USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=32 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 103 THR OG1 : rot -110:sc= 1.06 USER MOD Set 1.2: B 105 SER OG : rot 180:sc= 0.962 USER MOD Set 2.1: B 53 ASN : amide:sc= -0.117 K(o=-0.12,f=-0.7) USER MOD Set 2.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 41 HIS : no HD1:sc= -0.0739 K(o=-1.2,f=-0.0058) USER MOD Set 3.2: B 90 GLN : amide:sc= -1.09 K(o=-1.2,f=-0.0058) USER MOD Single : A 1 GLY N :NH3+ 135:sc= 0.0102 (180deg=0) USER MOD Single : A 2 SER OG : rot 37:sc= 0.0463 USER MOD Single : A 3 GLN : amide:sc= -1.87! K(o=-1.9!,f=-0.26) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 21 THR OG1 : rot -92:sc= 1.21 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 -38:sc= 0.194 USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : B 38 GLN : amide:sc= -1 K(o=-1,f=0) USER MOD Single : B 40 SER OG : rot 180:sc= 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 30:sc= -0.0659 USER MOD Single : B 52 LYS NZ :NH3+ 168:sc=-0.00405 (180deg=-0.136) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.46 X(o=-0.46,f=-0.4) USER MOD Single : B 68 ASN : amide:sc= -0.0293 K(o=-0.029,f=-3.9!) USER MOD Single : B 69 SER OG : rot 180:sc= 0 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 -78:sc= 0.612 USER MOD Single : B 84 GLN : amide:sc= -0.547 K(o=-0.55,f=-3.9!) USER MOD Single : B 87 SER OG : rot 41:sc= 0.29 USER MOD Single : B 89 GLN : amide:sc= 0.66 K(o=0.66,f=-2.5!) USER MOD Single : B 91 TYR OH : rot -133:sc= 1.25 USER MOD Single : B 93 HIS : no HD1:sc= -0.404 K(o=-0.4,f=-4.9!) USER MOD Single : B 94 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.83) USER MOD Single : B 97 THR OG1 : rot -152:sc= 1.27 USER MOD Single : B 102 THR OG1 : rot 180:sc=-0.00477 USER MOD Single : B 104 THR OG1 : rot 80:sc= -0.474 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0.00937 USER MOD Single : B 107 SER OG : rot -170:sc= -0.543 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 113 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HE2:sc= 1.27 K(o=1.3,f=-4.1!) USER MOD Single : B 115 HIS : no HD1:sc= -0.0352 X(o=-0.035,f=-0.22) USER MOD Single : B 116 HIS : no HD1:sc=-0.00684 X(o=-0.0068,f=-0.0068) USER MOD Single : B 117 HIS : no HD1:sc= -0.2 X(o=-0.2,f=-0.043) USER MOD Single : B 118 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : B 119 HIS : no HD1:sc= -0.0879 X(o=-0.088,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.616 27.308 12.739 1.00 0.00 N ATOM 2 CA GLY A 1 4.874 26.035 12.875 1.00 0.00 C ATOM 3 C GLY A 1 5.292 25.027 11.825 1.00 0.00 C ATOM 4 O GLY A 1 5.502 25.386 10.667 1.00 0.00 O ATOM 0 H1 GLY A 1 4.955 28.106 12.824 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.334 27.373 13.488 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.081 27.341 11.809 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.045 25.618 13.868 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.804 26.227 12.790 1.00 0.00 H new ATOM 10 N SER A 2 5.423 23.774 12.223 1.00 0.00 N ATOM 11 CA SER A 2 5.833 22.725 11.306 1.00 0.00 C ATOM 12 C SER A 2 4.996 21.468 11.512 1.00 0.00 C ATOM 13 O SER A 2 4.933 20.924 12.617 1.00 0.00 O ATOM 14 CB SER A 2 7.321 22.419 11.499 1.00 0.00 C ATOM 15 OG SER A 2 7.640 22.276 12.876 1.00 0.00 O ATOM 0 H SER A 2 5.251 23.458 13.177 1.00 0.00 H new ATOM 0 HA SER A 2 5.673 23.071 10.285 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.579 21.504 10.966 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.919 23.220 11.065 1.00 0.00 H new ATOM 0 HG SER A 2 6.902 21.827 13.338 1.00 0.00 H new ATOM 21 N GLN A 3 4.340 21.017 10.455 1.00 0.00 N ATOM 22 CA GLN A 3 3.535 19.810 10.523 1.00 0.00 C ATOM 23 C GLN A 3 4.414 18.589 10.301 1.00 0.00 C ATOM 24 O GLN A 3 4.575 18.122 9.172 1.00 0.00 O ATOM 25 CB GLN A 3 2.398 19.831 9.492 1.00 0.00 C ATOM 26 CG GLN A 3 1.300 20.847 9.786 1.00 0.00 C ATOM 27 CD GLN A 3 1.690 22.280 9.466 1.00 0.00 C ATOM 28 OE1 GLN A 3 1.236 23.216 10.121 1.00 0.00 O ATOM 29 NE2 GLN A 3 2.515 22.467 8.448 1.00 0.00 N ATOM 0 H GLN A 3 4.350 21.469 9.541 1.00 0.00 H new ATOM 0 HA GLN A 3 3.086 19.762 11.515 1.00 0.00 H new ATOM 0 HB2 GLN A 3 2.819 20.043 8.509 1.00 0.00 H new ATOM 0 HB3 GLN A 3 1.953 18.838 9.440 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.412 20.585 9.211 1.00 0.00 H new ATOM 0 HG3 GLN A 3 1.029 20.781 10.840 1.00 0.00 H new ATOM 0 HE21 GLN A 3 2.872 21.666 7.927 1.00 0.00 H new ATOM 0 HE22 GLN A 3 2.794 23.412 8.184 1.00 0.00 H new ATOM 38 N THR A 4 5.000 18.093 11.382 1.00 0.00 N ATOM 39 CA THR A 4 5.826 16.901 11.324 1.00 0.00 C ATOM 40 C THR A 4 4.983 15.708 10.884 1.00 0.00 C ATOM 41 O THR A 4 5.428 14.869 10.097 1.00 0.00 O ATOM 42 CB THR A 4 6.471 16.613 12.692 1.00 0.00 C ATOM 43 OG1 THR A 4 7.127 17.796 13.168 1.00 0.00 O ATOM 44 CG2 THR A 4 7.478 15.478 12.596 1.00 0.00 C ATOM 0 H THR A 4 4.916 18.502 12.313 1.00 0.00 H new ATOM 0 HA THR A 4 6.622 17.068 10.599 1.00 0.00 H new ATOM 0 HB THR A 4 5.685 16.315 13.387 1.00 0.00 H new ATOM 0 HG1 THR A 4 7.537 17.615 14.040 1.00 0.00 H new ATOM 0 HG21 THR A 4 7.917 15.297 13.577 1.00 0.00 H new ATOM 0 HG22 THR A 4 6.976 14.574 12.251 1.00 0.00 H new ATOM 0 HG23 THR A 4 8.264 15.748 11.891 1.00 0.00 H new ATOM 52 N THR A 5 3.757 15.652 11.379 1.00 0.00 N ATOM 53 CA THR A 5 2.820 14.636 10.949 1.00 0.00 C ATOM 54 C THR A 5 1.728 15.270 10.090 1.00 0.00 C ATOM 55 O THR A 5 1.244 16.369 10.383 1.00 0.00 O ATOM 56 CB THR A 5 2.199 13.877 12.147 1.00 0.00 C ATOM 57 OG1 THR A 5 1.376 12.801 11.679 1.00 0.00 O ATOM 58 CG2 THR A 5 1.375 14.800 13.033 1.00 0.00 C ATOM 0 H THR A 5 3.391 16.299 12.078 1.00 0.00 H new ATOM 0 HA THR A 5 3.367 13.904 10.355 1.00 0.00 H new ATOM 0 HB THR A 5 3.021 13.479 12.743 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.990 12.327 12.445 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.956 14.230 13.862 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.012 15.594 13.423 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.566 15.238 12.449 1.00 0.00 H new ATOM 66 N ALA A 6 1.370 14.588 9.016 1.00 0.00 N ATOM 67 CA ALA A 6 0.378 15.083 8.078 1.00 0.00 C ATOM 68 C ALA A 6 -0.251 13.915 7.335 1.00 0.00 C ATOM 69 O ALA A 6 0.399 12.890 7.139 1.00 0.00 O ATOM 70 CB ALA A 6 1.027 16.051 7.096 1.00 0.00 C ATOM 0 H ALA A 6 1.758 13.677 8.770 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.401 15.614 8.624 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.276 16.417 6.396 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.454 16.892 7.643 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.815 15.537 6.546 1.00 0.00 H new ATOM 76 N PRO A 7 -1.525 14.044 6.927 1.00 0.00 N ATOM 77 CA PRO A 7 -2.225 13.002 6.165 1.00 0.00 C ATOM 78 C PRO A 7 -1.712 12.888 4.729 1.00 0.00 C ATOM 79 O PRO A 7 -2.459 13.085 3.770 1.00 0.00 O ATOM 80 CB PRO A 7 -3.682 13.469 6.182 1.00 0.00 C ATOM 81 CG PRO A 7 -3.604 14.948 6.343 1.00 0.00 C ATOM 82 CD PRO A 7 -2.390 15.209 7.191 1.00 0.00 C ATOM 0 HA PRO A 7 -2.077 12.012 6.596 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -4.195 13.198 5.260 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -4.235 13.010 7.001 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -3.517 15.442 5.375 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -4.504 15.337 6.820 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -1.901 16.143 6.914 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -2.648 15.286 8.247 1.00 0.00 H new ATOM 90 N ASP A 8 -0.428 12.589 4.596 1.00 0.00 N ATOM 91 CA ASP A 8 0.197 12.412 3.291 1.00 0.00 C ATOM 92 C ASP A 8 0.338 10.925 2.990 1.00 0.00 C ATOM 93 O ASP A 8 0.294 10.498 1.837 1.00 0.00 O ATOM 94 CB ASP A 8 1.571 13.091 3.271 1.00 0.00 C ATOM 95 CG ASP A 8 2.154 13.217 1.874 1.00 0.00 C ATOM 96 OD1 ASP A 8 1.689 14.088 1.107 1.00 0.00 O ATOM 97 OD2 ASP A 8 3.113 12.487 1.547 1.00 0.00 O ATOM 0 H ASP A 8 0.208 12.463 5.384 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.429 12.872 2.526 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.485 14.084 3.713 1.00 0.00 H new ATOM 0 HB3 ASP A 8 2.260 12.522 3.896 1.00 0.00 H new ATOM 102 N ALA A 9 0.500 10.142 4.050 1.00 0.00 N ATOM 103 CA ALA A 9 0.589 8.696 3.940 1.00 0.00 C ATOM 104 C ALA A 9 -0.733 8.049 4.325 1.00 0.00 C ATOM 105 O ALA A 9 -1.313 8.386 5.359 1.00 0.00 O ATOM 106 CB ALA A 9 1.698 8.166 4.832 1.00 0.00 C ATOM 0 H ALA A 9 0.573 10.492 5.005 1.00 0.00 H new ATOM 0 HA ALA A 9 0.815 8.446 2.903 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.753 7.081 4.739 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.649 8.605 4.530 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.489 8.431 5.868 1.00 0.00 H new ATOM 112 N PRO A 10 -1.237 7.125 3.494 1.00 0.00 N ATOM 113 CA PRO A 10 -2.454 6.371 3.797 1.00 0.00 C ATOM 114 C PRO A 10 -2.283 5.498 5.038 1.00 0.00 C ATOM 115 O PRO A 10 -1.302 4.759 5.150 1.00 0.00 O ATOM 116 CB PRO A 10 -2.657 5.484 2.559 1.00 0.00 C ATOM 117 CG PRO A 10 -1.827 6.102 1.489 1.00 0.00 C ATOM 118 CD PRO A 10 -0.668 6.748 2.190 1.00 0.00 C ATOM 0 HA PRO A 10 -3.297 7.030 4.005 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.345 4.458 2.755 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.707 5.448 2.270 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.484 5.351 0.778 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.401 6.837 0.925 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.171 6.061 2.299 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.300 7.617 1.644 1.00 0.00 H new ATOM 126 N PRO A 11 -3.210 5.610 6.005 1.00 0.00 N ATOM 127 CA PRO A 11 -3.248 4.726 7.177 1.00 0.00 C ATOM 128 C PRO A 11 -3.296 3.254 6.775 1.00 0.00 C ATOM 129 O PRO A 11 -3.621 2.925 5.630 1.00 0.00 O ATOM 130 CB PRO A 11 -4.545 5.123 7.884 1.00 0.00 C ATOM 131 CG PRO A 11 -4.812 6.519 7.445 1.00 0.00 C ATOM 132 CD PRO A 11 -4.276 6.626 6.046 1.00 0.00 C ATOM 0 HA PRO A 11 -2.360 4.833 7.800 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.364 4.459 7.608 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.438 5.064 8.967 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.879 6.738 7.471 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.323 7.235 8.105 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.049 6.426 5.304 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.887 7.623 5.841 1.00 0.00 H new ATOM 140 N ASP A 12 -2.979 2.380 7.726 1.00 0.00 N ATOM 141 CA ASP A 12 -2.915 0.943 7.474 1.00 0.00 C ATOM 142 C ASP A 12 -4.225 0.427 6.879 1.00 0.00 C ATOM 143 O ASP A 12 -5.297 0.590 7.463 1.00 0.00 O ATOM 144 CB ASP A 12 -2.562 0.172 8.758 1.00 0.00 C ATOM 145 CG ASP A 12 -3.574 0.345 9.876 1.00 0.00 C ATOM 146 OD1 ASP A 12 -3.590 1.426 10.510 1.00 0.00 O ATOM 147 OD2 ASP A 12 -4.335 -0.610 10.147 1.00 0.00 O ATOM 0 H ASP A 12 -2.761 2.645 8.687 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.123 0.771 6.745 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -2.474 -0.888 8.521 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -1.585 0.502 9.111 1.00 0.00 H new ATOM 152 N PRO A 13 -4.152 -0.161 5.673 1.00 0.00 N ATOM 153 CA PRO A 13 -5.322 -0.701 4.977 1.00 0.00 C ATOM 154 C PRO A 13 -5.931 -1.896 5.703 1.00 0.00 C ATOM 155 O PRO A 13 -5.227 -2.663 6.361 1.00 0.00 O ATOM 156 CB PRO A 13 -4.774 -1.141 3.614 1.00 0.00 C ATOM 157 CG PRO A 13 -3.448 -0.475 3.484 1.00 0.00 C ATOM 158 CD PRO A 13 -2.924 -0.327 4.880 1.00 0.00 C ATOM 0 HA PRO A 13 -6.120 0.039 4.911 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -4.675 -2.225 3.562 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -5.444 -0.843 2.807 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -2.770 -1.071 2.873 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -3.545 0.496 2.998 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.355 -1.202 5.194 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.262 0.534 4.974 1.00 0.00 H new ATOM 166 N THR A 14 -7.239 -2.048 5.574 1.00 0.00 N ATOM 167 CA THR A 14 -7.949 -3.142 6.207 1.00 0.00 C ATOM 168 C THR A 14 -8.220 -4.268 5.214 1.00 0.00 C ATOM 169 O THR A 14 -8.676 -4.031 4.093 1.00 0.00 O ATOM 170 CB THR A 14 -9.274 -2.657 6.821 1.00 0.00 C ATOM 171 OG1 THR A 14 -9.924 -1.737 5.931 1.00 0.00 O ATOM 172 CG2 THR A 14 -9.033 -1.987 8.165 1.00 0.00 C ATOM 0 H THR A 14 -7.833 -1.421 5.031 1.00 0.00 H new ATOM 0 HA THR A 14 -7.313 -3.526 7.005 1.00 0.00 H new ATOM 0 HB THR A 14 -9.916 -3.525 6.974 1.00 0.00 H new ATOM 0 HG1 THR A 14 -10.767 -1.436 6.330 1.00 0.00 H new ATOM 0 HG21 THR A 14 -9.984 -1.652 8.580 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.569 -2.698 8.848 1.00 0.00 H new ATOM 0 HG23 THR A 14 -8.373 -1.130 8.031 1.00 0.00 H new ATOM 180 N VAL A 15 -7.909 -5.486 5.629 1.00 0.00 N ATOM 181 CA VAL A 15 -8.128 -6.666 4.809 1.00 0.00 C ATOM 182 C VAL A 15 -9.468 -7.311 5.148 1.00 0.00 C ATOM 183 O VAL A 15 -9.716 -7.675 6.297 1.00 0.00 O ATOM 184 CB VAL A 15 -6.989 -7.691 5.014 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.316 -9.023 4.359 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.678 -7.141 4.471 1.00 0.00 C ATOM 0 H VAL A 15 -7.499 -5.684 6.542 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.138 -6.354 3.765 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.884 -7.863 6.085 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.494 -9.720 4.522 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.229 -9.429 4.796 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.460 -8.876 3.289 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.885 -7.874 4.622 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.783 -6.935 3.406 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.425 -6.219 4.995 1.00 0.00 H new ATOM 196 N ASP A 16 -10.339 -7.429 4.153 1.00 0.00 N ATOM 197 CA ASP A 16 -11.642 -8.056 4.357 1.00 0.00 C ATOM 198 C ASP A 16 -11.626 -9.515 3.924 1.00 0.00 C ATOM 199 O ASP A 16 -10.612 -10.027 3.452 1.00 0.00 O ATOM 200 CB ASP A 16 -12.743 -7.330 3.588 1.00 0.00 C ATOM 201 CG ASP A 16 -12.957 -5.905 4.046 1.00 0.00 C ATOM 202 OD1 ASP A 16 -12.825 -5.628 5.257 1.00 0.00 O ATOM 203 OD2 ASP A 16 -13.295 -5.058 3.200 1.00 0.00 O ATOM 0 H ASP A 16 -10.170 -7.101 3.202 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.851 -7.994 5.425 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.494 -7.329 2.527 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.676 -7.883 3.696 1.00 0.00 H new ATOM 208 N GLN A 17 -12.770 -10.169 4.074 1.00 0.00 N ATOM 209 CA