 HG23 THR A 6 4.079 17.323 -6.579 1.00 0.00 H new ATOM 87 N ASP A 7 5.903 14.628 -3.291 1.00 0.00 N ATOM 88 CA ASP A 7 7.271 14.138 -3.086 1.00 0.00 C ATOM 89 C ASP A 7 7.632 13.032 -4.081 1.00 0.00 C ATOM 90 O ASP A 7 8.809 12.760 -4.314 1.00 0.00 O ATOM 91 CB ASP A 7 7.454 13.624 -1.655 1.00 0.00 C ATOM 92 CG ASP A 7 7.549 14.744 -0.639 1.00 0.00 C ATOM 93 OD1 ASP A 7 8.641 15.335 -0.505 1.00 0.00 O ATOM 94 OD2 ASP A 7 6.539 15.035 0.035 1.00 0.00 O ATOM 0 H ASP A 7 5.331 14.625 -2.446 1.00 0.00 H new ATOM 0 HA ASP A 7 7.942 14.980 -3.254 1.00 0.00 H new ATOM 0 HB2 ASP A 7 6.617 12.975 -1.397 1.00 0.00 H new ATOM 0 HB3 ASP A 7 8.357 13.016 -1.605 1.00 0.00 H new ATOM 99 N ILE A 8 6.612 12.399 -4.660 1.00 0.00 N ATOM 100 CA ILE A 8 6.802 11.386 -5.695 1.00 0.00 C ATOM 101 C ILE A 8 7.676 11.922 -6.840 1.00 0.00 C ATOM 102 O ILE A 8 8.461 11.182 -7.430 1.00 0.00 O ATOM 103 CB ILE A 8 5.436 10.899 -6.249 1.00 0.00 C ATOM 104 CG1 ILE A 8 5.625 9.768 -7.261 1.00 0.00 C ATOM 105 CG2 ILE A 8 4.660 12.051 -6.878 1.00 0.00 C ATOM 106 CD1 ILE A 8 4.322 9.153 -7.727 1.00 0.00 C ATOM 0 H ILE A 8 5.635 12.574 -4.425 1.00 0.00 H new ATOM 0 HA ILE A 8 7.315 10.540 -5.238 1.00 0.00 H new ATOM 0 HB ILE A 8 4.857 10.513 -5.410 1.00 0.00 H new ATOM 0 HG12 ILE A 8 6.167 10.151 -8.126 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.246 8.991 -6.815 1.00 0.00 H new ATOM 0 HG21 ILE A 8 3.707 11.683 -7.258 1.00 0.00 H new ATOM 0 HG22 ILE A 8 4.478 12.820 -6.127 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.239 12.474 -7.699 1.00 0.00 H new ATOM 0 HD11 ILE A 8 4.530 8.358 -8.443 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.788 8.740 -6.871 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.708 9.918 -8.203 1.00 0.00 H new ATOM 118 N CYS A 9 7.546 13.217 -7.126 1.00 0.00 N ATOM 119 CA CYS A 9 8.331 13.863 -8.174 1.00 0.00 C ATOM 120 C CYS A 9 9.813 13.878 -7.808 1.00 0.00 C ATOM 121 O CYS A 9 10.680 13.674 -8.656 1.00 0.00 O ATOM 122 CB CYS A 9 7.830 15.295 -8.394 1.00 0.00 C ATOM 123 SG CYS A 9 8.796 16.257 -9.586 1.00 0.00 S ATOM 0 H CYS A 9 6.900 13.841 -6.643 1.00 0.00 H new ATOM 0 HA CYS A 9 8.211 13.295 -9.096 1.00 0.00 H new ATOM 0 HB2 CYS A 9 6.795 15.256 -8.733 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.833 15.818 -7.438 1.00 0.00 H new ATOM 0 HG CYS A 9 8.286 17.448 -9.697 1.00 0.00 H new ATOM 129 N GLN A 10 10.094 14.097 -6.531 1.00 0.00 N ATOM 130 CA GLN A 10 11.466 14.195 -6.051 1.00 0.00 C ATOM 131 C GLN A 10 12.125 12.824 -6.007 1.00 0.00 C ATOM 132 O GLN A 10 13.325 12.689 -6.241 1.00 0.00 O ATOM 133 CB GLN A 10 11.500 14.841 -4.666 1.00 0.00 C ATOM 134 CG GLN A 10 10.873 16.227 -4.616 1.00 0.00 C ATOM 135 CD GLN A 10 11.605 17.247 -5.472 1.00 0.00 C ATOM 136 OE1 GLN A 10 12.196 16.919 -6.498 1.00 0.00 O ATOM 137 NE2 GLN A 10 11.568 18.498 -5.054 1.00 0.00 N ATOM 0 H GLN A 10 9.386 14.211 -5.805 1.00 0.00 H new ATOM 0 HA GLN A 10 12.025 14.822 -6.746 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.981 14.192 -3.961 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.536 14.909 -4.333 1.00 0.00 H new ATOM 0 HG2 GLN A 10 9.836 16.162 -4.947 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.857 16.574 -3.583 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.068 18.735 -4.197 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.040 19.228 -5.588 1.00 0.00 H new ATOM 146 N ALA A 11 11.324 11.808 -5.713 1.00 0.00 N ATOM 147 CA ALA A 11 11.813 10.437 -5.616 1.00 0.00 C ATOM 148 C ALA A 11 12.371 9.937 -6.950 1.00 0.00 C ATOM 149 O ALA A 11 13.081 8.934 -6.996 1.00 0.00 O ATOM 150 CB ALA A 11 10.702 9.524 -5.127 1.00 0.00 C ATOM 0 H ALA A 11 10.324 11.908 -5.536 1.00 0.00 H new ATOM 0 HA ALA A 11 12.632 10.423 -4.897 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.075 8.502 -5.057 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.365 9.855 -4.145 1.00 0.00 H new ATOM 0 HB3 ALA A 11 9.868 9.559 -5.828 1.00 0.00 H new ATOM 156 N ALA A 12 12.052 10.639 -8.034 1.00 0.00 N ATOM 157 CA ALA A 12 12.561 10.279 -9.354 1.00 0.00 C ATOM 158 C ALA A 12 14.044 10.619 -9.478 1.00 0.00 C ATOM 159 O ALA A 12 14.730 10.142 -10.381 1.00 0.00 O ATOM 160 CB ALA A 12 11.763 10.979 -10.442 1.00 0.00 C ATOM 0 H ALA A 12 11.445 11.459 -8.025 1.00 0.00 H new ATOM 0 HA ALA A 12 12.448 9.202 -9.478 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.156 10.699 -11.419 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.716 10.682 -10.374 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.843 12.059 -10.315 1.00 0.00 H new ATOM 166 N ASP A 13 14.534 11.444 -8.562 1.00 0.00 N ATOM 167 CA ASP A 13 15.942 11.828 -8.548 1.00 0.00 C ATOM 168 C ASP A 13 16.774 10.779 -7.817 1.00 0.00 C ATOM 169 O ASP A 13 17.986 10.685 -8.009 1.00 0.00 O ATOM 170 CB ASP A 13 16.111 13.199 -7.881 1.00 0.00 C ATOM 171 CG ASP A 13 17.559 13.652 -7.821 1.00 0.00 C ATOM 172 OD1 ASP A 13 18.039 14.264 -8.799 1.00 0.00 O ATOM 173 OD2 ASP A 13 18.221 13.407 -6.790 1.00 0.00 O ATOM 0 H ASP A 13 13.977 11.862 -7.817 1.00 0.00 H new ATOM 0 HA ASP A 13 16.294 11.893 -9.578 1.00 0.00 H new ATOM 0 HB2 ASP A 13 15.527 13.938 -8.429 1.00 0.00 H new ATOM 0 HB3 ASP A 13 15.706 13.158 -6.870 1.00 0.00 H new ATOM 178 N ALA A 14 16.105 9.971 -6.999 1.00 0.00 N ATOM 179 CA ALA A 14 16.781 8.962 -6.189 1.00 0.00 C ATOM 180 C ALA A 14 17.416 7.882 -7.059 1.00 0.00 C ATOM 181 O ALA A 14 18.420 7.277 -6.679 1.00 0.00 O ATOM 182 CB ALA A 14 15.806 8.342 -5.200 1.00 0.00 C ATOM 0 H ALA A 14 15.092 9.996 -6.879 1.00 0.00 H new ATOM 0 HA ALA A 14 17.581 9.456 -5.637 1.00 0.00 H new ATOM 0 HB1 ALA A 14 16.322 7.591 -4.602 1.00 0.00 H new ATOM 0 HB2 ALA A 14 15.410 9.118 -4.545 1.00 0.00 H new ATOM 0 HB3 ALA A 14 14.986 7.872 -5.743 1.00 0.00 H new ATOM 188 N LEU A 15 16.829 7.652 -8.228 1.00 0.00 N ATOM 189 CA LEU A 15 17.348 6.666 -9.166 1.00 0.00 C ATOM 190 C LEU A 15 18.752 7.055 -9.614 1.00 0.00 C ATOM 191 O LEU A 15 18.983 8.188 -10.035 1.00 0.00 O ATOM 192 CB LEU A 15 16.429 6.534 -10.389 1.00 0.00 C ATOM 193 CG LEU A 15 15.109 5.780 -10.165 1.00 0.00 C ATOM 194 CD1 LEU A 15 14.187 6.536 -9.219 1.00 0.00 C ATOM 195 CD2 LEU A 15 14.416 5.536 -11.496 1.00 0.00 C ATOM 0 H LEU A 15 15.991 8.137 -8.549 1.00 0.00 H new ATOM 0 HA LEU A 15 17.386 5.703 -8.658 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.195 7.535 -10.752 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.982 6.029 -11.181 1.00 0.00 H new ATOM 0 HG LEU A 15 15.344 4.822 -9.702 1.00 0.00 H new ATOM 0 HD11 LEU A 15 13.263 5.973 -9.084 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.679 6.662 -8.255 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.957 7.515 -9.640 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.481 5.001 -11.327 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.205 6.491 -11.977 1.00 0.00 H new ATOM 0 HD23 LEU A 15 15.064 4.941 -12.140 1.00 0.00 H new ATOM 207 N LYS A 16 19.684 6.122 -9.513 1.00 0.00 N ATOM 208 CA LYS A 16 21.071 6.386 -9.863 1.00 0.00 C ATOM 209 C LYS A 16 21.633 5.287 -10.753 1.00 0.00 C ATOM 210 O LYS A 16 21.241 4.125 -10.646 1.00 0.00 O ATOM 211 CB LYS A 16 21.924 6.511 -8.599 1.00 0.00 C ATOM 212 CG LYS A 16 21.819 5.307 -7.679 1.00 0.00 C ATOM 213 CD LYS A 16 22.824 5.379 -6.545 1.00 0.00 C ATOM 214 CE LYS A 16 22.618 4.253 -5.547 1.00 0.00 C ATOM 215 NZ LYS A 16 23.709 4.205 -4.540 1.00 0.00 N ATOM 0 H LYS A 16 19.505 5.171 -9.190 1.00 0.00 H new ATOM 0 HA LYS A 16 21.102 7.326 -10.414 1.00 0.00 H new ATOM 0 HB2 LYS A 16 22.966 6.650 -8.885 1.00 0.00 H new ATOM 0 HB3 LYS A 16 21.622 7.404 -8.052 1.00 0.00 H new ATOM 0 HG2 LYS A 16 20.811 5.249 -7.269 1.00 0.00 H new ATOM 0 HG3 LYS A 16 21.982 4.395 -8.253 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.835 5.328 -6.949 1.00 0.00 H new ATOM 0 HD3 LYS A 16 22.732 6.339 -6.036 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.662 4.385 -5.041 1.00 0.00 H new ATOM 0 HE3 LYS A 16 22.569 3.302 -6.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.534 3.424 -3.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 24.619 4.054 -5.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 23.739 5.104 -4.017 1.00 0.00 H new ATOM 229 N GLY A 17 22.544 5.666 -11.634 1.00 0.00 N ATOM 230 CA GLY A 17 23.183 4.703 -12.505 1.00 0.00 C ATOM 231 C GLY A 17 23.192 5.154 -13.948 1.00 0.00 C ATOM 232 O GLY A 17 22.335 5.937 -14.368 1.00 0.00 O ATOM 0 H GLY A 17 22.854 6.629 -11.762 1.00 0.00 H new ATOM 0 HA2 GLY A 17 24.208 4.538 -12.172 1.00 0.00 H new ATOM 0 HA3 GLY A 17 22.665 3.747 -12.428 1.00 0.00 H new ATOM 236 N PHE A 18 24.149 4.653 -14.714 1.00 0.00 N ATOM 237 CA PHE A 18 24.268 5.006 -16.118 1.00 0.00 C ATOM 238 C PHE A 18 23.914 3.801 -16.970 1.00 0.00 C ATOM 239 O PHE A 18 24.591 2.777 -16.917 1.00 0.00 O ATOM 240 CB PHE A 18 25.695 5.456 -16.448 1.00 0.00 C ATOM 241 CG PHE A 18 26.217 6.550 -15.563 1.00 0.00 C ATOM 242 CD1 PHE A 18 25.898 7.873 -15.814 1.00 0.00 C ATOM 243 CD2 PHE A 18 27.034 6.253 -14.484 1.00 0.00 C ATOM 244 CE1 PHE A 18 26.381 8.880 -15.003 1.00 0.00 C ATOM 245 CE2 PHE A 18 27.520 7.256 -13.670 1.00 0.00 C ATOM 246 CZ PHE A 18 27.194 8.571 -13.930 1.00 0.00 C ATOM 0 H PHE A 18 24.857 3.998 -14.384 1.00 0.00 H new ATOM 0 HA PHE A 18 23.585 5.829 -16.328 1.00 0.00 H new ATOM 0 HB2 PHE A 18 26.361 4.596 -16.375 1.00 0.00 H new ATOM 0 HB3 PHE A 18 25.726 5.796 -17.483 1.00 0.00 H new ATOM 0 HD1 PHE A 18 25.265 8.120 -16.653 1.00 0.00 H new ATOM 0 HD2 PHE A 18 27.293 5.225 -14.278 1.00 0.00 H new ATOM 0 HE1 PHE A 18 26.123 9.909 -15.207 1.00 0.00 H new ATOM 0 HE2 PHE A 18 28.154 7.012 -12.831 1.00 0.00 H new ATOM 0 HZ PHE A 18 27.574 9.358 -13.295 1.00 0.00 H new ATOM 256 N VAL A 19 22.860 3.917 -17.752 1.00 0.00 N ATOM 257 CA VAL A 19 22.409 2.804 -18.565 1.00 0.00 C ATOM 258 C VAL A 19 22.935 2.938 -19.994 1.00 0.00 C ATOM 259 O VAL A 19 22.894 4.018 -20.584 1.00 0.00 O ATOM 260 CB VAL A 19 20.864 2.680 -18.543 1.00 0.00 C ATOM 261 CG1 VAL A 19 20.195 3.939 -19.074 1.00 0.00 C ATOM 262 CG2 VAL A 19 20.407 1.453 -19.315 1.00 0.00 C ATOM 0 H VAL A 19 22.302 4.766 -17.842 1.00 0.00 H new ATOM 0 HA VAL A 19 22.814 1.886 -18.139 1.00 0.00 H new ATOM 0 HB VAL A 19 20.558 2.560 -17.504 1.00 0.00 H new ATOM 0 HG11 VAL A 19 19.112 3.816 -19.044 1.00 0.00 H new ATOM 0 HG12 VAL A 19 20.481 4.791 -18.457 1.00 0.00 H new ATOM 0 HG13 VAL A 19 20.512 4.113 -20.102 1.00 0.00 H new ATOM 0 HG21 VAL A 19 19.319 1.388 -19.285 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.737 1.531 -20.351 1.00 0.00 H new ATOM 0 HG23 VAL A 19 20.836 0.558 -18.864 1.00 0.00 H new ATOM 272 N GLY A 20 23.468 1.842 -20.521 1.00 0.00 N ATOM 273 CA GLY A 20 24.034 1.841 -21.855 1.00 0.00 C ATOM 274 C GLY A 20 23.813 0.520 -22.566 1.00 0.00 C ATOM 275 O GLY A 20 23.699 -0.527 -21.928 1.00 0.00 O ATOM 0 H GLY A 20 23.518 0.944 -20.040 1.00 0.00 H new ATOM 0 HA2 GLY A 20 23.587 2.646 -22.439 1.00 0.00 H new ATOM 0 HA3 GLY A 20 25.103 2.046 -21.795 1.00 0.00 H new ATOM 279 N PHE A 21 23.746 0.567 -23.888 1.00 0.00 N ATOM 280 CA PHE A 21 23.485 -0.624 -24.683 1.00 0.00 C ATOM 281 C PHE A 21 24.793 -1.312 -25.050 1.00 0.00 C ATOM 282 O PHE A 21 25.599 -0.768 -25.803 1.00 0.00 O ATOM 283 CB PHE A 21 22.708 -0.247 -25.948 1.00 0.00 C ATOM 284 CG PHE A 21 22.269 -1.422 -26.780 1.00 0.00 C ATOM 285 CD1 PHE A 21 21.053 -2.038 -26.540 1.00 0.00 C ATOM 286 CD2 PHE A 21 23.069 -1.902 -27.806 1.00 0.00 C ATOM 287 CE1 PHE A 21 20.643 -3.114 -27.305 1.00 0.00 C ATOM 288 CE2 PHE A 21 22.664 -2.976 -28.574 1.00 0.00 C ATOM 289 CZ PHE A 21 21.450 -3.583 -28.323 1.00 0.00 C ATOM 0 H PHE A 21 23.869 1.420 -24.434 1.00 0.00 H new ATOM 0 HA PHE A 21 22.884 -1.317 -24.094 1.00 0.00 H new ATOM 0 HB2 PHE A 21 21.828 0.329 -25.661 