USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 920 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: B 113 SER OG : rot 180:sc= 0.00555 USER MOD Set 1.2: B 114 HIS : no HD1:sc= 0 X(o=0.0055,f=0.0055) USER MOD Set 2.1: B 89 GLN : amide:sc= -4.08! C(o=-4!,f=-5.1!) USER MOD Set 2.2: B 93 HIS : no HE2:sc= 0.109 K(o=-4,f=-5.1) USER MOD Set 3.1: B 53 ASN : amide:sc= -3.51! K(o=-3.3!,f=-1.5) USER MOD Set 3.2: B 54 SER OG : rot 180:sc= 0.248 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -59:sc= 0.0479 USER MOD Single : A 3 GLN : amide:sc= -0.945 K(o=-0.95,f=-0.075) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0422 USER MOD Single : A 14 THR OG1 : rot -44:sc= 0.485 USER MOD Single : A 17 GLN : amide:sc= -1.02 K(o=-1,f=-0.31) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 GLN : amide:sc= -0.812 K(o=-0.81,f=0) USER MOD Single : B 40 SER OG : rot -75:sc= 1.29 USER MOD Single : B 41 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 LYS NZ :NH3+ 170:sc= -0.029 (180deg=-0.199) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.0216 X(o=-0.022,f=0) USER MOD Single : B 68 ASN : amide:sc= -0.0225 K(o=-0.023,f=-2.8!) USER MOD Single : B 69 SER OG : rot 180:sc= -0.0182 USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 81 TYR OH : rot 100:sc= 0.72 USER MOD Single : B 84 GLN : amide:sc= 0.646 K(o=0.65,f=-2.1) USER MOD Single : B 87 SER OG : rot -110:sc= 0.428 USER MOD Single : B 90 GLN : amide:sc= -0.931 K(o=-0.93,f=-0.22) USER MOD Single : B 91 TYR OH : rot 28:sc= -0.119 USER MOD Single : B 94 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : B 97 THR OG1 : rot -165:sc= 1.25 USER MOD Single : B 102 THR OG1 : rot -30:sc= -1.29 USER MOD Single : B 103 THR OG1 : rot -95:sc= 1.07 USER MOD Single : B 104 THR OG1 : rot 180:sc= -0.398 USER MOD Single : B 105 SER OG : rot 180:sc= 0 USER MOD Single : B 106 THR OG1 : rot -37:sc= 0.0686 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 115 HIS : no HD1:sc= -0.0653 X(o=-0.065,f=0) USER MOD Single : B 116 HIS : no HD1:sc=-0.00662 X(o=-0.0066,f=0) USER MOD Single : B 117 HIS : no HD1:sc= -0.0978 X(o=-0.098,f=0) USER MOD Single : B 118 HIS : no HD1:sc= -0.199 X(o=-0.2,f=-0.21) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=-0.00025) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.662 16.707 6.323 1.00 0.00 N ATOM 2 CA GLY A 1 -9.189 16.747 6.178 1.00 0.00 C ATOM 3 C GLY A 1 -8.585 17.959 6.847 1.00 0.00 C ATOM 4 O GLY A 1 -8.474 19.025 6.238 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.035 15.859 5.849 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.911 16.677 7.332 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.077 17.556 5.889 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.758 15.843 6.609 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.929 16.751 5.119 1.00 0.00 H new ATOM 10 N SER A 2 -8.205 17.805 8.104 1.00 0.00 N ATOM 11 CA SER A 2 -7.588 18.884 8.853 1.00 0.00 C ATOM 12 C SER A 2 -6.825 18.309 10.042 1.00 0.00 C ATOM 13 O SER A 2 -7.029 18.714 11.185 1.00 0.00 O ATOM 14 CB SER A 2 -8.657 19.881 9.323 1.00 0.00 C ATOM 15 OG SER A 2 -8.074 21.077 9.816 1.00 0.00 O ATOM 0 H SER A 2 -8.314 16.937 8.629 1.00 0.00 H new ATOM 0 HA SER A 2 -6.887 19.416 8.210 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.326 20.116 8.495 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.265 19.423 10.103 1.00 0.00 H new ATOM 0 HG SER A 2 -7.481 20.866 10.567 1.00 0.00 H new ATOM 21 N GLN A 3 -5.953 17.347 9.764 1.00 0.00 N ATOM 22 CA GLN A 3 -5.182 16.689 10.813 1.00 0.00 C ATOM 23 C GLN A 3 -3.724 17.134 10.775 1.00 0.00 C ATOM 24 O GLN A 3 -2.864 16.536 11.424 1.00 0.00 O ATOM 25 CB GLN A 3 -5.268 15.166 10.668 1.00 0.00 C ATOM 26 CG GLN A 3 -6.679 14.615 10.800 1.00 0.00 C ATOM 27 CD GLN A 3 -7.298 14.880 12.161 1.00 0.00 C ATOM 28 OE1 GLN A 3 -8.513 15.041 12.282 1.00 0.00 O ATOM 29 NE2 GLN A 3 -6.476 14.914 13.198 1.00 0.00 N ATOM 0 H GLN A 3 -5.762 17.005 8.822 1.00 0.00 H new ATOM 0 HA GLN A 3 -5.608 16.977 11.774 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -4.866 14.880 9.696 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.635 14.702 11.424 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -7.309 15.058 10.029 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -6.661 13.540 10.619 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -5.475 14.776 13.060 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -6.844 15.078 14.135 1.00 0.00 H new ATOM 38 N THR A 4 -3.462 18.189 10.005 1.00 0.00 N ATOM 39 CA THR A 4 -2.113 18.724 9.836 1.00 0.00 C ATOM 40 C THR A 4 -1.196 17.649 9.252 1.00 0.00 C ATOM 41 O THR A 4 -0.043 17.499 9.655 1.00 0.00 O ATOM 42 CB THR A 4 -1.539 19.236 11.177 1.00 0.00 C ATOM 43 OG1 THR A 4 -2.580 19.855 11.947 1.00 0.00 O ATOM 44 CG2 THR A 4 -0.424 20.246 10.944 1.00 0.00 C ATOM 0 H THR A 4 -4.177 18.695 9.482 1.00 0.00 H new ATOM 0 HA THR A 4 -2.168 19.568 9.149 1.00 0.00 H new ATOM 0 HB THR A 4 -1.132 18.382 11.718 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.212 20.176 12.796 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.038 20.590 11.904 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.380 19.776 10.377 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.814 21.096 10.384 1.00 0.00 H new ATOM 52 N THR A 5 -1.727 16.902 8.294 1.00 0.00 N ATOM 53 CA THR A 5 -1.024 15.767 7.723 1.00 0.00 C ATOM 54 C THR A 5 -0.009 16.194 6.667 1.00 0.00 C ATOM 55 O THR A 5 -0.373 16.537 5.540 1.00 0.00 O ATOM 56 CB THR A 5 -2.022 14.769 7.107 1.00 0.00 C ATOM 57 OG1 THR A 5 -3.099 15.478 6.477 1.00 0.00 O ATOM 58 CG2 THR A 5 -2.575 13.829 8.167 1.00 0.00 C ATOM 0 H THR A 5 -2.651 17.066 7.894 1.00 0.00 H new ATOM 0 HA THR A 5 -0.481 15.286 8.536 1.00 0.00 H new ATOM 0 HB THR A 5 -1.494 14.175 6.361 1.00 0.00 H new ATOM 0 HG1 THR A 5 -3.729 14.837 6.086 1.00 0.00 H new ATOM 0 HG21 THR A 5 -3.277 13.134 7.706 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.756 13.270 8.621 1.00 0.00 H new ATOM 0 HG23 THR A 5 -3.088 14.408 8.935 1.00 0.00 H new ATOM 66 N ALA A 6 1.263 16.190 7.045 1.00 0.00 N ATOM 67 CA ALA A 6 2.341 16.437 6.099 1.00 0.00 C ATOM 68 C ALA A 6 2.472 15.269 5.114 1.00 0.00 C ATOM 69 O ALA A 6 2.546 15.492 3.905 1.00 0.00 O ATOM 70 CB ALA A 6 3.655 16.704 6.825 1.00 0.00 C ATOM 0 H ALA A 6 1.573 16.018 8.002 1.00 0.00 H new ATOM 0 HA ALA A 6 2.097 17.332 5.527 1.00 0.00 H new ATOM 0 HB1 ALA A 6 4.444 16.885 6.095 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.545 17.579 7.466 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.916 15.839 7.434 1.00 0.00 H new ATOM 76 N PRO A 7 2.510 14.003 5.595 1.00 0.00 N ATOM 77 CA PRO A 7 2.441 12.840 4.708 1.00 0.00 C ATOM 78 C PRO A 7 1.016 12.592 4.221 1.00 0.00 C ATOM 79 O PRO A 7 0.050 12.863 4.938 1.00 0.00 O ATOM 80 CB PRO A 7 2.909 11.689 5.598 1.00 0.00 C ATOM 81 CG PRO A 7 2.504 12.098 6.970 1.00 0.00 C ATOM 82 CD PRO A 7 2.657 13.594 7.013 1.00 0.00 C ATOM 0 HA PRO A 7 3.042 12.966 3.808 1.00 0.00 H new ATOM 0 HB2 PRO A 7 2.442 10.747 5.309 1.00 0.00 H new ATOM 0 HB3 PRO A 7 3.987 11.545 5.528 1.00 0.00 H new ATOM 0 HG2 PRO A 7 1.475 11.804 7.178 1.00 0.00 H new ATOM 0 HG3 PRO A 7 3.131 11.619 7.722 1.00 0.00 H new ATOM 0 HD2 PRO A 7 1.898 14.056 7.644 1.00 0.00 H new ATOM 0 HD3 PRO A 7 3.627 13.886 7.416 1.00 0.00 H new ATOM 90 N ASP A 8 0.888 12.073 3.011 1.00 0.00 N ATOM 91 CA ASP A 8 -0.423 11.799 2.433 1.00 0.00 C ATOM 92 C ASP A 8 -0.623 10.296 2.297 1.00 0.00 C ATOM 93 O ASP A 8 -1.243 9.814 1.349 1.00 0.00 O ATOM 94 CB ASP A 8 -0.580 12.484 1.069 1.00 0.00 C ATOM 95 CG ASP A 8 -0.562 13.999 1.166 1.00 0.00 C ATOM 96 OD1 ASP A 8 0.518 14.598 0.985 1.00 0.00 O ATOM 97 OD2 ASP A 8 -1.627 14.598 1.421 1.00 0.00 O ATOM 0 H ASP A 8 1.674 11.832 2.408 1.00 0.00 H new ATOM 0 HA ASP A 8 -1.185 12.203 3.100 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.223 12.157 0.409 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.517 12.165 0.613 1.00 0.00 H new ATOM 102 N ALA A 9 -0.087 9.567 3.263 1.00 0.00 N ATOM 103 CA ALA A 9 -0.137 8.116 3.258 1.00 0.00 C ATOM 104 C ALA A 9 -1.319 7.608 4.075 1.00 0.00 C ATOM 105 O ALA A 9 -1.570 8.102 5.176 1.00 0.00 O ATOM 106 CB ALA A 9 1.159 7.554 3.817 1.00 0.00 C ATOM 0 H ALA A 9 0.394 9.965 4.070 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.264 7.780 2.229 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.116 6.465 3.811 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.995 7.887 3.202 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.297 7.906 4.839 1.00 0.00 H new ATOM 112 N PRO A 10 -2.065 6.627 3.541 1.00 0.00 N ATOM 113 CA PRO A 10 -3.157 5.970 4.270 1.00 0.00 C ATOM 114 C PRO A 10 -2.670 5.372 5.591 1.00 0.00 C ATOM 115 O PRO A 10 -1.758 4.543 5.607 1.00 0.00 O ATOM 116 CB PRO A 10 -3.608 4.860 3.317 1.00 0.00 C ATOM 117 CG PRO A 10 -3.191 5.324 1.967 1.00 0.00 C ATOM 118 CD PRO A 10 -1.916 6.090 2.175 1.00 0.00 C ATOM 0 HA PRO A 10 -3.954 6.664 4.535 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.141 3.908 3.570 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.686 4.709 3.368 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -3.035 4.481 1.294 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.957 5.955 1.516 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -1.041 5.446 2.089 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.800 6.886 1.440 1.00 0.00 H new ATOM 126 N PRO A 11 -3.278 5.810 6.713 1.00 0.00 N ATOM 127 CA PRO A 11 -2.879 5.404 8.072 1.00 0.00 C ATOM 128 C PRO A 11 -2.836 3.892 8.272 1.00 0.00 C ATOM 129 O PRO A 11 -1.926 3.376 8.923 1.00 0.00 O ATOM 130 CB PRO A 11 -3.961 6.017 8.962 1.00 0.00 C ATOM 131 CG PRO A 11 -4.483 7.172 8.184 1.00 0.00 C ATOM 132 CD PRO A 11 -4.403 6.767 6.740 1.00 0.00 C ATOM 0 HA PRO A 11 -1.866 5.739 8.295 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -4.750 5.297 9.179 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -3.551 6.338 9.920 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.510 7.402 8.469 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -3.892 8.068 8.371 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.330 6.306 6.400 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.217 7.624 6.092 1.00 0.00 H new ATOM 140 N ASP A 12 -3.825 3.188 7.737 1.00 0.00 N ATOM 141 CA ASP A 12 -3.860 1.733 7.839 1.00 0.00 C ATOM 142 C ASP A 12 -4.666 1.131 6.695 1.00 0.00 C ATOM 143 O ASP A 12 -5.769 1.586 6.390 1.00 0.00 O ATOM 144 CB ASP A 12 -4.455 1.279 9.186 1.00 0.00 C ATOM 145 CG ASP A 12 -5.970 1.389 9.251 1.00 0.00 C ATOM 146 OD1 ASP A 12 -6.482 2.511 9.448 1.00 0.00 O ATOM 147 OD2 ASP A 12 -6.658 0.351 9.116 1.00 0.00 O ATOM 0 H ASP A 12 -4.610 3.597 7.230 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.831 1.378 7.778 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.166 0.244 9.371 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.021 1.879 9.986 1.00 0.00 H new ATOM 152 N PRO A 13 -4.097 0.144 5.999 1.00 0.00 N ATOM 153 CA PRO A 13 -4.841 -0.682 5.059 1.00 0.00 C ATOM 154 C PRO A 13 -5.654 -1.745 5.794 1.00 0.00 C ATOM 155 O PRO A 13 -5.098 -2.605 6.480 1.00 0.00 O ATOM 156 CB PRO A 13 -3.749 -1.335 4.194 1.00 0.00 C ATOM 157 CG PRO A 13 -2.467 -0.685 4.609 1.00 0.00 C ATOM 158 CD PRO A 13 -2.680 -0.217 6.017 1.00 0.00 C ATOM 0 HA PRO A 13 -5.557 -0.107 4.472 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.713 -2.412 4.355 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -3.943 -1.178 3.133 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -1.636 -1.389 4.553 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.222 0.150 3.953 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.466 -1.000 6.745 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.044 0.633 6.266 1.00 0.00 H new ATOM 166 N THR A 14 -6.965 -1.674 5.655 1.00 0.00 N ATOM 167 CA THR A 14 -7.862 -2.579 6.348 1.00 0.00 C ATOM 168 C THR A 14 -8.292 -3.702 5.413 1.00 0.00 C ATOM 169 O THR A 14 -8.865 -3.451 4.354 1.00 0.00 O ATOM 170 CB THR A 14 -9.117 -1.838 6.840 1.00 0.00 C ATOM 171 OG1 THR A 14 -8.755 -0.558 7.388 1.00 0.00 O ATOM 172 CG2 THR A 14 -9.852 -2.653 7.897 1.00 0.00 C ATOM 0 H THR A 14 -7.436 -0.991 5.062 1.00 0.00 H new ATOM 0 HA THR A 14 -7.329 -2.989 7.206 1.00 0.00 H new ATOM 0 HB THR A 14 -9.779 -1.694 5.986 1.00 0.00 H new ATOM 0 HG1 THR A 14 -7.967 -0.659 7.961 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.735 -2.107 8.228 1.00 0.00 H new ATOM 0 HG22 THR A 14 -10.155 -3.610 7.473 1.00 0.00 H new ATOM 0 HG23 THR A 14 -9.192 -2.826 8.747 1.00 0.00 H new ATOM 180 N VAL A 15 -8.003 -4.933 5.796 1.00 0.00 N ATOM 181 CA VAL A 15 -8.357 -6.074 4.972 1.00 0.00 C ATOM 182 C VAL A 15 -9.689 -6.671 5.414 1.00 0.00 C ATOM 183 O VAL A 15 -9.817 -7.172 6.531 1.00 0.00 O ATOM 184 CB VAL A 15 -7.259 -7.160 5.005 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.704 -8.401 4.246 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.957 -6.622 4.425 1.00 0.00 C ATOM 0 H VAL A 15 -7.527 -5.167 6.667 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.452 -5.715 3.947 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.087 -7.437 6.045 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.915 -9.152 4.283 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.609 -8.802 4.703 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.908 -8.139 3.208 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.195 -7.401 4.457 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.119 -6.314 3.392 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.624 -5.765 5.011 1.00 0.00 H new ATOM 196 N ASP A 16 -10.676 -6.600 4.533 1.00 0.00 N ATOM 197 CA ASP A 16 -11.997 -7.152 4.805 1.00 0.00 C ATOM 198 C ASP A 16 -12.311 -8.269 3.820 1.00 0.00 C ATOM 199 O ASP A 16 -11.597 -8.445 2.831 1.00 0.00 O ATOM 200 CB ASP A 16 -13.080 -6.072 4.706 1.00 0.00 C ATOM 201 CG ASP A 16 -12.954 -4.998 5.771 1.00 0.00 C ATOM 202 OD1 ASP A 16 -12.989 -5.338 6.974 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.852 -3.806 5.410 1.00 0.00 O ATOM 0 H ASP A 16 -10.586 -6.162 3.616 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.990 -7.547 5.821 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -13.030 -5.606 3.722 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -14.060 -6.541 4.787 1.00 0.00 H new ATOM 208 N GLN A 17 -13.379 -9.014 4.103 1.00 0.00 N ATOM 209 CA GLN A 17 -13.834 -10.104 3.239 1.00 0.00 C ATOM 210 C GLN A 17 -12.709 -11.096 2.957 1.00 0.00 C ATOM 211 O GLN A 17 -12.314 -11.301 1.808 1.00 0.00 O ATOM 212 CB GLN A 17 -14.407 -9.555 1.929 1.00 0.00 C ATOM 213 CG GLN A 17 -15.712 -8.799 2.107 1.00 0.00 C ATOM 214 CD GLN A 17 -16.233 -8.218 0.807 1.00 0.00 C ATOM 215 OE1 GLN A 17 -16.974 -8.871 0.070 1.00 0.00 O ATOM 216 NE2 GLN A 17 -15.868 -6.977 0.530 1.00 0.00 N ATOM 0 H GLN A 17 -13.952 -8.880 4.936 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.625 -10.636 3.767 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.673 -8.893 1.470 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -14.567 -10.382 1.237 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.462 -9.470 2.527 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.566 -7.994 2.827 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.253 -6.472 1.168 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.202 -6.525 -0.321 1.00 0.00 H new ATOM 225 N VAL A 18 -12.194 -11.700 4.018 1.00 0.00 N ATOM 226 CA VAL A 18 -11.126 -12.677 3.893 1.00 0.00 C ATOM 227 C VAL A 18 -11.694 -14.040 3.511 1.00 0.00 C ATOM 228 O VAL A 18 -12.445 -14.649 4.277 1.00 0.00 O ATOM 229 CB VAL A 18 -10.318 -12.806 5.202 1.00 0.00 C ATOM 230 CG1 VAL A 18 -9.177 -13.800 5.038 1.00 0.00 C ATOM 231 CG2 VAL A 18 -9.785 -11.450 5.641 1.00 0.00 C ATOM 0 H VAL A 18 -12.500 -11.529 4.976 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.455 -12.327 3.108 1.00 0.00 H new ATOM 0 HB VAL A 18 -10.987 -13.180 5.977 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.622 -13.874 5.973 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.581 -14.778 4.777 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.510 -13.460 4.246 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.219 -11.564 6.565 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.135 -11.046 4.865 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.619 -10.768 5.808 1.00 0.00 H new ATOM 241 N ASP A 19 -11.349 -14.501 2.320 1.00 0.00 N ATOM 242 CA ASP A 19 -11.797 -15.799 1.836 1.00 0.00 C ATOM 243 C ASP A 19 -10.606 -16.758 1.804 1.00 0.00 C ATOM 244 O ASP A 19 -9.654 -16.581 2.566 1.00 0.00 O ATOM 245 CB ASP A 19 -12.426 -15.647 0.443 1.00 0.00 C ATOM 246 CG ASP A 19 -13.305 -16.822 0.056 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.452 -16.901 0.539 1.00 0.00 O ATOM 248 OD2 ASP A 19 -12.857 -17.667 -0.748 1.00 0.00 O ATOM 0 H ASP A 19 -10.755 -13.992 1.665 1.00 0.00 H new ATOM 0 HA ASP A 19 -12.556 -16.207 2.504 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.019 -14.733 0.416 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -11.633 -15.534 -0.297 1.00 0.00 H new ATOM 253 N ASP A 20 -10.650 -17.767 0.945 1.00 0.00 N ATOM 254 CA ASP A 20 -9.548 -18.716 0.835 1.00 0.00 C ATOM 255 C ASP A 20 -8.389 -18.114 0.052 1.00 0.00 C ATOM 256 O ASP A 20 -7.256 -18.079 0.530 1.00 0.00 O ATOM 257 CB ASP A 20 -10.001 -20.020 0.164 1.00 0.00 C ATOM 258 CG ASP A 20 -10.860 -20.890 1.063 1.00 0.00 C ATOM 259 OD1 ASP A 20 -12.095 -20.924 0.868 1.00 0.00 O ATOM 260 OD2 ASP A 20 -10.304 -21.563 1.959 1.00 0.00 O ATOM 0 H ASP A 20 -11.432 -17.950 0.317 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.213 -18.943 1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.560 -19.780 -0.740 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.122 -20.586 -0.146 1.00 0.00 H new ATOM 265 N THR A 21 -8.677 -17.621 -1.144 1.00 0.00 N ATOM 266 CA THR A 21 -7.636 -17.136 -2.039 1.00 0.00 C ATOM 267 C THR A 21 -7.856 -15.683 -2.465 1.00 0.00 C ATOM 268 O THR A 21 -7.258 -15.224 -3.443 1.00 0.00 O ATOM 269 CB THR A 21 -7.549 -18.027 -3.296 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.864 -18.326 -3.786 1.00 0.00 O ATOM 271 CG2 THR A 21 -6.814 -19.320 -2.998 1.00 0.00 C ATOM 0 H THR A 21 -9.623 -17.546 -1.517 1.00 0.00 H new ATOM 0 HA THR A 21 -6.701 -17.182 -1.481 1.00 0.00 H new ATOM 0 HB THR A 21 -6.994 -17.478 -4.057 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.795 -18.890 -4.584 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.767 -19.929 -3.901 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.803 -19.094 -2.660 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.343 -19.868 -2.218 1.00 0.00 H new ATOM 279 N SER A 22 -8.693 -14.956 -1.735 1.00 0.00 N ATOM 280 CA SER A 22 -8.986 -13.573 -2.088 1.00 0.00 C ATOM 281 C SER A 22 -9.294 -12.731 -0.855 1.00 0.00 C ATOM 282 O SER A 22 -9.919 -13.204 0.098 1.00 0.00 O ATOM 283 CB SER A 22 -10.160 -13.512 -3.068 1.00 0.00 C ATOM 284 OG SER A 22 -11.299 -14.176 -2.545 1.00 0.00 O ATOM 0 H SER A 22 -9.176 -15.296 -0.904 1.00 0.00 H new ATOM 0 HA SER A 22 -8.097 -13.160 -2.564 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.407 -12.472 -3.279 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.872 -13.970 -4.014 1.00 0.00 H new ATOM 0 HG SER A 22 -12.035 -14.121 -3.190 1.00 0.00 H new ATOM 290 N ILE A 23 -8.848 -11.481 -0.885 1.00 0.00 N ATOM 291 CA ILE A 23 -9.144 -10.525 0.175 1.00 0.00 C ATOM 292 C ILE A 23 -9.550 -9.191 -0.432 1.00 0.00 C ATOM 293 O ILE A 23 -9.219 -8.899 -1.585 1.00 0.00 O ATOM 294 CB ILE A 23 -7.931 -10.259 1.100 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.830 -9.524 0.325 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.402 -11.557 1.694 1.00 0.00 C ATOM 297 CD1 ILE A 23 -5.903 -8.707 1.198 1.00 0.00 C ATOM 0 H ILE A 23 -8.275 -11.103 -1.639 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.948 -10.964 0.766 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.258 -9.627 1.926 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.241 -10.254 -0.229 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.294 -8.866 -0.409 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.550 -11.341 2.339 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.188 -12.037 2.278 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.089 -12.224 0.891 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.153 -8.219 0.575 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.479 -7.951 1.733 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.408 -9.361 1.916 1.00 0.00 H new ATOM 309 N VAL A 24 -10.256 -8.382 0.337 1.00 0.00 N ATOM 310 CA VAL A 24 -10.538 -7.016 -0.064 1.00 0.00 C ATOM 311 C VAL A 24 -9.743 -6.060 0.816 1.00 0.00 C ATOM 312 O VAL A 24 -10.078 -5.839 1.979 1.00 0.00 O ATOM 313 CB VAL A 24 -12.043 -6.686 0.034 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.310 -5.239 -0.355 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.849 -7.630 -0.844 1.00 0.00 C ATOM 0 H VAL A 24 -10.644 -8.647 1.242 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.244 -6.902 -1.107 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.354 -6.820 1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.377 -5.032 -0.277 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.762 -4.575 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.982 -5.071 -1.381 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.908 -7.385 -0.765 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.529 -7.525 -1.881 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.688 -8.657 -0.517 1.00 0.00 H new ATOM 325 N VAL A 25 -8.689 -5.499 0.254 1.00 0.00 N ATOM 326 CA VAL A 25 -7.820 -4.603 0.993 1.00 0.00 C ATOM 327 C VAL A 25 -8.230 -3.154 0.747 1.00 0.00 C ATOM 328 O VAL A 25 -8.222 -2.665 -0.384 1.00 0.00 O ATOM 329 CB VAL A 25 -6.326 -4.847 0.642 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.108 -4.895 -0.858 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.423 -3.802 1.275 1.00 0.00 C ATOM 0 H VAL A 25 -8.413 -5.649 -0.716 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.931 -4.811 2.057 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.059 -5.819 1.056 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.052 -5.067 -1.067 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.699 -5.705 -1.286 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.416 -3.948 -1.301 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.386 -4.006 1.007 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.703 -2.812 0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.531 -3.837 2.359 1.00 0.00 H new ATOM 341 N ARG A 26 -8.646 -2.497 1.816 1.00 0.00 N ATOM 342 CA ARG A 26 -9.102 -1.119 1.754 1.00 0.00 C ATOM 343 C ARG A 26 -8.096 -0.201 2.422 1.00 0.00 C ATOM 344 O ARG A 26 -7.309 -0.640 3.253 1.00 0.00 O ATOM 345 CB ARG A 26 -10.458 -0.986 2.449 1.00 0.00 C ATOM 346 CG ARG A 26 -11.575 -1.760 1.774 1.00 0.00 C ATOM 347 CD ARG A 26 -12.836 -1.772 2.619 1.00 0.00 C ATOM 348 NE ARG A 26 -13.989 -2.266 1.869 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.990 -2.968 2.398 1.00 0.00 C ATOM 350 NH1 ARG A 26 -14.945 -3.355 3.667 1.00 0.00 N ATOM 351 NH2 ARG A 26 -16.021 -3.317 1.639 1.00 0.00 N ATOM 0 H ARG A 26 -8.677 -2.904 2.751 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.203 -0.833 0.707 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.362 -1.330 3.479 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.733 0.068 2.489 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.791 -1.315 0.803 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.250 -2.784 1.590 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.679 -2.398 3.497 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.042 -0.764 2.979 1.00 0.00 H new ATOM 0 HE ARG A 26 -14.030 -2.059 0.871 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.140 -3.115 4.245 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -15.716 -3.892 4.064 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -16.044 -3.048 0.655 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.790 -3.855 2.039 1.00 0.00 H new ATOM 365 N TRP A 27 -8.118 1.063 2.059 1.00 0.00 N ATOM 366 CA TRP A 27 -7.259 2.047 2.693 1.00 0.00 C ATOM 367 C TRP A 27 -7.958 3.394 2.738 1.00 0.00 C ATOM 368 O TRP A 27 -8.619 3.791 1.779 1.00 0.00 O ATOM 369 CB TRP A 27 -5.912 2.157 1.957 1.00 0.00 C ATOM 370 CG TRP A 27 -6.024 2.459 0.488 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.117 3.692 -0.095 1.00 0.00 C ATOM 372 CD2 TRP A 27 -6.039 1.507 -0.583 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.202 3.563 -1.460 1.00 0.00 N ATOM 374 CE2 TRP A 27 -6.154 2.234 -1.784 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.970 0.113 -0.644 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -6.197 1.611 -3.028 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -6.015 -0.503 -1.879 1.00 0.00 C ATOM 378 CH2 TRP A 27 -6.129 0.247 -3.056 1.00 0.00 C ATOM 0 H TRP A 27 -8.722 1.437 1.327 1.00 0.00 H new ATOM 0 HA TRP A 27 -7.055 1.723 3.714 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.317 2.938 2.431 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.367 1.221 2.082 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.123 4.630 0.439 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.287 4.332 -2.124 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.883 -0.473 0.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -6.281 2.186 -3.939 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.961 -1.580 -1.938 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -6.164 -0.264 -4.007 1.00 0.00 H new ATOM 389 N SER A 28 -7.844 4.084 3.860 1.00 0.00 N ATOM 390 CA SER A 28 -8.413 5.411 3.971 1.00 0.00 C ATOM 391 C SER A 28 -7.524 6.399 3.233 1.00 0.00 C ATOM 392 O SER A 28 -6.409 6.692 3.665 1.00 0.00 O ATOM 393 CB SER A 28 -8.555 5.811 5.438 1.00 0.00 C ATOM 394 OG SER A 28 -9.258 4.818 6.170 1.00 0.00 O ATOM 0 H SER A 28 -7.367 3.750 4.698 1.00 0.00 H new ATOM 0 HA SER A 28 -9.407 5.416 3.523 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.568 5.960 5.875 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.082 6.762 5.510 1.00 0.00 H new ATOM 0 HG SER A 28 -9.335 5.095 7.107 1.00 0.00 H new ATOM 400 N ARG A 29 -8.021 6.900 2.117 1.00 0.00 N ATOM 401 CA ARG A 29 -7.258 7.812 1.283 1.00 0.00 C ATOM 402 C ARG A 29 -7.472 9.248 1.741 1.00 0.00 C ATOM 403 O ARG A 29 -8.469 9.543 2.404 1.00 0.00 O ATOM 404 CB ARG A 29 -7.628 7.609 -0.201 1.00 0.00 C ATOM 405 CG ARG A 29 -9.094 7.841 -0.536 1.00 0.00 C ATOM 406 CD ARG A 29 -9.419 9.319 -0.593 1.00 0.00 C ATOM 407 NE ARG A 29 -10.847 9.558 -0.777 1.00 0.00 N ATOM 408 CZ ARG A 29 -11.413 10.761 -0.764 1.00 0.00 C ATOM 409 NH1 ARG A 29 -10.677 11.849 -0.575 1.00 0.00 N ATOM 410 NH2 ARG A 29 -12.722 10.877 -0.938 1.00 0.00 N ATOM 0 H ARG A 29 -8.955 6.690 1.765 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.194 7.596 1.385 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -7.022 8.283 -0.806 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -7.361 6.593 -0.491 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -9.328 7.378 -1.495 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -9.721 7.357 0.213 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -9.087 9.799 0.327 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.866 9.781 -1.411 1.00 0.00 H new ATOM 0 HE ARG A 29 -11.450 8.749 -0.925 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -9.670 11.766 -0.438 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -11.119 12.768 -0.566 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -13.293 10.044 -1.082 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -13.158 11.799 -0.928 1.00 0.00 H new ATOM 424 N PRO A 30 -6.523 10.148 1.431 1.00 0.00 N ATOM 425 CA PRO A 30 -6.646 11.571 1.743 1.00 0.00 C ATOM 426 C PRO A 30 -7.955 12.154 1.222 1.00 0.00 C ATOM 427 O PRO A 30 -8.876 12.375 2.041 1.00 0.00 O ATOM 428 CB PRO A 30 -5.443 12.218 1.036 1.00 0.00 C ATOM 429 CG PRO A 30 -4.889 11.163 0.137 1.00 0.00 C ATOM 430 CD PRO A 30 -5.242 9.851 0.771 1.00 0.00 C ATOM 431 OXT PRO A 30 -8.071 12.363 -0.006 1.00 0.00 O ATOM 0 HA PRO A 30 -6.654 11.751 2.818 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -5.749 13.096 0.467 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -4.696 12.549 1.758 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.315 11.240 -0.863 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -3.809 11.268 0.032 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.342 9.057 0.031 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.484 9.528 1.484 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -8.324 32.077 1.473 1.00 0.00 N ATOM 441 CA MET B 31 -8.360 33.481 1.943 1.00 0.00 C ATOM 442 C MET B 31 -6.994 33.891 2.477 1.00 0.00 C ATOM 443 O MET B 31 -6.358 34.803 1.950 1.00 0.00 O ATOM 444 CB MET B 31 -9.421 