USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1184 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 130 ASN : amide:sc= -3.24 K(o=-4.4,f=-12!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= -1.19 USER MOD Set 2.1: A 55 GLN : amide:sc= -11.1! K(o=-21!,f=-9.7) USER MOD Set 2.2: A 120 GLN : amide:sc= -9.72! C(o=-21!,f=-14!) USER MOD Set 3.1: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 71 GLN : amide:sc= -11.3! C(o=-11!,f=-21!) USER MOD Set 4.1: A 56 ASN : amide:sc= -1.26! C(o=-1.9!,f=-9.1!) USER MOD Set 4.2: A 58 SER OG : rot 42:sc= -0.304 USER MOD Set 4.3: A 122 THR OG1 : rot -87:sc= -0.298 USER MOD Set 5.1: A 40 ASN : amide:sc= -5.97! C(o=-6!,f=-4!) USER MOD Set 5.2: A 62 HIS : no HE2:sc= -0.029 K(o=-6,f=-4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -119:sc= 0.154 (180deg=-1.35!) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 LYS NZ :NH3+ -164:sc=-0.00224 (180deg=-0.261) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 9 LYS NZ :NH3+ -162:sc= -0.114 (180deg=-0.745) USER MOD Single : A 11 LYS NZ :NH3+ 146:sc= -2.19 (180deg=-4.42!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -130:sc= -2.55 (180deg=-5.09!) USER MOD Single : A 30 TYR OH : rot 180:sc= -4.09! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.548 USER MOD Single : A 38 GLN : amide:sc= -4.73! C(o=-4.7!,f=-3.1!) USER MOD Single : A 44 SER OG : rot 27:sc= 0.236 USER MOD Single : A 49 ASN : amide:sc= -0.0938 X(o=-0.094,f=-0.3) USER MOD Single : A 51 SER OG : rot 180:sc= 0.139 USER MOD Single : A 63 THR OG1 : rot 41:sc= -0.303 USER MOD Single : A 69 ASN : amide:sc= -2.34! C(o=-2.3!,f=-3.4!) USER MOD Single : A 73 THR OG1 : rot 76:sc= 0.149 USER MOD Single : A 74 ASN : amide:sc= -1.13 K(o=-1.1,f=-3.1!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ -130:sc= -2.33 (180deg=-5.1!) USER MOD Single : A 80 LYS NZ :NH3+ 155:sc= -0.185 (180deg=-1.06!) USER MOD Single : A 82 SER OG : rot 72:sc= 1.16 USER MOD Single : A 83 MET CE :methyl 140:sc= -0.246 (180deg=-1.34!) USER MOD Single : A 85 TYR OH : rot 83:sc= 0.386 USER MOD Single : A 87 LYS NZ :NH3+ -127:sc= -1.08 (180deg=-3.1!) USER MOD Single : A 90 ASN : amide:sc= -7.69! C(o=-7.7!,f=-13!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -153:sc= 0.0317 (180deg=-0.191) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -163:sc= 0 (180deg=-0.234) USER MOD Single : A 98 THR OG1 : rot 79:sc= 0.978 USER MOD Single : A 99 SER OG : rot -53:sc= -0.542! USER MOD Single : A 104 LYS NZ :NH3+ -155:sc= -0.984 (180deg=-1.61) USER MOD Single : A 106 THR OG1 : rot 24:sc=-0.000455 USER MOD Single : A 114 GLN : amide:sc= -2.88! C(o=-2.9!,f=-7.7!) USER MOD Single : A 115 LYS NZ :NH3+ -113:sc= 0.0864 (180deg=-0.157) USER MOD Single : A 117 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.00149) USER MOD Single : A 119 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.173) USER MOD Single : A 125 THR OG1 : rot 17:sc= -1.63! USER MOD Single : A 126 CYS SG : rot -92:sc= 0.627 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 160:sc= -0.0399 (180deg=-0.459) USER MOD Single : A 140 LYS NZ :NH3+ -158:sc= -0.0126 (180deg=-0.536) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -142:sc= -0.26 (180deg=-1.29!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.881 5.879 11.521 1.00 0.00 N ATOM 2 CA MET A 1 21.973 6.022 10.349 1.00 0.00 C ATOM 3 C MET A 1 20.691 6.735 10.784 1.00 0.00 C ATOM 4 O MET A 1 20.653 7.394 11.804 1.00 0.00 O ATOM 5 CB MET A 1 21.634 4.634 9.793 1.00 0.00 C ATOM 6 CG MET A 1 21.148 3.725 10.925 1.00 0.00 C ATOM 7 SD MET A 1 22.565 3.168 11.905 1.00 0.00 S ATOM 8 CE MET A 1 21.623 2.385 13.238 1.00 0.00 C ATOM 0 H1 MET A 1 23.771 6.384 11.334 1.00 0.00 H new ATOM 0 H2 MET A 1 22.425 6.282 12.365 1.00 0.00 H new ATOM 0 H3 MET A 1 23.082 4.872 11.684 1.00 0.00 H new ATOM 0 HA MET A 1 22.465 6.608 9.573 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.864 4.718 9.026 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.513 4.199 9.317 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.443 4.262 11.559 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.617 2.866 10.514 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.311 1.965 13.972 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.988 3.128 13.720 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.002 1.590 12.826 1.00 0.00 H new ATOM 20 N GLN A 2 19.638 6.609 10.022 1.00 0.00 N ATOM 21 CA GLN A 2 18.364 7.280 10.400 1.00 0.00 C ATOM 22 C GLN A 2 17.241 6.809 9.475 1.00 0.00 C ATOM 23 O GLN A 2 17.402 6.736 8.273 1.00 0.00 O ATOM 24 CB GLN A 2 18.528 8.798 10.275 1.00 0.00 C ATOM 25 CG GLN A 2 19.046 9.147 8.878 1.00 0.00 C ATOM 26 CD GLN A 2 19.364 10.642 8.809 1.00 0.00 C ATOM 27 OE1 GLN A 2 18.738 11.374 8.069 1.00 0.00 O ATOM 28 NE2 GLN A 2 20.317 11.129 9.555 1.00 0.00 N ATOM 0 H GLN A 2 19.606 6.071 9.156 1.00 0.00 H new ATOM 0 HA GLN A 2 18.114 7.026 11.430 1.00 0.00 H new ATOM 0 HB2 GLN A 2 17.573 9.293 10.454 1.00 0.00 H new ATOM 0 HB3 GLN A 2 19.222 9.162 11.032 1.00 0.00 H new ATOM 0 HG2 GLN A 2 19.939 8.564 8.654 1.00 0.00 H new ATOM 0 HG3 GLN A 2 18.300 8.888 8.127 1.00 0.00 H new ATOM 0 HE21 GLN A 2 20.843 10.514 10.176 1.00 0.00 H new ATOM 0 HE22 GLN A 2 20.536 12.124 9.517 1.00 0.00 H new ATOM 37 N ALA A 3 16.101 6.491 10.027 1.00 0.00 N ATOM 38 CA ALA A 3 14.967 6.028 9.179 1.00 0.00 C ATOM 39 C ALA A 3 14.326 7.237 8.495 1.00 0.00 C ATOM 40 O ALA A 3 13.162 7.526 8.685 1.00 0.00 O ATOM 41 CB ALA A 3 13.928 5.328 10.056 1.00 0.00 C ATOM 0 H ALA A 3 15.907 6.532 11.028 1.00 0.00 H new ATOM 0 HA ALA A 3 15.332 5.331 8.425 1.00 0.00 H new ATOM 0 HB1 ALA A 3 13.098 4.989 9.436 1.00 0.00 H new ATOM 0 HB2 ALA A 3 14.386 4.471 10.549 1.00 0.00 H new ATOM 0 HB3 ALA A 3 13.558 6.025 10.808 1.00 0.00 H new ATOM 47 N LYS A 4 15.082 7.949 7.702 1.00 0.00 N ATOM 48 CA LYS A 4 14.526 9.146 7.003 1.00 0.00 C ATOM 49 C LYS A 4 15.248 9.329 5.666 1.00 0.00 C ATOM 50 O LYS A 4 15.940 10.304 5.456 1.00 0.00 O ATOM 51 CB LYS A 4 14.746 10.387 7.870 1.00 0.00 C ATOM 52 CG LYS A 4 13.777 10.365 9.055 1.00 0.00 C ATOM 53 CD LYS A 4 13.911 11.666 9.850 1.00 0.00 C ATOM 54 CE LYS A 4 13.006 11.610 11.081 1.00 0.00 C ATOM 55 NZ LYS A 4 11.578 11.613 10.650 1.00 0.00 N ATOM 0 H LYS A 4 16.064 7.753 7.507 1.00 0.00 H new ATOM 0 HA LYS A 4 13.459 9.006 6.829 1.00 0.00 H new ATOM 0 HB2 LYS A 4 15.775 10.414 8.229 1.00 0.00 H new ATOM 0 HB3 LYS A 4 14.591 11.289 7.278 1.00 0.00 H new ATOM 0 HG2 LYS A 4 12.753 10.248 8.699 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.991 9.511 9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 4 14.947 11.813 10.154 1.00 0.00 H new ATOM 0 HD3 LYS A 4 13.639 12.516 9.224 1.00 0.00 H new ATOM 0 HE2 LYS A 4 13.220 10.713 11.662 1.00 0.00 H new ATOM 0 HE3 LYS A 4 13.203 12.464 11.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 10.971 11.847 11.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 11.443 12.322 9.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 11.323 10.673 10.286 1.00 0.00 H new ATOM 69 N PRO A 5 15.089 8.392 4.769 1.00 0.00 N ATOM 70 CA PRO A 5 15.737 8.440 3.427 1.00 0.00 C ATOM 71 C PRO A 5 15.002 9.389 2.468 1.00 0.00 C ATOM 72 O PRO A 5 14.401 10.360 2.885 1.00 0.00 O ATOM 73 CB PRO A 5 15.654 6.983 2.958 1.00 0.00 C ATOM 74 CG PRO A 5 14.394 6.471 3.572 1.00 0.00 C ATOM 75 CD PRO A 5 14.271 7.174 4.931 1.00 0.00 C ATOM 0 HA PRO A 5 16.756 8.825 3.459 1.00 0.00 H new ATOM 0 HB2 PRO A 5 15.623 6.916 1.871 1.00 0.00 H new ATOM 0 HB3 PRO A 5 16.520 6.409 3.288 1.00 0.00 H new ATOM 0 HG2 PRO A 5 13.534 6.691 2.939 1.00 0.00 H new ATOM 0 HG3 PRO A 5 14.431 5.389 3.694 1.00 0.00 H new ATOM 0 HD2 PRO A 5 13.234 7.416 5.165 1.00 0.00 H new ATOM 0 HD3 PRO A 5 14.642 6.547 5.742 1.00 0.00 H new ATOM 83 N GLN A 6 15.055 9.129 1.191 1.00 0.00 N ATOM 84 CA GLN A 6 14.374 10.026 0.215 1.00 0.00 C ATOM 85 C GLN A 6 12.853 9.947 0.381 1.00 0.00 C ATOM 86 O GLN A 6 12.219 9.001 -0.040 1.00 0.00 O ATOM 87 CB GLN A 6 14.748 9.601 -1.207 1.00 0.00 C ATOM 88 CG GLN A 6 14.020 10.494 -2.214 1.00 0.00 C ATOM 89 CD GLN A 6 14.596 10.261 -3.612 1.00 0.00 C ATOM 90 OE1 GLN A 6 15.153 9.216 -3.886 1.00 0.00 O ATOM 91 NE2 GLN A 6 14.485 11.197 -4.515 1.00 0.00 N ATOM 0 H GLN A 6 15.542 8.332 0.780 1.00 0.00 H new ATOM 0 HA GLN A 6 14.695 11.052 0.398 1.00 0.00 H new ATOM 0 HB2 GLN A 6 15.826 9.678 -1.349 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.479 8.557 -1.369 1.00 0.00 H new ATOM 0 HG2 GLN A 6 12.953 10.273 -2.207 1.00 0.00 H new ATOM 0 HG3 GLN A 6 14.130 11.542 -1.934 1.00 0.00 H new ATOM 0 HE21 GLN A 6 14.018 12.074 -4.286 1.00 0.00 H new ATOM 0 HE22 GLN A 6 14.866 11.051 -5.450 1.00 0.00 H new ATOM 100 N ILE A 7 12.265 10.958 0.966 1.00 0.00 N ATOM 101 CA ILE A 7 10.781 10.989 1.143 1.00 0.00 C ATOM 102 C ILE A 7 10.334 12.464 1.140 1.00 0.00 C ATOM 103 O ILE A 7 10.382 13.123 2.160 1.00 0.00 O ATOM 104 CB ILE A 7 10.388 10.353 2.488 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.048 8.976 2.639 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.865 10.185 2.539 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.474 8.255 3.868 1.00 0.00 C ATOM 0 H ILE A 7 12.755 11.774 1.333 1.00 0.00 H new ATOM 0 HA ILE A 7 10.303 10.430 0.338 1.00 0.00 H new ATOM 0 HB ILE A 7 10.724 11.001 3.298 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.876 8.380 1.743 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.127 9.089 2.744 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.580 9.735 3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.388 11.160 2.442 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.542 9.540 1.721 1.00 0.00 H new ATOM 0 HD11 ILE A 7 10.946 7.278 3.970 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.669 8.848 4.762 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.398 8.127 3.745 1.00 0.00 H new ATOM 119 N PRO A 8 9.917 12.991 0.007 1.00 0.00 N ATOM 120 CA PRO A 8 9.478 14.419 -0.100 1.00 0.00 C ATOM 121 C PRO A 8 8.531 14.839 1.031 1.00 0.00 C ATOM 122 O PRO A 8 7.421 14.359 1.136 1.00 0.00 O ATOM 123 CB PRO A 8 8.769 14.473 -1.457 1.00 0.00 C ATOM 124 CG PRO A 8 9.444 13.421 -2.275 1.00 0.00 C ATOM 125 CD PRO A 8 9.813 12.301 -1.297 1.00 0.00 C ATOM 0 HA PRO A 8 10.319 15.107 -0.018 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.702 14.273 -1.356 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.867 15.456 -1.917 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.783 13.052 -3.060 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.332 13.818 -2.767 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.052 11.521 -1.277 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.753 11.823 -1.573 1.00 0.00 H new ATOM 133 N LYS A 9 8.958 15.740 1.871 1.00 0.00 N ATOM 134 CA LYS A 9 8.079 16.193 2.984 1.00 0.00 C ATOM 135 C LYS A 9 6.801 16.800 2.402 1.00 0.00 C ATOM 136 O LYS A 9 5.845 17.057 3.106 1.00 0.00 O ATOM 137 CB LYS A 9 8.811 17.249 3.816 1.00 0.00 C ATOM 138 CG LYS A 9 9.195 18.428 2.919 1.00 0.00 C ATOM 139 CD LYS A 9 10.228 19.300 3.636 1.00 0.00 C ATOM 140 CE LYS A 9 10.540 20.530 2.780 1.00 0.00 C ATOM 141 NZ LYS A 9 10.885 20.097 1.396 1.00 0.00 N ATOM 0 H LYS A 9 9.877 16.182 1.835 1.00 0.00 H new ATOM 0 HA LYS A 9 7.826 15.344 3.619 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.174 17.591 4.632 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.703 16.817 4.269 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.603 18.064 1.976 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.311 19.018 2.677 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.846 19.608 4.609 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.139 18.729 3.817 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.680 21.200 2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.369 21.089 3.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.383 20.867 0.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.499 19.259 1.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.014 19.863 0.878 1.00 0.00 H new ATOM 155 N ASP A 10 6.778 17.029 1.118 1.00 0.00 N ATOM 156 CA ASP A 10 5.566 17.617 0.483 1.00 0.00 C ATOM 157 C ASP A 10 4.494 16.533 0.334 1.00 0.00 C ATOM 158 O ASP A 10 4.539 15.719 -0.568 1.00 0.00 O ATOM 159 CB ASP A 10 5.939 18.171 -0.896 1.00 0.00 C ATOM 160 CG ASP A 10 6.642 19.521 -0.735 1.00 0.00 C ATOM 161 OD1 ASP A 10 6.973 19.864 0.388 1.00 0.00 O ATOM 162 OD2 ASP A 10 6.838 20.188 -1.737 1.00 0.00 O ATOM 0 H ASP A 10 7.549 16.833 0.480 1.00 0.00 H new ATOM 0 HA ASP A 10 5.177 18.424 1.104 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.591 17.470 -1.416 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.044 18.287 -1.507 1.00 0.00 H new ATOM 167 N LYS A 11 3.535 16.516 1.216 1.00 0.00 N ATOM 168 CA LYS A 11 2.459 15.489 1.141 1.00 0.00 C ATOM 169 C LYS A 11 1.719 15.591 -0.195 1.00 0.00 C ATOM 170 O LYS A 11 0.790 14.851 -0.451 1.00 0.00 O ATOM 171 CB LYS A 11 1.476 15.717 2.289 1.00 0.00 C ATOM 172 CG LYS A 11 2.244 15.812 3.633 1.00 0.00 C ATOM 173 CD LYS A 11 1.465 15.103 4.748 1.00 0.00 C ATOM 174 CE LYS A 11 0.153 15.846 5.026 1.00 0.00 C ATOM 175 NZ LYS A 11 -0.845 15.512 3.970 1.00 0.00 N ATOM 0 H LYS A 11 3.450 17.174 1.991 1.00 0.00 H new ATOM 0 HA LYS A 11 2.902 14.496 1.219 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.911 16.633 2.118 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.755 14.900 2.329 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.231 15.361 3.527 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.398 16.858 3.897 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.255 14.073 4.458 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.068 15.062 5.655 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.233 15.568 6.007 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.330 16.921 5.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.798 15.494 4.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.809 16.230 3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.625 14.579 3.567 1.00 0.00 H new ATOM 189 N SER A 12 2.118 16.504 -1.049 1.00 0.00 N ATOM 190 CA SER A 12 1.439 16.669 -2.376 1.00 0.00 C ATOM 191 C SER A 12 2.466 16.512 -3.499 1.00 0.00 C ATOM 192 O SER A 12 2.427 17.215 -4.489 1.00 0.00 O ATOM 193 CB SER A 12 0.817 18.063 -2.453 1.00 0.00 C ATOM 194 OG SER A 12 -0.117 18.220 -1.393 1.00 0.00 O ATOM 0 H SER A 12 2.892 17.148 -0.883 1.00 0.00 H new ATOM 0 HA SER A 12 0.663 15.912 -2.485 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.594 18.825 -2.384 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.321 18.200 -3.414 1.00 0.00 H new ATOM 0 HG SER A 12 -0.516 19.114 -1.439 1.00 0.00 H new ATOM 200 N LYS A 13 3.381 15.587 -3.356 1.00 0.00 N ATOM 201 CA LYS A 13 4.420 15.369 -4.413 1.00 0.00 C ATOM 202 C LYS A 13 4.697 13.869 -4.526 1.00 0.00 C ATOM 203 O LYS A 13 4.687 13.150 -3.548 1.00 0.00 O ATOM 204 CB LYS A 13 5.723 16.091 -4.029 1.00 0.00 C ATOM 205 CG LYS A 13 5.584 17.611 -4.242 1.00 0.00 C ATOM 206 CD LYS A 13 5.869 17.979 -5.712 1.00 0.00 C ATOM 207 CE LYS A 13 5.144 19.280 -6.071 1.00 0.00 C ATOM 208 NZ LYS A 13 5.433 19.635 -7.489 1.00 0.00 N ATOM 0 H LYS A 13 3.455 14.969 -2.548 1.00 0.00 H new ATOM 0 HA LYS A 13 4.059 15.763 -5.363 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.966 15.885 -2.986 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.548 15.708 -4.630 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.579 17.932 -3.969 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.276 18.141 -3.588 1.00 0.00 H new ATOM 0 HD2 LYS A 13 6.942 18.095 -5.866 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.538 17.174 -6.369 1.00 0.00 H new ATOM 0 HE2 LYS A 13 4.070 19.162 -5.926 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.469 20.084 -5.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.941 20.518 -7.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.458 19.764 -7.