1.00 0.00 H new ATOM 0 HB3 PHE A 21 23.330 0.405 -26.561 1.00 0.00 H new ATOM 0 HD1 PHE A 21 20.417 -1.674 -25.746 1.00 0.00 H new ATOM 0 HD2 PHE A 21 24.020 -1.431 -28.007 1.00 0.00 H new ATOM 0 HE1 PHE A 21 19.693 -3.587 -27.107 1.00 0.00 H new ATOM 0 HE2 PHE A 21 23.296 -3.340 -29.370 1.00 0.00 H new ATOM 0 HZ PHE A 21 21.132 -4.424 -28.922 1.00 0.00 H new ATOM 299 N ASN A 22 25.002 -2.507 -24.519 1.00 0.00 N ATOM 300 CA ASN A 22 26.229 -3.241 -24.787 1.00 0.00 C ATOM 301 C ASN A 22 26.018 -4.193 -25.961 1.00 0.00 C ATOM 302 O ASN A 22 25.003 -4.887 -26.034 1.00 0.00 O ATOM 303 CB ASN A 22 26.702 -4.008 -23.538 1.00 0.00 C ATOM 304 CG ASN A 22 25.964 -5.306 -23.305 1.00 0.00 C ATOM 305 OD1 ASN A 22 26.420 -6.363 -23.730 1.00 0.00 O ATOM 306 ND2 ASN A 22 24.826 -5.245 -22.636 1.00 0.00 N ATOM 0 H ASN A 22 24.344 -2.986 -23.905 1.00 0.00 H new ATOM 0 HA ASN A 22 27.010 -2.527 -25.048 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.767 -4.218 -23.634 1.00 0.00 H new ATOM 0 HB3 ASN A 22 26.581 -3.369 -22.663 1.00 0.00 H new ATOM 0 HD21 ASN A 22 24.294 -6.096 -22.457 1.00 0.00 H new ATOM 0 HD22 ASN A 22 24.480 -4.347 -22.299 1.00 0.00 H new ATOM 313 N ARG A 23 26.972 -4.214 -26.882 1.00 0.00 N ATOM 314 CA ARG A 23 26.865 -5.048 -28.076 1.00 0.00 C ATOM 315 C ARG A 23 27.310 -6.479 -27.795 1.00 0.00 C ATOM 316 O ARG A 23 27.208 -7.348 -28.659 1.00 0.00 O ATOM 317 CB ARG A 23 27.703 -4.466 -29.218 1.00 0.00 C ATOM 318 CG ARG A 23 29.190 -4.393 -28.909 1.00 0.00 C ATOM 319 CD ARG A 23 29.989 -3.883 -30.099 1.00 0.00 C ATOM 320 NE ARG A 23 29.963 -4.815 -31.225 1.00 0.00 N ATOM 321 CZ ARG A 23 30.993 -5.594 -31.568 1.00 0.00 C ATOM 322 NH1 ARG A 23 32.127 -5.554 -30.872 1.00 0.00 N ATOM 323 NH2 ARG A 23 30.893 -6.413 -32.606 1.00 0.00 N ATOM 0 H ARG A 23 27.829 -3.664 -26.827 1.00 0.00 H new ATOM 0 HA ARG A 23 25.816 -5.062 -28.371 1.00 0.00 H new ATOM 0 HB2 ARG A 23 27.556 -5.073 -30.111 1.00 0.00 H new ATOM 0 HB3 ARG A 23 27.340 -3.465 -29.450 1.00 0.00 H new ATOM 0 HG2 ARG A 23 29.352 -3.737 -28.054 1.00 0.00 H new ATOM 0 HG3 ARG A 23 29.551 -5.381 -28.625 1.00 0.00 H new ATOM 0 HD2 ARG A 23 29.588 -2.921 -30.417 1.00 0.00 H new ATOM 0 HD3 ARG A 23 31.022 -3.713 -29.795 1.00 0.00 H new ATOM 0 HE ARG A 23 29.110 -4.874 -31.781 1.00 0.00 H new ATOM 0 HH11 ARG A 23 32.213 -4.927 -30.072 1.00 0.00 H new ATOM 0 HH12 ARG A 23 32.910 -6.151 -31.138 1.00 0.00 H new ATOM 0 HH21 ARG A 23 30.028 -6.450 -33.145 1.00 0.00 H new ATOM 0 HH22 ARG A 23 31.681 -7.006 -32.865 1.00 0.00 H new ATOM 337 N LYS A 24 27.807 -6.718 -26.589 1.00 0.00 N ATOM 338 CA LYS A 24 28.293 -8.040 -26.219 1.00 0.00 C ATOM 339 C LYS A 24 27.127 -8.989 -25.961 1.00 0.00 C ATOM 340 O LYS A 24 27.116 -10.124 -26.441 1.00 0.00 O ATOM 341 CB LYS A 24 29.194 -7.954 -24.986 1.00 0.00 C ATOM 342 CG LYS A 24 29.809 -9.288 -24.593 1.00 0.00 C ATOM 343 CD LYS A 24 30.802 -9.142 -23.452 1.00 0.00 C ATOM 344 CE LYS A 24 31.967 -8.239 -23.828 1.00 0.00 C ATOM 345 NZ LYS A 24 33.024 -8.240 -22.784 1.00 0.00 N ATOM 0 H LYS A 24 27.884 -6.016 -25.853 1.00 0.00 H new ATOM 0 HA LYS A 24 28.879 -8.434 -27.049 1.00 0.00 H new ATOM 0 HB2 LYS A 24 29.992 -7.237 -25.178 1.00 0.00 H new ATOM 0 HB3 LYS A 24 28.614 -7.569 -24.147 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.019 -9.979 -24.300 1.00 0.00 H new ATOM 0 HG3 LYS A 24 30.311 -9.725 -25.457 1.00 0.00 H new ATOM 0 HD2 LYS A 24 30.294 -8.735 -22.578 1.00 0.00 H new ATOM 0 HD3 LYS A 24 31.180 -10.125 -23.171 1.00 0.00 H new ATOM 0 HE2 LYS A 24 32.392 -8.569 -24.776 1.00 0.00 H new ATOM 0 HE3 LYS A 24 31.605 -7.222 -23.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 33.801 -7.613 -23.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 32.625 -7.901 -21.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 33.387 -9.206 -22.659 1.00 0.00 H new ATOM 359 N THR A 25 26.149 -8.522 -25.199 1.00 0.00 N ATOM 360 CA THR A 25 24.953 -9.314 -24.935 1.00 0.00 C ATOM 361 C THR A 25 23.763 -8.777 -25.720 1.00 0.00 C ATOM 362 O THR A 25 22.724 -9.430 -25.820 1.00 0.00 O ATOM 363 CB THR A 25 24.611 -9.347 -23.433 1.00 0.00 C ATOM 364 OG1 THR A 25 24.543 -8.017 -22.910 1.00 0.00 O ATOM 365 CG2 THR A 25 25.650 -10.139 -22.662 1.00 0.00 C ATOM 0 H THR A 25 26.158 -7.604 -24.754 1.00 0.00 H new ATOM 0 HA THR A 25 25.166 -10.332 -25.260 1.00 0.00 H new ATOM 0 HB THR A 25 23.641 -9.831 -23.319 1.00 0.00 H new ATOM 0 HG1 THR A 25 25.426 -7.596 -22.971 1.00 0.00 H new ATOM 0 HG21 THR A 25 25.388 -10.149 -21.604 1.00 0.00 H new ATOM 0 HG22 THR A 25 25.681 -11.162 -23.038 1.00 0.00 H new ATOM 0 HG23 THR A 25 26.629 -9.676 -22.789 1.00 0.00 H new ATOM 373 N GLY A 26 23.927 -7.582 -26.277 1.00 0.00 N ATOM 374 CA GLY A 26 22.878 -6.981 -27.074 1.00 0.00 C ATOM 375 C GLY A 26 21.685 -6.561 -26.243 1.00 0.00 C ATOM 376 O GLY A 26 20.545 -6.868 -26.590 1.00 0.00 O ATOM 0 H GLY A 26 24.772 -7.018 -26.189 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.277 -6.111 -27.597 1.00 0.00 H new ATOM 0 HA3 GLY A 26 22.554 -7.690 -27.836 1.00 0.00 H new ATOM 380 N ARG A 27 21.939 -5.875 -25.136 1.00 0.00 N ATOM 381 CA ARG A 27 20.858 -5.392 -24.286 1.00 0.00 C ATOM 382 C ARG A 27 21.243 -4.103 -23.573 1.00 0.00 C ATOM 383 O ARG A 27 22.425 -3.755 -23.476 1.00 0.00 O ATOM 384 CB ARG A 27 20.448 -6.465 -23.274 1.00 0.00 C ATOM 385 CG ARG A 27 21.583 -6.959 -22.396 1.00 0.00 C ATOM 386 CD ARG A 27 21.186 -8.225 -21.657 1.00 0.00 C ATOM 387 NE ARG A 27 20.710 -9.252 -22.584 1.00 0.00 N ATOM 388 CZ ARG A 27 20.692 -10.557 -22.328 1.00 0.00 C ATOM 389 NH1 ARG A 27 21.132 -11.028 -21.169 1.00 0.00 N ATOM 390 NH2 ARG A 27 20.229 -11.391 -23.248 1.00 0.00 N ATOM 0 H ARG A 27 22.876 -5.642 -24.807 1.00 0.00 H new ATOM 0 HA ARG A 27 20.004 -5.174 -24.928 1.00 0.00 H new ATOM 0 HB2 ARG A 27 19.659 -6.065 -22.637 1.00 0.00 H new ATOM 0 HB3 ARG A 27 20.024 -7.313 -23.812 1.00 0.00 H new ATOM 0 HG2 ARG A 27 22.464 -7.152 -23.008 1.00 0.00 H new ATOM 0 HG3 ARG A 27 21.856 -6.185 -21.679 1.00 0.00 H new ATOM 0 HD2 ARG A 27 22.040 -8.605 -21.097 1.00 0.00 H new ATOM 0 HD3 ARG A 27 20.405 -7.996 -20.932 1.00 0.00 H new ATOM 0 HE ARG A 27 20.367 -8.944 -23.494 1.00 0.00 H new ATOM 0 HH11 ARG A 27 21.490 -10.387 -20.461 1.00 0.00 H new ATOM 0 HH12 ARG A 27 21.112 -12.031 -20.986 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.892 -11.030 -24.140 1.00 0.00 H new ATOM 0 HH22 ARG A 27 20.210 -12.394 -23.064 1.00 0.00 H new ATOM 404 N TYR A 28 20.229 -3.403 -23.090 1.00 0.00 N ATOM 405 CA TYR A 28 20.404 -2.134 -22.405 1.00 0.00 C ATOM 406 C TYR A 28 20.677 -2.390 -20.925 1.00 0.00 C ATOM 407 O TYR A 28 19.775 -2.767 -20.179 1.00 0.00 O ATOM 408 CB TYR A 28 19.133 -1.292 -22.589 1.00 0.00 C ATOM 409 CG TYR A 28 19.355 0.204 -22.608 1.00 0.00 C ATOM 410 CD1 TYR A 28 20.540 0.745 -23.083 1.00 0.00 C ATOM 411 CD2 TYR A 28 18.371 1.076 -22.160 1.00 0.00 C ATOM 412 CE1 TYR A 28 20.742 2.111 -23.108 1.00 0.00 C ATOM 413 CE2 TYR A 28 18.565 2.445 -22.184 1.00 0.00 C ATOM 414 CZ TYR A 28 19.753 2.956 -22.660 1.00 0.00 C ATOM 415 OH TYR A 28 19.959 4.316 -22.678 1.00 0.00 O ATOM 0 H TYR A 28 19.256 -3.702 -23.163 1.00 0.00 H new ATOM 0 HA TYR A 28 21.252 -1.591 -22.822 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.653 -1.585 -23.523 1.00 0.00 H new ATOM 0 HB3 TYR A 28 18.437 -1.531 -21.785 1.00 0.00 H new ATOM 0 HD1 TYR A 28 21.318 0.087 -23.440 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.439 0.678 -21.787 1.00 0.00 H new ATOM 0 HE1 TYR A 28 21.673 2.514 -23.478 1.00 0.00 H new ATOM 0 HE2 TYR A 28 17.790 3.110 -21.832 1.00 0.00 H new ATOM 0 HH TYR A 28 20.869 4.505 -22.989 1.00 0.00 H new ATOM 425 N ILE A 29 21.923 -2.204 -20.509 1.00 0.00 N ATOM 426 CA ILE A 29 22.335 -2.552 -19.154 1.00 0.00 C ATOM 427 C ILE A 29 22.807 -1.328 -18.379 1.00 0.00 C ATOM 428 O ILE A 29 23.234 -0.338 -18.967 1.00 0.00 O ATOM 429 CB ILE A 29 23.437 -3.642 -19.161 1.00 0.00 C ATOM 430 CG1 ILE A 29 24.560 -3.310 -20.154 1.00 0.00 C ATOM 431 CG2 ILE A 29 22.833 -5.000 -19.484 1.00 0.00 C ATOM 432 CD1 ILE A 29 25.588 -2.334 -19.628 1.00 0.00 C ATOM 0 H ILE A 29 22.666 -1.814 -21.089 1.00 0.00 H new ATOM 0 HA ILE A 29 21.457 -2.955 -18.649 1.00 0.00 H new ATOM 0 HB ILE A 29 23.876 -3.673 -18.164 1.00 0.00 H new ATOM 0 HG12 ILE A 29 25.065 -4.234 -20.436 1.00 0.00 H new ATOM 0 HG13 ILE A 29 24.117 -2.899 -21.061 1.00 0.00 H new ATOM 0 HG21 ILE A 29 23.618 -5.756 -19.486 1.00 0.00 H new ATOM 0 HG22 ILE A 29 22.086 -5.254 -18.732 1.00 0.00 H new ATOM 0 HG23 ILE A 29 22.362 -4.964 -20.466 1.00 0.00 H new ATOM 0 HD11 ILE A 29 26.344 -2.155 -20.392 1.00 0.00 H new ATOM 0 HD12 ILE A 29 25.100 -1.393 -19.373 1.00 0.00 H new ATOM 0 HD13 ILE A 29 26.062 -2.749 -18.739 1.00 0.00 H new ATOM 444 N VAL A 30 22.726 -1.396 -17.059 1.00 0.00 N ATOM 445 CA VAL A 30 23.104 -0.269 -16.217 1.00 0.00 C ATOM 446 C VAL A 30 24.450 -0.503 -15.543 1.00 0.00 C ATOM 447 O VAL A 30 24.676 -1.543 -14.925 1.00 0.00 O ATOM 448 CB VAL A 30 22.047 0.005 -15.129 1.00 0.00 C ATOM 449 CG1 VAL A 30 22.442 1.221 -14.302 1.00 0.00 C ATOM 450 CG2 VAL A 30 20.673 0.196 -15.752 1.00 0.00 C ATOM 0 H VAL A 30 22.403 -2.217 -16.548 1.00 0.00 H new ATOM 0 HA VAL A 30 23.175 0.597 -16.876 1.00 0.00 H new ATOM 0 HB VAL A 30 21.999 -0.859 -14.466 1.00 0.00 H new ATOM 0 HG11 VAL A 30 21.686 1.402 -13.538 1.00 0.00 H new ATOM 0 HG12 VAL A 30 23.405 1.039 -13.824 1.00 0.00 H new ATOM 0 HG13 VAL A 30 22.518 2.093 -14.951 1.00 0.00 H new ATOM 0 HG21 VAL A 30 19.941 0.388 -14.967 1.00 0.00 H new ATOM 0 HG22 VAL A 30 20.699 1.042 -16.439 1.00 0.00 H new ATOM 0 HG23 VAL A 30 20.392 -0.705 -16.297 1.00 0.00 H new ATOM 460 N ARG A 31 25.337 0.471 -15.671 1.00 0.00 N ATOM 461 CA ARG A 31 26.634 0.435 -15.013 1.00 0.00 C ATOM 462 C ARG A 31 26.839 1.716 -14.211 1.00 0.00 C ATOM 463 O ARG A 31 26.061 2.662 -14.332 1.00 0.00 O ATOM 464 CB ARG A 31 27.763 0.261 -16.036 1.00 0.00 C ATOM 465 CG ARG A 31 27.717 -1.067 -16.774 1.00 0.00 C ATOM 466 CD ARG A 31 27.707 -2.240 -15.808 1.00 0.00 C ATOM 467 NE ARG A 31 27.642 -3.524 -16.502 1.00 0.00 N ATOM 468 CZ ARG A 31 26.580 -4.327 -16.486 1.00 0.00 C ATOM 469 NH1 ARG A 31 25.475 -3.962 -15.848 1.00 0.00 N ATOM 470 NH2 ARG A 31 26.626 -5.494 -17.116 1.00 0.00 N ATOM 0 H ARG A 31 25.179 1.307 -16.233 1.00 0.00 H new ATOM 0 HA ARG A 31 26.658 -0.420 -14.337 1.00 0.00 H new ATOM 0 HB2 ARG A 31 27.712 1.072 -16.762 1.00 0.00 H new ATOM 0 HB3 ARG A 31 28.722 0.350 -15.525 1.00 0.00 H new ATOM 0 HG2 ARG A 31 26.828 -1.104 -17.403 1.00 0.00 H new ATOM 0 HG3 ARG A 31 28.579 -1.147 -17.436 1.00 0.00 H new ATOM 0 HD2 ARG A 31 28.604 -2.208 -15.190 1.00 0.00 H new ATOM 0 HD3 ARG A 31 26.854 -2.148 -15.136 1.00 0.00 H new ATOM 0 HE ARG A 31 28.461 -3.824 -17.031 1.00 0.00 H new ATOM 0 HH11 ARG A 31 25.437 -3.063 -15.367 1.00 0.00 H new ATOM 0 HH12 ARG A 31 24.664 -4.580 -15.838 1.00 0.00 H new ATOM 0 HH21 ARG A 31 27.473 -5.774 -17.611 1.00 0.00 H new ATOM 0 HH22 ARG A 31 25.814 -6.111 -17.106 1.00 0.00 H new ATOM 484 N PHE A 32 27.872 1.746 -13.386 1.00 0.00 N ATOM 485 CA PHE A 32 28.157 2.919 -12.571 1.00 0.00 C ATOM 486 C PHE A 32 29.471 3.556 -12.997 1.00 0.00 C ATOM 487 O PHE A 32 29.906 4.559 -12.431 1.00 0.00 O ATOM 488 CB PHE A 32 28.194 2.547 -11.087 1.00 0.00 C ATOM 489 CG PHE A 32 26.871 2.059 -10.564 1.00 0.00 C ATOM 490 CD1 PHE A 32 25.887 2.959 -10.186 1.00 0.00 C ATOM 491 CD2 PHE A 32 26.609 0.701 -10.455 1.00 0.00 C ATOM 492 CE1 PHE A 32 24.667 2.515 -9.709 1.00 0.00 C ATOM 493 CE2 PHE A 32 25.392 0.252 -9.978 1.00 0.00 C ATOM 494 CZ PHE A 32 24.420 1.161 -9.606 1.00 0.00 C ATOM 0 H PHE A 32 28.527 0.974 -13.262 1.00 0.00 H new ATOM 0 HA PHE A 32 27.358 3.645 -12.721 1.00 0.00 H new ATOM 0 HB2 PHE A 32 28.946 1.773 -10.932 