33.664 3.035 1.00 0.00 C ATOM 445 CG MET B 31 -10.840 33.378 2.573 1.00 0.00 C ATOM 446 SD MET B 31 -12.066 33.719 3.850 1.00 0.00 S ATOM 447 CE MET B 31 -13.574 33.247 3.007 1.00 0.00 C ATOM 0 HA MET B 31 -8.621 34.116 1.096 1.00 0.00 H new ATOM 0 HB2 MET B 31 -9.183 33.007 3.872 1.00 0.00 H new ATOM 0 HB3 MET B 31 -9.371 34.687 3.408 1.00 0.00 H new ATOM 0 HG2 MET B 31 -11.060 33.982 1.693 1.00 0.00 H new ATOM 0 HG3 MET B 31 -10.916 32.334 2.271 1.00 0.00 H new ATOM 0 HE1 MET B 31 -14.425 33.401 3.670 1.00 0.00 H new ATOM 0 HE2 MET B 31 -13.696 33.857 2.112 1.00 0.00 H new ATOM 0 HE3 MET B 31 -13.519 32.195 2.725 1.00 0.00 H new ATOM 459 N ARG B 32 -6.551 33.219 3.528 1.00 0.00 N ATOM 460 CA ARG B 32 -5.235 33.464 4.095 1.00 0.00 C ATOM 461 C ARG B 32 -4.270 32.384 3.639 1.00 0.00 C ATOM 462 O ARG B 32 -4.612 31.200 3.630 1.00 0.00 O ATOM 463 CB ARG B 32 -5.307 33.501 5.624 1.00 0.00 C ATOM 464 CG ARG B 32 -6.094 34.680 6.173 1.00 0.00 C ATOM 465 CD ARG B 32 -5.391 35.997 5.885 1.00 0.00 C ATOM 466 NE ARG B 32 -6.159 37.148 6.356 1.00 0.00 N ATOM 467 CZ ARG B 32 -5.766 38.413 6.207 1.00 0.00 C ATOM 468 NH1 ARG B 32 -4.613 38.686 5.612 1.00 0.00 N ATOM 469 NH2 ARG B 32 -6.526 39.404 6.652 1.00 0.00 N ATOM 0 H ARG B 32 -7.087 32.496 4.008 1.00 0.00 H new ATOM 0 HA ARG B 32 -4.877 34.432 3.746 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -5.761 32.576 5.979 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -4.294 33.534 6.025 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -7.090 34.693 5.730 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -6.225 34.563 7.249 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -4.411 35.996 6.363 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -5.222 36.090 4.812 1.00 0.00 H new ATOM 0 HE ARG B 32 -7.047 36.973 6.826 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -4.025 37.927 5.267 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -4.314 39.655 5.499 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -7.414 39.199 7.110 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -6.222 40.371 6.536 1.00 0.00 H new ATOM 483 N GLY B 33 -3.079 32.792 3.242 1.00 0.00 N ATOM 484 CA GLY B 33 -2.101 31.847 2.754 1.00 0.00 C ATOM 485 C GLY B 33 -2.248 31.613 1.268 1.00 0.00 C ATOM 486 O GLY B 33 -3.336 31.780 0.710 1.00 0.00 O ATOM 0 H GLY B 33 -2.770 33.764 3.249 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -1.098 32.217 2.967 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.211 30.901 3.285 1.00 0.00 H new ATOM 490 N SER B 34 -1.160 31.246 0.622 1.00 0.00 N ATOM 491 CA SER B 34 -1.173 30.996 -0.807 1.00 0.00 C ATOM 492 C SER B 34 -1.620 29.568 -1.094 1.00 0.00 C ATOM 493 O SER B 34 -1.381 28.657 -0.297 1.00 0.00 O ATOM 494 CB SER B 34 0.218 31.249 -1.386 1.00 0.00 C ATOM 495 OG SER B 34 0.667 32.553 -1.054 1.00 0.00 O ATOM 0 H SER B 34 -0.251 31.113 1.065 1.00 0.00 H new ATOM 0 HA SER B 34 -1.882 31.675 -1.280 1.00 0.00 H new ATOM 0 HB2 SER B 34 0.919 30.508 -1.001 1.00 0.00 H new ATOM 0 HB3 SER B 34 0.194 31.132 -2.469 1.00 0.00 H new ATOM 0 HG SER B 34 1.560 32.697 -1.431 1.00 0.00 H new ATOM 501 N ASN B 35 -2.285 29.384 -2.223 1.00 0.00 N ATOM 502 CA ASN B 35 -2.771 28.073 -2.622 1.00 0.00 C ATOM 503 C ASN B 35 -1.746 27.386 -3.511 1.00 0.00 C ATOM 504 O ASN B 35 -1.339 27.929 -4.538 1.00 0.00 O ATOM 505 CB ASN B 35 -4.104 28.195 -3.365 1.00 0.00 C ATOM 506 CG ASN B 35 -5.193 28.827 -2.518 1.00 0.00 C ATOM 507 OD1 ASN B 35 -5.323 30.051 -2.466 1.00 0.00 O ATOM 508 ND2 ASN B 35 -5.997 28.003 -1.867 1.00 0.00 N ATOM 0 H ASN B 35 -2.502 30.131 -2.883 1.00 0.00 H new ATOM 0 HA ASN B 35 -2.926 27.475 -1.724 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -3.959 28.791 -4.266 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -4.428 27.205 -3.686 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -6.757 28.376 -1.297 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.858 26.995 -1.935 1.00 0.00 H new ATOM 515 N ALA B 36 -1.317 26.208 -3.105 1.00 0.00 N ATOM 516 CA ALA B 36 -0.352 25.437 -3.870 1.00 0.00 C ATOM 517 C ALA B 36 -0.943 24.083 -4.235 1.00 0.00 C ATOM 518 O ALA B 36 -1.681 23.504 -3.439 1.00 0.00 O ATOM 519 CB ALA B 36 0.927 25.259 -3.063 1.00 0.00 C ATOM 0 H ALA B 36 -1.623 25.759 -2.242 1.00 0.00 H new ATOM 0 HA ALA B 36 -0.113 25.972 -4.789 1.00 0.00 H new ATOM 0 HB1 ALA B 36 1.646 24.680 -3.643 1.00 0.00 H new ATOM 0 HB2 ALA B 36 1.351 26.236 -2.832 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.702 24.733 -2.135 1.00 0.00 H new ATOM 525 N PRO B 37 -0.655 23.578 -5.451 1.00 0.00 N ATOM 526 CA PRO B 37 -1.135 22.265 -5.902 1.00 0.00 C ATOM 527 C PRO B 37 -0.860 21.179 -4.868 1.00 0.00 C ATOM 528 O PRO B 37 0.282 20.751 -4.688 1.00 0.00 O ATOM 529 CB PRO B 37 -0.335 22.015 -7.182 1.00 0.00 C ATOM 530 CG PRO B 37 -0.022 23.377 -7.696 1.00 0.00 C ATOM 531 CD PRO B 37 0.160 24.248 -6.483 1.00 0.00 C ATOM 0 HA PRO B 37 -2.214 22.246 -6.058 1.00 0.00 H new ATOM 0 HB2 PRO B 37 0.574 21.449 -6.978 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -0.913 21.440 -7.906 1.00 0.00 H new ATOM 0 HG2 PRO B 37 0.881 23.365 -8.307 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.829 23.751 -8.327 1.00 0.00 H new ATOM 0 HD2 PRO B 37 1.207 24.312 -6.188 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -0.182 25.267 -6.666 1.00 0.00 H new ATOM 539 N GLN B 38 -1.916 20.754 -4.189 1.00 0.00 N ATOM 540 CA GLN B 38 -1.800 19.836 -3.066 1.00 0.00 C ATOM 541 C GLN B 38 -1.346 18.450 -3.509 1.00 0.00 C ATOM 542 O GLN B 38 -1.810 17.918 -4.521 1.00 0.00 O ATOM 543 CB GLN B 38 -3.135 19.732 -2.327 1.00 0.00 C ATOM 544 CG GLN B 38 -3.580 21.038 -1.686 1.00 0.00 C ATOM 545 CD GLN B 38 -4.842 20.891 -0.858 1.00 0.00 C ATOM 546 OE1 GLN B 38 -5.041 21.607 0.124 1.00 0.00 O ATOM 547 NE2 GLN B 38 -5.708 19.967 -1.244 1.00 0.00 N ATOM 0 H GLN B 38 -2.874 21.035 -4.400 1.00 0.00 H new ATOM 0 HA GLN B 38 -1.041 20.238 -2.395 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -3.903 19.400 -3.026 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -3.055 18.967 -1.555 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -2.778 21.417 -1.052 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -3.748 21.781 -2.466 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -5.509 19.392 -2.063 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -6.574 19.830 -0.723 1.00 0.00 H new ATOM 556 N PRO B 39 -0.424 17.848 -2.741 1.00 0.00 N ATOM 557 CA PRO B 39 0.051 16.487 -2.988 1.00 0.00 C ATOM 558 C PRO B 39 -0.993 15.442 -2.606 1.00 0.00 C ATOM 559 O PRO B 39 -0.819 14.251 -2.866 1.00 0.00 O ATOM 560 CB PRO B 39 1.283 16.371 -2.093 1.00 0.00 C ATOM 561 CG PRO B 39 1.031 17.328 -0.981 1.00 0.00 C ATOM 562 CD PRO B 39 0.246 18.463 -1.577 1.00 0.00 C ATOM 0 HA PRO B 39 0.263 16.309 -4.042 1.00 0.00 H new ATOM 0 HB2 PRO B 39 1.408 15.354 -1.720 1.00 0.00 H new ATOM 0 HB3 PRO B 39 2.193 16.625 -2.636 1.00 0.00 H new ATOM 0 HG2 PRO B 39 0.474 16.850 -0.175 1.00 0.00 H new ATOM 0 HG3 PRO B 39 1.968 17.685 -0.554 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.475 18.868 -0.867 1.00 0.00 H new ATOM 0 HD3 PRO B 39 0.895 19.286 -1.876 1.00 0.00 H new ATOM 570 N SER B 40 -2.088 15.907 -2.011 1.00 0.00 N ATOM 571 CA SER B 40 -3.202 15.045 -1.629 1.00 0.00 C ATOM 572 C SER B 40 -4.037 14.670 -2.856 1.00 0.00 C ATOM 573 O SER B 40 -5.268 14.656 -2.817 1.00 0.00 O ATOM 574 CB SER B 40 -4.069 15.768 -0.599 1.00 0.00 C ATOM 575 OG SER B 40 -3.266 16.334 0.426 1.00 0.00 O ATOM 0 H SER B 40 -2.228 16.891 -1.780 1.00 0.00 H new ATOM 0 HA SER B 40 -2.810 14.126 -1.192 1.00 0.00 H new ATOM 0 HB2 SER B 40 -4.647 16.551 -1.089 1.00 0.00 H new ATOM 0 HB3 SER B 40 -4.784 15.070 -0.164 1.00 0.00 H new ATOM 0 HG SER B 40 -2.954 15.625 1.026 1.00 0.00 H new ATOM 581 N HIS B 41 -3.347 14.372 -3.942 1.00 0.00 N ATOM 582 CA HIS B 41 -3.974 14.006 -5.195 1.00 0.00 C ATOM 583 C HIS B 41 -3.128 12.928 -5.854 1.00 0.00 C ATOM 584 O HIS B 41 -2.252 13.214 -6.671 1.00 0.00 O ATOM 585 CB HIS B 41 -4.100 15.229 -6.110 1.00 0.00 C ATOM 586 CG HIS B 41 -4.981 15.010 -7.303 1.00 0.00 C ATOM 587 ND1 HIS B 41 -6.292 15.426 -7.353 1.00 0.00 N ATOM 588 CD2 HIS B 41 -4.730 14.427 -8.500 1.00 0.00 C ATOM 589 CE1 HIS B 41 -6.810 15.108 -8.523 1.00 0.00 C ATOM 590 NE2 HIS B 41 -5.884 14.503 -9.239 1.00 0.00 N ATOM 0 H HIS B 41 -2.328 14.378 -3.977 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.980 13.627 -5.012 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -4.492 16.065 -5.530 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -3.106 15.517 -6.453 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -3.796 13.985 -8.814 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -7.822 15.309 -8.841 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -6.005 14.149 -10.188 1.00 0.00 H new ATOM 599 N ILE B 42 -3.378 11.694 -5.464 1.00 0.00 N ATOM 600 CA ILE B 42 -2.569 10.568 -5.898 1.00 0.00 C ATOM 601 C ILE B 42 -2.922 10.169 -7.331 1.00 0.00 C ATOM 602 O ILE B 42 -4.090 10.146 -7.718 1.00 0.00 O ATOM 603 CB ILE B 42 -2.741 9.361 -4.934 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.037 9.616 -3.590 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.209 8.081 -5.557 1.00 0.00 C ATOM 606 CD1 ILE B 42 -2.657 10.707 -2.742 1.00 0.00 C ATOM 0 H ILE B 42 -4.144 11.442 -4.840 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.523 10.874 -5.877 1.00 0.00 H new ATOM 0 HB ILE B 42 -3.809 9.245 -4.752 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.033 8.689 -3.017 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -0.996 9.875 -3.785 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.343 7.254 -4.860 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.753 7.871 -6.478 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.149 8.199 -5.781 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.092 10.813 -1.816 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.637 11.649 -3.290 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -3.689 10.445 -2.510 1.00 0.00 H new ATOM 618 N SER B 43 -1.890 9.881 -8.117 1.00 0.00 N ATOM 619 CA SER B 43 -2.057 9.522 -9.514 1.00 0.00 C ATOM 620 C SER B 43 -2.410 8.041 -9.642 1.00 0.00 C ATOM 621 O SER B 43 -3.195 7.650 -10.508 1.00 0.00 O ATOM 622 CB SER B 43 -0.771 9.839 -10.288 1.00 0.00 C ATOM 623 OG SER B 43 -0.940 9.651 -11.685 1.00 0.00 O ATOM 0 H SER B 43 -0.920 9.891 -7.802 1.00 0.00 H new ATOM 0 HA SER B 43 -2.875 10.106 -9.937 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.473 10.869 -10.093 1.00 0.00 H new ATOM 0 HB3 SER B 43 0.036 9.200 -9.930 1.00 0.00 H new ATOM 0 HG SER B 43 -0.102 9.863 -12.147 1.00 0.00 H new ATOM 629 N LYS B 44 -1.832 7.225 -8.766 1.00 0.00 N ATOM 630 CA LYS B 44 -2.093 5.791 -8.757 1.00 0.00 C ATOM 631 C LYS B 44 -1.574 5.161 -7.470 1.00 0.00 C ATOM 632 O LYS B 44 -0.607 5.643 -6.877 1.00 0.00 O ATOM 633 CB LYS B 44 -1.438 5.115 -9.966 1.00 0.00 C ATOM 634 CG LYS B 44 0.076 5.241 -9.990 1.00 0.00 C ATOM 635 CD LYS B 44 0.673 4.579 -11.217 1.00 0.00 C ATOM 636 CE LYS B 44 2.188 4.665 -11.204 1.00 0.00 C ATOM 637 NZ LYS B 44 2.784 4.077 -12.428 1.00 0.00 N ATOM 0 H LYS B 44 -1.176 7.536 -8.049 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.172 5.644 -8.813 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.706 4.058 -9.970 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.845 5.550 -10.879 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.354 6.295 -9.973 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.494 4.787 -9.091 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.366 3.534 -11.256 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.287 5.058 -12.116 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.492 5.708 -11.117 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.574 4.146 -10.327 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.820 4.155 -12.382 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.515 3.075 -12.498 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.436 4.588 -13.264 1.00 0.00 H new ATOM 651 N TYR B 45 -2.230 4.097 -7.040 1.00 0.00 N ATOM 652 CA TYR B 45 -1.808 3.349 -5.866 1.00 0.00 C ATOM 653 C TYR B 45 -1.260 2.000 -6.305 1.00 0.00 C ATOM 654 O TYR B 45 -1.833 1.352 -7.179 1.00 0.00 O ATOM 655 CB TYR B 45 -2.982 3.135 -4.902 1.00 0.00 C ATOM 656 CG TYR B 45 -3.613 4.412 -4.395 1.00 0.00 C ATOM 657 CD1 TYR B 45 -3.150 5.026 -3.239 1.00 0.00 C ATOM 658 CD2 TYR B 45 -4.679 4.998 -5.066 1.00 0.00 C ATOM 659 CE1 TYR B 45 -3.727 6.190 -2.767 1.00 0.00 C ATOM 660 CE2 TYR B 45 -5.259 6.162 -4.602 1.00 0.00 C ATOM 661 CZ TYR B 45 -4.781 6.754 -3.452 1.00 0.00 C ATOM 662 OH TYR B 45 -5.358 7.915 -2.989 1.00 0.00 O ATOM 0 H TYR B 45 -3.067 3.728 -7.492 1.00 0.00 H new ATOM 0 HA TYR B 45 -1.036 3.918 -5.347 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.746 2.541 -5.404 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.635 2.552 -4.049 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -2.324 4.586 -2.699 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -5.060 4.536 -5.965 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -3.354 6.655 -1.866 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -6.084 6.607 -5.138 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.087 8.180 -3.588 1.00 0.00 H new ATOM 672 N ILE B 46 -0.150 1.586 -5.728 1.00 0.00 N ATOM 673 CA ILE B 46 0.433 0.297 -6.053 1.00 0.00 C ATOM 674 C ILE B 46 0.376 -0.621 -4.843 1.00 0.00 C ATOM 675 O ILE B 46 0.886 -0.291 -3.771 1.00 0.00 O ATOM 676 CB ILE B 46 1.901 0.409 -6.553 1.00 0.00 C ATOM 677 CG1 ILE B 46 1.972 1.105 -7.918 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.549 -0.968 -6.642 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.785 2.605 -7.861 1.00 0.00 C ATOM 0 H ILE B 46 0.367 2.122 -5.032 1.00 0.00 H new ATOM 0 HA ILE B 46 -0.157 -0.119 -6.869 1.00 0.00 H new ATOM 0 HB ILE B 46 2.448 1.012 -5.828 1.00 0.00 H new ATOM 0 HG12 ILE B 46 2.938 0.888 -8.374 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.209 0.680 -8.570 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.575 -0.865 -6.994 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.548 -1.435 -5.657 1.00 0.00 H new ATOM 0 HG23 ILE B 46 1.987 -1.590 -7.339 1.00 0.00 H new ATOM 0 HD11 ILE B 46 1.849 3.018 -8.868 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.807 2.834 -7.437 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.563 3.045 -7.238 1.00 0.00 H new