GLN A 17 -12.902 -11.587 3.767 1.00 0.00 C ATOM 210 C GLN A 17 -14.119 -11.834 2.881 1.00 0.00 C ATOM 211 O GLN A 17 -15.136 -12.370 3.325 1.00 0.00 O ATOM 212 CB GLN A 17 -13.010 -12.384 5.066 1.00 0.00 C ATOM 213 CG GLN A 17 -14.012 -11.800 6.046 1.00 0.00 C ATOM 214 CD GLN A 17 -13.899 -12.393 7.430 1.00 0.00 C ATOM 215 OE1 GLN A 17 -13.555 -13.563 7.603 1.00 0.00 O ATOM 216 NE2 GLN A 17 -14.173 -11.574 8.427 1.00 0.00 N ATOM 0 H GLN A 17 -13.629 -9.734 4.410 1.00 0.00 H new ATOM 0 HA GLN A 17 -12.018 -11.916 3.221 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.296 -13.410 4.832 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -12.030 -12.426 5.541 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -13.867 -10.721 6.106 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.021 -11.965 5.667 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -14.454 -10.613 8.235 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -14.104 -11.902 9.390 1.00 0.00 H new ATOM 225 N VAL A 18 -14.016 -11.430 1.628 1.00 0.00 N ATOM 226 CA VAL A 18 -15.110 -11.607 0.687 1.00 0.00 C ATOM 227 C VAL A 18 -15.118 -13.029 0.142 1.00 0.00 C ATOM 228 O VAL A 18 -16.128 -13.726 0.215 1.00 0.00 O ATOM 229 CB VAL A 18 -15.024 -10.597 -0.475 1.00 0.00 C ATOM 230 CG1 VAL A 18 -16.139 -10.830 -1.486 1.00 0.00 C ATOM 231 CG2 VAL A 18 -15.080 -9.177 0.063 1.00 0.00 C ATOM 0 H VAL A 18 -13.189 -10.978 1.238 1.00 0.00 H new ATOM 0 HA VAL A 18 -16.040 -11.425 1.225 1.00 0.00 H new ATOM 0 HB VAL A 18 -14.073 -10.743 -0.987 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -16.054 -10.104 -2.295 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -16.056 -11.838 -1.893 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -17.105 -10.715 -0.995 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -15.019 -8.471 -0.765 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -16.018 -9.027 0.598 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -14.244 -9.012 0.743 1.00 0.00 H new ATOM 241 N ASP A 19 -13.979 -13.466 -0.372 1.00 0.00 N ATOM 242 CA ASP A 19 -13.863 -14.810 -0.918 1.00 0.00 C ATOM 243 C ASP A 19 -13.052 -15.677 0.036 1.00 0.00 C ATOM 244 O ASP A 19 -12.694 -15.225 1.124 1.00 0.00 O ATOM 245 CB ASP A 19 -13.194 -14.770 -2.293 1.00 0.00 C ATOM 246 CG ASP A 19 -13.594 -15.933 -3.172 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.491 -15.760 -4.022 1.00 0.00 O ATOM 248 OD2 ASP A 19 -13.015 -17.022 -3.022 1.00 0.00 O ATOM 0 H ASP A 19 -13.124 -12.912 -0.423 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.860 -15.236 -1.033 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.455 -13.837 -2.792 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.111 -14.772 -2.166 1.00 0.00 H new ATOM 253 N ASP A 20 -12.748 -16.903 -0.356 1.00 0.00 N ATOM 254 CA ASP A 20 -11.983 -17.793 0.508 1.00 0.00 C ATOM 255 C ASP A 20 -10.494 -17.490 0.380 1.00 0.00 C ATOM 256 O ASP A 20 -9.757 -17.508 1.369 1.00 0.00 O ATOM 257 CB ASP A 20 -12.272 -19.276 0.206 1.00 0.00 C ATOM 258 CG ASP A 20 -11.865 -19.718 -1.189 1.00 0.00 C ATOM 259 OD1 ASP A 20 -10.665 -19.983 -1.411 1.00 0.00 O ATOM 260 OD2 ASP A 20 -12.746 -19.830 -2.063 1.00 0.00 O ATOM 0 H ASP A 20 -13.014 -17.303 -1.256 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.294 -17.613 1.537 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.749 -19.893 0.937 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.338 -19.461 0.337 1.00 0.00 H new ATOM 265 N THR A 21 -10.066 -17.174 -0.835 1.00 0.00 N ATOM 266 CA THR A 21 -8.668 -16.872 -1.102 1.00 0.00 C ATOM 267 C THR A 21 -8.507 -15.519 -1.789 1.00 0.00 C ATOM 268 O THR A 21 -7.497 -15.255 -2.439 1.00 0.00 O ATOM 269 CB THR A 21 -8.025 -17.971 -1.967 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.993 -18.488 -2.891 1.00 0.00 O ATOM 271 CG2 THR A 21 -7.485 -19.099 -1.101 1.00 0.00 C ATOM 0 H THR A 21 -10.671 -17.120 -1.654 1.00 0.00 H new ATOM 0 HA THR A 21 -8.159 -16.831 -0.139 1.00 0.00 H new ATOM 0 HB THR A 21 -7.192 -17.533 -2.517 1.00 0.00 H new ATOM 0 HG1 THR A 21 -9.441 -19.265 -2.495 1.00 0.00 H new ATOM 0 HG21 THR A 21 -7.036 -19.862 -1.736 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.731 -18.705 -0.419 1.00 0.00 H new ATOM 0 HG23 THR A 21 -8.300 -19.539 -0.526 1.00 0.00 H new ATOM 279 N SER A 22 -9.503 -14.662 -1.632 1.00 0.00 N ATOM 280 CA SER A 22 -9.463 -13.331 -2.215 1.00 0.00 C ATOM 281 C SER A 22 -9.998 -12.315 -1.214 1.00 0.00 C ATOM 282 O SER A 22 -11.056 -12.520 -0.609 1.00 0.00 O ATOM 283 CB SER A 22 -10.272 -13.277 -3.514 1.00 0.00 C ATOM 284 OG SER A 22 -9.885 -14.310 -4.408 1.00 0.00 O ATOM 0 H SER A 22 -10.352 -14.865 -1.104 1.00 0.00 H new ATOM 0 HA SER A 22 -8.428 -13.087 -2.455 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.334 -13.369 -3.287 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.131 -12.308 -3.992 1.00 0.00 H new ATOM 0 HG SER A 22 -10.420 -14.251 -5.227 1.00 0.00 H new ATOM 290 N ILE A 23 -9.269 -11.228 -1.046 1.00 0.00 N ATOM 291 CA ILE A 23 -9.620 -10.216 -0.061 1.00 0.00 C ATOM 292 C ILE A 23 -9.954 -8.903 -0.744 1.00 0.00 C ATOM 293 O ILE A 23 -9.698 -8.730 -1.933 1.00 0.00 O ATOM 294 CB ILE A 23 -8.455 -9.933 0.912 1.00 0.00 C ATOM 295 CG1 ILE A 23 -7.338 -9.179 0.176 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.928 -11.231 1.510 1.00 0.00 C ATOM 297 CD1 ILE A 23 -6.403 -8.406 1.077 1.00 0.00 C ATOM 0 H ILE A 23 -8.426 -11.020 -1.581 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.477 -10.606 0.488 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.819 -9.312 1.730 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.755 -9.895 -0.403 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.791 -8.488 -0.535 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -7.108 -11.010 2.193 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.728 -11.732 2.054 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.570 -11.881 0.711 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.647 -7.905 0.473 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.970 -7.663 1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.917 -9.092 1.771 1.00 0.00 H new ATOM 309 N VAL A 24 -10.513 -7.984 0.017 1.00 0.00 N ATOM 310 CA VAL A 24 -10.643 -6.612 -0.428 1.00 0.00 C ATOM 311 C VAL A 24 -9.878 -5.720 0.533 1.00 0.00 C ATOM 312 O VAL A 24 -10.285 -5.528 1.678 1.00 0.00 O ATOM 313 CB VAL A 24 -12.116 -6.154 -0.519 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.202 -4.689 -0.925 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.881 -7.020 -1.507 1.00 0.00 C ATOM 0 H VAL A 24 -10.886 -8.164 0.949 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.232 -6.540 -1.435 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.568 -6.264 0.467 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.248 -4.388 -0.983 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.688 -4.076 -0.185 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.731 -4.553 -1.899 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.917 -6.684 -1.559 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.423 -6.939 -2.493 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.853 -8.059 -1.178 1.00 0.00 H new ATOM 325 N VAL A 25 -8.742 -5.224 0.074 1.00 0.00 N ATOM 326 CA VAL A 25 -7.894 -4.378 0.891 1.00 0.00 C ATOM 327 C VAL A 25 -8.293 -2.917 0.705 1.00 0.00 C ATOM 328 O VAL A 25 -8.222 -2.372 -0.398 1.00 0.00 O ATOM 329 CB VAL A 25 -6.391 -4.601 0.565 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.134 -4.560 -0.931 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.512 -3.590 1.281 1.00 0.00 C ATOM 0 H VAL A 25 -8.385 -5.395 -0.866 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.035 -4.648 1.938 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.130 -5.596 0.927 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.073 -4.720 -1.122 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.713 -5.343 -1.421 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.432 -3.588 -1.325 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.467 -3.775 1.031 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.787 -2.583 0.969 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.650 -3.686 2.358 1.00 0.00 H new ATOM 341 N ARG A 26 -8.765 -2.310 1.785 1.00 0.00 N ATOM 342 CA ARG A 26 -9.263 -0.944 1.746 1.00 0.00 C ATOM 343 C ARG A 26 -8.330 -0.003 2.490 1.00 0.00 C ATOM 344 O ARG A 26 -8.019 -0.222 3.659 1.00 0.00 O ATOM 345 CB ARG A 26 -10.656 -0.876 2.364 1.00 0.00 C ATOM 346 CG ARG A 26 -11.707 -1.646 1.586 1.00 0.00 C ATOM 347 CD ARG A 26 -13.030 -1.678 2.326 1.00 0.00 C ATOM 348 NE ARG A 26 -12.959 -2.506 3.524 1.00 0.00 N ATOM 349 CZ ARG A 26 -13.141 -2.060 4.763 1.00 0.00 C ATOM 350 NH1 ARG A 26 -13.429 -0.783 4.981 1.00 0.00 N ATOM 351 NH2 ARG A 26 -13.042 -2.901 5.786 1.00 0.00 N ATOM 0 H ARG A 26 -8.813 -2.747 2.705 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.312 -0.632 0.703 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.612 -1.265 3.381 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.962 0.168 2.435 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.847 -1.187 0.607 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.360 -2.665 1.413 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.317 -0.663 2.602 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.807 -2.061 1.665 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.755 -3.498 3.403 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.512 -0.138 4.196 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.568 -0.447 5.934 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -12.827 -3.884 5.619 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -13.181 -2.564 6.739 1.00 0.00 H new ATOM 365 N TRP A 27 -7.901 1.047 1.813 1.00 0.00 N ATOM 366 CA TRP A 27 -6.997 2.022 2.403 1.00 0.00 C ATOM 367 C TRP A 27 -7.644 3.400 2.427 1.00 0.00 C ATOM 368 O TRP A 27 -8.497 3.707 1.593 1.00 0.00 O ATOM 369 CB TRP A 27 -5.677 2.072 1.622 1.00 0.00 C ATOM 370 CG TRP A 27 -5.852 2.280 0.144 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.080 3.463 -0.502 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.801 1.273 -0.875 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.186 3.250 -1.854 1.00 0.00 N ATOM 374 CE2 TRP A 27 -6.015 1.915 -2.108 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.598 -0.110 -0.863 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -6.031 1.224 -3.315 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.613 -0.795 -2.062 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.828 -0.128 -3.273 1.00 0.00 C ATOM 0 H TRP A 27 -8.165 1.248 0.849 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.785 1.717 3.428 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.060 2.877 2.022 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.133 1.142 1.786 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.164 4.425 -0.019 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.363 3.969 -2.555 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.432 -0.633 0.067 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -6.198 1.736 -4.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.456 -1.864 -2.065 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.834 -0.692 -4.194 1.00 0.00 H new ATOM 389 N SER A 28 -7.258 4.216 3.390 1.00 0.00 N ATOM 390 CA SER A 28 -7.710 5.594 3.434 1.00 0.00 C ATOM 391 C SER A 28 -6.661 6.502 2.808 1.00 0.00 C ATOM 392 O SER A 28 -5.569 6.662 3.343 1.00 0.00 O ATOM 393 CB SER A 28 -7.999 6.019 4.873 1.00 0.00 C ATOM 394 OG SER A 28 -9.066 5.259 5.422 1.00 0.00 O ATOM 0 H SER A 28 -6.634 3.949 4.151 1.00 0.00 H new ATOM 0 HA SER A 28 -8.635 5.680 2.864 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.104 5.889 5.481 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.251 7.079 4.900 1.00 0.00 H new ATOM 0 HG SER A 28 -9.232 5.547 6.344 1.00 0.00 H new ATOM 400 N ARG A 29 -6.989 7.078 1.667 1.00 0.00 N ATOM 401 CA ARG A 29 -6.052 7.931 0.958 1.00 0.00 C ATOM 402 C ARG A 29 -6.154 9.368 1.455 1.00 0.00 C ATOM 403 O ARG A 29 -7.199 9.770 1.967 1.00 0.00 O ATOM 404 CB ARG A 29 -6.272 7.820 -0.561 1.00 0.00 C ATOM 405 CG ARG A 29 -7.646 8.252 -1.053 1.00 0.00 C ATOM 406 CD ARG A 29 -7.758 9.761 -1.119 1.00 0.00 C ATOM 407 NE ARG A 29 -9.036 10.196 -1.686 1.00 0.00 N ATOM 408 CZ ARG A 29 -9.373 11.471 -1.887 1.00 0.00 C ATOM 409 NH1 ARG A 29 -8.565 12.454 -1.511 1.00 0.00 N ATOM 410 NH2 ARG A 29 -10.536 11.765 -2.454 1.00 0.00 N ATOM 0 H ARG A 29 -7.895 6.972 1.211 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.036 7.594 1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.517 8.423 -1.066 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.106 6.785 -0.861 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.831 7.828 -2.040 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -8.414 7.857 -0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.647 10.176 -0.117 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -6.941 10.158 -1.721 1.00 0.00 H new ATOM 0 HE ARG A 29 -9.712 9.478 -1.944 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -7.674 12.239 -1.063 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -8.834 13.425 -1.670 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -11.170 11.017 -2.735 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -10.796 12.739 -2.609 1.00 0.00 H new ATOM 424 N PRO A 30 -5.050 10.132 1.355 1.00 0.00 N ATOM 425 CA PRO A 30 -5.015 11.560 1.698 1.00 0.00 C ATOM 426 C PRO A 30 -6.239 12.325 1.202 1.00 0.00 C ATOM 427 O PRO A 30 -7.049 12.770 2.050 1.00 0.00 O ATOM 428 CB PRO A 30 -3.758 12.046 0.982 1.00 0.00 C ATOM 429 CG PRO A 30 -2.845 10.872 0.988 1.00 0.00 C ATOM 430 CD PRO A 30 -3.724 9.648 0.921 1.00 0.00 C ATOM 431 OXT PRO A 30 -6.395 12.466 -0.025 1.00 0.00 O ATOM 0 HA PRO A 30 -5.013 11.720 2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.981 12.370 -0.035 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.313 12.897 1.497 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -2.162 10.907 0.139 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.232 10.861 1.889 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -3.760 9.238 -0.088 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.355 8.856 1.574 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -14.142 29.157 -6.950 1.00 0.00 N ATOM 441 CA MET B 31 -13.203 28.063 -7.291 1.00 0.00 C ATOM 442 C MET B 31 -13.156 27.032 -6.168 1.00 0.00 C ATOM 443 O MET B 31 -12.824 27.353 -5.024 1.00 0.00 O ATOM 444 CB MET B 31 -11.800 28.612 -7.588 1.00 0.00 C ATOM 445 CG MET B 31 -11.250 29.551 -6.526 1.00 0.00 C ATOM 446 SD MET B 31 -9.598 30.152 -6.933 1.00 0.00 S ATOM 447 CE MET B 31 -9.260 31.199 -5.519 1.00 0.00 C ATOM 0 HA MET B 31 -13.566 27.572 -8.194 1.00 0.00 H new ATOM 0 HB2 MET B 31 -11.113 27.774 -7.704 1.00 0.00 H new ATOM 0 HB3 MET B 31 -11.825 29.138 -8.542 1.00 0.00 H new ATOM 0 HG2 MET B 31 -11.924 30.399 -6.410 1.00 0.00 H new ATOM 0 HG3 MET B 31 -11.220 29.034 -5.567 1.00 0.00 H new ATOM 0 HE1 MET B 31 -8.271 31.644 -5.624 1.00 0.00 H new ATOM 0 HE2 MET B 31 -10.009 31.989 -5.464 1.00 0.00 H new ATOM 0 HE3 MET B 31 -9.294 30.602 -4.608 1.00 0.00 H new ATOM 459 N ARG B 32 -13.490 25.794 -6.502 1.00 0.00 N ATOM 460 CA ARG B 32 -13.623 24.736 -5.508 1.00 0.00 C ATOM 461 C ARG B 32 -12.338 23.918 -5.370 1.00 0.00 C ATOM 462 O ARG B 32 -12.211 22.829 -5.934 1.00 0.00 O ATOM 463 CB ARG B 32 -14.805 23.824 -5.864 1.00 0.00 C ATOM 464 CG ARG B 32 -14.767 23.276 -7.283 1.00 0.00 C ATOM 465 CD ARG B 32 -15.940 22.350 -7.553 1.00 0.00 C ATOM 466 NE ARG B 32 -15.983 21.230 -6.614 1.00 0.00 N ATOM 467 CZ ARG B 32 -17.044 20.442 -6.441 1.00 0.00 C ATOM 468 NH1 ARG B 32 -18.133 20.615 -7.182 1.00 0.00 N ATOM 469 NH2 ARG B 32 -17.008 19.468 -5.541 1.00 0.00 N ATOM 0 H ARG B 32 -13.675 25.495 -7.460 1.00 0.00 H new ATOM 0 HA ARG B 32 -13.812 25.208 -4.544 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -14.828 22.988 -5.165 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -15.732 24.380 -5.726 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -14.783 24.102 -7.994 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -13.833 22.737 -7.441 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -16.870 22.915 -7.486 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -15.872 21.967 -8.571 1.00 0.00 H new ATOM 0 HE ARG B 32 -15.150 21.040 -6.057 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -18.159 21.353 -7.886 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -18.943 20.010 -7.047 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -16.168 19.322 -4.981 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -17.820 18.865 -5.409 1.00 0.00 H new ATOM 483 N GLY B 33 -11.390 24.454 -4.611 1.00 0.00 N ATOM 484 CA GLY B 33 -10.145 23.751 -4.358 1.00 0.00 C ATOM 485 C GLY B 33 -9.360 23.484 -5.626 1.00 0.00 C ATOM 486 O GLY B 33 -8.755 22.423 -5.781 1.00 0.00 O ATOM 0 H GLY B 33 -11.461 25.368 -4.164 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -9.533 24.338 -3.673 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -10.360 22.805 -3.862 1.00 0.00 H new ATOM 490 N SER B 34 -9.379 24.443 -6.539 1.00 0.00 N ATOM 491 CA SER B 34 -8.687 24.295 -7.809 1.00 0.00 C ATOM 492 C SER B 34 -7.547 25.305 -7.912 1.00 0.00 C ATOM 493 O SER B 34 -6.756 25.273 -8.856 1.00 0.00 O ATOM 494 CB SER B 34 -9.674 24.476 -8.967 1.00 0.00 C ATOM 495 OG SER B 34 -9.084 24.144 -10.216 1.00 0.00 O ATOM 0 H SER B 34 -9.866 25.332 -6.424 1.00 0.00 H new ATOM 0 HA SER B 34 -8.263 23.293 -7.866 1.00 0.00 H new ATOM 0 HB2 SER B 34 -10.550 23.849 -8.800 1.00 0.00 H new ATOM 0 HB3 SER B 34 -10.021 25.509 -8.991 1.00 0.00 H new ATOM 0 HG SER B 34 -8.154 24.452 -10.230 1.00 0.00 H new ATOM 501 N ASN B 35 -7.460 26.193 -6.929 1.00 0.00 N ATOM 502 CA ASN B 35 -6.418 27.211 -6.913 1.00 0.00 C ATOM 503 C ASN B 35 -5.067 26.577 -6.617 1.00 0.00 C ATOM 504 O ASN B 35 -4.176 26.550 -7.464 1.00 0.00 O ATOM 505 CB ASN B 35 -6.727 28.283 -5.865 1.00 0.00 C ATOM 506 CG ASN B 35 -5.670 29.372 -5.815 1.00 0.00 C ATOM 507 OD1 ASN B 35 -5.062 29.720 -6.828 1.00 0.00 O ATOM 508 ND2 ASN B 35 -5.433 29.912 -4.630 1.00 0.00 N ATOM 0 H ASN B 35 -8.098 26.228 -6.134 1.00 0.00 H new ATOM 0 HA ASN B 35 -6.385 27.681 -7.896 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -7.696 28.732 -6.084 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -6.808 27.815 -4.884 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -4.727 30.642 -4.534 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.957 29.598 -3.813 1.00 0.00 H new ATOM 515 N ALA B 36 -4.933 26.049 -5.414 1.00 0.00 N ATOM 516 CA ALA B 36 -3.691 25.442 -4.984 1.00 0.00 C ATOM 517 C ALA B 36 -3.771 23.924 -5.089 1.00 0.00 C ATOM 518 O ALA B 36 -4.760 23.316 -4.671 1.00 0.00 O ATOM 519 CB ALA B 36 -3.372 25.860 -3.560 1.00 0.00 C ATOM 0 H ALA B 36 -5.676 26.030 -4.715 1.00 0.00 H new ATOM 0 HA ALA B 36 -2.890 25.787 -5.638 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -2.436 25.398 -3.246 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -3.275 26.945 -3.512 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -4.175 25.538 -2.898 1.00 0.00 H new ATOM 525 N PRO B 37 -2.739 23.297 -5.668 1.00 0.00 N ATOM 526 CA PRO B 37 -2.663 21.841 -5.785 1.00 0.00 C ATOM 527 C PRO B 37 -2.384 21.173 -4.440 1.00 0.00 C ATOM 528 O PRO B 37 -1.253 20.774 -4.148 1.00 0.00 O ATOM 529 CB PRO B 37 -1.498 21.624 -6.751 1.00 0.00 C ATOM 530 CG PRO B 37 -0.639 22.829 -6.590 1.00 0.00 C ATOM 531 CD PRO B 37 -1.568 23.965 -6.267 1.00 0.00 C ATOM 0 HA PRO B 37 -3.600 21.404 -6.130 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -0.950 20.713 -6.511 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -1.849 21.523 -7.778 1.00 0.00 H new ATOM 0 HG2 PRO B 37 0.090 22.684 -5.793 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.078 23.032 -7.502 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -1.111 24.671 -5.574 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -1.840 24.526 -7.161 1.00 0.00 H new ATOM 539 N GLN B 38 -3.422 21.072 -3.621 1.00 0.00 N ATOM 540 CA GLN B 38 -3.312 20.463 -2.302 1.00 0.00 C ATOM 541 C GLN B 38 -2.866 19.005 -2.403 1.00 0.00 C ATOM 542 O GLN B 38 -3.319 18.264 -3.283 1.00 0.00 O ATOM 543 CB GLN B 38 -4.649 20.564 -1.557 1.00 0.00 C ATOM 544 CG GLN B 38 -5.823 19.949 -2.302 1.00 0.00 C ATOM 545 CD GLN B 38 -7.135 20.080 -1.549 1.00 0.00 C ATOM 546 OE1 GLN B 38 -8.205 20.163 -2.156 1.00 0.00 O ATOM 547 NE2 GLN B 38 -7.069 20.101 -0.225 1.00 0.00 N ATOM 0 H GLN B 38 -4.358 21.407 -3.850 1.00 0.00 H new ATOM 0 HA GLN B 38 -2.553 21.007 -1.740 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -4.551 20.074 -0.588 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -4.866 21.614 -1.363 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -5.920 20.428 -3.276 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -5.618 18.894 -2.485 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -6.165 20.030 0.242 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -7.922 20.188 0.327 1.00 0.00 H new ATOM 556 N PRO B 39 -1.953 18.584 -1.512 1.00 0.00 N ATOM 557 CA PRO B 39 -1.424 17.216 -1.496 1.00 0.00 C ATOM 558 C PRO B 39 -2.434 16.197 -0.970 1.00 0.00 C ATOM 559 O PRO B 39 -2.256 15.611 0.100 1.00 0.00 O ATOM 560 CB PRO B 39 -0.214 17.315 -0.563 1.00 0.00 C ATOM 561 CG PRO B 39 -0.533 18.447 0.349 1.00 0.00 C ATOM 562 CD PRO B 39 -1.349 19.419 -0.459 1.00 0.00 C ATOM 0 HA PRO B 39 -1.178 16.865 -2.498 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -0.065 16.389 -0.008 1.00 0.00 H new ATOM 0 HB3 PRO B 39 0.703 17.503 -1.122 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -1.090 18.101 1.220 1.00 0.00 H new ATOM 0 HG3 PRO B 39 0.378 18.917 0.720 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -2.110 19.906 0.151 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.727 20.208 -0.882 1.00 0.00 H new ATOM 570 N SER B 40 -3.503 16.015 -1.723 1.00 0.00 N ATOM 571 CA SER B 40 -4.489 14.990 -1.436 1.00 0.00 C ATOM 572 C SER B 40 -5.071 14.467 -2.743 1.00 0.00 C ATOM 573 O SER B 40 -6.285 14.314 -2.895 1.00 0.00 O ATOM 574 CB SER B 40 -5.585 15.544 -0.520 1.00 0.00 C ATOM 575 OG SER B 40 -6.061 16.801 -0.979 1.00 0.00 O ATOM 0 H SER B 40 -3.712 16.573 -2.551 1.00 0.00 H new ATOM 0 HA SER B 40 -4.011 14.162 -0.913 1.00 0.00 H new ATOM 0 HB2 SER B 40 -6.412 14.836 -0.472 1.00 0.00 H new ATOM 0 HB3 SER B 40 -5.196 15.649 0.493 1.00 0.00 H new ATOM 0 HG SER B 40 -6.760 17.127 -0.374 1.00 0.00 H new ATOM 581 N HIS B 41 -4.185 14.217 -3.696 1.00 0.00 N ATOM 582 CA HIS B 41 -4.586 13.748 -5.013 1.00 0.00 C ATOM 583 C HIS B 41 -3.565 12.739 -5.526 1.00 0.00 C ATOM 584 O HIS B 41 -2.486 13.106 -6.000 1.00 0.00 O ATOM 585 CB HIS B 41 -4.713 14.930 -5.979 1.00 0.00 C ATOM 586 CG HIS B 41 -5.455 14.615 -7.245 1.00 0.00 C ATOM 587 ND1 HIS B 41 -5.830 15.583 -8.152 1.00 0.00 N ATOM 588 CD2 HIS B 41 -5.890 13.436 -7.757 1.00 0.00 C ATOM 589 CE1 HIS B 41 -6.461 15.017 -9.164 1.00 0.00 C ATOM 590 NE2 HIS B 41 -6.509 13.717 -8.946 1.00 0.00 N ATOM 0 H HIS B 41 -3.178 14.332 -3.580 1.00 0.00 H new ATOM 0 HA HIS B 41 -5.559 13.261 -4.944 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -5.220 15.749 -5.468 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -3.714 15.284 -6.235 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -5.771 12.460 -7.311 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -6.868 15.530 -10.023 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -6.939 13.030 -9.565 1.00 0.00 H new ATOM 599 N ILE B 42 -3.913 11.469 -5.422 1.00 0.00 N ATOM 600 CA ILE B 42 -3.011 10.389 -5.781 1.00 0.00 C ATOM 601 C ILE B 42 -3.215 10.001 -7.241 1.00 0.00 C ATOM 602 O ILE B 42 -4.344 9.934 -7.723 1.00 0.00 O ATOM 603 CB ILE B 42 -3.213 9.145 -4.874 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.947 9.477 -3.396 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.305 8.007 -5.314 1.00 0.00 C ATOM 606 CD1 ILE B 42 -4.051 10.265 -2.720 1.00 0.00 C ATOM 0 H ILE B 42 -4.825 11.158 -5.088 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.992 10.748 -5.635 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.253 8.834 -4.975 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.795 8.546 -2.849 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -2.018 10.043 -3.325 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.462 7.145 -4.666 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.537 7.734 -6.343 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.265 8.326 -5.249 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -3.779 10.454 -1.681 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -4.190 11.214 -3.238 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -4.979 9.694 -2.754 1.00 0.00 H new ATOM 618 N SER B 43 -2.115 9.768 -7.947 1.00 0.00 N ATOM 619 CA SER B 43 -2.164 9.433 -9.361 1.00 0.00 C ATOM 620 C SER B 43 -2.359 7.930 -9.547 1.00 0.00 C ATOM 621 O SER B 43 -3.001 7.492 -10.506 1.00 0.00 O ATOM 622 CB SER B 43 -0.878 9.891 -10.053 1.00 0.00 C ATOM 623 OG SER B 43 -0.962 9.725 -11.456 1.00 0.00 O ATOM 0 H SER B 43 -1.173 9.806 -7.558 1.00 0.00 H new ATOM 0 HA SER B 43 -3.011 9.949 -9.813 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.690 10.939 -9.819 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.032 9.322 -9.667 1.00 0.00 H new ATOM 0 HG SER B 43 -0.128 10.027 -11.872 1.00 0.00 H new ATOM 629 N LYS B 44 -1.801 7.147 -8.630 1.00 0.00 N ATOM 630 CA LYS B 44 -1.933 5.697 -8.673 1.00 0.00 C ATOM 631 C LYS B 44 -1.494 5.080 -7.352 1.00 0.00 C ATOM 632 O LYS B 44 -0.583 5.582 -6.690 1.00 0.00 O ATOM 633 CB LYS B 44 -1.112 5.110 -9.827 1.00 0.00 C ATOM 634 CG LYS B 44 0.350 5.526 -9.817 1.00 0.00 C ATOM 635 CD LYS B 44 1.074 5.023 -11.051 1.00 0.00 C ATOM 636 CE LYS B 44 2.476 5.601 -11.153 1.00 0.00 C ATOM 637 NZ LYS B 44 3.208 5.068 -12.331 1.00 0.00 N ATOM 0 H LYS B 44 -1.251 7.495 -7.845 1.00 0.00 H new ATOM 0 HA LYS B 44 -2.984 5.459 -8.839 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.170 4.022 -9.785 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.560 5.417 -10.772 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.421 6.613 -9.769 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.836 5.135 -8.923 1.00 0.00 H new ATOM 0 HD2 LYS B 44 1.130 3.935 -11.022 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.505 5.289 -11.941 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.417 6.687 -11.223 1.00 0.00 H new ATOM 0 HE3 LYS B 44 3.032 5.369 -10.244 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 4.160 5.486 -12.366 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 3.286 4.034 -12.252 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.691 5.311 -13.200 1.00 0.00 H new ATOM 651 N TYR B 45 -2.159 4.004 -6.970 1.00 0.00 N ATOM 652 CA TYR B 45 -1.821 3.277 -5.759 1.00 0.00 C ATOM 653 C TYR B 45 -1.177 1.954 -6.141 1.00 0.00 C ATOM 654 O TYR B 45 -1.756 1.176 -6.894 1.00 0.00 O ATOM 655 CB TYR B 45 -3.073 3.013 -4.914 1.00 0.00 C ATOM 656 CG TYR B 45 -3.924 4.237 -4.657 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.935 4.594 -5.538 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.723 5.030 -3.534 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.720 5.707 -5.312 1.00 0.00 C ATOM 660 CE2 TYR B 45 -4.506 6.144 -3.300 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.503 6.478 -4.193 1.00 0.00 C ATOM 662 OH TYR B 45 -6.283 7.591 -3.970 1.00 0.00 O ATOM 0 H TYR B 45 -2.945 3.611 -7.488 1.00 0.00 H new ATOM 0 HA TYR B 45 -1.129 3.877 -5.168 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.682 2.261 -5.415 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.768 2.590 -3.957 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.111 3.990 -6.416 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.943 4.772 -2.833 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.501 5.971 -6.010 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -4.338 6.750 -2.422 1.00 0.00 H new ATOM 0 HH TYR B 45 -7.172 7.450 -4.356 1.00 0.00 H new ATOM 672 N ILE B 46 0.022 1.710 -5.653 1.00 0.00 N ATOM 673 CA ILE B 46 0.722 0.477 -5.970 1.00 0.00 C ATOM 674 C ILE B 46 0.602 -0.509 -4.814 1.00 0.00 C ATOM 675 O ILE B 46 1.017 -0.223 -3.691 1.00 0.00 O ATOM 676 CB ILE B 46 2.216 0.729 -6.312 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.366 1.363 -7.703 1.00 0.00 C ATOM 678 CG2 ILE B 46 3.015 -0.564 -6.243 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.876 2.793 -7.799 1.00 0.00 C ATOM 0 H ILE B 46 0.532 2.344 -5.038 1.00 0.00 H new ATOM 0 HA ILE B 46 0.252 0.051 -6.856 1.00 0.00 H new ATOM 0 HB ILE B 46 2.609 1.424 -5.570 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.417 1.333 -7.991 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.820 0.756 -8.425 1.00 0.00 H new ATOM 0 HG21 ILE B 46 4.058 -0.361 -6.487 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.951 -0.978 -5.237 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.609 -1.281 -6.956 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.020 3.160 -8.815 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.816 2.832 -7.546 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.438 3.418 -7.105 1.00 0.00 H new ATOM 691 N LEU B 47 0.006 -1.658 -5.097 1.00 0.00 N ATOM 692 CA LEU B 47 -0.178 -2.702 -4.099 1.00 0.00 C ATOM 693 C LEU B 47 0.810 -3.829 -4.380 1.00 0.00 C ATOM 694 O LEU B 47 0.740 -4.477 -5.423 1.00 0.00 O ATOM 695 CB LEU B 47 -1.625 -3.227 -4.153 1.00 0.00 C ATOM 696 CG LEU B 47 -2.192 -3.866 -2.868 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.331 -5.017 -2.376 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.364 -2.828 -1.770 1.00 0.00 C ATOM 0 H LEU B 47 -0.362 -1.892 -6.019 1.00 0.00 H new ATOM 0 HA LEU B 47 0.004 -2.302 -3.102 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.275 -2.398 -4.433 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.687 -3.965 -4.953 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.172 -4.271 -3.122 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.768 -5.437 -1.470 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.280 -5.788 -3.145 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.326 -4.653 -2.160 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.765 -3.307 -0.877 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.398 -2.379 -1.539 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.053 -2.053 -2.107 1.00 0.00 H new ATOM 710 N ARG B 48 1.745 -4.039 -3.469 1.00 0.00 N ATOM 711 CA ARG B 48 2.720 -5.112 -3.614 1.00 0.00 C ATOM 712 C ARG B 48 2.611 -6.071 -2.443 1.00 0.00 C ATOM 713 O ARG B 48 2.587 -5.638 -1.294 1.00 0.00 O ATOM 714 CB ARG B 48 4.143 -4.550 -3.674 1.00 0.00 C ATOM 715 CG ARG B 48 4.334 -3.460 -4.711 1.00 0.00 C ATOM 716 CD ARG B 48 5.775 -2.977 -4.745 1.00 0.00 C ATOM 717 NE ARG B 48 6.237 -2.536 -3.427 1.00 0.00 N ATOM 718 CZ ARG B 48 7.518 -2.528 -3.053 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.460 -2.912 -3.903 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.859 -2.139 -1.828 1.00 0.00 N ATOM 0 H ARG B 48 1.851 -3.482 -2.621 1.00 0.00 H new ATOM 0 HA ARG B 48 2.509 -5.639 -4.544 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.408 -4.154 -2.693 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.835 -5.365 -3.887 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.051 -3.837 -5.694 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.673 -2.623 -4.488 1.00 0.00 H new ATOM 0 HD2 ARG B 48 6.418 -3.780 -5.105 1.00 0.00 H new ATOM 0 HD3 ARG B 48 5.865 -2.155 -5.455 1.00 0.00 H new ATOM 0 HE ARG B 48 5.539 -2.216 -2.756 1.00 0.00 H new ATOM 0 HH11 ARG B 48 8.206 -3.214 -4.844 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.439 -2.906 -3.616 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.140 -1.844 -1.168 1.00 0.00 H new ATOM 0 HH22 ARG B 48 8.840 -2.135 -1.549 1.00 0.00 H new ATOM 734 N TRP B 49 2.536 -7.362 -2.723 1.00 0.00 N ATOM 735 CA TRP B 49 2.478 -8.351 -1.659 1.00 0.00 C ATOM 736 C TRP B 49 3.432 -9.505 -1.933 1.00 0.00 C ATOM 737 O TRP B 49 3.566 -9.968 -3.067 1.00 0.00 O ATOM 738 CB TRP B 49 1.041 -8.856 -1.440 1.00 0.00 C ATOM 739 CG TRP B 49 0.455 -9.642 -2.579 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.350 -11.001 -2.664 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.124 -9.121 -3.782 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.259 -11.357 -3.841 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.558 -10.221 -4.548 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.317 -7.834 -4.286 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.174 -10.068 -5.787 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.928 -7.682 -5.515 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.351 -8.794 -6.254 1.00 0.00 C ATOM 0 H TRP B 49 2.514 -7.747 -3.667 1.00 0.00 H new ATOM 0 HA TRP B 49 2.798 -7.865 -0.737 1.00 0.00 H new ATOM 0 HB2 TRP B 49 1.025 -9.478 -0.545 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.398 -7.998 -1.244 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.696 -11.696 -1.913 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.457 -12.312 -4.141 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.006 -6.971 -3.724 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.500 -10.924 -6.359 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.082 -6.690 -5.913 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.827 -8.643 -7.212 1.00 0.00 H new ATOM 758 N ARG B 50 4.116 -9.938 -0.890 1.00 0.00 N ATOM 759 CA ARG B 50 5.064 -11.031 -0.989 1.00 0.00 C ATOM 760 C ARG B 50 4.701 -12.127 -0.004 1.00 0.00 C ATOM 761 O ARG B 50 4.583 -11.875 1.197 1.00 0.00 O ATOM 762 CB ARG B 50 6.483 -10.537 -0.698 1.00 0.00 C ATOM 763 CG ARG B 50 7.544 -11.619 -0.822 1.00 0.00 C ATOM 764 CD ARG B 50 8.917 -11.106 -0.421 1.00 0.00 C ATOM 765 NE ARG B 50 8.993 -10.785 1.006 1.00 0.00 N ATOM 766 CZ ARG B 50 10.038 -10.189 1.582 1.00 0.00 C ATOM 767 NH1 ARG B 50 11.075 -9.798 0.850 1.00 0.00 N ATOM 768 NH2 ARG B 50 10.040 -9.973 2.890 1.00 0.00 N ATOM 0 H ARG B 50 4.030 -9.543 0.047 1.00 0.00 H new ATOM 0 HA ARG B 50 5.026 -11.427 -2.004 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.723 -9.725 -1.384 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.515 -10.123 0.310 1.00 0.00 H new ATOM 0 HG2 ARG B 50 7.274 -12.467 -0.193 1.00 0.00 H new ATOM 0 HG3 ARG B 50 7.576 -11.981 -1.849 1.00 0.00 H new ATOM 0 HD2 ARG B 50 9.669 -11.857 -0.663 1.00 0.00 H new ATOM 0 HD3 ARG B 50 9.155 -10.217 -1.005 1.00 0.00 H new ATOM 0 HE ARG B 50 8.198 -11.032 1.595 1.00 0.00 H new ATOM 0 HH11 ARG B 50 11.075 -9.953 -0.158 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.871 -9.343 1.296 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.242 -10.263 3.456 1.00 0.00 H new ATOM 0 HH22 ARG B 50 10.839 -9.517 3.330 1.00 0.00 H new ATOM 782 N PRO B 51 4.501 -13.353 -0.495 1.00 0.00 N ATOM 783 CA PRO B 51 4.307 -14.513 0.366 1.00 0.00 C ATOM 784 C PRO B 51 5.580 -14.808 1.147 1.00 0.00 C ATOM 785 O PRO B 51 6.679 -14.710 0.606 1.00 0.00 O ATOM 786 CB PRO B 51 4.004 -15.657 -0.612 1.00 0.00 C ATOM 787 CG PRO B 51 3.714 -15.009 -1.925 1.00 0.00 C ATOM 788 CD PRO B 51 4.450 -13.704 -1.923 1.00 0.00 C ATOM 0 HA PRO B 51 3.514 -14.366 1.100 1.00 0.00 H new ATOM 0 HB2 PRO B 51 4.852 -16.337 -0.691 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.153 -16.247 -0.271 1.00 0.00 H new ATOM 0 HG2 PRO B 51 4.043 -15.640 -2.751 1.00 0.00 H new ATOM 0 HG3 PRO B 51 2.643 -14.851 -2.052 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.448 -13.803 -2.350 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.928 -12.946 -2.506 1.00 0.00 H new ATOM 796 N LYS B 52 5.435 -15.159 2.420 1.00 0.00 N ATOM 797 CA LYS B 52 6.586 -15.452 3.270 1.00 0.00 C ATOM 798 C LYS B 52 7.345 -16.678 2.778 1.00 0.00 C ATOM 799 O LYS B 52 8.507 -16.876 3.130 1.00 0.00 O ATOM 800 CB LYS B 52 6.155 -15.645 4.724 1.00 0.00 C ATOM 801 CG LYS B 52 6.264 -14.382 5.563 1.00 0.00 C ATOM 802 CD LYS B 52 7.718 -13.965 5.735 1.00 0.00 C ATOM 803 CE LYS B 52 7.854 -12.730 6.608 1.00 0.00 C ATOM 804 NZ LYS B 52 7.394 -12.971 8.000 1.00 0.00 N ATOM 0 H LYS B 52 4.533 -15.248 2.887 1.00 0.00 H new ATOM 0 HA LYS B 52 7.257 -14.595 3.216 1.00 0.00 H new ATOM 0 HB2 LYS B 52 5.124 -15.997 4.745 1.00 0.00 H new ATOM 0 HB3 LYS B 52 6.768 -16.425 5.175 1.00 0.00 H new ATOM 0 HG2 LYS B 52 5.705 -13.576 5.088 1.00 0.00 H new ATOM 0 HG3 LYS B 52 5.812 -14.550 6.541 1.00 0.00 H new ATOM 0 HD2 LYS B 52 8.281 -14.786 6.178 1.00 0.00 H new ATOM 0 HD3 LYS B 52 8.157 -13.768 4.757 1.00 0.00 H new ATOM 0 HE2 LYS B 52 8.896 -12.411 6.622 1.00 0.00 H new ATOM 0 HE3 LYS B 52 7.276 -11.914 6.173 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 7.689 -12.179 8.605 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.357 -13.050 8.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 7.813 -13.854 8.356 1.00 0.00 H new ATOM 818 N ASN B 53 6.688 -17.493 1.963 1.00 0.00 N ATOM 819 CA ASN B 53 7.339 -18.643 1.345 1.00 0.00 C ATOM 820 C ASN B 53 8.185 -18.203 0.153 1.00 0.00 C ATOM 821 O ASN B 53 8.934 -18.992 -0.415 1.00 0.00 O ATOM 822 CB ASN B 53 6.304 -19.685 0.905 1.00 0.00 C ATOM 823 CG ASN B 53 5.237 -19.108 -0.003 1.00 0.00 C ATOM 824 OD1 ASN B 53 4.210 -18.627 0.467 1.00 0.00 O ATOM 825 ND2 ASN B 53 5.461 -19.161 -1.307 1.00 0.00 N ATOM 0 H ASN B 53 5.705 -17.380 1.714 1.00 0.00 H new ATOM 0 HA ASN B 53 7.993 -19.101 2.088 1.00 0.00 H new ATOM 0 HB2 ASN B 53 6.812 -20.499 0.388 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.830 -20.114 1.788 1.00 0.00 H new ATOM 0 HD21 ASN B 53 4.768 -18.794 -1.959 1.00 0.00 H new ATOM 0 HD22 ASN B 53 6.327 -19.568 -1.660 1.00 0.00 H new ATOM 832 N SER B 54 8.050 -16.937 -0.221 1.00 0.00 N ATOM 833 CA SER B 54 8.848 -16.354 -1.284 1.00 0.00 C ATOM 834 C SER B 54 9.900 -15.430 -0.677 1.00 0.00 C ATOM 835 O SER B 54 9.576 -14.539 0.108 1.00 0.00 O ATOM 836 CB SER B 54 7.945 -15.573 -2.239 1.00 0.00 C ATOM 837 OG SER B 54 6.868 -16.380 -2.686 1.00 0.00 O ATOM 0 H SER B 54 7.386 -16.290 0.204 1.00 0.00 H new ATOM 0 HA SER B 54 9.347 -17.145 -1.844 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.557 -14.687 -1.737 1.00 0.00 H new ATOM 0 HB3 SER B 54 8.525 -15.227 -3.094 1.00 0.00 H new ATOM 0 HG SER B 54 6.301 -15.861 -3.294 1.00 0.00 H new ATOM 843 N VAL B 55 11.158 -15.652 -1.025 1.00 0.00 N ATOM 844 CA VAL B 55 12.248 -14.898 -0.425 1.00 0.00 C ATOM 845 C VAL B 55 12.412 -13.522 -1.064 1.00 0.00 C ATOM 846 O VAL B 55 12.729 -12.553 -0.374 1.00 0.00 O ATOM 847 CB VAL B 55 13.592 -15.661 -0.491 1.00 0.00 C ATOM 848 CG1 VAL B 55 13.519 -16.940 0.325 1.00 0.00 C ATOM 849 CG2 VAL B 55 13.982 -15.969 -1.930 1.00 0.00 C ATOM 0 H VAL B 55 11.449 -16.344 -1.716 1.00 0.00 H new ATOM 0 HA VAL B 55 11.976 -14.766 0.622 1.00 0.00 H new ATOM 0 HB VAL B 55 14.362 -15.018 -0.065 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.473 -17.464 0.267 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.302 -16.696 1.365 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.730 -17.579 -0.070 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.931 -16.506 -1.943 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.211 -16.585 -2.392 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.084 -15.037 -2.487 1.00 0.00 H new ATOM 859 N GLY B 56 12.178 -13.422 -2.368 1.00 0.00 N ATOM 860 CA GLY B 56 12.443 -12.171 -3.051 1.00 0.00 C ATOM 861 C GLY B 56 11.500 -11.884 -4.198 1.00 0.00 C ATOM 862 O GLY B 56 11.801 -11.054 -5.056 1.00 0.00 O ATOM 0 H GLY B 56 11.815 -14.172 -2.956 1.00 0.00 H new ATOM 0 HA2 GLY B 56 12.381 -11.355 -2.331 1.00 0.00 H new ATOM 0 HA3 GLY B 56 13.465 -12.185 -3.429 1.00 0.00 H new ATOM 866 N ARG B 57 10.368 -12.560 -4.233 1.00 0.00 N ATOM 867 CA ARG B 57 9.387 -12.301 -5.277 1.00 0.00 C ATOM 868 C ARG B 57 8.171 -11.565 -4.746 1.00 0.00 C ATOM 869 O ARG B 57 7.379 -12.104 -3.975 1.00 0.00 O ATOM 870 CB ARG B 57 8.933 -13.574 -5.966 1.00 0.00 C ATOM 871 CG ARG B 57 10.004 -14.238 -6.815 1.00 0.00 C ATOM 872 CD ARG B 57 10.421 -13.347 -7.972 1.00 0.00 C ATOM 873 NE ARG B 57 11.369 -14.010 -8.864 1.00 0.00 N ATOM 874 CZ ARG B 57 11.756 -13.510 -10.037 1.00 0.00 C ATOM 875 NH1 ARG B 57 11.269 -12.348 -10.459 1.00 0.00 N ATOM 876 NH2 ARG B 57 12.622 -14.174 -10.788 1.00 0.00 N ATOM 0 H ARG B 57 10.104 -13.283 -3.563 1.00 0.00 H new ATOM 0 HA ARG B 57 9.894 -11.669 -6.006 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.594 -14.282 -5.210 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.074 -13.346 -6.597 1.00 0.00 H new ATOM 0 HG2 ARG B 57 10.872 -14.465 -6.197 1.00 0.00 H new ATOM 0 HG3 ARG B 57 9.630 -15.187 -7.200 1.00 0.00 H new ATOM 0 HD2 ARG B 57 9.537 -13.052 -8.538 1.00 0.00 H new ATOM 0 HD3 ARG B 57 10.870 -12.433 -7.582 1.00 0.00 H new ATOM 0 HE ARG B 57 11.757 -14.907 -8.572 1.00 0.00 H new ATOM 0 HH11 ARG B 57 10.598 -11.838 -9.885 1.00 0.00 H new ATOM 0 HH12 ARG B 57 11.566 -11.966 -11.357 1.00 0.00 H new ATOM 0 HH21 ARG B 57 12.993 -15.069 -10.469 1.00 0.00 H new ATOM 0 HH22 ARG B 57 12.918 -13.791 -11.686 1.00 0.00 H new ATOM 890 N TRP B 58 8.055 -10.327 -5.165 1.00 0.00 N ATOM 891 CA TRP B 58 6.913 -9.489 -4.836 1.00 0.00 C ATOM 892 C TRP B 58 5.889 -9.537 -5.958 1.00 0.00 C ATOM 893 O TRP B 58 6.252 -9.469 -7.134 1.00 0.00 O ATOM 894 CB TRP B 58 7.350 -8.042 -4.590 1.00 0.00 C ATOM 895 CG TRP B 58 8.160 -7.868 -3.343 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.508 -8.031 -3.208 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.668 -7.499 -2.051 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.883 -7.790 -1.910 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.771 -7.461 -1.179 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.397 -7.197 -1.546 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.643 -7.135 0.167 1.00 0.00 C ATOM 902 CZ3 TRP B 58 6.273 -6.874 -0.209 1.00 0.00 C ATOM 903 CH2 TRP B 58 7.390 -6.847 0.634 1.00 0.00 C ATOM 0 H TRP B 58 8.752 -9.864 -5.748 1.00 0.00 H new ATOM 0 HA TRP B 58 6.461 -9.873 -3.921 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.933 -7.696 -5.444 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.465 -7.408 -4.531 1.00 0.00 H new ATOM 0 HD1 TRP B 58 10.181 -8.309 -4.006 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.835 -7.847 -1.548 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.530 -7.216 -2.190 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.503 -7.110 0.820 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 5.298 -6.638 0.193 1.00 0.00 H new ATOM 0 HH2 TRP B 58 7.260 -6.593 1.676 1.00 0.00 H new ATOM 914 N LYS B 59 4.624 -9.664 -5.610 1.00 0.00 N ATOM 915 CA LYS B 59 3.561 -9.585 -6.594 1.00 0.00 C ATOM 916 C LYS B 59 2.991 -8.176 -6.584 1.00 0.00 C ATOM 917 O LYS B 59 2.664 -7.644 -5.524 1.00 0.00 O ATOM 918 CB LYS B 59 2.478 -10.621 -6.299 1.00 0.00 C ATOM 919 CG LYS B 59 3.027 -12.034 -6.170 1.00 0.00 C ATOM 920 CD LYS B 59 1.925 -13.066 -5.994 1.00 0.00 C ATOM 921 CE LYS B 59 1.044 -13.156 -7.228 1.00 0.00 C ATOM 922 NZ LYS B 59 0.093 -14.289 -7.155 1.00 0.00 N ATOM 0 H LYS B 59 4.306 -9.822 -4.654 1.00 0.00 H new ATOM 0 HA LYS B 59 3.958 -9.804 -7.585 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.966 -10.350 -5.376 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.734 -10.597 -7.095 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.611 -12.277 -7.058 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.706 -12.082 -5.319 1.00 0.00 H new ATOM 0 HD2 LYS B 59 2.367 -14.041 -5.790 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.316 -12.805 -5.129 1.00 0.00 H new ATOM 0 HE2 LYS B 59 0.489 -12.225 -7.345 1.00 0.00 H new ATOM 0 HE3 LYS B 59 1.671 -13.267 -8.113 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -0.487 -14.311 -8.018 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 0.621 -15.181 -7.070 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -0.524 -14.172 -6.326 1.00 0.00 H new ATOM 936 N GLU B 60 2.895 -7.565 -7.754 1.00 0.00 N ATOM 937 CA GLU B 60 2.594 -6.143 -7.839 1.00 0.00 C ATOM 938 C GLU B 60 1.336 -5.871 -8.652 1.00 0.00 C ATOM 939 O GLU B 60 1.117 -6.469 -9.706 1.00 0.00 O ATOM 940 CB GLU B 60 3.779 -5.409 -8.465 1.00 0.00 C ATOM 941 CG GLU B 60 5.099 -5.689 -7.766 1.00 0.00 C ATOM 942 CD GLU B 60 6.275 -5.068 -8.480 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.671 -3.943 -8.119 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.813 -5.701 -9.409 1.00 0.00 O ATOM 0 H GLU B 60 3.020 -8.028 -8.654 1.00 0.00 H new ATOM 0 HA GLU B 60 2.416 -5.780 -6.827 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.863 -5.697 -9.513 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.585 -4.337 -8.444 1.00 0.00 H new ATOM 0 HG2 GLU B 60 5.054 -5.307 -6.746 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.248 -6.767 -7.697 1.00 0.00 H new ATOM 951 N ALA B 61 0.517 -4.958 -8.152 1.00 0.00 N ATOM 952 CA ALA B 61 -0.677 -4.520 -8.851 1.00 0.00 C ATOM 953 C ALA B 61 -0.767 -2.999 -8.831 1.00 0.00 C ATOM 954 O ALA B 61 -0.471 -2.367 -7.816 1.00 0.00 O ATOM 955 CB ALA B 61 -1.915 -5.134 -8.216 1.00 0.00 C ATOM 0 H ALA B 61 0.663 -4.502 -7.251 1.00 0.00 H new ATOM 0 HA ALA B 61 -0.620 -4.852 -9.887 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -2.803 -4.797 -8.750 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.850 -6.221 -8.269 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -1.980 -4.825 -7.173 1.00 0.00 H new ATOM 961 N THR B 62 -1.163 -2.414 -9.951 1.00 0.00 N ATOM 962 CA THR B 62 -1.308 -0.970 -10.042 1.00 0.00 C ATOM 963 C THR B 62 -2.781 -0.581 -10.014 1.00 0.00 C ATOM 964 O THR B 62 -3.574 -1.038 -10.841 1.00 0.00 O ATOM 965 CB THR B 62 -0.649 -0.421 -11.321 1.00 0.00 C ATOM 966 OG1 THR B 62 0.719 -0.851 -11.381 1.00 0.00 O ATOM 967 CG2 THR B 62 -0.702 1.101 -11.355 1.00 0.00 C ATOM 0 H THR B 62 -1.390 -2.917 -10.809 1.00 0.00 H new ATOM 0 HA THR B 62 -0.804 -0.532 -9.181 1.00 0.00 H new ATOM 0 HB THR B 62 -1.199 -0.806 -12.180 1.00 0.00 H new ATOM 0 HG1 THR B 62 1.136 -0.502 -12.196 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.230 1.461 -12.269 1.00 0.00 H new ATOM 0 HG22 THR B 62 -1.741 1.430 -11.330 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.173 1.503 -10.491 1.00 0.00 H new ATOM 975 N ILE B 63 -3.143 0.247 -9.050 1.00 0.00 N ATOM 976 CA ILE B 63 -4.521 0.675 -8.876 1.00 0.00 C ATOM 977 C ILE B 63 -4.665 2.151 -9.252 1.00 0.00 C ATOM 978 O ILE B 63 -3.919 2.997 -8.757 1.00 0.00 O ATOM 979 CB ILE B 63 -4.996 0.464 -7.414 1.00 0.00 C ATOM 980 CG1 ILE B 63 -4.997 -1.023 -7.034 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.380 1.053 -7.200 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.643 -1.564 -6.628 1.00 0.00 C ATOM 0 H ILE B 63 -2.494 0.640 -8.368 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.144 0.067 -9.532 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.289 0.984 -6.767 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -5.697 -1.175 -6.213 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.367 -1.602 -7.880 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -6.689 0.891 -6.167 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.356 2.123 -7.408 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.089 0.568 -7.871 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.734 -2.621 -6.376 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -2.942 -1.447 -7.454 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.277 -1.014 -5.761 1.00 0.00 H new ATOM 994 N PRO B 64 -5.608 2.466 -10.162 1.00 0.00 N ATOM 995 CA PRO B 64 -5.889 3.845 -10.591 1.00 0.00 C ATOM 996 C PRO B 64 -6.083 4.799 -9.413 1.00 0.00 C ATOM 997 O PRO B 64 -6.666 4.428 -8.390 1.00 0.00 O ATOM 998 CB PRO B 64 -7.186 3.703 -11.386 1.00 0.00 C ATOM 999 CG PRO B 64 -7.144 2.316 -11.919 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.469 1.492 -10.860 1.00 0.00 C ATOM 0 HA PRO B 64 -5.064 4.272 -11.161 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.059 3.859 -10.753 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.241 4.436 -12.191 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.148 1.945 -12.123 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -6.592 2.274 -12.858 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.193 1.038 -10.183 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -5.886 0.680 -11.294 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.626 6.035 -9.584 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.585 6.990 -8.488 1.00 0.00 C ATOM 1010 C GLY B 65 -6.931 7.602 -8.140 1.00 0.00 C ATOM 1011 O GLY B 65 -7.039 8.815 -7.967 1.00 0.00 O ATOM 0 H GLY B 65 -5.279 6.397 -10.472 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.186 6.493 -7.604 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -4.891 7.790 -8.745 1.00 0.00 H new ATOM 1015 N HIS B 66 -7.952 6.769 -8.026 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.262 7.221 -7.572 1.00 0.00 C ATOM 1017 C HIS B 66 -9.992 6.076 -6.888 1.00 0.00 C ATOM 1018 O HIS B 66 -11.209 6.112 -6.715 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.100 7.788 -8.732 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.660 6.764 -9.680 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -11.987 6.740 -10.058 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -10.068 5.745 -10.342 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -12.182 5.753 -10.910 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -11.033 5.134 -11.100 1.00 0.00 N ATOM 0 H HIS B 66 -7.901 5.773 -8.242 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.115 8.030 -6.856 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -10.927 8.363 -8.314 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.482 8.484 -9.299 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -9.027 5.464 -10.284 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -13.123 5.495 -11.374 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -10.886 4.331 -11.712 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.235 5.060 -6.499 1.00 0.00 N ATOM 1034 CA LEU B 67 -9.802 3.887 -5.857 1.00 0.00 C ATOM 1035 C LEU B 67 -9.219 3.736 -4.456 1.00 0.00 C ATOM 1036 O LEU B 67 -8.075 4.117 -4.211 1.00 0.00 O ATOM 1037 CB LEU B 67 -9.518 2.628 -6.687 1.00 0.00 C ATOM 1038 CG LEU B 67 -9.930 2.701 -8.164 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -9.731 1.357 -8.843 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.374 3.155 -8.304 1.00 0.00 C ATOM 0 H LEU B 67 -8.223 5.026 -6.618 1.00 0.00 H new ATOM 0 HA LEU B 67 -10.882 4.013 -5.785 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.450 2.414 -6.636 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.034 1.786 -6.225 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.292 3.436 -8.654 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.029 1.430 -9.889 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.681 1.071 -8.784 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.340 0.604 -8.344 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.641 3.198 -9.360 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.029 2.449 -7.793 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -11.489 4.144 -7.860 1.00 0.00 H new ATOM 1052 N ASN B 68 -10.004 3.192 -3.541 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.553 3.018 -2.163 1.00 0.00 C ATOM 1054 C ASN B 68 -9.681 1.563 -1.735 1.00 0.00 C ATOM 1055 O ASN B 68 -9.563 1.238 -0.553 1.00 0.00 O ATOM 1056 CB ASN B 68 -10.343 3.920 -1.205 1.00 0.00 C ATOM 1057 CG ASN B 68 -11.819 3.565 -1.115 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -12.429 3.112 -2.086 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -12.408 3.781 0.050 1.00 0.00 N ATOM 0 H ASN B 68 -10.953 2.864 -3.722 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.503 3.306 -2.119 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -9.901 3.856 -0.211 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -10.246 4.956 -1.531 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -13.399 3.571 0.167 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -11.871 4.157 0.831 1.00 0.00 H new ATOM 1066 N SER B 69 -9.918 0.689 -2.700 1.00 0.00 N ATOM 1067 CA SER B 69 -10.071 -0.725 -2.418 1.00 0.00 C ATOM 1068 C SER B 69 -9.614 -1.568 -3.603 1.00 0.00 C ATOM 1069 O SER B 69 -9.827 -1.197 -4.759 1.00 0.00 O ATOM 1070 CB SER B 69 -11.532 -1.028 -2.072 1.00 0.00 C ATOM 1071 OG SER B 69 -12.413 -0.530 -3.067 1.00 0.00 O ATOM 0 H SER B 69 -10.008 0.936 -3.685 1.00 0.00 H new ATOM 0 HA SER B 69 -9.443 -0.982 -1.565 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.668 -2.105 -1.969 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.779 -0.582 -1.109 1.00 0.00 H new ATOM 0 HG SER B 69 -13.338 -0.740 -2.820 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.967 -2.686 -3.311 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.531 -3.610 -4.346 1.00 0.00 C ATOM 1079 C TYR B 70 -8.770 -5.047 -3.900 1.00 0.00 C ATOM 1080 O TYR B 70 -8.616 -5.373 -2.723 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.049 -3.392 -4.673 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.524 -4.302 -5.763 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.621 -5.318 -5.475 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -6.942 -4.152 -7.079 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.148 -6.156 -6.467 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.473 -4.984 -8.076 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.579 -5.984 -7.766 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.114 -6.818 -8.759 1.00 0.00 O ATOM 0 H TYR B 70 -8.732 -2.976 -2.362 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.113 -3.421 -5.248 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.902 -2.355 -4.976 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.460 -3.546 -3.769 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.283 -5.455 -4.458 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.646 -3.371 -7.327 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.446 -6.940 -6.227 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -6.806 -4.851 -9.095 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.516 -6.563 -9.615 1.00 0.00 H new ATOM 1098 N THR B 71 -9.157 -5.897 -4.837 1.00 0.00 N ATOM 1099 CA THR B 71 -9.402 -7.295 -4.539 1.00 0.00 C ATOM 1100 C THR B 71 -8.173 -8.136 -4.868 1.00 0.00 C ATOM 1101 O THR B 71 -7.906 -8.438 -6.034 1.00 0.00 O ATOM 1102 CB THR B 71 -10.616 -7.820 -5.326 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.744 -6.965 -5.099 1.00 0.00 O ATOM 1104 CG2 THR B 71 -10.965 -9.245 -4.918 1.00 0.00 C ATOM 0 H THR B 71 -9.308 -5.640 -5.813 1.00 0.00 H new ATOM 0 HA THR B 71 -9.615 -7.377 -3.473 1.00 0.00 H new ATOM 0 HB THR B 71 -10.359 -7.822 -6.385 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.515 -7.300 -5.602 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.826 -9.587 -5.492 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.115 -9.898 -5.115 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.204 -9.271 -3.855 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.412 -8.491 -3.842 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.242 -9.335 -4.026 1.00 0.00 C ATOM 1114 C ILE B 72 -6.662 -10.795 -4.027 1.00 0.00 C ATOM 1115 O ILE B 72 -7.298 -11.267 -3.084 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.186 -9.129 -2.921 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.871 -7.644 -2.735 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.917 -9.899 -3.261 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.865 -7.377 -1.637 1.00 0.00 C ATOM 0 H ILE B 72 -7.584 -8.208 -2.877 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.794 -9.055 -4.979 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.592 -9.509 -1.984 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.490 -7.241 -3.673 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.794 -7.110 -2.510 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.178 -9.747 -2.475 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.147 -10.961 -3.343 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.517 -9.540 -4.209 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.688 -6.304 -1.559 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.253 -7.751 -0.689 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.929 -7.884 -1.871 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.318 -11.500 -5.088 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.684 -12.897 -5.223 1.00 0.00 C ATOM 1133 C LYS B 73 -5.460 -13.780 -5.014 1.00 0.00 C ATOM 1134 O LYS B 73 -4.334 -13.361 -5.281 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.298 -13.142 -6.603 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.516 -12.274 -6.879 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.033 -12.459 -8.294 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.258 -11.595 -8.550 1.00 0.00 C ATOM 1139 NZ LYS B 73 -10.779 -11.760 -9.933 1.00 0.00 N ATOM 0 H LYS B 73 -5.783 -11.126 -5.872 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.424 -13.150 -4.464 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.544 -12.953 -7.368 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.581 -14.191 -6.687 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.306 -12.520 -6.169 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.259 -11.227 -6.720 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.249 -12.203 -9.007 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.283 -13.507 -8.458 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.039 -11.854 -7.835 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.005 -10.548 -8.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -11.614 -11.153 -10.064 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -10.043 -11.489 -10.