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.507 3.416 -10.509 1.00 0.00 H new ATOM 0 HD1 PHE A 32 26.075 4.020 -10.265 1.00 0.00 H new ATOM 0 HD2 PHE A 32 27.365 -0.014 -10.746 1.00 0.00 H new ATOM 0 HE1 PHE A 32 23.909 3.227 -9.418 1.00 0.00 H new ATOM 0 HE2 PHE A 32 25.201 -0.808 -9.896 1.00 0.00 H new ATOM 0 HZ PHE A 32 23.468 0.812 -9.235 1.00 0.00 H new ATOM 504 N SER A 33 30.096 2.964 -14.001 1.00 0.00 N ATOM 505 CA SER A 33 31.333 3.489 -14.549 1.00 0.00 C ATOM 506 C SER A 33 31.168 3.799 -16.032 1.00 0.00 C ATOM 507 O SER A 33 31.003 2.893 -16.848 1.00 0.00 O ATOM 508 CB SER A 33 32.467 2.484 -14.345 1.00 0.00 C ATOM 509 OG SER A 33 32.720 2.267 -12.966 1.00 0.00 O ATOM 0 H SER A 33 29.763 2.113 -14.455 1.00 0.00 H new ATOM 0 HA SER A 33 31.581 4.413 -14.026 1.00 0.00 H new ATOM 0 HB2 SER A 33 32.209 1.539 -14.823 1.00 0.00 H new ATOM 0 HB3 SER A 33 33.372 2.850 -14.830 1.00 0.00 H new ATOM 0 HG SER A 33 33.448 1.619 -12.865 1.00 0.00 H new ATOM 515 N GLU A 34 31.204 5.080 -16.374 1.00 0.00 N ATOM 516 CA GLU A 34 31.078 5.507 -17.765 1.00 0.00 C ATOM 517 C GLU A 34 32.322 5.113 -18.555 1.00 0.00 C ATOM 518 O GLU A 34 32.282 4.959 -19.774 1.00 0.00 O ATOM 519 CB GLU A 34 30.878 7.022 -17.842 1.00 0.00 C ATOM 520 CG GLU A 34 29.671 7.525 -17.067 1.00 0.00 C ATOM 521 CD GLU A 34 29.515 9.029 -17.155 1.00 0.00 C ATOM 522 OE1 GLU A 34 30.302 9.752 -16.508 1.00 0.00 O ATOM 523 OE2 GLU A 34 28.608 9.500 -17.871 1.00 0.00 O ATOM 0 H GLU A 34 31.319 5.844 -15.708 1.00 0.00 H new ATOM 0 HA GLU A 34 30.209 5.012 -18.198 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.772 7.516 -17.463 1.00 0.00 H new ATOM 0 HB3 GLU A 34 30.773 7.312 -18.887 1.00 0.00 H new ATOM 0 HG2 GLU A 34 28.770 7.046 -17.451 1.00 0.00 H new ATOM 0 HG3 GLU A 34 29.766 7.233 -16.021 1.00 0.00 H new ATOM 530 N ASP A 35 33.417 4.929 -17.833 1.00 0.00 N ATOM 531 CA ASP A 35 34.716 4.632 -18.430 1.00 0.00 C ATOM 532 C ASP A 35 34.850 3.156 -18.794 1.00 0.00 C ATOM 533 O ASP A 35 35.874 2.734 -19.334 1.00 0.00 O ATOM 534 CB ASP A 35 35.828 5.016 -17.452 1.00 0.00 C ATOM 535 CG ASP A 35 35.760 4.218 -16.160 1.00 0.00 C ATOM 536 OD1 ASP A 35 34.886 4.514 -15.316 1.00 0.00 O ATOM 537 OD2 ASP A 35 36.572 3.287 -15.983 1.00 0.00 O ATOM 0 H ASP A 35 33.433 4.981 -16.814 1.00 0.00 H new ATOM 0 HA ASP A 35 34.801 5.213 -19.348 1.00 0.00 H new ATOM 0 HB2 ASP A 35 36.797 4.855 -17.925 1.00 0.00 H new ATOM 0 HB3 ASP A 35 35.757 6.080 -17.224 1.00 0.00 H new ATOM 542 N SER A 36 33.814 2.375 -18.521 1.00 0.00 N ATOM 543 CA SER A 36 33.883 0.934 -18.716 1.00 0.00 C ATOM 544 C SER A 36 33.714 0.562 -20.186 1.00 0.00 C ATOM 545 O SER A 36 34.160 -0.503 -20.624 1.00 0.00 O ATOM 546 CB SER A 36 32.815 0.237 -17.874 1.00 0.00 C ATOM 547 OG SER A 36 31.519 0.700 -18.209 1.00 0.00 O ATOM 0 H SER A 36 32.920 2.713 -18.165 1.00 0.00 H new ATOM 0 HA SER A 36 34.870 0.600 -18.395 1.00 0.00 H new ATOM 0 HB2 SER A 36 32.871 -0.840 -18.029 1.00 0.00 H new ATOM 0 HB3 SER A 36 33.007 0.417 -16.816 1.00 0.00 H new ATOM 0 HG SER A 36 31.259 1.417 -17.594 1.00 0.00 H new ATOM 553 N PHE A 37 33.082 1.445 -20.948 1.00 0.00 N ATOM 554 CA PHE A 37 32.775 1.163 -22.342 1.00 0.00 C ATOM 555 C PHE A 37 33.671 1.963 -23.276 1.00 0.00 C ATOM 556 O PHE A 37 33.824 3.175 -23.121 1.00 0.00 O ATOM 557 CB PHE A 37 31.306 1.474 -22.634 1.00 0.00 C ATOM 558 CG PHE A 37 30.349 0.704 -21.770 1.00 0.00 C ATOM 559 CD1 PHE A 37 30.285 -0.678 -21.847 1.00 0.00 C ATOM 560 CD2 PHE A 37 29.512 1.362 -20.884 1.00 0.00 C ATOM 561 CE1 PHE A 37 29.406 -1.389 -21.055 1.00 0.00 C ATOM 562 CE2 PHE A 37 28.631 0.655 -20.089 1.00 0.00 C ATOM 563 CZ PHE A 37 28.578 -0.722 -20.175 1.00 0.00 C ATOM 0 H PHE A 37 32.773 2.361 -20.624 1.00 0.00 H new ATOM 0 HA PHE A 37 32.959 0.103 -22.518 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.133 2.541 -22.493 1.00 0.00 H new ATOM 0 HB3 PHE A 37 31.097 1.253 -23.681 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.930 -1.205 -22.534 1.00 0.00 H new ATOM 0 HD2 PHE A 37 29.549 2.439 -20.814 1.00 0.00 H new ATOM 0 HE1 PHE A 37 29.366 -2.466 -21.124 1.00 0.00 H new ATOM 0 HE2 PHE A 37 27.984 1.179 -19.401 1.00 0.00 H new ATOM 0 HZ PHE A 37 27.890 -1.276 -19.554 1.00 0.00 H new ATOM 573 N GLY A 38 34.265 1.272 -24.239 1.00 0.00 N ATOM 574 CA GLY A 38 35.096 1.930 -25.224 1.00 0.00 C ATOM 575 C GLY A 38 34.351 2.183 -26.518 1.00 0.00 C ATOM 576 O GLY A 38 33.428 2.994 -26.562 1.00 0.00 O ATOM 0 H GLY A 38 34.185 0.262 -24.355 1.00 0.00 H new ATOM 0 HA2 GLY A 38 35.455 2.877 -24.821 1.00 0.00 H new ATOM 0 HA3 GLY A 38 35.974 1.316 -25.425 1.00 0.00 H new ATOM 580 N MET A 39 34.719 1.456 -27.562 1.00 0.00 N ATOM 581 CA MET A 39 34.133 1.662 -28.882 1.00 0.00 C ATOM 582 C MET A 39 32.980 0.693 -29.119 1.00 0.00 C ATOM 583 O MET A 39 32.312 0.744 -30.151 1.00 0.00 O ATOM 584 CB MET A 39 35.195 1.480 -29.972 1.00 0.00 C ATOM 585 CG MET A 39 35.707 0.053 -30.095 1.00 0.00 C ATOM 586 SD MET A 39 36.947 -0.135 -31.389 1.00 0.00 S ATOM 587 CE MET A 39 37.234 -1.901 -31.318 1.00 0.00 C ATOM 0 H MET A 39 35.421 0.717 -27.523 1.00 0.00 H new ATOM 0 HA MET A 39 33.748 2.681 -28.925 1.00 0.00 H new ATOM 0 HB2 MET A 39 34.777 1.790 -30.930 1.00 0.00 H new ATOM 0 HB3 MET A 39 36.036 2.141 -29.762 1.00 0.00 H new ATOM 0 HG2 MET A 39 36.133 -0.259 -29.141 1.00 0.00 H new ATOM 0 HG3 MET A 39 34.869 -0.612 -30.302 1.00 0.00 H new ATOM 0 HE1 MET A 39 37.981 -2.178 -32.062 1.00 0.00 H new ATOM 0 HE2 MET A 39 37.593 -2.172 -30.325 1.00 0.00 H new ATOM 0 HE3 MET A 39 36.303 -2.429 -31.524 1.00 0.00 H new ATOM 597 N ASP A 40 32.753 -0.195 -28.160 1.00 0.00 N ATOM 598 CA ASP A 40 31.705 -1.204 -28.282 1.00 0.00 C ATOM 599 C ASP A 40 30.333 -0.629 -27.955 1.00 0.00 C ATOM 600 O ASP A 40 29.307 -1.251 -28.229 1.00 0.00 O ATOM 601 CB ASP A 40 31.989 -2.397 -27.367 1.00 0.00 C ATOM 602 CG ASP A 40 33.113 -3.274 -27.877 1.00 0.00 C ATOM 603 OD1 ASP A 40 32.856 -4.128 -28.748 1.00 0.00 O ATOM 604 OD2 ASP A 40 34.253 -3.128 -27.392 1.00 0.00 O ATOM 0 H ASP A 40 33.280 -0.238 -27.288 1.00 0.00 H new ATOM 0 HA ASP A 40 31.702 -1.538 -29.319 1.00 0.00 H new ATOM 0 HB2 ASP A 40 32.242 -2.033 -26.371 1.00 0.00 H new ATOM 0 HB3 ASP A 40 31.084 -2.996 -27.267 1.00 0.00 H new ATOM 609 N VAL A 41 30.314 0.553 -27.362 1.00 0.00 N ATOM 610 CA VAL A 41 29.064 1.193 -26.978 1.00 0.00 C ATOM 611 C VAL A 41 29.078 2.659 -27.382 1.00 0.00 C ATOM 612 O VAL A 41 30.052 3.367 -27.128 1.00 0.00 O ATOM 613 CB VAL A 41 28.813 1.084 -25.453 1.00 0.00 C ATOM 614 CG1 VAL A 41 27.524 1.792 -25.056 1.00 0.00 C ATOM 615 CG2 VAL A 41 28.775 -0.372 -25.013 1.00 0.00 C ATOM 0 H VAL A 41 31.151 1.091 -27.135 1.00 0.00 H new ATOM 0 HA VAL A 41 28.258 0.675 -27.497 1.00 0.00 H new ATOM 0 HB VAL A 41 29.642 1.577 -24.945 1.00 0.00 H new ATOM 0 HG11 VAL A 41 27.374 1.699 -23.980 1.00 0.00 H new ATOM 0 HG12 VAL A 41 27.591 2.847 -25.323 1.00 0.00 H new ATOM 0 HG13 VAL A 41 26.683 1.338 -25.580 1.00 0.00 H new ATOM 0 HG21 VAL A 41 28.598 -0.423 -23.939 1.00 0.00 H new ATOM 0 HG22 VAL A 41 27.973 -0.890 -25.538 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.728 -0.848 -25.246 1.00 0.00 H new ATOM 625 N ALA A 42 28.007 3.104 -28.027 1.00 0.00 N ATOM 626 CA ALA A 42 27.865 4.506 -28.384 1.00 0.00 C ATOM 627 C ALA A 42 27.626 5.331 -27.128 1.00 0.00 C ATOM 628 O ALA A 42 26.716 5.036 -26.349 1.00 0.00 O ATOM 629 CB ALA A 42 26.723 4.693 -29.373 1.00 0.00 C ATOM 0 H ALA A 42 27.226 2.513 -28.312 1.00 0.00 H new ATOM 0 HA ALA A 42 28.784 4.846 -28.862 1.00 0.00 H new ATOM 0 HB1 ALA A 42 26.632 5.749 -29.628 1.00 0.00 H new ATOM 0 HB2 ALA A 42 26.926 4.117 -30.276 1.00 0.00 H new ATOM 0 HB3 ALA A 42 25.792 4.347 -28.924 1.00 0.00 H new ATOM 635 N ASP A 43 28.436 6.362 -26.932 1.00 0.00 N ATOM 636 CA ASP A 43 28.371 7.164 -25.712 1.00 0.00 C ATOM 637 C ASP A 43 27.049 7.920 -25.622 1.00 0.00 C ATOM 638 O ASP A 43 26.590 8.267 -24.534 1.00 0.00 O ATOM 639 CB ASP A 43 29.547 8.139 -25.656 1.00 0.00 C ATOM 640 CG ASP A 43 29.707 8.776 -24.290 1.00 0.00 C ATOM 641 OD1 ASP A 43 29.653 8.043 -23.278 1.00 0.00 O ATOM 642 OD2 ASP A 43 29.918 10.004 -24.224 1.00 0.00 O ATOM 0 H ASP A 43 29.146 6.665 -27.599 1.00 0.00 H new ATOM 0 HA ASP A 43 28.432 6.489 -24.858 1.00 0.00 H new ATOM 0 HB2 ASP A 43 30.465 7.612 -25.918 1.00 0.00 H new ATOM 0 HB3 ASP A 43 29.404 8.920 -26.403 1.00 0.00 H new ATOM 647 N ASP A 44 26.426 8.143 -26.773 1.00 0.00 N ATOM 648 CA ASP A 44 25.120 8.798 -26.832 1.00 0.00 C ATOM 649 C ASP A 44 24.036 7.904 -26.240 1.00 0.00 C ATOM 650 O ASP A 44 22.987 8.384 -25.813 1.00 0.00 O ATOM 651 CB ASP A 44 24.747 9.149 -28.277 1.00 0.00 C ATOM 652 CG ASP A 44 25.590 10.265 -28.857 1.00 0.00 C ATOM 653 OD1 ASP A 44 25.214 11.444 -28.697 1.00 0.00 O ATOM 654 OD2 ASP A 44 26.618 9.967 -29.501 1.00 0.00 O ATOM 0 H ASP A 44 26.804 7.880 -27.683 1.00 0.00 H new ATOM 0 HA ASP A 44 25.190 9.715 -26.247 1.00 0.00 H new ATOM 0 HB2 ASP A 44 24.855 8.260 -28.899 1.00 0.00 H new ATOM 0 HB3 ASP A 44 23.697 9.439 -28.314 1.00 0.00 H new ATOM 659 N SER A 45 24.295 6.603 -26.213 1.00 0.00 N ATOM 660 CA SER A 45 23.331 5.645 -25.693 1.00 0.00 C ATOM 661 C SER A 45 23.528 5.426 -24.196 1.00 0.00 C ATOM 662 O SER A 45 22.765 4.697 -23.564 1.00 0.00 O ATOM 663 CB SER A 45 23.450 4.317 -26.441 1.00 0.00 C ATOM 664 OG SER A 45 23.187 4.487 -27.827 1.00 0.00 O ATOM 0 H SER A 45 25.165 6.188 -26.546 1.00 0.00 H new ATOM 0 HA SER A 45 22.332 6.052 -25.848 1.00 0.00 H new ATOM 0 HB2 SER A 45 24.451 3.907 -26.305 1.00 0.00 H new ATOM 0 HB3 SER A 45 22.750 3.595 -26.020 1.00 0.00 H new ATOM 0 HG SER A 45 23.271 3.624 -28.284 1.00 0.00 H new ATOM 670 N ILE A 46 24.558 6.051 -23.637 1.00 0.00 N ATOM 671 CA ILE A 46 24.800 5.987 -22.204 1.00 0.00 C ATOM 672 C ILE A 46 24.164 7.195 -21.530 1.00 0.00 C ATOM 673 O ILE A 46 24.531 8.337 -21.807 1.00 0.00 O ATOM 674 CB ILE A 46 26.308 5.946 -21.871 1.00 0.00 C ATOM 675 CG1 ILE A 46 26.967 4.738 -22.543 1.00 0.00 C ATOM 676 CG2 ILE A 46 26.520 5.901 -20.360 1.00 0.00 C ATOM 677 CD1 ILE A 46 28.459 4.639 -22.293 1.00 0.00 C ATOM 0 H ILE A 46 25.238 6.607 -24.156 1.00 0.00 H new ATOM 0 HA ILE A 46 24.354 5.065 -21.832 1.00 0.00 H new ATOM 0 HB ILE A 46 26.774 6.853 -22.255 1.00 0.00 H new ATOM 0 HG12 ILE A 46 26.487 3.828 -22.185 1.00 0.00 H new ATOM 0 HG13 ILE A 46 26.790 4.790 -23.617 1.00 0.00 H new ATOM 0 HG21 ILE A 46 27.588 5.872 -20.143 1.00 0.00 H new ATOM 0 HG22 ILE A 46 26.081 6.788 -19.904 1.00 0.00 H new ATOM 0 HG23 ILE A 46 26.043 5.010 -19.952 1.00 0.00 H new ATOM 0 HD11 ILE A 46 28.855 3.759 -22.800 1.00 0.00 H new ATOM 0 HD12 ILE A 46 28.952 5.532 -22.677 1.00 0.00 H new ATOM 0 HD13 ILE A 46 28.644 4.554 -21.222 1.00 0.00 H new ATOM 689 N THR A 47 23.191 6.943 -20.675 1.00 0.00 N ATOM 690 CA THR A 47 22.450 8.012 -20.033 1.00 0.00 C ATOM 691 C THR A 47 22.140 7.662 -18.581 1.00 0.00 C ATOM 692 O THR A 47 21.750 6.533 -18.277 1.00 0.00 O ATOM 693 CB THR A 47 21.133 8.281 -20.793 1.00 0.00 C ATOM 694 OG1 THR A 47 21.415 8.486 -22.182 1.00 0.00 O ATOM 695 CG2 THR A 47 20.405 9.498 -20.238 1.00 0.00 C ATOM 0 H THR A 47 22.895 6.004 -20.408 1.00 0.00 H new ATOM 0 HA THR A 47 23.068 8.910 -20.052 1.00 0.00 H new ATOM 0 HB THR A 47 20.487 7.413 -20.665 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.579 8.655 -22.664 1.00 0.00 H new ATOM 0 HG21 THR A 47 19.483 9.657 -20.797 1.00 0.00 H new ATOM 0 HG22 THR A 47 20.168 9.332 -19.187 1.00 0.00 H new ATOM 0 HG23 THR A 47 21.042 10.377 -20.332 1.00 0.00 H new ATOM 703 N PRO A 48 22.348 8.612 -17.661 1.00 0.00 N ATOM 704 CA PRO A 48 21.943 8.454 -16.266 1.00 0.00 C ATOM 705 C PRO A 48 20.440 8.220 -16.154 1.00 0.00 C ATOM 706 O PRO A 48 19.640 9.025 -16.640 1.00 0.00 O ATOM 707 CB PRO A 48 