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.102 18.871 -8.112 1.00 0.00 H new ATOM 222 N VAL A 14 4.937 13.387 -5.714 1.00 0.00 N ATOM 223 CA VAL A 14 5.204 11.932 -5.886 1.00 0.00 C ATOM 224 C VAL A 14 6.408 11.509 -5.045 1.00 0.00 C ATOM 225 O VAL A 14 7.276 12.299 -4.731 1.00 0.00 O ATOM 226 CB VAL A 14 5.497 11.629 -7.355 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.770 10.131 -7.518 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.292 12.024 -8.213 1.00 0.00 C ATOM 0 H VAL A 14 4.960 13.938 -6.572 1.00 0.00 H new ATOM 0 HA VAL A 14 4.323 11.379 -5.561 1.00 0.00 H new ATOM 0 HB VAL A 14 6.370 12.198 -7.676 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.979 9.911 -8.565 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.629 9.849 -6.909 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.896 9.565 -7.196 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.504 11.807 -9.260 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.417 11.457 -7.895 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.096 13.090 -8.096 1.00 0.00 H new ATOM 238 N ALA A 15 6.467 10.252 -4.694 1.00 0.00 N ATOM 239 CA ALA A 15 7.610 9.730 -3.888 1.00 0.00 C ATOM 240 C ALA A 15 7.961 8.331 -4.398 1.00 0.00 C ATOM 241 O ALA A 15 8.783 7.638 -3.833 1.00 0.00 O ATOM 242 CB ALA A 15 7.207 9.649 -2.414 1.00 0.00 C ATOM 0 H ALA A 15 5.762 9.555 -4.935 1.00 0.00 H new ATOM 0 HA ALA A 15 8.469 10.394 -3.985 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.044 9.268 -1.829 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.936 10.642 -2.056 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.354 8.979 -2.306 1.00 0.00 H new ATOM 248 N GLY A 16 7.339 7.915 -5.470 1.00 0.00 N ATOM 249 CA GLY A 16 7.627 6.565 -6.029 1.00 0.00 C ATOM 250 C GLY A 16 6.503 6.154 -6.985 1.00 0.00 C ATOM 251 O GLY A 16 5.622 6.935 -7.294 1.00 0.00 O ATOM 0 H GLY A 16 6.642 8.455 -5.983 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.581 6.575 -6.556 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.716 5.838 -5.222 1.00 0.00 H new ATOM 255 N TYR A 17 6.526 4.932 -7.454 1.00 0.00 N ATOM 256 CA TYR A 17 5.465 4.464 -8.395 1.00 0.00 C ATOM 257 C TYR A 17 5.189 2.980 -8.163 1.00 0.00 C ATOM 258 O TYR A 17 6.082 2.159 -8.220 1.00 0.00 O ATOM 259 CB TYR A 17 5.938 4.648 -9.841 1.00 0.00 C ATOM 260 CG TYR A 17 6.262 6.099 -10.105 1.00 0.00 C ATOM 261 CD1 TYR A 17 7.538 6.595 -9.818 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.289 6.943 -10.651 1.00 0.00 C ATOM 263 CE1 TYR A 17 7.842 7.937 -10.076 1.00 0.00 C ATOM 264 CE2 TYR A 17 5.591 8.285 -10.908 1.00 0.00 C ATOM 265 CZ TYR A 17 6.869 8.783 -10.621 1.00 0.00 C ATOM 266 OH TYR A 17 7.168 10.105 -10.877 1.00 0.00 O ATOM 0 H TYR A 17 7.236 4.237 -7.225 1.00 0.00 H new ATOM 0 HA TYR A 17 4.560 5.045 -8.221 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.819 4.032 -10.024 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.164 4.310 -10.530 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.289 5.943 -9.397 1.00 0.00 H new ATOM 0 HD2 TYR A 17 4.305 6.559 -10.874 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.827 8.320 -9.855 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.839 8.937 -11.328 1.00 0.00 H new ATOM 0 HH TYR A 17 6.382 10.551 -11.255 1.00 0.00 H new ATOM 276 N ILE A 18 3.952 2.624 -7.923 1.00 0.00 N ATOM 277 CA ILE A 18 3.619 1.184 -7.713 1.00 0.00 C ATOM 278 C ILE A 18 3.159 0.611 -9.054 1.00 0.00 C ATOM 279 O ILE A 18 2.530 1.293 -9.837 1.00 0.00 O ATOM 280 CB ILE A 18 2.495 1.063 -6.674 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.268 -0.416 -6.324 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.200 1.649 -7.239 1.00 0.00 C ATOM 283 CD1 ILE A 18 3.452 -0.971 -5.515 1.00 0.00 C ATOM 0 H ILE A 18 3.162 3.266 -7.864 1.00 0.00 H new ATOM 0 HA ILE A 18 4.487 0.636 -7.347 1.00 0.00 H new ATOM 0 HB ILE A 18 2.783 1.612 -5.777 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.347 -0.522 -5.750 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.142 -0.996 -7.238 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.406 1.560 -6.497 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.352 2.700 -7.483 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.917 1.105 -8.140 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.271 -2.019 -5.278 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.366 -0.885 -6.102 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.559 -0.403 -4.591 1.00 0.00 H new ATOM 295 N GLU A 19 3.478 -0.625 -9.345 1.00 0.00 N ATOM 296 CA GLU A 19 3.062 -1.203 -10.660 1.00 0.00 C ATOM 297 C GLU A 19 2.771 -2.695 -10.522 1.00 0.00 C ATOM 298 O GLU A 19 3.568 -3.455 -10.009 1.00 0.00 O ATOM 299 CB GLU A 19 4.188 -1.007 -11.673 1.00 0.00 C ATOM 300 CG GLU A 19 3.724 -1.485 -13.050 1.00 0.00 C ATOM 301 CD GLU A 19 4.800 -1.167 -14.089 1.00 0.00 C ATOM 302 OE1 GLU A 19 4.994 0.003 -14.373 1.00 0.00 O ATOM 303 OE2 GLU A 19 5.410 -2.100 -14.584 1.00 0.00 O ATOM 0 H GLU A 19 4.003 -1.253 -8.737 1.00 0.00 H new ATOM 0 HA GLU A 19 2.158 -0.696 -10.996 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.472 0.044 -11.718 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.072 -1.563 -11.362 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.530 -2.557 -13.028 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.787 -0.997 -13.320 1.00 0.00 H new ATOM 310 N ILE A 20 1.625 -3.118 -10.995 1.00 0.00 N ATOM 311 CA ILE A 20 1.247 -4.559 -10.919 1.00 0.00 C ATOM 312 C ILE A 20 0.445 -4.915 -12.190 1.00 0.00 C ATOM 313 O ILE A 20 -0.529 -4.256 -12.497 1.00 0.00 O ATOM 314 CB ILE A 20 0.373 -4.779 -9.668 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.273 -4.845 -8.430 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.413 -6.096 -9.788 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.422 -4.836 -7.161 1.00 0.00 C ATOM 0 H ILE A 20 0.928 -2.517 -11.435 1.00 0.00 H new ATOM 0 HA ILE A 20 2.133 -5.190 -10.852 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.331 -3.951 -9.579 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.883 -5.748 -8.462 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.958 -3.998 -8.424 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -1.025 -6.237 -8.897 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.056 -6.057 -10.667 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.284 -6.928 -9.884 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.072 -4.883 -6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.168 -3.920 -7.125 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -0.245 -5.698 -7.164 1.00 0.00 H new ATOM 329 N PRO A 21 0.823 -5.941 -12.925 1.00 0.00 N ATOM 330 CA PRO A 21 0.083 -6.336 -14.157 1.00 0.00 C ATOM 331 C PRO A 21 -1.213 -7.081 -13.816 1.00 0.00 C ATOM 332 O PRO A 21 -2.250 -6.849 -14.408 1.00 0.00 O ATOM 333 CB PRO A 21 1.069 -7.251 -14.890 1.00 0.00 C ATOM 334 CG PRO A 21 1.881 -7.879 -13.803 1.00 0.00 C ATOM 335 CD PRO A 21 1.978 -6.835 -12.683 1.00 0.00 C ATOM 0 HA PRO A 21 -0.226 -5.479 -14.755 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.547 -8.004 -15.480 1.00 0.00 H new ATOM 0 HB3 PRO A 21 1.698 -6.686 -15.578 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.409 -8.793 -13.443 1.00 0.00 H new ATOM 0 HG3 PRO A 21 2.871 -8.153 -14.166 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.924 -7.300 -11.699 1.00 0.00 H new ATOM 0 HD3 PRO A 21 2.921 -6.290 -12.726 1.00 0.00 H new ATOM 343 N ASP A 22 -1.163 -7.967 -12.860 1.00 0.00 N ATOM 344 CA ASP A 22 -2.390 -8.718 -12.473 1.00 0.00 C ATOM 345 C ASP A 22 -3.514 -7.724 -12.183 1.00 0.00 C ATOM 346 O ASP A 22 -4.668 -8.091 -12.074 1.00 0.00 O ATOM 347 CB ASP A 22 -2.109 -9.552 -11.223 1.00 0.00 C ATOM 348 CG ASP A 22 -1.135 -10.680 -11.570 1.00 0.00 C ATOM 349 OD1 ASP A 22 -1.552 -11.611 -12.240 1.00 0.00 O ATOM 350 OD2 ASP A 22 0.011 -10.593 -11.160 1.00 0.00 O ATOM 0 H ASP A 22 -0.324 -8.204 -12.330 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.686 -9.381 -13.286 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.688 -8.922 -10.440 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -3.039 -9.967 -10.833 1.00 0.00 H new ATOM 355 N ALA A 23 -3.182 -6.463 -12.056 1.00 0.00 N ATOM 356 CA ALA A 23 -4.216 -5.421 -11.769 1.00 0.00 C ATOM 357 C ALA A 23 -3.987 -4.224 -12.698 1.00 0.00 C ATOM 358 O ALA A 23 -4.576 -3.175 -12.528 1.00 0.00 O ATOM 359 CB ALA A 23 -4.081 -4.972 -10.313 1.00 0.00 C ATOM 0 H ALA A 23 -2.230 -6.108 -12.140 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.214 -5.827 -11.934 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.832 -4.212 -10.096 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.229 -5.827 -9.653 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.086 -4.556 -10.151 1.00 0.00 H new ATOM 365 N ASP A 24 -3.131 -4.383 -13.682 1.00 0.00 N ATOM 366 CA ASP A 24 -2.842 -3.273 -14.647 1.00 0.00 C ATOM 367 C ASP A 24 -2.744 -1.940 -13.902 1.00 0.00 C ATOM 368 O ASP A 24 -3.218 -0.921 -14.361 1.00 0.00 O ATOM 369 CB ASP A 24 -3.952 -3.197 -15.703 1.00 0.00 C ATOM 370 CG ASP A 24 -5.322 -3.227 -15.025 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.693 -2.224 -14.438 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.978 -4.253 -15.103 1.00 0.00 O ATOM 0 H ASP A 24 -2.615 -5.245 -13.859 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.891 -3.474 -15.140 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.847 -2.283 -16.288 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.862 -4.032 -16.397 1.00 0.00 H new ATOM 377 N ILE A 25 -2.137 -1.949 -12.746 1.00 0.00 N ATOM 378 CA ILE A 25 -2.003 -0.695 -11.944 1.00 0.00 C ATOM 379 C ILE A 25 -0.651 -0.030 -12.231 1.00 0.00 C ATOM 380 O ILE A 25 0.346 -0.679 -12.468 1.00 0.00 O ATOM 381 CB ILE A 25 -2.148 -1.058 -10.450 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.634 -1.043 -10.077 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.391 -0.065 -9.555 1.00 0.00 C ATOM 384 CD1 ILE A 25 -3.827 -1.715 -8.724 1.00 0.00 C ATOM 0 H ILE A 25 -1.724 -2.778 -12.318 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.781 0.019 -12.216 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.722 -2.049 -10.293 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.000 -0.017 -10.040 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.216 -1.562 -10.839 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.514 -0.350 -8.510 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.332 -0.078 -9.812 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.789 0.938 -9.707 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.884 -1.704 -8.460 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.477 -2.746 -8.777 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.258 -1.177 -7.966 1.00 0.00 H new ATOM 396 N LYS A 26 -0.637 1.274 -12.201 1.00 0.00 N ATOM 397 CA LYS A 26 0.611 2.043 -12.454 1.00 0.00 C ATOM 398 C LYS A 26 0.352 3.478 -12.000 1.00 0.00 C ATOM 399 O LYS A 26 -0.026 4.322 -12.787 1.00 0.00 O ATOM 400 CB LYS A 26 0.938 2.025 -13.949 1.00 0.00 C ATOM 401 CG LYS A 26 2.270 2.738 -14.191 1.00 0.00 C ATOM 402 CD LYS A 26 2.785 2.402 -15.595 1.00 0.00 C ATOM 403 CE LYS A 26 1.821 2.955 -16.651 1.00 0.00 C ATOM 404 NZ LYS A 26 0.651 2.042 -16.784 1.00 0.00 N ATOM 0 H LYS A 26 -1.457 1.850 -12.007 1.00 0.00 H new ATOM 0 HA LYS A 26 1.452 1.608 -11.915 1.00 0.00 H new ATOM 0 HB2 LYS A 26 0.994 0.997 -14.307 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.144 2.516 -14.511 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.141 3.815 -14.088 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.000 2.431 -13.442 1.00 0.00 H new ATOM 0 HD2 LYS A 26 3.778 2.827 -15.739 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.881 1.322 -15.708 1.00 0.00 H new ATOM 0 HE2 LYS A 26 1.487 3.953 -16.366 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.331 3.051 -17.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.495 1.821 -17.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.836 1.163 -16.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.196 2.504 -16.396 1.00 0.00 H new ATOM 418 N GLU A 27 0.498 3.749 -10.727 1.00 0.00 N ATOM 419 CA GLU A 27 0.197 5.120 -10.211 1.00 0.00 C ATOM 420 C GLU A 27 1.241 5.546 -9.156 1.00 0.00 C ATOM 421 O GLU A 27 1.909 4.718 -8.570 1.00 0.00 O ATOM 422 CB GLU A 27 -1.194 5.051 -9.563 1.00 0.00 C ATOM 423 CG GLU A 27 -2.284 5.351 -10.603 1.00 0.00 C ATOM 424 CD GLU A 27 -2.360 6.857 -10.854 1.00 0.00 C ATOM 425 OE1 GLU A 27 -1.551 7.351 -11.623 1.00 0.00 O ATOM 426 OE2 GLU A 27 -3.225 7.491 -10.272 1.00 0.00 O ATOM 0 H GLU A 27 0.812 3.081 -10.023 1.00 0.00 H new ATOM 0 HA GLU A 27 0.227 5.850 -11.020 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.354 4.062 -9.134 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.257 5.767 -8.744 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.065 4.829 -11.534 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.247 4.983 -10.250 1.00 0.00 H new ATOM 433 N PRO A 28 1.372 6.839 -8.911 1.00 0.00 N ATOM 434 CA PRO A 28 2.337 7.383 -7.905 1.00 0.00 C ATOM 435 C PRO A 28 1.804 7.291 -6.466 1.00 0.00 C ATOM 436 O PRO A 28 0.620 7.148 -6.239 1.00 0.00 O ATOM 437 CB PRO A 28 2.480 8.847 -8.326 1.00 0.00 C ATOM 438 CG PRO A 28 1.139 9.201 -8.873 1.00 0.00 C ATOM 439 CD PRO A 28 0.622 7.934 -9.568 1.00 0.00 C ATOM 0 HA PRO A 28 3.274 6.826 -7.893 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.745 9.481 -7.480 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.262 8.972 -9.075 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.463 9.514 -8.078 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.210 10.031 -9.576 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.454 7.817 -9.437 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.811 7.961 -10.641 1.00 0.00 H new ATOM 447 N VAL A 29 2.682 7.383 -5.497 1.00 0.00 N ATOM 448 CA VAL A 29 2.253 7.314 -4.063 1.00 0.00 C ATOM 449 C VAL A 29 3.012 8.382 -3.261 1.00 0.00 C ATOM 450 O VAL A 29 4.214 8.303 -3.103 1.00 0.00 O ATOM 451 CB VAL A 29 2.587 5.922 -3.512 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.787 5.660 -2.233 1.00 0.00 C ATOM 453 CG2 VAL A 29 2.233 4.864 -4.562 1.00 0.00 C ATOM 0 H VAL A 29 3.685 7.504 -5.638 1.00 0.00 H new ATOM 0 HA VAL A 29 1.181 7.493 -3.982 1.00 0.00 H new ATOM 0 HB VAL A 29 3.651 5.872 -3.283 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.030 4.670 -1.848 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.040 6.412 -1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.721 5.712 -2.454 1.00 0.00 H new ATOM 0 HG21 VAL A 29 2.469 3.873 -4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.169 4.920 -4.791 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.809 5.045 -5.469 1.00 0.00 H new ATOM 463 N TYR A 30 2.332 9.385 -2.753 1.00 0.00 N ATOM 464 CA TYR A 30 3.052 10.443 -1.971 1.00 0.00 C ATOM 465 C TYR A 30 3.277 9.945 -0.538 1.00 0.00 C ATOM 466 O TYR A 30 2.742 8.929 -0.142 1.00 0.00 O ATOM 467 CB TYR A 30 2.232 11.761 -1.932 1.00 0.00 C ATOM 468 CG TYR A 30 1.108 11.716 -2.932 1.00 0.00 C ATOM 469 CD1 TYR A 30 -0.139 11.200 -2.559 1.00 0.00 C ATOM 470 CD2 TYR A 30 1.310 12.205 -4.224 1.00 0.00 C ATOM 471 CE1 TYR A 30 -1.187 11.169 -3.484 1.00 0.00 C ATOM 472 CE2 TYR A 30 0.266 12.176 -5.150 1.00 0.00 C ATOM 473 CZ TYR A 30 -0.982 11.659 -4.782 1.00 0.00 C ATOM 474 OH TYR A 30 -2.006 11.629 -5.702 1.00 0.00 O ATOM 0 H TYR A 30 1.325 9.516 -2.844 1.00 0.00 H new ATOM 0 HA TYR A 30 4.007 10.644 -2.457 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.829 11.915 -0.931 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.884 12.608 -2.147 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.291 10.826 -1.557 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.273 12.605 -4.507 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.150 10.770 -3.200 1.00 0.00 H new ATOM 0 HE2 TYR A 30 0.421 12.552 -6.150 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.695 12.008 -6.551 1.00 0.00 H new ATOM 484 N PRO A 31 4.046 10.665 0.245 1.00 0.00 N ATOM 485 CA PRO A 31 4.315 10.298 1.651 1.00 0.00 C ATOM 486 C PRO A 31 3.373 11.014 2.621 1.00 0.00 C ATOM 487 O PRO A 31 3.108 12.193 2.486 1.00 0.00 O ATOM 488 CB PRO A 31 5.744 10.782 1.831 1.00 0.00 C ATOM 489 CG PRO A 31 5.805 12.051 1.032 1.00 0.00 C ATOM 490 CD PRO A 31 4.765 11.906 -0.102 1.00 0.00 C ATOM 0 HA PRO A 31 4.169 9.237 1.855 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.975 10.961 2.881 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.462 10.047 1.467 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.579 12.915 1.658 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.804 12.205 0.625 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.092 12.762 -0.141 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.244 11.833 -1.078 1.00 0.00 H new ATOM 498 N GLY A 32 2.864 10.315 3.598 1.00 0.00 N ATOM 499 CA GLY A 32 1.941 10.966 4.572 1.00 0.00 C ATOM 500 C GLY A 32 0.984 9.926 5.155 1.00 0.00 C ATOM 501 O GLY A 32 0.952 8.789 4.726 1.00 0.00 O ATOM 0 H GLY A 32 3.046 9.325 3.764 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.514 11.435 5.372 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.376 11.757 4.079 1.00 0.00 H new ATOM 505 N PRO A 33 0.201 10.324 6.121 1.00 0.00 N ATOM 506 CA PRO A 33 -0.792 9.426 6.775 1.00 0.00 C ATOM 507 C PRO A 33 -1.963 9.137 5.836 1.00 0.00 C ATOM 508 O PRO A 33 -2.694 10.027 5.458 1.00 0.00 O ATOM 509 CB PRO A 33 -1.246 10.222 8.008 1.00 0.00 C ATOM 510 CG PRO A 33 -1.029 11.657 7.641 1.00 0.00 C ATOM 511 CD PRO A 33 0.177 11.680 6.694 1.00 0.00 C ATOM 0 HA PRO A 33 -0.379 8.452 7.037 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.293 10.028 8.240 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.668 9.948 8.890 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.912 12.072 7.156 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.839 12.261 8.528 1.00 0.00 H new ATOM 0 HD2 PRO A 33 0.063 12.439 5.920 1.00 0.00 H new ATOM 0 HD3 PRO A 33 1.100 11.905 7.228 1.00 0.00 H new ATOM 519 N ALA A 34 -2.126 7.905 5.441 1.00 0.00 N ATOM 520 CA ALA A 34 -3.238 7.560 4.502 1.00 0.00 C ATOM 521 C ALA A 34 -4.552 8.204 4.957 1.00 0.00 C ATOM 522 O ALA A 34 -5.347 7.594 5.646 1.00 0.00 O ATOM 523 CB ALA A 34 -3.410 6.038 4.440 1.00 0.00 C ATOM 0 H ALA A 34 -1.540 7.120 5.726 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.985 7.942 3.513 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.221 5.791 3.755 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.485 5.581 4.087 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.646 5.658 5.434 1.00 0.00 H new ATOM 529 N THR A 35 -4.793 9.424 4.551 1.00 0.00 N ATOM 530 CA THR A 35 -6.063 10.126 4.920 1.00 0.00 C ATOM 531 C THR A 35 -6.927 10.232 3.654 1.00 0.00 C ATOM 532 O THR A 35 -6.410 10.257 2.555 1.00 0.00 O ATOM 533 CB THR A 35 -5.734 11.532 5.441 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.660 12.072 4.684 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.327 11.458 6.915 1.00 0.00 C ATOM 0 H THR A 35 -4.157 9.972 3.972 1.00 0.00 H new ATOM 0 HA THR A 35 -6.595 9.577 5.697 1.00 0.00 H new ATOM 0 HB THR A 35 -6.614 12.168 5.342 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.448 12.971 5.012 1.00 0.00 H new ATOM 0 HG21 THR A 35 -5.095 12.459 7.279 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.148 11.041 7.499 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.448 10.821 7.018 1.00 0.00 H new ATOM 543 N PRO A 36 -8.229 10.288 3.791 1.00 0.00 N ATOM 544 CA PRO A 36 -9.147 10.385 2.616 1.00 0.00 C ATOM 545 C PRO A 36 -8.943 11.684 1.829 1.00 0.00 C ATOM 546 O PRO A 36 -8.914 11.683 0.615 1.00 0.00 O ATOM 547 CB PRO A 36 -10.556 10.318 3.236 1.00 0.00 C ATOM 548 CG PRO A 36 -10.375 10.732 4.662 1.00 0.00 C ATOM 549 CD PRO A 36 -8.973 10.269 5.063 1.00 0.00 C ATOM 0 HA PRO A 36 -8.968 9.591 1.891 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.247 10.983 2.717 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -10.969 9.312 3.167 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.475 11.812 4.770 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.133 10.277 5.299 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.525 10.936 5.800 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.990 9.272 5.504 1.00 0.00 H new ATOM 557 N GLU A 37 -8.799 12.789 2.503 1.00 0.00 N ATOM 558 CA GLU A 37 -8.597 14.072 1.777 1.00 0.00 C ATOM 559 C GLU A 37 -7.288 14.012 0.987 1.00 0.00 C ATOM 560 O GLU A 37 -7.130 14.670 -0.023 1.00 0.00 O ATOM 561 CB GLU A 37 -8.539 15.226 2.779 1.00 0.00 C ATOM 562 CG GLU A 37 -7.381 15.000 3.752 1.00 0.00 C ATOM 563 CD GLU A 37 -7.426 16.059 4.854 1.00 0.00 C ATOM 564 OE1 GLU A 37 -8.418 16.106 5.562 1.00 0.00 O ATOM 565 OE2 GLU A 37 -6.467 16.805 4.971 1.00 0.00 O ATOM 0 H GLU A 37 -8.812 12.860 3.520 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.428 14.233 1.090 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.407 16.172 2.253 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.479 15.294 3.326 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.448 14.003 4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.430 