USER MOD reduce.3.24.130724 H: found=0, std=0, add=1186, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1185 hydrogens (30 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: C 48 GLN : amide:sc= 0.838 K(o=1.9,f=-6!) USER MOD Set 1.2: C 53 LYS NZ :NH3+ -148:sc= 1.11 (180deg=-0.507) USER MOD Set 2.1: B 1 FME CE :methyl -142:sc= -0.339 (180deg=0) USER MOD Set 2.2: C 42 THR OG1 : rot 69:sc= 0.392 USER MOD Set 3.1: B 48 GLN : amide:sc= 0.489 K(o=1.2,f=-3.7!) USER MOD Set 3.2: B 53 LYS NZ :NH3+ -151:sc= 0.665 (180deg=-0.385) USER MOD Set 4.1: B 32 LYS NZ :NH3+ -174:sc= 0.655 (180deg=1.14) USER MOD Set 4.2: C 50 HIS : no HD1:sc= -3.72! C(o=-3.1!,f=-4.7!) USER MOD Set 5.1: A 48 GLN : amide:sc= 0.706 K(o=1.7,f=-5.4!) USER MOD Set 5.2: A 53 LYS NZ :NH3+ -150:sc= 1.03 (180deg=-0.372) USER MOD Set 6.1: A 50 HIS : no HE2:sc= -3.76! C(o=-3.3!,f=-4.4!) USER MOD Set 6.2: C 32 LYS NZ :NH3+ -167:sc= 0.424 (180deg=1.26) USER MOD Set 7.1: A 42 THR OG1 : rot 71:sc= 0.372 USER MOD Set 7.2: C 1 FME CE :methyl -143:sc= -0.402 (180deg=0) USER MOD Set 8.1: A 32 LYS NZ :NH3+ -161:sc= 0.803 (180deg=1.2) USER MOD Set 8.2: B 50 HIS : no HE2:sc= -3.27! C(o=-2.5!,f=-4.4!) USER MOD Set 9.1: A 1 FME CE :methyl -146:sc= -0.303 (180deg=0) USER MOD Set 9.2: B 42 THR OG1 : rot 69:sc= 0.452 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -122:sc= -8.26! USER MOD Single : A 30 SER OG : rot 180:sc= 0.00394 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 39 GLN : amide:sc= -0.0493 K(o=-0.049,f=-0.79) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 136:sc= 0.734 (180deg=-0.0138) USER MOD Single : A 52 ASN :FLIP amide:sc= -0.53 F(o=-1.2,f=-0.53) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot 180:sc= -0.12 USER MOD Single : B 39 GLN : amide:sc= -0.0169 K(o=-0.017,f=-0.92) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 LYS NZ :NH3+ 137:sc= 0.997 (180deg=-0.0627) USER MOD Single : B 52 ASN :FLIP amide:sc= -0.576 F(o=-1.1,f=-0.58) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 180:sc= 0 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 37 THR OG1 : rot 180:sc= -0.089 USER MOD Single : C 39 GLN : amide:sc= -0.088 K(o=-0.088,f=-0.93) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 49 LYS NZ :NH3+ 137:sc= 0.927 (180deg=0.0269) USER MOD Single : C 52 ASN :FLIP amide:sc= -0.824 F(o=-1.5,f=-0.82) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 2.229 -10.912 12.968 1.00 0.00 N HETATM 2 CN FME A 1 3.396 -10.471 12.519 1.00 0.00 C HETATM 3 O1 FME A 1 4.466 -10.797 13.032 1.00 0.00 O HETATM 4 CA FME A 1 0.978 -10.505 12.340 1.00 0.00 C HETATM 5 CB FME A 1 0.242 -11.714 11.765 1.00 0.00 C HETATM 6 CG FME A 1 -0.854 -11.345 10.780 1.00 0.00 C HETATM 7 SD FME A 1 -1.601 -12.792 10.004 1.00 0.00 S HETATM 8 CE FME A 1 -2.585 -12.017 8.722 1.00 0.00 C HETATM 9 C FME A 1 0.090 -9.797 13.348 1.00 0.00 C HETATM 10 O FME A 1 -0.612 -10.437 14.126 1.00 0.00 O HETATM 0 HG3 FME A 1 -1.626 -10.775 11.297 1.00 0.00 H new HETATM 0 HG2 FME A 1 -0.441 -10.695 10.008 1.00 0.00 H new HETATM 0 HE3 FME A 1 -3.499 -12.591 8.568 1.00 0.00 H new HETATM 0 HE2 FME A 1 -2.841 -11.001 9.024 1.00 0.00 H new HETATM 0 HE1 FME A 1 -2.014 -11.987 7.794 1.00 0.00 H new HETATM 0 HCN FME A 1 3.408 -9.795 11.664 1.00 0.00 H new HETATM 0 HB3 FME A 1 0.962 -12.365 11.268 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.194 -12.287 12.583 1.00 