22.323 9.789 -15.615 1.00 0.00 C ATOM 708 CG PRO A 48 23.334 10.398 -16.525 1.00 0.00 C ATOM 709 CD PRO A 48 23.007 9.905 -17.906 1.00 0.00 C ATOM 0 HA PRO A 48 22.421 7.597 -15.792 1.00 0.00 H new ATOM 0 HB2 PRO A 48 21.452 10.435 -15.506 1.00 0.00 H new ATOM 0 HB3 PRO A 48 22.734 9.637 -14.617 1.00 0.00 H new ATOM 0 HG2 PRO A 48 23.292 11.486 -16.480 1.00 0.00 H new ATOM 0 HG3 PRO A 48 24.344 10.106 -16.236 1.00 0.00 H new ATOM 0 HD2 PRO A 48 22.351 10.597 -18.434 1.00 0.00 H new ATOM 0 HD3 PRO A 48 23.904 9.790 -18.514 1.00 0.00 H new ATOM 717 N THR A 49 20.059 7.117 -15.519 1.00 0.00 N ATOM 718 CA THR A 49 18.651 6.755 -15.380 1.00 0.00 C ATOM 719 C THR A 49 17.869 7.826 -14.614 1.00 0.00 C ATOM 720 O THR A 49 16.642 7.881 -14.693 1.00 0.00 O ATOM 721 CB THR A 49 18.485 5.387 -14.680 1.00 0.00 C ATOM 722 OG1 THR A 49 17.105 5.004 -14.666 1.00 0.00 O ATOM 723 CG2 THR A 49 19.015 5.428 -13.254 1.00 0.00 C ATOM 0 H THR A 49 20.707 6.456 -15.091 1.00 0.00 H new ATOM 0 HA THR A 49 18.244 6.682 -16.389 1.00 0.00 H new ATOM 0 HB THR A 49 19.063 4.653 -15.242 1.00 0.00 H new ATOM 0 HG1 THR A 49 16.544 5.797 -14.797 1.00 0.00 H new ATOM 0 HG21 THR A 49 18.884 4.451 -12.789 1.00 0.00 H new ATOM 0 HG22 THR A 49 20.074 5.685 -13.267 1.00 0.00 H new ATOM 0 HG23 THR A 49 18.467 6.178 -12.684 1.00 0.00 H new ATOM 731 N SER A 50 18.591 8.678 -13.893 1.00 0.00 N ATOM 732 CA SER A 50 17.993 9.779 -13.152 1.00 0.00 C ATOM 733 C SER A 50 17.230 10.718 -14.087 1.00 0.00 C ATOM 734 O SER A 50 16.142 11.189 -13.760 1.00 0.00 O ATOM 735 CB SER A 50 19.096 10.554 -12.430 1.00 0.00 C ATOM 736 OG SER A 50 20.036 9.664 -11.848 1.00 0.00 O ATOM 0 H SER A 50 19.606 8.623 -13.807 1.00 0.00 H new ATOM 0 HA SER A 50 17.287 9.372 -12.428 1.00 0.00 H new ATOM 0 HB2 SER A 50 19.602 11.216 -13.133 1.00 0.00 H new ATOM 0 HB3 SER A 50 18.658 11.185 -11.657 1.00 0.00 H new ATOM 0 HG SER A 50 19.726 9.398 -10.957 1.00 0.00 H new ATOM 742 N GLU A 51 17.805 10.973 -15.257 1.00 0.00 N ATOM 743 CA GLU A 51 17.212 11.898 -16.213 1.00 0.00 C ATOM 744 C GLU A 51 16.618 11.135 -17.396 1.00 0.00 C ATOM 745 O GLU A 51 15.939 11.708 -18.248 1.00 0.00 O ATOM 746 CB GLU A 51 18.272 12.884 -16.704 1.00 0.00 C ATOM 747 CG GLU A 51 17.701 14.126 -17.363 1.00 0.00 C ATOM 748 CD GLU A 51 18.780 15.035 -17.904 1.00 0.00 C ATOM 749 OE1 GLU A 51 19.383 15.786 -17.111 1.00 0.00 O ATOM 750 OE2 GLU A 51 19.038 14.992 -19.127 1.00 0.00 O ATOM 0 H GLU A 51 18.681 10.552 -15.565 1.00 0.00 H new ATOM 0 HA GLU A 51 16.411 12.449 -15.719 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.892 13.185 -15.860 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.925 12.376 -17.414 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.037 13.831 -18.175 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.097 14.673 -16.640 1.00 0.00 H new ATOM 757 N PHE A 52 16.877 9.834 -17.436 1.00 0.00 N ATOM 758 CA PHE A 52 16.405 8.984 -18.524 1.00 0.00 C ATOM 759 C PHE A 52 14.880 8.892 -18.519 1.00 0.00 C ATOM 760 O PHE A 52 14.248 8.772 -19.568 1.00 0.00 O ATOM 761 CB PHE A 52 17.023 7.588 -18.395 1.00 0.00 C ATOM 762 CG PHE A 52 16.675 6.652 -19.517 1.00 0.00 C ATOM 763 CD1 PHE A 52 17.327 6.742 -20.736 1.00 0.00 C ATOM 764 CD2 PHE A 52 15.698 5.681 -19.353 1.00 0.00 C ATOM 765 CE1 PHE A 52 17.012 5.883 -21.770 1.00 0.00 C ATOM 766 CE2 PHE A 52 15.381 4.819 -20.383 1.00 0.00 C ATOM 767 CZ PHE A 52 16.038 4.920 -21.593 1.00 0.00 C ATOM 0 H PHE A 52 17.415 9.341 -16.723 1.00 0.00 H new ATOM 0 HA PHE A 52 16.714 9.426 -19.471 1.00 0.00 H new ATOM 0 HB2 PHE A 52 18.107 7.687 -18.343 1.00 0.00 H new ATOM 0 HB3 PHE A 52 16.698 7.145 -17.454 1.00 0.00 H new ATOM 0 HD1 PHE A 52 18.090 7.493 -20.879 1.00 0.00 H new ATOM 0 HD2 PHE A 52 15.180 5.599 -18.409 1.00 0.00 H new ATOM 0 HE1 PHE A 52 17.527 5.964 -22.716 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.620 4.066 -20.243 1.00 0.00 H new ATOM 0 HZ PHE A 52 15.791 4.247 -22.400 1.00 0.00 H new ATOM 777 N VAL A 53 14.298 8.972 -17.329 1.00 0.00 N ATOM 778 CA VAL A 53 12.854 8.855 -17.170 1.00 0.00 C ATOM 779 C VAL A 53 12.133 10.139 -17.581 1.00 0.00 C ATOM 780 O VAL A 53 10.909 10.156 -17.723 1.00 0.00 O ATOM 781 CB VAL A 53 12.475 8.497 -15.715 1.00 0.00 C ATOM 782 CG1 VAL A 53 13.001 7.118 -15.348 1.00 0.00 C ATOM 783 CG2 VAL A 53 13.007 9.542 -14.744 1.00 0.00 C ATOM 0 H VAL A 53 14.806 9.118 -16.457 1.00 0.00 H new ATOM 0 HA VAL A 53 12.533 8.049 -17.830 1.00 0.00 H new ATOM 0 HB VAL A 53 11.387 8.484 -15.643 1.00 0.00 H new ATOM 0 HG11 VAL A 53 12.724 6.885 -14.320 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.570 6.374 -16.018 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.087 7.106 -15.443 1.00 0.00 H new ATOM 0 HG21 VAL A 53 12.728 9.269 -13.726 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.093 9.591 -14.822 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.581 10.515 -14.988 1.00 0.00 H new ATOM 793 N TRP A 54 12.894 11.205 -17.782 1.00 0.00 N ATOM 794 CA TRP A 54 12.320 12.485 -18.164 1.00 0.00 C ATOM 795 C TRP A 54 12.371 12.667 -19.674 1.00 0.00 C ATOM 796 O TRP A 54 13.438 12.587 -20.283 1.00 0.00 O ATOM 797 CB TRP A 54 13.059 13.634 -17.476 1.00 0.00 C ATOM 798 CG TRP A 54 12.880 13.659 -15.989 1.00 0.00 C ATOM 799 CD1 TRP A 54 13.739 13.168 -15.049 1.00 0.00 C ATOM 800 CD2 TRP A 54 11.768 14.205 -15.271 1.00 0.00 C ATOM 801 NE1 TRP A 54 13.231 13.379 -13.791 1.00 0.00 N ATOM 802 CE2 TRP A 54 12.021 14.012 -13.900 1.00 0.00 C ATOM 803 CE3 TRP A 54 10.583 14.838 -15.655 1.00 0.00 C ATOM 804 CZ2 TRP A 54 11.133 14.432 -12.915 1.00 0.00 C ATOM 805 CZ3 TRP A 54 9.703 15.253 -14.675 1.00 0.00 C ATOM 806 CH2 TRP A 54 9.982 15.049 -13.319 1.00 0.00 C ATOM 0 H TRP A 54 13.910 11.208 -17.687 1.00 0.00 H new ATOM 0 HA TRP A 54 11.278 12.496 -17.844 1.00 0.00 H new ATOM 0 HB2 TRP A 54 14.122 13.559 -17.704 1.00 0.00 H new ATOM 0 HB3 TRP A 54 12.710 14.579 -17.891 1.00 0.00 H new ATOM 0 HD1 TRP A 54 14.681 12.684 -15.263 1.00 0.00 H new ATOM 0 HE1 TRP A 54 13.682 13.108 -12.917 1.00 0.00 H new ATOM 0 HE3 TRP A 54 10.359 15.000 -16.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.346 14.276 -11.868 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 8.784 15.743 -14.960 1.00 0.00 H new ATOM 0 HH2 TRP A 54 9.274 15.386 -12.577 1.00 0.00 H new ATOM 817 N SER A 55 11.216 12.892 -20.275 1.00 0.00 N ATOM 818 CA SER A 55 11.132 13.122 -21.702 1.00 0.00 C ATOM 819 C SER A 55 10.740 14.570 -21.978 1.00 0.00 C ATOM 820 O SER A 55 9.601 14.977 -21.730 1.00 0.00 O ATOM 821 CB SER A 55 10.117 12.162 -22.323 1.00 0.00 C ATOM 822 OG SER A 55 10.457 10.815 -22.033 1.00 0.00 O ATOM 0 H SER A 55 10.319 12.920 -19.791 1.00 0.00 H new ATOM 0 HA SER A 55 12.107 12.938 -22.152 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.120 12.381 -21.940 1.00 0.00 H new ATOM 0 HB3 SER A 55 10.083 12.309 -23.402 1.00 0.00 H new ATOM 0 HG SER A 55 9.795 10.216 -22.437 1.00 0.00 H new ATOM 828 N SER A 56 11.693 15.354 -22.457 1.00 0.00 N ATOM 829 CA SER A 56 11.452 16.753 -22.761 1.00 0.00 C ATOM 830 C SER A 56 10.611 16.899 -24.026 1.00 0.00 C ATOM 831 O SER A 56 11.010 16.474 -25.111 1.00 0.00 O ATOM 832 CB SER A 56 12.785 17.491 -22.899 1.00 0.00 C ATOM 833 OG SER A 56 13.804 16.620 -23.371 1.00 0.00 O ATOM 0 H SER A 56 12.646 15.041 -22.644 1.00 0.00 H new ATOM 0 HA SER A 56 10.890 17.199 -21.940 1.00 0.00 H new ATOM 0 HB2 SER A 56 12.671 18.329 -23.587 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.076 17.907 -21.934 1.00 0.00 H new ATOM 0 HG SER A 56 14.646 17.115 -23.453 1.00 0.00 H new ATOM 839 N VAL A 57 9.430 17.480 -23.872 1.00 0.00 N ATOM 840 CA VAL A 57 8.540 17.706 -25.001 1.00 0.00 C ATOM 841 C VAL A 57 8.647 19.152 -25.474 1.00 0.00 C ATOM 842 O VAL A 57 8.329 19.480 -26.618 1.00 0.00 O ATOM 843 CB VAL A 57 7.079 17.357 -24.648 1.00 0.00 C ATOM 844 CG1 VAL A 57 6.947 15.864 -24.388 1.00 0.00 C ATOM 845 CG2 VAL A 57 6.605 18.148 -23.436 1.00 0.00 C ATOM 0 H VAL A 57 9.066 17.804 -22.976 1.00 0.00 H new ATOM 0 HA VAL A 57 8.849 17.045 -25.811 1.00 0.00 H new ATOM 0 HB VAL A 57 6.449 17.628 -25.495 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.912 15.628 -24.140 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.241 15.312 -25.281 1.00 0.00 H new ATOM 0 HG13 VAL A 57 7.593 15.581 -23.557 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.572 17.883 -23.209 1.00 0.00 H new ATOM 0 HG22 VAL A 57 7.236 17.914 -22.579 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.666 19.215 -23.651 1.00 0.00 H new ATOM 855 N ARG A 58 9.092 20.014 -24.570 1.00 0.00 N ATOM 856 CA ARG A 58 9.463 21.382 -24.909 1.00 0.00 C ATOM 857 C ARG A 58 10.909 21.588 -24.486 1.00 0.00 C ATOM 858 O ARG A 58 11.591 20.621 -24.153 1.00 0.00 O ATOM 859 CB ARG A 58 8.566 22.422 -24.216 1.00 0.00 C ATOM 860 CG ARG A 58 7.187 22.617 -24.840 1.00 0.00 C ATOM 861 CD ARG A 58 6.322 21.378 -24.714 1.00 0.00 C ATOM 862 NE ARG A 58 4.938 21.618 -25.112 1.00 0.00 N ATOM 863 CZ ARG A 58 4.351 21.034 -26.157 1.00 0.00 C ATOM 864 NH1 ARG A 58 5.058 20.286 -26.997 1.00 0.00 N ATOM 865 NH2 ARG A 58 3.058 21.220 -26.380 1.00 0.00 N ATOM 0 H ARG A 58 9.206 19.786 -23.582 1.00 0.00 H new ATOM 0 HA ARG A 58 9.337 21.524 -25.982 1.00 0.00 H new ATOM 0 HB2 ARG A 58 8.436 22.128 -23.174 1.00 0.00 H new ATOM 0 HB3 ARG A 58 9.084 23.381 -24.215 1.00 0.00 H new ATOM 0 HG2 ARG A 58 6.687 23.458 -24.358 1.00 0.00 H new ATOM 0 HG3 ARG A 58 7.300 22.874 -25.893 1.00 0.00 H new ATOM 0 HD2 ARG A 58 6.741 20.582 -25.330 1.00 0.00 H new ATOM 0 HD3 ARG A 58 6.344 21.027 -23.682 1.00 0.00 H new ATOM 0 HE ARG A 58 4.387 22.272 -24.557 1.00 0.00 H new ATOM 0 HH11 ARG A 58 6.058 20.155 -26.845 1.00 0.00 H new ATOM 0 HH12 ARG A 58 4.601 19.843 -27.794 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.512 21.810 -25.752 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.609 20.773 -27.179 1.00 0.00 H new ATOM 879 N ASP A 59 11.372 22.830 -24.484 1.00 0.00 N ATOM 880 CA ASP A 59 12.743 23.123 -24.069 1.00 0.00 C ATOM 881 C ASP A 59 12.961 22.759 -22.607 1.00 0.00 C ATOM 882 O ASP A 59 13.757 21.878 -22.291 1.00 0.00 O ATOM 883 CB ASP A 59 13.080 24.600 -24.287 1.00 0.00 C ATOM 884 CG ASP A 59 13.352 24.932 -25.737 1.00 0.00 C ATOM 885 OD1 ASP A 59 12.381 25.115 -26.503 1.00 0.00 O ATOM 886 OD2 ASP A 59 14.535 25.031 -26.117 1.00 0.00 O ATOM 0 H ASP A 59 10.827 23.646 -24.762 1.00 0.00 H new ATOM 0 HA ASP A 59 13.406 22.516 -24.686 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.254 25.213 -23.928 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.954 24.861 -23.689 1.00 0.00 H new ATOM 891 N ASP A 60 12.236 23.425 -21.718 1.00 0.00 N ATOM 892 CA ASP A 60 12.423 23.223 -20.285 1.00 0.00 C ATOM 893 C ASP A 60 11.276 22.427 -19.679 1.00 0.00 C ATOM 894 O ASP A 60 11.194 22.281 -18.462 1.00 0.00 O ATOM 895 CB ASP A 60 12.542 24.568 -19.565 1.00 0.00 C ATOM 896 CG ASP A 60 13.686 25.412 -20.087 1.00 0.00 C ATOM 897 OD1 ASP A 60 14.843 25.164 -19.693 1.00 0.00 O ATOM 898 OD2 ASP A 60 13.427 26.334 -20.895 1.00 0.00 O ATOM 0 H ASP A 60 11.517 24.106 -21.961 1.00 0.00 H new ATOM 0 HA ASP A 60 13.345 22.656 -20.155 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.608 25.119 -19.678 1.00 0.00 H new ATOM 0 HB3 ASP A 60 12.682 24.393 -18.498 1.00 0.00 H new ATOM 903 N VAL A 61 10.390 21.914 -20.524 1.00 0.00 N ATOM 904 CA VAL A 61 9.238 21.159 -20.041 1.00 0.00 C ATOM 905 C VAL A 61 9.435 19.668 -20.287 1.00 0.00 C ATOM 906 O VAL A 61 9.389 19.205 -21.432 1.00 0.00 O ATOM 907 CB VAL A 61 7.923 21.604 -20.717 1.00 0.00 C ATOM 908 CG1 VAL A 61 6.724 20.964 -20.034 1.00 0.00 C ATOM 909 CG2 VAL A 61 7.797 23.121 -20.719 1.00 0.00 C ATOM 0 H VAL A 61 10.445 22.005 -21.538 1.00 0.00 H new ATOM 0 HA VAL