ATOM 691 N LEU B 47 -0.271 -1.758 -5.018 1.00 0.00 N ATOM 692 CA LEU B 47 -0.358 -2.757 -3.971 1.00 0.00 C ATOM 693 C LEU B 47 0.722 -3.805 -4.210 1.00 0.00 C ATOM 694 O LEU B 47 0.729 -4.467 -5.248 1.00 0.00 O ATOM 695 CB LEU B 47 -1.758 -3.405 -3.977 1.00 0.00 C ATOM 696 CG LEU B 47 -2.274 -3.982 -2.642 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.360 -5.068 -2.102 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.453 -2.882 -1.611 1.00 0.00 C ATOM 0 H LEU B 47 -0.747 -2.013 -5.883 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.205 -2.295 -2.996 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.474 -2.659 -4.322 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.755 -4.208 -4.714 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.244 -4.436 -2.843 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.761 -5.446 -1.162 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.297 -5.883 -2.823 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.365 -4.656 -1.933 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.817 -3.313 -0.679 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.497 -2.390 -1.434 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.174 -2.152 -1.979 1.00 0.00 H new ATOM 710 N ARG B 48 1.655 -3.916 -3.278 1.00 0.00 N ATOM 711 CA ARG B 48 2.693 -4.935 -3.354 1.00 0.00 C ATOM 712 C ARG B 48 2.517 -5.950 -2.243 1.00 0.00 C ATOM 713 O ARG B 48 2.229 -5.582 -1.105 1.00 0.00 O ATOM 714 CB ARG B 48 4.085 -4.312 -3.257 1.00 0.00 C ATOM 715 CG ARG B 48 4.568 -3.675 -4.537 1.00 0.00 C ATOM 716 CD ARG B 48 5.984 -3.155 -4.376 1.00 0.00 C ATOM 717 NE ARG B 48 6.461 -2.495 -5.583 1.00 0.00 N ATOM 718 CZ ARG B 48 7.560 -1.748 -5.641 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.273 -1.514 -4.545 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.937 -1.224 -6.798 1.00 0.00 N ATOM 0 H ARG B 48 1.716 -3.312 -2.458 1.00 0.00 H new ATOM 0 HA ARG B 48 2.600 -5.432 -4.319 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.080 -3.559 -2.469 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.795 -5.082 -2.957 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.533 -4.403 -5.347 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.904 -2.856 -4.815 1.00 0.00 H new ATOM 0 HD2 ARG B 48 6.021 -2.455 -3.541 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.649 -3.983 -4.128 1.00 0.00 H new ATOM 0 HE ARG B 48 5.918 -2.613 -6.438 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.979 -1.908 -3.651 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.115 -0.940 -4.597 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.385 -1.394 -7.639 1.00 0.00 H new ATOM 0 HH22 ARG B 48 8.779 -0.650 -6.848 1.00 0.00 H new ATOM 734 N TRP B 49 2.686 -7.225 -2.569 1.00 0.00 N ATOM 735 CA TRP B 49 2.575 -8.277 -1.572 1.00 0.00 C ATOM 736 C TRP B 49 3.492 -9.450 -1.907 1.00 0.00 C ATOM 737 O TRP B 49 3.737 -9.748 -3.081 1.00 0.00 O ATOM 738 CB TRP B 49 1.121 -8.758 -1.443 1.00 0.00 C ATOM 739 CG TRP B 49 0.581 -9.460 -2.659 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.489 -10.809 -2.850 1.00 0.00 C ATOM 741 CD2 TRP B 49 0.053 -8.853 -3.846 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.066 -11.077 -4.077 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.341 -9.893 -4.708 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.126 -7.534 -4.264 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -0.904 -9.652 -5.960 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.683 -7.294 -5.505 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.067 -8.348 -6.340 1.00 0.00 C ATOM 0 H TRP B 49 2.899 -7.553 -3.511 1.00 0.00 H new ATOM 0 HA TRP B 49 2.888 -7.860 -0.615 1.00 0.00 H new ATOM 0 HB2 TRP B 49 1.050 -9.432 -0.590 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.487 -7.899 -1.224 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.807 -11.557 -2.139 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.244 -12.007 -4.457 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.167 -6.713 -3.627 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.201 -10.465 -6.606 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -0.824 -6.276 -5.836 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.501 -8.128 -7.304 1.00 0.00 H new ATOM 758 N ARG B 50 4.009 -10.093 -0.869 1.00 0.00 N ATOM 759 CA ARG B 50 4.820 -11.293 -1.026 1.00 0.00 C ATOM 760 C ARG B 50 4.497 -12.281 0.091 1.00 0.00 C ATOM 761 O ARG B 50 4.180 -11.875 1.212 1.00 0.00 O ATOM 762 CB ARG B 50 6.321 -10.965 -1.002 1.00 0.00 C ATOM 763 CG ARG B 50 6.816 -10.427 0.318 1.00 0.00 C ATOM 764 CD ARG B 50 8.333 -10.456 0.383 1.00 0.00 C ATOM 765 NE ARG B 50 8.791 -10.295 1.749 1.00 0.00 N ATOM 766 CZ ARG B 50 9.928 -9.696 2.104 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.798 -9.295 1.185 1.00 0.00 N ATOM 768 NH2 ARG B 50 10.202 -9.513 3.389 1.00 0.00 N ATOM 0 H ARG B 50 3.880 -9.800 0.099 1.00 0.00 H new ATOM 0 HA ARG B 50 4.584 -11.734 -1.994 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.882 -11.867 -1.248 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.534 -10.234 -1.782 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.462 -9.405 0.454 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.402 -11.019 1.134 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.701 -11.399 -0.020 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.744 -9.661 -0.240 1.00 0.00 H new ATOM 0 HE ARG B 50 8.200 -10.667 2.493 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.600 -9.444 0.196 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.665 -8.838 1.468 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.544 -9.830 4.101 1.00 0.00 H new ATOM 0 HH22 ARG B 50 11.071 -9.055 3.665 1.00 0.00 H new ATOM 782 N PRO B 51 4.542 -13.588 -0.208 1.00 0.00 N ATOM 783 CA PRO B 51 4.352 -14.634 0.799 1.00 0.00 C ATOM 784 C PRO B 51 5.465 -14.612 1.841 1.00 0.00 C ATOM 785 O PRO B 51 6.628 -14.854 1.529 1.00 0.00 O ATOM 786 CB PRO B 51 4.392 -15.934 -0.012 1.00 0.00 C ATOM 787 CG PRO B 51 5.110 -15.581 -1.270 1.00 0.00 C ATOM 788 CD PRO B 51 4.768 -14.148 -1.550 1.00 0.00 C ATOM 0 HA PRO B 51 3.424 -14.509 1.358 1.00 0.00 H new ATOM 0 HB2 PRO B 51 4.912 -16.723 0.532 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.387 -16.300 -0.221 1.00 0.00 H new ATOM 0 HG2 PRO B 51 6.186 -15.710 -1.155 1.00 0.00 H new ATOM 0 HG3 PRO B 51 4.797 -16.225 -2.092 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.577 -13.635 -2.069 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.881 -14.061 -2.177 1.00 0.00 H new ATOM 796 N LYS B 52 5.085 -14.330 3.081 1.00 0.00 N ATOM 797 CA LYS B 52 6.032 -14.143 4.179 1.00 0.00 C ATOM 798 C LYS B 52 6.833 -15.419 4.431 1.00 0.00 C ATOM 799 O LYS B 52 8.032 -15.374 4.702 1.00 0.00 O ATOM 800 CB LYS B 52 5.248 -13.754 5.436 1.00 0.00 C ATOM 801 CG LYS B 52 6.026 -12.979 6.490 1.00 0.00 C ATOM 802 CD LYS B 52 7.063 -13.832 7.198 1.00 0.00 C ATOM 803 CE LYS B 52 7.771 -13.044 8.285 1.00 0.00 C ATOM 804 NZ LYS B 52 8.779 -13.868 9.003 1.00 0.00 N ATOM 0 H LYS B 52 4.109 -14.224 3.357 1.00 0.00 H new ATOM 0 HA LYS B 52 6.738 -13.355 3.918 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.388 -13.156 5.134 1.00 0.00 H new ATOM 0 HB3 LYS B 52 4.859 -14.663 5.894 1.00 0.00 H new ATOM 0 HG2 LYS B 52 6.521 -12.129 6.019 1.00 0.00 H new ATOM 0 HG3 LYS B 52 5.330 -12.575 7.225 1.00 0.00 H new ATOM 0 HD2 LYS B 52 6.582 -14.707 7.634 1.00 0.00 H new ATOM 0 HD3 LYS B 52 7.793 -14.197 6.475 1.00 0.00 H new ATOM 0 HE2 LYS B 52 8.260 -12.176 7.843 1.00 0.00 H new ATOM 0 HE3 LYS B 52 7.036 -12.668 8.997 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 9.239 -13.292 9.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 8.309 -14.683 9.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 9.495 -14.206 8.329 1.00 0.00 H new ATOM 818 N ASN B 53 6.159 -16.558 4.327 1.00 0.00 N ATOM 819 CA ASN B 53 6.777 -17.847 4.625 1.00 0.00 C ATOM 820 C ASN B 53 7.557 -18.389 3.431 1.00 0.00 C ATOM 821 O ASN B 53 8.042 -19.519 3.453 1.00 0.00 O ATOM 822 CB ASN B 53 5.717 -18.862 5.094 1.00 0.00 C ATOM 823 CG ASN B 53 4.508 -18.993 4.171 1.00 0.00 C ATOM 824 OD1 ASN B 53 3.377 -19.123 4.642 1.00 0.00 O ATOM 825 ND2 ASN B 53 4.720 -18.997 2.862 1.00 0.00 N ATOM 0 H ASN B 53 5.183 -16.617 4.038 1.00 0.00 H new ATOM 0 HA ASN B 53 7.489 -17.691 5.435 1.00 0.00 H new ATOM 0 HB2 ASN B 53 6.189 -19.840 5.194 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.370 -18.573 6.086 1.00 0.00 H new ATOM 0 HD21 ASN B 53 3.936 -19.110 2.219 1.00 0.00 H new ATOM 0 HD22 ASN B 53 5.667 -18.887 2.498 1.00 0.00 H new ATOM 832 N SER B 54 7.674 -17.581 2.390 1.00 0.00 N ATOM 833 CA SER B 54 8.351 -17.996 1.174 1.00 0.00 C ATOM 834 C SER B 54 9.298 -16.903 0.693 1.00 0.00 C ATOM 835 O SER B 54 9.216 -15.759 1.133 1.00 0.00 O ATOM 836 CB SER B 54 7.318 -18.297 0.092 1.00 0.00 C ATOM 837 OG SER B 54 6.320 -19.181 0.575 1.00 0.00 O ATOM 0 H SER B 54 7.307 -16.630 2.364 1.00 0.00 H new ATOM 0 HA SER B 54 8.933 -18.894 1.383 1.00 0.00 H new ATOM 0 HB2 SER B 54 6.855 -17.369 -0.243 1.00 0.00 H new ATOM 0 HB3 SER B 54 7.811 -18.738 -0.774 1.00 0.00 H new ATOM 0 HG SER B 54 5.668 -19.358 -0.135 1.00 0.00 H new ATOM 843 N VAL B 55 10.195 -17.263 -0.213 1.00 0.00 N ATOM 844 CA VAL B 55 11.107 -16.311 -0.819 1.00 0.00 C ATOM 845 C VAL B 55 10.445 -15.679 -2.055 1.00 0.00 C ATOM 846 O VAL B 55 11.083 -15.393 -3.074 1.00 0.00 O ATOM 847 CB VAL B 55 12.432 -17.018 -1.186 1.00 0.00 C ATOM 848 CG1 VAL B 55 12.212 -18.052 -2.279 1.00 0.00 C ATOM 849 CG2 VAL B 55 13.499 -16.014 -1.582 1.00 0.00 C ATOM 0 H VAL B 55 10.309 -18.220 -0.546 1.00 0.00 H new ATOM 0 HA VAL B 55 11.336 -15.514 -0.112 1.00 0.00 H new ATOM 0 HB VAL B 55 12.789 -17.542 -0.299 1.00 0.00 H new ATOM 0 HG11 VAL B 55 13.159 -18.535 -2.519 1.00 0.00 H new ATOM 0 HG12 VAL B 55 11.500 -18.801 -1.933 1.00 0.00 H new ATOM 0 HG13 VAL B 55 11.819 -17.562 -3.170 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.419 -16.541 -1.834 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.159 -15.443 -2.446 1.00 0.00 H new ATOM 0 HG23 VAL B 55 13.687 -15.335 -0.750 1.00 0.00 H new ATOM 859 N GLY B 56 9.140 -15.471 -1.939 1.00 0.00 N ATOM 860 CA GLY B 56 8.359 -14.922 -3.027 1.00 0.00 C ATOM 861 C GLY B 56 8.666 -13.464 -3.287 1.00 0.00 C ATOM 862 O GLY B 56 9.197 -12.764 -2.423 1.00 0.00 O ATOM 0 H GLY B 56 8.603 -15.677 -1.097 1.00 0.00 H new ATOM 0 HA2 GLY B 56 8.551 -15.497 -3.933 1.00 0.00 H new ATOM 0 HA3 GLY B 56 7.299 -15.031 -2.799 1.00 0.00 H new ATOM 866 N ARG B 57 8.320 -13.004 -4.475 1.00 0.00 N ATOM 867 CA ARG B 57 8.641 -11.653 -4.893 1.00 0.00 C ATOM 868 C ARG B 57 7.416 -10.760 -4.798 1.00 0.00 C ATOM 869 O ARG B 57 6.280 -11.243 -4.793 1.00 0.00 O ATOM 870 CB ARG B 57 9.188 -11.673 -6.323 1.00 0.00 C ATOM 871 CG ARG B 57 10.379 -12.607 -6.494 1.00 0.00 C ATOM 872 CD ARG B 57 11.490 -12.264 -5.519 1.00 0.00 C ATOM 873 NE ARG B 57 12.588 -13.225 -5.561 1.00 0.00 N ATOM 874 CZ ARG B 57 13.631 -13.196 -4.734 1.00 0.00 C ATOM 875 NH1 ARG B 57 13.747 -12.221 -3.839 1.00 0.00 N ATOM 876 NH2 ARG B 57 14.561 -14.138 -4.808 1.00 0.00 N ATOM 0 H ARG B 57 7.813 -13.551 -5.171 1.00 0.00 H new ATOM 0 HA ARG B 57 9.404 -11.247 -4.229 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.394 -11.978 -7.005 1.00 0.00 H new ATOM 0 HB3 ARG B 57 9.482 -10.663 -6.607 1.00 0.00 H new ATOM 0 HG2 ARG B 57 10.061 -13.638 -6.339 1.00 0.00 H new ATOM 0 HG3 ARG B 57 10.754 -12.539 -7.515 1.00 0.00 H new ATOM 0 HD2 ARG B 57 11.873 -11.269 -5.746 1.00 0.00 H new ATOM 0 HD3 ARG B 57 11.083 -12.226 -4.508 1.00 0.00 H new ATOM 0 HE ARG B 57 12.554 -13.962 -6.265 1.00 0.00 H new ATOM 0 HH11 ARG B 57 13.036 -11.492 -3.784 1.00 0.00 H new ATOM 0 HH12 ARG B 57 14.547 -12.202 -3.207 1.00 0.00 H new ATOM 0 HH21 ARG B 57 14.477 -14.884 -5.498 1.00 0.00 H new ATOM 0 HH22 ARG B 57 15.360 -14.116 -4.175 1.00 0.00 H new ATOM 890 N TRP B 58 7.653 -9.458 -4.708 1.00 0.00 N ATOM 891 CA TRP B 58 6.577 -8.494 -4.557 1.00 0.00 C ATOM 892 C TRP B 58 5.820 -8.328 -5.866 1.00 0.00 C ATOM 893 O TRP B 58 6.374 -7.850 -6.858 1.00 0.00 O ATOM 894 CB TRP B 58 7.124 -7.133 -4.121 1.00 0.00 C ATOM 895 CG TRP B 58 7.834 -7.145 -2.802 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.170 -7.323 -2.593 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.248 -6.956 -1.509 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.450 -7.261 -1.252 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.288 -7.037 -0.565 1.00 0.00 C ATOM 900 CE3 TRP B 58 5.946 -6.728 -1.056 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.066 -6.896 0.801 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.727 -6.589 0.299 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.782 -6.674 1.214 1.00 0.00 C ATOM 0 H TRP B 58 8.586 -9.046 -4.737 1.00 0.00 H new ATOM 0 HA TRP B 58 5.900 -8.872 -3.791 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.810 -6.769 -4.886 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.299 -6.423 -4.069 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.901 -7.489 -3.371 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.375 -7.365 -0.834 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.125 -6.662 -1.755 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 8.879 -6.960 1.510 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.724 -6.412 0.659 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.578 -6.562 2.269 1.00 0.00 H new ATOM 914 N LYS B 59 4.561 -8.727 -5.865 1.00 0.00 N ATOM 915 CA LYS B 59 3.695 -8.504 -7.009 1.00 0.00 C ATOM 916 C LYS B 59 3.123 -7.100 -6.939 1.00 0.00 C ATOM 917 O LYS B 59 2.807 -6.612 -5.856 1.00 0.00 O ATOM 918 CB LYS B 59 2.569 -9.535 -7.049 1.00 0.00 C ATOM 919 CG LYS B 59 3.042 -10.939 -7.383 1.00 0.00 C ATOM 920 CD LYS B 59 1.901 -11.940 -7.316 1.00 0.00 C ATOM 921 CE LYS B 59 2.345 -13.323 -7.765 1.00 0.00 C ATOM 922 NZ LYS B 59 3.493 -13.832 -6.968 1.00 0.00 N ATOM 0 H LYS B 59 4.115 -9.208 -5.084 1.00 0.00 H new ATOM 0 HA LYS B 59 4.280 -8.613 -7.922 1.00 0.00 H new ATOM 0 HB2 LYS B 59 2.067 -9.550 -6.082 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.829 -9.225 -7.787 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.479 -10.949 -8.382 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.828 -11.234 -6.688 1.00 0.00 H new ATOM 0 HD2 LYS B 59 1.521 -11.992 -6.296 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.079 -11.599 -7.945 1.00 0.00 H new