USER MOD reduce.3.24.130724 H: found=0, std=0, add=816, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 813 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 7 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 9 SER OG : rot 69:sc= 0.512 USER MOD Single : A 1 SER N :NH3+ -129:sc= 0.238 (180deg=0.00232) USER MOD Single : A 1 SER OG : rot 180:sc= -3.19! USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot -11:sc= 0.525 USER MOD Single : A 19 GLN : amide:sc= 0.572 K(o=0.57,f=-0.078) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 30:sc= 0.233 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 0.967 K(o=0.97,f=-0.036) USER MOD Single : A 33 SER OG : rot 180:sc= -1.92! USER MOD Single : A 35 MET CE :methyl -148:sc= -1.57 (180deg=-4.32!) USER MOD Single : A 36 SER OG : rot 180:sc= 0.012 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= -0.275 (180deg=-0.275) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -69:sc= 1.17 USER MOD Single : A 41 SER OG : rot -31:sc= 0.118 USER MOD Single : A 42 GLN : amide:sc= -4.73 K(o=-4.7,f=-0.86) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.0911 K(o=-0.091,f=-1.7!) USER MOD Single : A 54 GLN : amide:sc= -1.01 K(o=-1,f=-2.2!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -2.16 K(o=-2.2,f=-1.2) USER MOD Single : A 72 SER OG : rot -48:sc= 0.0106 USER MOD Single : A 78 THR OG1 : rot -56:sc= 1.44 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -53:sc= 0.971 USER MOD Single : A 91 HIS : no HE2:sc=-0.00894 X(o=-0.0089,f=-0.29) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -5.11 K(o=-5.1,f=-4!) USER MOD Single : A 105 MET CE :methyl -172:sc= -0.669 (180deg=-0.728) USER MOD Single : A 107 GLN : amide:sc= -2.98 K(o=-3,f=-1.7) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 3.395 0.262 -2.386 1.00 0.00 N ATOM 2 CA SER A 1 2.407 -0.759 -2.060 1.00 0.00 C ATOM 3 C SER A 1 2.804 -2.108 -2.652 1.00 0.00 C ATOM 4 O SER A 1 3.731 -2.197 -3.459 1.00 0.00 O ATOM 5 CB SER A 1 1.028 -0.348 -2.579 1.00 0.00 C ATOM 6 OG SER A 1 1.129 0.311 -3.829 1.00 0.00 O ATOM 0 H1 SER A 1 3.682 0.757 -1.518 1.00 0.00 H new ATOM 0 H2 SER A 1 4.227 -0.186 -2.820 1.00 0.00 H new ATOM 0 H3 SER A 1 2.982 0.944 -3.053 1.00 0.00 H new ATOM 0 HA SER A 1 2.365 -0.856 -0.975 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.396 -1.230 -2.680 1.00 0.00 H new ATOM 0 HB3 SER A 1 0.545 0.309 -1.856 1.00 0.00 H new ATOM 0 HG SER A 1 0.234 0.562 -4.140 1.00 0.00 H new ATOM 12 N LEU A 2 2.097 -3.156 -2.245 1.00 0.00 N ATOM 13 CA LEU A 2 2.374 -4.502 -2.734 1.00 0.00 C ATOM 14 C LEU A 2 1.200 -5.435 -2.455 1.00 0.00 C ATOM 15 O LEU A 2 0.693 -6.101 -3.359 1.00 0.00 O ATOM 16 CB LEU A 2 3.643 -5.052 -2.080 1.00 0.00 C ATOM 17 CG LEU A 2 4.127 -6.410 -2.591 1.00 0.00 C ATOM 18 CD1 LEU A 2 5.586 -6.332 -3.013 1.00 0.00 C ATOM 19 CD2 LEU A 2 3.935 -7.480 -1.527 1.00 0.00 C ATOM 0 H LEU A 2 1.328 -3.100 -1.578 1.00 0.00 H new ATOM 0 HA LEU A 2 2.522 -4.447 -3.812 1.00 0.00 H new ATOM 0 HB2 LEU A 2 4.444 -4.327 -2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 2 3.470 -5.131 -1.007 1.00 0.00 H new ATOM 0 HG LEU A 2 3.531 -6.682 -3.463 1.00 0.00 H new ATOM 0 HD11 LEU A 2 5.913 -7.307 -3.374 1.00 0.00 H new ATOM 0 HD12 LEU A 2 5.696 -5.595 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 2 6.196 -6.038 -2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 2 4.285 -8.439 -1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.505 -7.214 -0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 2 2.878 -7.555 -1.273 1.00 0.00 H new ATOM 31 N THR A 3 0.769 -5.478 -1.198 1.00 0.00 N ATOM 32 CA THR A 3 -0.346 -6.328 -0.800 1.00 0.00 C ATOM 33 C THR A 3 -1.616 -5.509 -0.599 1.00 0.00 C ATOM 34 O THR A 3 -2.641 -6.034 -0.162 1.00 0.00 O ATOM 35 CB THR A 3 -0.032 -7.095 0.498 1.00 0.00 C ATOM 36 OG1 THR A 3 -0.189 -6.230 1.629 1.00 0.00 O ATOM 37 CG2 THR A 3 1.385 -7.649 0.470 1.00 0.00 C ATOM 0 H THR A 3 1.176 -4.933 -0.438 1.00 0.00 H new ATOM 0 HA THR A 3 -0.502 -7.044 -1.607 1.00 0.00 H new ATOM 0 HB THR A 3 -0.730 -7.928 0.579 1.00 0.00 H new ATOM 0 HG1 THR A 3 0.011 -6.726 2.450 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.584 -8.187 1.397 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.493 -8.330 -0.374 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.095 -6.828 0.367 1.00 0.00 H new ATOM 45 N ASP A 4 -1.542 -4.223 -0.920 1.00 0.00 N ATOM 46 CA ASP A 4 -2.688 -3.332 -0.776 1.00 0.00 C ATOM 47 C ASP A 4 -3.840 -3.779 -1.671 1.00 0.00 C ATOM 48 O ASP A 4 -4.827 -4.339 -1.195 1.00 0.00 O ATOM 49 CB ASP A 4 -2.289 -1.895 -1.116 1.00 0.00 C ATOM 50 CG ASP A 4 -3.478 -0.954 -1.136 1.00 0.00 C ATOM 51 OD1 ASP A 4 -3.938 -0.555 -0.045 1.00 0.00 O ATOM 52 OD2 ASP A 4 -3.947 -0.615 -2.242 1.00 0.00 O ATOM 0 H ASP A 4 -0.701 -3.773 -1.282 1.00 0.00 H new ATOM 0 HA ASP A 4 -3.021 -3.373 0.261 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -1.561 -1.541 -0.386 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -1.799 -1.878 -2.089 1.00 0.00 H new ATOM 57 N ILE A 5 -3.706 -3.526 -2.969 1.00 0.00 N ATOM 58 CA ILE A 5 -4.736 -3.902 -3.929 1.00 0.00 C ATOM 59 C ILE A 5 -4.850 -5.418 -4.047 1.00 0.00 C ATOM 60 O ILE A 5 -5.899 -5.946 -4.419 1.00 0.00 O ATOM 61 CB ILE A 5 -4.449 -3.310 -5.322 1.00 0.00 C ATOM 62 CG1 ILE A 5 -5.758 -2.940 -6.022 1.00 0.00 C ATOM 63 CG2 ILE A 5 -3.654 -4.297 -6.163 1.00 0.00 C ATOM 64 CD1 ILE A 5 -5.803 -1.505 -6.500 1.00 0.00 C ATOM 0 H ILE A 5 -2.895 -3.063 -3.379 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.677 -3.497 -3.558 1.00 0.00 H new ATOM 0 HB ILE A 5 -3.855 -2.404 -5.200 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.905 -3.603 -6.874 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.588 -3.113 -5.337 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -3.459 -3.864 -7.144 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -2.708 -4.517 -5.669 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.225 -5.218 -6.279 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.759 -1.313 -6.986 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.688 -0.834 -5.649 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.994 -1.332 -7.210 1.00 0.00 H new ATOM 76 N LEU A 6 -3.765 -6.114 -3.727 1.00 0.00 N ATOM 77 CA LEU A 6 -3.743 -7.571 -3.795 1.00 0.00 C ATOM 78 C LEU A 6 -3.985 -8.184 -2.419 1.00 0.00 C ATOM 79 O LEU A 6 -4.343 -7.485 -1.472 1.00 0.00 O ATOM 80 CB LEU A 6 -2.403 -8.055 -4.352 1.00 0.00 C ATOM 81 CG LEU A 6 -2.466 -8.848 -5.658 1.00 0.00 C ATOM 82 CD1 LEU A 6 -1.318 -8.458 -6.576 1.00 0.00 C ATOM 83 CD2 LEU A 6 -2.442 -10.343 -5.377 1.00 0.00 C ATOM 0 H LEU A 6 -2.889 -5.693 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.544 -7.891 -4.461 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -1.762 -7.187 -4.508 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -1.921 -8.675 -3.596 1.00 0.00 H new ATOM 0 HG LEU A 6 -3.403 -8.608 -6.160 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -1.380 -9.033 -7.500 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -1.381 -7.394 -6.805 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.369 -8.667 -6.081 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -2.488 -10.891 -6.318 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -1.522 -10.600 -4.852 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -3.299 -10.611 -4.759 1.00 0.00 H new ATOM 95 N SER A 7 -3.786 -9.494 -2.317 1.00 0.00 N ATOM 96 CA SER A 7 -3.985 -10.202 -1.058 1.00 0.00 C ATOM 97 C SER A 7 -2.659 -10.721 -0.512 1.00 0.00 C ATOM 98 O SER A 7 -1.962 -11.512 -1.148 1.00 0.00 O ATOM 99 CB SER A 7 -4.961 -11.365 -1.250 1.00 0.00 C ATOM 100 OG SER A 7 -5.655 -11.651 -0.049 1.00 0.00 O ATOM 0 H SER A 7 -3.487 -10.087 -3.091 1.00 0.00 H new ATOM 0 HA SER A 7 -4.405 -9.500 -0.338 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.675 -11.119 -2.036 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.417 -12.250 -1.579 1.00 0.00 H new ATOM 0 HG SER A 7 -6.273 -12.396 -0.198 1.00 0.00 H new ATOM 106 N PRO A 8 -2.299 -10.266 0.698 1.00 0.00 N ATOM 107 CA PRO A 8 -1.055 -10.671 1.358 1.00 0.00 C ATOM 108 C PRO A 8 -1.084 -12.128 1.807 1.00 0.00 C ATOM 109 O PRO A 8 -0.042 -12.729 2.068 1.00 0.00 O ATOM 110 CB PRO A 8 -0.977 -9.740 2.571 1.00 0.00 C ATOM 111 CG PRO A 8 -2.391 -9.363 2.850 1.00 0.00 C ATOM 112 CD PRO A 8 -3.080 -9.322 1.514 1.00 0.00 C ATOM 0 HA PRO A 8 -0.197 -10.596 0.690 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -0.525 -10.241 3.427 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -0.368 -8.862 2.358 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.865 -10.088 3.511 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.446 -8.395 3.347 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.124 -9.626 1.591 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -3.070 -8.319 1.088 1.00 0.00 H new ATOM 120 N SER A 9 -2.285 -12.692 1.894 1.00 0.00 N ATOM 121 CA SER A 9 -2.450 -14.078 2.315 1.00 0.00 C ATOM 122 C SER A 9 -2.536 -15.006 1.107 1.00 0.00 C ATOM 123 O SER A 9 -3.134 -16.080 1.176 1.00 0.00 O ATOM 124 CB SER A 9 -3.705 -14.226 3.177 1.00 0.00 C ATOM 125 OG SER A 9 -4.852 -14.444 2.373 1.00 0.00 O ATOM 0 H SER A 9 -3.158 -12.210 1.678 1.00 0.00 H new ATOM 0 HA SER A 9 -1.578 -14.359 2.906 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.579 -15.058 3.869 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.844 -13.328 3.780 1.00 0.00 H new ATOM 0 HG SER A 9 -4.796 -15.329 1.957 1.00 0.00 H new ATOM 131 N ASP A 10 -1.936 -14.582 0.000 1.00 0.00 N ATOM 132 CA ASP A 10 -1.944 -15.374 -1.225 1.00 0.00 C ATOM 133 C ASP A 10 -0.564 -15.383 -1.875 1.00 0.00 C ATOM 134 O ASP A 10 -0.144 -16.387 -2.450 1.00 0.00 O ATOM 135 CB ASP A 10 -2.980 -14.825 -2.206 1.00 0.00 C ATOM 136 CG ASP A 10 -4.270 -15.622 -2.193 1.00 0.00 C ATOM 137 OD1 ASP A 10 -4.229 -16.822 -2.536 1.00 0.00 O ATOM 138 OD2 ASP A 10 -5.320 -15.045 -1.841 1.00 0.00 O ATOM 0 H ASP A 10 -1.438 -13.695 -0.074 1.00 0.00 H new ATOM 0 HA ASP A 10 -2.210 -16.398 -0.964 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -3.196 -13.786 -1.958 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.562 -14.832 -3.213 1.00 0.00 H new ATOM 143 N ILE A 11 0.136 -14.257 -1.780 1.00 0.00 N ATOM 144 CA ILE A 11 1.468 -14.135 -2.359 1.00 0.00 C ATOM 145 C ILE A 11 2.413 -15.190 -1.792 1.00 0.00 C ATOM 146 O ILE A 11 3.273 -15.712 -2.499 1.00 0.00 O ATOM 147 CB ILE A 11 2.066 -12.738 -2.108 1.00 0.00 C ATOM 148 CG1 ILE A 11 1.173 -11.659 -2.724 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.475 -12.655 -2.676 1.00 0.00 C ATOM 150 CD1 ILE A 11 1.227 -10.338 -1.990 1.00 0.00 C ATOM 0 H ILE A 11 -0.197 -13.417 -1.308 1.00 0.00 H new ATOM 0 HA ILE A 11 1.360 -14.287 -3.433 1.00 0.00 H new ATOM 0 HB ILE A 11 2.118 -12.569 -1.032 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.470 -11.502 -3.761 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.143 -12.016 -2.738 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.884 -11.662 -2.491 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.106 -13.403 -2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.446 -12.841 -3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.570 -9.621 -2.482 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.901 -10.481 -0.960 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.249 -9.959 -1.998 1.00 0.00 H new ATOM 162 N ALA A 12 2.244 -15.498 -0.510 1.00 0.00 N ATOM 163 CA ALA A 12 3.079 -16.493 0.152 1.00 0.00 C ATOM 164 C ALA A 12 2.775 -17.896 -0.363 1.00 0.00 C ATOM 165 O ALA A 12 3.657 -18.751 -0.419 1.00 0.00 O ATOM 166 CB ALA A 12 2.881 -16.429 1.660 1.00 0.00 C ATOM 0 H ALA A 12 1.537 -15.073 0.090 1.00 0.00 H new ATOM 0 HA ALA A 12 4.120 -16.267 -0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.510 -17.177 2.142 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.155 -15.438 2.021 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.836 -16.626 1.898 1.00 0.00 H new ATOM 172 N ALA A 13 1.521 -18.124 -0.739 1.00 0.00 N ATOM 173 CA ALA A 13 1.101 -19.423 -1.251 1.00 0.00 C ATOM 174 C ALA A 13 1.692 -19.685 -2.632 1.00 0.00 C ATOM 175 O ALA A 13 1.702 -20.820 -3.108 1.00 0.00 O ATOM 176 CB ALA A 13 -0.417 -19.505 -1.300 1.00 0.00 C ATOM 0 H ALA A 13 0.778 -17.426 -0.699 1.00 0.00 H new ATOM 0 HA ALA A 13 1.473 -20.191 -0.573 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.716 -20.480 -1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.821 -19.371 -0.297 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.803 -18.723 -1.954 1.00 0.00 H new ATOM 182 N ALA A 14 2.182 -18.628 -3.271 1.00 0.00 N ATOM 183 CA ALA A 14 2.775 -18.744 -4.598 1.00 0.00 C ATOM 184 C ALA A 14 4.296 -18.815 -4.514 1.00 0.00 C ATOM 