A 61 9.161 21.358 -18.972 1.00 0.00 H new ATOM 0 HB VAL A 61 7.946 21.267 -21.753 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.808 21.291 -20.526 1.00 0.00 H new ATOM 0 HG12 VAL A 61 6.804 19.879 -20.100 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.700 21.263 -18.986 1.00 0.00 H new ATOM 0 HG21 VAL A 61 6.862 23.408 -21.201 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.804 23.488 -19.693 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.635 23.555 -21.265 1.00 0.00 H new ATOM 919 N MET A 62 9.660 18.925 -19.214 1.00 0.00 N ATOM 920 CA MET A 62 9.859 17.486 -19.306 1.00 0.00 C ATOM 921 C MET A 62 8.663 16.734 -18.732 1.00 0.00 C ATOM 922 O MET A 62 8.068 17.155 -17.737 1.00 0.00 O ATOM 923 CB MET A 62 11.130 17.068 -18.565 1.00 0.00 C ATOM 924 CG MET A 62 12.404 17.650 -19.154 1.00 0.00 C ATOM 925 SD MET A 62 13.882 17.140 -18.255 1.00 0.00 S ATOM 926 CE MET A 62 13.542 17.815 -16.631 1.00 0.00 C ATOM 0 H MET A 62 9.710 19.297 -18.265 1.00 0.00 H new ATOM 0 HA MET A 62 9.962 17.232 -20.361 1.00 0.00 H new ATOM 0 HB2 MET A 62 11.049 17.376 -17.523 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.202 15.980 -18.571 1.00 0.00 H new ATOM 0 HG2 MET A 62 12.492 17.341 -20.195 1.00 0.00 H new ATOM 0 HG3 MET A 62 12.338 18.738 -19.149 1.00 0.00 H new ATOM 0 HE1 MET A 62 14.458 18.232 -16.211 1.00 0.00 H new ATOM 0 HE2 MET A 62 12.790 18.600 -16.713 1.00 0.00 H new ATOM 0 HE3 MET A 62 13.171 17.024 -15.979 1.00 0.00 H new ATOM 936 N ARG A 63 8.312 15.631 -19.378 1.00 0.00 N ATOM 937 CA ARG A 63 7.248 14.756 -18.904 1.00 0.00 C ATOM 938 C ARG A 63 7.846 13.440 -18.429 1.00 0.00 C ATOM 939 O ARG A 63 8.732 12.889 -19.082 1.00 0.00 O ATOM 940 CB ARG A 63 6.233 14.490 -20.020 1.00 0.00 C ATOM 941 CG ARG A 63 5.431 15.713 -20.430 1.00 0.00 C ATOM 942 CD ARG A 63 4.635 15.460 -21.702 1.00 0.00 C ATOM 943 NE ARG A 63 3.688 14.353 -21.568 1.00 0.00 N ATOM 944 CZ ARG A 63 3.160 13.691 -22.597 1.00 0.00 C ATOM 945 NH1 ARG A 63 3.498 14.000 -23.844 1.00 0.00 N ATOM 946 NH2 ARG A 63 2.291 12.718 -22.376 1.00 0.00 N ATOM 0 H ARG A 63 8.754 15.318 -20.242 1.00 0.00 H new ATOM 0 HA ARG A 63 6.734 15.245 -18.076 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.761 14.105 -20.893 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.545 13.710 -19.693 1.00 0.00 H new ATOM 0 HG2 ARG A 63 4.752 15.990 -19.624 1.00 0.00 H new ATOM 0 HG3 ARG A 63 6.105 16.556 -20.583 1.00 0.00 H new ATOM 0 HD2 ARG A 63 4.092 16.366 -21.971 1.00 0.00 H new ATOM 0 HD3 ARG A 63 5.324 15.246 -22.519 1.00 0.00 H new ATOM 0 HE ARG A 63 3.414 14.070 -20.627 1.00 0.00 H new ATOM 0 HH11 ARG A 63 4.167 14.750 -24.020 1.00 0.00 H new ATOM 0 HH12 ARG A 63 3.089 13.488 -24.625 1.00 0.00 H new ATOM 0 HH21 ARG A 63 2.027 12.477 -21.421 1.00 0.00 H new ATOM 0 HH22 ARG A 63 1.885 12.209 -23.161 1.00 0.00 H new ATOM 960 N LEU A 64 7.382 12.956 -17.290 1.00 0.00 N ATOM 961 CA LEU A 64 7.859 11.693 -16.750 1.00 0.00 C ATOM 962 C LEU A 64 7.228 10.534 -17.510 1.00 0.00 C ATOM 963 O LEU A 64 6.016 10.326 -17.450 1.00 0.00 O ATOM 964 CB LEU A 64 7.517 11.592 -15.257 1.00 0.00 C ATOM 965 CG LEU A 64 8.425 10.686 -14.406 1.00 0.00 C ATOM 966 CD1 LEU A 64 8.394 9.240 -14.882 1.00 0.00 C ATOM 967 CD2 LEU A 64 9.849 11.211 -14.413 1.00 0.00 C ATOM 0 H LEU A 64 6.674 13.419 -16.720 1.00 0.00 H new ATOM 0 HA LEU A 64 8.942 11.646 -16.865 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.541 12.596 -14.832 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.492 11.232 -15.165 1.00 0.00 H new ATOM 0 HG LEU A 64 8.041 10.704 -13.386 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.049 8.636 -14.254 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.375 8.858 -14.818 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.736 9.190 -15.916 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.480 10.560 -13.807 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.225 11.230 -15.436 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.867 12.220 -14.001 1.00 0.00 H new ATOM 979 N GLY A 65 8.051 9.790 -18.225 1.00 0.00 N ATOM 980 CA GLY A 65 7.574 8.608 -18.906 1.00 0.00 C ATOM 981 C GLY A 65 7.774 7.380 -18.049 1.00 0.00 C ATOM 982 O GLY A 65 8.875 6.846 -17.973 1.00 0.00 O ATOM 0 H GLY A 65 9.045 9.983 -18.347 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.517 8.722 -19.145 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.104 8.488 -19.851 1.00 0.00 H new ATOM 986 N ARG A 66 6.724 6.936 -17.380 1.00 0.00 N ATOM 987 CA ARG A 66 6.848 5.823 -16.451 1.00 0.00 C ATOM 988 C ARG A 66 7.132 4.505 -17.174 1.00 0.00 C ATOM 989 O ARG A 66 7.546 3.529 -16.551 1.00 0.00 O ATOM 990 CB ARG A 66 5.609 5.704 -15.558 1.00 0.00 C ATOM 991 CG ARG A 66 4.335 5.341 -16.299 1.00 0.00 C ATOM 992 CD ARG A 66 3.163 5.210 -15.340 1.00 0.00 C ATOM 993 NE ARG A 66 1.970 4.689 -16.001 1.00 0.00 N ATOM 994 CZ ARG A 66 0.991 4.037 -15.373 1.00 0.00 C ATOM 995 NH1 ARG A 66 1.028 3.885 -14.051 1.00 0.00 N ATOM 996 NH2 ARG A 66 -0.030 3.552 -16.069 1.00 0.00 N ATOM 0 H ARG A 66 5.784 7.324 -17.460 1.00 0.00 H new ATOM 0 HA ARG A 66 7.705 6.034 -15.812 1.00 0.00 H new ATOM 0 HB2 ARG A 66 5.798 4.950 -14.794 1.00 0.00 H new ATOM 0 HB3 ARG A 66 5.457 6.651 -15.041 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.115 6.104 -17.045 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.477 4.403 -16.835 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.439 4.550 -14.518 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.940 6.184 -14.905 1.00 0.00 H new ATOM 0 HE ARG A 66 1.880 4.833 -17.007 1.00 0.00 H new ATOM 0 HH11 ARG A 66 1.807 4.268 -13.515 1.00 0.00 H new ATOM 0 HH12 ARG A 66 0.277 3.386 -13.574 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -0.064 3.679 -17.081 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -0.781 3.053 -15.592 1.00 0.00 H new ATOM 1010 N GLU A 67 6.918 4.476 -18.485 1.00 0.00 N ATOM 1011 CA GLU A 67 7.262 3.304 -19.286 1.00 0.00 C ATOM 1012 C GLU A 67 8.770 3.050 -19.261 1.00 0.00 C ATOM 1013 O GLU A 67 9.222 1.926 -19.488 1.00 0.00 O ATOM 1014 CB GLU A 67 6.764 3.430 -20.735 1.00 0.00 C ATOM 1015 CG GLU A 67 6.889 4.822 -21.335 1.00 0.00 C ATOM 1016 CD GLU A 67 5.671 5.678 -21.061 1.00 0.00 C ATOM 1017 OE1 GLU A 67 5.605 6.296 -19.982 1.00 0.00 O ATOM 1018 OE2 GLU A 67 4.763 5.720 -21.919 1.00 0.00 O ATOM 0 H GLU A 67 6.510 5.246 -19.015 1.00 0.00 H new ATOM 0 HA GLU A 67 6.755 2.450 -18.837 1.00 0.00 H new ATOM 0 HB2 GLU A 67 7.321 2.730 -21.358 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.718 3.126 -20.772 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.774 5.312 -20.928 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.037 4.739 -22.412 1.00 0.00 H new ATOM 1025 N GLN A 68 9.546 4.094 -18.978 1.00 0.00 N ATOM 1026 CA GLN A 68 10.997 3.971 -18.869 1.00 0.00 C ATOM 1027 C GLN A 68 11.363 2.990 -17.761 1.00 0.00 C ATOM 1028 O GLN A 68 12.378 2.298 -17.835 1.00 0.00 O ATOM 1029 CB GLN A 68 11.633 5.329 -18.572 1.00 0.00 C ATOM 1030 CG GLN A 68 11.251 6.429 -19.552 1.00 0.00 C ATOM 1031 CD GLN A 68 11.984 6.359 -20.882 1.00 0.00 C ATOM 1032 OE1 GLN A 68 12.264 7.385 -21.499 1.00 0.00 O ATOM 1033 NE2 GLN A 68 12.274 5.157 -21.354 1.00 0.00 N ATOM 0 H GLN A 68 9.192 5.037 -18.820 1.00 0.00 H new ATOM 0 HA GLN A 68 11.377 3.601 -19.821 1.00 0.00 H new ATOM 0 HB2 GLN A 68 11.347 5.639 -17.567 1.00 0.00 H new ATOM 0 HB3 GLN A 68 12.717 5.217 -18.574 1.00 0.00 H new ATOM 0 HG2 GLN A 68 10.178 6.378 -19.738 1.00 0.00 H new ATOM 0 HG3 GLN A 68 11.449 7.396 -19.091 1.00 0.00 H new ATOM 0 HE21 GLN A 68 12.028 4.325 -20.817 1.00 0.00 H new ATOM 0 HE22 GLN A 68 12.743 5.062 -22.255 1.00 0.00 H new ATOM 1042 N LEU A 69 10.514 2.932 -16.739 1.00 0.00 N ATOM 1043 CA LEU A 69 10.729 2.050 -15.597 1.00 0.00 C ATOM 1044 C LEU A 69 10.729 0.587 -16.027 1.00 0.00 C ATOM 1045 O LEU A 69 11.364 -0.250 -15.392 1.00 0.00 O ATOM 1046 CB LEU A 69 9.669 2.282 -14.512 1.00 0.00 C ATOM 1047 CG LEU A 69 9.872 3.526 -13.635 1.00 0.00 C ATOM 1048 CD1 LEU A 69 9.699 4.809 -14.433 1.00 0.00 C ATOM 1049 CD2 LEU A 69 8.912 3.500 -12.455 1.00 0.00 C ATOM 0 H LEU A 69 9.663 3.491 -16.679 1.00 0.00 H new ATOM 0 HA LEU A 69 11.707 2.288 -15.179 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.694 2.355 -14.993 1.00 0.00 H new ATOM 0 HB3 LEU A 69 9.640 1.405 -13.865 1.00 0.00 H new ATOM 0 HG LEU A 69 10.896 3.507 -13.261 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.850 5.668 -13.779 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.430 4.836 -15.242 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.693 4.844 -14.852 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.066 4.387 -11.841 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.885 3.486 -12.821 1.00 0.00 H new ATOM 0 HD23 LEU A 69 9.096 2.608 -11.856 1.00 0.00 H new ATOM 1061 N GLN A 70 10.019 0.280 -17.109 1.00 0.00 N ATOM 1062 CA GLN A 70 9.977 -1.082 -17.626 1.00 0.00 C ATOM 1063 C GLN A 70 11.347 -1.501 -18.149 1.00 0.00 C ATOM 1064 O GLN A 70 11.702 -2.676 -18.118 1.00 0.00 O ATOM 1065 CB GLN A 70 8.935 -1.214 -18.734 1.00 0.00 C ATOM 1066 CG GLN A 70 7.525 -0.857 -18.291 1.00 0.00 C ATOM 1067 CD GLN A 70 6.490 -1.081 -19.378 1.00 0.00 C ATOM 1068 OE1 GLN A 70 5.491 -0.366 -19.454 1.00 0.00 O ATOM 1069 NE2 GLN A 70 6.713 -2.084 -20.213 1.00 0.00 N ATOM 0 H GLN A 70 9.468 0.953 -17.642 1.00 0.00 H new ATOM 0 HA GLN A 70 9.696 -1.741 -16.805 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.219 -0.570 -19.567 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.941 -2.238 -19.107 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.262 -1.454 -17.417 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.500 0.188 -17.982 1.00 0.00 H new ATOM 0 HE21 GLN A 70 7.554 -2.652 -20.115 1.00 0.00 H new ATOM 0 HE22 GLN A 70 6.043 -2.289 -20.955 1.00 0.00 H new ATOM 1078 N ILE A 71 12.122 -0.530 -18.617 1.00 0.00 N ATOM 1079 CA ILE A 71 13.481 -0.794 -19.068 1.00 0.00 C ATOM 1080 C ILE A 71 14.360 -1.134 -17.868 1.00 0.00 C ATOM 1081 O ILE A 71 15.277 -1.952 -17.955 1.00 0.00 O ATOM 1082 CB ILE A 71 14.069 0.413 -19.833 1.00 0.00 C ATOM 1083 CG1 ILE A 71 13.186 0.748 -21.041 1.00 0.00 C ATOM 1084 CG2 ILE A 71 15.499 0.127 -20.275 1.00 0.00 C ATOM 1085 CD1 ILE A 71 13.667 1.940 -21.842 1.00 0.00 C ATOM 0 H ILE A 71 11.833 0.445 -18.694 1.00 0.00 H new ATOM 0 HA ILE A 71 13.454 -1.640 -19.755 1.00 0.00 H new ATOM 0 HB ILE A 71 14.090 1.274 -19.164 1.00 0.00 H new ATOM 0 HG12 ILE A 71 13.138 -0.122 -21.696 1.00 0.00 H new ATOM 0 HG13 ILE A 71 12.171 0.942 -20.694 1.00 0.00 H new ATOM 0 HG21 ILE A 71 15.893 0.990 -20.812 1.00 0.00 H new ATOM 0 HG22 ILE A 71 16.118 -0.070 -19.400 1.00 0.00 H new ATOM 0 HG23 ILE A 71 15.510 -0.744 -20.930 1.00 0.00 H new ATOM 0 HD11 ILE A 71 12.990 2.113 -22.679 1.00 0.00 H new ATOM 0 HD12 ILE A 71 13.688 2.823 -21.203 1.00 0.00 H new ATOM 0 HD13 ILE A 71 14.670 1.743 -22.221 1.00 0.00 H new ATOM 1097 N LEU A 72 14.046 -0.519 -16.737 1.00 0.00 N ATOM 1098 CA LEU A 72 14.731 -0.810 -15.485 1.00 0.00 C ATOM 1099 C LEU A 72 14.248 -2.149 -14.939 1.00 0.00 C ATOM 1100 O LEU A 72 14.994 -2.881 -14.285 1.00 0.00 O ATOM 1101 CB LEU A 72 14.465 0.302 -14.470 1.00 0.00 C ATOM 1102 CG LEU A 72 14.725 1.723 -14.979 1.00 0.00 C ATOM 1103 CD1 LEU A 72 14.443 2.739 -13.885 1.00 0.00 C ATOM 1104 CD2 LEU A 72 16.152 1.864 -15.488 1.00 0.00 C ATOM 0 H LEU A 72 13.316 0.189 -16.660 1.00 0.00 H new ATOM 0 HA LEU A 72 15.804 -0.865 -15.666 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.427 0.234 -14.144 1.00 0.00 H new ATOM 0 HB3 LEU A 72 15.087 0.128 -13.592 1.00 0.00 H new ATOM 0 HG LEU A 72 14.049 1.916 -15.812 1.00 0.00 H new ATOM 0 HD11 LEU A 72 14.633 3.743 -14.264 1.00 