15.053 3.221 1.00 0.00 H new ATOM 572 N GLN A 38 -6.344 13.229 1.440 1.00 0.00 N ATOM 573 CA GLN A 38 -5.041 13.129 0.718 1.00 0.00 C ATOM 574 C GLN A 38 -5.162 12.107 -0.420 1.00 0.00 C ATOM 575 O GLN A 38 -5.039 12.442 -1.580 1.00 0.00 O ATOM 576 CB GLN A 38 -3.946 12.691 1.706 1.00 0.00 C ATOM 577 CG GLN A 38 -2.569 13.136 1.202 1.00 0.00 C ATOM 578 CD GLN A 38 -2.346 12.616 -0.218 1.00 0.00 C ATOM 579 OE1 GLN A 38 -1.942 13.356 -1.093 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.596 11.364 -0.488 1.00 0.00 N ATOM 0 H GLN A 38 -6.419 12.654 2.279 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.778 14.099 0.296 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.139 13.123 2.688 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -3.965 11.608 1.824 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.500 14.224 1.216 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.790 12.759 1.864 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.935 10.742 0.246 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.452 11.007 -1.433 1.00 0.00 H new ATOM 589 N LEU A 39 -5.399 10.861 -0.098 1.00 0.00 N ATOM 590 CA LEU A 39 -5.524 9.824 -1.162 1.00 0.00 C ATOM 591 C LEU A 39 -6.454 10.332 -2.261 1.00 0.00 C ATOM 592 O LEU A 39 -6.506 9.785 -3.343 1.00 0.00 O ATOM 593 CB LEU A 39 -6.106 8.536 -0.575 1.00 0.00 C ATOM 594 CG LEU A 39 -5.272 8.067 0.629 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.098 7.099 1.480 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.003 7.354 0.144 1.00 0.00 C ATOM 0 H LEU A 39 -5.511 10.518 0.856 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.536 9.620 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.138 8.704 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.124 7.758 -1.338 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.993 8.936 1.225 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.505 6.768 2.333 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.996 7.603 1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.381 6.236 0.878 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.419 7.026 1.004 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.280 6.489 -0.459 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.408 8.040 -0.458 1.00 0.00 H new ATOM 608 N ASN A 40 -7.179 11.383 -2.003 1.00 0.00 N ATOM 609 CA ASN A 40 -8.086 11.918 -3.049 1.00 0.00 C ATOM 610 C ASN A 40 -7.234 12.276 -4.255 1.00 0.00 C ATOM 611 O ASN A 40 -7.674 12.244 -5.386 1.00 0.00 O ATOM 612 CB ASN A 40 -8.767 13.185 -2.535 1.00 0.00 C ATOM 613 CG ASN A 40 -9.893 12.835 -1.563 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.468 13.709 -0.944 1.00 0.00 O ATOM 615 ND2 ASN A 40 -10.239 11.593 -1.401 1.00 0.00 N ATOM 0 H ASN A 40 -7.182 11.891 -1.118 1.00 0.00 H new ATOM 0 HA ASN A 40 -8.846 11.181 -3.308 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.035 13.821 -2.038 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.167 13.755 -3.374 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -10.992 11.353 -0.756 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -9.758 10.858 -1.919 1.00 0.00 H new ATOM 622 N ARG A 41 -6.006 12.605 -4.005 1.00 0.00 N ATOM 623 CA ARG A 41 -5.086 12.962 -5.110 1.00 0.00 C ATOM 624 C ARG A 41 -4.583 11.676 -5.757 1.00 0.00 C ATOM 625 O ARG A 41 -4.079 11.681 -6.862 1.00 0.00 O ATOM 626 CB ARG A 41 -3.900 13.750 -4.548 1.00 0.00 C ATOM 627 CG ARG A 41 -4.338 15.187 -4.223 1.00 0.00 C ATOM 628 CD ARG A 41 -3.368 15.807 -3.211 1.00 0.00 C ATOM 629 NE ARG A 41 -3.894 17.133 -2.742 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.150 18.107 -3.576 1.00 0.00 C ATOM 631 NH1 ARG A 41 -3.795 18.022 -4.827 1.00 0.00 N ATOM 632 NH2 ARG A 41 -4.720 19.198 -3.139 1.00 0.00 N ATOM 0 H ARG A 41 -5.595 12.643 -3.072 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.605 13.573 -5.849 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.521 13.263 -3.649 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.085 13.763 -5.271 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -4.360 15.785 -5.134 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.350 15.186 -3.818 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.238 15.137 -2.361 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -2.387 15.936 -3.668 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.056 17.278 -1.745 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.312 17.189 -5.165 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.000 18.788 -5.468 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -4.963 19.287 -2.152 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.922 19.961 -3.784 1.00 0.00 H new ATOM 646 N GLY A 42 -4.713 10.565 -5.076 1.00 0.00 N ATOM 647 CA GLY A 42 -4.235 9.279 -5.665 1.00 0.00 C ATOM 648 C GLY A 42 -3.949 8.243 -4.569 1.00 0.00 C ATOM 649 O GLY A 42 -4.848 7.606 -4.057 1.00 0.00 O ATOM 0 H GLY A 42 -5.126 10.493 -4.146 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.986 8.889 -6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.331 9.456 -6.248 1.00 0.00 H new ATOM 653 N VAL A 43 -2.695 8.048 -4.232 1.00 0.00 N ATOM 654 CA VAL A 43 -2.326 7.024 -3.198 1.00 0.00 C ATOM 655 C VAL A 43 -1.288 7.603 -2.224 1.00 0.00 C ATOM 656 O VAL A 43 -0.541 8.503 -2.554 1.00 0.00 O ATOM 657 CB VAL A 43 -1.721 5.815 -3.923 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.664 4.598 -2.991 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.575 5.477 -5.146 1.00 0.00 C ATOM 0 H VAL A 43 -1.906 8.557 -4.631 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.211 6.733 -2.632 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.707 6.066 -4.234 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.232 3.751 -3.524 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.048 4.833 -2.123 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.672 4.344 -2.662 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.147 4.618 -5.663 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.590 5.240 -4.827 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.598 6.332 -5.821 1.00 0.00 H new ATOM 669 N SER A 44 -1.235 7.072 -1.029 1.00 0.00 N ATOM 670 CA SER A 44 -0.246 7.556 -0.017 1.00 0.00 C ATOM 671 C SER A 44 0.091 6.389 0.918 1.00 0.00 C ATOM 672 O SER A 44 -0.713 5.499 1.109 1.00 0.00 O ATOM 673 CB SER A 44 -0.859 8.700 0.793 1.00 0.00 C ATOM 674 OG SER A 44 0.162 9.349 1.538 1.00 0.00 O ATOM 0 H SER A 44 -1.840 6.317 -0.708 1.00 0.00 H new ATOM 0 HA SER A 44 0.655 7.917 -0.512 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.347 9.412 0.127 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.626 8.315 1.465 1.00 0.00 H new ATOM 0 HG SER A 44 1.020 9.245 1.076 1.00 0.00 H new ATOM 680 N PHE A 45 1.266 6.361 1.498 1.00 0.00 N ATOM 681 CA PHE A 45 1.593 5.216 2.398 1.00 0.00 C ATOM 682 C PHE A 45 0.540 5.122 3.500 1.00 0.00 C ATOM 683 O PHE A 45 -0.283 6.001 3.663 1.00 0.00 O ATOM 684 CB PHE A 45 2.963 5.390 3.067 1.00 0.00 C ATOM 685 CG PHE A 45 4.093 5.288 2.057 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.244 4.139 1.267 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.997 6.347 1.919 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.292 4.057 0.343 1.00 0.00 C ATOM 689 CE2 PHE A 45 6.044 6.265 0.998 1.00 0.00 C ATOM 690 CZ PHE A 45 6.192 5.121 0.207 1.00 0.00 C ATOM 0 H PHE A 45 1.997 7.065 1.390 1.00 0.00 H new ATOM 0 HA PHE A 45 1.610 4.314 1.787 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.005 6.359 3.565 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.092 4.629 3.837 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.551 3.317 1.372 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.885 7.232 2.528 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.407 3.172 -0.266 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.739 7.085 0.897 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.999 5.058 -0.508 1.00 0.00 H new ATOM 700 N ALA A 46 0.574 4.071 4.275 1.00 0.00 N ATOM 701 CA ALA A 46 -0.412 3.938 5.383 1.00 0.00 C ATOM 702 C ALA A 46 0.074 4.785 6.560 1.00 0.00 C ATOM 703 O ALA A 46 -0.634 4.998 7.524 1.00 0.00 O ATOM 704 CB ALA A 46 -0.536 2.462 5.801 1.00 0.00 C ATOM 0 H ALA A 46 1.239 3.303 4.188 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.394 4.283 5.059 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.259 2.373 6.612 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.871 1.870 4.950 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.434 2.097 6.138 1.00 0.00 H new ATOM 710 N GLU A 47 1.289 5.266 6.484 1.00 0.00 N ATOM 711 CA GLU A 47 1.836 6.100 7.601 1.00 0.00 C ATOM 712 C GLU A 47 2.847 7.124 7.047 1.00 0.00 C ATOM 713 O GLU A 47 3.434 6.941 5.999 1.00 0.00 O ATOM 714 CB GLU A 47 2.504 5.167 8.638 1.00 0.00 C ATOM 715 CG GLU A 47 1.711 5.160 9.954 1.00 0.00 C ATOM 716 CD GLU A 47 1.820 6.531 10.623 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.849 7.164 10.463 1.00 0.00 O ATOM 718 OE2 GLU A 47 0.873 6.924 11.283 1.00 0.00 O ATOM 0 H GLU A 47 1.925 5.119 5.700 1.00 0.00 H new ATOM 0 HA GLU A 47 1.031 6.653 8.085 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.564 4.155 8.238 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.526 5.496 8.825 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.666 4.921 9.760 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.097 4.387 10.619 1.00 0.00 H new ATOM 725 N GLU A 48 3.016 8.211 7.751 1.00 0.00 N ATOM 726 CA GLU A 48 3.944 9.298 7.308 1.00 0.00 C ATOM 727 C GLU A 48 5.415 8.846 7.268 1.00 0.00 C ATOM 728 O GLU A 48 6.147 9.190 6.361 1.00 0.00 O ATOM 729 CB GLU A 48 3.816 10.480 8.273 1.00 0.00 C ATOM 730 CG GLU A 48 4.389 10.095 9.640 1.00 0.00 C ATOM 731 CD GLU A 48 3.931 11.109 10.691 1.00 0.00 C ATOM 732 OE1 GLU A 48 3.502 12.182 10.302 1.00 0.00 O ATOM 733 OE2 GLU A 48 4.019 10.794 11.866 1.00 0.00 O ATOM 0 H GLU A 48 2.540 8.397 8.634 1.00 0.00 H new ATOM 0 HA GLU A 48 3.660 9.578 6.293 1.00 0.00 H new ATOM 0 HB2 GLU A 48 4.347 11.345 7.876 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.769 10.767 8.374 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.057 9.094 9.916 1.00 0.00 H new ATOM 0 HG3 GLU A 48 5.478 10.069 9.595 1.00 0.00 H new ATOM 740 N ASN A 49 5.875 8.125 8.258 1.00 0.00 N ATOM 741 CA ASN A 49 7.319 7.717 8.277 1.00 0.00 C ATOM 742 C ASN A 49 7.541 6.445 7.457 1.00 0.00 C ATOM 743 O ASN A 49 8.600 5.851 7.493 1.00 0.00 O ATOM 744 CB ASN A 49 7.747 7.464 9.724 1.00 0.00 C ATOM 745 CG ASN A 49 7.769 8.789 10.486 1.00 0.00 C ATOM 746 OD1 ASN A 49 6.977 9.001 11.381 1.00 0.00 O ATOM 747 ND2 ASN A 49 8.650 9.696 10.166 1.00 0.00 N ATOM 0 H ASN A 49 5.321 7.801 9.051 1.00 0.00 H new ATOM 0 HA ASN A 49 7.913 8.519 7.838 1.00 0.00 H new ATOM 0 HB2 ASN A 49 7.058 6.768 10.202 1.00 0.00 H new ATOM 0 HB3 ASN A 49 8.734 7.002 9.747 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.674 10.584 10.668 1.00 0.00 H new ATOM 0 HD22 ASN A 49 9.315 9.518 9.414 1.00 0.00 H new ATOM 754 N GLU A 50 6.561 6.028 6.720 1.00 0.00 N ATOM 755 CA GLU A 50 6.715 4.799 5.894 1.00 0.00 C ATOM 756 C GLU A 50 7.779 5.012 4.817 1.00 0.00 C ATOM 757 O GLU A 50 7.514 5.544 3.758 1.00 0.00 O ATOM 758 CB GLU A 50 5.366 4.483 5.247 1.00 0.00 C ATOM 759 CG GLU A 50 4.459 3.781 6.267 1.00 0.00 C ATOM 760 CD GLU A 50 4.760 2.279 6.291 1.00 0.00 C ATOM 761 OE1 GLU A 50 5.871 1.922 6.650 1.00 0.00 O ATOM 762 OE2 GLU A 50 3.874 1.511 5.953 1.00 0.00 O ATOM 0 H GLU A 50 5.652 6.485 6.650 1.00 0.00 H new ATOM 0 HA GLU A 50 7.033 3.967 6.522 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.895 5.402 4.897 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.510 3.846 4.374 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.615 4.207 7.258 1.00 0.00 H new ATOM 0 HG3 GLU A 50 3.413 3.946 6.010 1.00 0.00 H new ATOM 769 N SER A 51 8.979 4.581 5.083 1.00 0.00 N ATOM 770 CA SER A 51 10.078 4.727 4.088 1.00 0.00 C ATOM 771 C SER A 51 10.165 3.449 3.255 1.00 0.00 C ATOM 772 O SER A 51 9.477 2.482 3.512 1.00 0.00 O ATOM 773 CB SER A 51 11.398 4.934 4.829 1.00 0.00 C ATOM 774 OG SER A 51 11.842 3.688 5.348 1.00 0.00 O ATOM 0 H SER A 51 9.249 4.129 5.957 1.00 0.00 H new ATOM 0 HA SER A 51 9.882 5.580 3.439 1.00 0.00 H new ATOM 0 HB2 SER A 51 12.147 5.348 4.154 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.266 5.652 5.638 1.00 0.00 H new ATOM 0 HG SER A 51 12.690 3.815 5.823 1.00 0.00 H new ATOM 780 N LEU A 52 11.014 3.431 2.265 1.00 0.00 N ATOM 781 CA LEU A 52 11.151 2.208 1.428 1.00 0.00 C ATOM 782 C LEU A 52 12.034 1.210 2.180 1.00 0.00 C ATOM 783 O LEU A 52 12.152 0.060 1.803 1.00 0.00 O ATOM 784 CB LEU A 52 11.798 2.573 0.078 1.00 0.00 C ATOM 785 CG LEU A 52 12.803 3.737 0.267 1.00 0.00 C ATOM 786 CD1 LEU A 52 13.931 3.626 -0.768 1.00 0.00 C ATOM 787 CD2 LEU A 52 12.085 5.091 0.096 1.00 0.00 C ATOM 0 H LEU A 52 11.618 4.209 2.000 1.00 0.00 H new ATOM 0 HA LEU A 52 10.172 1.768 1.236 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.310 1.704 -0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.028 2.860 -0.638 1.00 0.00 H new ATOM 0 HG LEU A 52 13.223 3.677 1.271 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.634 4.447 -0.630 1.00 0.00 H new ATOM 0 HD12 LEU A 52 14.452 2.677 -0.638 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.510 3.675 -1.772 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.801 5.902 0.231 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.653 5.150 -0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 52 11.293 5.179 0.839 1.00 0.00 H new ATOM 799 N ASP A 53 12.659 1.651 3.243 1.00 0.00 N ATOM 800 CA ASP A 53 13.545 0.748 4.037 1.00 0.00 C ATOM 801 C ASP A 53 12.822 0.288 5.303 1.00 0.00 C ATOM 802 O ASP A 53 13.338 -0.509 6.062 1.00 0.00 O ATOM 803 CB ASP A 53 14.812 1.505 4.440 1.00 0.00 C ATOM 804 CG ASP A 53 15.724 1.664 3.222 1.00 0.00 C ATOM 805 OD1 ASP A 53 15.322 1.248 2.149 1.00 0.00 O ATOM 806 OD2 ASP A 53 16.808 2.199 3.385 1.00 0.00 O ATOM 0 H ASP A 53 12.592 2.605 3.597 1.00 0.00 H new ATOM 0 HA ASP A 53 13.803 -0.119 3.429 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.551 2.484 4.842 1.00 0.00 H new ATOM 0 HB3 ASP A 53 15.334 0.966 5.230 1.00 0.00 H new ATOM 811 N ASP A 54 11.638 0.780 5.552 1.00 0.00 N ATOM 812 CA ASP A 54 10.919 0.355 6.781 1.00 0.00 C ATOM 813 C ASP A 54 10.732 -1.162 6.759 1.00 0.00 C ATOM 814 O ASP A 54 10.202 -1.715 5.816 1.00 0.00 O ATOM 815 CB ASP A 54 9.552 1.043 6.839 1.00 0.00 C ATOM 816 CG ASP A 54 8.986 0.948 8.258 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.392 -0.070 8.570 1.00 0.00 O ATOM 818 OD2 ASP A 54 9.157 1.895 9.007 1.00 0.00 O ATOM 0 H ASP A 54 11.144 1.451 4.963 1.00 0.00 H new ATOM 0 HA ASP A 54 11.500 0.636 7.660 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.647 2.088 6.544 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.868 0.574 6.132 1.00 0.00 H new ATOM 823 N GLN A 55 11.169 -1.834 7.795 1.00 0.00 N ATOM 824 CA GLN A 55 11.028 -3.325 7.870 1.00 0.00 C ATOM 825 C GLN A 55 9.669 -3.751 7.304 1.00 0.00 C ATOM 826 O GLN A 55 9.497 -4.865 6.853 1.00 0.00 O ATOM 827 CB GLN A 55 11.142 -3.754 9.343 1.00 0.00 C ATOM 828 CG GLN A 55 10.692 -5.212 9.523 1.00 0.00 C ATOM 829 CD GLN A 55 11.374 -6.100 8.482 1.00 0.00 C ATOM 830 OE1 GLN A 55 12.568 -6.008 8.276 1.00 0.00 O ATOM 831 NE2 GLN A 55 10.660 -6.960 7.811 1.00 0.00 N ATOM 0 H GLN A 55 11.624 -1.409 8.603 1.00 0.00 H new ATOM 0 HA GLN A 55 11.812 -3.802 7.283 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.173 -3.642 9.680 1.00 0.00 H new ATOM 0 HB3 GLN A 55 10.531 -3.100 9.965 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.940 -5.557 10.527 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.609 -5.283 9.421 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.658 -7.037 7.985 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.104 -7.556 7.112 1.00 0.00 H new ATOM 840 N ASN A 56 8.706 -2.870 7.316 1.00 0.00 N ATOM 841 CA ASN A 56 7.365 -3.228 6.774 1.00 0.00 C ATOM 842 C ASN A 56 6.664 -1.978 6.253 1.00 0.00 C ATOM 843 O ASN A 56 6.306 -1.091 7.003 1.00 0.00 O ATOM 844 CB ASN A 56 6.526 -3.865 7.883 1.00 0.00 C ATOM 845 CG ASN A 56 5.128 -4.192 7.352 1.00 0.00 C ATOM 846 OD1 ASN A 56 4.757 -3.768 6.276 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.331 -4.936 8.069 1.00 0.00 N ATOM 0 H ASN A 56 8.790 -1.920 7.677 1.00 0.00 H new ATOM 0 HA ASN A 56 7.484 -3.935 5.953 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.010 -4.773 8.242 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.453 -3.186 8.732 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.397 -5.161 7.726 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.642 -5.292 8.973 1.00 0.00 H new ATOM 854 N ILE A 57 6.450 -1.912 4.966 1.00 0.00 N ATOM 855 CA ILE A 57 5.756 -0.735 4.374 1.00 0.00 C ATOM 856 C ILE A 57 4.278 -1.084 4.223 1.00 0.00 C ATOM 857 O ILE A 57 3.908 -2.237 4.139 1.00 0.00 O ATOM 858 CB ILE A 57 6.344 -0.414 2.988 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.796 0.103 3.125 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.481 0.663 2.315 1.00 0.00 C ATOM 861 CD1 ILE A 57 8.781 -1.071 3.171 1.00 0.00 C ATOM 0 H ILE A 57 6.729 -2.629 4.296 1.00 0.00 H new ATOM 0 HA ILE A 57 5.885 0.134 5.019 1.00 0.00 H new ATOM 0 HB ILE A 57 6.350 -1.321 2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.037 0.755 2.285 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.891 0.701 4.031 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.891 0.896 1.332 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.461 0.295 2.205 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.478 1.563 2.930 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.797 -0.690 3.267 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.549 -1.707 4.025 1.00 0.00 H new ATOM 0 HD13 ILE A 57 8.697 -1.652 2.253 1.00 0.00 H new ATOM 873 N SER A 58 3.433 -0.096 4.187 1.00 0.00 N ATOM 874 CA SER A 58 1.974 -0.357 4.038 1.00 0.00 C ATOM 875 C SER A 58 1.381 0.739 3.158 1.00 0.00 C ATOM 876 O SER A 58 1.519 1.911 3.443 1.00 0.00 O ATOM 877 CB SER A 58 1.315 -0.334 5.416 1.00 0.00 C ATOM 878 OG SER A 58 -0.090 -0.477 5.268 1.00 0.00 O ATOM 0 H SER A 58 3.690 0.889 4.255 1.00 0.00 H new ATOM 0 HA SER A 58 1.803 -1.332 3.582 1.00 0.00 H new ATOM 0 HB2 SER A 58 1.711 -1.140 6.034 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.545 0.601 5.926 1.00 0.00 H new ATOM 0 HG SER A 58 -0.280 -1.162 4.593 1.00 0.00 H new ATOM 884 N ILE A 59 0.744 0.367 2.074 1.00 0.00 N ATOM 885 CA ILE A 59 0.159 1.388 1.148 1.00 