185 O ALA A 14 4.925 -19.659 -5.154 1.00 0.00 O ATOM 186 CB ALA A 14 2.346 -17.576 -5.472 1.00 0.00 C ATOM 0 H ALA A 14 2.180 -17.681 -2.891 1.00 0.00 H new ATOM 0 HA ALA A 14 2.418 -19.670 -5.049 1.00 0.00 H new ATOM 0 HB1 ALA A 14 2.796 -17.676 -6.460 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.260 -17.572 -5.567 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.674 -16.641 -5.017 1.00 0.00 H new ATOM 192 N LEU A 15 4.882 -17.923 -3.723 1.00 0.00 N ATOM 193 CA LEU A 15 6.331 -17.884 -3.556 1.00 0.00 C ATOM 194 C LEU A 15 6.857 -19.220 -3.042 1.00 0.00 C ATOM 195 O LEU A 15 8.043 -19.523 -3.172 1.00 0.00 O ATOM 196 CB LEU A 15 6.723 -16.763 -2.592 1.00 0.00 C ATOM 197 CG LEU A 15 6.488 -15.337 -3.089 1.00 0.00 C ATOM 198 CD1 LEU A 15 6.726 -14.335 -1.970 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.386 -15.032 -4.280 1.00 0.00 C ATOM 0 H LEU A 15 4.377 -17.217 -3.187 1.00 0.00 H new ATOM 0 HA LEU A 15 6.779 -17.690 -4.531 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.168 -16.899 -1.664 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.780 -16.872 -2.350 1.00 0.00 H new ATOM 0 HG LEU A 15 5.450 -15.252 -3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.554 -13.325 -2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.041 -14.539 -1.147 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.754 -14.421 -1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.205 -14.012 -4.621 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.430 -15.136 -3.985 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.167 -15.729 -5.089 1.00 0.00 H new ATOM 211 N ARG A 16 5.966 -20.016 -2.459 1.00 0.00 N ATOM 212 CA ARG A 16 6.340 -21.320 -1.926 1.00 0.00 C ATOM 213 C ARG A 16 5.970 -22.433 -2.903 1.00 0.00 C ATOM 214 O ARG A 16 6.739 -23.372 -3.110 1.00 0.00 O ATOM 215 CB ARG A 16 5.655 -21.560 -0.580 1.00 0.00 C ATOM 216 CG ARG A 16 6.379 -22.564 0.302 1.00 0.00 C ATOM 217 CD ARG A 16 5.930 -23.987 0.010 1.00 0.00 C ATOM 218 NE ARG A 16 4.545 -24.218 0.412 1.00 0.00 N ATOM 219 CZ ARG A 16 3.808 -25.229 -0.034 1.00 0.00 C ATOM 220 NH1 ARG A 16 4.322 -26.099 -0.893 1.00 0.00 N ATOM 221 NH2 ARG A 16 2.555 -25.372 0.378 1.00 0.00 N ATOM 0 H ARG A 16 4.980 -19.780 -2.344 1.00 0.00 H new ATOM 0 HA ARG A 16 7.421 -21.330 -1.783 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.577 -20.612 -0.048 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.638 -21.911 -0.757 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.454 -22.481 0.143 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.193 -22.330 1.350 1.00 0.00 H new ATOM 0 HD2 ARG A 16 6.036 -24.189 -1.056 1.00 0.00 H new ATOM 0 HD3 ARG A 16 6.581 -24.687 0.534 1.00 0.00 H new ATOM 0 HE ARG A 16 4.120 -23.567 1.072 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.285 -25.992 -1.212 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.754 -26.875 -1.234 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.156 -24.705 1.038 1.00 0.00 H new ATOM 0 HH22 ARG A 16 1.991 -26.149 0.034 1.00 0.00 H new ATOM 235 N ASP A 17 4.788 -22.321 -3.498 1.00 0.00 N ATOM 236 CA ASP A 17 4.315 -23.317 -4.453 1.00 0.00 C ATOM 237 C ASP A 17 5.332 -23.524 -5.571 1.00 0.00 C ATOM 238 O ASP A 17 5.640 -24.657 -5.942 1.00 0.00 O ATOM 239 CB ASP A 17 2.970 -22.891 -5.043 1.00 0.00 C ATOM 240 CG ASP A 17 2.395 -23.931 -5.985 1.00 0.00 C ATOM 241 OD1 ASP A 17 3.014 -25.006 -6.130 1.00 0.00 O ATOM 242 OD2 ASP A 17 1.327 -23.670 -6.575 1.00 0.00 O ATOM 0 H ASP A 17 4.139 -21.551 -3.336 1.00 0.00 H new ATOM 0 HA ASP A 17 4.188 -24.261 -3.923 1.00 0.00 H new ATOM 0 HB2 ASP A 17 2.263 -22.708 -4.234 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.093 -21.949 -5.578 1.00 0.00 H new ATOM 247 N CYS A 18 5.850 -22.422 -6.104 1.00 0.00 N ATOM 248 CA CYS A 18 6.832 -22.483 -7.181 1.00 0.00 C ATOM 249 C CYS A 18 8.158 -21.870 -6.743 1.00 0.00 C ATOM 250 O CYS A 18 8.827 -21.193 -7.524 1.00 0.00 O ATOM 251 CB CYS A 18 6.305 -21.758 -8.420 1.00 0.00 C ATOM 252 SG CYS A 18 5.620 -20.119 -8.081 1.00 0.00 S ATOM 0 H CYS A 18 5.606 -21.477 -5.808 1.00 0.00 H new ATOM 0 HA CYS A 18 7.001 -23.531 -7.427 1.00 0.00 H new ATOM 0 HB2 CYS A 18 7.116 -21.659 -9.142 1.00 0.00 H new ATOM 0 HB3 CYS A 18 5.535 -22.372 -8.887 1.00 0.00 H new ATOM 0 HG CYS A 18 5.491 -19.960 -6.797 1.00 0.00 H new ATOM 258 N GLN A 19 8.530 -22.110 -5.490 1.00 0.00 N ATOM 259 CA GLN A 19 9.775 -21.579 -4.948 1.00 0.00 C ATOM 260 C GLN A 19 10.978 -22.139 -5.699 1.00 0.00 C ATOM 261 O GLN A 19 12.082 -21.602 -5.611 1.00 0.00 O ATOM 262 CB GLN A 19 9.889 -21.909 -3.459 1.00 0.00 C ATOM 263 CG GLN A 19 10.216 -23.368 -3.182 1.00 0.00 C ATOM 264 CD GLN A 19 10.036 -23.740 -1.724 1.00 0.00 C ATOM 265 OE1 GLN A 19 11.005 -23.822 -0.968 1.00 0.00 O ATOM 266 NE2 GLN A 19 8.792 -23.967 -1.319 1.00 0.00 N ATOM 0 H GLN A 19 7.987 -22.669 -4.831 1.00 0.00 H new ATOM 0 HA GLN A 19 9.764 -20.496 -5.073 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.661 -21.282 -3.014 1.00 0.00 H new ATOM 0 HB3 GLN A 19 8.950 -21.656 -2.966 1.00 0.00 H new ATOM 0 HG2 GLN A 19 9.577 -24.002 -3.796 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.245 -23.568 -3.480 1.00 0.00 H new ATOM 0 HE21 GLN A 19 8.018 -23.888 -1.979 1.00 0.00 H new ATOM 0 HE22 GLN A 19 8.610 -24.220 -0.348 1.00 0.00 H new ATOM 275 N ALA A 20 10.757 -23.222 -6.437 1.00 0.00 N ATOM 276 CA ALA A 20 11.823 -23.854 -7.205 1.00 0.00 C ATOM 277 C ALA A 20 12.189 -23.018 -8.426 1.00 0.00 C ATOM 278 O ALA A 20 11.418 -22.176 -8.887 1.00 0.00 O ATOM 279 CB ALA A 20 11.409 -25.256 -7.627 1.00 0.00 C ATOM 0 H ALA A 20 9.849 -23.680 -6.519 1.00 0.00 H new ATOM 0 HA ALA A 20 12.705 -23.924 -6.568 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.214 -25.716 -8.200 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.204 -25.857 -6.741 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.512 -25.200 -8.243 1.00 0.00 H new ATOM 285 N PRO A 21 13.396 -23.252 -8.964 1.00 0.00 N ATOM 286 CA PRO A 21 13.892 -22.530 -10.140 1.00 0.00 C ATOM 287 C PRO A 21 13.142 -22.909 -11.412 1.00 0.00 C ATOM 288 O PRO A 21 12.869 -24.084 -11.656 1.00 0.00 O ATOM 289 CB PRO A 21 15.356 -22.966 -10.232 1.00 0.00 C ATOM 290 CG PRO A 21 15.398 -24.296 -9.560 1.00 0.00 C ATOM 291 CD PRO A 21 14.367 -24.240 -8.467 1.00 0.00 C ATOM 0 HA PRO A 21 13.759 -21.452 -10.043 1.00 0.00 H new ATOM 0 HB2 PRO A 21 15.684 -23.036 -11.269 1.00 0.00 H new ATOM 0 HB3 PRO A 21 16.014 -22.251 -9.737 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.176 -25.097 -10.265 1.00 0.00 H new ATOM 0 HG3 PRO A 21 16.389 -24.496 -9.152 1.00 0.00 H new ATOM 0 HD2 PRO A 21 13.903 -25.212 -8.303 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.804 -23.931 -7.518 1.00 0.00 H new ATOM 299 N ASP A 22 12.813 -21.907 -12.220 1.00 0.00 N ATOM 300 CA ASP A 22 12.096 -22.136 -13.469 1.00 0.00 C ATOM 301 C ASP A 22 10.703 -22.699 -13.201 1.00 0.00 C ATOM 302 O ASP A 22 10.081 -23.288 -14.084 1.00 0.00 O ATOM 303 CB ASP A 22 12.882 -23.094 -14.365 1.00 0.00 C ATOM 304 CG ASP A 22 14.381 -22.898 -14.247 1.00 0.00 C ATOM 305 OD1 ASP A 22 14.821 -21.733 -14.151 1.00 0.00 O ATOM 306 OD2 ASP A 22 15.114 -23.909 -14.252 1.00 0.00 O ATOM 0 H ASP A 22 13.031 -20.928 -12.032 1.00 0.00 H new ATOM 0 HA ASP A 22 11.990 -21.178 -13.979 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.631 -24.122 -14.102 1.00 0.00 H new ATOM 0 HB3 ASP A 22 12.580 -22.948 -15.402 1.00 0.00 H new ATOM 311 N SER A 23 10.221 -22.513 -11.976 1.00 0.00 N ATOM 312 CA SER A 23 8.905 -23.006 -11.590 1.00 0.00 C ATOM 313 C SER A 23 7.922 -21.852 -11.414 1.00 0.00 C ATOM 314 O SER A 23 6.707 -22.040 -11.485 1.00 0.00 O ATOM 315 CB SER A 23 8.999 -23.813 -10.293 1.00 0.00 C ATOM 316 OG SER A 23 7.718 -24.245 -9.867 1.00 0.00 O ATOM 0 H SER A 23 10.723 -22.024 -11.234 1.00 0.00 H new ATOM 0 HA SER A 23 8.539 -23.654 -12.387 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.646 -24.677 -10.445 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.458 -23.204 -9.514 1.00 0.00 H new ATOM 0 HG SER A 23 7.805 -24.759 -9.038 1.00 0.00 H new ATOM 322 N PHE A 24 8.457 -20.658 -11.185 1.00 0.00 N ATOM 323 CA PHE A 24 7.629 -19.472 -10.998 1.00 0.00 C ATOM 324 C PHE A 24 7.471 -18.707 -12.309 1.00 0.00 C ATOM 325 O PHE A 24 8.397 -18.642 -13.118 1.00 0.00 O ATOM 326 CB PHE A 24 8.240 -18.560 -9.933 1.00 0.00 C ATOM 327 CG PHE A 24 7.680 -17.167 -9.943 1.00 0.00 C ATOM 328 CD1 PHE A 24 6.326 -16.949 -9.746 1.00 0.00 C ATOM 329 CD2 PHE A 24 8.507 -16.075 -10.151 1.00 0.00 C ATOM 330 CE1 PHE A 24 5.807 -15.668 -9.755 1.00 0.00 C ATOM 331 CE2 PHE A 24 7.993 -14.791 -10.161 1.00 0.00 C ATOM 332 CZ PHE A 24 6.642 -14.588 -9.964 1.00 0.00 C ATOM 0 H PHE A 24 9.460 -20.485 -11.124 1.00 0.00 H new ATOM 0 HA PHE A 24 6.643 -19.797 -10.666 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.076 -19.002 -8.950 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.318 -18.510 -10.084 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.668 -17.790 -9.583 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.565 -16.228 -10.307 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.750 -15.512 -9.599 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.648 -13.948 -10.323 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.239 -13.586 -9.973 1.00 0.00 H new ATOM 342 N SER A 25 6.291 -18.131 -12.512 1.00 0.00 N ATOM 343 CA SER A 25 6.008 -17.374 -13.726 1.00 0.00 C ATOM 344 C SER A 25 4.904 -16.350 -13.483 1.00 0.00 C ATOM 345 O SER A 25 4.125 -16.451 -12.535 1.00 0.00 O ATOM 346 CB SER A 25 5.603 -18.319 -14.859 1.00 0.00 C ATOM 347 OG SER A 25 6.742 -18.818 -15.538 1.00 0.00 O ATOM 0 H SER A 25 5.515 -18.174 -11.851 1.00 0.00 H new ATOM 0 HA SER A 25 6.915 -16.843 -14.013 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.024 -19.149 -14.455 1.00 0.00 H new ATOM 0 HB3 SER A 25 4.958 -17.793 -15.563 1.00 0.00 H new ATOM 0 HG SER A 25 7.499 -18.864 -14.917 1.00 0.00 H new ATOM 353 N PRO A 26 4.833 -15.338 -14.361 1.00 0.00 N ATOM 354 CA PRO A 26 3.828 -14.275 -14.264 1.00 0.00 C ATOM 355 C PRO A 26 2.422 -14.776 -14.579 1.00 0.00 C ATOM 356 O PRO A 26 1.449 -14.369 -13.944 1.00 0.00 O ATOM 357 CB PRO A 26 4.282 -13.260 -15.316 1.00 0.00 C ATOM 358 CG PRO A 26 5.060 -14.060 -16.303 1.00 0.00 C ATOM 359 CD PRO A 26 5.728 -15.153 -15.515 1.00 0.00 C ATOM 0 HA PRO A 26 3.765 -13.865 -13.256 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.430 -12.770 -15.787 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.895 -12.476 -14.871 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.407 -14.475 -17.070 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.797 -13.440 -16.813 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.824 -16.068 -16.099 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.732 -14.867 -15.203 1.00 0.00 H new ATOM 367 N LYS A 27 2.322 -15.662 -15.564 1.00 0.00 N ATOM 368 CA LYS A 27 1.036 -16.221 -15.963 1.00 0.00 C ATOM 369 C LYS A 27 0.751 -17.520 -15.215 1.00 0.00 C ATOM 370 O LYS A 27 0.143 -18.442 -15.759 1.00 0.00 O ATOM 371 CB LYS A 27 1.013 -16.475 -17.472 1.00 0.00 C ATOM 372 CG LYS A 27 1.918 -17.612 -17.912 1.00 0.00 C ATOM 373 CD LYS A 27 2.463 -17.383 -19.312 1.00 0.00 C ATOM 374 CE LYS A 27 3.300 -18.561 -19.785 1.00 0.00 C ATOM 375 NZ LYS A 27 2.453 -19.685 -20.269 1.00 0.00 N ATOM 0 H LYS A 27 3.117 -16.009 -16.101 1.00 0.00 H new ATOM 0 HA LYS A 27 0.260 -15.498 -15.710 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.009 -16.696 -17.779 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.311 -15.563 -17.990 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.746 -17.711 -17.210 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.364 -18.550 -17.886 1.00 0.00 H new ATOM 0 HD2 LYS A 27 1.636 -17.222 -20.004 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.069 -16.477 -19.324 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.964 -18.236 -20.586 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.932 -18.909 -18.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 3.061 -20.468 -20.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.837 -20.012 -19.