0.00 H new HETATM 0 HA FME A 1 1.214 -9.820 11.526 1.00 0.00 H new HETATM 0 H FME A 1 2.206 -11.547 13.766 1.00 0.00 H new ATOM 21 N VAL A 2 0.130 -8.478 13.335 1.00 0.00 N ATOM 22 CA VAL A 2 -0.658 -7.680 14.263 1.00 0.00 C ATOM 23 C VAL A 2 -1.833 -7.026 13.529 1.00 0.00 C ATOM 24 O VAL A 2 -2.547 -6.184 14.073 1.00 0.00 O ATOM 25 CB VAL A 2 0.230 -6.607 14.941 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.667 -5.547 13.940 1.00 0.00 C ATOM 27 CG2 VAL A 2 -0.472 -5.979 16.140 1.00 0.00 C ATOM 0 H VAL A 2 0.702 -7.932 12.690 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.056 -8.333 15.040 1.00 0.00 H new ATOM 0 HB VAL A 2 1.126 -7.106 15.312 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.289 -4.806 14.443 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.238 -6.017 13.139 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.212 -5.058 13.521 1.00 0.00 H new ATOM 0 HG21 VAL A 2 0.179 -5.231 16.592 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.397 -5.505 15.813 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.700 -6.752 16.874 1.00 0.00 H new ATOM 37 N ILE A 3 -2.040 -7.436 12.286 1.00 0.00 N ATOM 38 CA ILE A 3 -3.100 -6.873 11.470 1.00 0.00 C ATOM 39 C ILE A 3 -3.732 -7.946 10.591 1.00 0.00 C ATOM 40 O ILE A 3 -3.040 -8.831 10.083 1.00 0.00 O ATOM 41 CB ILE A 3 -2.571 -5.720 10.579 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.727 -5.027 9.846 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.536 -6.238 9.584 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.301 -3.819 9.037 1.00 0.00 C ATOM 0 H ILE A 3 -1.487 -8.157 11.823 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.855 -6.473 12.147 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.087 -4.986 11.224 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.207 -5.746 9.182 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.475 -4.718 10.576 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.178 -5.413 8.969 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.698 -6.677 10.126 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.992 -6.995 8.946 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.172 -3.383 8.548 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.848 -3.080 9.698 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.576 -4.124 8.282 1.00 0.00 H new ATOM 56 N ALA A 4 -5.045 -7.887 10.448 1.00 0.00 N ATOM 57 CA ALA A 4 -5.750 -8.739 9.509 1.00 0.00 C ATOM 58 C ALA A 4 -6.464 -7.877 8.480 1.00 0.00 C ATOM 59 O ALA A 4 -6.615 -6.669 8.671 1.00 0.00 O ATOM 60 CB ALA A 4 -6.735 -9.644 10.234 1.00 0.00 C ATOM 0 H ALA A 4 -5.646 -7.253 10.974 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.029 -9.378 8.999 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.252 -10.274 9.510 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.197 -10.273 10.943 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.463 -9.034 10.769 1.00 0.00 H new ATOM 66 N THR A 5 -6.903 -8.490 7.390 1.00 0.00 N ATOM 67 CA THR A 5 -7.582 -7.759 6.329 1.00 0.00 C ATOM 68 C THR A 5 -8.934 -7.238 6.818 1.00 0.00 C ATOM 69 O THR A 5 -9.528 -6.348 6.212 1.00 0.00 O ATOM 70 CB THR A 5 -7.783 -8.650 5.090 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.579 -9.389 4.829 1.00 0.00 O ATOM 72 CG2 THR A 5 -8.141 -7.819 3.862 1.00 0.00 C ATOM 0 H THR A 5 -6.802 -9.490 7.217 1.00 0.00 H new ATOM 0 HA THR