0.00 C ATOM 886 C ILE A 59 -1.366 1.346 1.198 1.00 0.00 C ATOM 887 O ILE A 59 -1.964 0.331 1.486 1.00 0.00 O ATOM 888 CB ILE A 59 0.614 1.092 -0.285 1.00 0.00 C ATOM 889 CG1 ILE A 59 2.141 1.139 -0.360 1.00 0.00 C ATOM 890 CG2 ILE A 59 0.027 2.137 -1.236 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.606 0.502 -1.671 1.00 0.00 C ATOM 0 H ILE A 59 0.604 -0.602 1.790 1.00 0.00 H new ATOM 0 HA ILE A 59 0.500 2.376 1.459 1.00 0.00 H new ATOM 0 HB ILE A 59 0.267 0.100 -0.574 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.487 2.171 -0.302 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.574 0.609 0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.352 1.925 -2.255 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.061 2.103 -1.187 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.372 3.129 -0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.694 0.535 -1.726 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.272 -0.535 -1.710 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.184 1.051 -2.512 1.00 0.00 H new ATOM 903 N ALA A 60 -1.991 2.454 0.895 1.00 0.00 N ATOM 904 CA ALA A 60 -3.482 2.529 0.890 1.00 0.00 C ATOM 905 C ALA A 60 -3.905 3.241 -0.394 1.00 0.00 C ATOM 906 O ALA A 60 -3.347 4.264 -0.744 1.00 0.00 O ATOM 907 CB ALA A 60 -3.958 3.329 2.106 1.00 0.00 C ATOM 0 H ALA A 60 -1.522 3.325 0.646 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.919 1.532 0.936 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.047 3.384 2.102 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.623 2.837 3.019 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.544 4.336 2.063 1.00 0.00 H new ATOM 913 N GLY A 61 -4.865 2.708 -1.116 1.00 0.00 N ATOM 914 CA GLY A 61 -5.286 3.366 -2.400 1.00 0.00 C ATOM 915 C GLY A 61 -6.804 3.312 -2.571 1.00 0.00 C ATOM 916 O GLY A 61 -7.481 2.479 -2.002 1.00 0.00 O ATOM 0 H GLY A 61 -5.371 1.855 -0.877 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -4.952 4.404 -2.408 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.804 2.870 -3.242 1.00 0.00 H new ATOM 920 N HIS A 62 -7.336 4.207 -3.362 1.00 0.00 N ATOM 921 CA HIS A 62 -8.812 4.238 -3.593 1.00 0.00 C ATOM 922 C HIS A 62 -9.234 3.028 -4.437 1.00 0.00 C ATOM 923 O HIS A 62 -8.419 2.243 -4.873 1.00 0.00 O ATOM 924 CB HIS A 62 -9.192 5.546 -4.321 1.00 0.00 C ATOM 925 CG HIS A 62 -9.492 6.630 -3.315 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.743 6.776 -2.738 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.712 7.620 -2.774 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.681 7.819 -1.891 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.465 8.370 -1.873 1.00 0.00 N ATOM 0 H HIS A 62 -6.808 4.923 -3.861 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.328 4.196 -2.634 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.376 5.859 -4.972 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.061 5.378 -4.957 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -11.563 6.197 -2.922 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.672 7.792 -3.010 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.513 8.168 -1.298 1.00 0.00 H new ATOM 937 N THR A 63 -10.513 2.878 -4.662 1.00 0.00 N ATOM 938 CA THR A 63 -11.013 1.730 -5.463 1.00 0.00 C ATOM 939 C THR A 63 -12.417 2.079 -5.992 1.00 0.00 C ATOM 940 O THR A 63 -13.413 1.884 -5.325 1.00 0.00 O ATOM 941 CB THR A 63 -11.016 0.475 -4.555 1.00 0.00 C ATOM 942 OG1 THR A 63 -9.794 -0.224 -4.741 1.00 0.00 O ATOM 943 CG2 THR A 63 -12.184 -0.478 -4.866 1.00 0.00 C ATOM 0 H THR A 63 -11.237 3.510 -4.320 1.00 0.00 H new ATOM 0 HA THR A 63 -10.378 1.522 -6.324 1.00 0.00 H new ATOM 0 HB THR A 63 -11.132 0.812 -3.525 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.055 0.418 -4.797 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.137 -1.340 -4.201 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.129 0.044 -4.718 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.114 -0.814 -5.901 1.00 0.00 H new ATOM 951 N PHE A 64 -12.495 2.606 -7.189 1.00 0.00 N ATOM 952 CA PHE A 64 -13.824 2.976 -7.772 1.00 0.00 C ATOM 953 C PHE A 64 -14.345 1.801 -8.606 1.00 0.00 C ATOM 954 O PHE A 64 -13.874 1.543 -9.693 1.00 0.00 O ATOM 955 CB PHE A 64 -13.665 4.220 -8.666 1.00 0.00 C ATOM 956 CG PHE A 64 -13.772 5.482 -7.830 1.00 0.00 C ATOM 957 CD1 PHE A 64 -12.982 5.632 -6.683 1.00 0.00 C ATOM 958 CD2 PHE A 64 -14.663 6.499 -8.202 1.00 0.00 C ATOM 959 CE1 PHE A 64 -13.082 6.795 -5.910 1.00 0.00 C ATOM 960 CE2 PHE A 64 -14.764 7.661 -7.428 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.973 7.809 -6.282 1.00 0.00 C ATOM 0 H PHE A 64 -11.693 2.797 -7.790 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.531 3.200 -6.973 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.701 4.192 -9.173 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.432 4.221 -9.440 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -12.295 4.850 -6.395 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -15.272 6.386 -9.087 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -12.472 6.910 -5.026 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -15.452 8.443 -7.715 1.00 0.00 H new ATOM 0 HZ PHE A 64 -14.050 8.706 -5.685 1.00 0.00 H new ATOM 971 N ILE A 65 -15.313 1.089 -8.103 1.00 0.00 N ATOM 972 CA ILE A 65 -15.860 -0.071 -8.865 1.00 0.00 C ATOM 973 C ILE A 65 -16.414 0.396 -10.207 1.00 0.00 C ATOM 974 O ILE A 65 -16.449 -0.346 -11.169 1.00 0.00 O ATOM 975 CB ILE A 65 -17.003 -0.715 -8.082 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.604 -0.902 -6.623 1.00 0.00 C ATOM 977 CG2 ILE A 65 -17.333 -2.074 -8.697 1.00 0.00 C ATOM 978 CD1 ILE A 65 -17.780 -1.521 -5.873 1.00 0.00 C ATOM 0 H ILE A 65 -15.750 1.259 -7.197 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.054 -0.788 -9.020 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.877 -0.065 -8.128 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.727 -1.546 -6.550 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.334 0.056 -6.179 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -18.148 -2.537 -8.141 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.633 -1.940 -9.736 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.454 -2.716 -8.653 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.511 -1.662 -4.826 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.643 -0.859 -5.940 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -18.027 -2.485 -6.317 1.00 0.00 H new ATOM 990 N ASP A 66 -16.875 1.612 -10.274 1.00 0.00 N ATOM 991 CA ASP A 66 -17.457 2.117 -11.544 1.00 0.00 C ATOM 992 C ASP A 66 -16.341 2.635 -12.441 1.00 0.00 C ATOM 993 O ASP A 66 -16.576 3.275 -13.447 1.00 0.00 O ATOM 994 CB ASP A 66 -18.445 3.244 -11.231 1.00 0.00 C ATOM 995 CG ASP A 66 -19.363 3.475 -12.434 1.00 0.00 C ATOM 996 OD1 ASP A 66 -18.862 3.889 -13.466 1.00 0.00 O ATOM 997 OD2 ASP A 66 -20.552 3.235 -12.301 1.00 0.00 O ATOM 0 H ASP A 66 -16.873 2.278 -9.502 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.981 1.312 -12.058 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -19.038 2.987 -10.353 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.904 4.160 -10.993 1.00 0.00 H new ATOM 1002 N ARG A 67 -15.126 2.354 -12.080 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.969 2.815 -12.897 1.00 0.00 C ATOM 1004 C ARG A 67 -12.802 1.838 -12.718 1.00 0.00 C ATOM 1005 O ARG A 67 -11.893 2.100 -11.958 1.00 0.00 O ATOM 1006 CB ARG A 67 -13.542 4.211 -12.440 1.00 0.00 C ATOM 1007 CG ARG A 67 -12.623 4.833 -13.494 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.160 6.213 -13.025 1.00 0.00 C ATOM 1009 NE ARG A 67 -13.325 6.973 -12.491 1.00 0.00 N ATOM 1010 CZ ARG A 67 -13.132 8.052 -11.783 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -11.918 8.470 -11.548 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -14.153 8.715 -11.312 1.00 0.00 N ATOM 0 H ARG A 67 -14.879 1.820 -11.247 1.00 0.00 H new ATOM 0 HA ARG A 67 -14.257 2.853 -13.948 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -14.419 4.840 -12.290 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -13.026 4.150 -11.482 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -11.761 4.188 -13.665 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -13.150 4.919 -14.444 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -11.396 6.110 -12.255 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -11.706 6.757 -13.853 1.00 0.00 H new ATOM 0 HE ARG A 67 -14.274 6.650 -12.679 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -11.120 7.953 -11.918 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -11.767 9.313 -10.995 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -15.102 8.390 -11.497 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -14.002 9.558 -10.759 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.836 0.719 -13.406 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.770 -0.342 -13.329 1.00 0.00 C ATOM 1028 C PRO A 68 -10.337 0.179 -13.555 1.00 0.00 C ATOM 1029 O PRO A 68 -9.456 -0.564 -13.938 1.00 0.00 O ATOM 1030 CB PRO A 68 -12.169 -1.327 -14.440 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.643 -1.154 -14.583 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.909 0.329 -14.338 1.00 0.00 C ATOM 0 HA PRO A 68 -11.729 -0.778 -12.331 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.651 -1.104 -15.373 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.914 -2.352 -14.171 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.978 -1.453 -15.576 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -14.182 -1.773 -13.865 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.866 0.903 -15.263 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.896 0.494 -13.906 1.00 0.00 H new ATOM 1040 N ASN A 69 -10.092 1.436 -13.310 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.721 1.990 -13.492 1.00 0.00 C ATOM 1042 C ASN A 69 -8.532 3.154 -12.518 1.00 0.00 C ATOM 1043 O ASN A 69 -8.346 4.286 -12.921 1.00 0.00 O ATOM 1044 CB ASN A 69 -8.555 2.492 -14.929 1.00 0.00 C ATOM 1045 CG ASN A 69 -9.012 1.407 -15.907 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -8.425 0.345 -15.973 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -10.042 1.629 -16.676 1.00 0.00 N ATOM 0 H ASN A 69 -10.788 2.109 -12.989 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.978 1.216 -13.298 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.140 3.400 -15.078 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -7.513 2.750 -15.117 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.353 0.912 -17.331 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.536 2.520 -16.622 1.00 0.00 H new ATOM 1054 N TYR A 70 -8.591 2.892 -11.236 1.00 0.00 N ATOM 1055 CA TYR A 70 -8.431 3.995 -10.238 1.00 0.00 C ATOM 1056 C TYR A 70 -7.730 3.472 -8.974 1.00 0.00 C ATOM 1057 O TYR A 70 -8.332 2.833 -8.134 1.00 0.00 O ATOM 1058 CB TYR A 70 -9.820 4.545 -9.871 1.00 0.00 C ATOM 1059 CG TYR A 70 -9.697 5.944 -9.305 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -9.387 7.015 -10.151 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -9.900 6.168 -7.936 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -9.279 8.309 -9.630 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -9.791 7.464 -7.415 1.00 0.00 C ATOM 1064 CZ TYR A 70 -9.480 8.534 -8.263 1.00 0.00 C ATOM 1065 OH TYR A 70 -9.373 9.811 -7.751 1.00 0.00 O ATOM 0 H TYR A 70 -8.743 1.965 -10.838 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.821 4.788 -10.672 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.459 4.557 -10.754 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -10.297 3.891 -9.141 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -9.231 6.843 -11.206 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -10.140 5.342 -7.283 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -9.040 9.135 -10.283 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.947 7.638 -6.360 1.00 0.00 H new ATOM 0 HH TYR A 70 -9.543 9.792 -6.786 1.00 0.00 H new ATOM 1075 N GLN A 71 -6.466 3.771 -8.834 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.697 3.339 -7.626 1.00 0.00 C ATOM 1077 C GLN A 71 -5.774 1.818 -7.414 1.00 0.00 C ATOM 1078 O GLN A 71 -5.232 1.048 -8.183 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.244 4.063 -6.384 1.00 0.00 C ATOM 1080 CG GLN A 71 -5.812 5.545 -6.381 1.00 0.00 C ATOM 1081 CD GLN A 71 -6.784 6.391 -7.211 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -7.305 5.939 -8.209 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -7.046 7.612 -6.833 1.00 0.00 N ATOM 0 H GLN A 71 -5.924 4.304 -9.514 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.650 3.600 -7.783 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.332 3.996 -6.368 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.881 3.572 -5.481 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -5.779 5.918 -5.357 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -4.804 5.637 -6.786 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -6.608 7.991 -5.994 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -7.689 8.187 -7.377 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.403 1.381 -6.349 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.470 -0.086 -6.051 1.00 0.00 C ATOM 1094 C PHE A 72 -7.740 -0.696 -6.652 1.00 0.00 C ATOM 1095 O PHE A 72 -8.059 -1.838 -6.385 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.523 -0.303 -4.528 1.00 0.00 C ATOM 1097 CG PHE A 72 -5.146 -0.253 -3.898 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -4.156 0.616 -4.381 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -4.880 -1.070 -2.792 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -2.902 0.659 -3.759 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -3.628 -1.019 -2.168 1.00 0.00 C ATOM 1102 CZ PHE A 72 -2.639 -0.157 -2.652 1.00 0.00 C ATOM 0 H PHE A 72 -6.875 1.979 -5.671 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.587 -0.560 -6.480 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.156 0.460 -4.075 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.984 -1.268 -4.315 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.361 1.250 -5.231 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -5.641 -1.740 -2.420 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.137 1.323 -4.134 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.426 -1.646 -1.312 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.672 -0.121 -2.172 1.00 0.00 H new ATOM 1112 N THR A 73 -8.481 0.037 -7.434 1.00 0.00 N ATOM 1113 CA THR A 73 -9.731 -0.544 -8.005 1.00 0.00 C ATOM 1114 C THR A 73 -9.440 -1.933 -8.576 1.00 0.00 C ATOM 1115 O THR A 73 -10.278 -2.813 -8.553 1.00 0.00 O ATOM 1116 CB THR A 73 -10.267 0.342 -9.127 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.525 1.643 -8.622 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.565 -0.262 -9.671 1.00 0.00 C ATOM 0 H THR A 73 -8.281 1.001 -7.701 1.00 0.00 H new ATOM 0 HA THR A 73 -10.473 -0.612 -7.210 1.00 0.00 H new ATOM 0 HB THR A 73 -9.529 0.405 -9.927 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.679 2.124 -8.510 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.951 0.368 -10.473 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.367 -1.262 -10.058 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.302 -0.323 -8.870 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.262 -2.127 -9.106 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.908 -3.447 -9.705 1.00 0.00 C ATOM 1128 C ASN A 74 -7.058 -4.267 -8.730 1.00 0.00 C ATOM 1129 O ASN A 74 -7.094 -5.480 -8.744 1.00 0.00 O ATOM 1130 CB ASN A 74 -7.126 -3.205 -10.995 1.00 0.00 C ATOM 1131 CG ASN A 74 -8.043 -2.539 -12.022 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -8.436 -1.402 -11.855 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -8.403 -3.202 -13.085 1.00 0.00 N ATOM 0 H ASN A 74 -7.525 -1.423 -9.150 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.820 -4.005 -9.918 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.262 -2.571 -10.797 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.746 -4.149 -11.387 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -9.014 -2.766 -13.775 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.074 -4.157 -13.226 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.296 -3.634 -7.879 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.470 -4.430 -6.924 1.00 0.00 C ATOM 1142 C LEU A 75 -6.380 -5.389 -6.170 1.00 0.00 C ATOM 1143 O LEU A 75 -5.985 -6.477 -5.801 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.769 -3.525 -5.903 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.703 -4.347 -5.138 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.379 -4.326 -5.909 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -3.465 -3.753 -3.747 1.00 0.00 C ATOM 0 H LEU A 75 -6.209 -2.621 -7.803 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.712 -4.968 -7.493 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.300 -2.681 -6.409 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.497 -3.113 -5.205 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.066 -5.370 -5.041 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.633 -4.906 -5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.527 -4.760 -6.898 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.034 -3.297 -6.012 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.713 -4.343 -3.223 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.116 -2.725 -3.845 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.396 -3.767 -3.181 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.598 -4.997 -5.942 1.00 0.00 N ATOM 1160 CA LYS A 76 -8.525 -5.894 -5.220 1.00 0.00 C ATOM 1161 C LYS A 76 -8.767 -7.107 -6.114 1.00 0.00 C ATOM 1162 O LYS A 76 -9.455 -8.042 -5.759 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.847 -5.171 -4.956 1.00 0.00 C ATOM 1164 CG LYS A 76 -10.308 -4.467 -6.239 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.781 -4.028 -6.109 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.715 -5.165 -6.548 1.00 0.00 C ATOM 1167 NZ LYS A 76 -14.104 -4.864 -6.098 1.00 0.00 N ATOM 0 H LYS A 76 -7.988 -4.098 -6.224 1.00 0.00 H new ATOM 0 HA LYS A 76 -8.104 -6.197 -4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.604 -5.883 -4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.723 -4.444 -4.154 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.678 -3.598 -6.432 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -10.195 -5.138 -7.091 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.995 -3.750 -5.077 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.960 -3.144 -6.721 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.688 -5.275 -7.632 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -12.380 -6.111 -6.