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.868 -19.361 -21.066 1.00 0.00 H new ATOM 389 N LYS A 28 1.193 -17.585 -13.964 1.00 0.00 N ATOM 390 CA LYS A 28 0.984 -18.769 -13.139 1.00 0.00 C ATOM 391 C LYS A 28 0.598 -18.380 -11.716 1.00 0.00 C ATOM 392 O LYS A 28 -0.268 -19.005 -11.103 1.00 0.00 O ATOM 393 CB LYS A 28 2.248 -19.632 -13.118 1.00 0.00 C ATOM 394 CG LYS A 28 2.038 -21.004 -12.503 1.00 0.00 C ATOM 395 CD LYS A 28 1.387 -21.962 -13.486 1.00 0.00 C ATOM 396 CE LYS A 28 1.262 -23.361 -12.901 1.00 0.00 C ATOM 397 NZ LYS A 28 0.861 -24.359 -13.932 1.00 0.00 N ATOM 0 H LYS A 28 1.699 -16.831 -13.499 1.00 0.00 H new ATOM 0 HA LYS A 28 0.166 -19.344 -13.574 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.612 -19.752 -14.138 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.026 -19.109 -12.561 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.997 -21.409 -12.179 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.414 -20.914 -11.614 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.399 -21.590 -13.758 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.976 -22.001 -14.402 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.214 -23.657 -12.460 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.526 -23.354 -12.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.787 -25.299 -13.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.059 -24.091 -14.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.576 -24.384 -14.687 1.00 0.00 H new ATOM 411 N PHE A 29 1.245 -17.342 -11.195 1.00 0.00 N ATOM 412 CA PHE A 29 0.969 -16.868 -9.844 1.00 0.00 C ATOM 413 C PHE A 29 -0.231 -15.926 -9.833 1.00 0.00 C ATOM 414 O PHE A 29 -0.792 -15.629 -8.777 1.00 0.00 O ATOM 415 CB PHE A 29 2.196 -16.157 -9.269 1.00 0.00 C ATOM 416 CG PHE A 29 2.255 -14.695 -9.609 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.422 -14.282 -10.921 1.00 0.00 C ATOM 418 CD2 PHE A 29 2.143 -13.735 -8.617 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.478 -12.937 -11.236 1.00 0.00 C ATOM 420 CE2 PHE A 29 2.197 -12.389 -8.926 1.00 0.00 C ATOM 421 CZ PHE A 29 2.364 -11.990 -10.237 1.00 0.00 C ATOM 0 H PHE A 29 1.964 -16.813 -11.688 1.00 0.00 H new ATOM 0 HA PHE A 29 0.735 -17.733 -9.223 1.00 0.00 H new ATOM 0 HB2 PHE A 29 2.197 -16.270 -8.185 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.097 -16.645 -9.641 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.509 -15.019 -11.706 1.00 0.00 H new ATOM 0 HD2 PHE A 29 2.012 -14.042 -7.590 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.611 -12.627 -12.262 1.00 0.00 H new ATOM 0 HE2 PHE A 29 2.109 -11.650 -8.143 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.405 -10.939 -10.481 1.00 0.00 H new ATOM 431 N PHE A 30 -0.620 -15.458 -11.014 1.00 0.00 N ATOM 432 CA PHE A 30 -1.752 -14.548 -11.141 1.00 0.00 C ATOM 433 C PHE A 30 -2.998 -15.135 -10.485 1.00 0.00 C ATOM 434 O PHE A 30 -3.878 -14.402 -10.034 1.00 0.00 O ATOM 435 CB PHE A 30 -2.030 -14.249 -12.616 1.00 0.00 C ATOM 436 CG PHE A 30 -2.691 -15.385 -13.343 1.00 0.00 C ATOM 437 CD1 PHE A 30 -1.982 -16.535 -13.649 1.00 0.00 C ATOM 438 CD2 PHE A 30 -4.022 -15.302 -13.721 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.587 -17.583 -14.318 1.00 0.00 C ATOM 440 CE2 PHE A 30 -4.632 -16.347 -14.390 1.00 0.00 C ATOM 441 CZ PHE A 30 -3.914 -17.488 -14.690 1.00 0.00 C ATOM 0 H PHE A 30 -0.168 -15.694 -11.897 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.498 -13.619 -10.631 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.664 -13.365 -12.686 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.090 -14.008 -13.113 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.944 -16.614 -13.362 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.588 -14.412 -13.491 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.023 -18.474 -14.549 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -5.670 -16.271 -14.678 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.389 -18.304 -15.214 1.00 0.00 H new ATOM 451 N GLN A 31 -3.065 -16.462 -10.438 1.00 0.00 N ATOM 452 CA GLN A 31 -4.204 -17.148 -9.839 1.00 0.00 C ATOM 453 C GLN A 31 -3.975 -17.384 -8.350 1.00 0.00 C ATOM 454 O GLN A 31 -4.923 -17.424 -7.565 1.00 0.00 O ATOM 455 CB GLN A 31 -4.453 -18.481 -10.547 1.00 0.00 C ATOM 456 CG GLN A 31 -3.550 -19.604 -10.065 1.00 0.00 C ATOM 457 CD GLN A 31 -3.366 -20.692 -11.104 1.00 0.00 C ATOM 458 OE1 GLN A 31 -4.338 -21.248 -11.617 1.00 0.00 O ATOM 459 NE2 GLN A 31 -2.114 -21.002 -11.422 1.00 0.00 N ATOM 0 H GLN A 31 -2.345 -17.083 -10.807 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.082 -16.513 -9.957 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.493 -18.773 -10.399 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.310 -18.346 -11.619 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -2.576 -19.193 -9.799 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.971 -20.040 -9.159 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.338 -20.516 -10.972 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -1.928 -21.726 -12.116 1.00 0.00 H new ATOM 468 N ILE A 32 -2.712 -17.541 -7.968 1.00 0.00 N ATOM 469 CA ILE A 32 -2.359 -17.773 -6.573 1.00 0.00 C ATOM 470 C ILE A 32 -2.376 -16.472 -5.778 1.00 0.00 C ATOM 471 O ILE A 32 -3.195 -16.293 -4.877 1.00 0.00 O ATOM 472 CB ILE A 32 -0.969 -18.422 -6.444 1.00 0.00 C ATOM 473 CG1 ILE A 32 -0.926 -19.744 -7.214 1.00 0.00 C ATOM 474 CG2 ILE A 32 -0.622 -18.645 -4.979 1.00 0.00 C ATOM 475 CD1 ILE A 32 0.377 -19.972 -7.949 1.00 0.00 C ATOM 0 H ILE A 32 -1.916 -17.512 -8.605 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.107 -18.454 -6.168 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.228 -17.748 -6.874 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.090 -20.566 -6.518 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.747 -19.765 -7.931 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.364 -19.104 -4.904 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.617 -17.688 -4.457 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.364 -19.302 -4.525 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.337 -20.927 -8.472 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.533 -19.169 -8.670 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.200 -19.984 -7.235 1.00 0.00 H new ATOM 487 N SER A 33 -1.467 -15.564 -6.119 1.00 0.00 N ATOM 488 CA SER A 33 -1.375 -14.279 -5.436 1.00 0.00 C ATOM 489 C SER A 33 -2.736 -13.590 -5.391 1.00 0.00 C ATOM 490 O SER A 33 -3.091 -12.959 -4.397 1.00 0.00 O ATOM 491 CB SER A 33 -0.357 -13.377 -6.136 1.00 0.00 C ATOM 492 OG SER A 33 -0.192 -12.156 -5.437 1.00 0.00 O ATOM 0 H SER A 33 -0.783 -15.695 -6.865 1.00 0.00 H new ATOM 0 HA SER A 33 -1.045 -14.461 -4.413 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.601 -13.892 -6.207 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.686 -13.175 -7.155 1.00 0.00 H new ATOM 0 HG SER A 33 0.465 -11.598 -5.904 1.00 0.00 H new ATOM 498 N GLY A 34 -3.493 -13.717 -6.477 1.00 0.00 N ATOM 499 CA GLY A 34 -4.805 -13.101 -6.542 1.00 0.00 C ATOM 500 C GLY A 34 -4.841 -11.910 -7.478 1.00 0.00 C ATOM 501 O GLY A 34 -5.403 -10.867 -7.145 1.00 0.00 O ATOM 0 H GLY A 34 -3.221 -14.235 -7.312 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.534 -13.841 -6.872 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.104 -12.783 -5.543 1.00 0.00 H new ATOM 505 N MET A 35 -4.239 -12.064 -8.653 1.00 0.00 N ATOM 506 CA MET A 35 -4.204 -10.991 -9.640 1.00 0.00 C ATOM 507 C MET A 35 -5.275 -11.198 -10.706 1.00 0.00 C ATOM 508 O MET A 35 -5.640 -10.266 -11.422 1.00 0.00 O ATOM 509 CB MET A 35 -2.824 -10.916 -10.295 1.00 0.00 C ATOM 510 CG MET A 35 -1.740 -10.387 -9.370 1.00 0.00 C ATOM 511 SD MET A 35 -0.482 -9.437 -10.246 1.00 0.00 S ATOM 512 CE MET A 35 -0.191 -10.490 -11.666 1.00 0.00 C ATOM 0 H MET A 35 -3.769 -12.921 -8.945 1.00 0.00 H new ATOM 0 HA MET A 35 -4.405 -10.051 -9.125 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.541 -11.910 -10.642 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.883 -10.276 -11.175 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.196 -9.760 -8.604 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.266 -11.223 -8.856 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.850 -10.401 -11.978 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.403 -11.526 -11.400 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.843 -10.185 -12.485 1.00 0.00 H new ATOM 522 N SER A 36 -5.775 -12.426 -10.805 1.00 0.00 N ATOM 523 CA SER A 36 -6.802 -12.756 -11.787 1.00 0.00 C ATOM 524 C SER A 36 -7.998 -11.818 -11.659 1.00 0.00 C ATOM 525 O SER A 36 -8.653 -11.489 -12.648 1.00 0.00 O ATOM 526 CB SER A 36 -7.256 -14.207 -11.613 1.00 0.00 C ATOM 527 OG SER A 36 -7.309 -14.564 -10.243 1.00 0.00 O ATOM 0 H SER A 36 -5.486 -13.208 -10.218 1.00 0.00 H new ATOM 0 HA SER A 36 -6.372 -12.634 -12.781 1.00 0.00 H new ATOM 0 HB2 SER A 36 -8.239 -14.340 -12.065 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.570 -14.871 -12.139 1.00 0.00 H new ATOM 0 HG SER A 36 -7.603 -15.495 -10.159 1.00 0.00 H new ATOM 533 N LYS A 37 -8.277 -11.390 -10.432 1.00 0.00 N ATOM 534 CA LYS A 37 -9.393 -10.489 -10.171 1.00 0.00 C ATOM 535 C LYS A 37 -9.154 -9.127 -10.814 1.00 0.00 C ATOM 536 O LYS A 37 -10.099 -8.410 -11.146 1.00 0.00 O ATOM 537 CB LYS A 37 -9.601 -10.324 -8.664 1.00 0.00 C ATOM 538 CG LYS A 37 -9.937 -11.622 -7.951 1.00 0.00 C ATOM 539 CD LYS A 37 -10.028 -11.424 -6.447 1.00 0.00 C ATOM 540 CE LYS A 37 -10.519 -12.683 -5.748 1.00 0.00 C ATOM 541 NZ LYS A 37 -12.001 -12.813 -5.817 1.00 0.00 N ATOM 0 H LYS A 37 -7.745 -11.653 -9.602 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.290 -10.926 -10.609 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -8.697 -9.902 -8.225 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.404 -9.607 -8.493 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.884 -12.010 -8.326 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.176 -12.369 -8.175 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.049 -11.147 -6.055 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.704 -10.598 -6.228 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.056 -13.557 -6.206 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.204 -12.666 -4.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.296 -13.683 -5.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.443 -11.992 -5.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.300 -12.855 -6.812 1.00 0.00 H new ATOM 555 N LYS A 38 -7.885 -8.775 -10.990 1.00 0.00 N ATOM 556 CA LYS A 38 -7.520 -7.500 -11.596 1.00 0.00 C ATOM 557 C LYS A 38 -8.160 -7.350 -12.973 1.00 0.00 C ATOM 558 O LYS A 38 -8.917 -8.214 -13.414 1.00 0.00 O ATOM 559 CB LYS A 38 -5.999 -7.384 -11.713 1.00 0.00 C ATOM 560 CG LYS A 38 -5.276 -7.500 -10.382 1.00 0.00 C ATOM 561 CD LYS A 38 -5.879 -6.575 -9.338 1.00 0.00 C ATOM 562 CE LYS A 38 -6.740 -7.341 -8.346 1.00 0.00 C ATOM 563 NZ LYS A 38 -6.347 -7.061 -6.937 1.00 0.00 N ATOM 0 H LYS A 38 -7.091 -9.356 -10.721 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.890 -6.701 -10.953 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.634 -8.162 -12.384 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.750 -6.426 -12.170 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.325 -8.530 -10.029 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.222 -7.259 -10.517 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.082 -6.057 -8.805 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.481 -5.812 -9.831 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.787 -7.073 -8.491 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.655 -8.410 -8.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.958 -7.602 -6.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.356 -7.340 -6.