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.045 -12.753 -10.087 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.678 -14.985 -4.515 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.582 -15.907 -4.301 1.00 0.00 C ATOM 1155 C GLY B 74 -3.985 -15.785 -2.913 1.00 0.00 C ATOM 1156 O GLY B 74 -2.842 -16.182 -2.683 1.00 0.00 O ATOM 0 H GLY B 74 -6.597 -15.343 -4.253 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.934 -16.927 -4.453 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.806 -15.723 -5.044 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.751 -15.230 -1.984 1.00 0.00 N ATOM 1161 CA LEU B 75 -4.298 -15.111 -0.606 1.00 0.00 C ATOM 1162 C LEU B 75 -4.856 -16.256 0.223 1.00 0.00 C ATOM 1163 O LEU B 75 -6.068 -16.430 0.320 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.719 -13.773 0.009 1.00 0.00 C ATOM 1165 CG LEU B 75 -4.185 -12.520 -0.690 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.390 -11.302 0.191 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.714 -12.677 -1.045 1.00 0.00 C ATOM 0 H LEU B 75 -5.684 -14.857 -2.158 1.00 0.00 H new ATOM 0 HA LEU B 75 -3.209 -15.155 -0.606 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.808 -13.725 0.017 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -4.391 -13.754 1.048 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.742 -12.383 -1.617 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.006 -10.417 -0.317 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.454 -11.173 0.392 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -3.858 -11.440 1.132 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.361 -11.773 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -2.136 -12.842 -0.136 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.590 -13.529 -1.714 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.969 -17.024 0.830 1.00 0.00 N ATOM 1180 CA LYS B 76 -4.367 -18.218 1.555 1.00 0.00 C ATOM 1181 C LYS B 76 -4.376 -17.961 3.054 1.00 0.00 C ATOM 1182 O LYS B 76 -3.355 -17.580 3.626 1.00 0.00 O ATOM 1183 CB LYS B 76 -3.406 -19.364 1.241 1.00 0.00 C ATOM 1184 CG LYS B 76 -3.269 -19.658 -0.241 1.00 0.00 C ATOM 1185 CD LYS B 76 -2.288 -20.788 -0.487 1.00 0.00 C ATOM 1186 CE LYS B 76 -2.101 -21.052 -1.969 1.00 0.00 C ATOM 1187 NZ LYS B 76 -1.210 -22.211 -2.212 1.00 0.00 N ATOM 0 H LYS B 76 -2.965 -16.842 0.835 1.00 0.00 H new ATOM 0 HA LYS B 76 -5.375 -18.489 1.239 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -2.423 -19.124 1.647 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -3.750 -20.264 1.750 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -4.243 -19.922 -0.654 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -2.934 -18.762 -0.763 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -1.327 -20.541 -0.037 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -2.645 -21.694 0.002 1.00 0.00 H new ATOM 0 HE2 LYS B 76 -3.071 -21.236 -2.431 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -1.683 -20.166 -2.447 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -1.106 -22.360 -3.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -0.277 -22.025 -1.793 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -1.621 -23.062 -1.778 1.00 0.00 H new ATOM 1201 N PRO B 77 -5.524 -18.169 3.712 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.624 -18.045 5.163 1.00 0.00 C ATOM 1203 C PRO B 77 -4.768 -19.091 5.865 1.00 0.00 C ATOM 1204 O PRO B 77 -4.988 -20.296 5.716 1.00 0.00 O ATOM 1205 CB PRO B 77 -7.108 -18.287 5.459 1.00 0.00 C ATOM 1206 CG PRO B 77 -7.805 -18.134 4.151 1.00 0.00 C ATOM 1207 CD PRO B 77 -6.809 -18.526 3.099 1.00 0.00 C ATOM 0 HA PRO B 77 -5.272 -17.076 5.517 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.268 -19.282 5.875 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.484 -17.571 6.190 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -8.690 -18.768 4.105 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -8.141 -17.107 4.006 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -6.864 -19.590 2.867 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.975 -17.988 2.166 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.798 -18.625 6.628 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.861 -19.513 7.278 1.00 0.00 C ATOM 1217 C GLY B 78 -1.462 -19.309 6.743 1.00 0.00 C ATOM 1218 O GLY B 78 -0.476 -19.659 7.392 1.00 0.00 O ATOM 0 H GLY B 78 -3.640 -17.634 6.812 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -2.872 -19.336 8.353 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -3.167 -20.548 7.122 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.387 -18.730 5.552 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.117 -18.397 4.931 1.00 0.00 C ATOM 1224 C VAL B 79 0.162 -16.912 5.136 1.00 0.00 C ATOM 1225 O VAL B 79 -0.734 -16.081 4.988 1.00 0.00 O ATOM 1226 CB VAL B 79 -0.128 -18.727 3.420 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.207 -18.408 2.773 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.477 -20.187 3.183 1.00 0.00 C ATOM 0 H VAL B 79 -2.203 -18.480 4.993 1.00 0.00 H new ATOM 0 HA VAL B 79 0.667 -18.993 5.397 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.893 -18.102 2.960 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.164 -18.652 1.711 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.425 -17.347 2.893 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.992 -18.996 3.249 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -0.478 -20.392 2.112 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.261 -20.822 3.673 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.465 -20.396 3.593 1.00 0.00 H new ATOM 1238 N VAL B 80 1.391 -16.581 5.492 1.00 0.00 N ATOM 1239 CA VAL B 80 1.734 -15.205 5.810 1.00 0.00 C ATOM 1240 C VAL B 80 2.129 -14.430 4.556 1.00 0.00 C ATOM 1241 O VAL B 80 2.994 -14.858 3.788 1.00 0.00 O ATOM 1242 CB VAL B 80 2.871 -15.130 6.850 1.00 0.00 C ATOM 1243 CG1 VAL B 80 3.142 -13.687 7.245 1.00 0.00 C ATOM 1244 CG2 VAL B 80 2.534 -15.969 8.074 1.00 0.00 C ATOM 0 H VAL B 80 2.164 -17.242 5.568 1.00 0.00 H new ATOM 0 HA VAL B 80 0.843 -14.747 6.240 1.00 0.00 H new ATOM 0 HB VAL B 80 3.776 -15.535 6.398 1.00 0.00 H new ATOM 0 HG11 VAL B 80 3.947 -13.656 7.979 1.00 0.00 H new ATOM 0 HG12 VAL B 80 3.433 -13.117 6.363 1.00 0.00 H new ATOM 0 HG13 VAL B 80 2.240 -13.252 7.677 1.00 0.00 H new ATOM 0 HG21 VAL B 80 3.348 -15.903 8.796 1.00 0.00 H new ATOM 0 HG22 VAL B 80 1.615 -15.597 8.528 1.00 0.00 H new ATOM 0 HG23 VAL B 80 2.397 -17.008 7.776 1.00 0.00 H new ATOM 1254 N TYR B 81 1.476 -13.295 4.356 1.00 0.00 N ATOM 1255 CA TYR B 81 1.769 -12.416 3.236 1.00 0.00 C ATOM 1256 C TYR B 81 2.166 -11.035 3.739 1.00 0.00 C ATOM 1257 O TYR B 81 1.555 -10.505 4.669 1.00 0.00 O ATOM 1258 CB TYR B 81 0.554 -12.282 2.315 1.00 0.00 C ATOM 1259 CG TYR B 81 0.261 -13.502 1.470 1.00 0.00 C ATOM 1260 CD1 TYR B 81 0.676 -13.560 0.148 1.00 0.00 C ATOM 1261 CD2 TYR B 81 -0.444 -14.585 1.983 1.00 0.00 C ATOM 1262 CE1 TYR B 81 0.400 -14.658 -0.641 1.00 0.00 C ATOM 1263 CE2 TYR B 81 -0.720 -15.692 1.201 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.295 -15.722 -0.111 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.577 -16.814 -0.904 1.00 0.00 O ATOM 0 H TYR B 81 0.730 -12.959 4.965 1.00 0.00 H new ATOM 0 HA TYR B 81 2.595 -12.854 2.675 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.323 -12.060 2.923 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.709 -11.429 1.655 1.00 0.00 H new ATOM 0 HD1 TYR B 81 1.225 -12.730 -0.272 1.00 0.00 H new ATOM 0 HD2 TYR B 81 -0.782 -14.562 3.009 1.00 0.00 H new ATOM 0 HE1 TYR B 81 0.728 -14.683 -1.670 1.00 0.00 H new ATOM 0 HE2 TYR B 81 -1.265 -16.528 1.615 1.00 0.00 H new ATOM 0 HH TYR B 81 -1.330 -16.604 -1.494 1.00 0.00 H new ATOM 1275 N GLU B 82 3.189 -10.463 3.132 1.00 0.00 N ATOM 1276 CA GLU B 82 3.609 -9.109 3.455 1.00 0.00 C ATOM 1277 C GLU B 82 3.165 -8.159 2.356 1.00 0.00 C ATOM 1278 O GLU B 82 3.501 -8.362 1.193 1.00 0.00 O ATOM 1279 CB GLU B 82 5.125 -9.044 3.602 1.00 0.00 C ATOM 1280 CG GLU B 82 5.678 -9.985 4.653 1.00 0.00 C ATOM 1281 CD GLU B 82 7.170 -9.843 4.807 1.00 0.00 C ATOM 1282 OE1 GLU B 82 7.610 -8.898 5.497 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.911 -10.666 4.235 1.00 0.00 O ATOM 0 H GLU B 82 3.748 -10.916 2.409 1.00 0.00 H new ATOM 0 HA GLU B 82 3.150 -8.816 4.399 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.584 -9.277 2.641 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.413 -8.023 3.854 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.194 -9.786 5.609 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.437 -11.013 4.382 1.00 0.00 H new ATOM 1290 N GLY B 83 2.415 -7.131 2.711 1.00 0.00 N ATOM 1291 CA GLY B 83 1.896 -6.234 1.703 1.00 0.00 C ATOM 1292 C GLY B 83 2.262 -4.792 1.951 1.00 0.00 C ATOM 1293 O GLY B 83 2.423 -4.369 3.094 1.00 0.00 O ATOM 0 H GLY B 83 2.157 -6.902 3.671 1.00 0.00 H new ATOM 0 HA2 GLY B 83 2.274 -6.536 0.726 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.811 -6.326 1.667 1.00 0.00 H new ATOM 1297 N GLN B 84 2.406 -4.038 0.873 1.00 0.00 N ATOM 1298 CA GLN B 84 2.765 -2.633 0.957 1.00 0.00 C ATOM 1299 C GLN B 84 1.961 -1.814 -0.040 1.00 0.00 C ATOM 1300 O GLN B 84 1.870 -2.167 -1.218 1.00 0.00 O ATOM 1301 CB GLN B 84 4.259 -2.451 0.690 1.00 0.00 C ATOM 1302 CG GLN B 84 5.135 -3.195 1.678 1.00 0.00 C ATOM 1303 CD GLN B 84 6.613 -2.987 1.432 1.00 0.00 C ATOM 1304 OE1 GLN B 84 7.037 -1.950 0.919 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.404 -3.975 1.799 1.00 0.00 N ATOM 0 H GLN B 84 2.278 -4.381 -0.079 1.00 0.00 H new ATOM 0 HA GLN B 84 2.537 -2.282 1.964 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.486 -2.795 -0.319 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.502 -1.389 0.726 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.891 -2.868 2.689 1.00 0.00 H new ATOM 0 HG3 GLN B 84 4.910 -4.260 1.624 1.00 0.00 H new ATOM 0 HE21 GLN B 84 7.008 -4.816 2.220 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.412 -3.899 1.662 1.00 0.00 H new ATOM 1314 N LEU B 85 1.373 -0.732 0.445 1.00 0.00 N ATOM 1315 CA LEU B 85 0.618 0.180 -0.399 1.00 0.00 C ATOM 1316 C LEU B 85 1.421 1.460 -0.593 1.00 0.00 C ATOM 1317 O LEU B 85 1.707 2.174 0.370 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.753 0.474 0.243 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.767 1.264 -0.607 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.454 2.754 -0.607 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -1.808 0.732 -2.032 1.00 0.00 C ATOM 0 H LEU B 85 1.405 -0.462 1.428 1.00 0.00 H new ATOM 0 HA LEU B 85 0.441 -0.273 -1.375 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.209 -0.477 0.518 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.583 1.026 1.168 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.749 1.127 -0.155 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.189 3.280 -1.216 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.490 3.133 0.414 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.458 2.917 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.531 1.305 -2.614 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -0.821 0.827 -2.484 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.102 -0.318 -2.020 1.00 0.00 H new ATOM 1333 N ILE B 86 1.809 1.727 -1.829 1.00 0.00 N ATOM 1334 CA ILE B 86 2.565 2.928 -2.144 1.00 0.00 C ATOM 1335 C ILE B 86 1.678 3.914 -2.895 1.00 0.00 C ATOM 1336 O ILE B 86 1.247 3.645 -4.018 1.00 0.00 O ATOM 1337 CB ILE B 86 3.829 2.641 -2.997 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.661 1.495 -2.407 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.689 3.895 -3.096 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.199 0.112 -2.812 1.00 0.00 C ATOM 0 H ILE B 86 1.613 1.128 -2.631 1.00 0.00 H new ATOM 0 HA ILE B 86 2.896 3.347 -1.194 1.00 0.00 H new ATOM 0 HB ILE B 86 3.495 2.343 -3.991 1.00 0.00 H new ATOM 0 HG12 ILE B 86 5.699 1.622 -2.713 1.00 0.00 H new ATOM 0 HG13 ILE B 86 4.638 1.568 -1.320 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.574 3.683 -3.697 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.115 4.694 -3.565 1.00 0.00 H new ATOM 0 HG23 ILE B 86 4.995 4.206 -2.097 1.00 0.00 H new ATOM 0 HD11 ILE B 86 4.843 -0.636 -2.350 1.00 0.00 H new ATOM 0 HD12 ILE B 86 3.171 -0.040 -2.482 1.00 0.00 H new ATOM 0 HD13 ILE B 86 4.249 0.015 -3.896 1.00 0.00 H new ATOM 1352 N SER B 87 1.388 5.039 -2.267 1.00 0.00 N ATOM 1353 CA SER B 87 0.556 6.056 -2.881 1.00 0.00 C ATOM 1354 C SER B 87 1.409 7.065 -3.641 1.00 0.00 C ATOM 1355 O SER B 87 2.126 7.864 -3.036 1.00 0.00 O ATOM 1356 CB SER B 87 -0.271 6.762 -1.807 1.00 0.00 C ATOM 1357 OG SER B 87 0.552 7.185 -0.731 1.00 0.00 O ATOM 0 H SER B 87 1.717 5.271 -1.330 1.00 0.00 H new ATOM 0 HA SER B 87 -0.116 5.576 -3.593 1.00 0.00 H new ATOM 0 HB2 SER B 87 -0.780 7.623 -2.241 1.00 0.00 H new ATOM 0 HB3 SER B 87 -1.044 6.089 -1.436 1.00 0.00 H new ATOM 0 HG SER B 87 1.389 7.552 -1.084 1.00 0.00 H new ATOM 1363 N ILE B 88 1.345 7.017 -4.965 1.00 0.00 N ATOM 1364 CA ILE B 88 2.093 7.955 -5.788 1.00 0.00 C ATOM 1365 C ILE B 88 1.237 9.171 -6.100 1.00 0.00 C ATOM 1366 O ILE B 88 0.339 9.112 -6.944 1.00 0.00 O ATOM 1367 CB ILE B 88 2.555 7.331 -7.121 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.163 5.943 -6.893 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.559 8.253 -7.813 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.397 5.942 -6.019 1.00 0.00 C ATOM 0 H ILE B 88 0.786 6.343 -5.488 1.00 0.00 H new ATOM 0 HA ILE B 88 2.977 8.238 -5.216 1.00 0.00 H new ATOM 0 HB ILE B 88 1.685 7.214 -7.767 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.410 5.299 -6.439 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.416 5.506 -7.859 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.879 7.803 -8.753 1.00 0.00 H new ATOM 0 HG22 ILE B 88 3.090 9.217 -8.013 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.425 8.398 -7.167 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.764 4.921 -5.908 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.170 6.557 -6.480 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.148 6.347 -5.038 1.00 0.00 H new ATOM 1382 N GLN B 89 1.496 10.262 -5.407 1.00 0.00 N ATOM 1383 CA GLN B 89 0.785 11.499 -5.657 1.00 0.00 C ATOM 1384 C GLN B 89 1.370 12.217 -6.860 1.00 0.00 C ATOM 1385 O GLN B 89 2.525 12.004 -7.225 1.00 0.00 O ATOM 1386 CB GLN B 89 0.832 12.406 -4.431 1.00 0.00 C ATOM 1387 CG GLN B 89 -0.096 11.966 -3.314 1.00 0.00 C ATOM 1388 CD GLN B 89 -0.146 12.966 -2.180 