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -14.739 -5.633 -6.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -14.122 -4.779 -5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -14.421 -3.970 -6.524 1.00 0.00 H new ATOM 1181 N ALA A 77 -8.196 -7.072 -7.291 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.359 -8.183 -8.269 1.00 0.00 C ATOM 1183 C ALA A 77 -7.099 -9.052 -8.274 1.00 0.00 C ATOM 1184 O ALA A 77 -7.144 -10.231 -8.562 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.569 -7.568 -9.658 1.00 0.00 C ATOM 0 H ALA A 77 -7.612 -6.303 -7.619 1.00 0.00 H new ATOM 0 HA ALA A 77 -9.213 -8.805 -7.998 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.691 -8.363 -10.393 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.462 -6.943 -9.648 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.703 -6.960 -9.921 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.972 -8.469 -7.963 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.697 -9.245 -7.952 1.00 0.00 C ATOM 1193 C ALA A 78 -4.908 -10.590 -7.251 1.00 0.00 C ATOM 1194 O ALA A 78 -5.923 -10.824 -6.624 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.625 -8.448 -7.208 1.00 0.00 C ATOM 0 H ALA A 78 -5.879 -7.484 -7.715 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.378 -9.423 -8.979 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.693 -9.013 -7.199 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.466 -7.494 -7.711 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.951 -8.268 -6.183 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.953 -11.477 -7.356 1.00 0.00 N ATOM 1202 CA LYS A 79 -4.082 -12.814 -6.701 1.00 0.00 C ATOM 1203 C LYS A 79 -2.720 -13.227 -6.144 1.00 0.00 C ATOM 1204 O LYS A 79 -1.695 -12.709 -6.542 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.541 -13.842 -7.738 1.00 0.00 C ATOM 1206 CG LYS A 79 -3.734 -13.661 -9.027 1.00 0.00 C ATOM 1207 CD LYS A 79 -3.896 -14.898 -9.914 1.00 0.00 C ATOM 1208 CE LYS A 79 -5.358 -15.037 -10.352 1.00 0.00 C ATOM 1209 NZ LYS A 79 -6.152 -15.637 -9.245 1.00 0.00 N ATOM 0 H LYS A 79 -3.084 -11.332 -7.870 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.811 -12.763 -5.892 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.405 -14.852 -7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.605 -13.719 -7.942 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.074 -12.773 -9.559 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -2.681 -13.507 -8.790 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -3.251 -14.816 -10.789 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.584 -15.790 -9.370 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.764 -14.061 -10.617 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.424 -15.663 -11.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.711 -16.434 -9.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.509 -15.977 -8.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.792 -14.919 -8.848 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.693 -14.152 -5.223 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.388 -14.581 -4.648 1.00 0.00 C ATOM 1225 C LYS A 80 -0.413 -14.899 -5.786 1.00 0.00 C ATOM 1226 O LYS A 80 -0.770 -15.521 -6.765 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.590 -15.827 -3.775 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.349 -16.057 -2.897 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.675 -17.048 -1.771 1.00 0.00 C ATOM 1230 CE LYS A 80 -0.834 -18.461 -2.341 1.00 0.00 C ATOM 1231 NZ LYS A 80 0.371 -18.816 -3.142 1.00 0.00 N ATOM 0 H LYS A 80 -3.514 -14.626 -4.846 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.980 -13.778 -4.033 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.472 -15.703 -3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.767 -16.699 -4.405 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.470 -16.442 -3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.014 -15.111 -2.473 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.119 -17.036 -1.025 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.592 -16.746 -1.265 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.968 -19.178 -1.531 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.726 -18.514 -2.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.477 -19.850 -3.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.264 -18.452 -4.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.215 -18.394 -2.705 1.00 0.00 H new ATOM 1245 N GLY A 81 0.818 -14.470 -5.663 1.00 0.00 N ATOM 1246 CA GLY A 81 1.830 -14.735 -6.734 1.00 0.00 C ATOM 1247 C GLY A 81 2.038 -13.465 -7.562 1.00 0.00 C ATOM 1248 O GLY A 81 3.071 -13.272 -8.171 1.00 0.00 O ATOM 0 H GLY A 81 1.168 -13.944 -4.862 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.773 -15.050 -6.288 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.492 -15.549 -7.375 1.00 0.00 H new ATOM 1252 N SER A 82 1.070 -12.591 -7.579 1.00 0.00 N ATOM 1253 CA SER A 82 1.217 -11.331 -8.352 1.00 0.00 C ATOM 1254 C SER A 82 2.373 -10.543 -7.754 1.00 0.00 C ATOM 1255 O SER A 82 2.330 -10.138 -6.610 1.00 0.00 O ATOM 1256 CB SER A 82 -0.071 -10.513 -8.261 1.00 0.00 C ATOM 1257 OG SER A 82 -1.181 -11.352 -8.548 1.00 0.00 O ATOM 0 H SER A 82 0.182 -12.698 -7.089 1.00 0.00 H new ATOM 0 HA SER A 82 1.413 -11.552 -9.401 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.173 -10.084 -7.264 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.038 -9.681 -8.965 1.00 0.00 H new ATOM 0 HG SER A 82 -1.323 -11.973 -7.803 1.00 0.00 H new ATOM 1263 N MET A 83 3.416 -10.338 -8.498 1.00 0.00 N ATOM 1264 CA MET A 83 4.568 -9.596 -7.933 1.00 0.00 C ATOM 1265 C MET A 83 4.213 -8.117 -7.782 1.00 0.00 C ATOM 1266 O MET A 83 3.139 -7.686 -8.152 1.00 0.00 O ATOM 1267 CB MET A 83 5.782 -9.746 -8.852 1.00 0.00 C ATOM 1268 CG MET A 83 6.149 -11.226 -8.978 1.00 0.00 C ATOM 1269 SD MET A 83 7.564 -11.405 -10.095 1.00 0.00 S ATOM 1270 CE MET A 83 8.781 -10.534 -9.077 1.00 0.00 C ATOM 0 H MET A 83 3.521 -10.648 -9.464 1.00 0.00 H new ATOM 0 HA MET A 83 4.808 -10.006 -6.952 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.560 -9.331 -9.835 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.626 -9.184 -8.452 1.00 0.00 H new ATOM 0 HG2 MET A 83 6.392 -11.636 -7.998 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.298 -11.791 -9.358 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.737 -11.056 -9.126 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.904 -9.516 -9.448 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.436 -10.504 -8.043 1.00 0.00 H new ATOM 1280 N VAL A 84 5.110 -7.337 -7.231 1.00 0.00 N ATOM 1281 CA VAL A 84 4.832 -5.880 -7.037 1.00 0.00 C ATOM 1282 C VAL A 84 6.114 -5.080 -7.285 1.00 0.00 C ATOM 1283 O VAL A 84 7.042 -5.125 -6.503 1.00 0.00 O ATOM 1284 CB VAL A 84 4.367 -5.650 -5.596 1.00 0.00 C ATOM 1285 CG1 VAL A 84 3.820 -4.228 -5.446 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.278 -6.669 -5.241 1.00 0.00 C ATOM 0 H VAL A 84 6.026 -7.648 -6.906 1.00 0.00 H new ATOM 0 HA VAL A 84 4.059 -5.556 -7.734 1.00 0.00 H new ATOM 0 HB VAL A 84 5.212 -5.776 -4.920 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.491 -4.071 -4.419 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.602 -3.510 -5.690 1.00 0.00 H new ATOM 0 HG13 VAL A 84 2.976 -4.089 -6.122 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.947 -6.505 -4.215 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.433 -6.549 -5.919 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.679 -7.678 -5.336 1.00 0.00 H new ATOM 1296 N TYR A 85 6.174 -4.346 -8.368 1.00 0.00 N ATOM 1297 CA TYR A 85 7.399 -3.545 -8.660 1.00 0.00 C ATOM 1298 C TYR A 85 7.230 -2.124 -8.116 1.00 0.00 C ATOM 1299 O TYR A 85 6.558 -1.299 -8.703 1.00 0.00 O ATOM 1300 CB TYR A 85 7.617 -3.485 -10.173 1.00 0.00 C ATOM 1301 CG TYR A 85 7.619 -4.885 -10.737 1.00 0.00 C ATOM 1302 CD1 TYR A 85 8.816 -5.607 -10.813 1.00 0.00 C ATOM 1303 CD2 TYR A 85 6.425 -5.462 -11.184 1.00 0.00 C ATOM 1304 CE1 TYR A 85 8.818 -6.907 -11.335 1.00 0.00 C ATOM 1305 CE2 TYR A 85 6.426 -6.760 -11.706 1.00 0.00 C ATOM 1306 CZ TYR A 85 7.622 -7.483 -11.782 1.00 0.00 C ATOM 1307 OH TYR A 85 7.623 -8.764 -12.297 1.00 0.00 O ATOM 0 H TYR A 85 5.429 -4.268 -9.060 1.00 0.00 H new ATOM 0 HA TYR A 85 8.259 -4.015 -8.182 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.830 -2.894 -10.641 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.562 -2.990 -10.396 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.738 -5.162 -10.469 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.502 -4.905 -11.126 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.741 -7.465 -11.393 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.504 -7.204 -12.050 1.00 0.00 H new ATOM 0 HH TYR A 85 7.590 -9.412 -11.562 1.00 0.00 H new ATOM 1317 N PHE A 86 7.847 -1.830 -7.001 1.00 0.00 N ATOM 1318 CA PHE A 86 7.747 -0.457 -6.417 1.00 0.00 C ATOM 1319 C PHE A 86 8.981 0.338 -6.845 1.00 0.00 C ATOM 1320 O PHE A 86 10.090 0.035 -6.452 1.00 0.00 O ATOM 1321 CB PHE A 86 7.696 -0.558 -4.890 1.00 0.00 C ATOM 1322 CG PHE A 86 7.597 0.824 -4.282 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.477 1.626 -4.542 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.621 1.306 -3.453 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.382 2.903 -3.977 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.524 2.582 -2.889 1.00 0.00 C ATOM 1327 CZ PHE A 86 7.405 3.381 -3.151 1.00 0.00 C ATOM 0 H PHE A 86 8.419 -2.484 -6.467 1.00 0.00 H new ATOM 0 HA PHE A 86 6.844 0.042 -6.768 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.840 -1.160 -4.586 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.588 -1.063 -4.521 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.686 1.258 -5.179 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.485 0.691 -3.250 1.00 0.00 H new ATOM 0 HE1 PHE A 86 5.519 3.520 -4.179 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.313 2.951 -2.251 1.00 0.00 H new ATOM 0 HZ PHE A 86 7.331 4.367 -2.715 1.00 0.00 H new ATOM 1337 N LYS A 87 8.808 1.337 -7.671 1.00 0.00 N ATOM 1338 CA LYS A 87 9.984 2.130 -8.148 1.00 0.00 C ATOM 1339 C LYS A 87 10.200 3.362 -7.267 1.00 0.00 C ATOM 1340 O LYS A 87 9.287 3.873 -6.652 1.00 0.00 O ATOM 1341 CB LYS A 87 9.740 2.576 -9.593 1.00 0.00 C ATOM 1342 CG LYS A 87 9.170 1.406 -10.401 1.00 0.00 C ATOM 1343 CD LYS A 87 8.972 1.828 -11.864 1.00 0.00 C ATOM 1344 CE LYS A 87 10.328 2.136 -12.525 1.00 0.00 C ATOM 1345 NZ LYS A 87 10.655 3.577 -12.334 1.00 0.00 N ATOM 0 H LYS A 87 7.905 1.639 -8.036 1.00 0.00 H new ATOM 0 HA LYS A 87 10.874 1.503 -8.094 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.047 3.417 -9.613 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.672 2.921 -10.041 1.00 0.00 H new ATOM 0 HG2 LYS A 87 9.846 0.553 -10.348 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.219 1.087 -9.974 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.466 1.034 -12.412 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.330 2.707 -11.911 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.108 1.513 -12.087 1.00 0.00 H new ATOM 0 HE3 LYS A 87 10.289 1.898 -13.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.870 4.009 -13.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.842 4.064 -11.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 11.481 3.666 -11.708 1.00 0.00 H new ATOM 1359 N VAL A 88 11.417 3.842 -7.215 1.00 0.00 N ATOM 1360 CA VAL A 88 11.730 5.047 -6.392 1.00 0.00 C ATOM 1361 C VAL A 88 12.912 5.783 -7.033 1.00 0.00 C ATOM 1362 O VAL A 88 13.657 5.220 -7.810 1.00 0.00 O ATOM 1363 CB VAL A 88 12.102 4.615 -4.965 1.00 0.00 C ATOM 1364 CG1 VAL A 88 10.834 4.368 -4.144 1.00 0.00 C ATOM 1365 CG2 VAL A 88 12.924 3.324 -5.023 1.00 0.00 C ATOM 0 H VAL A 88 12.214 3.446 -7.713 1.00 0.00 H new ATOM 0 HA VAL A 88 10.862 5.704 -6.348 1.00 0.00 H new ATOM 0 HB VAL A 88 12.686 5.406 -4.494 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.108 4.062 -3.134 1.00 0.00 H new ATOM 0 HG12 VAL A 88 10.246 5.284 -4.099 1.00 0.00 H new ATOM 0 HG13 VAL A 88 10.244 3.581 -4.614 1.00 0.00 H new ATOM 0 HG21 VAL A 88 13.189 3.016 -4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 88 12.336 2.539 -5.499 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.833 3.497 -5.599 1.00 0.00 H new ATOM 1375 N GLY A 89 13.086 7.038 -6.717 1.00 0.00 N ATOM 1376 CA GLY A 89 14.215 7.808 -7.315 1.00 0.00 C ATOM 1377 C GLY A 89 15.550 7.267 -6.799 1.00 0.00 C ATOM 1378 O GLY A 89 16.423 8.017 -6.410 1.00 0.00 O ATOM 0 H GLY A 89 12.496 7.563 -6.071 1.00 0.00 H new ATOM 0 HA2 GLY A 89 14.180 7.735 -8.402 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.119 8.864 -7.063 1.00 0.00 H new ATOM 1382 N ASN A 90 15.721 5.973 -6.795 1.00 0.00 N ATOM 1383 CA ASN A 90 17.004 5.394 -6.308 1.00 0.00 C ATOM 1384 C ASN A 90 17.163 3.966 -6.839 1.00 0.00 C ATOM 1385 O ASN A 90 18.249 3.535 -7.171 1.00 0.00 O ATOM 1386 CB ASN A 90 17.009 5.375 -4.777 1.00 0.00 C ATOM 1387 CG ASN A 90 15.827 4.543 -4.272 1.00 0.00 C ATOM 1388 OD1 ASN A 90 15.746 3.360 -4.532 1.00 0.00 O ATOM 1389 ND2 ASN A 90 14.901 5.117 -3.553 1.00 0.00 N ATOM 0 H ASN A 90 15.028 5.293 -7.108 1.00 0.00 H new ATOM 0 HA ASN A 90 17.833 6.005 -6.666 1.00 0.00 H new ATOM 0 HB2 ASN A 90 17.946 4.955 -4.411 1.00 0.00 H new ATOM 0 HB3 ASN A 90 16.943 6.392 -4.390 1.00 0.00 H new ATOM 0 HD21 ASN A 90 14.110 4.572 -3.210 1.00 0.00 H new ATOM 0 HD22 ASN A 90 14.968 6.111 -3.334 1.00 0.00 H new ATOM 1396 N GLU A 91 16.088 3.231 -6.924 1.00 0.00 N ATOM 1397 CA GLU A 91 16.175 1.831 -7.433 1.00 0.00 C ATOM 1398 C GLU A 91 14.757 1.259 -7.561 1.00 0.00 C ATOM 1399 O GLU A 91 13.794 1.991 -7.681 1.00 0.00 O ATOM 1400 CB GLU A 91 17.010 0.970 -6.458 1.00 0.00 C ATOM 1401 CG GLU A 91 17.776 -0.115 -7.229 1.00 0.00 C ATOM 1402 CD GLU A 91 18.308 -1.168 -6.253 1.00 0.00 C ATOM 1403 OE1 GLU A 91 17.692 -1.356 -5.216 1.00 0.00 O ATOM 1404 OE2 GLU A 91 19.323 -1.770 -6.559 1.00 0.00 O ATOM 0 H GLU A 91 15.151 3.539 -6.663 1.00 0.00 H new ATOM 0 HA GLU A 91 16.661 1.822 -8.409 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.711 1.602 -5.913 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.356 0.508 -5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.120 -0.584 -7.962 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.602 0.333 -7.781 1.00 0.00 H new ATOM 1411 N THR A 92 14.622 -0.043 -7.545 1.00 0.00 N ATOM 1412 CA THR A 92 13.274 -0.668 -7.675 1.00 0.00 C ATOM 1413 C THR A 92 13.171 -1.890 -6.757 1.00 0.00 C ATOM 1414 O THR A 92 14.021 -2.757 -6.760 1.00 0.00 O ATOM 1415 CB THR A 92 13.072 -1.085 -9.133 1.00 0.00 C ATOM 1416 OG1 THR A 92 11.700 -1.375 -9.360 1.00 0.00 O ATOM 1417 CG2 THR A 92 13.921 -2.319 -9.453 1.00 0.00 C ATOM 0 H THR A 92 15.394 -0.703 -7.447 1.00 0.00 H new ATOM 0 HA THR A 92 12.503 0.045 -7.383 1.00 0.00 H new ATOM 0 HB THR A 92 13.382 -0.266 -9.782 1.00 0.00 H new ATOM 0 HG1 THR A 92 11.572 -1.640 -10.295 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.768 -2.606 -10.493 1.00 0.00 H new ATOM 0 HG22 THR A 92 14.974 -2.088 -9.291 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.626 -3.142 -8.803 1.00 0.00 H new ATOM 1425 N ARG A 93 12.128 -1.961 -5.971 1.00 0.00 N ATOM 1426 CA ARG A 93 11.953 -3.125 -5.049 1.00 0.00 C ATOM 1427 C ARG A 93 11.119 -4.204 -5.751 1.00 0.00 C ATOM 1428 O ARG A 93 10.449 -3.939 -6.730 1.00 0.00 O ATOM 1429 CB ARG A 93 11.236 -2.659 -3.774 1.00 0.00 C ATOM 1430 CG ARG A 93 11.689 -1.242 -3.416 1.00 0.00 C ATOM 1431 CD ARG A 93 13.217 -1.194 -3.330 1.00 0.00 C ATOM 1432 NE ARG A 93 13.720 -2.461 -2.725 1.00 0.00 N ATOM 1433 CZ ARG A 93 14.983 -2.776 -2.826 1.00 0.00 C ATOM 1434 NH1 ARG A 93 15.804 -1.992 -3.471 1.00 0.00 N ATOM 1435 NH2 ARG A 93 15.424 -3.878 -2.282 1.00 0.00 N ATOM 0 H ARG A 93 11.387 -1.261 -5.927 1.00 0.00 H new ATOM 0 HA ARG A 93 12.926 -3.537 -4.783 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.157 -2.679 -3.924 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.456 -3.340 -2.952 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.335 -0.536 -4.168 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.252 -0.940 -2.464 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.644 -1.058 -4.324 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.532 -0.341 -2.729 1.00 0.00 H new ATOM 0 HE ARG A 93 13.077 -3.081 -2.232 1.00 0.00 H new ATOM 0 HH11 ARG A 93 15.459 -1.132 -3.897 1.00 0.00 H new ATOM 0 HH12 ARG A 93 16.790 -2.240 -3.549 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.782 -4.491 -1.779 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.410 -4.126 -2.360 1.00 0.00 H new ATOM 1449 N LYS A 94 11.152 -5.418 -5.261 1.00 0.00 N ATOM 1450 CA LYS A 94 10.358 -6.510 -5.906 1.00 0.00 C ATOM 1451 C LYS A 94 9.821 -7.470 -4.840 1.00 0.00 C ATOM 1452 O LYS A 94 10.484 -8.410 -4.448 1.00 0.00 O ATOM 1453 CB LYS A 94 11.257 -7.286 -6.870 1.00 0.00 C ATOM 1454 CG LYS A 94 11.824 -6.331 -7.922 1.00 0.00 C ATOM 1455 CD LYS A 94 12.550 -7.136 -9.001 1.00 0.00 C ATOM 1456 CE LYS A 94 13.250 -6.182 -9.971 1.00 0.00 C ATOM 1457 NZ LYS A 94 12.228 -5.439 -10.761 1.00 0.00 N ATOM 0 H LYS A 94 11.693 -5.700 -4.444 1.00 0.00 H new ATOM 0 HA LYS A 94 9.521 -6.069 -6.448 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.069 -7.763 -6.322 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.689 -8.081 -7.354 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.020 -5.746 -8.369 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.511 -5.625 -7.455 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.279 -7.803 -8.542 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.840 -7.763 -9.541 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.878 -5.482 -9.420 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.905 -6.741 -10.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.632 -5.162 -11.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.400 -6.048 -10.