A 5 -6.955 -6.912 6.051 1.00 0.00 H new ATOM 0 HB THR A 5 -8.607 -9.334 5.294 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.708 -9.957 4.041 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.276 -8.477 3.004 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.065 -7.272 4.049 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.338 -7.112 3.654 1.00 0.00 H new ATOM 80 N ASP A 6 -9.377 -7.751 7.962 1.00 0.00 N ATOM 81 CA ASP A 6 -10.671 -7.388 8.522 1.00 0.00 C ATOM 82 C ASP A 6 -10.573 -6.066 9.275 1.00 0.00 C ATOM 83 O ASP A 6 -11.579 -5.527 9.732 1.00 0.00 O ATOM 84 CB ASP A 6 -11.174 -8.485 9.469 1.00 0.00 C ATOM 85 CG ASP A 6 -11.416 -9.810 8.771 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.465 -10.619 8.673 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.556 -10.056 8.327 1.00 0.00 O ATOM 0 H ASP A 6 -8.853 -8.424 8.521 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.378 -7.278 7.700 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.446 -8.629 10.267 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.100 -8.154 9.939 1.00 0.00 H new ATOM 92 N ASP A 7 -9.357 -5.540 9.397 1.00 0.00 N ATOM 93 CA ASP A 7 -9.150 -4.236 10.021 1.00 0.00 C ATOM 94 C ASP A 7 -8.936 -3.175 8.951 1.00 0.00 C ATOM 95 O ASP A 7 -8.672 -2.013 9.250 1.00 0.00 O ATOM 96 CB ASP A 7 -7.917 -4.264 10.939 1.00 0.00 C ATOM 97 CG ASP A 7 -7.947 -5.379 11.967 1.00 0.00 C ATOM 98 OD1 ASP A 7 -8.611 -5.217 13.014 1.00 0.00 O ATOM 99 OD2 ASP A 7 -7.290 -6.420 11.741 1.00 0.00 O ATOM 0 H ASP A 7 -8.503 -5.994 9.073 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.036 -3.999 10.611 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.022 -4.370 10.327 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -7.838 -3.308 11.456 1.00 0.00 H new ATOM 104 N LEU A 8 -9.057 -3.584 7.696 1.00 0.00 N ATOM 105 CA LEU A 8 -8.885 -2.670 6.574 1.00 0.00 C ATOM 106 C LEU A 8 -10.096 -2.710 5.652 1.00 0.00 C ATOM 107 O LEU A 8 -10.470 -1.697 5.054 1.00 0.00 O ATOM 108 CB LEU A 8 -7.616 -3.023 5.801 1.00 0.00 C ATOM 109 CG LEU A 8 -6.316 -2.840 6.584 1.00 0.00 C ATOM 110 CD1 LEU A 8 -5.129 -3.337 5.781 1.00 0.00 C ATOM 111 CD2 LEU A 8 -6.122 -1.381 6.954 1.00 0.00 C ATOM 0 H LEU A 8 -9.274 -4.544 7.428 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.791 -1.657 6.965 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.684 -4.061 5.474 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.572 -2.408 4.902 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.385 -3.429 7.498 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.215 -3.197 6.358 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.258 -4.396 5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.059 -2.776 4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.192 -1.267 7.511 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.077 -0.778 6.047 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.957 -1.048 7.570 1.00 0.00 H new ATOM 123 N GLU A 9 -10.728 -3.871 5.588 1.00 0.00 N ATOM 124 CA GLU A 9 -11.898 -4.071 4.751 1.00 0.00 C ATOM 125 C GLU A 9 -12.816 -5.103 5.391 1.00 0.00 C ATOM 126 O GLU A 9 -12.371 -5.966 6.147 1.00 0.00 O ATOM 127 CB GLU A 9 -11.527 -4.497 3.321 1.00 0.00 C ATOM 128 CG GLU A 9 -10.846 -3.396 2.522 1.00 0.00 C ATOM 129 CD GLU A 9 -10.881 -3.616 1.024 1.00 0.00 C ATOM 130 OE1 GLU A 9 -11.843 -3.148 0.366 1.00 0.00 O