0.00 H new ATOM 0 HD12 LEU A 72 13.401 2.659 -13.574 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.092 2.544 -13.031 1.00 0.00 H new ATOM 0 HD21 LEU A 72 16.312 2.882 -15.844 1.00 0.00 H new ATOM 0 HD22 LEU A 72 16.850 1.648 -14.679 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.317 1.163 -16.306 1.00 0.00 H new ATOM 1116 N LEU A 73 12.988 -2.455 -15.226 1.00 0.00 N ATOM 1117 CA LEU A 73 12.382 -3.734 -14.873 1.00 0.00 C ATOM 1118 C LEU A 73 13.129 -4.882 -15.550 1.00 0.00 C ATOM 1119 O LEU A 73 13.232 -5.981 -15.004 1.00 0.00 O ATOM 1120 CB LEU A 73 10.908 -3.725 -15.295 1.00 0.00 C ATOM 1121 CG LEU A 73 10.136 -5.029 -15.089 1.00 0.00 C ATOM 1122 CD1 LEU A 73 9.999 -5.348 -13.608 1.00 0.00 C ATOM 1123 CD2 LEU A 73 8.767 -4.931 -15.751 1.00 0.00 C ATOM 0 H LEU A 73 12.355 -1.820 -15.712 1.00 0.00 H new ATOM 0 HA LEU A 73 12.446 -3.881 -13.795 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.399 -2.935 -14.743 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.856 -3.460 -16.351 1.00 0.00 H new ATOM 0 HG LEU A 73 10.692 -5.843 -15.554 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.446 -6.280 -13.486 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.989 -5.453 -13.165 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.463 -4.540 -13.110 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.222 -5.863 -15.600 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.207 -4.108 -15.308 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.891 -4.752 -16.819 1.00 0.00 H new ATOM 1135 N GLU A 74 13.655 -4.612 -16.741 1.00 0.00 N ATOM 1136 CA GLU A 74 14.480 -5.578 -17.458 1.00 0.00 C ATOM 1137 C GLU A 74 15.721 -5.928 -16.638 1.00 0.00 C ATOM 1138 O GLU A 74 16.183 -7.070 -16.642 1.00 0.00 O ATOM 1139 CB GLU A 74 14.905 -5.011 -18.815 1.00 0.00 C ATOM 1140 CG GLU A 74 13.744 -4.604 -19.709 1.00 0.00 C ATOM 1141 CD GLU A 74 12.895 -5.780 -20.146 1.00 0.00 C ATOM 1142 OE1 GLU A 74 13.363 -6.568 -20.996 1.00 0.00 O ATOM 1143 OE2 GLU A 74 11.754 -5.913 -19.660 1.00 0.00 O ATOM 0 H GLU A 74 13.523 -3.728 -17.232 1.00 0.00 H new ATOM 0 HA GLU A 74 13.891 -6.481 -17.617 1.00 0.00 H new ATOM 0 HB2 GLU A 74 15.544 -4.144 -18.650 1.00 0.00 H new ATOM 0 HB3 GLU A 74 15.507 -5.756 -19.336 1.00 0.00 H new ATOM 0 HG2 GLU A 74 13.117 -3.887 -19.178 1.00 0.00 H new ATOM 0 HG3 GLU A 74 14.133 -4.095 -20.591 1.00 0.00 H new ATOM 1150 N GLN A 75 16.249 -4.937 -15.927 1.00 0.00 N ATOM 1151 CA GLN A 75 17.425 -5.134 -15.089 1.00 0.00 C ATOM 1152 C GLN A 75 17.043 -5.839 -13.789 1.00 0.00 C ATOM 1153 O GLN A 75 17.826 -6.614 -13.244 1.00 0.00 O ATOM 1154 CB GLN A 75 18.107 -3.797 -14.789 1.00 0.00 C ATOM 1155 CG GLN A 75 18.625 -3.075 -16.025 1.00 0.00 C ATOM 1156 CD GLN A 75 19.628 -3.899 -16.812 1.00 0.00 C ATOM 1157 OE1 GLN A 75 20.832 -3.850 -16.554 1.00 0.00 O ATOM 1158 NE2 GLN A 75 19.141 -4.649 -17.790 1.00 0.00 N ATOM 0 H GLN A 75 15.879 -3.987 -15.915 1.00 0.00 H new ATOM 0 HA GLN A 75 18.129 -5.764 -15.633 1.00 0.00 H new ATOM 0 HB2 GLN A 75 17.400 -3.148 -14.271 1.00 0.00 H new ATOM 0 HB3 GLN A 75 18.939 -3.970 -14.107 1.00 0.00 H new ATOM 0 HG2 GLN A 75 17.784 -2.821 -16.671 1.00 0.00 H new ATOM 0 HG3 GLN A 75 19.090 -2.136 -15.723 1.00 0.00 H new ATOM 0 HE21 GLN A 75 18.137 -4.662 -17.971 1.00 0.00 H new ATOM 0 HE22 GLN A 75 19.770 -5.214 -18.361 1.00 0.00 H new ATOM 1167 N ASN A 76 15.841 -5.539 -13.289 1.00 0.00 N ATOM 1168 CA ASN A 76 15.258 -6.249 -12.140 1.00 0.00 C ATOM 1169 C ASN A 76 16.027 -5.950 -10.844 1.00 0.00 C ATOM 1170 O ASN A 76 15.870 -6.636 -9.834 1.00 0.00 O ATOM 1171 CB ASN A 76 15.225 -7.762 -12.425 1.00 0.00 C ATOM 1172 CG ASN A 76 14.476 -8.578 -11.380 1.00 0.00 C ATOM 1173 OD1 ASN A 76 14.840 -9.721 -11.105 1.00 0.00 O ATOM 1174 ND2 ASN A 76 13.423 -8.019 -10.802 1.00 0.00 N ATOM 0 H ASN A 76 15.245 -4.802 -13.665 1.00 0.00 H new ATOM 0 HA ASN A 76 14.238 -5.893 -11.997 1.00 0.00 H new ATOM 0 HB2 ASN A 76 14.763 -7.927 -13.398 1.00 0.00 H new ATOM 0 HB3 ASN A 76 16.249 -8.130 -12.492 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.888 -8.538 -10.106 1.00 0.00 H new ATOM 0 HD22 ASN A 76 13.148 -7.069 -11.053 1.00 0.00 H new ATOM 1181 N ILE A 77 16.837 -4.902 -10.866 1.00 0.00 N ATOM 1182 CA ILE A 77 17.607 -4.519 -9.692 1.00 0.00 C ATOM 1183 C ILE A 77 17.105 -3.198 -9.100 1.00 0.00 C ATOM 1184 O ILE A 77 17.595 -2.116 -9.419 1.00 0.00 O ATOM 1185 CB ILE A 77 19.131 -4.476 -9.990 1.00 0.00 C ATOM 1186 CG1 ILE A 77 19.427 -4.030 -11.430 1.00 0.00 C ATOM 1187 CG2 ILE A 77 19.745 -5.842 -9.741 1.00 0.00 C ATOM 1188 CD1 ILE A 77 19.498 -2.533 -11.625 1.00 0.00 C ATOM 0 H ILE A 77 16.978 -4.304 -11.680 1.00 0.00 H new ATOM 0 HA ILE A 77 17.454 -5.291 -8.938 1.00 0.00 H new ATOM 0 HB ILE A 77 19.574 -3.740 -9.319 1.00 0.00 H new ATOM 0 HG12 ILE A 77 20.374 -4.469 -11.745 1.00 0.00 H new ATOM 0 HG13 ILE A 77 18.655 -4.432 -12.086 1.00 0.00 H new ATOM 0 HG21 ILE A 77 20.814 -5.804 -9.952 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.590 -6.126 -8.700 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.272 -6.578 -10.392 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.711 -2.312 -12.671 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.545 -2.084 -11.346 1.00 0.00 H new ATOM 0 HD13 ILE A 77 20.290 -2.122 -10.999 1.00 0.00 H new ATOM 1200 N ASN A 78 16.109 -3.309 -8.228 1.00 0.00 N ATOM 1201 CA ASN A 78 15.426 -2.147 -7.672 1.00 0.00 C ATOM 1202 C ASN A 78 16.301 -1.392 -6.681 1.00 0.00 C ATOM 1203 O ASN A 78 16.293 -0.163 -6.654 1.00 0.00 O ATOM 1204 CB ASN A 78 14.121 -2.563 -6.985 1.00 0.00 C ATOM 1205 CG ASN A 78 13.075 -3.073 -7.958 1.00 0.00 C ATOM 1206 OD1 ASN A 78 13.007 -4.267 -8.251 1.00 0.00 O ATOM 1207 ND2 ASN A 78 12.242 -2.173 -8.460 1.00 0.00 N ATOM 0 H ASN A 78 15.754 -4.203 -7.888 1.00 0.00 H new ATOM 0 HA ASN A 78 15.203 -1.482 -8.506 1.00 0.00 H new ATOM 0 HB2 ASN A 78 14.335 -3.339 -6.250 1.00 0.00 H new ATOM 0 HB3 ASN A 78 13.717 -1.711 -6.439 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.513 -2.461 -9.113 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.330 -1.192 -8.193 1.00 0.00 H new ATOM 1214 N GLU A 79 17.057 -2.124 -5.876 1.00 0.00 N ATOM 1215 CA GLU A 79 17.882 -1.508 -4.844 1.00 0.00 C ATOM 1216 C GLU A 79 19.166 -0.953 -5.444 1.00 0.00 C ATOM 1217 O GLU A 79 19.722 0.029 -4.954 1.00 0.00 O ATOM 1218 CB GLU A 79 18.208 -2.521 -3.746 1.00 0.00 C ATOM 1219 CG GLU A 79 16.977 -3.099 -3.069 1.00 0.00 C ATOM 1220 CD GLU A 79 17.327 -4.011 -1.916 1.00 0.00 C ATOM 1221 OE1 GLU A 79 17.525 -5.222 -2.148 1.00 0.00 O ATOM 1222 OE2 GLU A 79 17.406 -3.521 -0.770 1.00 0.00 O ATOM 0 H GLU A 79 17.117 -3.141 -5.916 1.00 0.00 H new ATOM 0 HA GLU A 79 17.320 -0.684 -4.405 1.00 0.00 H new ATOM 0 HB2 GLU A 79 18.792 -3.335 -4.175 1.00 0.00 H new ATOM 0 HB3 GLU A 79 18.834 -2.041 -2.994 1.00 0.00 H new ATOM 0 HG2 GLU A 79 16.349 -2.285 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 79 16.390 -3.653 -3.801 1.00 0.00 H new ATOM 1229 N ARG A 80 19.624 -1.583 -6.514 1.00 0.00 N ATOM 1230 CA ARG A 80 20.847 -1.168 -7.188 1.00 0.00 C ATOM 1231 C ARG A 80 20.659 0.202 -7.831 1.00 0.00 C ATOM 1232 O ARG A 80 21.492 1.094 -7.681 1.00 0.00 O ATOM 1233 CB ARG A 80 21.224 -2.195 -8.248 1.00 0.00 C ATOM 1234 CG ARG A 80 22.660 -2.087 -8.725 1.00 0.00 C ATOM 1235 CD ARG A 80 22.987 -3.180 -9.726 1.00 0.00 C ATOM 1236 NE ARG A 80 24.391 -3.156 -10.126 1.00 0.00 N ATOM 1237 CZ ARG A 80 24.884 -3.847 -11.152 1.00 0.00 C ATOM 1238 NH1 ARG A 80 24.095 -4.631 -11.879 1.00 0.00 N ATOM 1239 NH2 ARG A 80 26.174 -3.768 -11.445 1.00 0.00 N ATOM 0 H ARG A 80 19.165 -2.389 -6.938 1.00 0.00 H new ATOM 0 HA ARG A 80 21.649 -1.100 -6.453 1.00 0.00 H new ATOM 0 HB2 ARG A 80 21.059 -3.195 -7.846 1.00 0.00 H new ATOM 0 HB3 ARG A 80 20.558 -2.081 -9.103 1.00 0.00 H new ATOM 0 HG2 ARG A 80 22.822 -1.111 -9.182 1.00 0.00 H new ATOM 0 HG3 ARG A 80 23.336 -2.156 -7.873 1.00 0.00 H new ATOM 0 HD2 ARG A 80 22.751 -4.151 -9.292 1.00 0.00 H new ATOM 0 HD3 ARG A 80 22.357 -3.064 -10.608 1.00 0.00 H new ATOM 0 HE ARG A 80 25.033 -2.575 -9.587 1.00 0.00 H new ATOM 0 HH11 ARG A 80 23.103 -4.707 -11.653 1.00 0.00 H new ATOM 0 HH12 ARG A 80 24.481 -5.157 -12.663 1.00 0.00 H new ATOM 0 HH21 ARG A 80 26.789 -3.178 -10.885 1.00 0.00 H new ATOM 0 HH22 ARG A 80 26.552 -4.297 -12.231 1.00 0.00 H new ATOM 1253 N LEU A 81 19.552 0.353 -8.544 1.00 0.00 N ATOM 1254 CA LEU A 81 19.200 1.626 -9.168 1.00 0.00 C ATOM 1255 C LEU A 81 18.631 2.600 -8.144 1.00 0.00 C ATOM 1256 O LEU A 81 18.615 3.809 -8.374 1.00 0.00 O ATOM 1257 CB LEU A 81 18.172 1.406 -10.275 1.00 0.00 C ATOM 1258 CG LEU A 81 18.711 0.823 -11.575 1.00 0.00 C ATOM 1259 CD1 LEU A 81 17.564 0.374 -12.464 1.00 0.00 C ATOM 1260 CD2 LEU A 81 19.560 1.855 -12.293 1.00 0.00 C ATOM 0 H LEU A 81 18.877 -0.394 -8.707 1.00 0.00 H new ATOM 0 HA LEU A 81 20.110 2.051 -9.591 1.00 0.00 H new ATOM 0 HB2 LEU A 81 17.395 0.742 -9.896 1.00 0.00 H new ATOM 0 HB3 LEU A 81 17.696 2.361 -10.497 1.00 0.00 H new ATOM 0 HG LEU A 81 19.331 -0.043 -11.344 1.00 0.00 H new ATOM 0 HD11 LEU A 81 17.962 -0.041 -13.390 1.00 0.00 H new ATOM 0 HD12 LEU A 81 16.980 -0.387 -11.947 1.00 0.00 H new ATOM 0 HD13 LEU A 81 16.926 1.227 -12.694 1.00 0.00 H new ATOM 0 HD21 LEU A 81 19.941 1.430 -13.221 1.00 0.00 H new ATOM 0 HD22 LEU A 81 18.954 2.732 -12.518 1.00 0.00 H new ATOM 0 HD23 LEU A 81 20.396 2.145 -11.656 1.00 0.00 H new ATOM 1272 N ASN A 82 18.163 2.055 -7.024 1.00 0.00 N ATOM 1273 CA ASN A 82 17.523 2.838 -5.970 1.00 0.00 C ATOM 1274 C ASN A 82 16.220 3.455 -6.478 1.00 0.00 C ATOM 1275 O ASN A 82 16.077 4.677 -6.565 1.00 0.00 O ATOM 1276 CB ASN A 82 18.467 3.925 -5.432 1.00 0.00 C ATOM 1277 CG ASN A 82 17.906 4.646 -4.218 1.00 0.00 C ATOM 1278 OD1 ASN A 82 17.161 4.071 -3.423 1.00 0.00 O ATOM 1279 ND2 ASN A 82 18.260 5.910 -4.065 1.00 0.00 N ATOM 0 H ASN A 82 18.217 1.057 -6.821 1.00 0.00 H new ATOM 0 HA ASN A 82 17.289 2.165 -5.145 1.00 0.00 H new ATOM 0 HB2 ASN A 82 19.423 3.472 -5.170 1.00 0.00 H new ATOM 0 HB3 ASN A 82 18.664 4.651 -6.221 1.00 0.00 H new ATOM 0 HD21 ASN A 82 17.914 6.443 -3.267 1.00 0.00 H new ATOM 0 HD22 ASN A 82 18.879 6.352 -4.745 1.00 0.00 H new ATOM 1286 N ILE A 83 15.277 2.596 -6.848 1.00 0.00 N ATOM 1287 CA ILE A 83 13.957 3.054 -7.255 1.00 0.00 C ATOM 1288 C ILE A 83 13.119 3.358 -6.023 1.00 0.00 C ATOM 1289 O ILE A 83 12.866 2.474 -5.200 1.00 0.00 O ATOM 1290 CB ILE A 83 13.207 2.027 -8.148 1.00 0.00 C ATOM 1291 CG1 ILE A 83 13.855 1.916 -9.529 1.00 0.00 C ATOM 1292 CG2 ILE A 83 11.739 2.400 -8.298 1.00 0.00 C ATOM 1293 CD1 ILE A 83 14.990 0.925 -9.592 1.00 0.00 C ATOM 0 H ILE A 83 15.402 1.584 -6.874 1.00 0.00 H new ATOM 0 HA ILE A 83 14.104 3.954 -7.853 1.00 0.00 H new ATOM 0 HB ILE A 83 13.275 1.059 -7.652 1.00 0.00 H new ATOM 0 HG12 ILE A 83 13.094 1.629 -10.255 1.00 0.00 H new ATOM 0 HG13 ILE A 83 14.225 2.897 -9.826 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.239 1.664 -8.928 1.00 0.00 H new ATOM 0 HG22 ILE A 83 11.266 2.418 -7.316 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.659 3.385 -8.758 1.00 0.00 H new ATOM 0 HD11 ILE A 83 15.398 0.903 -10.603 1.00 0.00 H new ATOM 0 HD12 ILE A 83 15.771 1.221 -8.892 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.622 -0.066 -9.327 1.00 0.00 H new ATOM 1305 N GLY A 84 12.710 4.612 -5.896 1.00 0.00 N ATOM 1306 CA GLY A 84 11.918 5.028 -4.758 1.00 0.00 C ATOM 1307 C GLY A 84 10.581 4.316 -4.683 1.00 0.00 C ATOM 1308 O GLY A 84 10.056 3.846 -5.693 1.00 0.00 O ATOM 0 H GLY A 84 12.915 5.353 -6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 84 12.478 4.838 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 84 11.750 6.104 -4.812 1.00 0.00 H new ATOM 1312 N GLU A 85 10.028 4.242 -3.486 1.00 