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.453 -6.045 -6.743 1.00 0.00 H new ATOM 577 N SER A 39 -7.848 -6.248 -13.648 1.00 0.00 N ATOM 578 CA SER A 39 -8.394 -5.984 -14.974 1.00 0.00 C ATOM 579 C SER A 39 -7.630 -4.856 -15.661 1.00 0.00 C ATOM 580 O SER A 39 -8.224 -3.996 -16.312 1.00 0.00 O ATOM 581 CB SER A 39 -9.878 -5.624 -14.875 1.00 0.00 C ATOM 582 OG SER A 39 -10.557 -5.923 -16.083 1.00 0.00 O ATOM 0 H SER A 39 -7.220 -5.524 -13.298 1.00 0.00 H new ATOM 0 HA SER A 39 -8.286 -6.889 -15.572 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.335 -6.174 -14.052 1.00 0.00 H new ATOM 0 HB3 SER A 39 -9.984 -4.563 -14.648 1.00 0.00 H new ATOM 0 HG SER A 39 -11.504 -5.685 -15.994 1.00 0.00 H new ATOM 588 N SER A 40 -6.310 -4.867 -15.512 1.00 0.00 N ATOM 589 CA SER A 40 -5.463 -3.844 -16.114 1.00 0.00 C ATOM 590 C SER A 40 -5.810 -2.462 -15.569 1.00 0.00 C ATOM 591 O SER A 40 -5.474 -1.442 -16.171 1.00 0.00 O ATOM 592 CB SER A 40 -5.616 -3.857 -17.636 1.00 0.00 C ATOM 593 OG SER A 40 -6.617 -2.946 -18.056 1.00 0.00 O ATOM 0 H SER A 40 -5.803 -5.574 -14.979 1.00 0.00 H new ATOM 0 HA SER A 40 -4.427 -4.067 -15.858 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.665 -3.598 -18.102 1.00 0.00 H new ATOM 0 HB3 SER A 40 -5.872 -4.862 -17.970 1.00 0.00 H new ATOM 0 HG SER A 40 -7.497 -3.276 -17.778 1.00 0.00 H new ATOM 599 N SER A 41 -6.486 -2.437 -14.424 1.00 0.00 N ATOM 600 CA SER A 41 -6.882 -1.181 -13.798 1.00 0.00 C ATOM 601 C SER A 41 -6.273 -1.052 -12.405 1.00 0.00 C ATOM 602 O SER A 41 -6.394 -0.012 -11.758 1.00 0.00 O ATOM 603 CB SER A 41 -8.407 -1.090 -13.710 1.00 0.00 C ATOM 604 OG SER A 41 -8.823 0.234 -13.422 1.00 0.00 O ATOM 0 H SER A 41 -6.770 -3.272 -13.912 1.00 0.00 H new ATOM 0 HA SER A 41 -6.510 -0.363 -14.415 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.849 -1.417 -14.651 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.771 -1.765 -12.936 1.00 0.00 H new ATOM 0 HG SER A 41 -8.143 0.678 -12.873 1.00 0.00 H new ATOM 610 N GLN A 42 -5.617 -2.115 -11.952 1.00 0.00 N ATOM 611 CA GLN A 42 -4.989 -2.122 -10.637 1.00 0.00 C ATOM 612 C GLN A 42 -3.530 -2.555 -10.732 1.00 0.00 C ATOM 613 O GLN A 42 -2.749 -2.355 -9.800 1.00 0.00 O ATOM 614 CB GLN A 42 -5.749 -3.052 -9.690 1.00 0.00 C ATOM 615 CG GLN A 42 -7.231 -2.731 -9.581 1.00 0.00 C ATOM 616 CD GLN A 42 -8.106 -3.798 -10.209 1.00 0.00 C ATOM 617 OE1 GLN A 42 -9.149 -4.162 -9.664 1.00 0.00 O ATOM 618 NE2 GLN A 42 -7.686 -4.306 -11.361 1.00 0.00 N ATOM 0 H GLN A 42 -5.507 -2.983 -12.477 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.022 -1.107 -10.242 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.633 -4.080 -10.033 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.299 -2.994 -8.699 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.498 -2.619 -8.530 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.428 -1.774 -10.064 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -6.816 -3.975 -11.777 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.234 -5.027 -11.830 1.00 0.00 H new ATOM 627 N LEU A 43 -3.167 -3.150 -11.863 1.00 0.00 N ATOM 628 CA LEU A 43 -1.801 -3.613 -12.081 1.00 0.00 C ATOM 629 C LEU A 43 -0.813 -2.455 -11.990 1.00 0.00 C ATOM 630 O LEU A 43 0.099 -2.465 -11.162 1.00 0.00 O ATOM 631 CB LEU A 43 -1.683 -4.293 -13.446 1.00 0.00 C ATOM 632 CG LEU A 43 -2.795 -5.281 -13.802 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.346 -6.209 -14.921 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.209 -6.082 -12.576 1.00 0.00 C ATOM 0 H LEU A 43 -3.800 -3.323 -12.644 1.00 0.00 H new ATOM 0 HA LEU A 43 -1.560 -4.335 -11.301 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.652 -3.520 -14.213 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.730 -4.820 -13.486 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.659 -4.716 -14.151 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.150 -6.905 -15.161 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.100 -5.621 -15.805 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.467 -6.767 -14.600 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.001 -6.780 -12.848 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.351 -6.637 -12.197 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.572 -5.404 -11.804 1.00 0.00 H new ATOM 646 N LYS A 44 -1.000 -1.455 -12.845 1.00 0.00 N ATOM 647 CA LYS A 44 -0.128 -0.287 -12.860 1.00 0.00 C ATOM 648 C LYS A 44 -0.359 0.580 -11.626 1.00 0.00 C ATOM 649 O LYS A 44 0.463 1.433 -11.295 1.00 0.00 O ATOM 650 CB LYS A 44 -0.368 0.538 -14.127 1.00 0.00 C ATOM 651 CG LYS A 44 -1.744 1.177 -14.185 1.00 0.00 C ATOM 652 CD LYS A 44 -2.624 0.513 -15.232 1.00 0.00 C ATOM 653 CE LYS A 44 -3.528 1.523 -15.922 1.00 0.00 C ATOM 654 NZ LYS A 44 -2.788 2.331 -16.931 1.00 0.00 N ATOM 0 H LYS A 44 -1.749 -1.430 -13.537 1.00 0.00 H new ATOM 0 HA LYS A 44 0.905 -0.636 -12.850 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.389 1.319 -14.190 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -0.238 -0.104 -14.998 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.221 1.104 -13.208 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -1.644 2.238 -14.412 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -1.998 0.017 -15.974 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.232 -0.259 -14.761 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.352 1.000 -16.408 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.967 2.186 -15.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.439 3.007 -17.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.018 2.850 -16.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.390 1.701 -17.656 1.00 0.00 H new ATOM 668 N GLU A 45 -1.480 0.353 -10.950 1.00 0.00 N ATOM 669 CA GLU A 45 -1.817 1.114 -9.752 1.00 0.00 C ATOM 670 C GLU A 45 -0.647 1.131 -8.773 1.00 0.00 C ATOM 671 O GLU A 45 -0.283 2.182 -8.243 1.00 0.00 O ATOM 672 CB GLU A 45 -3.054 0.520 -9.075 1.00 0.00 C ATOM 673 CG GLU A 45 -3.654 1.421 -8.008 1.00 0.00 C ATOM 674 CD GLU A 45 -3.876 2.838 -8.498 1.00 0.00 C ATOM 675 OE1 GLU A 45 -4.259 3.005 -9.675 1.00 0.00 O ATOM 676 OE2 GLU A 45 -3.668 3.780 -7.706 1.00 0.00 O ATOM 0 H GLU A 45 -2.170 -0.351 -11.211 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.033 2.139 -10.052 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.810 0.315 -9.833 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -2.788 -0.436 -8.624 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.604 1.002 -7.677 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.994 1.440 -7.141 1.00 0.00 H new ATOM 683 N ILE A 46 -0.062 -0.038 -8.537 1.00 0.00 N ATOM 684 CA ILE A 46 1.066 -0.158 -7.622 1.00 0.00 C ATOM 685 C ILE A 46 2.379 0.180 -8.322 1.00 0.00 C ATOM 686 O ILE A 46 3.367 0.529 -7.676 1.00 0.00 O ATOM 687 CB ILE A 46 1.163 -1.576 -7.030 1.00 0.00 C ATOM 688 CG1 ILE A 46 -0.208 -2.039 -6.533 1.00 0.00 C ATOM 689 CG2 ILE A 46 2.181 -1.609 -5.899 1.00 0.00 C ATOM 690 CD1 ILE A 46 -0.976 -2.853 -7.551 1.00 0.00 C ATOM 0 H ILE A 46 -0.351 -0.917 -8.967 1.00 0.00 H new ATOM 0 HA ILE A 46 0.894 0.553 -6.814 1.00 0.00 H new ATOM 0 HB ILE A 46 1.495 -2.259 -7.812 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.076 -2.634 -5.629 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -0.799 -1.166 -6.257 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.238 -2.618 -5.490 1.00 0.00 H new ATOM 0 HG22 ILE A 46 3.159 -1.316 -6.281 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.876 -0.917 -5.114 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.938 -3.147 -7.131 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.139 -2.254 -8.447 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.405 -3.745 -7.809 1.00 0.00 H new ATOM 702 N PHE A 47 2.381 0.074 -9.646 1.00 0.00 N ATOM 703 CA PHE A 47 3.572 0.369 -10.435 1.00 0.00 C ATOM 704 C PHE A 47 4.828 -0.136 -9.731 1.00 0.00 C ATOM 705 O PHE A 47 5.871 0.519 -9.754 1.00 0.00 O ATOM 706 CB PHE A 47 3.684 1.874 -10.685 1.00 0.00 C ATOM 707 CG PHE A 47 3.604 2.698 -9.431 1.00 0.00 C ATOM 708 CD1 PHE A 47 2.382 3.149 -8.959 1.00 0.00 C ATOM 709 CD2 PHE A 47 4.751 3.021 -8.724 1.00 0.00 C ATOM 710 CE1 PHE A 47 2.306 3.907 -7.807 1.00 0.00 C ATOM 711 CE2 PHE A 47 4.681 3.779 -7.571 1.00 0.00 C ATOM 712 CZ PHE A 47 3.457 4.222 -7.111 1.00 0.00 C ATOM 0 H PHE A 47 1.572 -0.214 -10.196 1.00 0.00 H new ATOM 0 HA PHE A 47 3.481 -0.145 -11.392 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.629 2.081 -11.187 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.888 2.182 -11.364 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.479 2.905 -9.498 1.00 0.00 H new ATOM 0 HD2 PHE A 47 5.711 2.676 -9.078 1.00 0.00 H new ATOM 0 HE1 PHE A 47 1.347 4.253 -7.450 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.583 4.025 -7.030 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.399 4.813 -6.209 1.00 0.00 H new ATOM 722 N ARG A 48 4.721 -1.305 -9.108 1.00 0.00 N ATOM 723 CA ARG A 48 5.847 -1.898 -8.396 1.00 0.00 C ATOM 724 C ARG A 48 5.893 -3.407 -8.613 1.00 0.00 C ATOM 725 O ARG A 48 6.604 -4.124 -7.908 1.00 0.00 O ATOM 726 CB ARG A 48 5.752 -1.590 -6.901 1.00 0.00 C ATOM 727 CG ARG A 48 5.966 -0.123 -6.566 1.00 0.00 C ATOM 728 CD ARG A 48 7.334 0.113 -5.944 1.00 0.00 C ATOM 729 NE ARG A 48 7.390 -0.343 -4.557 1.00 0.00 N ATOM 730 CZ ARG A 48 8.501 -0.350 -3.830 1.00 0.00 C ATOM 731 NH1 ARG A 48 9.643 0.073 -4.355 1.00 0.00 N ATOM 732 NH2 ARG A 48 8.472 -0.780 -2.575 1.00 0.00 N ATOM 0 H ARG A 48 3.866 -1.860 -9.082 1.00 0.00 H new ATOM 0 HA ARG A 48 6.765 -1.463 -8.792 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.772 -1.898 -6.537 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.492 -2.187 -6.368 1.00 0.00 H new ATOM 0 HG2 ARG A 48 5.869 0.476 -7.471 1.00 0.00 H new ATOM 0 HG3 ARG A 48 5.190 0.211 -5.878 1.00 0.00 H new ATOM 0 HD2 ARG A 48 8.093 -0.408 -6.528 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.573 1.176 -5.986 1.00 0.00 H new ATOM 0 HE ARG A 48 6.528 -0.674 -4.123 1.00 0.00 H new ATOM 0 HH11 ARG A 48 9.669 0.405 -5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 48 10.495 0.067 -3.795 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.595 -1.106 -2.168 1.00 0.00 H new ATOM 0 HH22 ARG A 48 9.326 -0.785 -2.018 1.00 0.00 H new ATOM 746 N ILE A 49 5.132 -3.882 -9.593 1.00 0.00 N ATOM 747 CA ILE A 49 5.087 -5.306 -9.903 1.00 0.00 C ATOM 748 C ILE A 49 5.237 -5.547 -11.401 1.00 0.00 C ATOM 749 O ILE A 49 5.141 -6.682 -11.871 1.00 0.00 O ATOM 750 CB ILE A 49 3.772 -5.946 -9.421 1.00 0.00 C ATOM 751 CG1 ILE A 49 2.597 -5.448 -10.265 1.00 0.00 C ATOM 752 CG2 ILE A 49 3.541 -5.637 -7.949 1.00 0.00 C ATOM 753 CD1 ILE A 49 2.229 -4.006 -9.999 1.00 0.00 C ATOM 0 H ILE A 49 4.538 -3.302 -10.186 1.00 0.00 H new ATOM 0 HA ILE A 49 5.921 -5.770 -9.377 1.00 0.00 H new ATOM 0 HB ILE A 49 3.847 -7.027 -9.539 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.844 -5.562 -11.320 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.729 -6.078 -10.071 1.00 0.00 H new ATOM 0 HG21 ILE A 49 2.608 -6.096 -7.623 1.00 0.00 H new ATOM 0 HG22 ILE A 49 4.367 -6.036 -7.360 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.483 -4.558 -7.809 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.389 -3.722 -10.632 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.950 -3.889 -8.952 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.083 -3.366 -10.221 1.00 0.00 H new ATOM 765 N LEU A 50 5.474 -4.473 -12.147 1.00 0.00 N ATOM 766 CA LEU A 50 5.640 -4.568 -13.593 1.00 0.00 C ATOM 767 C LEU A 50 6.944 -3.913 -14.036 1.00 0.00 C ATOM 768 O LEU A 50 7.869 -4.590 -14.485 1.00 0.00 O ATOM 769 CB LEU A 50 4.458 -3.909 -14.306 1.00 0.00 C ATOM 770 CG LEU A 50 3.078 -4.168 -13.699 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.070 -3.150 -14.209 1.00 0.00 C ATOM 772 CD2 LEU A 50 2.615 -5.584 -14.013 1.00 0.00 C ATOM 0 H LEU A 50 5.555 -3.527 -11.774 1.00 0.00 H new ATOM 0 HA LEU A 50 5.676 -5.624 -13.861 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.627 -2.832 -14.328 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.447 -4.251 -15.341 1.00 0.00 H new ATOM 0 HG LEU A 50 3.153 -4.063 -12.617 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.094 -3.351 -13.766 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.395 -2.147 -13.933 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.997 -3.222 -15.294 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.632 -5.751 -13.574 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.557 -5.717 -15.093 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.324 -6.299 -13.597 1.00 0.00 H new ATOM 784 N ASP A 51 7.012 -2.593 -13.904 1.00 0.00 N ATOM 785 CA ASP A 51 8.205 -1.846 -14.287 1.00 0.00 C ATOM 786 C ASP A 51 8.512 -0.753 -13.268 1.00 0.00 C ATOM 787 O ASP A 51 7.854 0.286 -13.240 1.00 0.00 O ATOM 788 CB ASP A 51 8.023 -1.230 -15.675 1.00 0.00 C ATOM 789 CG ASP A 51 9.336 -0.783 -16.286 1.00 0.00 C ATOM 790 OD1 ASP A 51 10.298 -1.579 -16.275 1.00 0.00 O ATOM 791 OD2 ASP A 51 9.401 0.364 -16.777 1.00 0.00 O ATOM 0 H ASP A 51 6.255 -2.018 -13.535 1.00 0.00 H new ATOM 0 HA ASP A 51 9.045 -2.540 -14.313 1.00 0.00 H new ATOM 0 HB2 ASP A 51 7.548 -1.958 -16.333 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.349 -0.376 -15.605 1.00 0.00 H new ATOM 796 N ASN A 52 9.516 -0.997 -12.431 1.00 0.00 N ATOM 797 CA ASN A 52 9.909 -0.034 -11.409 1.00 0.00 C ATOM 798 C ASN A 52 10.640 1.152 -12.032 1.00 0.00 C ATOM 799 O ASN A 52 10.803 2.196 -11.399 1.00 0.00 O ATOM 800 CB ASN A 52 10.802 -0.705 -10.363 1.00 0.00 C ATOM 801 CG ASN A 52 10.848 0.069 -9.060 1.00 0.00 C ATOM 802 OD1 ASN A 52 9.971 0.885 -8.779 1.00 0.00 O ATOM 803 ND2 ASN A 52 11.875 -0.186 -8.257 1.00 0.00 N ATOM 0 H ASN A 52 10.071 -1.853 -12.441 1.00 0.00 H new ATOM 0 HA ASN A 52 9.005 0.333 -10.924 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.437 -1.714 -10.171 1.00 0.00 H new ATOM 0 HB3 ASN A 52 11.812 -0.802 -10.760 1.00 0.00 H new ATOM 0 HD21 ASN A 52 11.960 0.303 -7.366 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.579 -0.871 -8.531 1.00 0.00 H new ATOM 810 N ASP A 53 11.077 0.985 -13.275 1.00 0.00 N ATOM 811 CA ASP A 53 11.788 2.041 -13.984 1.00 0.00 C ATOM 812 C ASP