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.938 -4.587 -10.239 1.00 0.00 H new ATOM 1471 N TYR A 95 8.614 -7.255 -4.379 1.00 0.00 N ATOM 1472 CA TYR A 95 8.027 -8.170 -3.350 1.00 0.00 C ATOM 1473 C TYR A 95 7.215 -9.258 -4.062 1.00 0.00 C ATOM 1474 O TYR A 95 7.113 -9.271 -5.273 1.00 0.00 O ATOM 1475 CB TYR A 95 7.101 -7.381 -2.418 1.00 0.00 C ATOM 1476 CG TYR A 95 7.768 -6.094 -1.993 1.00 0.00 C ATOM 1477 CD1 TYR A 95 8.557 -6.060 -0.836 1.00 0.00 C ATOM 1478 CD2 TYR A 95 7.590 -4.931 -2.753 1.00 0.00 C ATOM 1479 CE1 TYR A 95 9.167 -4.864 -0.440 1.00 0.00 C ATOM 1480 CE2 TYR A 95 8.202 -3.736 -2.357 1.00 0.00 C ATOM 1481 CZ TYR A 95 8.990 -3.702 -1.201 1.00 0.00 C ATOM 1482 OH TYR A 95 9.592 -2.523 -0.810 1.00 0.00 O ATOM 0 H TYR A 95 8.010 -6.486 -4.670 1.00 0.00 H new ATOM 0 HA TYR A 95 8.828 -8.620 -2.763 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.161 -7.163 -2.925 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.858 -7.981 -1.541 1.00 0.00 H new ATOM 0 HD1 TYR A 95 8.695 -6.956 -0.250 1.00 0.00 H new ATOM 0 HD2 TYR A 95 6.981 -4.956 -3.644 1.00 0.00 H new ATOM 0 HE1 TYR A 95 9.774 -4.837 0.453 1.00 0.00 H new ATOM 0 HE2 TYR A 95 8.066 -2.840 -2.944 1.00 0.00 H new ATOM 0 HH TYR A 95 9.368 -1.814 -1.449 1.00 0.00 H new ATOM 1492 N LYS A 96 6.631 -10.168 -3.322 1.00 0.00 N ATOM 1493 CA LYS A 96 5.821 -11.251 -3.964 1.00 0.00 C ATOM 1494 C LYS A 96 4.625 -11.608 -3.076 1.00 0.00 C ATOM 1495 O LYS A 96 4.781 -12.113 -1.980 1.00 0.00 O ATOM 1496 CB LYS A 96 6.695 -12.495 -4.159 1.00 0.00 C ATOM 1497 CG LYS A 96 5.923 -13.537 -4.974 1.00 0.00 C ATOM 1498 CD LYS A 96 6.878 -14.639 -5.443 1.00 0.00 C ATOM 1499 CE LYS A 96 7.366 -15.453 -4.241 1.00 0.00 C ATOM 1500 NZ LYS A 96 7.974 -16.726 -4.720 1.00 0.00 N ATOM 0 H LYS A 96 6.679 -10.208 -2.304 1.00 0.00 H new ATOM 0 HA LYS A 96 5.459 -10.899 -4.930 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.619 -12.227 -4.672 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.977 -12.910 -3.191 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.125 -13.968 -4.369 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.450 -13.062 -5.834 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.372 -15.292 -6.154 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.728 -14.198 -5.964 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.097 -14.879 -3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.534 -15.665 -3.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.306 -17.280 -3.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.263 -17.274 -5.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.778 -16.513 -5.345 1.00 0.00 H new ATOM 1514 N MET A 97 3.429 -11.354 -3.546 1.00 0.00 N ATOM 1515 CA MET A 97 2.221 -11.687 -2.736 1.00 0.00 C ATOM 1516 C MET A 97 2.340 -13.124 -2.227 1.00 0.00 C ATOM 1517 O MET A 97 2.026 -14.066 -2.928 1.00 0.00 O ATOM 1518 CB MET A 97 0.966 -11.549 -3.600 1.00 0.00 C ATOM 1519 CG MET A 97 0.683 -10.067 -3.858 1.00 0.00 C ATOM 1520 SD MET A 97 -0.915 -9.895 -4.690 1.00 0.00 S ATOM 1521 CE MET A 97 -0.923 -8.088 -4.792 1.00 0.00 C ATOM 0 H MET A 97 3.239 -10.931 -4.454 1.00 0.00 H new ATOM 0 HA MET A 97 2.148 -11.003 -1.890 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.103 -12.074 -4.545 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.115 -12.011 -3.100 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.676 -9.518 -2.917 1.00 0.00 H new ATOM 0 HG3 MET A 97 1.473 -9.636 -4.473 1.00 0.00 H new ATOM 0 HE1 MET A 97 -1.936 -7.739 -4.994 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.577 -7.669 -3.847 1.00 0.00 H new ATOM 0 HE3 MET A 97 -0.261 -7.766 -5.596 1.00 0.00 H new ATOM 1531 N THR A 98 2.799 -13.296 -1.011 1.00 0.00 N ATOM 1532 CA THR A 98 2.959 -14.669 -0.436 1.00 0.00 C ATOM 1533 C THR A 98 2.217 -14.754 0.901 1.00 0.00 C ATOM 1534 O THR A 98 2.592 -15.501 1.783 1.00 0.00 O ATOM 1535 CB THR A 98 4.455 -14.948 -0.215 1.00 0.00 C ATOM 1536 OG1 THR A 98 5.195 -14.405 -1.299 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.701 -16.457 -0.137 1.00 0.00 C ATOM 0 H THR A 98 3.072 -12.537 -0.387 1.00 0.00 H new ATOM 0 HA THR A 98 2.545 -15.407 -1.123 1.00 0.00 H new ATOM 0 HB THR A 98 4.773 -14.487 0.720 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.300 -13.439 -1.172 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.763 -16.645 0.020 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.132 -16.876 0.693 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.383 -16.926 -1.068 1.00 0.00 H new ATOM 1545 N SER A 99 1.164 -13.999 1.058 1.00 0.00 N ATOM 1546 CA SER A 99 0.404 -14.046 2.333 1.00 0.00 C ATOM 1547 C SER A 99 -0.868 -13.220 2.169 1.00 0.00 C ATOM 1548 O SER A 99 -0.912 -12.045 2.473 1.00 0.00 O ATOM 1549 CB SER A 99 1.261 -13.477 3.466 1.00 0.00 C ATOM 1550 OG SER A 99 0.430 -12.785 4.390 1.00 0.00 O ATOM 0 H SER A 99 0.800 -13.353 0.358 1.00 0.00 H new ATOM 0 HA SER A 99 0.145 -15.076 2.579 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.794 -14.282 3.972 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.014 -12.801 3.062 1.00 0.00 H new ATOM 0 HG SER A 99 -0.110 -12.122 3.911 1.00 0.00 H new ATOM 1556 N ILE A 100 -1.900 -13.835 1.678 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.182 -13.115 1.471 1.00 0.00 C ATOM 1558 C ILE A 100 -3.959 -13.085 2.790 1.00 0.00 C ATOM 1559 O ILE A 100 -3.874 -13.996 3.589 1.00 0.00 O ATOM 1560 CB ILE A 100 -3.984 -13.873 0.414 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.211 -13.917 -0.918 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.344 -13.202 0.207 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -2.832 -12.505 -1.385 1.00 0.00 C ATOM 0 H ILE A 100 -1.911 -14.818 1.407 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.002 -12.092 1.142 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.140 -14.894 0.761 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.309 -14.518 -0.799 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.820 -14.404 -1.680 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.909 -13.749 -0.548 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.897 -13.204 1.146 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.196 -12.174 -0.125 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.288 -12.567 -2.327 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.737 -11.914 -1.527 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -2.202 -12.030 -0.633 1.00 0.00 H new ATOM 1575 N ARG A 101 -4.713 -12.041 3.034 1.00 0.00 N ATOM 1576 CA ARG A 101 -5.487 -11.957 4.311 1.00 0.00 C ATOM 1577 C ARG A 101 -6.822 -11.250 4.065 1.00 0.00 C ATOM 1578 O ARG A 101 -7.723 -11.319 4.875 1.00 0.00 O ATOM 1579 CB ARG A 101 -4.678 -11.165 5.342 1.00 0.00 C ATOM 1580 CG ARG A 101 -3.336 -11.860 5.577 1.00 0.00 C ATOM 1581 CD ARG A 101 -2.617 -11.199 6.755 1.00 0.00 C ATOM 1582 NE ARG A 101 -1.445 -12.031 7.150 1.00 0.00 N ATOM 1583 CZ ARG A 101 -0.523 -11.529 7.926 1.00 0.00 C ATOM 1584 NH1 ARG A 101 -0.629 -10.301 8.355 1.00 0.00 N ATOM 1585 NH2 ARG A 101 0.506 -12.254 8.271 1.00 0.00 N ATOM 0 H ARG A 101 -4.826 -11.245 2.406 1.00 0.00 H new ATOM 0 HA ARG A 101 -5.676 -12.964 4.683 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -4.516 -10.147 4.989 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -5.232 -11.093 6.278 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -3.494 -12.919 5.782 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -2.720 -11.797 4.680 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.289 -10.197 6.479 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.300 -11.090 7.597 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.364 -12.991 6.815 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.432 -9.734 8.084 1.00 0.00 H new ATOM 0 HH12 ARG A 101 0.091 -9.909 8.961 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.590 -13.213 7.934 1.00 0.00 H new ATOM 0 HH22 ARG A 101 1.226 -11.861 8.877 1.00 0.00 H new ATOM 1599 N ASP A 102 -6.955 -10.572 2.955 1.00 0.00 N ATOM 1600 CA ASP A 102 -8.234 -9.857 2.657 1.00 0.00 C ATOM 1601 C ASP A 102 -9.430 -10.748 3.003 1.00 0.00 C ATOM 1602 O ASP A 102 -10.334 -10.344 3.707 1.00 0.00 O ATOM 1603 CB ASP A 102 -8.286 -9.509 1.170 1.00 0.00 C ATOM 1604 CG ASP A 102 -8.067 -10.776 0.340 1.00 0.00 C ATOM 1605 OD1 ASP A 102 -7.647 -11.768 0.911 1.00 0.00 O ATOM 1606 OD2 ASP A 102 -8.324 -10.730 -0.851 1.00 0.00 O ATOM 0 H ASP A 102 -6.233 -10.482 2.240 1.00 0.00 H new ATOM 0 HA ASP A 102 -8.278 -8.947 3.256 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -9.249 -9.063 0.924 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.522 -8.769 0.932 1.00 0.00 H new ATOM 1611 N VAL A 103 -9.443 -11.957 2.513 1.00 0.00 N ATOM 1612 CA VAL A 103 -10.582 -12.872 2.811 1.00 0.00 C ATOM 1613 C VAL A 103 -10.366 -13.529 4.177 1.00 0.00 C ATOM 1614 O VAL A 103 -9.314 -14.069 4.456 1.00 0.00 O ATOM 1615 CB VAL A 103 -10.657 -13.952 1.730 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -11.700 -15.001 2.123 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -11.058 -13.310 0.400 1.00 0.00 C ATOM 0 H VAL A 103 -8.714 -12.351 1.919 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.513 -12.305 2.827 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.683 -14.431 1.627 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.752 -15.769 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.417 -15.458 3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -12.675 -14.524 2.226 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.112 -14.077 -0.373 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -12.032 -12.832 0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.316 -12.563 0.118 1.00 0.00 H new ATOM 1627 N LYS A 104 -11.358 -13.491 5.029 1.00 0.00 N ATOM 1628 CA LYS A 104 -11.209 -14.119 6.374 1.00 0.00 C ATOM 1629 C LYS A 104 -9.873 -13.695 6.989 1.00 0.00 C ATOM 1630 O LYS A 104 -8.968 -14.494 7.127 1.00 0.00 O ATOM 1631 CB LYS A 104 -11.237 -15.641 6.229 1.00 0.00 C ATOM 1632 CG LYS A 104 -11.386 -16.286 7.610 1.00 0.00 C ATOM 1633 CD LYS A 104 -11.040 -17.773 7.523 1.00 0.00 C ATOM 1634 CE LYS A 104 -11.927 -18.447 6.474 1.00 0.00 C ATOM 1635 NZ LYS A 104 -13.326 -17.953 6.614 1.00 0.00 N ATOM 0 H LYS A 104 -12.262 -13.053 4.851 1.00 0.00 H new ATOM 0 HA LYS A 104 -12.027 -13.797 7.018 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -12.065 -15.940 5.586 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.321 -15.988 5.751 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.730 -15.791 8.326 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -12.406 -16.160 7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -9.990 -17.897 7.260 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.183 -18.247 8.494 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -11.553 -18.232 5.473 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -11.898 -19.529 6.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -13.985 -18.664 6.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -13.536 -17.785 7.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.435 -17.065 6.084 1.00 0.00 H new ATOM 1649 N PRO A 105 -9.743 -12.444 7.344 1.00 0.00 N ATOM 1650 CA PRO A 105 -8.488 -11.909 7.939 1.00 0.00 C ATOM 1651 C PRO A 105 -8.345 -12.289 9.422 1.00 0.00 C ATOM 1652 O PRO A 105 -7.971 -13.397 9.752 1.00 0.00 O ATOM 1653 CB PRO A 105 -8.635 -10.394 7.761 1.00 0.00 C ATOM 1654 CG PRO A 105 -10.110 -10.149 7.819 1.00 0.00 C ATOM 1655 CD PRO A 105 -10.777 -11.398 7.221 1.00 0.00 C ATOM 0 HA PRO A 105 -7.594 -12.313 7.465 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -8.111 -9.850 8.547 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -8.215 -10.064 6.811 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -10.437 -9.987 8.846 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -10.379 -9.256 7.254 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -11.683 -11.666 7.764 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -11.063 -11.239 6.181 1.00 0.00 H new ATOM 1663 N THR A 106 -8.641 -11.381 10.314 1.00 0.00 N ATOM 1664 CA THR A 106 -8.523 -11.692 11.769 1.00 0.00 C ATOM 1665 C THR A 106 -7.189 -12.392 12.043 1.00 0.00 C ATOM 1666 O THR A 106 -7.139 -13.430 12.672 1.00 0.00 O ATOM 1667 CB THR A 106 -9.674 -12.608 12.189 1.00 0.00 C ATOM 1668 OG1 THR A 106 -9.621 -13.809 11.431 1.00 0.00 O ATOM 1669 CG2 THR A 106 -11.007 -11.902 11.937 1.00 0.00 C ATOM 0 H THR A 106 -8.960 -10.437 10.098 1.00 0.00 H new ATOM 0 HA THR A 106 -8.567 -10.764 12.340 1.00 0.00 H new ATOM 0 HB THR A 106 -9.585 -12.843 13.250 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.707 -13.952 11.108 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.827 -12.555 12.236 1.00 0.00 H new ATOM 0 HG22 THR A 106 -11.046 -10.981 12.518 1.00 0.00 H new ATOM 0 HG23 THR A 106 -11.099 -11.667 10.877 1.00 0.00 H new ATOM 1677 N ASP A 107 -6.105 -11.831 11.574 1.00 0.00 N ATOM 1678 CA ASP A 107 -4.771 -12.460 11.805 1.00 0.00 C ATOM 1679 C ASP A 107 -4.129 -11.843 13.047 1.00 0.00 C ATOM 1680 O ASP A 107 -4.787 -11.212 13.849 1.00 0.00 O ATOM 1681 CB ASP A 107 -3.876 -12.205 10.590 1.00 0.00 C ATOM 1682 CG ASP A 107 -4.649 -12.535 9.311 1.00 0.00 C ATOM 1683 OD1 ASP A 107 -5.456 -11.717 8.903 1.00 0.00 O ATOM 1684 OD2 ASP A 107 -4.423 -13.602 8.764 1.00 0.00 O ATOM 0 H ASP A 107 -6.086 -10.962 11.040 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.891 -13.533 11.952 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.553 -11.164 10.574 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -2.976 -12.817 10.652 1.00 0.00 H new ATOM 1689 N VAL A 108 -2.847 -12.018 13.215 1.00 0.00 N ATOM 1690 CA VAL A 108 -2.168 -11.440 14.406 1.00 0.00 C ATOM 1691 C VAL A 108 -1.934 -9.945 14.183 1.00 0.00 C ATOM 1692 O VAL A 108 -0.923 -9.402 14.577 1.00 0.00 O ATOM 1693 CB VAL A 108 -0.824 -12.139 14.623 1.00 0.00 C ATOM 1694 CG1 VAL A 108 -1.063 -13.611 14.961 1.00 0.00 C ATOM 1695 CG2 VAL A 108 0.014 -12.040 13.346 1.00 0.00 C ATOM 0 H VAL A 108 -2.242 -12.536 12.578 1.00 0.00 H new ATOM 0 HA VAL A 108 -2.796 -11.584 15.285 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.294 -11.659 15.445 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.106 -14.109 15.116 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -1.661 -13.683 15.870 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.593 -14.092 14.139 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.972 -12.538 13.500 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -0.517 -12.521 12.524 1.00 0.00 H new ATOM 0 HG23 VAL A 108 0.185 -10.991 13.103 1.00 0.00 H new ATOM 1705 N GLY A 109 -2.862 -9.275 13.551 1.00 0.00 N ATOM 1706 CA GLY A 109 -2.692 -7.812 13.303 1.00 0.00 C ATOM 1707 C GLY A 109 -1.964 -7.600 11.974 1.00 0.00 C ATOM 1708 O GLY A 109 -0.998 -8.272 11.669 1.00 0.00 O ATOM 0 H GLY A 109 -3.730 -9.677 13.196 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -3.665 -7.321 13.279 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -2.126 -7.358 14.116 1.00 0.00 H new ATOM 1712 N VAL A 110 -2.415 -6.665 11.184 1.00 0.00 N ATOM 1713 CA VAL A 110 -1.748 -6.401 9.883 1.00 0.00 C ATOM 1714 C VAL A 110 -0.372 -5.803 10.154 1.00 0.00 C ATOM 1715 O VAL A 110 0.612 -6.176 9.546 1.00 0.00 O ATOM 1716 CB VAL A 110 -2.591 -5.418 9.067 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -2.019 -5.302 7.654 1.00 0.00 C ATOM 1718 CG2 VAL A 110 -4.032 -5.929 8.992 1.00 0.00 C ATOM 0 H VAL A 110 -3.220 -6.072 11.386 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.643 -7.328 9.320 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.573 -4.439 9.546 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.620 -4.602 7.074 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.992 -4.942 7.706 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.037 -6.280 7.173 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.636 -5.231 8.411 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.046 -6.908 8.512 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.441 -6.012 9.999 1.00 0.00 H new ATOM 1728 N LEU A 111 -0.300 -4.872 11.073 1.00 0.00 N ATOM 1729 CA LEU A 111 1.008 -4.234 11.406 1.00 0.00 C ATOM 1730 C LEU A 111 1.566 -4.863 12.685 1.00 0.00 C ATOM 1731 O LEU A 111 1.746 -4.199 13.686 1.00 0.00 O ATOM 1732 CB LEU A 111 0.799 -2.730 11.624 1.00 0.00 C ATOM 1733 CG LEU A 111 0.415 -2.049 10.293 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -0.335 -0.743 10.577 1.00 0.00 C ATOM 1735 CD2 LEU A 111 1.675 -1.729 9.474 1.00 0.00 C ATOM 0 H LEU A 111 -1.096 -4.526 11.609 1.00 0.00 H new ATOM 0 HA LEU A 111 1.711 -4.388 10.587 1.00 0.00 H new ATOM 0 HB2 LEU A 111 0.015 -2.567 12.364 1.00 0.00 H new ATOM 0 HB3 LEU A 111 1.710 -2.282 12.021 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.222 -2.729 9.728 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.604 -0.266 9.635 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.239 -0.959 11.146 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.304 -0.074 11.153 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.389 -1.249 8.538 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.319 -1.058 10.043 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.213 -2.652 9.258 1.00 0.00 H new ATOM 1747 N ASP A 112 1.840 -6.139 12.655 1.00 0.00 N ATOM 1748 CA ASP A 112 2.384 -6.821 13.862 1.00 0.00 C ATOM 1749 C ASP A 112 2.790 -8.250 13.492 1.00 0.00 C ATOM 1750 O ASP A 112 2.906 -9.111 14.341 1.00 0.00 O ATOM 1751 CB ASP A 112 1.313 -6.862 14.954 1.00 0.00 C ATOM 1752 CG ASP A 112 1.952 -7.254 16.287 1.00 0.00 C ATOM 1753 OD1 ASP A 112 2.169 -8.437 16.493 1.00 0.00 O ATOM 1754 OD2 ASP A 112 2.214 -6.365 17.080 1.00 0.00 O ATOM 0 H ASP A 112 1.709 -6.741 11.842 1.00 0.00 H new ATOM 0 HA ASP A 112 3.253 -6.275 14.230 1.00 0.00 H new ATOM 0 HB2 ASP A 112 0.832 -5.888 15.042 1.00 0.00 H new ATOM 0 HB3 ASP A 112 0.535 -7.578 14.688 1.00 0.00 H new ATOM 1759 N GLU A 113 3.015 -8.501 12.223 1.00 0.00 N ATOM 1760 CA GLU A 113 3.428 -9.865 11.768 1.00 0.00 C ATOM 1761 C GLU A 113 4.884 -9.802 11.344 1.00 0.00 C ATOM 1762 O GLU A 113 5.502 -10.792 11.007 1.00 0.00 O ATOM 1763 CB GLU A 113 2.557 -10.306 10.584 1.00 0.00 C ATOM 1764 CG GLU A 113 2.660 -9.283 9.443 1.00 0.00 C ATOM 1765 CD GLU A 113 3.950 -9.512 8.651 1.00 0.00 C ATOM 1766 OE1 GLU A 113 4.147 -10.623 8.188 1.00 0.00 O ATOM 1767 OE2 GLU A 113 4.718 -8.573 8.522 1.00 0.00 O ATOM 0 H GLU A 113 2.929 -7.811 11.477 1.00 0.00 H new ATOM 0 HA GLU A 113 3.303 -10.586 12.576 1.00 0.00 H new ATOM 0 HB2 GLU A 113 2.877 -11.287 10.233 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.519 -10.404 10.903 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.797 -9.374 8.783 1.00 0.00 H new ATOM 0 HG3 GLU A 113 2.647 -8.271 9.848 1.00 0.00 H new ATOM 1774 N GLN A 114 5.432 -8.627 11.384 1.00 0.00 N ATOM 1775 CA GLN A 114 6.863 -8.432 11.013 1.00 0.00 C ATOM 1776 C GLN A 114 7.680 -8.381 12.295 1.00 0.00 C ATOM 1777 O GLN A 114 8.856 -8.079 12.295 1.00 0.00 O ATOM 1778 CB GLN A 114 7.029 -7.122 10.235 1.00 0.00 C ATOM 1779 CG GLN A 114 6.503 -5.945 11.068 1.00 0.00 C ATOM 1780 CD GLN A 114 7.551 -5.525 12.102 1.00 0.00 C ATOM 1781 OE1 GLN A 114 8.704 -5.332 11.771 1.00 0.00 O ATOM 1782 NE2 GLN A 114 7.196 -5.375 13.349 1.00 0.00 N ATOM 0 H GLN A 114 4.944 -7.775 11.662 1.00 0.00 H new ATOM 0 HA GLN A 114 7.203 -9.252 10.381 1.00 0.00 H new ATOM 0 HB2 GLN A 114 8.080 -6.965 9.992 1.00 0.00 H new ATOM 0 HB3 GLN A 114 6.488 -7.180 9.290 1.00 0.00 H new ATOM 0 HG2 GLN A 114 6.266 -5.104 10.416 1.00 0.00 H new ATOM 0 HG3 GLN A 114 5.578 -6.229 11.570 1.00 0.00 H new ATOM 0 HE21 GLN A 114 6.228 -5.537 13.627 1.00 0.00 H new ATOM 0 HE22 GLN A 114 7.887 -5.096 14.046 1.00 0.00 H new ATOM 1791 N LYS A 115 7.045 -8.678 13.388 1.00 0.00 N ATOM 1792 CA LYS A 115 7.750 -8.658 14.699 1.00 0.00 C ATOM 1793 C LYS A 115 9.084 -9.403 14.575 1.00 0.00 C ATOM 1794 O LYS A 115 9.972 -9.248 15.391 1.00 0.00 O ATOM 1795 CB LYS A 115 6.874 -9.343 15.760 1.00 0.00 C ATOM 1796 CG LYS A 115 5.783 -8.374 16.258 1.00 0.00 C ATOM 1797 CD LYS A 115 6.322 -7.519 17.412 1.00 0.00 C ATOM 1798 CE LYS A 115 5.247 -6.525 17.854 1.00 0.00 C ATOM 1799 NZ LYS A 115 5.130 -5.438 16.841 1.00 0.00 N ATOM 0 H LYS A 115 6.059 -8.936 13.433 1.00 0.00 H new ATOM 0 HA LYS A 115 7.939 -7.626 14.995 1.00 0.00 H new ATOM 0 HB2 LYS A 115 6.412 -10.236 15.339 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.492 -9.668 16.597 1.00 0.00 H new ATOM 0 HG2 LYS A 115 5.457 -7.731 15.441 1.00 0.00 H new ATOM 0 HG3 LYS A 115 4.910 -8.937 16.589 1.00 0.00 H new ATOM 0 HD2 LYS A 115 6.609 -8.157 18.248 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.218 -6.985 17.096 1.00 0.00 H new ATOM 0 HE2 LYS A 115 4.290 -7.035 17.969 1.00 0.00 H new ATOM 0 HE3 LYS A 115 5.503 -6.105 18.