0.00 N ATOM 1313 CA GLU A 85 8.730 3.616 -3.276 1.00 0.00 C ATOM 1314 C GLU A 85 7.612 4.367 -4.011 1.00 0.00 C ATOM 1315 O GLU A 85 6.746 3.733 -4.613 1.00 0.00 O ATOM 1316 CB GLU A 85 8.421 3.505 -1.785 1.00 0.00 C ATOM 1317 CG GLU A 85 9.315 2.517 -1.057 1.00 0.00 C ATOM 1318 CD GLU A 85 8.932 2.350 0.394 1.00 0.00 C ATOM 1319 OE1 GLU A 85 7.901 1.704 0.669 1.00 0.00 O ATOM 1320 OE2 GLU A 85 9.654 2.865 1.271 1.00 0.00 O ATOM 0 H GLU A 85 10.459 4.610 -2.638 1.00 0.00 H new ATOM 0 HA GLU A 85 8.777 2.611 -3.695 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.527 4.487 -1.325 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.381 3.205 -1.658 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.264 1.550 -1.556 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.350 2.854 -1.120 1.00 0.00 H new ATOM 1327 N PRO A 86 7.597 5.723 -3.974 1.00 0.00 N ATOM 1328 CA PRO A 86 6.685 6.517 -4.810 1.00 0.00 C ATOM 1329 C PRO A 86 6.779 6.140 -6.289 1.00 0.00 C ATOM 1330 O PRO A 86 5.815 6.265 -7.038 1.00 0.00 O ATOM 1331 CB PRO A 86 7.170 7.950 -4.600 1.00 0.00 C ATOM 1332 CG PRO A 86 7.777 7.943 -3.244 1.00 0.00 C ATOM 1333 CD PRO A 86 8.407 6.590 -3.086 1.00 0.00 C ATOM 0 HA PRO A 86 5.642 6.359 -4.537 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.898 8.238 -5.359 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.346 8.661 -4.662 1.00 0.00 H new ATOM 0 HG2 PRO A 86 8.520 8.734 -3.144 1.00 0.00 H new ATOM 0 HG3 PRO A 86 7.022 8.115 -2.477 1.00 0.00 H new ATOM 0 HD2 PRO A 86 9.456 6.599 -3.382 1.00 0.00 H new ATOM 0 HD3 PRO A 86 8.371 6.249 -2.051 1.00 0.00 H new ATOM 1341 N LEU A 87 7.946 5.665 -6.695 1.00 0.00 N ATOM 1342 CA LEU A 87 8.174 5.248 -8.074 1.00 0.00 C ATOM 1343 C LEU A 87 7.546 3.880 -8.319 1.00 0.00 C ATOM 1344 O LEU A 87 6.985 3.622 -9.384 1.00 0.00 O ATOM 1345 CB LEU A 87 9.677 5.198 -8.370 1.00 0.00 C ATOM 1346 CG LEU A 87 10.355 6.527 -8.732 1.00 0.00 C ATOM 1347 CD1 LEU A 87 10.233 6.797 -10.225 1.00 0.00 C ATOM 1348 CD2 LEU A 87 9.765 7.688 -7.947 1.00 0.00 C ATOM 0 H LEU A 87 8.757 5.557 -6.086 1.00 0.00 H new ATOM 0 HA LEU A 87 7.709 5.974 -8.741 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.182 4.786 -7.496 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.839 4.499 -9.191 1.00 0.00 H new ATOM 0 HG LEU A 87 11.409 6.440 -8.467 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.719 7.743 -10.465 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.713 5.992 -10.781 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.180 6.850 -10.500 1.00 0.00 H new ATOM 0 HD21 LEU A 87 10.270 8.612 -8.230 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.701 7.773 -8.168 1.00 0.00 H new ATOM 0 HD23 LEU A 87 9.901 7.512 -6.880 1.00 0.00 H new ATOM 1360 N LEU A 88 7.637 3.015 -7.314 1.00 0.00 N ATOM 1361 CA LEU A 88 7.054 1.680 -7.384 1.00 0.00 C ATOM 1362 C LEU A 88 5.539 1.760 -7.534 1.00 0.00 C ATOM 1363 O LEU A 88 4.941 1.017 -8.311 1.00 0.00 O ATOM 1364 CB LEU A 88 7.407 0.876 -6.129 1.00 0.00 C ATOM 1365 CG LEU A 88 8.901 0.624 -5.910 1.00 0.00 C ATOM 1366 CD1 LEU A 88 9.135 -0.055 -4.569 1.00 0.00 C ATOM 1367 CD2 LEU A 88 9.467 -0.224 -7.041 1.00 0.00 C ATOM 0 H LEU A 88 8.113 3.217 -6.435 1.00 0.00 H new ATOM 0 HA LEU A 88 7.467 1.177 -8.258 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.013 1.401 -5.259 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.897 -0.086 -6.179 1.00 0.00 H new ATOM 0 HG LEU A 88 9.417 1.584 -5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 88 10.202 -0.227 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.762 0.583 -3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 88 8.608 -1.009 -4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 88 10.530 -0.395 -6.871 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.947 -1.181 -7.074 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.330 0.296 -7.989 1.00 0.00 H new ATOM 1379 N VAL A 89 4.923 2.670 -6.791 1.00 0.00 N ATOM 1380 CA VAL A 89 3.482 2.851 -6.860 1.00 0.00 C ATOM 1381 C VAL A 89 3.088 3.578 -8.144 1.00 0.00 C ATOM 1382 O VAL A 89 2.024 3.318 -8.705 1.00 0.00 O ATOM 1383 CB VAL A 89 2.918 3.596 -5.625 1.00 0.00 C ATOM 1384 CG1 VAL A 89 3.238 2.831 -4.353 1.00 0.00 C ATOM 1385 CG2 VAL A 89 3.448 5.018 -5.532 1.00 0.00 C ATOM 0 H VAL A 89 5.398 3.291 -6.136 1.00 0.00 H new ATOM 0 HA VAL A 89 3.040 1.854 -6.865 1.00 0.00 H new ATOM 0 HB VAL A 89 1.836 3.654 -5.744 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.835 3.368 -3.494 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.791 1.838 -4.403 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.319 2.737 -4.247 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.028 5.506 -4.652 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.535 4.997 -5.451 1.00 0.00 H new ATOM 0 HG23 VAL A 89 3.161 5.572 -6.426 1.00 0.00 H new ATOM 1395 N TYR A 90 3.963 4.475 -8.609 1.00 0.00 N ATOM 1396 CA TYR A 90 3.724 5.255 -9.826 1.00 0.00 C ATOM 1397 C TYR A 90 3.625 4.346 -11.050 1.00 0.00 C ATOM 1398 O TYR A 90 2.986 4.687 -12.051 1.00 0.00 O ATOM 1399 CB TYR A 90 4.848 6.278 -10.024 1.00 0.00 C ATOM 1400 CG TYR A 90 4.561 7.307 -11.097 1.00 0.00 C ATOM 1401 CD1 TYR A 90 3.307 7.894 -11.201 1.00 0.00 C ATOM 1402 CD2 TYR A 90 5.540 7.694 -12.003 1.00 0.00 C ATOM 1403 CE1 TYR A 90 3.035 8.834 -12.174 1.00 0.00 C ATOM 1404 CE2 TYR A 90 5.274 8.637 -12.980 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.019 9.204 -13.058 1.00 0.00 C ATOM 1406 OH TYR A 90 3.744 10.141 -14.029 1.00 0.00 O ATOM 0 H TYR A 90 4.853 4.680 -8.154 1.00 0.00 H new ATOM 0 HA TYR A 90 2.775 5.780 -9.712 1.00 0.00 H new ATOM 0 HB2 TYR A 90 5.028 6.793 -9.080 1.00 0.00 H new ATOM 0 HB3 TYR A 90 5.766 5.749 -10.278 1.00 0.00 H new ATOM 0 HD1 TYR A 90 2.530 7.610 -10.507 1.00 0.00 H new ATOM 0 HD2 TYR A 90 6.524 7.252 -11.944 1.00 0.00 H new ATOM 0 HE1 TYR A 90 2.052 9.277 -12.240 1.00 0.00 H new ATOM 0 HE2 TYR A 90 6.045 8.928 -13.678 1.00 0.00 H new ATOM 0 HH TYR A 90 4.545 10.293 -14.573 1.00 0.00 H new ATOM 1416 N LEU A 91 4.261 3.185 -10.961 1.00 0.00 N ATOM 1417 CA LEU A 91 4.198 2.191 -12.021 1.00 0.00 C ATOM 1418 C LEU A 91 2.762 1.685 -12.164 1.00 0.00 C ATOM 1419 O LEU A 91 2.344 1.258 -13.240 1.00 0.00 O ATOM 1420 CB LEU A 91 5.170 1.041 -11.706 1.00 0.00 C ATOM 1421 CG LEU A 91 5.468 0.064 -12.854 1.00 0.00 C ATOM 1422 CD1 LEU A 91 6.833 -0.576 -12.655 1.00 0.00 C ATOM 1423 CD2 LEU A 91 4.404 -1.020 -12.942 1.00 0.00 C ATOM 0 H LEU A 91 4.829 2.909 -10.160 1.00 0.00 H new ATOM 0 HA LEU A 91 4.496 2.637 -12.970 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.113 1.473 -11.372 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.766 0.472 -10.869 1.00 0.00 H new ATOM 0 HG LEU A 91 5.463 0.629 -13.786 1.00 0.00 H new ATOM 0 HD11 LEU A 91 7.034 -1.266 -13.474 1.00 0.00 H new ATOM 0 HD12 LEU A 91 7.599 0.199 -12.637 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.846 -1.120 -11.711 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.641 -1.697 -13.763 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.377 -1.580 -12.007 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.431 -0.561 -13.119 1.00 0.00 H new ATOM 1435 N ARG A 92 2.002 1.780 -11.078 1.00 0.00 N ATOM 1436 CA ARG A 92 0.621 1.317 -11.062 1.00 0.00 C ATOM 1437 C ARG A 92 -0.336 2.499 -11.219 1.00 0.00 C ATOM 1438 O ARG A 92 -0.962 2.669 -12.264 1.00 0.00 O ATOM 1439 CB ARG A 92 0.328 0.571 -9.758 1.00 0.00 C ATOM 1440 CG ARG A 92 1.476 -0.312 -9.292 1.00 0.00 C ATOM 1441 CD ARG A 92 1.095 -1.128 -8.071 1.00 0.00 C ATOM 1442 NE ARG A 92 0.442 -0.317 -7.045 1.00 0.00 N ATOM 1443 CZ ARG A 92 0.177 -0.750 -5.816 1.00 0.00 C ATOM 1444 NH1 ARG A 92 0.611 -1.934 -5.412 1.00 0.00 N ATOM 1445 NH2 ARG A 92 -0.513 0.012 -4.981 1.00 0.00 N ATOM 0 H ARG A 92 2.322 2.176 -10.194 1.00 0.00 H new ATOM 0 HA ARG A 92 0.473 0.633 -11.898 1.00 0.00 H new ATOM 0 HB2 ARG A 92 0.098 1.296 -8.978 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -0.561 -0.044 -9.893 1.00 0.00 H new ATOM 0 HG2 ARG A 92 1.771 -0.982 -10.100 1.00 0.00 H new ATOM 0 HG3 ARG A 92 2.342 0.308 -9.060 1.00 0.00 H new ATOM 0 HD2 ARG A 92 0.429 -1.937 -8.371 1.00 0.00 H new ATOM 0 HD3 ARG A 92 1.989 -1.590 -7.652 1.00 0.00 H new ATOM 0 HE ARG A 92 0.174 0.637 -7.286 1.00 0.00 H new ATOM 0 HH11 ARG A 92 1.153 -2.522 -6.045 1.00 0.00 H new ATOM 0 HH12 ARG A 92 0.403 -2.258 -4.468 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.841 0.930 -5.281 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -0.717 -0.319 -4.038 1.00 0.00 H new ATOM 1459 N ARG A 93 -0.424 3.330 -10.187 1.00 0.00 N ATOM 1460 CA ARG A 93 -1.289 4.507 -10.216 1.00 0.00 C ATOM 1461 C ARG A 93 -0.481 5.754 -9.893 1.00 0.00 C ATOM 1462 O ARG A 93 0.734 5.682 -9.738 1.00 0.00 O ATOM 1463 CB ARG A 93 -2.453 4.366 -9.234 1.00 0.00 C ATOM 1464 CG ARG A 93 -3.413 3.242 -9.580 1.00 0.00 C ATOM 1465 CD ARG A 93 -4.665 3.298 -8.724 1.00 0.00 C ATOM 1466 NE ARG A 93 -5.462 4.497 -8.988 1.00 0.00 N ATOM 1467 CZ ARG A 93 -6.750 4.616 -8.675 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -7.384 3.621 -8.066 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -7.401 5.739 -8.956 1.00 0.00 N ATOM 0 H ARG A 93 0.094 3.211 -9.316 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.705 4.596 -11.220 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.054 4.196 -8.234 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -3.005 5.306 -9.201 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.687 3.307 -10.633 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -2.917 2.282 -9.439 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -5.271 2.412 -8.912 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -4.384 3.275 -7.671 1.00 0.00 H new ATOM 0 HE ARG A 93 -5.003 5.288 -9.439 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -6.884 2.762 -7.837 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.371 3.715 -7.827 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.914 6.511 -9.412 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -8.388 5.830 -8.716 1.00 0.00 H new ATOM 1483 N GLN A 94 -1.146 6.895 -9.782 1.00 0.00 N ATOM 1484 CA GLN A 94 -0.435 8.148 -9.595 1.00 0.00 C ATOM 1485 C GLN A 94 -1.272 9.191 -8.864 1.00 0.00 C ATOM 1486 O GLN A 94 -2.503 9.112 -8.820 1.00 0.00 O ATOM 1487 CB GLN A 94 0.008 8.713 -10.950 1.00 0.00 C ATOM 1488 CG GLN A 94 -1.132 9.046 -11.909 1.00 0.00 C ATOM 1489 CD GLN A 94 -1.703 7.831 -12.618 1.00 0.00 C ATOM 1490 OE1 GLN A 94 -2.646 7.201 -12.140 1.00 0.00 O ATOM 1491 NE2 GLN A 94 -1.136 7.496 -13.766 1.00 0.00 N ATOM 0 H GLN A 94 -2.162 6.978 -9.818 1.00 0.00 H new ATOM 0 HA GLN A 94 0.435 7.927 -8.977 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.594 9.616 -10.777 1.00 0.00 H new ATOM 0 HB3 GLN A 94 0.669 7.991 -11.430 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -1.929 9.541 -11.355 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -0.773 9.756 -12.654 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -0.356 8.044 -14.129 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -1.479 6.690 -14.288 1.00 0.00 H new ATOM 1500 N ASP A 95 -0.578 10.157 -8.272 1.00 0.00 N ATOM 1501 CA ASP A 95 -1.211 11.354 -7.725 1.00 0.00 C ATOM 1502 C ASP A 95 -1.255 12.403 -8.827 1.00 0.00 C ATOM 1503 O ASP A 95 -2.320 12.883 -9.218 1.00 0.00 O ATOM 1504 CB ASP A 95 -0.422 11.876 -6.517 1.00 0.00 C ATOM 1505 CG ASP A 95 -1.091 13.058 -5.838 1.00 0.00 C ATOM 1506 OD1 ASP A 95 -0.900 14.202 -6.293 1.00 0.00 O ATOM 1507 OD2 ASP A 95 -1.805 12.848 -4.835 1.00 0.00 O ATOM 0 H ASP A 95 0.435 10.134 -8.157 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.220 11.124 -7.383 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -0.300 