A 53 10.810 3.048 -14.583 1.00 0.00 C ATOM 813 O ASP A 53 11.052 4.254 -14.553 1.00 0.00 O ATOM 814 CB ASP A 53 12.664 1.445 -15.087 1.00 0.00 C ATOM 815 CG ASP A 53 13.943 0.838 -14.546 1.00 0.00 C ATOM 816 OD1 ASP A 53 14.321 1.170 -13.403 1.00 0.00 O ATOM 817 OD2 ASP A 53 14.567 0.030 -15.265 1.00 0.00 O ATOM 0 H ASP A 53 10.951 0.127 -13.813 1.00 0.00 H new ATOM 0 HA ASP A 53 12.424 2.561 -13.267 1.00 0.00 H new ATOM 0 HB2 ASP A 53 12.100 0.680 -15.621 1.00 0.00 H new ATOM 0 HB3 ASP A 53 12.912 2.222 -15.810 1.00 0.00 H new ATOM 822 N GLN A 54 9.708 2.543 -15.126 1.00 0.00 N ATOM 823 CA GLN A 54 8.695 3.398 -15.733 1.00 0.00 C ATOM 824 C GLN A 54 9.314 4.316 -16.782 1.00 0.00 C ATOM 825 O GLN A 54 8.808 5.407 -17.043 1.00 0.00 O ATOM 826 CB GLN A 54 7.992 4.232 -14.660 1.00 0.00 C ATOM 827 CG GLN A 54 7.137 3.407 -13.712 1.00 0.00 C ATOM 828 CD GLN A 54 6.036 2.649 -14.427 1.00 0.00 C ATOM 829 OE1 GLN A 54 5.750 2.904 -15.598 1.00 0.00 O ATOM 830 NE2 GLN A 54 5.411 1.710 -13.726 1.00 0.00 N ATOM 0 H GLN A 54 9.493 1.546 -15.158 1.00 0.00 H new ATOM 0 HA GLN A 54 7.962 2.758 -16.224 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.742 4.773 -14.083 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.364 4.979 -15.146 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.772 2.700 -13.179 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.693 4.064 -12.964 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.680 1.532 -12.758 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.662 1.167 -14.155 1.00 0.00 H new ATOM 839 N SER A 55 10.413 3.866 -17.379 1.00 0.00 N ATOM 840 CA SER A 55 11.105 4.648 -18.397 1.00 0.00 C ATOM 841 C SER A 55 10.368 4.577 -19.731 1.00 0.00 C ATOM 842 O SER A 55 10.481 5.475 -20.564 1.00 0.00 O ATOM 843 CB SER A 55 12.540 4.148 -18.567 1.00 0.00 C ATOM 844 OG SER A 55 13.396 5.192 -18.999 1.00 0.00 O ATOM 0 H SER A 55 10.843 2.964 -17.175 1.00 0.00 H new ATOM 0 HA SER A 55 11.127 5.687 -18.069 1.00 0.00 H new ATOM 0 HB2 SER A 55 12.902 3.744 -17.622 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.561 3.333 -19.291 1.00 0.00 H new ATOM 0 HG SER A 55 14.308 4.847 -19.099 1.00 0.00 H new ATOM 850 N GLY A 56 9.612 3.501 -19.926 1.00 0.00 N ATOM 851 CA GLY A 56 8.867 3.331 -21.160 1.00 0.00 C ATOM 852 C GLY A 56 8.681 1.872 -21.528 1.00 0.00 C ATOM 853 O GLY A 56 7.837 1.537 -22.360 1.00 0.00 O ATOM 0 H GLY A 56 9.502 2.744 -19.251 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.890 3.805 -21.060 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.388 3.843 -21.969 1.00 0.00 H new ATOM 857 N PHE A 57 9.473 1.002 -20.910 1.00 0.00 N ATOM 858 CA PHE A 57 9.393 -0.429 -21.179 1.00 0.00 C ATOM 859 C PHE A 57 10.090 -1.229 -20.082 1.00 0.00 C ATOM 860 O PHE A 57 10.437 -0.689 -19.031 1.00 0.00 O ATOM 861 CB PHE A 57 10.022 -0.749 -22.537 1.00 0.00 C ATOM 862 CG PHE A 57 11.518 -0.616 -22.552 1.00 0.00 C ATOM 863 CD1 PHE A 57 12.118 0.621 -22.378 1.00 0.00 C ATOM 864 CD2 PHE A 57 12.324 -1.727 -22.739 1.00 0.00 C ATOM 865 CE1 PHE A 57 13.495 0.747 -22.390 1.00 0.00 C ATOM 866 CE2 PHE A 57 13.701 -1.607 -22.752 1.00 0.00 C ATOM 867 CZ PHE A 57 14.287 -0.368 -22.579 1.00 0.00 C ATOM 0 H PHE A 57 10.177 1.263 -20.220 1.00 0.00 H new ATOM 0 HA PHE A 57 8.341 -0.712 -21.197 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.753 -1.766 -22.822 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.599 -0.084 -23.290 1.00 0.00 H new ATOM 0 HD1 PHE A 57 11.503 1.497 -22.231 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.871 -2.698 -22.876 1.00 0.00 H new ATOM 0 HE1 PHE A 57 13.950 1.716 -22.252 1.00 0.00 H new ATOM 0 HE2 PHE A 57 14.318 -2.481 -22.897 1.00 0.00 H new ATOM 0 HZ PHE A 57 15.363 -0.272 -22.592 1.00 0.00 H new ATOM 877 N ILE A 58 10.291 -2.518 -20.335 1.00 0.00 N ATOM 878 CA ILE A 58 10.946 -3.392 -19.370 1.00 0.00 C ATOM 879 C ILE A 58 12.094 -4.160 -20.015 1.00 0.00 C ATOM 880 O ILE A 58 12.097 -4.392 -21.224 1.00 0.00 O ATOM 881 CB ILE A 58 9.954 -4.395 -18.754 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.671 -3.679 -18.325 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.589 -5.110 -17.571 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.624 -4.607 -17.750 1.00 0.00 C ATOM 0 H ILE A 58 10.010 -2.980 -21.200 1.00 0.00 H new ATOM 0 HA ILE A 58 11.339 -2.751 -18.580 1.00 0.00 H new ATOM 0 HB ILE A 58 9.698 -5.139 -19.508 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.919 -2.920 -17.583 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.250 -3.158 -19.185 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.875 -5.816 -17.146 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.476 -5.648 -17.905 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.871 -4.379 -16.813 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.743 -4.031 -17.468 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.347 -5.351 -18.497 1.00 0.00 H new ATOM 0 HD13 ILE A 58 8.026 -5.109 -16.870 1.00 0.00 H new ATOM 896 N GLU A 59 13.067 -4.555 -19.200 1.00 0.00 N ATOM 897 CA GLU A 59 14.221 -5.299 -19.692 1.00 0.00 C ATOM 898 C GLU A 59 14.569 -6.449 -18.751 1.00 0.00 C ATOM 899 O GLU A 59 14.099 -6.497 -17.615 1.00 0.00 O ATOM 900 CB GLU A 59 15.426 -4.370 -19.849 1.00 0.00 C ATOM 901 CG GLU A 59 16.506 -4.923 -20.764 1.00 0.00 C ATOM 902 CD GLU A 59 15.960 -5.374 -22.105 1.00 0.00 C ATOM 903 OE1 GLU A 59 15.055 -4.696 -22.634 1.00 0.00 O ATOM 904 OE2 GLU A 59 16.438 -6.404 -22.624 1.00 0.00 O ATOM 0 H GLU A 59 13.079 -4.372 -18.197 1.00 0.00 H new ATOM 0 HA GLU A 59 13.964 -5.715 -20.666 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.086 -3.411 -20.240 1.00 0.00 H new ATOM 0 HB3 GLU A 59 15.857 -4.179 -18.866 1.00 0.00 H new ATOM 0 HG2 GLU A 59 17.267 -4.159 -20.924 1.00 0.00 H new ATOM 0 HG3 GLU A 59 16.996 -5.764 -20.274 1.00 0.00 H new ATOM 911 N GLU A 60 15.396 -7.371 -19.233 1.00 0.00 N ATOM 912 CA GLU A 60 15.806 -8.520 -18.435 1.00 0.00 C ATOM 913 C GLU A 60 16.476 -8.072 -17.139 1.00 0.00 C ATOM 914 O GLU A 60 16.549 -8.829 -16.171 1.00 0.00 O ATOM 915 CB GLU A 60 16.761 -9.410 -19.234 1.00 0.00 C ATOM 916 CG GLU A 60 16.179 -9.899 -20.549 1.00 0.00 C ATOM 917 CD GLU A 60 16.731 -11.249 -20.964 1.00 0.00 C ATOM 918 OE1 GLU A 60 16.247 -12.275 -20.442 1.00 0.00 O ATOM 919 OE2 GLU A 60 17.647 -11.280 -21.813 1.00 0.00 O ATOM 0 H GLU A 60 15.795 -7.345 -20.171 1.00 0.00 H new ATOM 0 HA GLU A 60 14.913 -9.092 -18.183 1.00 0.00 H new ATOM 0 HB2 GLU A 60 17.678 -8.856 -19.436 1.00 0.00 H new ATOM 0 HB3 GLU A 60 17.036 -10.271 -18.625 1.00 0.00 H new ATOM 0 HG2 GLU A 60 15.095 -9.966 -20.460 1.00 0.00 H new ATOM 0 HG3 GLU A 60 16.390 -9.168 -21.330 1.00 0.00 H new ATOM 926 N ASP A 61 16.964 -6.836 -17.129 1.00 0.00 N ATOM 927 CA ASP A 61 17.628 -6.286 -15.953 1.00 0.00 C ATOM 928 C ASP A 61 16.609 -5.901 -14.885 1.00 0.00 C ATOM 929 O ASP A 61 16.976 -5.495 -13.782 1.00 0.00 O ATOM 930 CB ASP A 61 18.466 -5.066 -16.339 1.00 0.00 C ATOM 931 CG ASP A 61 19.304 -4.551 -15.185 1.00 0.00 C ATOM 932 OD1 ASP A 61 20.157 -5.313 -14.684 1.00 0.00 O ATOM 933 OD2 ASP A 61 19.107 -3.385 -14.784 1.00 0.00 O ATOM 0 H ASP A 61 16.912 -6.196 -17.922 1.00 0.00 H new ATOM 0 HA ASP A 61 18.285 -7.054 -15.544 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.120 -5.327 -17.171 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.807 -4.272 -16.688 1.00 0.00 H new ATOM 938 N GLU A 62 15.330 -6.031 -15.220 1.00 0.00 N ATOM 939 CA GLU A 62 14.259 -5.696 -14.289 1.00 0.00 C ATOM 940 C GLU A 62 13.311 -6.876 -14.101 1.00 0.00 C ATOM 941 O GLU A 62 12.138 -6.699 -13.767 1.00 0.00 O ATOM 942 CB GLU A 62 13.481 -4.477 -14.790 1.00 0.00 C ATOM 943 CG GLU A 62 14.072 -3.151 -14.342 1.00 0.00 C ATOM 944 CD GLU A 62 14.202 -3.049 -12.835 1.00 0.00 C ATOM 945 OE1 GLU A 62 13.336 -3.603 -12.126 1.00 0.00 O ATOM 946 OE2 GLU A 62 15.170 -2.416 -12.365 1.00 0.00 O ATOM 0 H GLU A 62 15.010 -6.366 -16.129 1.00 0.00 H new ATOM 0 HA GLU A 62 14.711 -5.459 -13.326 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.447 -4.501 -15.879 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.452 -4.544 -14.438 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.054 -3.023 -14.797 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.444 -2.337 -14.705 1.00 0.00 H new ATOM 953 N LEU A 63 13.826 -8.081 -14.319 1.00 0.00 N ATOM 954 CA LEU A 63 13.026 -9.293 -14.175 1.00 0.00 C ATOM 955 C LEU A 63 13.579 -10.182 -13.065 1.00 0.00 C ATOM 956 O LEU A 63 12.847 -10.960 -12.455 1.00 0.00 O ATOM 957 CB LEU A 63 12.993 -10.066 -15.494 1.00 0.00 C ATOM 958 CG LEU A 63 12.633 -9.254 -16.739 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.617 -10.145 -17.971 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.288 -8.566 -16.557 1.00 0.00 C ATOM 0 H LEU A 63 14.794 -8.245 -14.596 1.00 0.00 H new ATOM 0 HA LEU A 63 12.011 -8.999 -13.908 1.00 0.00 H new ATOM 0 HB2 LEU A 63 13.972 -10.519 -15.651 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.276 -10.881 -15.396 1.00 0.00 H new ATOM 0 HG LEU A 63 13.394 -8.487 -16.881 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.359 -9.550 -18.847 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.602 -10.589 -18.112 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.878 -10.935 -17.839 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.048 -7.993 -17.453 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.515 -9.316 -16.389 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.336 -7.895 -15.699 1.00 0.00 H new ATOM 972 N LYS A 64 14.877 -10.059 -12.808 1.00 0.00 N ATOM 973 CA LYS A 64 15.530 -10.848 -11.770 1.00 0.00 C ATOM 974 C LYS A 64 15.353 -10.198 -10.401 1.00 0.00 C ATOM 975 O LYS A 64 15.890 -10.677 -9.402 1.00 0.00 O ATOM 976 CB LYS A 64 17.019 -11.008 -12.082 1.00 0.00 C ATOM 977 CG LYS A 64 17.815 -9.724 -11.922 1.00 0.00 C ATOM 978 CD LYS A 64 19.233 -9.878 -12.447 1.00 0.00 C ATOM 979 CE LYS A 64 19.647 -8.684 -13.293 1.00 0.00 C ATOM 980 NZ LYS A 64 20.314 -9.104 -14.557 1.00 0.00 N ATOM 0 H LYS A 64 15.498 -9.420 -13.305 1.00 0.00 H new ATOM 0 HA LYS A 64 15.063 -11.832 -11.749 1.00 0.00 H new ATOM 0 HB2 LYS A 64 17.439 -11.770 -11.426 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.131 -11.370 -13.104 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.314 -8.916 -12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 64 17.844 -9.442 -10.870 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.922 -9.988 -11.610 1.00 0.00 H new ATOM 0 HD3 LYS A 64 19.305 -10.789 -13.041 1.00 0.00 H new ATOM 0 HE2 LYS A 64 18.768 -8.084 -13.528 1.00 0.00 H new ATOM 0 HE3 LYS A 64 20.323 -8.049 -12.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 20.581 -8.261 -15.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 21.167 -9.656 -14.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 19.661 -9.689 -15.117 1.00 0.00 H new ATOM 994 N TYR A 65 14.598 -9.106 -10.362 1.00 0.00 N ATOM 995 CA TYR A 65 14.352 -8.391 -9.116 1.00 0.00 C ATOM 996 C TYR A 65 12.858 -8.322 -8.813 1.00 0.00 C ATOM 997 O TYR A 65 12.339 -7.275 -8.426 1.00 0.00 O ATOM 998 CB TYR A 65 14.934 -6.978 -9.192 1.00 0.00 C ATOM 999 CG TYR A 65 16.445 -6.945 -9.194 1.00 0.00 C ATOM 1000 CD1 TYR A 65 17.160 -7.044 -10.381 1.00 0.00 C ATOM 1001 CD2 TYR A 65 17.159 -6.815 -8.009 1.00 0.00 C ATOM 1002 CE1 TYR A 65 18.541 -7.015 -10.388 1.00 0.00 C ATOM 1003 CE2 TYR A 65 18.540 -6.784 -8.006 1.00 0.00 C ATOM 1004 CZ TYR A 65 19.226 -6.885 -9.198 1.00 0.00 C ATOM 1005 OH TYR A 65 20.602 -6.854 -9.200 1.00 0.00 O ATOM 0 H TYR A 65 14.146 -8.697 -11.179 1.00 0.00 H new ATOM 0 HA TYR A 65 14.843 -8.937 -8.310 1.00 0.00 H new ATOM 0 HB2 TYR A 65 14.567 -6.491 -10.096 1.00 0.00 H new ATOM 0 HB3 TYR A 65 14.567 -6.397 -8.346 1.00 0.00 H new ATOM 0 HD1 TYR A 65 16.627 -7.145 -11.315 1.00 0.00 H new ATOM 0 HD2 TYR A 65 16.625 -6.737 -7.074 1.00 0.00 H new ATOM 0 HE1 TYR A 65 19.081 -7.094 -11.320 1.00 0.00 H new ATOM 0 HE2 TYR A 65 19.079 -6.681 -7.076 1.00 0.00 H new ATOM 0 HH TYR A 65 20.928 -6.757 -8.281 1.00 0.00 H new ATOM 1015 N PHE A 66 12.173 -9.447 -8.991 1.00 0.00 N ATOM 1016 CA PHE A 66 10.738 -9.516 -8.738 1.00 0.00 C ATOM 1017 C PHE A 66 10.460 -9.952 -7.302 1.00 0.00 C ATOM 1018 O PHE A 66 10.002 -9.159 -6.478 1.00 0.00 O ATOM 1019 CB PHE A 66 10.072 -10.486 -9.715 1.00 0.00 C ATOM 1020 CG PHE A 66 8.573 -10.394 -9.724 1.00 0.00 C ATOM 1021 CD1 PHE A 66 7.927 -9.467 -10.526 1.00 0.00 C ATOM 1022 CD2 PHE A 66 7.810 -11.234 -8.929 1.00 0.00 C ATOM 1023 CE1 PHE A 66 6.548 -9.380 -10.537 1.00 0.00 C ATOM 1024 CE2 PHE A 66 6.430 -11.151 -8.935 1.00 0.00 C ATOM 1025 CZ PHE A 66 5.799 -10.223 -9.739 1.00 0.00 C ATOM 0 H PHE A 66 12.588 -10.323 -9.309 1.00 0.00 H new ATOM 0 HA PHE A 66 10.320 -8.520 -8.885 1.00 0.00 H new ATOM 0 HB2 PHE A 66 10.446 -10.290 -10.720 1.00 0.00 H new ATOM 0 HB3 PHE A 66 10.364 -11.504 -9.459 1.00 0.00 H new ATOM 0 HD1 PHE A 66 8.508 -8.804 -11.150 1.00 0.00 H new ATOM 0 HD2 PHE A 66 8.299 -11.961 -8.298 1.00 0.00 H new ATOM 0 HE1 PHE A 66 6.057 -8.654 -11.168 1.00 0.00 H new ATOM 0 HE2 PHE A 66 5.846 -11.812 -8.311 1.00 0.00 H new ATOM 0 HZ PHE A 66 4.721 -10.156 -9.744 1.00 0.00 H new ATOM 1035 N LEU A 67 10.740 -11.217 -7.010 1.00 0.00 N ATOM 1036 CA LEU A 67 10.520 -11.761 -5.674 1.00 0.00 C ATOM 1037 C LEU A 67 11.220 -10.911 -4.618 1.00 0.00 C ATOM 1038 O LEU A 67 10.823 -10.900 -3.454 1.00 0.00 O ATOM 1039 CB LEU A 67 11.023 -13.204 -5.600 1.00 0.00 C ATOM 1040 CG LEU A 67 10.640 -14.109 -6.771 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.267 -15.485 -6.610 1.00 0.00 C ATOM 1042 CD2 LEU A 67 9.127 -14.221 -6.886 1.00 0.00 C ATOM 0 H LEU A 67 11.120 -11.886 -7.680 1.00 0.00 H new ATOM 0 HA LEU A 67 9.449 -11.746 -5.474 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.110 -13.185 -5.522 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.645 -13.653 -4.681 1.00 0.00 H new ATOM 0 HG LEU A 67 11.022 -13.663 -7.689 1.00 0.00 H new ATOM 0 HD11 LEU A 67 10.983 -16.115 -7.453 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.352 -15.389 -6.578 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.916 -15.939 -5.683 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.873 -14.869 -7.725 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.722 -14.643 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.700 -13.231 -7.050 1.00 0.00 H new ATOM 1054 N GLN A 68 12.263 -10.200 -5.035 1.00 0.00 N ATOM 1055 CA GLN A 68 13.017 -9.346 -4.125 1.00 0.00 C ATOM 1056 C GLN A 68 12.084 -8.437 -3.333 1.00 0.00 C ATOM 1057 O GLN A 68 12.409 -8.013 -2.223 1.00 0.00 O ATOM 1058 CB GLN A 68 14.030 -8.504 -4.903 1.00 0.00 C ATOM 1059 CG GLN A 68 15.267 -8.142 -4.098 1.00 0.00 C ATOM 1060 CD GLN A 68 16.509 -8.022 -4.958 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.235 -7.029 -4.886 1.00 0.00 O ATOM 1062 NE2 GLN A 68 16.762 -9.035 -5.778 1.00 0.00 N ATOM 0 H GLN A 68 12.605 -10.198 -5.996 1.00 0.00 H new ATOM 0 HA GLN A 68 13.551 -9.987 -3.424 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.335 -9.051 -5.795 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.545 -7.588 -5.240 1.00 0.00 H new ATOM 0 HG2 GLN A 68 15.096 -7.198 -3.581 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.432 -8.900 -3.332 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.134 -9.838 -5.805 1.00 0.00 H new ATOM 0 HE22 GLN A 68 17.585 -9.010 -6.381 1.00 0.00 H new ATOM 1071 N ARG A 69 10.924 -8.140 -3.910 1.00 0.00 N ATOM 1072 CA ARG A 69 9.945 -7.279 -3.258 1.00 0.00 C ATOM 1073 C ARG A 69 9.065 -8.082 -2.303 1.00 0.00 C ATOM 1074 O ARG A 69 9.171 -7.947 -1.084 1.00 0.00 O ATOM 1075 CB ARG A 69 9.074 -6.578 -4.303 1.00 0.00 C ATOM 1076 CG ARG A 69 9.767 -5.412 -4.989 1.00 0.00 C ATOM 1077 CD ARG A 69 9.754 -4.166 -4.118 1.00 0.00 C ATOM 1078 NE ARG A 69 10.898 -4.119 -3.212 1.00 0.00 N ATOM 1079 CZ ARG A 69 12.142 -3.874 -3.611 1.00 0.00 C ATOM 1080 NH1 ARG A 69 12.399 -3.654 -4.893 1.00 0.00 N ATOM 1081 NH2 ARG A 69 13.130 -3.848 -2.727 1.00 0.00 N ATOM 0 H ARG A 69 10.639 -8.483 -4.828 1.00 0.00 H new ATOM 0 HA ARG A 69 10.486 -6.528 -2.682 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.770 -7.304 -5.057 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.164 -6.218 -3.823 1.00 0.00 H new ATOM 0 HG2 ARG A 69 10.797 -5.685 -5.221 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.272 -5.200 -5.937 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.758 -3.280 -4.753 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.831 -4.139 -3.538 1.00 0.00 H new ATOM 0 HE ARG A 69 10.734 -4.283 -2.219 1.00 0.00 H new ATOM 0 HH11 ARG A 69 11.641 -3.673 -5.576 1.00 0.00 H new ATOM 0 HH12 ARG A 69 13.354 -3.466 -5.197 1.00 0.00 H new ATOM 0 HH21 ARG A 69 12.936 -4.016 -1.740 1.00 0.00 H new ATOM 0 HH22 ARG A 69 14.084 -3.660 -3.034 1.00 0.00 H new ATOM 1095 N PHE A 70 8.198 -8.916 -2.867 1.00 0.00 N ATOM 1096 CA PHE A 70 7.299 -9.740 -2.066 1.00 0.00 C ATOM 1097 C PHE A 70 8.069 -10.489 -0.982 1.00 0.00 C ATOM 1098 O PHE A 70 7.867 -10.257 0.209 1.00 0.00 O ATOM 1099 CB PHE A 70 6.554 -10.734 -2.959 1.00 0.00 C ATOM 1100 CG PHE A 70 5.766 -10.080 -4.057 1.00 0.00 C ATOM 1101 CD1 PHE A 70 4.475 -9.630 -3.830 1.00 0.00 C ATOM 1102 CD2 PHE A 70 6.316 -9.914 -5.318 1.00 0.00 C ATOM 1103 CE1 PHE A 70 3.748 -9.027 -4.838 1.00 0.00 C ATOM 1104 CE2 PHE A 70 5.594 -9.312 -6.331 1.00 0.00 C ATOM 1105 CZ PHE A 70 4.308 -8.869 -6.091 1.00 0.00 C ATOM 0 H PHE A 70 8.098 -9.039 -3.875 1.00 0.00 H new ATOM 0 HA PHE A 70 6.575 -9.083 -1.584 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.274 -11.424 -3.400 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.879 -11.328 -2.343 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.032 -9.752 -2.853 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.321 -10.259 -5.511 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.743 -8.680 -4.647 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.035 -9.188 -7.309 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.741 -8.400 -6.882 1.00 0.00 H new ATOM 1115 N GLU A 71 8.951 -11.389 -1.406 1.00 0.00 N ATOM 1116 CA GLU A 71 9.749 -12.174 -0.472 1.00 0.00 C ATOM 1117 C GLU A 71 10.569 -11.265 0.440 1.00 0.00 C ATOM 1118 O GLU A 71 10.844 -11.608 1.590 1.00 0.00 O ATOM 1119 CB GLU A 71 10.678 -13.123 -1.232 1.00 0.00 C ATOM 1120 CG GLU A 71 11.732 -13.776 -0.354 1.00 0.00 C ATOM 1121 CD GLU A 71 11.129 -14.636 0.740 1.00 0.00 C ATOM 1122 OE1 GLU A 71 10.408 -15.600 0.406 1.00 0.00 O ATOM 1123 OE2 GLU A 71 11.377 -14.345 1.928 1.00 0.00 O ATOM 0 H GLU A 71 9.131 -11.592 -2.389 1.00 0.00 H new ATOM 0 HA GLU A 71 9.068 -12.760 0.144 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.080 -13.901 -1.706 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.174 -12.571 -2.030 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.387 -14.389 -0.974 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.353 -13.003 0.098 1.00 0.00 H new ATOM 1130 N SER A 72 10.955 -10.106 -0.082 1.00 0.00 N ATOM 1131 CA SER A 72 11.747 -9.149 0.683 1.00 0.00 C ATOM 1132 C SER A 72 13.125 -9.719 1.004 1.00 0.00 C ATOM 1133 O SER A 72 13.847 -9.189 1.848 1.00 0.00 O ATOM 1134 CB SER A 72 11.022 -8.775 1.977 1.00 0.00 C ATOM 1135 OG SER A 72 11.423 -7.495 2.434 1.00 0.00 O ATOM 0 H SER A 72 10.733 -9.806 -1.031 1.00 0.00 H new ATOM 0 HA SER A 72 11.876 -8.253 0.076 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.945 -8.784 1.810 1.00 0.00 H new ATOM 0 HB3 SER A 72 11.232 -9.521 2.744 1.00 0.00 H new ATOM 0 HG SER A 72 12.401 -7.437 2.428 1.00 0.00 H new ATOM 1141 N GLY A 73 13.484 -10.803 0.323 1.00 0.00 N ATOM 1142 CA GLY A 73 14.775 -11.427 0.550 1.00 0.00 C ATOM 1143 C GLY A 73 15.245 -12.235 -0.644 1.00 0.00 C ATOM 1144 O GLY A 73 16.105 -13.105 -0.512 1.00 0.00 O ATOM 0 H GLY A 73 12.905 -11.260 -0.381 1.00 0.00 H new ATOM 0 HA2 GLY A 73 15.513 -10.657 0.777 1.00 0.00 H new ATOM 0 HA3 GLY A 73 14.713 -12.077 1.423 1.00 0.00 H new ATOM 1148 N ALA A 74 14.678 -11.949 -1.811 1.00 0.00 N ATOM 1149 CA ALA A 74 15.045 -12.655 -3.032 1.00 0.00 C ATOM 1150 C ALA A 74 16.348 -12.114 -3.609 1.00 0.00 C ATOM 1151 O ALA A 74 16.484 -10.912 -3.840 1.00 0.00 O ATOM 1152 CB ALA A 74 13.927 -12.550 -4.059 1.00 0.00 C ATOM 0 H ALA A 74 13.962 -11.233 -1.937 1.00 0.00 H new ATOM 0 HA ALA A 74 15.197 -13.705 -2.783 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.215 -13.082 -4.966 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.017 -12.992 -3.653 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.747 -11.501 -4.295 1.00 0.00 H new ATOM 1158 N ARG A 75 17.305 -13.007 -3.839 1.00 0.00 N ATOM 1159 CA ARG A 75 18.598 -12.618 -4.387 1.00 0.00 C ATOM 1160 C ARG A 75 18.485 -12.303 -5.876 1.00 0.00 C ATOM 1161 O ARG A 75 18.385 -11.141 -6.269 1.00 0.00 O ATOM 1162 CB ARG A 75 19.625 -13.731 -4.167 1.00 0.00 C ATOM 1163 CG ARG A 75 19.010 -15.118 -4.075 1.00 0.00 C ATOM 1164 CD ARG A 75 19.996 -16.194 -4.501 1.00 0.00 C ATOM 1165 NE ARG A 75 19.535 -17.532 -4.141 1.00 0.00 N ATOM 1166 CZ ARG A 75 18.561 -18.170 -4.780 1.00 0.00 C ATOM 1167 NH1 ARG A 75 17.948 -17.595 -5.805 1.00 0.00 N ATOM 1168 NH2 ARG A 75 18.198 -19.387 -4.393 1.00 0.00 N ATOM 0 H ARG A 75 17.209 -14.005 -3.654 1.00 0.00 H new ATOM 0 HA ARG A 75 18.929 -11.719 -3.867 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.345 -13.716 -4.985 1.00 0.00 H new ATOM 0 HB3 ARG A 75 20.179 -13.527 -3.251 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.685 -15.306 -3.052 1.00 0.00 H new ATOM 0 HG3 ARG A 75 18.122 -15.166 -4.706 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.147 -16.141 -5.579 1.00 0.00 H new ATOM 0 HD3 ARG A 75 20.963 -16.006 -4.034 1.00 0.00 H new ATOM 0 HE ARG A 75 19.986 -18.002 -3.356 1.00 0.00 H new ATOM 0 HH11 ARG A 75 18.224 -16.660 -6.105 1.00 0.00 H new ATOM 0 HH12 ARG A 75 17.200 -18.088 -6.294 1.00 0.00 H new ATOM 0 HH21 ARG A 75 18.667 -19.833 -3.604 1.00 0.00 H new ATOM 0 HH22 ARG A 75 17.450 -19.876 -4.884 1.00 0.00 H new ATOM 1182 N VAL A 76 18.503 -13.346 -6.699 1.00 0.00 N ATOM 1183 CA VAL A 76 18.402 -13.181 -8.144 1.00 0.00 C ATOM 1184 C VAL A 76 17.719 -14.383 -8.788 1.00 0.00 C ATOM 1185 O VAL A 76 18.218 -15.506 -8.718 1.00 0.00 O ATOM 1186 CB VAL A 76 19.789 -12.989 -8.786 1.00 0.00 C ATOM 1187 CG1 VAL A 76 19.658 -12.347 -10.158 1.00 0.00 C ATOM 1188 CG2 VAL A 76 20.682 -12.155 -7.880 1.00 0.00 C ATOM 0 H VAL A 76 18.587 -14.314 -6.390 1.00 0.00 H new ATOM 0 HA VAL A 76 17.802 -12.288 -8.319 1.00 0.00 H new ATOM 0 HB VAL A 76 20.251 -13.968 -8.913 1.00 0.00 H new ATOM 0 HG11 VAL A 76 20.648 -12.219 -10.596 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.056 -12.987 -10.803 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.176 -11.374 -10.060 1.00 0.00 H new ATOM 0 HG21 VAL A 76 21.658 -12.028 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.227 -11.178 -7.720 1.00 0.00 H new ATOM 0 HG23 VAL A 76 20.802 -12.661 -6.922 1.00 0.00 H new ATOM 1198 N LEU A 77 16.574 -14.139 -9.416 1.00 0.00 N ATOM 1199 CA LEU A 77 15.821 -15.201 -10.074 1.00 0.00 C ATOM 1200 C LEU A 77 16.699 -15.958 -11.065 1.00 0.00 C ATOM 1201 O LEU A 77 17.855 -15.597 -11.289 1.00 0.00 O ATOM 1202 CB LEU A 77 14.604 -14.619 -10.795 1.00 0.00 C ATOM 1203 CG LEU A 77 13.358 -14.397 -9.937 1.00 0.00 C ATOM 1204 CD1 LEU A 77 12.763 -13.023 -10.204 1.00 0.00 C ATOM 1205 CD2 LEU A 77 12.328 -15.486 -10.201 1.00 0.00 C ATOM 0 H LEU A 77 16.147 -13.215 -9.483 1.00 0.00 H new ATOM 0 HA LEU A 77 15.483 -15.900 -9.309 1.00 0.00 H new ATOM 0 HB2 LEU A 77 14.891 -13.665 -11.237 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.341 -15.285 -11.617 1.00 0.00 H new ATOM 0 HG LEU A 77 13.650 -14.446 -8.888 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.877 -12.883 -9.584 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.498 -12.255 -9.964 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.486 -12.944 -11.255 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.448 -15.312 -9.582 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.041 -15.468 -11.252 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.756 -16.458 -9.958 1.00 0.00 H new ATOM 1217 N THR A 78 16.143 -17.009 -11.659 1.00 0.00 N ATOM 1218 CA THR A 78 16.874 -17.816 -12.627 1.00 0.00 C ATOM 1219 C THR A 78 16.955 -17.115 -13.978 1.00 0.00 C ATOM 1220 O THR A 78 16.506 -15.979 -14.127 1.00 0.00 O ATOM 1221 CB THR A 78 16.219 -19.197 -12.817 1.00 0.00 C ATOM 1222 OG1 THR A 78 14.965 -19.056 -13.493 1.00 0.00 O ATOM 1223 CG2 THR A 78 16.004 -19.882 -11.476 1.00 0.00 C ATOM 0 H THR A 78 15.187 -17.321 -11.486 1.00 0.00 H new ATOM 0 HA THR A 78 17.880 -17.951 -12.229 1.00 0.00 H new ATOM 0 HB THR A 78 16.888 -19.812 -13.419 1.00 0.00 H new ATOM 0 HG1 THR A 78 14.391 -18.439 -12.992 1.00 0.00 H new ATOM 0 HG21 THR A 78 15.540 -20.856 -11.635 1.00 0.00 H new ATOM 0 HG22 THR A 78 16.964 -20.014 -10.977 1.00 0.00 H new ATOM 0 HG23 THR A 78 15.353 -19.268 -10.854 1.00 0.00 H new ATOM 1231 N ALA A 79 17.530 -17.800 -14.962 1.00 0.00 N ATOM 1232 CA ALA A 79 17.667 -17.243 -16.302 1.00 0.00 C ATOM 1233 C ALA A 79 16.465 -17.598 -17.169 1.00 0.00 C ATOM 1234 O ALA A 79 16.282 -17.042 -18.252 1.00 0.00 O ATOM 1235 CB ALA A 79 18.952 -17.737 -16.949 1.00 0.00 C ATOM 0 H ALA A 79 17.908 -18.741 -14.856 1.00 0.00 H new ATOM 0 HA ALA A 79 17.711 -16.157 -16.215 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.042 -17.313 -17.949 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.805 -17.427 -16.346 