ATOM 131 OE2 GLU A 9 -9.927 -4.214 0.485 1.00 0.00 O ATOM 0 H GLU A 9 -10.445 -4.698 6.113 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.417 -3.116 4.673 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.868 -5.364 3.367 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.430 -4.811 2.797 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -11.325 -2.444 2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.808 -3.316 2.844 1.00 0.00 H new ATOM 138 N VAL A 10 -14.091 -4.994 5.088 1.00 0.00 N ATOM 139 CA VAL A 10 -15.107 -5.865 5.647 1.00 0.00 C ATOM 140 C VAL A 10 -16.044 -6.318 4.531 1.00 0.00 C ATOM 141 O VAL A 10 -16.253 -5.592 3.564 1.00 0.00 O ATOM 142 CB VAL A 10 -15.890 -5.126 6.761 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.459 -3.817 6.238 1.00 0.00 C ATOM 144 CG2 VAL A 10 -16.994 -6.003 7.335 1.00 0.00 C ATOM 0 H VAL A 10 -14.457 -4.294 4.442 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.637 -6.741 6.093 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.192 -4.900 7.567 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.005 -3.313 7.035 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.645 -3.178 5.895 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.135 -4.020 5.407 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.525 -5.456 8.114 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.692 -6.275 6.543 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.557 -6.907 7.760 1.00 0.00 H new ATOM 154 N ALA A 11 -16.584 -7.523 4.648 1.00 0.00 N ATOM 155 CA ALA A 11 -17.449 -8.077 3.618 1.00 0.00 C ATOM 156 C ALA A 11 -18.732 -7.268 3.483 1.00 0.00 C ATOM 157 O ALA A 11 -19.395 -6.958 4.474 1.00 0.00 O ATOM 158 CB ALA A 11 -17.751 -9.528 3.957 1.00 0.00 C ATOM 0 H ALA A 11 -16.437 -8.137 5.449 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.939 -8.029 2.656 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.399 -9.953 3.191 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.820 -10.093 3.999 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.251 -9.579 4.924 1.00 0.00 H new ATOM 164 N CYS A 12 -19.058 -6.937 2.231 1.00 0.00 N ATOM 165 CA CYS A 12 -20.143 -6.020 1.892 1.00 0.00 C ATOM 166 C CYS A 12 -21.503 -6.515 2.396 1.00 0.00 C ATOM 167 O CYS A 12 -21.658 -7.697 2.704 1.00 0.00 O ATOM 168 CB CYS A 12 -20.202 -5.864 0.363 1.00 0.00 C ATOM 169 SG CYS A 12 -20.817 -4.263 -0.225 1.00 0.00 S ATOM 0 H CYS A 12 -18.568 -7.305 1.415 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.938 -5.066 2.378 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.202 -6.022 -0.041 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.838 -6.651 -0.042 1.00 0.00 H new ATOM 174 N PRO A 13 -22.506 -5.618 2.498 1.00 0.00 N ATOM 175 CA PRO A 13 -23.888 -5.995 2.818 1.00 0.00 C ATOM 176 C PRO A 13 -24.399 -7.233 2.057 1.00 0.00 C ATOM 177 O PRO A 13 -25.126 -8.057 2.606 1.00 0.00 O ATOM 178 CB PRO A 13 -24.669 -4.755 2.365 1.00 0.00 C ATOM 179 CG PRO A 13 -23.751 -3.605 2.604 1.00 0.00 C ATOM 180 CD PRO A 13 -22.360 -4.143 2.369 1.00 0.00 C ATOM 0 HA PRO A 13 -23.993 -6.268 3.868 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.945 -4.826 1.313 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.594 -4.644 2.930 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.972 -2.779 1.927 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.857 -3.222 3.619 