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 5.452 -4.541 17.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 5.718 -5.669 16.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 4.138 -5.345 16.544 1.00 0.00 H new ATOM 1813 N GLY A 116 9.231 -10.213 13.560 1.00 0.00 N ATOM 1814 CA GLY A 116 10.506 -10.965 13.387 1.00 0.00 C ATOM 1815 C GLY A 116 10.508 -11.665 12.025 1.00 0.00 C ATOM 1816 O GLY A 116 11.164 -12.670 11.835 1.00 0.00 O ATOM 0 H GLY A 116 8.524 -10.385 12.845 1.00 0.00 H new ATOM 0 HA2 GLY A 116 11.354 -10.284 13.459 1.00 0.00 H new ATOM 0 HA3 GLY A 116 10.618 -11.699 14.185 1.00 0.00 H new ATOM 1820 N LYS A 117 9.780 -11.140 11.075 1.00 0.00 N ATOM 1821 CA LYS A 117 9.736 -11.771 9.719 1.00 0.00 C ATOM 1822 C LYS A 117 10.770 -11.085 8.816 1.00 0.00 C ATOM 1823 O LYS A 117 11.774 -10.587 9.287 1.00 0.00 O ATOM 1824 CB LYS A 117 8.321 -11.598 9.132 1.00 0.00 C ATOM 1825 CG LYS A 117 8.009 -12.736 8.136 1.00 0.00 C ATOM 1826 CD LYS A 117 7.486 -13.977 8.888 1.00 0.00 C ATOM 1827 CE LYS A 117 5.970 -13.866 9.107 1.00 0.00 C ATOM 1828 NZ LYS A 117 5.258 -14.260 7.859 1.00 0.00 N ATOM 0 H LYS A 117 9.212 -10.299 11.178 1.00 0.00 H new ATOM 0 HA LYS A 117 9.969 -12.834 9.787 1.00 0.00 H new ATOM 0 HB2 LYS A 117 7.585 -11.597 9.936 1.00 0.00 H new ATOM 0 HB3 LYS A 117 8.244 -10.634 8.629 1.00 0.00 H new ATOM 0 HG2 LYS A 117 7.266 -12.401 7.412 1.00 0.00 H new ATOM 0 HG3 LYS A 117 8.907 -12.994 7.575 1.00 0.00 H new ATOM 0 HD2 LYS A 117 7.713 -14.878 8.319 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.993 -14.070 9.848 1.00 0.00 H new ATOM 0 HE2 LYS A 117 5.663 -14.509 9.932 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.705 -12.845 9.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.315 -13.821 7.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.803 -13.940 7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.158 -15.295 7.828 1.00 0.00 H new ATOM 1842 N ASP A 118 10.528 -11.049 7.527 1.00 0.00 N ATOM 1843 CA ASP A 118 11.489 -10.388 6.583 1.00 0.00 C ATOM 1844 C ASP A 118 10.797 -9.187 5.942 1.00 0.00 C ATOM 1845 O ASP A 118 9.588 -9.074 5.979 1.00 0.00 O ATOM 1846 CB ASP A 118 11.891 -11.383 5.492 1.00 0.00 C ATOM 1847 CG ASP A 118 13.045 -10.803 4.673 1.00 0.00 C ATOM 1848 OD1 ASP A 118 12.770 -10.126 3.695 1.00 0.00 O ATOM 1849 OD2 ASP A 118 14.184 -11.046 5.036 1.00 0.00 O ATOM 0 H ASP A 118 9.702 -11.451 7.085 1.00 0.00 H new ATOM 0 HA ASP A 118 12.379 -10.062 7.122 1.00 0.00 H new ATOM 0 HB2 ASP A 118 12.190 -12.330 5.941 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.040 -11.592 4.844 1.00 0.00 H new ATOM 1854 N LYS A 119 11.548 -8.287 5.354 1.00 0.00 N ATOM 1855 CA LYS A 119 10.925 -7.090 4.709 1.00 0.00 C ATOM 1856 C LYS A 119 9.689 -7.525 3.916 1.00 0.00 C ATOM 1857 O LYS A 119 9.740 -8.454 3.135 1.00 0.00 O ATOM 1858 CB LYS A 119 11.933 -6.441 3.757 1.00 0.00 C ATOM 1859 CG LYS A 119 13.130 -5.911 4.553 1.00 0.00 C ATOM 1860 CD LYS A 119 13.923 -4.927 3.689 1.00 0.00 C ATOM 1861 CE LYS A 119 15.263 -4.617 4.358 1.00 0.00 C ATOM 1862 NZ LYS A 119 16.187 -5.773 4.182 1.00 0.00 N ATOM 0 H LYS A 119 12.565 -8.330 5.293 1.00 0.00 H new ATOM 0 HA LYS A 119 10.634 -6.374 5.477 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.269 -7.168 3.018 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.458 -5.626 3.210 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.786 -5.418 5.462 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.770 -6.738 4.862 1.00 0.00 H new ATOM 0 HD2 LYS A 119 14.090 -5.350 2.698 1.00 0.00 H new ATOM 0 HD3 LYS A 119 13.353 -4.008 3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 119 15.700 -3.719 3.921 1.00 0.00 H new ATOM 0 HE3 LYS A 119 15.114 -4.416 5.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 17.165 -5.465 4.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 15.937 -6.523 4.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 16.105 -6.139 3.212 1.00 0.00 H new ATOM 1876 N GLN A 120 8.572 -6.872 4.115 1.00 0.00 N ATOM 1877 CA GLN A 120 7.336 -7.272 3.372 1.00 0.00 C ATOM 1878 C GLN A 120 6.454 -6.045 3.117 1.00 0.00 C ATOM 1879 O GLN A 120 6.677 -4.982 3.661 1.00 0.00 O ATOM 1880 CB GLN A 120 6.564 -8.335 4.176 1.00 0.00 C ATOM 1881 CG GLN A 120 6.052 -7.760 5.504 1.00 0.00 C ATOM 1882 CD GLN A 120 7.232 -7.315 6.366 1.00 0.00 C ATOM 1883 OE1 GLN A 120 7.688 -6.201 6.252 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.749 -8.140 7.233 1.00 0.00 N ATOM 0 H GLN A 120 8.461 -6.085 4.754 1.00 0.00 H new ATOM 0 HA GLN A 120 7.619 -7.699 2.410 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.723 -8.701 3.587 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.212 -9.189 4.372 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.390 -6.915 5.314 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.466 -8.511 6.034 1.00 0.00 H new ATOM 0 HE21 GLN A 120 7.367 -9.081 7.332 1.00 0.00 H new ATOM 0 HE22 GLN A 120 8.535 -7.845 7.812 1.00 0.00 H new ATOM 1893 N LEU A 121 5.468 -6.188 2.263 1.00 0.00 N ATOM 1894 CA LEU A 121 4.567 -5.041 1.917 1.00 0.00 C ATOM 1895 C LEU A 121 3.121 -5.363 2.307 1.00 0.00 C ATOM 1896 O LEU A 121 2.549 -6.323 1.839 1.00 0.00 O ATOM 1897 CB LEU A 121 4.627 -4.830 0.402 1.00 0.00 C ATOM 1898 CG LEU A 121 3.844 -3.567 -0.004 1.00 0.00 C ATOM 1899 CD1 LEU A 121 4.561 -2.302 0.506 1.00 0.00 C ATOM 1900 CD2 LEU A 121 3.735 -3.511 -1.535 1.00 0.00 C ATOM 0 H LEU A 121 5.246 -7.061 1.785 1.00 0.00 H new ATOM 0 HA LEU A 121 4.890 -4.149 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.665 -4.738 0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.213 -5.700 -0.108 1.00 0.00 H new ATOM 0 HG LEU A 121 2.849 -3.608 0.439 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.995 -1.419 0.211 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.635 -2.339 1.593 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.561 -2.252 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.182 -2.619 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.734 -3.478 -1.970 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.212 -4.397 -1.895 1.00 0.00 H new ATOM 1912 N THR A 122 2.518 -4.551 3.140 1.00 0.00 N ATOM 1913 CA THR A 122 1.097 -4.785 3.545 1.00 0.00 C ATOM 1914 C THR A 122 0.197 -3.844 2.732 1.00 0.00 C ATOM 1915 O THR A 122 -0.010 -2.702 3.089 1.00 0.00 O ATOM 1916 CB THR A 122 0.951 -4.490 5.044 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.791 -3.400 5.389 1.00 0.00 O ATOM 1918 CG2 THR A 122 1.357 -5.721 5.861 1.00 0.00 C ATOM 0 H THR A 122 2.953 -3.730 3.560 1.00 0.00 H new ATOM 0 HA THR A 122 0.808 -5.819 3.355 1.00 0.00 H new ATOM 0 HB THR A 122 -0.088 -4.242 5.263 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.686 -3.733 5.607 1.00 0.00 H new ATOM 0 HG21 THR A 122 1.251 -5.504 6.924 1.00 0.00 H new ATOM 0 HG22 THR A 122 0.715 -6.561 5.596 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.395 -5.975 5.645 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.324 -4.314 1.630 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.190 -3.448 0.776 1.00 0.00 C ATOM 1928 C LEU A 123 -2.563 -3.254 1.436 1.00 0.00 C ATOM 1929 O LEU A 123 -3.062 -4.125 2.121 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.363 -4.108 -0.599 1.00 0.00 C ATOM 1931 CG LEU A 123 0.012 -4.240 -1.301 1.00 0.00 C ATOM 1932 CD1 LEU A 123 0.757 -5.498 -0.815 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -0.187 -4.336 -2.820 1.00 0.00 C ATOM 0 H LEU A 123 -0.187 -5.263 1.283 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.719 -2.472 0.659 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.818 -5.092 -0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.039 -3.514 -1.214 1.00 0.00 H new ATOM 0 HG LEU A 123 0.604 -3.359 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 123 1.719 -5.569 -1.322 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.917 -5.433 0.261 1.00 0.00 H new ATOM 0 HD13 LEU A 123 0.162 -6.383 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU A 123 0.783 -4.429 -3.309 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -0.796 -5.210 -3.053 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.690 -3.438 -3.179 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.174 -2.105 1.240 1.00 0.00 N ATOM 1946 CA ILE A 124 -4.516 -1.828 1.858 1.00 0.00 C ATOM 1947 C ILE A 124 -5.419 -1.122 0.843 1.00 0.00 C ATOM 1948 O ILE A 124 -4.960 -0.359 0.016 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.351 -0.891 3.060 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.453 -1.534 4.119 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -5.724 -0.593 3.670 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.044 -0.469 5.137 1.00 0.00 C ATOM 0 H ILE A 124 -2.798 -1.343 0.675 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.955 -2.777 2.168 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.889 0.036 2.721 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.981 -2.348 4.617 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.569 -1.967 3.651 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.606 0.073 4.525 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.358 -0.116 2.923 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.187 -1.524 3.997 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.404 -0.918 5.896 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.501 0.329 4.630 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.935 -0.058 5.611 1.00 0.00 H new ATOM 1964 N THR A 125 -6.707 -1.349 0.920 1.00 0.00 N ATOM 1965 CA THR A 125 -7.657 -0.668 -0.015 1.00 0.00 C ATOM 1966 C THR A 125 -8.340 0.485 0.725 1.00 0.00 C ATOM 1967 O THR A 125 -8.294 0.567 1.936 1.00 0.00 O ATOM 1968 CB THR A 125 -8.724 -1.656 -0.483 1.00 0.00 C ATOM 1969 OG1 THR A 125 -9.244 -2.359 0.638 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.115 -2.644 -1.474 1.00 0.00 C ATOM 0 H THR A 125 -7.144 -1.979 1.593 1.00 0.00 H new ATOM 0 HA THR A 125 -7.108 -0.293 -0.878 1.00 0.00 H new ATOM 0 HB THR A 125 -9.530 -1.111 -0.974 1.00 0.00 H new ATOM 0 HG1 THR A 125 -9.012 -1.880 1.461 1.00 0.00 H new ATOM 0 HG21 THR A 125 -8.880 -3.346 -1.804 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.724 -2.102 -2.335 1.00 0.00 H new ATOM 0 HG23 THR A 125 -7.305 -3.191 -0.991 1.00 0.00 H new ATOM 1978 N CYS A 126 -8.978 1.379 0.013 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.666 2.522 0.688 1.00 0.00 C ATOM 1980 C CYS A 126 -10.913 2.910 -0.118 1.00 0.00 C ATOM 1981 O CYS A 126 -10.864 3.771 -0.970 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.699 3.710 0.772 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.690 3.555 2.266 1.00 0.00 S ATOM 0 H CYS A 126 -9.052 1.367 -1.004 1.00 0.00 H new ATOM 0 HA CYS A 126 -9.970 2.235 1.695 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.060 3.737 -0.111 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.256 4.647 0.791 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.260 4.196 3.243 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.034 2.278 0.148 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.292 2.602 -0.604 1.00 0.00 C ATOM 1991 C ASP A 127 -14.444 2.840 0.376 1.00 0.00 C ATOM 1992 O ASP A 127 -14.525 2.227 1.422 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.648 1.427 -1.520 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.465 0.112 -0.759 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -13.306 0.167 0.449 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -13.489 -0.927 -1.398 1.00 0.00 O ATOM 0 H ASP A 127 -12.132 1.550 0.855 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.132 3.503 -1.196 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.678 1.520 -1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.013 1.438 -2.406 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.337 3.727 0.031 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.499 4.018 0.918 1.00 0.00 C ATOM 2003 C ASP A 128 -15.996 4.396 2.309 1.00 0.00 C ATOM 2004 O ASP A 128 -16.104 3.633 3.246 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.392 2.779 1.015 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.751 2.298 -0.393 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -17.593 3.075 -1.321 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -18.177 1.162 -0.519 1.00 0.00 O ATOM 0 H ASP A 128 -15.311 4.267 -0.834 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.074 4.846 0.503 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -16.877 1.988 1.561 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.298 3.014 1.573 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.439 5.566 2.452 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.929 5.985 3.784 1.00 0.00 C ATOM 2015 C TYR A 129 -16.107 6.181 4.751 1.00 0.00 C ATOM 2016 O TYR A 129 -16.981 6.991 4.511 1.00 0.00 O ATOM 2017 CB TYR A 129 -14.139 7.294 3.636 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.789 7.852 4.993 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.725 8.613 5.701 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.521 7.616 5.537 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -14.395 9.135 6.953 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -12.188 8.139 6.790 1.00 0.00 C ATOM 2023 CZ TYR A 129 -13.126 8.899 7.500 1.00 0.00 C ATOM 2024 OH TYR A 129 -12.799 9.417 8.738 1.00 0.00 O ATOM 0 H TYR A 129 -15.316 6.249 1.704 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.271 5.214 4.185 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.229 7.114 3.064 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.729 8.021 3.078 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.702 8.797 5.279 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.799 7.029 4.988 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -15.118 9.721 7.501 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.210 7.957 7.210 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.882 9.159 8.969 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.151 5.446 5.842 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.288 5.610 6.803 1.00 0.00 C ATOM 2036 C ASN A 130 -16.945 6.698 7.830 1.00 0.00 C ATOM 2037 O ASN A 130 -15.957 6.617 8.530 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.534 4.283 7.533 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.519 4.495 8.686 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -19.347 5.383 8.636 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -18.462 3.714 9.731 1.00 0.00 N ATOM 0 H ASN A 130 -15.455 4.748 6.104 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.184 5.899 6.254 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.930 3.543 6.837 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.593 3.889 7.916 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.112 3.849 10.505 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -17.767 2.969 9.773 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.770 7.711 7.930 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.512 8.806 8.916 1.00 0.00 C ATOM 2050 C GLU A 131 -18.250 8.491 10.213 1.00 0.00 C ATOM 2051 O GLU A 131 -18.014 9.096 11.240 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.019 10.138 8.354 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.463 9.980 7.851 1.00 0.00 C ATOM 2054 CD GLU A 131 -19.463 9.369 6.446 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -18.646 9.785 5.641 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -20.280 8.497 6.201 1.00 0.00 O ATOM 0 H GLU A 131 -18.614 7.827 7.369 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.441 8.881 9.106 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.976 10.908 9.125 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.375 10.467 7.539 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -20.027 9.344 8.533 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.960 10.950 7.835 1.00 0.00 H new ATOM 2063 N LYS A 132 -19.137 7.545 10.170 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.892 7.180 11.399 1.00 0.00 C ATOM 2065 C LYS A 132 -18.907 6.656 12.444 1.00 0.00 C ATOM 2066 O LYS A 132 -18.901 7.087 13.580 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.924 6.098 11.068 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.866 6.603 9.962 1.00 0.00 C ATOM 2069 CD LYS A 132 -23.167 5.774 9.954 1.00 0.00 C ATOM 2070 CE LYS A 132 -24.174 6.356 10.958 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.950 7.447 10.305 1.00 0.00 N ATOM 0 H LYS A 132 -19.375 7.006 9.337 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.412 8.055 11.789 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -20.420 5.188 10.743 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.497 5.843 11.959 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -22.098 7.656 10.123 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.373 6.530 8.993 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -23.600 5.773 8.954 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.947 4.737 10.208 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -24.848 5.574 11.308 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.651 6.741 11.