1.00 0.00 H new ATOM 0 HB3 ALA A 79 18.931 -18.825 -17.016 1.00 0.00 H new ATOM 1241 N SER A 80 15.648 -18.529 -16.687 1.00 0.00 N ATOM 1242 CA SER A 80 14.465 -18.962 -17.422 1.00 0.00 C ATOM 1243 C SER A 80 13.237 -18.162 -16.995 1.00 0.00 C ATOM 1244 O SER A 80 12.467 -17.695 -17.833 1.00 0.00 O ATOM 1245 CB SER A 80 14.217 -20.456 -17.198 1.00 0.00 C ATOM 1246 OG SER A 80 14.696 -21.221 -18.289 1.00 0.00 O ATOM 0 H SER A 80 15.783 -18.998 -15.791 1.00 0.00 H new ATOM 0 HA SER A 80 14.642 -18.785 -18.483 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.711 -20.776 -16.281 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.150 -20.635 -17.065 1.00 0.00 H new ATOM 0 HG SER A 80 14.527 -22.172 -18.121 1.00 0.00 H new ATOM 1252 N GLU A 81 13.064 -18.010 -15.686 1.00 0.00 N ATOM 1253 CA GLU A 81 11.930 -17.268 -15.148 1.00 0.00 C ATOM 1254 C GLU A 81 11.828 -15.888 -15.792 1.00 0.00 C ATOM 1255 O GLU A 81 10.794 -15.528 -16.356 1.00 0.00 O ATOM 1256 CB GLU A 81 12.060 -17.125 -13.630 1.00 0.00 C ATOM 1257 CG GLU A 81 11.668 -18.378 -12.865 1.00 0.00 C ATOM 1258 CD GLU A 81 12.410 -18.515 -11.549 1.00 0.00 C ATOM 1259 OE1 GLU A 81 13.594 -18.122 -11.493 1.00 0.00 O ATOM 1260 OE2 GLU A 81 11.806 -19.013 -10.577 1.00 0.00 O ATOM 0 H GLU A 81 13.694 -18.390 -14.979 1.00 0.00 H new ATOM 0 HA GLU A 81 11.022 -17.826 -15.377 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.090 -16.867 -13.385 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.436 -16.296 -13.297 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.595 -18.361 -12.673 1.00 0.00 H new ATOM 0 HG3 GLU A 81 11.867 -19.254 -13.483 1.00 0.00 H new ATOM 1267 N THR A 82 12.908 -15.119 -15.705 1.00 0.00 N ATOM 1268 CA THR A 82 12.941 -13.779 -16.277 1.00 0.00 C ATOM 1269 C THR A 82 12.576 -13.804 -17.757 1.00 0.00 C ATOM 1270 O THR A 82 11.921 -12.892 -18.261 1.00 0.00 O ATOM 1271 CB THR A 82 14.329 -13.132 -16.113 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.332 -13.965 -16.705 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.651 -12.908 -14.643 1.00 0.00 C ATOM 0 H THR A 82 13.773 -15.402 -15.243 1.00 0.00 H new ATOM 0 HA THR A 82 12.205 -13.185 -15.734 1.00 0.00 H new ATOM 0 HB THR A 82 14.317 -12.166 -16.618 1.00 0.00 H new ATOM 0 HG1 THR A 82 16.211 -13.545 -16.598 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.636 -12.450 -14.552 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.903 -12.249 -14.203 1.00 0.00 H new ATOM 0 HG23 THR A 82 14.646 -13.864 -14.120 1.00 0.00 H new ATOM 1281 N LYS A 83 13.004 -14.854 -18.449 1.00 0.00 N ATOM 1282 CA LYS A 83 12.721 -15.000 -19.872 1.00 0.00 C ATOM 1283 C LYS A 83 11.218 -14.991 -20.132 1.00 0.00 C ATOM 1284 O LYS A 83 10.744 -14.357 -21.076 1.00 0.00 O ATOM 1285 CB LYS A 83 13.334 -16.298 -20.404 1.00 0.00 C ATOM 1286 CG LYS A 83 13.341 -16.389 -21.920 1.00 0.00 C ATOM 1287 CD LYS A 83 14.481 -17.262 -22.421 1.00 0.00 C ATOM 1288 CE LYS A 83 14.339 -17.567 -23.904 1.00 0.00 C ATOM 1289 NZ LYS A 83 15.501 -18.340 -24.424 1.00 0.00 N ATOM 0 H LYS A 83 13.549 -15.617 -18.047 1.00 0.00 H new ATOM 0 HA LYS A 83 13.167 -14.154 -20.394 1.00 0.00 H new ATOM 0 HB2 LYS A 83 14.357 -16.384 -20.038 1.00 0.00 H new ATOM 0 HB3 LYS A 83 12.779 -17.145 -20.000 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.391 -16.796 -22.265 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.433 -15.390 -22.345 1.00 0.00 H new ATOM 0 HD2 LYS A 83 15.431 -16.760 -22.241 1.00 0.00 H new ATOM 0 HD3 LYS A 83 14.502 -18.195 -21.857 1.00 0.00 H new ATOM 0 HE2 LYS A 83 13.422 -18.132 -24.073 1.00 0.00 H new ATOM 0 HE3 LYS A 83 14.245 -16.634 -24.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 15.367 -18.528 -25.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 16.373 -17.791 -24.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 15.575 -19.242 -23.911 1.00 0.00 H new ATOM 1303 N THR A 84 10.472 -15.696 -19.287 1.00 0.00 N ATOM 1304 CA THR A 84 9.023 -15.769 -19.425 1.00 0.00 C ATOM 1305 C THR A 84 8.339 -14.663 -18.630 1.00 0.00 C ATOM 1306 O THR A 84 7.332 -14.897 -17.961 1.00 0.00 O ATOM 1307 CB THR A 84 8.481 -17.133 -18.957 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.061 -17.181 -19.129 1.00 0.00 O ATOM 1309 CG2 THR A 84 8.830 -17.381 -17.498 1.00 0.00 C ATOM 0 H THR A 84 10.848 -16.225 -18.500 1.00 0.00 H new ATOM 0 HA THR A 84 8.800 -15.643 -20.484 1.00 0.00 H new ATOM 0 HB THR A 84 8.945 -17.911 -19.562 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.652 -16.405 -18.692 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.437 -18.350 -17.190 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.913 -17.373 -17.377 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.390 -16.598 -16.880 1.00 0.00 H new ATOM 1317 N PHE A 85 8.891 -13.457 -18.706 1.00 0.00 N ATOM 1318 CA PHE A 85 8.334 -12.314 -17.992 1.00 0.00 C ATOM 1319 C PHE A 85 7.949 -11.201 -18.963 1.00 0.00 C ATOM 1320 O PHE A 85 6.814 -10.721 -18.957 1.00 0.00 O ATOM 1321 CB PHE A 85 9.339 -11.786 -16.967 1.00 0.00 C ATOM 1322 CG PHE A 85 8.788 -11.708 -15.572 1.00 0.00 C ATOM 1323 CD1 PHE A 85 8.458 -12.861 -14.878 1.00 0.00 C ATOM 1324 CD2 PHE A 85 8.601 -10.482 -14.954 1.00 0.00 C ATOM 1325 CE1 PHE A 85 7.950 -12.792 -13.595 1.00 0.00 C ATOM 1326 CE2 PHE A 85 8.094 -10.407 -13.670 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.769 -11.564 -12.990 1.00 0.00 C ATOM 0 H PHE A 85 9.724 -13.246 -19.255 1.00 0.00 H new ATOM 0 HA PHE A 85 7.436 -12.646 -17.472 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.218 -12.431 -16.966 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.672 -10.794 -17.274 1.00 0.00 H new ATOM 0 HD1 PHE A 85 8.599 -13.824 -15.345 1.00 0.00 H new ATOM 0 HD2 PHE A 85 8.854 -9.574 -15.482 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.695 -13.698 -13.066 1.00 0.00 H new ATOM 0 HE2 PHE A 85 7.952 -9.445 -13.200 1.00 0.00 H new ATOM 0 HZ PHE A 85 7.374 -11.509 -11.986 1.00 0.00 H new ATOM 1337 N LEU A 86 8.901 -10.796 -19.796 1.00 0.00 N ATOM 1338 CA LEU A 86 8.663 -9.739 -20.773 1.00 0.00 C ATOM 1339 C LEU A 86 8.855 -10.258 -22.194 1.00 0.00 C ATOM 1340 O LEU A 86 8.360 -9.668 -23.154 1.00 0.00 O ATOM 1341 CB LEU A 86 9.603 -8.560 -20.517 1.00 0.00 C ATOM 1342 CG LEU A 86 11.099 -8.854 -20.643 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.496 -8.983 -22.105 1.00 0.00 C ATOM 1344 CD2 LEU A 86 11.915 -7.766 -19.961 1.00 0.00 C ATOM 0 H LEU A 86 9.845 -11.183 -19.815 1.00 0.00 H new ATOM 0 HA LEU A 86 7.632 -9.403 -20.665 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.350 -7.762 -21.215 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.411 -8.179 -19.514 1.00 0.00 H new ATOM 0 HG LEU A 86 11.307 -9.802 -20.146 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.563 -9.192 -22.175 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.936 -9.798 -22.564 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.274 -8.052 -22.626 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.977 -7.991 -20.060 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.703 -6.805 -20.429 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.651 -7.721 -18.904 1.00 0.00 H new ATOM 1356 N ALA A 87 9.576 -11.368 -22.321 1.00 0.00 N ATOM 1357 CA ALA A 87 9.829 -11.969 -23.624 1.00 0.00 C ATOM 1358 C ALA A 87 8.698 -12.911 -24.024 1.00 0.00 C ATOM 1359 O ALA A 87 8.751 -13.548 -25.075 1.00 0.00 O ATOM 1360 CB ALA A 87 11.157 -12.712 -23.613 1.00 0.00 C ATOM 0 H ALA A 87 9.995 -11.868 -21.537 1.00 0.00 H new ATOM 0 HA ALA A 87 9.878 -11.168 -24.362 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.334 -13.156 -24.593 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.962 -12.015 -23.380 1.00 0.00 H new ATOM 0 HB3 ALA A 87 11.128 -13.498 -22.858 1.00 0.00 H new ATOM 1366 N ALA A 88 7.676 -12.993 -23.178 1.00 0.00 N ATOM 1367 CA ALA A 88 6.532 -13.856 -23.445 1.00 0.00 C ATOM 1368 C ALA A 88 5.282 -13.034 -23.739 1.00 0.00 C ATOM 1369 O ALA A 88 4.263 -13.570 -24.173 1.00 0.00 O ATOM 1370 CB ALA A 88 6.288 -14.788 -22.267 1.00 0.00 C ATOM 0 H ALA A 88 7.617 -12.473 -22.303 1.00 0.00 H new ATOM 0 HA ALA A 88 6.758 -14.455 -24.327 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.431 -15.427 -22.480 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.170 -15.407 -22.104 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.088 -14.199 -21.372 1.00 0.00 H new ATOM 1376 N ALA A 89 5.367 -11.729 -23.501 1.00 0.00 N ATOM 1377 CA ALA A 89 4.243 -10.833 -23.742 1.00 0.00 C ATOM 1378 C ALA A 89 3.838 -10.845 -25.212 1.00 0.00 C ATOM 1379 O ALA A 89 2.751 -11.305 -25.563 1.00 0.00 O ATOM 1380 CB ALA A 89 4.590 -9.420 -23.299 1.00 0.00 C ATOM 0 H ALA A 89 6.203 -11.269 -23.141 1.00 0.00 H new ATOM 0 HA ALA A 89 3.395 -11.187 -23.156 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.741 -8.762 -23.485 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.823 -9.419 -22.234 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.454 -9.065 -23.860 1.00 0.00 H new ATOM 1386 N ASP A 90 4.718 -10.335 -26.067 1.00 0.00 N ATOM 1387 CA ASP A 90 4.451 -10.287 -27.500 1.00 0.00 C ATOM 1388 C ASP A 90 5.742 -10.078 -28.286 1.00 0.00 C ATOM 1389 O ASP A 90 6.814 -9.904 -27.705 1.00 0.00 O ATOM 1390 CB ASP A 90 3.459 -9.167 -27.819 1.00 0.00 C ATOM 1391 CG ASP A 90 2.017 -9.609 -27.660 1.00 0.00 C ATOM 1392 OD1 ASP A 90 1.497 -10.276 -28.578 1.00 0.00 O ATOM 1393 OD2 ASP A 90 1.409 -9.286 -26.617 1.00 0.00 O ATOM 0 H ASP A 90 5.622 -9.949 -25.793 1.00 0.00 H new ATOM 0 HA ASP A 90 4.016 -11.242 -27.796 1.00 0.00 H new ATOM 0 HB2 ASP A 90 3.650 -8.318 -27.163 1.00 0.00 H new ATOM 0 HB3 ASP A 90 3.620 -8.823 -28.841 1.00 0.00 H new ATOM 1398 N HIS A 91 5.632 -10.099 -29.610 1.00 0.00 N ATOM 1399 CA HIS A 91 6.791 -9.912 -30.476 1.00 0.00 C ATOM 1400 C HIS A 91 6.590 -8.717 -31.403 1.00 0.00 C ATOM 1401 O HIS A 91 7.017 -8.735 -32.557 1.00 0.00 O ATOM 1402 CB HIS A 91 7.046 -11.174 -31.301 1.00 0.00 C ATOM 1403 CG HIS A 91 5.814 -11.723 -31.953 1.00 0.00 C ATOM 1404 ND1 HIS A 91 5.243 -11.161 -33.075 1.00 0.00 N ATOM 1405 CD2 HIS A 91 5.045 -12.790 -31.635 1.00 0.00 C ATOM 1406 CE1 HIS A 91 4.174 -11.858 -33.419 1.00 0.00 C ATOM 1407 NE2 HIS A 91 4.032 -12.852 -32.561 1.00 0.00 N ATOM 0 H HIS A 91 4.753 -10.243 -30.107 1.00 0.00 H new ATOM 0 HA HIS A 91 7.658 -9.718 -29.844 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.786 -10.952 -32.070 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.477 -11.939 -30.655 1.00 0.00 H new ATOM 0 HD1 HIS A 91 5.591 -10.336 -33.563 1.00 0.00 H new ATOM 0 HD2 HIS A 91 5.199 -13.467 -30.808 1.00 0.00 H new ATOM 0 HE1 HIS A 91 3.527 -11.650 -34.258 1.00 0.00 H new ATOM 1415 N ASP A 92 5.938 -7.680 -30.889 1.00 0.00 N ATOM 1416 CA ASP A 92 5.681 -6.475 -31.670 1.00 0.00 C ATOM 1417 C ASP A 92 6.975 -5.921 -32.257 1.00 0.00 C ATOM 1418 O ASP A 92 6.990 -5.398 -33.370 1.00 0.00 O ATOM 1419 CB ASP A 92 5.004 -5.413 -30.802 1.00 0.00 C ATOM 1420 CG ASP A 92 4.758 -4.120 -31.554 1.00 0.00 C ATOM 1421 OD1 ASP A 92 5.678 -3.278 -31.601 1.00 0.00 O ATOM 1422 OD2 ASP A 92 3.646 -3.951 -32.096 1.00 0.00 O ATOM 0 H ASP A 92 5.578 -7.649 -29.935 1.00 0.00 H new ATOM 0 HA ASP A 92 5.015 -6.740 -32.491 1.00 0.00 H new ATOM 0 HB2 ASP A 92 4.055 -5.801 -30.433 1.00 0.00 H new ATOM 0 HB3 ASP A 92 5.626 -5.210 -29.930 1.00 0.00 H new ATOM 1427 N GLY A 93 8.061 -6.039 -31.498 1.00 0.00 N ATOM 1428 CA GLY A 93 9.345 -5.544 -31.958 1.00 0.00 C ATOM 1429 C GLY A 93 10.502 -6.088 -31.144 1.00 0.00 C ATOM 1430 O GLY A 93 11.393 -6.746 -31.682 1.00 0.00 O ATOM 0 H GLY A 93 8.074 -6.469 -30.573 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.482 -5.816 -33.005 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.350 -4.455 -31.908 1.00 0.00 H new ATOM 1434 N ASP A 94 10.490 -5.813 -29.845 1.00 0.00 N ATOM 1435 CA ASP A 94 11.547 -6.279 -28.955 1.00 0.00 C ATOM 1436 C ASP A 94 10.990 -6.601 -27.571 1.00 0.00 C ATOM 1437 O ASP A 94 11.707 -6.545 -26.574 1.00 0.00 O ATOM 1438 CB ASP A 94 12.650 -5.225 -28.842 1.00 0.00 C ATOM 1439 CG ASP A 94 14.013 -5.772 -29.216 1.00 0.00 C ATOM 1440 OD1 ASP A 94 14.711 -6.289 -28.319 1.00 0.00 O ATOM 1441 OD2 ASP A 94 14.383 -5.682 -30.406 1.00 0.00 O ATOM 0 H ASP A 94 9.760 -5.270 -29.384 1.00 0.00 H new ATOM 0 HA ASP A 94 11.969 -7.191 -29.378 1.00 0.00 H new ATOM 0 HB2 ASP A 94 12.410 -4.381 -29.489 1.00 0.00 H new ATOM 0 HB3 ASP A 94 12.682 -4.845 -27.821 1.00 0.00 H new ATOM 1446 N GLY A 95 9.704 -6.937 -27.520 1.00 0.00 N ATOM 1447 CA GLY A 95 9.072 -7.261 -26.255 1.00 0.00 C ATOM 1448 C GLY A 95 8.965 -6.060 -25.336 1.00 0.00 C ATOM 1449 O GLY A 95 8.752 -6.207 -24.132 1.00 0.00 O ATOM 0 H GLY A 95 9.089 -6.990 -28.332 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.076 -7.661 -26.442 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.642 -8.045 -25.758 1.00 0.00 H new ATOM 1453 N LYS A 96 9.114 -4.868 -25.903 1.00 0.00 N ATOM 1454 CA LYS A 96 9.034 -3.636 -25.127 1.00 0.00 C ATOM 1455 C LYS A 96 7.625 -3.428 -24.581 1.00 0.00 C ATOM 1456 O LYS A 96 6.725 -3.001 -25.306 1.00 0.00 O ATOM 1457 CB LYS A 96 9.440 -2.439 -25.990 1.00 0.00 C ATOM 1458 CG LYS A 96 10.688 -2.683 -26.821 1.00 0.00 C ATOM 1459 CD LYS A 96 11.460 -1.396 -27.059 1.00 0.00 C ATOM 1460 CE LYS A 96 12.316 -1.030 -25.856 1.00 0.00 C ATOM 1461 NZ LYS A 96 13.552 -0.301 -26.256 1.00 0.00 N ATOM 0 H LYS A 96 9.291 -4.729 -26.898 1.00 0.00 H new ATOM 0 HA LYS A 96 9.722 -3.720 -24.286 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.615 -2.185 -26.655 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.606 -1.576 -25.345 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.329 -3.404 -26.314 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.409 -3.123 -27.778 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.095 -1.508 -27.938 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.762 -0.586 -27.271 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.735 -0.412 -25.172 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.588 -1.936 -25.