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.988 -3.865 1.383 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.653 -3.749 3.099 1.00 0.00 H new ATOM 188 N LYS A 14 -23.991 -7.379 0.805 1.00 0.00 N ATOM 189 CA LYS A 14 -24.682 -8.292 -0.088 1.00 0.00 C ATOM 190 C LYS A 14 -23.782 -8.954 -1.106 1.00 0.00 C ATOM 191 O LYS A 14 -23.975 -10.117 -1.437 1.00 0.00 O ATOM 192 CB LYS A 14 -25.773 -7.512 -0.804 1.00 0.00 C ATOM 193 CG LYS A 14 -26.496 -8.297 -1.883 1.00 0.00 C ATOM 194 CD LYS A 14 -27.556 -7.445 -2.555 1.00 0.00 C ATOM 195 CE LYS A 14 -28.137 -8.141 -3.769 1.00 0.00 C ATOM 196 NZ LYS A 14 -29.076 -9.236 -3.408 1.00 0.00 N ATOM 0 H LYS A 14 -23.199 -6.886 0.392 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.088 -9.100 0.520 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.502 -7.171 -0.069 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.332 -6.622 -1.252 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.779 -8.646 -2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -26.958 -9.182 -1.446 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.352 -7.225 -1.844 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.122 -6.491 -2.854 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.658 -7.410 -4.387 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.326 -8.548 -4.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.444 -9.678 -4.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.575 -9.950 -2.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.867 -8.847 -2.855 1.00 0.00 H new ATOM 210 N CYS A 15 -22.795 -8.264 -1.631 1.00 0.00 N ATOM 211 CA CYS A 15 -22.101 -8.834 -2.767 1.00 0.00 C ATOM 212 C CYS A 15 -20.645 -9.205 -2.490 1.00 0.00 C ATOM 213 O CYS A 15 -19.770 -8.969 -3.349 1.00 0.00 O ATOM 214 CB CYS A 15 -22.109 -7.771 -3.856 1.00 0.00 C ATOM 215 SG CYS A 15 -21.262 -6.243 -3.346 1.00 0.00 S ATOM 0 H CYS A 15 -22.465 -7.353 -1.312 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.611 -9.758 -3.039 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.628 -8.168 -4.750 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -23.139 -7.539 -4.125 1.00 0.00 H new ATOM 220 N GLU A 16 -20.406 -9.878 -1.363 1.00 0.00 N ATOM 221 CA GLU A 16 -19.062 -10.297 -0.946 1.00 0.00 C ATOM 222 C GLU A 16 -18.799 -11.657 -1.549 1.00 0.00 C ATOM 223 O GLU A 16 -18.029 -12.452 -1.012 1.00 0.00 O ATOM 224 CB GLU A 16 -18.984 -10.420 0.603 1.00 0.00 C ATOM 225 CG GLU A 16 -20.218 -9.926 1.345 1.00 0.00 C ATOM 226 CD GLU A 16 -21.314 -10.977 1.414 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.130 -11.032 0.478 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.367 -11.751 2.391 1.00 0.00 O ATOM 0 H GLU A 16 -21.141 -10.150 -0.710 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.329 -9.561 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.815 -11.465 0.862 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.117 -9.860 0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.937 -9.632 2.356 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.604 -9.035 0.850 1.00 0.00 H new ATOM 235 N ARG A 17 -19.441 -11.931 -2.685 1.00 0.00 N ATOM 236 CA ARG A 17 -19.537 -13.279 -3.177 1.00 0.00 C ATOM 237 C ARG A 17 -19.553 -13.224 -4.704 1.00 0.00 C ATOM 238 O ARG A 17 -19.109 -14.152 -5.380 1.00 0.00 O ATOM 239 CB ARG A 17 -20.793 -13.954 -2.630 1.00 0.00 C ATOM 240 