ATOM 0 HE2 LYS B 59 1.509 -14.017 -7.678 1.00 0.00 H new ATOM 0 HE3 LYS B 59 2.623 -13.289 -8.818 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 3.653 -14.835 -7.191 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 4.347 -13.286 -7.201 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 3.283 -13.732 -5.954 1.00 0.00 H new ATOM 936 N GLU B 60 3.005 -6.450 -8.082 1.00 0.00 N ATOM 937 CA GLU B 60 2.550 -5.073 -8.121 1.00 0.00 C ATOM 938 C GLU B 60 1.206 -4.957 -8.823 1.00 0.00 C ATOM 939 O GLU B 60 1.049 -5.384 -9.969 1.00 0.00 O ATOM 940 CB GLU B 60 3.585 -4.193 -8.826 1.00 0.00 C ATOM 941 CG GLU B 60 4.939 -4.189 -8.140 1.00 0.00 C ATOM 942 CD GLU B 60 5.968 -3.353 -8.868 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.048 -2.136 -8.603 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.713 -3.914 -9.699 1.00 0.00 O ATOM 0 H GLU B 60 3.218 -6.853 -8.995 1.00 0.00 H new ATOM 0 HA GLU B 60 2.428 -4.731 -7.093 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.707 -4.539 -9.852 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.208 -3.171 -8.877 1.00 0.00 H new ATOM 0 HG2 GLU B 60 4.824 -3.811 -7.124 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.302 -5.213 -8.059 1.00 0.00 H new ATOM 951 N ALA B 61 0.243 -4.384 -8.124 1.00 0.00 N ATOM 952 CA ALA B 61 -1.061 -4.107 -8.697 1.00 0.00 C ATOM 953 C ALA B 61 -1.291 -2.606 -8.744 1.00 0.00 C ATOM 954 O ALA B 61 -1.102 -1.916 -7.743 1.00 0.00 O ATOM 955 CB ALA B 61 -2.151 -4.788 -7.887 1.00 0.00 C ATOM 0 H ALA B 61 0.342 -4.099 -7.150 1.00 0.00 H new ATOM 0 HA ALA B 61 -1.095 -4.502 -9.712 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.123 -4.570 -8.330 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.985 -5.865 -7.887 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.128 -4.417 -6.862 1.00 0.00 H new ATOM 961 N THR B 62 -1.685 -2.104 -9.902 1.00 0.00 N ATOM 962 CA THR B 62 -1.872 -0.675 -10.086 1.00 0.00 C ATOM 963 C THR B 62 -3.344 -0.287 -9.959 1.00 0.00 C ATOM 964 O THR B 62 -4.181 -0.691 -10.772 1.00 0.00 O ATOM 965 CB THR B 62 -1.334 -0.222 -11.456 1.00 0.00 C ATOM 966 OG1 THR B 62 0.021 -0.670 -11.616 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.387 1.295 -11.587 1.00 0.00 C ATOM 0 H THR B 62 -1.882 -2.666 -10.730 1.00 0.00 H new ATOM 0 HA THR B 62 -1.310 -0.171 -9.299 1.00 0.00 H new ATOM 0 HB THR B 62 -1.962 -0.659 -12.233 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.360 -0.382 -12.489 1.00 0.00 H new ATOM 0 HG21 THR B 62 -1.002 1.590 -12.563 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.418 1.633 -11.487 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.779 1.749 -10.805 1.00 0.00 H new ATOM 975 N ILE B 63 -3.646 0.503 -8.945 1.00 0.00 N ATOM 976 CA ILE B 63 -5.001 0.965 -8.699 1.00 0.00 C ATOM 977 C ILE B 63 -5.095 2.452 -9.028 1.00 0.00 C ATOM 978 O ILE B 63 -4.247 3.236 -8.601 1.00 0.00 O ATOM 979 CB ILE B 63 -5.425 0.749 -7.221 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.299 -0.722 -6.813 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.851 1.229 -6.989 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.935 -1.100 -6.274 1.00 0.00 C ATOM 0 H ILE B 63 -2.961 0.842 -8.270 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.671 0.385 -9.334 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.749 1.337 -6.601 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -6.051 -0.943 -6.056 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.523 -1.348 -7.677 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.124 1.067 -5.946 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.919 2.292 -7.221 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.532 0.672 -7.633 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.929 -2.157 -6.008 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.178 -0.913 -7.036 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.715 -0.502 -5.389 1.00 0.00 H new ATOM 994 N PRO B 64 -6.107 2.850 -9.819 1.00 0.00 N ATOM 995 CA PRO B 64 -6.337 4.253 -10.177 1.00 0.00 C ATOM 996 C PRO B 64 -6.328 5.173 -8.959 1.00 0.00 C ATOM 997 O PRO B 64 -6.848 4.817 -7.898 1.00 0.00 O ATOM 998 CB PRO B 64 -7.729 4.233 -10.805 1.00 0.00 C ATOM 999 CG PRO B 64 -7.882 2.857 -11.350 1.00 0.00 C ATOM 1000 CD PRO B 64 -7.103 1.952 -10.437 1.00 0.00 C ATOM 0 HA PRO B 64 -5.557 4.636 -10.835 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.499 4.453 -10.066 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.819 4.982 -11.592 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.932 2.566 -11.382 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.504 2.799 -12.371 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.746 1.491 -9.687 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.625 1.143 -10.988 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.761 6.363 -9.128 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.626 7.302 -8.028 1.00 0.00 C ATOM 1010 C GLY B 65 -6.930 7.993 -7.668 1.00 0.00 C ATOM 1011 O GLY B 65 -6.979 9.211 -7.520 1.00 0.00 O ATOM 0 H GLY B 65 -5.389 6.697 -10.017 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.248 6.774 -7.152 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -4.884 8.055 -8.291 1.00 0.00 H new ATOM 1015 N HIS B 66 -7.986 7.209 -7.538 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.279 7.712 -7.099 1.00 0.00 C ATOM 1017 C HIS B 66 -10.098 6.572 -6.503 1.00 0.00 C ATOM 1018 O HIS B 66 -11.325 6.631 -6.442 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.037 8.403 -8.250 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.258 7.556 -9.471 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.509 7.684 -10.623 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -11.168 6.588 -9.726 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.953 6.835 -11.531 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.957 6.158 -11.011 1.00 0.00 N ATOM 0 H HIS B 66 -7.973 6.208 -7.733 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.115 8.467 -6.330 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.006 8.735 -7.878 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.485 9.296 -8.542 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.921 6.222 -9.044 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -9.560 6.716 -12.530 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -11.491 5.431 -11.488 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.398 5.528 -6.073 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.028 4.391 -5.419 1.00 0.00 C ATOM 1035 C LEU B 67 -9.420 4.201 -4.038 1.00 0.00 C ATOM 1036 O LEU B 67 -8.327 4.704 -3.765 1.00 0.00 O ATOM 1037 CB LEU B 67 -9.850 3.108 -6.239 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.387 3.149 -7.673 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.227 1.792 -8.332 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.846 3.580 -7.698 1.00 0.00 C ATOM 0 H LEU B 67 -8.386 5.447 -6.168 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.095 4.594 -5.333 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.787 2.869 -6.277 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.342 2.291 -5.711 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.808 3.884 -8.232 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.612 1.835 -9.351 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.172 1.521 -8.354 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.782 1.044 -7.765 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.202 3.601 -8.728 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.444 2.874 -7.122 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -11.939 4.575 -7.262 1.00 0.00 H new ATOM 1052 N ASN B 68 -10.121 3.494 -3.168 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.627 3.254 -1.817 1.00 0.00 C ATOM 1054 C ASN B 68 -9.782 1.787 -1.432 1.00 0.00 C ATOM 1055 O ASN B 68 -9.730 1.431 -0.254 1.00 0.00 O ATOM 1056 CB ASN B 68 -10.363 4.141 -0.807 1.00 0.00 C ATOM 1057 CG ASN B 68 -11.807 3.724 -0.582 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -12.477 3.214 -1.480 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -12.293 3.935 0.628 1.00 0.00 N ATOM 0 H ASN B 68 -11.030 3.077 -3.369 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.567 3.506 -1.800 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -9.832 4.114 0.144 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -10.340 5.173 -1.156 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -13.255 3.673 0.844 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -11.707 4.360 1.346 1.00 0.00 H new ATOM 1066 N SER B 69 -9.968 0.934 -2.428 1.00 0.00 N ATOM 1067 CA SER B 69 -10.173 -0.482 -2.178 1.00 0.00 C ATOM 1068 C SER B 69 -9.699 -1.318 -3.360 1.00 0.00 C ATOM 1069 O SER B 69 -9.937 -0.968 -4.517 1.00 0.00 O ATOM 1070 CB SER B 69 -11.657 -0.749 -1.900 1.00 0.00 C ATOM 1071 OG SER B 69 -11.890 -2.114 -1.589 1.00 0.00 O ATOM 0 H SER B 69 -9.981 1.198 -3.413 1.00 0.00 H new ATOM 0 HA SER B 69 -9.586 -0.769 -1.305 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.991 -0.124 -1.072 1.00 0.00 H new ATOM 0 HB3 SER B 69 -12.248 -0.467 -2.771 1.00 0.00 H new ATOM 0 HG SER B 69 -12.845 -2.252 -1.415 1.00 0.00 H new ATOM 1077 N TYR B 70 -9.013 -2.412 -3.061 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.574 -3.347 -4.082 1.00 0.00 C ATOM 1079 C TYR B 70 -8.849 -4.776 -3.631 1.00 0.00 C ATOM 1080 O TYR B 70 -8.762 -5.086 -2.447 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.079 -3.156 -4.371 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.527 -4.106 -5.411 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.613 -5.091 -5.058 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -6.923 -4.024 -6.740 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.108 -5.964 -6.001 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.422 -4.895 -7.689 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.516 -5.863 -7.314 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.014 -6.733 -8.253 1.00 0.00 O ATOM 0 H TYR B 70 -8.748 -2.673 -2.111 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.130 -3.155 -5.000 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.912 -2.132 -4.704 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.521 -3.285 -3.444 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.293 -5.175 -4.030 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.634 -3.267 -7.037 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.396 -6.723 -5.711 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -6.739 -4.817 -8.719 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.403 -6.529 -9.129 1.00 0.00 H new ATOM 1098 N THR B 71 -9.209 -5.634 -4.566 1.00 0.00 N ATOM 1099 CA THR B 71 -9.419 -7.036 -4.264 1.00 0.00 C ATOM 1100 C THR B 71 -8.244 -7.863 -4.780 1.00 0.00 C ATOM 1101 O THR B 71 -7.989 -7.908 -5.984 1.00 0.00 O ATOM 1102 CB THR B 71 -10.727 -7.549 -4.894 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.811 -6.685 -4.529 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.033 -8.969 -4.437 1.00 0.00 C ATOM 0 H THR B 71 -9.362 -5.384 -5.543 1.00 0.00 H new ATOM 0 HA THR B 71 -9.493 -7.141 -3.182 1.00 0.00 H new ATOM 0 HB THR B 71 -10.606 -7.553 -5.977 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.641 -7.013 -4.933 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.962 -9.307 -4.897 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.219 -9.630 -4.735 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.137 -8.988 -3.352 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.520 -8.498 -3.870 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.373 -9.305 -4.254 1.00 0.00 C ATOM 1114 C ILE B 72 -6.810 -10.739 -4.506 1.00 0.00 C ATOM 1115 O ILE B 72 -7.412 -11.373 -3.638 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.265 -9.307 -3.179 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.952 -7.883 -2.713 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -4.008 -9.975 -3.725 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.880 -7.821 -1.645 1.00 0.00 C ATOM 0 H ILE B 72 -7.705 -8.470 -2.867 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.964 -8.860 -5.161 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.622 -9.873 -2.319 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.635 -7.290 -3.571 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.864 -7.426 -2.329 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.232 -9.971 -2.959 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.235 -11.003 -4.006 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.656 -9.429 -4.600 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.709 -6.783 -1.361 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.204 -8.387 -0.771 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.955 -8.249 -2.032 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.519 -11.237 -5.695 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.877 -12.595 -6.066 1.00 0.00 C ATOM 1133 C LYS B 73 -5.626 -13.369 -6.454 1.00 0.00 C ATOM 1134 O LYS B 73 -4.709 -12.816 -7.064 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.874 -12.584 -7.227 1.00 0.00 C ATOM 1136 CG LYS B 73 -9.140 -11.792 -6.933 1.00 0.00 C ATOM 1137 CD LYS B 73 -10.035 -11.697 -8.156 1.00 0.00 C ATOM 1138 CE LYS B 73 -11.255 -10.833 -7.885 1.00 0.00 C ATOM 1139 NZ LYS B 73 -12.116 -10.686 -9.089 1.00 0.00 N ATOM 0 H LYS B 73 -6.032 -10.717 -6.425 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.347 -13.083 -5.212 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -7.389 -12.164 -8.108 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -8.146 -13.611 -7.472 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.686 -12.267 -6.118 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.873 -10.790 -6.597 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -9.470 -11.280 -8.990 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -10.354 -12.696 -8.454 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.837 -11.273 -7.075 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.933 -9.848 -7.548 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.936 -10.089 -8.