11.070 -5.794 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.577 12.168 -6.841 1.00 0.00 H new ATOM 1512 N LEU A 96 -0.075 12.736 -9.333 1.00 0.00 N ATOM 1513 CA LEU A 96 0.049 13.505 -10.561 1.00 0.00 C ATOM 1514 C LEU A 96 0.019 12.538 -11.736 1.00 0.00 C ATOM 1515 O LEU A 96 0.860 11.643 -11.806 1.00 0.00 O ATOM 1516 CB LEU A 96 1.364 14.307 -10.593 1.00 0.00 C ATOM 1517 CG LEU A 96 1.459 15.510 -9.644 1.00 0.00 C ATOM 1518 CD1 LEU A 96 0.246 16.413 -9.800 1.00 0.00 C ATOM 1519 CD2 LEU A 96 1.625 15.061 -8.199 1.00 0.00 C ATOM 0 H LEU A 96 0.816 12.482 -8.907 1.00 0.00 H new ATOM 0 HA LEU A 96 -0.776 14.215 -10.618 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.184 13.626 -10.363 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.521 14.663 -11.611 1.00 0.00 H new ATOM 0 HG LEU A 96 2.346 16.083 -9.914 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.333 17.260 -9.119 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.193 16.777 -10.826 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.658 15.851 -9.567 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.689 15.935 -7.551 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.768 14.455 -7.906 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.537 14.471 -8.104 1.00 0.00 H new ATOM 1531 N PRO A 97 -0.952 12.691 -12.659 1.00 0.00 N ATOM 1532 CA PRO A 97 -1.111 11.787 -13.808 1.00 0.00 C ATOM 1533 C PRO A 97 0.211 11.555 -14.524 1.00 0.00 C ATOM 1534 O PRO A 97 0.671 10.421 -14.672 1.00 0.00 O ATOM 1535 CB PRO A 97 -2.089 12.534 -14.713 1.00 0.00 C ATOM 1536 CG PRO A 97 -2.885 13.386 -13.788 1.00 0.00 C ATOM 1537 CD PRO A 97 -1.962 13.764 -12.660 1.00 0.00 C ATOM 0 HA PRO A 97 -1.462 10.797 -13.515 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.562 13.137 -15.452 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -2.728 11.842 -15.262 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -3.257 14.274 -14.300 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.755 12.846 -13.414 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -1.508 14.741 -12.825 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -2.492 13.815 -11.709 1.00 0.00 H new ATOM 1545 N GLU A 98 0.816 12.648 -14.948 1.00 0.00 N ATOM 1546 CA GLU A 98 2.149 12.630 -15.504 1.00 0.00 C ATOM 1547 C GLU A 98 2.986 13.655 -14.770 1.00 0.00 C ATOM 1548 O GLU A 98 2.605 14.825 -14.685 1.00 0.00 O ATOM 1549 CB GLU A 98 2.115 12.951 -16.995 1.00 0.00 C ATOM 1550 CG GLU A 98 1.412 11.897 -17.827 1.00 0.00 C ATOM 1551 CD GLU A 98 1.244 12.325 -19.265 1.00 0.00 C ATOM 1552 OE1 GLU A 98 2.067 13.125 -19.751 1.00 0.00 O ATOM 1553 OE2 GLU A 98 0.285 11.867 -19.920 1.00 0.00 O ATOM 0 H GLU A 98 0.392 13.575 -14.915 1.00 0.00 H new ATOM 0 HA GLU A 98 2.582 11.637 -15.386 1.00 0.00 H new ATOM 0 HB2 GLU A 98 1.616 13.909 -17.141 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.137 13.066 -17.357 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.981 10.968 -17.790 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.433 11.688 -17.395 1.00 0.00 H new ATOM 1560 N ILE A 99 4.104 13.222 -14.217 1.00 0.00 N ATOM 1561 CA ILE A 99 4.958 14.126 -13.474 1.00 0.00 C ATOM 1562 C ILE A 99 5.654 15.072 -14.439 1.00 0.00 C ATOM 1563 O ILE A 99 6.496 14.663 -15.238 1.00 0.00 O ATOM 1564 CB ILE A 99 5.997 13.369 -12.621 1.00 0.00 C ATOM 1565 CG1 ILE A 99 5.289 12.431 -11.639 1.00 0.00 C ATOM 1566 CG2 ILE A 99 6.886 14.351 -11.874 1.00 0.00 C ATOM 1567 CD1 ILE A 99 6.233 11.613 -10.782 1.00 0.00 C ATOM 0 H ILE A 99 4.438 12.260 -14.268 1.00 0.00 H new ATOM 0 HA ILE A 99 4.332 14.695 -12.787 1.00 0.00 H new ATOM 0 HB ILE A 99 6.625 12.772 -13.282 1.00 0.00 H new ATOM 0 HG12 ILE A 99 4.643 13.022 -10.989 1.00 0.00 H new ATOM 0 HG13 ILE A 99 4.644 11.754 -12.199 1.00 0.00 H new ATOM 0 HG21 ILE A 99 7.614 13.801 -11.277 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.409 14.985 -12.590 1.00 0.00 H new ATOM 0 HG23 ILE A 99 6.273 14.971 -11.219 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.656 10.974 -10.113 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.862 10.994 -11.422 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.861 12.281 -10.193 1.00 0.00 H new ATOM 1579 N THR A 100 5.262 16.329 -14.385 1.00 0.00 N ATOM 1580 CA THR A 100 5.762 17.325 -15.310 1.00 0.00 C ATOM 1581 C THR A 100 6.655 18.330 -14.599 1.00 0.00 C ATOM 1582 O THR A 100 6.297 18.873 -13.551 1.00 0.00 O ATOM 1583 CB THR A 100 4.601 18.052 -16.017 1.00 0.00 C ATOM 1584 OG1 THR A 100 3.476 18.161 -15.130 1.00 0.00 O ATOM 1585 CG2 THR A 100 4.184 17.313 -17.279 1.00 0.00 C ATOM 0 H THR A 100 4.593 16.687 -13.704 1.00 0.00 H new ATOM 0 HA THR A 100 6.357 16.808 -16.063 1.00 0.00 H new ATOM 0 HB THR A 100 4.945 19.048 -16.295 1.00 0.00 H new ATOM 0 HG1 THR A 100 2.744 18.626 -15.586 1.00 0.00 H new ATOM 0 HG21 THR A 100 3.363 17.847 -17.759 1.00 0.00 H new ATOM 0 HG22 THR A 100 5.030 17.257 -17.964 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.859 16.305 -17.020 1.00 0.00 H new ATOM 1593 N ALA A 101 7.829 18.552 -15.161 1.00 0.00 N ATOM 1594 CA ALA A 101 8.772 19.499 -14.605 1.00 0.00 C ATOM 1595 C ALA A 101 9.158 20.528 -15.649 1.00 0.00 C ATOM 1596 O ALA A 101 9.658 20.176 -16.719 1.00 0.00 O ATOM 1597 CB ALA A 101 10.007 18.778 -14.087 1.00 0.00 C ATOM 0 H ALA A 101 8.152 18.085 -16.008 1.00 0.00 H new ATOM 0 HA ALA A 101 8.298 20.012 -13.769 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.706 19.505 -13.672 1.00 0.00 H new ATOM 0 HB2 ALA A 101 9.716 18.070 -13.311 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.485 18.241 -14.906 1.00 0.00 H new ATOM 1603 N GLN A 102 8.900 21.790 -15.351 1.00 0.00 N ATOM 1604 CA GLN A 102 9.277 22.869 -16.244 1.00 0.00 C ATOM 1605 C GLN A 102 9.745 24.074 -15.443 1.00 0.00 C ATOM 1606 O GLN A 102 9.200 24.375 -14.379 1.00 0.00 O ATOM 1607 CB GLN A 102 8.113 23.249 -17.169 1.00 0.00 C ATOM 1608 CG GLN A 102 6.916 23.864 -16.463 1.00 0.00 C ATOM 1609 CD GLN A 102 5.773 24.150 -17.415 1.00 0.00 C ATOM 1610 OE1 GLN A 102 5.707 25.218 -18.024 1.00 0.00 O ATOM 1611 NE2 GLN A 102 4.857 23.202 -17.538 1.00 0.00 N ATOM 0 H GLN A 102 8.431 22.091 -14.497 1.00 0.00 H new ATOM 0 HA GLN A 102 10.101 22.526 -16.870 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.477 23.952 -17.918 1.00 0.00 H new ATOM 0 HB3 GLN A 102 7.784 22.357 -17.702 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.573 23.189 -15.679 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.221 24.790 -15.976 1.00 0.00 H new ATOM 0 HE21 GLN A 102 4.950 22.332 -17.015 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.058 23.342 -18.156 1.00 0.00 H new ATOM 1620 N ARG A 103 10.766 24.742 -15.941 1.00 0.00 N ATOM 1621 CA ARG A 103 11.307 25.910 -15.272 1.00 0.00 C ATOM 1622 C ARG A 103 11.448 27.063 -16.252 1.00 0.00 C ATOM 1623 O ARG A 103 12.007 26.906 -17.336 1.00 0.00 O ATOM 1624 CB ARG A 103 12.657 25.584 -14.628 1.00 0.00 C ATOM 1625 CG ARG A 103 13.650 24.931 -15.576 1.00 0.00 C ATOM 1626 CD ARG A 103 15.013 24.778 -14.930 1.00 0.00 C ATOM 1627 NE ARG A 103 15.963 24.103 -15.811 1.00 0.00 N ATOM 1628 CZ ARG A 103 16.724 24.726 -16.708 1.00 0.00 C ATOM 1629 NH1 ARG A 103 16.625 26.042 -16.880 1.00 0.00 N ATOM 1630 NH2 ARG A 103 17.586 24.029 -17.438 1.00 0.00 N ATOM 0 H ARG A 103 11.240 24.495 -16.810 1.00 0.00 H new ATOM 0 HA ARG A 103 10.615 26.208 -14.484 1.00 0.00 H new ATOM 0 HB2 ARG A 103 13.093 26.503 -14.237 1.00 0.00 H new ATOM 0 HB3 ARG A 103 12.492 24.922 -13.778 1.00 0.00 H new ATOM 0 HG2 ARG A 103 13.277 23.952 -15.878 1.00 0.00 H new ATOM 0 HG3 ARG A 103 13.740 25.531 -16.481 1.00 0.00 H new ATOM 0 HD2 ARG A 103 15.401 25.761 -14.664 1.00 0.00 H new ATOM 0 HD3 ARG A 103 14.914 24.213 -14.003 1.00 0.00 H new ATOM 0 HE ARG A 103 16.049 23.090 -15.734 1.00 0.00 H new ATOM 0 HH11 ARG A 103 15.962 26.581 -16.322 1.00 0.00 H new ATOM 0 HH12 ARG A 103 17.212 26.512 -17.569 1.00 0.00 H new ATOM 0 HH21 ARG A 103 17.663 23.020 -17.311 1.00 0.00 H new ATOM 0 HH22 ARG A 103 18.171 24.502 -18.126 1.00 0.00 H new ATOM 1644 N GLN A 104 10.922 28.213 -15.876 1.00 0.00 N ATOM 1645 CA GLN A 104 10.988 29.392 -16.721 1.00 0.00 C ATOM 1646 C GLN A 104 11.561 30.576 -15.953 1.00 0.00 C ATOM 1647 O GLN A 104 11.497 30.623 -14.723 1.00 0.00 O ATOM 1648 CB GLN A 104 9.606 29.720 -17.308 1.00 0.00 C ATOM 1649 CG GLN A 104 8.424 29.334 -16.422 1.00 0.00 C ATOM 1650 CD GLN A 104 8.363 30.113 -15.123 1.00 0.00 C ATOM 1651 OE1 GLN A 104 8.912 29.689 -14.106 1.00 0.00 O ATOM 1652 NE2 GLN A 104 7.686 31.248 -15.148 1.00 0.00 N ATOM 0 H GLN A 104 10.442 28.357 -14.987 1.00 0.00 H new ATOM 0 HA GLN A 104 11.660 29.181 -17.553 1.00 0.00 H new ATOM 0 HB2 GLN A 104 9.557 30.790 -17.508 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.504 29.211 -18.267 1.00 0.00 H new ATOM 0 HG2 GLN A 104 7.498 29.492 -16.975 1.00 0.00 H new ATOM 0 HG3 GLN A 104 8.482 28.269 -16.196 1.00 0.00 H new ATOM 0 HE21 GLN A 104 7.247 31.561 -16.014 1.00 0.00 H new ATOM 0 HE22 GLN A 104 7.603 31.811 -14.301 1.00 0.00 H new ATOM 1661 N LEU A 105 12.144 31.514 -16.679 1.00 0.00 N ATOM 1662 CA LEU A 105 12.783 32.668 -16.066 1.00 0.00 C ATOM 1663 C LEU A 105 12.265 33.952 -16.704 1.00 0.00 C ATOM 1664 O LEU A 105 12.899 35.006 -16.642 1.00 0.00 O ATOM 1665 CB LEU A 105 14.304 32.557 -16.217 1.00 0.00 C ATOM 1666 CG LEU A 105 15.121 33.562 -15.402 1.00 0.00 C ATOM 1667 CD1 LEU A 105 14.807 33.432 -13.919 1.00 0.00 C ATOM 1668 CD2 LEU A 105 16.604 33.359 -15.650 1.00 0.00 C ATOM 0 H LEU A 105 12.189 31.500 -17.698 1.00 0.00 H new ATOM 0 HA LEU A 105 12.541 32.695 -15.003 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.608 31.550 -15.930 1.00 0.00 H new ATOM 0 HB3 LEU A 105 14.557 32.678 -17.270 1.00 0.00 H new ATOM 0 HG LEU A 105 14.849 34.568 -15.722 1.00 0.00 H new ATOM 0 HD11 LEU A 105 15.398 34.155 -13.357 1.00 0.00 H new ATOM 0 HD12 LEU A 105 13.747 33.623 -13.753 1.00 0.00 H new ATOM 0 HD13 LEU A 105 15.051 32.424 -13.582 1.00 0.00 H new ATOM 0 HD21 LEU A 105 17.173 34.081 -15.064 1.00 0.00 H new ATOM 0 HD22 LEU A 105 16.887 32.348 -15.356 1.00 0.00 H new ATOM 0 HD23 LEU A 105 16.819 33.502 -16.709 1.00 0.00 H new ATOM 1680 N ARG A 106 11.097 33.856 -17.315 1.00 0.00 N ATOM 1681 CA ARG A 106 10.471 35.009 -17.934 1.00 0.00 C ATOM 1682 C ARG A 106 9.725 35.821 -16.886 1.00 0.00 C ATOM 1683 O ARG A 106 10.316 36.786 -16.354 1.00 0.00 O ATOM 1684 CB ARG A 106 9.525 34.572 -19.053 1.00 0.00 C ATOM 1685 CG ARG A 106 10.238 33.900 -20.214 1.00 0.00 C ATOM 1686 CD ARG A 106 9.265 33.485 -21.304 1.00 0.00 C ATOM 1687 NE ARG A 106 8.513 34.623 -21.832 1.00 0.00 N ATOM 1688 CZ ARG A 106 7.578 34.525 -22.774 1.00 0.00 C ATOM 1689 NH1 ARG A 106 7.319 33.354 -23.349 1.00 0.00 N ATOM 1690 NH2 ARG A 106 6.917 35.606 -23.160 1.00 0.00 N ATOM 1691 OXT ARG A 106 8.571 35.475 -16.568 1.00 0.00 O ATOM 0 H ARG A 106 10.563 32.990 -17.395 1.00 0.00 H new ATOM 0 HA ARG A 106 11.247 35.635 -18.374 1.00 0.00 H new ATOM 0 HB2 ARG A 106 8.783 33.886 -18.645 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.984 35.443 -19.423 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.981 34.581 -20.629 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.776 33.023 -19.853 1.00 0.00 H new ATOM 0 HD2 ARG A 106 9.813 33.005 -22.115 1.00 0.00 H new ATOM 0 HD3 ARG A 106 8.570 32.745 -20.907 1.00 0.00 H new ATOM 0 HE ARG A 106 8.718 35.548 -21.455 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.839 32.522 -23.069 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.601 33.288 -24.070 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.125 36.510 -22.736 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.200 35.535 -23.882 1.00 0.00 H new TER 1705 ARG A 106