CG ARG A 17 -22.071 -13.184 -2.902 1.00 0.00 C ATOM 241 CD ARG A 17 -23.206 -13.684 -2.028 1.00 0.00 C ATOM 242 NE ARG A 17 -22.984 -13.377 -0.616 1.00 0.00 N ATOM 243 CZ ARG A 17 -23.326 -14.185 0.383 1.00 0.00 C ATOM 244 NH1 ARG A 17 -23.944 -15.337 0.135 1.00 0.00 N ATOM 245 NH2 ARG A 17 -23.056 -13.832 1.635 1.00 0.00 N ATOM 0 H ARG A 17 -19.896 -11.231 -3.270 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.684 -13.870 -2.844 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.879 -14.949 -3.068 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.683 -14.088 -1.554 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.906 -12.123 -2.717 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.344 -13.286 -3.952 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -24.142 -13.231 -2.355 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.312 -14.762 -2.153 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.540 -12.489 -0.383 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.158 -15.604 -0.826 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.204 -15.953 0.906 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.589 -12.945 1.825 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.316 -14.447 2.406 1.00 0.00 H new ATOM 259 N ALA A 18 -20.070 -12.099 -5.228 1.00 0.00 N ATOM 260 CA ALA A 18 -20.242 -11.917 -6.671 1.00 0.00 C ATOM 261 C ALA A 18 -19.402 -10.757 -7.191 1.00 0.00 C ATOM 262 O ALA A 18 -18.838 -10.822 -8.277 1.00 0.00 O ATOM 263 CB ALA A 18 -21.710 -11.675 -6.982 1.00 0.00 C ATOM 0 H ALA A 18 -20.375 -11.303 -4.668 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.904 -12.824 -7.172 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.837 -11.540 -8.056 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.298 -12.532 -6.652 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -22.050 -10.780 -6.461 1.00 0.00 H new ATOM 269 N GLY A 19 -19.297 -9.702 -6.398 1.00 0.00 N ATOM 270 CA GLY A 19 -18.568 -8.536 -6.848 1.00 0.00 C ATOM 271 C GLY A 19 -19.475 -7.526 -7.521 1.00 0.00 C ATOM 272 O GLY A 19 -19.012 -6.631 -8.216 1.00 0.00 O ATOM 0 H GLY A 19 -19.698 -9.632 -5.463 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.072 -8.068 -5.998 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.787 -8.843 -7.544 1.00 0.00 H new ATOM 276 N GLU A 20 -20.767 -7.639 -7.251 1.00 0.00 N ATOM 277 CA GLU A 20 -21.772 -6.779 -7.864 1.00 0.00 C ATOM 278 C GLU A 20 -23.112 -6.997 -7.179 1.00 0.00 C ATOM 279 O GLU A 20 -23.259 -7.917 -6.382 1.00 0.00 O ATOM 280 CB GLU A 20 -21.895 -7.007 -9.384 1.00 0.00 C ATOM 281 CG GLU A 20 -21.825 -8.461 -9.822 1.00 0.00 C ATOM 282 CD GLU A 20 -21.917 -8.610 -11.329 1.00 0.00 C ATOM 283 OE1 GLU A 20 -21.089 -8.011 -12.044 1.00 0.00 O ATOM 284 OE2 GLU A 20 -22.810 -9.338 -11.808 1.00 0.00 O ATOM 0 H GLU A 20 -21.149 -8.327 -6.602 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.453 -5.745 -7.729 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.841 -6.586 -9.724 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.101 -6.453 -9.885 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -20.891 -8.900 -9.471 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.635 -9.019 -9.353 1.00 0.00 H new ATOM 291 N ILE A 21 -24.080 -6.163 -7.500 1.00 0.00 N ATOM 292 CA ILE A 21 -25.391 -6.215 -6.867 1.00 0.00 C ATOM 293 C ILE A 21 -26.434 -5.972 -7.925 