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -11.569 -10.243 -9.855 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -12.445 -11.623 -9.397 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.586 -14.640 -6.099 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.420 -15.448 -6.385 1.00 0.00 C ATOM 1155 C GLY B 74 -3.518 -15.585 -5.178 1.00 0.00 C ATOM 1156 O GLY B 74 -2.323 -15.854 -5.306 1.00 0.00 O ATOM 0 H GLY B 74 -6.340 -15.129 -5.617 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.736 -16.437 -6.716 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.861 -15.001 -7.207 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.089 -15.376 -4.003 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.370 -15.585 -2.758 1.00 0.00 C ATOM 1162 C LEU B 75 -3.459 -17.060 -2.372 1.00 0.00 C ATOM 1163 O LEU B 75 -4.260 -17.798 -2.939 1.00 0.00 O ATOM 1164 CB LEU B 75 -3.959 -14.707 -1.647 1.00 0.00 C ATOM 1165 CG LEU B 75 -3.834 -13.189 -1.845 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.582 -12.454 -0.748 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.374 -12.768 -1.860 1.00 0.00 C ATOM 0 H LEU B 75 -5.052 -15.061 -3.886 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.325 -15.307 -2.892 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.016 -14.953 -1.540 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -3.473 -14.971 -0.708 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.276 -12.930 -2.807 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.486 -11.379 -0.899 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.636 -12.732 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.162 -12.723 0.221 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.308 -11.689 -2.001 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -1.907 -13.039 -0.913 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -1.858 -13.273 -2.676 1.00 0.00 H new ATOM 1179 N LYS B 76 -2.630 -17.496 -1.439 1.00 0.00 N ATOM 1180 CA LYS B 76 -2.648 -18.885 -0.995 1.00 0.00 C ATOM 1181 C LYS B 76 -3.152 -18.989 0.444 1.00 0.00 C ATOM 1182 O LYS B 76 -2.616 -18.343 1.344 1.00 0.00 O ATOM 1183 CB LYS B 76 -1.253 -19.502 -1.107 1.00 0.00 C ATOM 1184 CG LYS B 76 -0.711 -19.544 -2.528 1.00 0.00 C ATOM 1185 CD LYS B 76 0.658 -20.206 -2.588 1.00 0.00 C ATOM 1186 CE LYS B 76 0.592 -21.665 -2.165 1.00 0.00 C ATOM 1187 NZ LYS B 76 1.925 -22.321 -2.204 1.00 0.00 N ATOM 0 H LYS B 76 -1.936 -16.912 -0.973 1.00 0.00 H new ATOM 0 HA LYS B 76 -3.330 -19.437 -1.642 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -0.564 -18.934 -0.482 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -1.282 -20.516 -0.709 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -1.407 -20.088 -3.167 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -0.643 -18.530 -2.922 1.00 0.00 H new ATOM 0 HD2 LYS B 76 1.052 -20.138 -3.602 1.00 0.00 H new ATOM 0 HD3 LYS B 76 1.351 -19.670 -1.940 1.00 0.00 H new ATOM 0 HE2 LYS B 76 0.186 -21.731 -1.156 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -0.094 -22.201 -2.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 1.832 -23.314 -1.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 2.303 -22.282 -3.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 2.574 -21.827 -1.559 1.00 0.00 H new ATOM 1201 N PRO B 77 -4.184 -19.820 0.674 1.00 0.00 N ATOM 1202 CA PRO B 77 -4.815 -19.957 1.990 1.00 0.00 C ATOM 1203 C PRO B 77 -3.876 -20.563 3.027 1.00 0.00 C ATOM 1204 O PRO B 77 -3.322 -21.650 2.829 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.004 -20.889 1.733 1.00 0.00 C ATOM 1206 CG PRO B 77 -5.649 -21.632 0.493 1.00 0.00 C ATOM 1207 CD PRO B 77 -4.814 -20.692 -0.331 1.00 0.00 C ATOM 0 HA PRO B 77 -5.102 -18.988 2.399 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -6.160 -21.570 2.570 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -6.928 -20.325 1.604 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -5.095 -22.541 0.728 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -6.544 -21.936 -0.049 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.070 -21.228 -0.920 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -5.425 -20.122 -1.031 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.693 -19.845 4.124 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.829 -20.311 5.186 1.00 0.00 C ATOM 1217 C GLY B 78 -1.502 -19.591 5.180 1.00 0.00 C ATOM 1218 O GLY B 78 -0.762 -19.609 6.167 1.00 0.00 O ATOM 0 H GLY B 78 -4.132 -18.941 4.298 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.320 -20.161 6.147 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -2.663 -21.383 5.076 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.203 -18.950 4.063 1.00 0.00 N ATOM 1223 CA VAL B 79 0.031 -18.206 3.915 1.00 0.00 C ATOM 1224 C VAL B 79 -0.162 -16.771 4.381 1.00 0.00 C ATOM 1225 O VAL B 79 -1.088 -16.086 3.942 1.00 0.00 O ATOM 1226 CB VAL B 79 0.515 -18.213 2.448 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.764 -17.368 2.273 1.00 0.00 C ATOM 1228 CG2 VAL B 79 0.783 -19.631 1.981 1.00 0.00 C ATOM 0 H VAL B 79 -1.805 -18.932 3.240 1.00 0.00 H new ATOM 0 HA VAL B 79 0.789 -18.690 4.531 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.279 -17.781 1.839 1.00 0.00 H new ATOM 0 HG11 VAL B 79 2.078 -17.395 1.230 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.550 -16.339 2.562 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.562 -17.763 2.902 1.00 0.00 H new ATOM 0 HG21 VAL B 79 1.123 -19.615 0.945 1.00 0.00 H new ATOM 0 HG22 VAL B 79 1.552 -20.081 2.608 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -0.133 -20.217 2.053 1.00 0.00 H new ATOM 1238 N VAL B 80 0.688 -16.328 5.295 1.00 0.00 N ATOM 1239 CA VAL B 80 0.671 -14.942 5.720 1.00 0.00 C ATOM 1240 C VAL B 80 1.465 -14.110 4.718 1.00 0.00 C ATOM 1241 O VAL B 80 2.501 -14.551 4.212 1.00 0.00 O ATOM 1242 CB VAL B 80 1.230 -14.760 7.157 1.00 0.00 C ATOM 1243 CG1 VAL B 80 0.464 -15.626 8.142 1.00 0.00 C ATOM 1244 CG2 VAL B 80 2.717 -15.070 7.232 1.00 0.00 C ATOM 0 H VAL B 80 1.393 -16.906 5.753 1.00 0.00 H new ATOM 0 HA VAL B 80 -0.364 -14.602 5.748 1.00 0.00 H new ATOM 0 HB VAL B 80 1.097 -13.712 7.425 1.00 0.00 H new ATOM 0 HG11 VAL B 80 0.870 -15.485 9.143 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -0.588 -15.342 8.134 1.00 0.00 H new ATOM 0 HG13 VAL B 80 0.559 -16.674 7.856 1.00 0.00 H new ATOM 0 HG21 VAL B 80 3.067 -14.930 8.255 1.00 0.00 H new ATOM 0 HG22 VAL B 80 2.889 -16.102 6.928 1.00 0.00 H new ATOM 0 HG23 VAL B 80 3.262 -14.400 6.567 1.00 0.00 H new ATOM 1254 N TYR B 81 0.960 -12.937 4.391 1.00 0.00 N ATOM 1255 CA TYR B 81 1.579 -12.108 3.373 1.00 0.00 C ATOM 1256 C TYR B 81 2.070 -10.791 3.942 1.00 0.00 C ATOM 1257 O TYR B 81 1.502 -10.260 4.899 1.00 0.00 O ATOM 1258 CB TYR B 81 0.595 -11.828 2.238 1.00 0.00 C ATOM 1259 CG TYR B 81 0.368 -12.996 1.306 1.00 0.00 C ATOM 1260 CD1 TYR B 81 1.106 -13.119 0.139 1.00 0.00 C ATOM 1261 CD2 TYR B 81 -0.585 -13.966 1.587 1.00 0.00 C ATOM 1262 CE1 TYR B 81 0.903 -14.175 -0.725 1.00 0.00 C ATOM 1263 CE2 TYR B 81 -0.793 -15.028 0.728 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.046 -15.125 -0.426 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.250 -16.176 -1.287 1.00 0.00 O ATOM 0 H TYR B 81 0.123 -12.536 4.814 1.00 0.00 H new ATOM 0 HA TYR B 81 2.437 -12.660 2.989 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.362 -11.531 2.668 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.961 -10.981 1.657 1.00 0.00 H new ATOM 0 HD1 TYR B 81 1.853 -12.375 -0.098 1.00 0.00 H new ATOM 0 HD2 TYR B 81 -1.172 -13.889 2.490 1.00 0.00 H new ATOM 0 HE1 TYR B 81 1.486 -14.255 -1.631 1.00 0.00 H new ATOM 0 HE2 TYR B 81 -1.536 -15.777 0.959 1.00 0.00 H new ATOM 0 HH TYR B 81 0.215 -16.970 -0.950 1.00 0.00 H new ATOM 1275 N GLU B 82 3.123 -10.277 3.333 1.00 0.00 N ATOM 1276 CA GLU B 82 3.627 -8.954 3.638 1.00 0.00 C ATOM 1277 C GLU B 82 3.196 -8.018 2.526 1.00 0.00 C ATOM 1278 O GLU B 82 3.433 -8.308 1.353 1.00 0.00 O ATOM 1279 CB GLU B 82 5.153 -8.970 3.733 1.00 0.00 C ATOM 1280 CG GLU B 82 5.694 -9.920 4.784 1.00 0.00 C ATOM 1281 CD GLU B 82 7.190 -10.108 4.672 1.00 0.00 C ATOM 1282 OE1 GLU B 82 7.624 -11.094 4.045 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.944 -9.264 5.198 1.00 0.00 O ATOM 0 H GLU B 82 3.652 -10.767 2.612 1.00 0.00 H new ATOM 0 HA GLU B 82 3.229 -8.621 4.597 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.565 -9.246 2.762 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.504 -7.962 3.954 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.451 -9.538 5.775 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.200 -10.887 4.685 1.00 0.00 H new ATOM 1290 N GLY B 83 2.552 -6.921 2.876 1.00 0.00 N ATOM 1291 CA GLY B 83 2.048 -6.024 1.863 1.00 0.00 C ATOM 1292 C GLY B 83 2.429 -4.585 2.109 1.00 0.00 C ATOM 1293 O GLY B 83 2.718 -4.193 3.239 1.00 0.00 O ATOM 0 H GLY B 83 2.369 -6.636 3.838 1.00 0.00 H new ATOM 0 HA2 GLY B 83 2.428 -6.334 0.889 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.962 -6.105 1.822 1.00 0.00 H new ATOM 1297 N GLN B 84 2.442 -3.801 1.043 1.00 0.00 N ATOM 1298 CA GLN B 84 2.757 -2.385 1.128 1.00 0.00 C ATOM 1299 C GLN B 84 1.862 -1.594 0.185 1.00 0.00 C ATOM 1300 O GLN B 84 1.728 -1.938 -0.992 1.00 0.00 O ATOM 1301 CB GLN B 84 4.227 -2.134 0.781 1.00 0.00 C ATOM 1302 CG GLN B 84 5.199 -2.921 1.644 1.00 0.00 C ATOM 1303 CD GLN B 84 6.643 -2.573 1.366 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.968 -1.443 1.005 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.520 -3.547 1.526 1.00 0.00 N ATOM 0 H GLN B 84 2.235 -4.127 0.099 1.00 0.00 H new ATOM 0 HA GLN B 84 2.581 -2.056 2.152 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.393 -2.390 -0.265 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.440 -1.070 0.886 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.980 -2.732 2.695 1.00 0.00 H new ATOM 0 HG3 GLN B 84 5.048 -3.987 1.474 1.00 0.00 H new ATOM 0 HE21 GLN B 84 7.208 -4.470 1.827 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.510 -3.376 1.349 1.00 0.00 H new ATOM 1314 N LEU B 85 1.235 -0.554 0.713 1.00 0.00 N ATOM 1315 CA LEU B 85 0.403 0.327 -0.089 1.00 0.00 C ATOM 1316 C LEU B 85 1.227 1.541 -0.502 1.00 0.00 C ATOM 1317 O LEU B 85 1.569 2.383 0.331 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.847 0.745 0.708 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.982 1.422 -0.087 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.632 2.856 -0.455 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -2.310 0.629 -1.345 1.00 0.00 C ATOM 0 H LEU B 85 1.288 -0.299 1.699 1.00 0.00 H new ATOM 0 HA LEU B 85 0.064 -0.192 -0.986 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.254 -0.143 1.193 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.534 1.425 1.500 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.860 1.442 0.559 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.456 3.300 -1.014 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.458 3.433 0.453 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.731 2.865 -1.068 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -3.113 1.126 -1.889 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -1.425 0.569 -1.979 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.627 -0.377 -1.069 1.00 0.00 H new ATOM 1333 N ILE B 86 1.560 1.608 -1.780 1.00 0.00 N ATOM 1334 CA ILE B 86 2.400 2.673 -2.302 1.00 0.00 C ATOM 1335 C ILE B 86 1.571 3.672 -3.097 1.00 0.00 C ATOM 1336 O ILE B 86 1.004 3.334 -4.131 1.00 0.00 O ATOM 1337 CB ILE B 86 3.499 2.098 -3.211 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.232 0.966 -2.495 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.476 3.192 -3.623 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.995 0.062 -3.429 1.00 0.00 C ATOM 0 H ILE B 86 1.258 0.931 -2.481 1.00 0.00 H new ATOM 0 HA ILE B 86 2.859 3.180 -1.453 1.00 0.00 H new ATOM 0 HB ILE B 86 3.035 1.698 -4.112 1.00 0.00 H new ATOM 0 HG12 ILE B 86 4.924 1.393 -1.769 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.509 0.372 -1.936 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.247 2.768 -4.266 1.00 0.00 H new ATOM 0 HG22 ILE B 86 3.941 3.972 -4.164 1.00 0.00 H new ATOM 0 HG23 ILE B 86 4.940 3.620 -2.734 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.492 -0.720 -2.854 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.305 -0.393 -4.139 1.00 0.00 H new ATOM 0 HD13 ILE B 86 5.741 0.644 -3.970 1.00 0.00 H new ATOM 1352 N SER B 87 1.495 4.892 -2.610 1.00 0.00 N ATOM 1353 CA SER B 87 0.735 5.927 -3.283 1.00 0.00 C ATOM 1354 C SER B 87 1.669 6.860 -4.050 1.00 0.00 C ATOM 1355 O SER B 87 2.593 7.436 -3.474 1.00 0.00 O ATOM 1356 CB SER B 87 -0.073 6.713 -2.260 1.00 0.00 C ATOM 1357 OG SER B 87 -0.675 5.838 -1.321 1.00 0.00 O ATOM 0 H SER B 87 1.951 5.193 -1.749 1.00 0.00 H new ATOM 0 HA SER B 87 0.054 5.462 -3.996 1.00 0.00 H new ATOM 0 HB2 SER B 87 0.575 7.420 -1.743 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.842 7.297 -2.766 1.00 0.00 H new ATOM 0 HG SER B 87 -1.645 5.828 -1.459 1.00 0.00 H new ATOM 1363 N ILE B 88 1.440 6.981 -5.351 1.00 0.00 N ATOM 1364 CA ILE B 88 2.247 7.856 -6.192 1.00 0.00 C ATOM 1365 C ILE B 88 1.563 9.206 -6.365 1.00 0.00 C ATOM 1366 O ILE B 88 0.487 9.295 -6.960 1.00 0.00 O ATOM 1367 CB ILE B 88 2.487 7.234 -7.586 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.117 5.844 -7.461 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.367 8.144 -8.435 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.459 5.834 -6.763 1.00 0.00 C ATOM 0 H ILE B 88 0.701 6.484 -5.848 1.00 0.00 H new ATOM 0 HA ILE B 88 3.208 7.988 -5.695 1.00 0.00 H new ATOM 0 HB ILE B 88 1.521 7.128 -8.080 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.432 5.194 -6.917 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.235 5.419 -8.458 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.525 7.689 -9.413 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.878 9.110 -8.559 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.328 8.285 -7.941 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.837 4.813 -6.715 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.162 6.456 -7.317 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.346 6.227 -5.752 1.00 0.00 H new ATOM 1382 N GLN B 89 2.177 10.256 -5.839 1.00 0.00 N ATOM 1383 CA GLN B 89 1.609 11.592 -5.941 1.00 0.00 C ATOM 1384 C GLN B 89 1.952 12.237 -7.278 1.00 0.00 C ATOM 1385 O GLN B 89 2.750 11.699 -8.048 1.00 0.00 O ATOM 1386 CB GLN B 89 2.120 12.496 -4.823 1.00 0.00 C ATOM 1387 CG GLN B 89 1.964 11.920 -3.430 1.00 0.00 C ATOM 1388 CD GLN B 89 2.426 12.893 -2.367 1.00 0.00 C ATOM 1389 OE1 GLN B 89 3.287 13.737 -2.614 