1.00 0.00 C ATOM 1389 OE1 GLN B 89 -0.933 13.910 -2.215 1.00 0.00 O ATOM 1390 NE2 GLN B 89 0.680 12.761 -1.166 1.00 0.00 N ATOM 0 H GLN B 89 2.194 10.317 -4.666 1.00 0.00 H new ATOM 0 HA GLN B 89 -0.256 11.254 -5.868 1.00 0.00 H new ATOM 0 HB2 GLN B 89 1.853 12.438 -4.052 1.00 0.00 H new ATOM 0 HB3 GLN B 89 0.571 13.421 -4.730 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -1.100 11.823 -3.714 1.00 0.00 H new ATOM 0 HG3 GLN B 89 0.234 11.001 -2.930 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.316 11.964 -1.180 1.00 0.00 H new ATOM 0 HE22 GLN B 89 0.680 13.400 -0.371 1.00 0.00 H new ATOM 1399 N GLN B 90 0.560 13.089 -7.447 1.00 0.00 N ATOM 1400 CA GLN B 90 0.914 13.797 -8.679 1.00 0.00 C ATOM 1401 C GLN B 90 2.052 14.784 -8.448 1.00 0.00 C ATOM 1402 O GLN B 90 2.556 15.398 -9.386 1.00 0.00 O ATOM 1403 CB GLN B 90 -0.306 14.550 -9.200 1.00 0.00 C ATOM 1404 CG GLN B 90 -1.543 13.680 -9.346 1.00 0.00 C ATOM 1405 CD GLN B 90 -2.765 14.451 -9.804 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -3.637 13.902 -10.473 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -2.844 15.725 -9.447 1.00 0.00 N ATOM 0 H GLN B 90 -0.363 13.328 -7.085 1.00 0.00 H new ATOM 0 HA GLN B 90 1.245 13.059 -9.410 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.530 15.374 -8.523 1.00 0.00 H new ATOM 0 HB3 GLN B 90 -0.065 14.989 -10.168 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -1.336 12.882 -10.060 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -1.759 13.204 -8.390 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -2.100 16.146 -8.891 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -3.649 16.284 -9.728 1.00 0.00 H new ATOM 1416 N TYR B 91 2.439 14.937 -7.195 1.00 0.00 N ATOM 1417 CA TYR B 91 3.479 15.877 -6.816 1.00 0.00 C ATOM 1418 C TYR B 91 4.753 15.120 -6.467 1.00 0.00 C ATOM 1419 O TYR B 91 5.637 15.640 -5.789 1.00 0.00 O ATOM 1420 CB TYR B 91 3.005 16.711 -5.625 1.00 0.00 C ATOM 1421 CG TYR B 91 1.528 17.035 -5.683 1.00 0.00 C ATOM 1422 CD1 TYR B 91 1.035 17.978 -6.575 1.00 0.00 C ATOM 1423 CD2 TYR B 91 0.622 16.376 -4.858 1.00 0.00 C ATOM 1424 CE1 TYR B 91 -0.316 18.258 -6.641 1.00 0.00 C ATOM 1425 CE2 TYR B 91 -0.729 16.653 -4.918 1.00 0.00 C ATOM 1426 CZ TYR B 91 -1.192 17.593 -5.811 1.00 0.00 C ATOM 1427 OH TYR B 91 -2.539 17.869 -5.873 1.00 0.00 O ATOM 0 H TYR B 91 2.043 14.415 -6.413 1.00 0.00 H new ATOM 0 HA TYR B 91 3.690 16.546 -7.650 1.00 0.00 H new ATOM 0 HB2 TYR B 91 3.217 16.171 -4.702 1.00 0.00 H new ATOM 0 HB3 TYR B 91 3.574 17.640 -5.589 1.00 0.00 H new ATOM 0 HD1 TYR B 91 1.719 18.501 -7.227 1.00 0.00 H new ATOM 0 HD2 TYR B 91 0.982 15.635 -4.159 1.00 0.00 H new ATOM 0 HE1 TYR B 91 -0.684 18.995 -7.340 1.00 0.00 H new ATOM 0 HE2 TYR B 91 -1.419 16.135 -4.268 1.00 0.00 H new ATOM 0 HH TYR B 91 -2.890 17.990 -4.966 1.00 0.00 H new ATOM 1437 N GLY B 92 4.814 13.867 -6.911 1.00 0.00 N ATOM 1438 CA GLY B 92 5.976 13.032 -6.674 1.00 0.00 C ATOM 1439 C GLY B 92 6.054 12.529 -5.248 1.00 0.00 C ATOM 1440 O GLY B 92 7.032 11.887 -4.860 1.00 0.00 O ATOM 0 H GLY B 92 4.068 13.412 -7.437 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.951 12.181 -7.354 1.00 0.00 H new ATOM 0 HA3 GLY B 92 6.878 13.598 -6.905 1.00 0.00 H new ATOM 1444 N HIS B 93 5.024 12.824 -4.465 1.00 0.00 N ATOM 1445 CA HIS B 93 4.936 12.333 -3.099 1.00 0.00 C ATOM 1446 C HIS B 93 4.618 10.849 -3.103 1.00 0.00 C ATOM 1447 O HIS B 93 3.589 10.430 -3.633 1.00 0.00 O ATOM 1448 CB HIS B 93 3.856 13.096 -2.323 1.00 0.00 C ATOM 1449 CG HIS B 93 4.354 14.319 -1.620 1.00 0.00 C ATOM 1450 ND1 HIS B 93 3.963 14.659 -0.343 1.00 0.00 N ATOM 1451 CD2 HIS B 93 5.203 15.292 -2.022 1.00 0.00 C ATOM 1452 CE1 HIS B 93 4.552 15.785 0.010 1.00 0.00 C ATOM 1453 NE2 HIS B 93 5.310 16.189 -0.992 1.00 0.00 N ATOM 0 H HIS B 93 4.236 13.403 -4.756 1.00 0.00 H new ATOM 0 HA HIS B 93 5.896 12.493 -2.609 1.00 0.00 H new ATOM 0 HB2 HIS B 93 3.064 13.385 -3.014 1.00 0.00 H new ATOM 0 HB3 HIS B 93 3.410 12.425 -1.589 1.00 0.00 H new ATOM 0 HD2 HIS B 93 5.703 15.351 -2.977 1.00 0.00 H new ATOM 0 HE1 HIS B 93 4.434 16.290 0.957 1.00 0.00 H new ATOM 0 HE2 HIS B 93 5.883 17.033 -0.999 1.00 0.00 H new ATOM 1462 N GLN B 94 5.506 10.059 -2.526 1.00 0.00 N ATOM 1463 CA GLN B 94 5.319 8.622 -2.467 1.00 0.00 C ATOM 1464 C GLN B 94 5.398 8.151 -1.027 1.00 0.00 C ATOM 1465 O GLN B 94 6.408 8.357 -0.355 1.00 0.00 O ATOM 1466 CB GLN B 94 6.390 7.907 -3.293 1.00 0.00 C ATOM 1467 CG GLN B 94 6.487 8.390 -4.730 1.00 0.00 C ATOM 1468 CD GLN B 94 7.619 7.726 -5.491 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.640 7.351 -4.910 1.00 0.00 O ATOM 1470 NE2 GLN B 94 7.454 7.583 -6.795 1.00 0.00 N ATOM 0 H GLN B 94 6.367 10.391 -2.090 1.00 0.00 H new ATOM 0 HA GLN B 94 4.338 8.385 -2.878 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.357 8.042 -2.809 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.180 6.837 -3.293 1.00 0.00 H new ATOM 0 HG2 GLN B 94 5.545 8.192 -5.241 1.00 0.00 H new ATOM 0 HG3 GLN B 94 6.633 9.470 -4.738 1.00 0.00 H new ATOM 0 HE21 GLN B 94 6.594 7.906 -7.239 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.186 7.149 -7.357 1.00 0.00 H new ATOM 1479 N GLU B 95 4.338 7.526 -0.558 1.00 0.00 N ATOM 1480 CA GLU B 95 4.318 6.979 0.785 1.00 0.00 C ATOM 1481 C GLU B 95 4.057 5.486 0.740 1.00 0.00 C ATOM 1482 O GLU B 95 3.130 5.029 0.071 1.00 0.00 O ATOM 1483 CB GLU B 95 3.266 7.675 1.645 1.00 0.00 C ATOM 1484 CG GLU B 95 3.623 9.107 2.003 1.00 0.00 C ATOM 1485 CD GLU B 95 4.935 9.210 2.758 1.00 0.00 C ATOM 1486 OE1 GLU B 95 5.028 8.682 3.889 1.00 0.00 O ATOM 1487 OE2 GLU B 95 5.879 9.834 2.234 1.00 0.00 O ATOM 0 H GLU B 95 3.477 7.383 -1.087 1.00 0.00 H new ATOM 0 HA GLU B 95 5.294 7.154 1.237 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.314 7.669 1.115 1.00 0.00 H new ATOM 0 HB3 GLU B 95 3.124 7.105 2.563 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.685 9.701 1.091 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.825 9.536 2.609 1.00 0.00 H new ATOM 1494 N VAL B 96 4.888 4.735 1.438 1.00 0.00 N ATOM 1495 CA VAL B 96 4.770 3.290 1.468 1.00 0.00 C ATOM 1496 C VAL B 96 4.251 2.833 2.822 1.00 0.00 C ATOM 1497 O VAL B 96 4.925 2.990 3.841 1.00 0.00 O ATOM 1498 CB VAL B 96 6.127 2.612 1.187 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.982 1.100 1.143 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.732 3.141 -0.106 1.00 0.00 C ATOM 0 H VAL B 96 5.657 5.106 1.996 1.00 0.00 H new ATOM 0 HA VAL B 96 4.067 2.999 0.688 1.00 0.00 H new ATOM 0 HB VAL B 96 6.805 2.856 2.004 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.953 0.647 0.943 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.605 0.743 2.101 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.284 0.824 0.353 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.689 2.651 -0.287 1.00 0.00 H new ATOM 0 HG22 VAL B 96 6.056 2.934 -0.935 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.885 4.217 -0.022 1.00 0.00 H new ATOM 1510 N THR B 97 3.045 2.302 2.835 1.00 0.00 N ATOM 1511 CA THR B 97 2.455 1.779 4.053 1.00 0.00 C ATOM 1512 C THR B 97 2.536 0.256 4.069 1.00 0.00 C ATOM 1513 O THR B 97 1.931 -0.420 3.234 1.00 0.00 O ATOM 1514 CB THR B 97 0.992 2.239 4.196 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.938 3.671 4.140 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.387 1.757 5.507 1.00 0.00 C ATOM 0 H THR B 97 2.450 2.221 2.010 1.00 0.00 H new ATOM 0 HA THR B 97 3.019 2.170 4.900 1.00 0.00 H new ATOM 0 HB THR B 97 0.414 1.809 3.378 1.00 0.00 H new ATOM 0 HG1 THR B 97 0.165 3.989 4.651 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.646 2.098 5.578 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.413 0.668 5.541 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.960 2.160 6.342 1.00 0.00 H new ATOM 1524 N ARG B 98 3.310 -0.271 5.007 1.00 0.00 N ATOM 1525 CA ARG B 98 3.535 -1.705 5.102 1.00 0.00 C ATOM 1526 C ARG B 98 2.523 -2.352 6.040 1.00 0.00 C ATOM 1527 O ARG B 98 2.322 -1.895 7.165 1.00 0.00 O ATOM 1528 CB ARG B 98 4.954 -1.984 5.602 1.00 0.00 C ATOM 1529 CG ARG B 98 6.043 -1.372 4.734 1.00 0.00 C ATOM 1530 CD ARG B 98 7.423 -1.617 5.317 1.00 0.00 C ATOM 1531 NE ARG B 98 7.599 -0.950 6.605 1.00 0.00 N ATOM 1532 CZ ARG B 98 8.684 -1.077 7.369 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.690 -1.850 6.979 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.759 -0.426 8.524 1.00 0.00 N ATOM 0 H ARG B 98 3.795 0.278 5.717 1.00 0.00 H new ATOM 0 HA ARG B 98 3.412 -2.135 4.108 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.053 -1.600 6.617 1.00 0.00 H new ATOM 0 HB3 ARG B 98 5.106 -3.062 5.653 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.991 -1.795 3.731 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.873 -0.300 4.637 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.580 -2.689 5.439 1.00 0.00 H new ATOM 0 HD3 ARG B 98 8.180 -1.262 4.618 1.00 0.00 H new ATOM 0 HE ARG B 98 6.845 -0.350 6.940 1.00 0.00 H new ATOM 0 HH11 ARG B 98 9.635 -2.350 6.092 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.518 -1.944 7.567 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.987 0.170 8.825 1.00 0.00 H new ATOM 0 HH22 ARG B 98 9.588 -0.522 9.110 1.00 0.00 H new ATOM 1548 N PHE B 99 1.885 -3.407 5.565 1.00 0.00 N ATOM 1549 CA PHE B 99 0.929 -4.159 6.362 1.00 0.00 C ATOM 1550 C PHE B 99 1.181 -5.653 6.191 1.00 0.00 C ATOM 1551 O PHE B 99 2.048 -6.057 5.412 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.513 -3.798 5.967 1.00 0.00 C ATOM 1553 CG PHE B 99 -0.834 -3.999 4.508 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.339 -5.209 4.056 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.638 -2.975 3.594 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.643 -5.391 2.720 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -0.938 -3.155 2.257 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.441 -4.364 1.819 1.00 0.00 C ATOM 0 H PHE B 99 2.014 -3.767 4.619 1.00 0.00 H new ATOM 0 HA PHE B 99 1.060 -3.898 7.412 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.200 -4.399 6.563 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -0.696 -2.755 6.225 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.496 -6.017 4.755 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.247 -2.026 3.931 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.039 -6.337 2.381 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.779 -2.350 1.555 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.676 -4.506 0.774 1.00 0.00 H new ATOM 1568 N ASP B 100 0.435 -6.472 6.918 1.00 0.00 N ATOM 1569 CA ASP B 100 0.631 -7.914 6.869 1.00 0.00 C ATOM 1570 C ASP B 100 -0.704 -8.641 6.774 1.00 0.00 C ATOM 1571 O ASP B 100 -1.742 -8.120 7.191 1.00 0.00 O ATOM 1572 CB ASP B 100 1.395 -8.400 8.107 1.00 0.00 C ATOM 1573 CG ASP B 100 0.533 -8.446 9.355 1.00 0.00 C ATOM 1574 OD1 ASP B 100 0.363 -7.398 10.015 1.00 0.00 O ATOM 1575 OD2 ASP B 100 0.026 -9.539 9.690 1.00 0.00 O ATOM 0 H ASP B 100 -0.308 -6.165 7.546 1.00 0.00 H new ATOM 0 HA ASP B 100 1.218 -8.138 5.978 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.796 -9.395 7.912 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.246 -7.742 8.284 1.00 0.00 H new ATOM 1580 N PHE B 101 -0.665 -9.842 6.218 1.00 0.00 N ATOM 1581 CA PHE B 101 -1.839 -10.693 6.122 1.00 0.00 C ATOM 1582 C PHE B 101 -1.485 -12.121 6.527 1.00 0.00 C ATOM 1583 O PHE B 101 -0.366 -12.581 6.300 1.00 0.00 O ATOM 1584 CB PHE B 101 -2.408 -10.671 4.693 1.00 0.00 C ATOM 1585 CG PHE B 101 -3.445 -11.732 4.434 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -4.736 -11.592 4.913 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -3.122 -12.873 3.715 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -5.685 -12.569 4.678 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -4.065 -13.852 3.478 1.00 0.00 C ATOM 1590 CZ PHE B 101 -5.348 -13.701 3.962 1.00 0.00 C ATOM 0 H PHE B 101 0.180 -10.253 5.821 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.601 -10.311 6.801 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -2.848 -9.692 4.502 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -1.589 -10.796 3.984 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -5.005 -10.710 5.476 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -2.119 -12.997 3.335 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -6.690 -12.447 5.054 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -3.799 -14.734 2.915 1.00 0.00 H new ATOM 0 HZ PHE B 101 -6.088 -14.467 3.781 1.00 0.00 H new ATOM 1600 N THR B 102 -2.429 -12.803 7.153 1.00 0.00 N ATOM 1601 CA THR B 102 -2.260 -14.202 7.508 1.00 0.00 C ATOM 1602 C THR B 102 -3.592 -14.931 7.364 1.00 0.00 C ATOM 1603 O THR B 102 -3.687 -15.956 6.696 1.00 0.00 O ATOM 1604 CB THR B 102 -1.734 -14.349 8.948 1.00 0.00 C ATOM 1605 OG1 THR B 102 -0.579 -13.515 9.122 1.00 0.00 O ATOM 1606 CG2 THR B 102 -1.369 -15.795 9.253 1.00 0.00 C ATOM 0 H THR B 102 -3.328 -12.406 7.428 1.00 0.00 H new ATOM 0 HA THR B 102 -1.526 -14.643 6.833 1.00 0.00 H new ATOM 0 HB THR B 102 -2.522 -14.042 9.636 1.00 0.00 H new ATOM 0 HG1 THR B 102 -0.244 -13.607 10.039 1.00 0.00 H new ATOM 0 HG21 THR B 102 -1.001 -15.869 10.276 1.00 0.00 H new ATOM 0 HG22 THR B 102 -2.251 -16.425 9.138 1.00 0.00 H new ATOM 0 HG23 THR B 102 -0.593 -16.128 8.563 1.00 0.00 H new ATOM 1614 N THR B 103 -4.617 -14.379 7.992 1.00 0.00 N ATOM 1615 CA THR B 103 -5.968 -14.893 7.876 1.00 0.00 C ATOM 1616 C THR B 103 -6.950 -13.850 8.394 1.00 0.00 C ATOM 1617 O THR B 103 -6.750 -13.263 9.458 1.00 0.00 O ATOM 1618 CB THR B 103 -6.153 -16.232 8.633 1.00 0.00 C ATOM 1619 OG1 THR B 103 -7.508 -16.688 8.508 1.00 0.00 O ATOM 1620 CG2 THR B 103 -5.789 -16.097 10.106 1.00 0.00 C ATOM 0 H THR B 103 -4.534 -13.562 8.596 1.00 0.00 H new ATOM 0 HA THR B 103 -6.162 -15.096 6.823 1.00 0.00 H new ATOM 0 HB THR B 103 -5.480 -16.962 8.183 1.00 0.00 H new ATOM 0 HG1 THR B 103 -7.961 -16.609 9.374 1.00 0.00 H new ATOM 0 HG21 THR B 103 -5.931 -17.056 10.605 1.00 0.00 H new ATOM 0 HG22 THR B 103 -4.747 -15.792 10.197 1.00 0.00 H new ATOM 0 HG23 THR B 103 -6.429 -15.347 10.572 1.00 0.00 H new ATOM 1628 N THR B 104 -7.996 -13.605 7.626 1.00 0.00 N ATOM 1629 CA THR B 104 -8.949 -12.560 7.951 1.00 0.00 C ATOM 1630 C THR B 104 -9.981 -13.047 8.971 1.00 0.00 C ATOM 1631 O THR B 104 -10.799 -12.268 9.467 1.00 0.00 O ATOM 1632 CB THR B 104 -9.666 -12.081 6.676 1.00 0.00 C ATOM 1633 OG1 THR B 104 -8.727 -11.980 5.594 1.00 0.00 O ATOM 1634 CG2 THR B 104 -10.324 -10.729 6.897 1.00 