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.108 -0.069 -25.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.119 -0.900 -26.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.293 0.577 -26.750 1.00 0.00 H new ATOM 1475 N ILE A 97 7.441 -3.730 -23.300 1.00 0.00 N ATOM 1476 CA ILE A 97 6.143 -3.573 -22.658 1.00 0.00 C ATOM 1477 C ILE A 97 5.690 -2.117 -22.680 1.00 0.00 C ATOM 1478 O ILE A 97 6.510 -1.200 -22.633 1.00 0.00 O ATOM 1479 CB ILE A 97 6.173 -4.067 -21.199 1.00 0.00 C ATOM 1480 CG1 ILE A 97 6.758 -5.479 -21.128 1.00 0.00 C ATOM 1481 CG2 ILE A 97 4.774 -4.037 -20.600 1.00 0.00 C ATOM 1482 CD1 ILE A 97 6.000 -6.490 -21.960 1.00 0.00 C ATOM 0 H ILE A 97 8.175 -4.085 -22.687 1.00 0.00 H new ATOM 0 HA ILE A 97 5.436 -4.179 -23.225 1.00 0.00 H new ATOM 0 HB ILE A 97 6.810 -3.400 -20.618 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.795 -5.451 -21.461 1.00 0.00 H new ATOM 0 HG13 ILE A 97 6.766 -5.808 -20.089 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.812 -4.389 -19.569 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.391 -3.017 -20.621 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.116 -4.684 -21.180 1.00 0.00 H new ATOM 0 HD11 ILE A 97 6.471 -7.468 -21.862 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.968 -6.547 -21.612 1.00 0.00 H new ATOM 0 HD13 ILE A 97 6.014 -6.184 -23.006 1.00 0.00 H new ATOM 1494 N GLY A 98 4.379 -1.911 -22.751 1.00 0.00 N ATOM 1495 CA GLY A 98 3.839 -0.564 -22.776 1.00 0.00 C ATOM 1496 C GLY A 98 2.500 -0.462 -22.073 1.00 0.00 C ATOM 1497 O GLY A 98 1.537 0.063 -22.631 1.00 0.00 O ATOM 0 H GLY A 98 3.680 -2.653 -22.792 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.547 0.117 -22.303 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.728 -0.240 -23.811 1.00 0.00 H new ATOM 1501 N ALA A 99 2.438 -0.967 -20.846 1.00 0.00 N ATOM 1502 CA ALA A 99 1.207 -0.931 -20.066 1.00 0.00 C ATOM 1503 C ALA A 99 0.036 -1.498 -20.861 1.00 0.00 C ATOM 1504 O ALA A 99 -1.017 -0.870 -20.964 1.00 0.00 O ATOM 1505 CB ALA A 99 0.906 0.493 -19.622 1.00 0.00 C ATOM 0 H ALA A 99 3.226 -1.406 -20.370 1.00 0.00 H new ATOM 0 HA ALA A 99 1.347 -1.554 -19.183 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.016 0.506 -19.040 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.727 0.864 -19.009 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.791 1.131 -20.498 1.00 0.00 H new ATOM 1511 N GLU A 100 0.229 -2.688 -21.421 1.00 0.00 N ATOM 1512 CA GLU A 100 -0.812 -3.338 -22.208 1.00 0.00 C ATOM 1513 C GLU A 100 -0.441 -4.787 -22.511 1.00 0.00 C ATOM 1514 O GLU A 100 -1.302 -5.666 -22.533 1.00 0.00 O ATOM 1515 CB GLU A 100 -1.045 -2.577 -23.515 1.00 0.00 C ATOM 1516 CG GLU A 100 0.087 -2.726 -24.517 1.00 0.00 C ATOM 1517 CD GLU A 100 -0.037 -1.768 -25.685 1.00 0.00 C ATOM 1518 OE1 GLU A 100 -1.177 -1.385 -26.021 1.00 0.00 O ATOM 1519 OE2 GLU A 100 1.008 -1.401 -26.264 1.00 0.00 O ATOM 0 H GLU A 100 1.095 -3.221 -21.344 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.731 -3.331 -21.622 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.971 -2.929 -23.970 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -1.183 -1.519 -23.290 1.00 0.00 H new ATOM 0 HG2 GLU A 100 1.038 -2.556 -24.012 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.103 -3.749 -24.892 1.00 0.00 H new ATOM 1526 N GLU A 101 0.846 -5.026 -22.742 1.00 0.00 N ATOM 1527 CA GLU A 101 1.330 -6.368 -23.045 1.00 0.00 C ATOM 1528 C GLU A 101 1.393 -7.221 -21.781 1.00 0.00 C ATOM 1529 O GLU A 101 1.215 -8.438 -21.831 1.00 0.00 O ATOM 1530 CB GLU A 101 2.713 -6.300 -23.696 1.00 0.00 C ATOM 1531 CG GLU A 101 2.675 -5.914 -25.166 1.00 0.00 C ATOM 1532 CD GLU A 101 3.999 -5.363 -25.659 1.00 0.00 C ATOM 1533 OE1 GLU A 101 5.041 -5.999 -25.398 1.00 0.00 O ATOM 1534 OE2 GLU A 101 3.992 -4.295 -26.306 1.00 0.00 O ATOM 0 H GLU A 101 1.571 -4.309 -22.725 1.00 0.00 H new ATOM 0 HA GLU A 101 0.631 -6.831 -23.741 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.325 -5.578 -23.155 1.00 0.00 H new ATOM 0 HB3 GLU A 101 3.201 -7.270 -23.596 1.00 0.00 H new ATOM 0 HG2 GLU A 101 2.405 -6.787 -25.760 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.895 -5.169 -25.322 1.00 0.00 H new ATOM 1541 N PHE A 102 1.648 -6.573 -20.649 1.00 0.00 N ATOM 1542 CA PHE A 102 1.736 -7.272 -19.372 1.00 0.00 C ATOM 1543 C PHE A 102 0.357 -7.414 -18.733 1.00 0.00 C ATOM 1544 O PHE A 102 0.062 -8.419 -18.088 1.00 0.00 O ATOM 1545 CB PHE A 102 2.676 -6.526 -18.422 1.00 0.00 C ATOM 1546 CG PHE A 102 3.336 -7.418 -17.410 1.00 0.00 C ATOM 1547 CD1 PHE A 102 2.594 -8.009 -16.400 1.00 0.00 C ATOM 1548 CD2 PHE A 102 4.698 -7.664 -17.467 1.00 0.00 C ATOM 1549 CE1 PHE A 102 3.198 -8.830 -15.466 1.00 0.00 C ATOM 1550 CE2 PHE A 102 5.308 -8.484 -16.536 1.00 0.00 C ATOM 1551 CZ PHE A 102 4.557 -9.067 -15.534 1.00 0.00 C ATOM 0 H PHE A 102 1.797 -5.566 -20.590 1.00 0.00 H new ATOM 0 HA PHE A 102 2.135 -8.269 -19.559 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.445 -6.022 -19.007 1.00 0.00 H new ATOM 0 HB3 PHE A 102 2.113 -5.752 -17.900 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.531 -7.826 -16.342 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.290 -7.210 -18.248 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.608 -9.285 -14.684 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.371 -8.669 -16.592 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.032 -9.707 -14.805 1.00 0.00 H new ATOM 1561 N GLN A 103 -0.481 -6.399 -18.919 1.00 0.00 N ATOM 1562 CA GLN A 103 -1.828 -6.410 -18.360 1.00 0.00 C ATOM 1563 C GLN A 103 -2.666 -7.523 -18.981 1.00 0.00 C ATOM 1564 O GLN A 103 -3.465 -8.164 -18.300 1.00 0.00 O ATOM 1565 CB GLN A 103 -2.507 -5.058 -18.585 1.00 0.00 C ATOM 1566 CG GLN A 103 -2.079 -3.990 -17.591 1.00 0.00 C ATOM 1567 CD GLN A 103 -0.574 -3.822 -17.527 1.00 0.00 C ATOM 1568 OE1 GLN A 103 0.031 -3.942 -16.461 1.00 0.00 O ATOM 1569 NE2 GLN A 103 0.040 -3.543 -18.670 1.00 0.00 N ATOM 0 H GLN A 103 -0.251 -5.560 -19.452 1.00 0.00 H new ATOM 0 HA GLN A 103 -1.748 -6.595 -17.289 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.285 -4.713 -19.595 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.587 -5.188 -18.523 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.536 -3.039 -17.866 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -2.454 -4.249 -16.601 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.500 -3.452 -19.530 1.00 0.00 H new ATOM 0 HE22 GLN A 103 1.052 -3.419 -18.688 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.477 -7.745 -20.278 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.218 -8.780 -20.991 1.00 0.00 C ATOM 1580 C GLU A 104 -2.660 -10.165 -20.673 1.00 0.00 C ATOM 1581 O GLU A 104 -3.368 -11.167 -20.767 1.00 0.00 O ATOM 1582 CB GLU A 104 -3.164 -8.530 -22.499 1.00 0.00 C ATOM 1583 CG GLU A 104 -1.820 -8.864 -23.124 1.00 0.00 C ATOM 1584 CD GLU A 104 -1.726 -8.427 -24.573 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -1.820 -7.209 -24.834 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -1.557 -9.303 -25.447 1.00 0.00 O ATOM 0 H GLU A 104 -1.818 -7.223 -20.856 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.256 -8.741 -20.661 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.939 -9.123 -22.985 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.395 -7.483 -22.694 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.027 -8.383 -22.551 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.651 -9.939 -23.061 1.00 0.00 H new ATOM 1593 N MET A 105 -1.386 -10.211 -20.299 1.00 0.00 N ATOM 1594 CA MET A 105 -0.732 -11.472 -19.967 1.00 0.00 C ATOM 1595 C MET A 105 -1.324 -12.073 -18.697 1.00 0.00 C ATOM 1596 O MET A 105 -1.327 -13.291 -18.517 1.00 0.00 O ATOM 1597 CB MET A 105 0.773 -11.260 -19.791 1.00 0.00 C ATOM 1598 CG MET A 105 1.468 -12.407 -19.076 1.00 0.00 C ATOM 1599 SD MET A 105 3.069 -12.810 -19.802 1.00 0.00 S ATOM 1600 CE MET A 105 3.884 -11.217 -19.729 1.00 0.00 C ATOM 0 H MET A 105 -0.786 -9.390 -20.218 1.00 0.00 H new ATOM 0 HA MET A 105 -0.900 -12.167 -20.790 1.00 0.00 H new ATOM 0 HB2 MET A 105 1.230 -11.124 -20.771 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.939 -10.340 -19.231 1.00 0.00 H new ATOM 0 HG2 MET A 105 1.605 -12.146 -18.027 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.828 -13.289 -19.105 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.829 -11.267 -20.269 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.245 -10.460 -20.185 1.00 0.00 H new ATOM 0 HE3 MET A 105 4.074 -10.953 -18.689 1.00 0.00 H new ATOM 1610 N VAL A 106 -1.825 -11.212 -17.817 1.00 0.00 N ATOM 1611 CA VAL A 106 -2.421 -11.659 -16.563 1.00 0.00 C ATOM 1612 C VAL A 106 -3.902 -11.975 -16.741 1.00 0.00 C ATOM 1613 O VAL A 106 -4.357 -13.068 -16.405 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.263 -10.598 -15.457 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -2.771 -11.134 -14.127 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -0.811 -10.159 -15.345 1.00 0.00 C ATOM 0 H VAL A 106 -1.830 -10.201 -17.949 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.892 -12.565 -16.266 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.863 -9.727 -15.723 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -2.651 -10.371 -13.358 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.825 -11.395 -14.219 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -2.201 -12.021 -13.850 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.717 -9.409 -14.559 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.188 -11.020 -15.102 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.486 -9.733 -16.294 1.00 0.00 H new ATOM 1626 N GLN A 107 -4.648 -11.012 -17.271 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.078 -11.189 -17.493 1.00 0.00 C ATOM 1628 C GLN A 107 -6.353 -12.461 -18.287 1.00 0.00 C ATOM 1629 O GLN A 107 -7.249 -13.234 -17.950 1.00 0.00 O ATOM 1630 CB GLN A 107 -6.655 -9.978 -18.230 1.00 0.00 C ATOM 1631 CG GLN A 107 -6.591 -8.690 -17.426 1.00 0.00 C ATOM 1632 CD GLN A 107 -6.911 -8.900 -15.959 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -8.030 -9.269 -15.603 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -5.927 -8.666 -15.099 1.00 0.00 N ATOM 0 H GLN A 107 -4.286 -10.101 -17.555 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.562 -11.278 -16.521 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -6.113 -9.840 -19.165 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.693 -10.183 -18.491 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.594 -8.258 -17.518 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -7.291 -7.969 -17.847 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -5.015 -8.361 -15.438 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -6.083 -8.791 -14.099 1.00 0.00 H new ATOM 1643 N SER A 108 -5.575 -12.672 -19.345 1.00 0.00 N ATOM 1644 CA SER A 108 -5.738 -13.848 -20.191 1.00 0.00 C ATOM 1645 C SER A 108 -7.151 -13.918 -20.760 1.00 0.00 C ATOM 1646 O SER A 108 -7.842 -14.924 -20.611 1.00 0.00 O ATOM 1647 CB SER A 108 -5.433 -15.120 -19.396 1.00 0.00 C ATOM 1648 OG SER A 108 -4.036 -15.331 -19.289 1.00 0.00 O ATOM 0 H SER A 108 -4.826 -12.044 -19.636 1.00 0.00 H new ATOM 0 HA SER A 108 -5.035 -13.768 -21.020 1.00 0.00 H new ATOM 0 HB2 SER A 108 -5.870 -15.044 -18.400 1.00 0.00 H new ATOM 0 HB3 SER A 108 -5.897 -15.977 -19.883 1.00 0.00 H new ATOM 0 HG SER A 108 -3.867 -16.148 -18.776 1.00 0.00 H new TER 1654 SER A 108