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.868 12.781 -1.181 1.00 0.00 N ATOM 0 H GLN B 89 3.065 10.209 -5.339 1.00 0.00 H new ATOM 0 HA GLN B 89 0.528 11.481 -5.856 1.00 0.00 H new ATOM 0 HB2 GLN B 89 3.174 12.709 -4.998 1.00 0.00 H new ATOM 0 HB3 GLN B 89 1.590 13.447 -4.871 1.00 0.00 H new ATOM 0 HG2 GLN B 89 0.919 11.662 -3.258 1.00 0.00 H new ATOM 0 HG3 GLN B 89 2.537 10.996 -3.352 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.158 12.068 -1.017 1.00 0.00 H new ATOM 0 HE22 GLN B 89 2.146 13.407 -0.425 1.00 0.00 H new ATOM 1399 N GLN B 90 1.367 13.397 -7.538 1.00 0.00 N ATOM 1400 CA GLN B 90 1.679 14.164 -8.740 1.00 0.00 C ATOM 1401 C GLN B 90 3.171 14.483 -8.796 1.00 0.00 C ATOM 1402 O GLN B 90 3.807 14.366 -9.842 1.00 0.00 O ATOM 1403 CB GLN B 90 0.867 15.461 -8.770 1.00 0.00 C ATOM 1404 CG GLN B 90 -0.637 15.240 -8.775 1.00 0.00 C ATOM 1405 CD GLN B 90 -1.420 16.537 -8.841 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.726 17.036 -9.922 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -1.757 17.093 -7.686 1.00 0.00 N ATOM 0 H GLN B 90 0.671 13.831 -6.932 1.00 0.00 H new ATOM 0 HA GLN B 90 1.415 13.562 -9.610 1.00 0.00 H new ATOM 0 HB2 GLN B 90 1.134 16.066 -7.904 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.144 16.033 -9.656 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.905 14.615 -9.627 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -0.923 14.694 -7.876 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -1.485 16.650 -6.808 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -2.288 17.964 -7.675 1.00 0.00 H new ATOM 1416 N TYR B 91 3.728 14.837 -7.642 1.00 0.00 N ATOM 1417 CA TYR B 91 5.129 15.237 -7.545 1.00 0.00 C ATOM 1418 C TYR B 91 6.065 14.031 -7.555 1.00 0.00 C ATOM 1419 O TYR B 91 7.263 14.169 -7.329 1.00 0.00 O ATOM 1420 CB TYR B 91 5.355 16.052 -6.270 1.00 0.00 C ATOM 1421 CG TYR B 91 4.601 17.362 -6.242 1.00 0.00 C ATOM 1422 CD1 TYR B 91 3.278 17.419 -5.820 1.00 0.00 C ATOM 1423 CD2 TYR B 91 5.214 18.542 -6.640 1.00 0.00 C ATOM 1424 CE1 TYR B 91 2.588 18.615 -5.798 1.00 0.00 C ATOM 1425 CE2 TYR B 91 4.531 19.743 -6.618 1.00 0.00 C ATOM 1426 CZ TYR B 91 3.220 19.774 -6.198 1.00 0.00 C ATOM 1427 OH TYR B 91 2.539 20.970 -6.174 1.00 0.00 O ATOM 0 H TYR B 91 3.226 14.855 -6.754 1.00 0.00 H new ATOM 0 HA TYR B 91 5.357 15.847 -8.419 1.00 0.00 H new ATOM 0 HB2 TYR B 91 5.057 15.453 -5.409 1.00 0.00 H new ATOM 0 HB3 TYR B 91 6.421 16.254 -6.163 1.00 0.00 H new ATOM 0 HD1 TYR B 91 2.782 16.513 -5.504 1.00 0.00 H new ATOM 0 HD2 TYR B 91 6.241 18.521 -6.972 1.00 0.00 H new ATOM 0 HE1 TYR B 91 1.560 18.643 -5.470 1.00 0.00 H new ATOM 0 HE2 TYR B 91 5.023 20.653 -6.929 1.00 0.00 H new ATOM 0 HH TYR B 91 1.847 20.938 -5.481 1.00 0.00 H new ATOM 1437 N GLY B 92 5.514 12.848 -7.798 1.00 0.00 N ATOM 1438 CA GLY B 92 6.329 11.651 -7.863 1.00 0.00 C ATOM 1439 C GLY B 92 6.706 11.129 -6.492 1.00 0.00 C ATOM 1440 O GLY B 92 7.478 10.178 -6.376 1.00 0.00 O ATOM 0 H GLY B 92 4.517 12.697 -7.951 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.788 10.876 -8.407 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.236 11.863 -8.429 1.00 0.00 H new ATOM 1444 N HIS B 93 6.164 11.754 -5.452 1.00 0.00 N ATOM 1445 CA HIS B 93 6.417 11.315 -4.087 1.00 0.00 C ATOM 1446 C HIS B 93 5.742 9.980 -3.842 1.00 0.00 C ATOM 1447 O HIS B 93 4.597 9.777 -4.255 1.00 0.00 O ATOM 1448 CB HIS B 93 5.908 12.333 -3.062 1.00 0.00 C ATOM 1449 CG HIS B 93 6.644 13.636 -3.065 1.00 0.00 C ATOM 1450 ND1 HIS B 93 6.087 14.808 -2.611 1.00 0.00 N ATOM 1451 CD2 HIS B 93 7.907 13.943 -3.442 1.00 0.00 C ATOM 1452 CE1 HIS B 93 6.972 15.780 -2.708 1.00 0.00 C ATOM 1453 NE2 HIS B 93 8.088 15.284 -3.208 1.00 0.00 N ATOM 0 H HIS B 93 5.549 12.564 -5.529 1.00 0.00 H new ATOM 0 HA HIS B 93 7.496 11.218 -3.966 1.00 0.00 H new ATOM 0 HB2 HIS B 93 4.852 12.526 -3.253 1.00 0.00 H new ATOM 0 HB3 HIS B 93 5.977 11.893 -2.067 1.00 0.00 H new ATOM 0 HD1 HIS B 93 5.137 14.910 -2.255 1.00 0.00 H new ATOM 0 HD2 HIS B 93 8.637 13.260 -3.851 1.00 0.00 H new ATOM 0 HE1 HIS B 93 6.811 16.810 -2.426 1.00 0.00 H new ATOM 1462 N GLN B 94 6.444 9.076 -3.187 1.00 0.00 N ATOM 1463 CA GLN B 94 5.884 7.773 -2.885 1.00 0.00 C ATOM 1464 C GLN B 94 5.531 7.678 -1.412 1.00 0.00 C ATOM 1465 O GLN B 94 6.402 7.781 -0.543 1.00 0.00 O ATOM 1466 CB GLN B 94 6.872 6.663 -3.242 1.00 0.00 C ATOM 1467 CG GLN B 94 7.267 6.637 -4.708 1.00 0.00 C ATOM 1468 CD GLN B 94 8.168 5.466 -5.041 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.940 5.003 -4.200 1.00 0.00 O ATOM 1470 NE2 GLN B 94 8.077 4.976 -6.265 1.00 0.00 N ATOM 0 H GLN B 94 7.398 9.218 -2.855 1.00 0.00 H new ATOM 0 HA GLN B 94 4.981 7.649 -3.482 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.770 6.781 -2.636 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.433 5.701 -2.977 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.368 6.587 -5.323 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.776 7.567 -4.961 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.425 5.388 -6.932 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.659 4.186 -6.543 1.00 0.00 H new ATOM 1479 N GLU B 95 4.261 7.460 -1.140 1.00 0.00 N ATOM 1480 CA GLU B 95 3.798 7.259 0.219 1.00 0.00 C ATOM 1481 C GLU B 95 3.551 5.774 0.437 1.00 0.00 C ATOM 1482 O GLU B 95 2.656 5.197 -0.178 1.00 0.00 O ATOM 1483 CB GLU B 95 2.516 8.059 0.462 1.00 0.00 C ATOM 1484 CG GLU B 95 2.657 9.553 0.189 1.00 0.00 C ATOM 1485 CD GLU B 95 3.671 10.230 1.091 1.00 0.00 C ATOM 1486 OE1 GLU B 95 3.299 10.649 2.207 1.00 0.00 O ATOM 1487 OE2 GLU B 95 4.846 10.357 0.689 1.00 0.00 O ATOM 0 H GLU B 95 3.526 7.417 -1.846 1.00 0.00 H new ATOM 0 HA GLU B 95 4.553 7.608 0.924 1.00 0.00 H new ATOM 0 HB2 GLU B 95 1.724 7.658 -0.170 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.202 7.917 1.496 1.00 0.00 H new ATOM 0 HG2 GLU B 95 2.949 9.700 -0.851 1.00 0.00 H new ATOM 0 HG3 GLU B 95 1.687 10.033 0.318 1.00 0.00 H new ATOM 1494 N VAL B 96 4.347 5.157 1.295 1.00 0.00 N ATOM 1495 CA VAL B 96 4.299 3.712 1.457 1.00 0.00 C ATOM 1496 C VAL B 96 3.896 3.316 2.871 1.00 0.00 C ATOM 1497 O VAL B 96 4.629 3.558 3.834 1.00 0.00 O ATOM 1498 CB VAL B 96 5.660 3.063 1.121 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.559 1.546 1.179 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.158 3.519 -0.244 1.00 0.00 C ATOM 0 H VAL B 96 5.030 5.630 1.887 1.00 0.00 H new ATOM 0 HA VAL B 96 3.544 3.348 0.760 1.00 0.00 H new ATOM 0 HB VAL B 96 6.384 3.387 1.869 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.528 1.107 0.939 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.260 1.239 2.181 1.00 0.00 H new ATOM 0 HG13 VAL B 96 4.817 1.203 0.458 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.118 3.048 -0.457 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.436 3.233 -1.009 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.277 4.602 -0.244 1.00 0.00 H new ATOM 1510 N THR B 97 2.726 2.715 2.990 1.00 0.00 N ATOM 1511 CA THR B 97 2.270 2.167 4.254 1.00 0.00 C ATOM 1512 C THR B 97 2.360 0.644 4.220 1.00 0.00 C ATOM 1513 O THR B 97 1.688 -0.008 3.420 1.00 0.00 O ATOM 1514 CB THR B 97 0.821 2.591 4.561 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.710 4.021 4.512 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.391 2.094 5.934 1.00 0.00 C ATOM 0 H THR B 97 2.069 2.594 2.219 1.00 0.00 H new ATOM 0 HA THR B 97 2.914 2.559 5.042 1.00 0.00 H new ATOM 0 HB THR B 97 0.168 2.147 3.809 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.132 4.298 4.930 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.635 2.405 6.129 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.452 1.006 5.963 1.00 0.00 H new ATOM 0 HG23 THR B 97 1.048 2.514 6.695 1.00 0.00 H new ATOM 1524 N ARG B 98 3.209 0.082 5.068 1.00 0.00 N ATOM 1525 CA ARG B 98 3.403 -1.361 5.105 1.00 0.00 C ATOM 1526 C ARG B 98 2.377 -2.011 6.026 1.00 0.00 C ATOM 1527 O ARG B 98 1.915 -1.392 6.987 1.00 0.00 O ATOM 1528 CB ARG B 98 4.813 -1.705 5.585 1.00 0.00 C ATOM 1529 CG ARG B 98 5.922 -1.025 4.796 1.00 0.00 C ATOM 1530 CD ARG B 98 7.290 -1.452 5.295 1.00 0.00 C ATOM 1531 NE ARG B 98 7.435 -1.237 6.734 1.00 0.00 N ATOM 1532 CZ ARG B 98 7.987 -2.117 7.568 1.00 0.00 C ATOM 1533 NH1 ARG B 98 8.497 -3.254 7.101 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.043 -1.854 8.866 1.00 0.00 N ATOM 0 H ARG B 98 3.774 0.602 5.739 1.00 0.00 H new ATOM 0 HA ARG B 98 3.272 -1.745 4.094 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.906 -1.427 6.635 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.951 -2.785 5.528 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.824 -1.272 3.739 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.822 0.057 4.881 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.447 -2.506 5.067 1.00 0.00 H new ATOM 0 HD3 ARG B 98 8.061 -0.893 4.765 1.00 0.00 H new ATOM 0 HE ARG B 98 7.092 -0.359 7.123 1.00 0.00 H new ATOM 0 HH11 ARG B 98 8.466 -3.454 6.101 1.00 0.00 H new ATOM 0 HH12 ARG B 98 8.919 -3.925 7.743 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.664 -0.978 9.226 1.00 0.00 H new ATOM 0 HH22 ARG B 98 8.466 -2.527 9.505 1.00 0.00 H new ATOM 1548 N PHE B 99 2.022 -3.249 5.727 1.00 0.00 N ATOM 1549 CA PHE B 99 1.066 -3.995 6.533 1.00 0.00 C ATOM 1550 C PHE B 99 1.213 -5.489 6.273 1.00 0.00 C ATOM 1551 O PHE B 99 2.029 -5.907 5.449 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.370 -3.540 6.228 1.00 0.00 C ATOM 1553 CG PHE B 99 -0.842 -3.841 4.828 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.777 -4.838 4.601 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.362 -3.121 3.744 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -2.222 -5.111 3.322 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -0.803 -3.392 2.462 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.734 -4.389 2.252 1.00 0.00 C ATOM 0 H PHE B 99 2.384 -3.764 4.925 1.00 0.00 H new ATOM 0 HA PHE B 99 1.273 -3.799 7.585 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.047 -4.019 6.936 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -0.440 -2.466 6.397 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -2.162 -5.408 5.433 1.00 0.00 H new ATOM 0 HD2 PHE B 99 0.365 -2.339 3.903 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.952 -5.890 3.159 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.420 -2.825 1.627 1.00 0.00 H new ATOM 0 HZ PHE B 99 -2.080 -4.604 1.252 1.00 0.00 H new ATOM 1568 N ASP B 100 0.429 -6.287 6.979 1.00 0.00 N ATOM 1569 CA ASP B 100 0.433 -7.729 6.790 1.00 0.00 C ATOM 1570 C ASP B 100 -0.995 -8.243 6.782 1.00 0.00 C ATOM 1571 O ASP B 100 -1.902 -7.583 7.295 1.00 0.00 O ATOM 1572 CB ASP B 100 1.240 -8.437 7.887 1.00 0.00 C ATOM 1573 CG ASP B 100 0.585 -8.367 9.255 1.00 0.00 C ATOM 1574 OD1 ASP B 100 0.838 -7.389 9.992 1.00 0.00 O ATOM 1575 OD2 ASP B 100 -0.174 -9.296 9.612 1.00 0.00 O ATOM 0 H ASP B 100 -0.222 -5.958 7.692 1.00 0.00 H new ATOM 0 HA ASP B 100 0.909 -7.947 5.834 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.377 -9.482 7.610 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.233 -7.990 7.944 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.199 -9.406 6.191 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.522 -10.001 6.128 1.00 0.00 C ATOM 1582 C PHE B 101 -2.424 -11.501 5.908 1.00 0.00 C ATOM 1583 O PHE B 101 -1.434 -11.994 5.368 1.00 0.00 O ATOM 1584 CB PHE B 101 -3.364 -9.347 5.022 1.00 0.00 C ATOM 1585 CG PHE B 101 -2.747 -9.400 3.648 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -3.101 -10.396 2.750 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -1.825 -8.445 3.251 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -2.544 -10.436 1.486 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -1.265 -8.482 1.989 1.00 0.00 C ATOM 1590 CZ PHE B 101 -1.627 -9.477 1.104 1.00 0.00 C ATOM 0 H PHE B 101 -0.465 -9.958 5.747 1.00 0.00 H new ATOM 0 HA PHE B 101 -3.019 -9.825 7.082 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -4.337 -9.836 4.988 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -3.540 -8.304 5.287 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -3.819 -11.148 3.042 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -1.540 -7.661 3.937 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -2.826 -11.218 0.796 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -0.545 -7.733 1.695 1.00 0.00 H new ATOM 0 HZ PHE B 101 -1.194 -9.506 0.115 1.00 0.00 H new ATOM 1600 N THR B 102 -3.441 -12.220 6.347 1.00 0.00 N ATOM 1601 CA THR B 102 -3.484 -13.660 6.178 1.00 0.00 C ATOM 1602 C THR B 102 -4.794 -14.081 5.531 1.00 0.00 C ATOM 1603 O THR B 102 -5.869 -13.838 6.077 1.00 0.00 O ATOM 1604 CB THR B 102 -3.337 -14.381 7.530 1.00 0.00 C ATOM 1605 OG1 THR B 102 -2.196 -13.870 8.228 1.00 0.00 O ATOM 1606 CG2 THR B 102 -3.186 -15.884 7.335 1.00 0.00 C ATOM 0 H THR B 102 -4.252 -11.827 6.825 1.00 0.00 H new ATOM 0 HA THR B 102 -2.651 -13.940 5.534 1.00 0.00 H new ATOM 0 HB THR B 102 -4.239 -14.199 8.115 1.00 0.00 H new ATOM 0 HG1 THR B 102 -1.522 -13.575 7.581 1.00 0.00 H new ATOM 0 HG21 THR B 102 -3.084 -16.368 8.306 1.00 0.00 H new ATOM 0 HG22 THR B 102 -4.066 -16.275 6.825 1.00 0.00 H new ATOM 0 HG23 THR B 102 -2.299 -16.086 6.734 1.00 0.00 H new ATOM 1614 N THR B 103 -4.705 -14.693 4.364 1.00 0.00 N ATOM 1615 CA THR B 103 -5.883 -15.216 3.701 1.00 0.00 C ATOM 1616 C THR B 103 -6.072 -16.682 4.092 1.00 0.00 C ATOM 1617 O THR B 103 -5.166 -17.503 3.934 1.00 0.00 O ATOM 1618 CB THR B 103 -5.788 -15.055 2.163 1.00 0.00 C ATOM 1619 OG1 THR B 103 -6.987 -15.511 1.530 1.00 0.00 O ATOM 1620 CG2 THR B 103 -4.594 -15.806 1.596 1.00 0.00 C ATOM 0 H THR B 103 -3.832 -14.839 3.858 1.00 0.00 H new ATOM 0 HA THR B 103 -6.752 -14.644 4.025 1.00 0.00 H new ATOM 0 HB THR B 103 -5.656 -13.993 1.958 1.00 0.00 H new ATOM 0 HG1 THR B 103 -6.874 -16.443 1.249 1.00 0.00 H new ATOM 0 HG21 THR B 103 -4.559 -15.671 0.515 1.00 0.00 H new ATOM 0 HG22 THR B 103 -3.677 -15.419 2.040 1.00 0.00 H new ATOM 0 HG23 THR B 103 -4.689 -16.867 1.826 1.00 0.00 H new ATOM 1628 N THR B 104 -7.231 -17.000 4.650 1.00 0.00 N ATOM 1629 CA THR B 104 -7.499 -18.343 5.132 1.00 0.00 C ATOM 1630 C THR B 104 -8.924 -18.451 5.666 1.00 0.00 C ATOM 1631 O THR B 104 -9.479 -17.486 6.197 1.00 0.00 O ATOM 1632 CB THR B 104 -6.495 -18.757 6.242 1.00 0.00 C ATOM 1633 OG1 THR B 104 -6.727 -20.113 6.650 1.00 0.00 O ATOM 1634 CG2 THR B 104 -6.592 -17.836 7.454 1.00 0.00 C ATOM 0 H THR B 104 -8.001 -16.343 4.779 1.00 0.00 