0.00 C ATOM 0 H THR B 104 -8.207 -14.118 6.770 1.00 0.00 H new ATOM 0 HA THR B 104 -8.397 -11.730 8.392 1.00 0.00 H new ATOM 0 HB THR B 104 -10.438 -12.810 6.428 1.00 0.00 H new ATOM 0 HG1 THR B 104 -8.565 -12.870 5.217 1.00 0.00 H new ATOM 0 HG21 THR B 104 -10.824 -10.413 5.981 1.00 0.00 H new ATOM 0 HG22 THR B 104 -11.056 -10.808 7.701 1.00 0.00 H new ATOM 0 HG23 THR B 104 -9.565 -9.995 7.168 1.00 0.00 H new ATOM 1642 N SER B 105 -9.925 -14.332 9.301 1.00 0.00 N ATOM 1643 CA SER B 105 -10.890 -14.928 10.215 1.00 0.00 C ATOM 1644 C SER B 105 -10.766 -14.340 11.618 1.00 0.00 C ATOM 1645 O SER B 105 -11.768 -14.044 12.266 1.00 0.00 O ATOM 1646 CB SER B 105 -10.708 -16.446 10.258 1.00 0.00 C ATOM 1647 OG SER B 105 -9.355 -16.793 10.513 1.00 0.00 O ATOM 0 H SER B 105 -9.221 -14.981 8.949 1.00 0.00 H new ATOM 0 HA SER B 105 -11.889 -14.699 9.845 1.00 0.00 H new ATOM 0 HB2 SER B 105 -11.347 -16.870 11.032 1.00 0.00 H new ATOM 0 HB3 SER B 105 -11.025 -16.880 9.310 1.00 0.00 H new ATOM 0 HG SER B 105 -9.266 -17.769 10.537 1.00 0.00 H new ATOM 1653 N THR B 106 -9.540 -14.154 12.079 1.00 0.00 N ATOM 1654 CA THR B 106 -9.308 -13.688 13.436 1.00 0.00 C ATOM 1655 C THR B 106 -9.083 -12.178 13.493 1.00 0.00 C ATOM 1656 O THR B 106 -8.841 -11.624 14.564 1.00 0.00 O ATOM 1657 CB THR B 106 -8.103 -14.412 14.061 1.00 0.00 C ATOM 1658 OG1 THR B 106 -6.999 -14.406 13.145 1.00 0.00 O ATOM 1659 CG2 THR B 106 -8.463 -15.845 14.421 1.00 0.00 C ATOM 0 H THR B 106 -8.693 -14.318 11.535 1.00 0.00 H new ATOM 0 HA THR B 106 -10.207 -13.918 14.008 1.00 0.00 H new ATOM 0 HB THR B 106 -7.821 -13.885 14.972 1.00 0.00 H new ATOM 0 HG1 THR B 106 -6.235 -14.867 13.550 1.00 0.00 H new ATOM 0 HG21 THR B 106 -7.596 -16.338 14.861 1.00 0.00 H new ATOM 0 HG22 THR B 106 -9.284 -15.845 15.138 1.00 0.00 H new ATOM 0 HG23 THR B 106 -8.767 -16.381 13.522 1.00 0.00 H new ATOM 1667 N SER B 107 -9.176 -11.516 12.348 1.00 0.00 N ATOM 1668 CA SER B 107 -8.938 -10.080 12.280 1.00 0.00 C ATOM 1669 C SER B 107 -10.045 -9.300 12.991 1.00 0.00 C ATOM 1670 O SER B 107 -9.809 -8.679 14.030 1.00 0.00 O ATOM 1671 CB SER B 107 -8.823 -9.638 10.822 1.00 0.00 C ATOM 1672 OG SER B 107 -7.794 -10.353 10.160 1.00 0.00 O ATOM 0 H SER B 107 -9.414 -11.949 11.455 1.00 0.00 H new ATOM 0 HA SER B 107 -8.000 -9.865 12.792 1.00 0.00 H new ATOM 0 HB2 SER B 107 -9.772 -9.801 10.312 1.00 0.00 H new ATOM 0 HB3 SER B 107 -8.617 -8.569 10.776 1.00 0.00 H new ATOM 0 HG SER B 107 -7.629 -9.951 9.282 1.00 0.00 H new ATOM 1678 N THR B 108 -11.251 -9.347 12.444 1.00 0.00 N ATOM 1679 CA THR B 108 -12.373 -8.616 13.012 1.00 0.00 C ATOM 1680 C THR B 108 -13.358 -9.576 13.680 1.00 0.00 C ATOM 1681 O THR B 108 -13.908 -10.459 13.023 1.00 0.00 O ATOM 1682 CB THR B 108 -13.109 -7.812 11.922 1.00 0.00 C ATOM 1683 OG1 THR B 108 -12.155 -7.151 11.080 1.00 0.00 O ATOM 1684 CG2 THR B 108 -14.038 -6.780 12.543 1.00 0.00 C ATOM 0 H THR B 108 -11.477 -9.884 11.607 1.00 0.00 H new ATOM 0 HA THR B 108 -11.977 -7.928 13.759 1.00 0.00 H new ATOM 0 HB THR B 108 -13.706 -8.505 11.329 1.00 0.00 H new ATOM 0 HG1 THR B 108 -12.627 -6.643 10.388 1.00 0.00 H new ATOM 0 HG21 THR B 108 -14.546 -6.226 11.754 1.00 0.00 H new ATOM 0 HG22 THR B 108 -14.777 -7.284 13.166 1.00 0.00 H new ATOM 0 HG23 THR B 108 -13.458 -6.090 13.155 1.00 0.00 H new ATOM 1692 N PRO B 109 -13.573 -9.437 14.999 1.00 0.00 N ATOM 1693 CA PRO B 109 -14.541 -10.255 15.741 1.00 0.00 C ATOM 1694 C PRO B 109 -15.991 -9.915 15.380 1.00 0.00 C ATOM 1695 O PRO B 109 -16.721 -9.308 16.172 1.00 0.00 O ATOM 1696 CB PRO B 109 -14.263 -9.914 17.215 1.00 0.00 C ATOM 1697 CG PRO B 109 -12.971 -9.169 17.221 1.00 0.00 C ATOM 1698 CD PRO B 109 -12.875 -8.496 15.884 1.00 0.00 C ATOM 0 HA PRO B 109 -14.428 -11.314 15.511 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -15.066 -9.308 17.635 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -14.196 -10.818 17.820 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -12.946 -8.437 18.029 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -12.131 -9.846 17.378 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -13.351 -7.515 15.889 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -11.839 -8.346 15.580 1.00 0.00 H new ATOM 1706 N GLY B 110 -16.400 -10.292 14.179 1.00 0.00 N ATOM 1707 CA GLY B 110 -17.766 -10.072 13.750 1.00 0.00 C ATOM 1708 C GLY B 110 -18.572 -11.352 13.784 1.00 0.00 C ATOM 1709 O GLY B 110 -19.186 -11.681 14.800 1.00 0.00 O ATOM 0 H GLY B 110 -15.806 -10.750 13.488 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -18.235 -9.328 14.394 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -17.770 -9.665 12.739 1.00 0.00 H new ATOM 1713 N SER B 111 -18.569 -12.077 12.677 1.00 0.00 N ATOM 1714 CA SER B 111 -19.200 -13.386 12.620 1.00 0.00 C ATOM 1715 C SER B 111 -18.330 -14.397 13.361 1.00 0.00 C ATOM 1716 O SER B 111 -18.828 -15.328 13.995 1.00 0.00 O ATOM 1717 CB SER B 111 -19.398 -13.817 11.165 1.00 0.00 C ATOM 1718 OG SER B 111 -20.100 -12.828 10.427 1.00 0.00 O ATOM 0 H SER B 111 -18.135 -11.780 11.803 1.00 0.00 H new ATOM 0 HA SER B 111 -20.179 -13.337 13.097 1.00 0.00 H new ATOM 0 HB2 SER B 111 -18.428 -14.000 10.702 1.00 0.00 H new ATOM 0 HB3 SER B 111 -19.949 -14.757 11.133 1.00 0.00 H new ATOM 0 HG SER B 111 -20.211 -13.128 9.501 1.00 0.00 H new ATOM 1724 N ARG B 112 -17.024 -14.191 13.279 1.00 0.00 N ATOM 1725 CA ARG B 112 -16.067 -15.007 14.000 1.00 0.00 C ATOM 1726 C ARG B 112 -15.866 -14.434 15.396 1.00 0.00 C ATOM 1727 O ARG B 112 -15.695 -13.224 15.550 1.00 0.00 O ATOM 1728 CB ARG B 112 -14.732 -15.047 13.251 1.00 0.00 C ATOM 1729 CG ARG B 112 -13.680 -15.928 13.909 1.00 0.00 C ATOM 1730 CD ARG B 112 -14.043 -17.400 13.819 1.00 0.00 C ATOM 1731 NE ARG B 112 -13.060 -18.252 14.485 1.00 0.00 N ATOM 1732 CZ ARG B 112 -12.916 -19.555 14.241 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -13.676 -20.149 13.325 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -12.011 -20.264 14.907 1.00 0.00 N ATOM 0 H ARG B 112 -16.602 -13.455 12.712 1.00 0.00 H new ATOM 0 HA ARG B 112 -16.450 -16.025 14.077 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -14.907 -15.404 12.236 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -14.342 -14.032 13.169 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -12.715 -15.761 13.430 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -13.570 -15.644 14.956 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -15.023 -17.559 14.269 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -14.122 -17.690 12.771 1.00 0.00 H new ATOM 0 HE ARG B 112 -12.447 -17.824 15.179 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -14.369 -19.608 12.809 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -13.565 -21.146 13.139 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -11.424 -19.812 15.608 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -11.904 -21.261 14.718 1.00 0.00 H new ATOM 1748 N SER B 113 -15.900 -15.304 16.400 1.00 0.00 N ATOM 1749 CA SER B 113 -15.753 -14.900 17.792 1.00 0.00 C ATOM 1750 C SER B 113 -16.918 -14.001 18.200 1.00 0.00 C ATOM 1751 O SER B 113 -16.742 -12.823 18.519 1.00 0.00 O ATOM 1752 CB SER B 113 -14.408 -14.194 18.017 1.00 0.00 C ATOM 1753 OG SER B 113 -14.142 -14.017 19.399 1.00 0.00 O ATOM 0 H SER B 113 -16.030 -16.307 16.271 1.00 0.00 H new ATOM 0 HA SER B 113 -15.767 -15.792 18.419 1.00 0.00 H new ATOM 0 HB2 SER B 113 -13.608 -14.779 17.563 1.00 0.00 H new ATOM 0 HB3 SER B 113 -14.416 -13.224 17.519 1.00 0.00 H new ATOM 0 HG SER B 113 -13.279 -13.567 19.511 1.00 0.00 H new ATOM 1759 N HIS B 114 -18.115 -14.571 18.176 1.00 0.00 N ATOM 1760 CA HIS B 114 -19.319 -13.836 18.534 1.00 0.00 C ATOM 1761 C HIS B 114 -19.842 -14.301 19.889 1.00 0.00 C ATOM 1762 O HIS B 114 -20.927 -13.912 20.320 1.00 0.00 O ATOM 1763 CB HIS B 114 -20.400 -13.999 17.453 1.00 0.00 C ATOM 1764 CG HIS B 114 -20.799 -15.421 17.184 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -20.272 -16.167 16.152 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -21.678 -16.233 17.818 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -20.806 -17.372 16.165 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -21.663 -17.440 17.165 1.00 0.00 N ATOM 0 H HIS B 114 -18.278 -15.543 17.912 1.00 0.00 H new ATOM 0 HA HIS B 114 -19.066 -12.778 18.604 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -21.284 -13.437 17.753 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -20.039 -13.554 16.526 1.00 0.00 H new ATOM 0 HD1 HIS B 114 -19.577 -15.838 15.482 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -22.279 -15.978 18.678 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -20.580 -18.170 15.473 1.00 0.00 H new ATOM 1777 N HIS B 115 -19.058 -15.138 20.557 1.00 0.00 N ATOM 1778 CA HIS B 115 -19.424 -15.644 21.874 1.00 0.00 C ATOM 1779 C HIS B 115 -18.988 -14.649 22.948 1.00 0.00 C ATOM 1780 O HIS B 115 -18.176 -14.962 23.819 1.00 0.00 O ATOM 1781 CB HIS B 115 -18.783 -17.018 22.119 1.00 0.00 C ATOM 1782 CG HIS B 115 -19.287 -17.719 23.350 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -18.553 -17.831 24.511 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -20.460 -18.351 23.591 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -19.250 -18.498 25.409 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -20.412 -18.824 24.878 1.00 0.00 N ATOM 0 H HIS B 115 -18.163 -15.481 20.208 1.00 0.00 H new ATOM 0 HA HIS B 115 -20.507 -15.762 21.921 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -18.966 -17.652 21.252 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -17.703 -16.894 22.201 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -21.281 -18.462 22.898 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -18.924 -18.737 26.411 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -21.154 -19.343 25.347 1.00 0.00 H new ATOM 1795 N HIS B 116 -19.517 -13.438 22.865 1.00 0.00 N ATOM 1796 CA HIS B 116 -19.169 -12.391 23.812 1.00 0.00 C ATOM 1797 C HIS B 116 -20.389 -11.977 24.629 1.00 0.00 C ATOM 1798 O HIS B 116 -20.263 -11.336 25.670 1.00 0.00 O ATOM 1799 CB HIS B 116 -18.583 -11.185 23.069 1.00 0.00 C ATOM 1800 CG HIS B 116 -18.012 -10.135 23.972 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -18.396 -8.813 23.931 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -17.068 -10.219 24.937 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -17.714 -8.131 24.831 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -16.900 -8.961 25.457 1.00 0.00 N ATOM 0 H HIS B 116 -20.189 -13.156 22.151 1.00 0.00 H new ATOM 0 HA HIS B 116 -18.417 -12.778 24.500 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -17.802 -11.532 22.392 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -19.362 -10.736 22.453 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -16.543 -11.112 25.242 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -17.806 -7.072 25.023 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -16.253 -8.708 26.204 1.00 0.00 H new ATOM 1813 N HIS B 117 -21.570 -12.357 24.161 1.00 0.00 N ATOM 1814 CA HIS B 117 -22.806 -11.996 24.844 1.00 0.00 C ATOM 1815 C HIS B 117 -23.130 -13.001 25.944 1.00 0.00 C ATOM 1816 O HIS B 117 -23.174 -14.208 25.711 1.00 0.00 O ATOM 1817 CB HIS B 117 -23.979 -11.875 23.855 1.00 0.00 C ATOM 1818 CG HIS B 117 -24.287 -13.123 23.078 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -25.269 -14.016 23.444 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -23.747 -13.612 21.936 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -25.320 -14.998 22.565 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -24.408 -14.778 21.639 1.00 0.00 N ATOM 0 H HIS B 117 -21.699 -12.913 23.315 1.00 0.00 H new ATOM 0 HA HIS B 117 -22.657 -11.019 25.304 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -24.871 -11.580 24.407 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -23.760 -11.072 23.151 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -22.945 -13.167 21.365 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -25.995 -15.840 22.598 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -24.224 -15.376 20.834 1.00 0.00 H new ATOM 1831 N HIS B 118 -23.347 -12.495 27.146 1.00 0.00 N ATOM 1832 CA HIS B 118 -23.659 -13.346 28.286 1.00 0.00 C ATOM 1833 C HIS B 118 -25.146 -13.278 28.602 1.00 0.00 C ATOM 1834 O HIS B 118 -25.834 -12.347 28.184 1.00 0.00 O ATOM 1835 CB HIS B 118 -22.849 -12.929 29.518 1.00 0.00 C ATOM 1836 CG HIS B 118 -21.372 -13.152 29.389 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -20.702 -14.167 30.039 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -20.431 -12.473 28.691 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -19.417 -14.102 29.748 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -19.228 -13.083 28.934 1.00 0.00 N ATOM 0 H HIS B 118 -23.313 -11.498 27.360 1.00 0.00 H new ATOM 0 HA HIS B 118 -23.393 -14.370 28.026 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -23.029 -11.872 29.716 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -23.214 -13.483 30.383 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -20.597 -11.612 28.061 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -18.651 -14.770 30.114 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -18.330 -12.794 28.547 1.00 0.00 H new ATOM 1849 N HIS B 119 -25.636 -14.264 29.338 1.00 0.00 N ATOM 1850 CA HIS B 119 -27.038 -14.305 29.729 1.00 0.00 C ATOM 1851 C HIS B 119 -27.157 -14.255 31.244 1.00 0.00 C ATOM 1852 O HIS B 119 -27.874 -13.373 31.758 1.00 0.00 O ATOM 1853 CB HIS B 119 -27.743 -15.550 29.162 1.00 0.00 C ATOM 1854 CG HIS B 119 -27.110 -16.861 29.534 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -26.179 -17.494 28.743 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -27.290 -17.664 30.612 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -25.815 -18.627 29.313 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -26.473 -18.754 30.448 1.00 0.00 N ATOM 1859 OXT HIS B 119 -26.488 -15.060 31.919 1.00 0.00 O ATOM 0 H HIS B 119 -25.081 -15.050 29.678 1.00 0.00 H new ATOM 0 HA HIS B 119 -27.536 -13.431 29.309 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -28.777 -15.552 29.506 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -27.769 -15.471 28.075 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -27.953 -17.480 31.444 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -25.099 -19.331 28.916 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -26.389 -19.535 31.098 1.00 0.00 H new TER 1868 HIS B 119