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.632 7.842 10.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.300 8.196 9.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -25.461 7.066 9.483 1.00 0.00 H new ATOM 2085 N THR A 133 -18.061 5.734 12.062 1.00 0.00 N ATOM 2086 CA THR A 133 -17.057 5.183 13.020 1.00 0.00 C ATOM 2087 C THR A 133 -15.727 5.909 12.811 1.00 0.00 C ATOM 2088 O THR A 133 -14.823 5.817 13.617 1.00 0.00 O ATOM 2089 CB THR A 133 -16.870 3.686 12.758 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.516 3.485 11.398 1.00 0.00 O ATOM 2091 CG2 THR A 133 -18.175 2.948 13.064 1.00 0.00 C ATOM 0 H THR A 133 -18.023 5.338 11.123 1.00 0.00 H new ATOM 0 HA THR A 133 -17.401 5.328 14.044 1.00 0.00 H new ATOM 0 HB THR A 133 -16.078 3.300 13.399 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.395 2.527 11.230 1.00 0.00 H new ATOM 0 HG21 THR A 133 -18.043 1.882 12.878 1.00 0.00 H new ATOM 0 HG22 THR A 133 -18.444 3.103 14.109 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.969 3.332 12.424 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.603 6.632 11.730 1.00 0.00 N ATOM 2100 CA GLY A 134 -14.334 7.368 11.461 1.00 0.00 C ATOM 2101 C GLY A 134 -13.280 6.395 10.931 1.00 0.00 C ATOM 2102 O GLY A 134 -12.115 6.488 11.262 1.00 0.00 O ATOM 0 H GLY A 134 -16.327 6.745 11.021 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.509 8.162 10.735 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.977 7.844 12.374 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.681 5.457 10.113 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.704 4.469 9.561 1.00 0.00 C ATOM 2108 C VAL A 135 -13.126 4.065 8.150 1.00 0.00 C ATOM 2109 O VAL A 135 -14.263 4.237 7.758 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.694 3.218 10.445 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.428 2.401 10.171 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.722 3.627 11.919 1.00 0.00 C ATOM 0 H VAL A 135 -14.644 5.332 9.802 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.712 4.921 9.537 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.573 2.615 10.218 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -11.425 1.512 10.802 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.408 2.102 9.123 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.549 3.006 10.393 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.715 2.734 12.544 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.846 4.235 12.145 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.625 4.203 12.120 1.00 0.00 H new ATOM 2122 N TRP A 136 -12.227 3.506 7.391 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.590 3.066 6.027 1.00 0.00 C ATOM 2124 C TRP A 136 -13.621 1.948 6.144 1.00 0.00 C ATOM 2125 O TRP A 136 -13.331 0.882 6.648 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.335 2.567 5.303 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.557 3.744 4.809 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.446 4.250 5.390 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.829 4.580 3.652 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -9.023 5.344 4.657 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.842 5.586 3.578 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.828 4.557 2.672 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.845 6.541 2.564 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.839 5.516 1.644 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.849 6.509 1.592 1.00 0.00 C ATOM 0 H TRP A 136 -11.258 3.337 7.661 1.00 0.00 H new ATOM 0 HA TRP A 136 -13.012 3.892 5.455 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.724 1.968 5.978 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.613 1.923 4.469 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.968 3.864 6.278 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.203 5.904 4.888 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.595 3.798 2.706 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.078 7.300 2.529 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.613 5.488 0.891 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.863 7.247 0.803 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.832 2.203 5.707 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.920 1.180 5.805 1.00 0.00 C ATOM 2148 C GLU A 137 -15.358 -0.225 5.552 1.00 0.00 C ATOM 2149 O GLU A 137 -15.077 -0.964 6.475 1.00 0.00 O ATOM 2150 CB GLU A 137 -17.011 1.488 4.772 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.214 0.566 4.995 1.00 0.00 C ATOM 2152 CD GLU A 137 -18.893 0.920 6.321 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.582 1.926 6.360 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -18.712 0.180 7.274 1.00 0.00 O ATOM 0 H GLU A 137 -15.115 3.086 5.282 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.344 1.215 6.809 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.320 2.530 4.856 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.619 1.352 3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -18.922 0.670 4.173 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -17.890 -0.475 5.007 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.183 -0.589 4.306 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.630 -1.940 3.970 1.00 0.00 C ATOM 2163 C LYS A 138 -13.228 -1.760 3.379 1.00 0.00 C ATOM 2164 O LYS A 138 -12.991 -0.874 2.582 1.00 0.00 O ATOM 2165 CB LYS A 138 -15.544 -2.620 2.936 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.766 -3.249 3.637 1.00 0.00 C ATOM 2167 CD LYS A 138 -16.435 -4.672 4.106 1.00 0.00 C ATOM 2168 CE LYS A 138 -17.564 -5.190 5.000 1.00 0.00 C ATOM 2169 NZ LYS A 138 -18.865 -5.057 4.285 1.00 0.00 N ATOM 0 H LYS A 138 -15.401 -0.004 3.500 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.578 -2.560 4.865 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -15.875 -1.890 2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.988 -3.388 2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -17.060 -2.637 4.489 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -17.614 -3.272 2.953 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -16.307 -5.329 3.246 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -15.492 -4.676 4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -17.386 -6.233 5.262 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -17.591 -4.627 5.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.565 -5.693 4.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.200 -4.075 4.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -18.739 -5.310 3.284 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.295 -2.589 3.767 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.907 -2.457 3.229 1.00 0.00 C ATOM 2185 C ARG A 139 -10.248 -3.838 3.152 1.00 0.00 C ATOM 2186 O ARG A 139 -9.981 -4.468 4.156 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.085 -1.546 4.154 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.443 -1.831 5.624 1.00 0.00 C ATOM 2189 CD ARG A 139 -9.280 -1.419 6.534 1.00 0.00 C ATOM 2190 NE ARG A 139 -8.711 -0.125 6.060 1.00 0.00 N ATOM 2191 CZ ARG A 139 -7.909 0.554 6.833 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -7.598 0.095 8.015 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -7.414 1.691 6.424 1.00 0.00 N ATOM 0 H ARG A 139 -12.432 -3.350 4.432 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.947 -2.022 2.230 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.020 -1.713 3.991 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.283 -0.500 3.919 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.344 -1.284 5.901 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.661 -2.891 5.755 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.627 -1.321 7.563 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -8.510 -2.190 6.529 1.00 0.00 H new ATOM 0 HE ARG A 139 -8.948 0.229 5.133 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.982 -0.794 8.334 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -6.971 0.626 8.619 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -7.654 2.049 5.500 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -6.787 2.221 7.029 1.00 0.00 H new ATOM 2207 N LYS A 140 -9.969 -4.308 1.967 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.313 -5.637 1.831 1.00 0.00 C ATOM 2209 C LYS A 140 -7.837 -5.490 2.201 1.00 0.00 C ATOM 2210 O LYS A 140 -7.328 -4.390 2.309 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.428 -6.121 0.383 1.00 0.00 C ATOM 2212 CG LYS A 140 -10.857 -6.599 0.111 1.00 0.00 C ATOM 2213 CD LYS A 140 -10.964 -7.089 -1.337 1.00 0.00 C ATOM 2214 CE LYS A 140 -12.437 -7.174 -1.747 1.00 0.00 C ATOM 2215 NZ LYS A 140 -13.225 -7.793 -0.645 1.00 0.00 N ATOM 0 H LYS A 140 -10.167 -3.829 1.089 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.796 -6.360 2.489 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.167 -5.314 -0.302 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -8.722 -6.932 0.203 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.120 -7.403 0.799 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.563 -5.787 0.285 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -10.431 -6.409 -2.001 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -10.492 -8.067 -1.436 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -12.822 -6.179 -1.969 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -12.539 -7.765 -2.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -14.106 -8.190 -1.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.667 -8.552 -0.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -13.452 -7.070 0.068 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.138 -6.577 2.402 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.694 -6.469 2.770 1.00 0.00 C ATOM 2231 C ILE A 141 -4.919 -7.679 2.243 1.00 0.00 C ATOM 2232 O ILE A 141 -5.334 -8.814 2.379 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.555 -6.397 4.294 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.451 -7.455 4.940 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -5.976 -5.010 4.784 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.216 -7.465 6.452 1.00 0.00 C ATOM 0 H ILE A 141 -7.500 -7.528 2.328 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.284 -5.564 2.322 1.00 0.00 H new ATOM 0 HB ILE A 141 -4.516 -6.580 4.569 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.498 -7.241 4.725 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -6.233 -8.437 4.520 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -5.876 -4.961 5.868 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -5.338 -4.253 4.327 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -7.014 -4.826 4.507 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.854 -8.218 6.914 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.171 -7.699 6.656 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.455 -6.485 6.864 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.781 -7.427 1.650 1.00 0.00 N ATOM 2249 CA PHE A 142 -2.926 -8.526 1.106 1.00 0.00 C ATOM 2250 C PHE A 142 -1.502 -8.312 1.626 1.00 0.00 C ATOM 2251 O PHE A 142 -1.203 -7.284 2.202 1.00 0.00 O ATOM 2252 CB PHE A 142 -2.950 -8.469 -0.432 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.317 -8.010 -0.891 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -4.684 -6.667 -0.751 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -5.220 -8.926 -1.448 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -5.950 -6.238 -1.168 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.486 -8.497 -1.864 1.00 0.00 C ATOM 2258 CZ PHE A 142 -6.851 -7.153 -1.724 1.00 0.00 C ATOM 0 H PHE A 142 -3.401 -6.490 1.517 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.293 -9.502 1.423 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.183 -7.785 -0.795 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.724 -9.451 -0.848 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -3.990 -5.960 -0.321 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.939 -9.963 -1.556 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -6.231 -5.201 -1.060 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -7.181 -9.203 -2.293 1.00 0.00 H new ATOM 0 HZ PHE A 142 -7.828 -6.822 -2.045 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.618 -9.262 1.446 1.00 0.00 N ATOM 2269 CA VAL A 143 0.778 -9.078 1.955 1.00 0.00 C ATOM 2270 C VAL A 143 1.787 -9.752 1.021 1.00 0.00 C ATOM 2271 O VAL A 143 1.539 -10.814 0.474 1.00 0.00 O ATOM 2272 CB VAL A 143 0.899 -9.691 3.352 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.219 -9.250 3.987 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.268 -9.222 4.226 1.00 0.00 C ATOM 0 H VAL A 143 -0.799 -10.148 0.974 1.00 0.00 H new ATOM 0 HA VAL A 143 0.993 -8.010 1.996 1.00 0.00 H new ATOM 0 HB VAL A 143 0.875 -10.778 3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.307 -9.685 4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.051 -9.587 3.368 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.241 -8.163 4.063 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.178 -9.661 5.220 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.249 -8.135 4.306 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.209 -9.536 3.775 1.00 0.00 H new ATOM 2284 N ALA A 144 2.935 -9.135 0.846 1.00 0.00 N ATOM 2285 CA ALA A 144 3.993 -9.709 -0.041 1.00 0.00 C ATOM 2286 C ALA A 144 5.335 -9.660 0.687 1.00 0.00 C ATOM 2287 O ALA A 144 5.760 -8.623 1.156 1.00 0.00 O ATOM 2288 CB ALA A 144 4.085 -8.875 -1.322 1.00 0.00 C ATOM 0 H ALA A 144 3.183 -8.249 1.286 1.00 0.00 H new ATOM 0 HA ALA A 144 3.745 -10.740 -0.291 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.855 -9.290 -1.972 1.00 0.00 H new ATOM 0 HB2 ALA A 144 3.125 -8.895 -1.839 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.340 -7.846 -1.069 1.00 0.00 H new ATOM 2294 N THR A 145 6.009 -10.777 0.788 1.00 0.00 N ATOM 2295 CA THR A 145 7.328 -10.798 1.491 1.00 0.00 C ATOM 2296 C THR A 145 8.454 -10.626 0.468 1.00 0.00 C ATOM 2297 O THR A 145 8.362 -11.085 -0.654 1.00 0.00 O ATOM 2298 CB THR A 145 7.495 -12.127 2.241 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.607 -12.033 3.120 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.727 -13.269 1.250 1.00 0.00 C ATOM 0 H THR A 145 5.703 -11.676 0.414 1.00 0.00 H new ATOM 0 HA THR A 145 7.370 -9.980 2.210 1.00 0.00 H new ATOM 0 HB THR A 145 6.588 -12.331 2.810 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.716 -12.879 3.602 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.844 -14.206 1.795 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.873 -13.345 0.576 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.629 -13.071 0.671 1.00 0.00 H new ATOM 2308 N GLU A 146 9.512 -9.962 0.846 1.00 0.00 N ATOM 2309 CA GLU A 146 10.642 -9.756 -0.103 1.00 0.00 C ATOM 2310 C GLU A 146 11.169 -11.114 -0.570 1.00 0.00 C ATOM 2311 O GLU A 146 11.153 -12.082 0.164 1.00 0.00 O ATOM 2312 CB GLU A 146 11.763 -8.990 0.603 1.00 0.00 C ATOM 2313 CG GLU A 146 12.824 -8.580 -0.419 1.00 0.00 C ATOM 2314 CD GLU A 146 14.020 -7.958 0.306 1.00 0.00 C ATOM 2315 OE1 GLU A 146 14.059 -8.041 1.522 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.877 -7.410 -0.368 1.00 0.00 O ATOM 0 H GLU A 146 9.642 -9.553 1.771 1.00 0.00 H new ATOM 0 HA GLU A 146 10.296 -9.185 -0.965 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.359 -8.107 1.097 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.211 -9.612 1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.145 -9.449 -0.993 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.404 -7.867 -1.128 1.00 0.00 H new ATOM 2323 N VAL A 147 11.636 -11.194 -1.788 1.00 0.00 N ATOM 2324 CA VAL A 147 12.165 -12.488 -2.306 1.00 0.00 C ATOM 2325 C VAL A 147 13.661 -12.583 -2.001 1.00 0.00 C ATOM 2326 O VAL A 147 14.365 -11.593 -1.983 1.00 0.00 O ATOM 2327 CB VAL A 147 11.950 -12.552 -3.820 1.00 0.00 C ATOM 2328 CG1 VAL A 147 10.475 -12.826 -4.118 1.00 0.00 C ATOM 2329 CG2 VAL A 147 12.359 -11.219 -4.451 1.00 0.00 C ATOM 0 H VAL A 147 11.674 -10.417 -2.447 1.00 0.00 H new ATOM 0 HA VAL A 147 11.642 -13.316 -1.827 1.00 0.00 H new ATOM 0 HB VAL A 147 12.559 -13.354 -4.238 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.324 -12.871 -5.197 1.00 0.00 H new ATOM 0 HG12 VAL A 147 10.184 -13.776 -3.671 1.00 0.00 H new ATOM 0 HG13 VAL A 147 9.864 -12.026 -3.699 1.00 0.00 H new ATOM 0 HG21 VAL A 147 12.206 -11.265 -5.529 1.00 0.00 H new ATOM 0 HG22 VAL A 147 11.752 -10.417 -4.032 1.00 0.00 H new ATOM 0 HG23 VAL A 147 13.411 -11.025 -4.242 1.00 0.00 H new ATOM 2339 N LYS A 148 14.152 -13.768 -1.760 1.00 0.00 N ATOM 2340 CA LYS A 148 15.602 -13.926 -1.455 1.00 0.00 C ATOM 2341 C LYS A 148 16.430 -13.182 -2.505 1.00 0.00 C ATOM 2342 O LYS A 148 16.769 -13.793 -3.505 1.00 0.00 O ATOM 2343 CB LYS A 148 15.969 -15.411 -1.477 1.00 0.00 C ATOM 2344 CG LYS A 148 15.161 -16.151 -0.403 1.00 0.00 C ATOM 2345 CD LYS A 148 15.680 -17.588 -0.242 1.00 0.00 C ATOM 2346 CE LYS A 148 15.137 -18.476 -1.368 1.00 0.00 C ATOM 2347 NZ LYS A 148 13.647 -18.429 -1.369 1.00 0.00 N ATOM 2348 OXT LYS A 148 16.710 -12.014 -2.291 1.00 0.00 O ATOM 0 H LYS A 148 13.612 -14.633 -1.761 1.00 0.00 H new ATOM 0 HA LYS A 148 15.811 -13.513 -0.468 1.00 0.00 H new ATOM 0 HB2 LYS A 148 15.761 -15.834 -2.460 1.00 0.00 H new ATOM 0 HB3 LYS A 148 17.036 -15.536 -1.295 1.00 0.00 H new ATOM 0 HG2 LYS A 148 15.235 -15.622 0.547 1.00 0.00 H new ATOM 0 HG3 LYS A 148 14.106 -16.167 -0.678 1.00 0.00 H new ATOM 0 HD2 LYS A 148 16.770 -17.593 -0.259 1.00 0.00 H new ATOM 0 HD3 LYS A 148 15.374 -17.987 0.725 1.00 0.00 H new ATOM 0 HE2 LYS A 148 15.522 -18.137 -2.330 1.00 0.00 H new ATOM 0 HE3 LYS A 148 15.478 -19.502 -1.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 13.270 -19.372 -1.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 13.308 -18.135 -0.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 13.322 -17.747 -2.084 1.00 0.00 H new TER 2362 LYS A 148