H new ATOM 0 HA THR B 104 -7.380 -19.021 4.287 1.00 0.00 H new ATOM 0 HB THR B 104 -5.492 -18.671 5.823 1.00 0.00 H new ATOM 0 HG1 THR B 104 -6.085 -20.359 7.349 1.00 0.00 H new ATOM 0 HG21 THR B 104 -5.876 -18.155 8.211 1.00 0.00 H new ATOM 0 HG22 THR B 104 -6.370 -16.813 7.152 1.00 0.00 H new ATOM 0 HG23 THR B 104 -7.600 -17.882 7.866 1.00 0.00 H new ATOM 1642 N SER B 105 -9.514 -19.621 5.493 1.00 0.00 N ATOM 1643 CA SER B 105 -10.824 -19.909 6.046 1.00 0.00 C ATOM 1644 C SER B 105 -10.733 -21.132 6.955 1.00 0.00 C ATOM 1645 O SER B 105 -11.622 -21.391 7.768 1.00 0.00 O ATOM 1646 CB SER B 105 -11.837 -20.143 4.921 1.00 0.00 C ATOM 1647 OG SER B 105 -13.157 -20.264 5.430 1.00 0.00 O ATOM 0 H SER B 105 -9.101 -20.393 4.969 1.00 0.00 H new ATOM 0 HA SER B 105 -11.164 -19.056 6.633 1.00 0.00 H new ATOM 0 HB2 SER B 105 -11.793 -19.316 4.212 1.00 0.00 H new ATOM 0 HB3 SER B 105 -11.572 -21.047 4.373 1.00 0.00 H new ATOM 0 HG SER B 105 -13.781 -20.411 4.689 1.00 0.00 H new ATOM 1653 N THR B 106 -9.635 -21.870 6.823 1.00 0.00 N ATOM 1654 CA THR B 106 -9.408 -23.057 7.631 1.00 0.00 C ATOM 1655 C THR B 106 -8.946 -22.666 9.034 1.00 0.00 C ATOM 1656 O THR B 106 -8.944 -23.483 9.956 1.00 0.00 O ATOM 1657 CB THR B 106 -8.374 -24.000 6.965 1.00 0.00 C ATOM 1658 OG1 THR B 106 -8.329 -25.260 7.645 1.00 0.00 O ATOM 1659 CG2 THR B 106 -6.984 -23.378 6.957 1.00 0.00 C ATOM 0 H THR B 106 -8.887 -21.663 6.161 1.00 0.00 H new ATOM 0 HA THR B 106 -10.352 -23.596 7.709 1.00 0.00 H new ATOM 0 HB THR B 106 -8.692 -24.157 5.934 1.00 0.00 H new ATOM 0 HG1 THR B 106 -8.442 -25.116 8.608 1.00 0.00 H new ATOM 0 HG21 THR B 106 -6.281 -24.064 6.483 1.00 0.00 H new ATOM 0 HG22 THR B 106 -7.008 -22.441 6.400 1.00 0.00 H new ATOM 0 HG23 THR B 106 -6.667 -23.183 7.981 1.00 0.00 H new ATOM 1667 N SER B 107 -8.564 -21.405 9.190 1.00 0.00 N ATOM 1668 CA SER B 107 -8.198 -20.872 10.490 1.00 0.00 C ATOM 1669 C SER B 107 -9.253 -19.869 10.944 1.00 0.00 C ATOM 1670 O SER B 107 -9.564 -18.913 10.229 1.00 0.00 O ATOM 1671 CB SER B 107 -6.816 -20.212 10.432 1.00 0.00 C ATOM 1672 OG SER B 107 -6.398 -19.767 11.712 1.00 0.00 O ATOM 0 H SER B 107 -8.500 -20.732 8.426 1.00 0.00 H new ATOM 0 HA SER B 107 -8.150 -21.689 11.210 1.00 0.00 H new ATOM 0 HB2 SER B 107 -6.089 -20.922 10.037 1.00 0.00 H new ATOM 0 HB3 SER B 107 -6.844 -19.368 9.743 1.00 0.00 H new ATOM 0 HG SER B 107 -5.513 -19.353 11.641 1.00 0.00 H new ATOM 1678 N THR B 108 -9.820 -20.105 12.115 1.00 0.00 N ATOM 1679 CA THR B 108 -10.847 -19.238 12.662 1.00 0.00 C ATOM 1680 C THR B 108 -10.485 -18.821 14.086 1.00 0.00 C ATOM 1681 O THR B 108 -10.390 -19.661 14.979 1.00 0.00 O ATOM 1682 CB THR B 108 -12.220 -19.943 12.659 1.00 0.00 C ATOM 1683 OG1 THR B 108 -12.525 -20.401 11.334 1.00 0.00 O ATOM 1684 CG2 THR B 108 -13.321 -19.007 13.138 1.00 0.00 C ATOM 0 H THR B 108 -9.582 -20.899 12.710 1.00 0.00 H new ATOM 0 HA THR B 108 -10.910 -18.350 12.033 1.00 0.00 H new ATOM 0 HB THR B 108 -12.168 -20.790 13.343 1.00 0.00 H new ATOM 0 HG1 THR B 108 -13.396 -20.850 11.335 1.00 0.00 H new ATOM 0 HG21 THR B 108 -14.276 -19.532 13.125 1.00 0.00 H new ATOM 0 HG22 THR B 108 -13.102 -18.677 14.154 1.00 0.00 H new ATOM 0 HG23 THR B 108 -13.374 -18.140 12.479 1.00 0.00 H new ATOM 1692 N PRO B 109 -10.260 -17.518 14.312 1.00 0.00 N ATOM 1693 CA PRO B 109 -9.862 -16.997 15.620 1.00 0.00 C ATOM 1694 C PRO B 109 -11.046 -16.778 16.562 1.00 0.00 C ATOM 1695 O PRO B 109 -11.216 -15.695 17.126 1.00 0.00 O ATOM 1696 CB PRO B 109 -9.200 -15.669 15.262 1.00 0.00 C ATOM 1697 CG PRO B 109 -9.923 -15.204 14.045 1.00 0.00 C ATOM 1698 CD PRO B 109 -10.361 -16.444 13.303 1.00 0.00 C ATOM 0 HA PRO B 109 -9.216 -17.690 16.160 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -9.290 -14.949 16.076 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -8.135 -15.797 15.066 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -10.782 -14.591 14.316 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -9.275 -14.588 13.421 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -11.379 -16.345 12.926 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -9.721 -16.642 12.444 1.00 0.00 H new ATOM 1706 N GLY B 110 -11.854 -17.813 16.740 1.00 0.00 N ATOM 1707 CA GLY B 110 -12.996 -17.716 17.625 1.00 0.00 C ATOM 1708 C GLY B 110 -12.641 -18.100 19.046 1.00 0.00 C ATOM 1709 O GLY B 110 -12.704 -19.273 19.416 1.00 0.00 O ATOM 0 H GLY B 110 -11.739 -18.719 16.287 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -13.382 -16.697 17.610 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -13.793 -18.364 17.262 1.00 0.00 H new ATOM 1713 N SER B 111 -12.256 -17.115 19.844 1.00 0.00 N ATOM 1714 CA SER B 111 -11.864 -17.360 21.221 1.00 0.00 C ATOM 1715 C SER B 111 -13.096 -17.598 22.088 1.00 0.00 C ATOM 1716 O SER B 111 -13.815 -16.662 22.436 1.00 0.00 O ATOM 1717 CB SER B 111 -11.051 -16.178 21.762 1.00 0.00 C ATOM 1718 OG SER B 111 -10.533 -16.450 23.056 1.00 0.00 O ATOM 0 H SER B 111 -12.207 -16.137 19.559 1.00 0.00 H new ATOM 0 HA SER B 111 -11.240 -18.253 21.251 1.00 0.00 H new ATOM 0 HB2 SER B 111 -10.230 -15.957 21.080 1.00 0.00 H new ATOM 0 HB3 SER B 111 -11.681 -15.289 21.801 1.00 0.00 H new ATOM 0 HG SER B 111 -10.019 -15.678 23.372 1.00 0.00 H new ATOM 1724 N ARG B 112 -13.342 -18.856 22.416 1.00 0.00 N ATOM 1725 CA ARG B 112 -14.486 -19.225 23.232 1.00 0.00 C ATOM 1726 C ARG B 112 -14.155 -20.440 24.090 1.00 0.00 C ATOM 1727 O ARG B 112 -14.947 -21.379 24.197 1.00 0.00 O ATOM 1728 CB ARG B 112 -15.707 -19.512 22.349 1.00 0.00 C ATOM 1729 CG ARG B 112 -15.484 -20.608 21.317 1.00 0.00 C ATOM 1730 CD ARG B 112 -16.754 -20.894 20.538 1.00 0.00 C ATOM 1731 NE ARG B 112 -16.586 -21.992 19.590 1.00 0.00 N ATOM 1732 CZ ARG B 112 -17.554 -22.433 18.791 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -18.760 -21.879 18.835 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -17.317 -23.434 17.954 1.00 0.00 N ATOM 0 H ARG B 112 -12.761 -19.643 22.127 1.00 0.00 H new ATOM 0 HA ARG B 112 -14.725 -18.389 23.889 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -16.545 -19.793 22.987 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -15.993 -18.595 21.833 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -14.692 -20.309 20.630 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -15.147 -21.517 21.815 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -17.557 -21.137 21.233 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -17.058 -19.996 20.000 1.00 0.00 H new ATOM 0 HE ARG B 112 -15.674 -22.447 19.537 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -18.946 -21.113 19.483 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -19.500 -22.219 18.221 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -16.393 -23.865 17.923 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -18.059 -23.773 17.341 1.00 0.00 H new ATOM 1748 N SER B 113 -12.978 -20.420 24.699 1.00 0.00 N ATOM 1749 CA SER B 113 -12.530 -21.522 25.536 1.00 0.00 C ATOM 1750 C SER B 113 -13.487 -21.750 26.706 1.00 0.00 C ATOM 1751 O SER B 113 -13.715 -22.886 27.120 1.00 0.00 O ATOM 1752 CB SER B 113 -11.111 -21.255 26.039 1.00 0.00 C ATOM 1753 OG SER B 113 -10.981 -19.926 26.518 1.00 0.00 O ATOM 0 H SER B 113 -12.314 -19.649 24.628 1.00 0.00 H new ATOM 0 HA SER B 113 -12.523 -22.431 24.934 1.00 0.00 H new ATOM 0 HB2 SER B 113 -10.866 -21.958 26.835 1.00 0.00 H new ATOM 0 HB3 SER B 113 -10.398 -21.426 25.233 1.00 0.00 H new ATOM 0 HG SER B 113 -10.065 -19.781 26.836 1.00 0.00 H new ATOM 1759 N HIS B 114 -14.055 -20.670 27.229 1.00 0.00 N ATOM 1760 CA HIS B 114 -15.025 -20.769 28.312 1.00 0.00 C ATOM 1761 C HIS B 114 -16.285 -19.977 27.990 1.00 0.00 C ATOM 1762 O HIS B 114 -17.391 -20.512 28.038 1.00 0.00 O ATOM 1763 CB HIS B 114 -14.427 -20.279 29.636 1.00 0.00 C ATOM 1764 CG HIS B 114 -13.360 -21.174 30.184 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -13.602 -22.140 31.133 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -12.041 -21.249 29.903 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -12.477 -22.771 31.413 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -11.514 -22.250 30.679 1.00 0.00 N ATOM 0 H HIS B 114 -13.861 -19.717 26.921 1.00 0.00 H new ATOM 0 HA HIS B 114 -15.290 -21.821 28.418 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -14.012 -19.282 29.490 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -15.225 -20.187 30.373 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -11.501 -20.635 29.198 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -12.365 -23.577 32.123 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -10.537 -22.543 30.687 1.00 0.00 H new ATOM 1777 N HIS B 115 -16.114 -18.700 27.671 1.00 0.00 N ATOM 1778 CA HIS B 115 -17.242 -17.821 27.379 1.00 0.00 C ATOM 1779 C HIS B 115 -16.914 -16.897 26.214 1.00 0.00 C ATOM 1780 O HIS B 115 -15.760 -16.507 26.032 1.00 0.00 O ATOM 1781 CB HIS B 115 -17.608 -16.976 28.606 1.00 0.00 C ATOM 1782 CG HIS B 115 -18.238 -17.747 29.727 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -19.596 -17.769 29.951 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -17.688 -18.517 30.696 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -19.855 -18.519 31.005 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -18.714 -18.985 31.474 1.00 0.00 N ATOM 0 H HIS B 115 -15.202 -18.248 27.608 1.00 0.00 H new ATOM 0 HA HIS B 115 -18.091 -18.450 27.113 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -16.706 -16.490 28.978 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -18.292 -16.186 28.296 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -16.636 -18.724 30.830 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -20.835 -18.718 31.414 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -18.612 -19.595 32.285 1.00 0.00 H new ATOM 1795 N HIS B 116 -17.925 -16.555 25.428 1.00 0.00 N ATOM 1796 CA HIS B 116 -17.756 -15.619 24.324 1.00 0.00 C ATOM 1797 C HIS B 116 -19.096 -15.017 23.922 1.00 0.00 C ATOM 1798 O HIS B 116 -20.003 -15.733 23.499 1.00 0.00 O ATOM 1799 CB HIS B 116 -17.115 -16.312 23.117 1.00 0.00 C ATOM 1800 CG HIS B 116 -16.816 -15.380 21.983 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -17.554 -15.345 20.819 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -15.855 -14.437 21.843 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -17.062 -14.421 20.016 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -16.032 -13.856 20.613 1.00 0.00 N ATOM 0 H HIS B 116 -18.874 -16.913 25.534 1.00 0.00 H new ATOM 0 HA HIS B 116 -17.096 -14.819 24.660 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -16.190 -16.795 23.434 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -17.781 -17.099 22.764 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -15.091 -14.188 22.565 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -17.439 -14.170 19.036 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -15.459 -13.108 20.223 1.00 0.00 H new ATOM 1813 N HIS B 117 -19.218 -13.707 24.066 1.00 0.00 N ATOM 1814 CA HIS B 117 -20.433 -13.001 23.680 1.00 0.00 C ATOM 1815 C HIS B 117 -20.136 -11.536 23.388 1.00 0.00 C ATOM 1816 O HIS B 117 -18.990 -11.099 23.509 1.00 0.00 O ATOM 1817 CB HIS B 117 -21.515 -13.127 24.766 1.00 0.00 C ATOM 1818 CG HIS B 117 -21.063 -12.768 26.156 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -21.116 -13.652 27.213 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -20.569 -11.612 26.663 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -20.675 -13.057 28.305 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -20.335 -11.819 27.999 1.00 0.00 N ATOM 0 H HIS B 117 -18.487 -13.107 24.449 1.00 0.00 H new ATOM 0 HA HIS B 117 -20.813 -13.463 22.769 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -22.356 -12.488 24.497 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -21.884 -14.153 24.773 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -20.392 -10.697 26.117 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -20.604 -13.507 29.284 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -19.960 -11.129 28.649 1.00 0.00 H new ATOM 1831 N HIS B 118 -21.174 -10.793 23.000 1.00 0.00 N ATOM 1832 CA HIS B 118 -21.061 -9.365 22.694 1.00 0.00 C ATOM 1833 C HIS B 118 -20.192 -9.153 21.451 1.00 0.00 C ATOM 1834 O HIS B 118 -19.371 -8.237 21.386 1.00 0.00 O ATOM 1835 CB HIS B 118 -20.505 -8.590 23.903 1.00 0.00 C ATOM 1836 CG HIS B 118 -20.569 -7.097 23.759 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -19.476 -6.274 23.940 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -21.605 -6.279 23.459 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -19.838 -5.019 23.757 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -21.123 -4.995 23.463 1.00 0.00 N ATOM 0 H HIS B 118 -22.118 -11.164 22.889 1.00 0.00 H new ATOM 0 HA HIS B 118 -22.056 -8.975 22.481 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -21.060 -8.882 24.794 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -19.468 -8.884 24.063 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -22.622 -6.581 23.255 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -19.192 -4.157 23.835 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -21.671 -4.156 23.270 1.00 0.00 H new ATOM 1849 N HIS B 119 -20.381 -10.022 20.470 1.00 0.00 N ATOM 1850 CA HIS B 119 -19.668 -9.925 19.206 1.00 0.00 C ATOM 1851 C HIS B 119 -20.368 -8.929 18.286 1.00 0.00 C ATOM 1852 O HIS B 119 -21.438 -9.273 17.744 1.00 0.00 O ATOM 1853 CB HIS B 119 -19.584 -11.304 18.544 1.00 0.00 C ATOM 1854 CG HIS B 119 -18.896 -11.303 17.212 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -19.569 -11.469 16.024 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -17.588 -11.167 16.887 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -18.707 -11.439 15.026 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -17.499 -11.255 15.521 1.00 0.00 N ATOM 1859 OXT HIS B 119 -19.851 -7.808 18.116 1.00 0.00 O ATOM 0 H HIS B 119 -21.028 -10.809 20.526 1.00 0.00 H new ATOM 0 HA HIS B 119 -18.655 -9.569 19.394 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -19.057 -11.985 19.213 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -20.593 -11.697 18.419 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -16.769 -11.017 17.575 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -18.950 -11.547 13.979 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -16.639 -11.189 14.977 1.00 0.00 H new TER 1868 HIS B 119