1.00 0.00 C ATOM 294 O ILE A 21 -26.390 -4.957 -8.618 1.00 0.00 O ATOM 295 CB ILE A 21 -25.559 -5.179 -5.720 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.745 -5.609 -4.492 1.00 0.00 C ATOM 297 CG2 ILE A 21 -27.026 -4.974 -5.348 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.962 -4.755 -3.253 1.00 0.00 C ATOM 0 H ILE A 21 -23.985 -5.431 -8.204 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.504 -7.199 -6.412 1.00 0.00 H new ATOM 0 HB ILE A 21 -25.180 -4.223 -6.080 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.994 -6.643 -4.252 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.686 -5.588 -4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -27.098 -4.243 -4.543 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.575 -4.612 -6.218 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.453 -5.921 -5.018 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -24.346 -5.134 -2.437 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -24.684 -3.723 -3.469 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -26.012 -4.794 -2.963 1.00 0.00 H new ATOM 310 N GLU A 22 -27.360 -6.905 -8.037 1.00 0.00 N ATOM 311 CA GLU A 22 -28.370 -6.864 -9.078 1.00 0.00 C ATOM 312 C GLU A 22 -27.739 -6.634 -10.454 1.00 0.00 C ATOM 313 O GLU A 22 -28.147 -5.747 -11.207 1.00 0.00 O ATOM 314 CB GLU A 22 -29.358 -5.758 -8.754 1.00 0.00 C ATOM 315 CG GLU A 22 -30.614 -5.769 -9.628 1.00 0.00 C ATOM 316 CD GLU A 22 -31.505 -6.983 -9.429 1.00 0.00 C ATOM 317 OE1 GLU A 22 -32.056 -7.152 -8.324 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.674 -7.765 -10.390 1.00 0.00 O ATOM 0 H GLU A 22 -27.434 -7.709 -7.413 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.886 -7.823 -9.114 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -29.655 -5.845 -7.709 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.859 -4.795 -8.865 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -31.194 -4.870 -9.421 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.314 -5.721 -10.675 1.00 0.00 H new ATOM 325 N GLY A 23 -26.699 -7.397 -10.748 1.00 0.00 N ATOM 326 CA GLY A 23 -26.083 -7.332 -12.059 1.00 0.00 C ATOM 327 C GLY A 23 -25.372 -6.020 -12.305 1.00 0.00 C ATOM 328 O GLY A 23 -24.919 -5.746 -13.415 1.00 0.00 O ATOM 0 H GLY A 23 -26.269 -8.061 -10.104 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -25.371 -8.151 -12.163 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.847 -7.475 -12.823 1.00 0.00 H new ATOM 332 N THR A 24 -25.291 -5.203 -11.275 1.00 0.00 N ATOM 333 CA THR A 24 -24.753 -3.864 -11.407 1.00 0.00 C ATOM 334 C THR A 24 -23.581 -3.606 -10.443 1.00 0.00 C ATOM 335 O THR A 24 -23.496 -4.222 -9.375 1.00 0.00 O ATOM 336 CB THR A 24 -25.924 -2.895 -11.165 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.435 -2.426 -12.417 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.568 -1.714 -10.273 1.00 0.00 C ATOM 0 H THR A 24 -25.593 -5.445 -10.331 1.00 0.00 H new ATOM 0 HA THR A 24 -24.331 -3.720 -12.402 1.00 0.00 H new ATOM 0 HB THR A 24 -26.687 -3.462 -10.631 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.181 -1.811 -12.256 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.443 -1.076 -10.148 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.243 -2.079 -9.299 1.00 0.00 H new ATOM 0 HG23 THR A 24 -24.763 -1.141 -10.733 1.00 0.00 H new ATOM 346 N PRO A 25 -22.641 -2.706 -10.832 1.00 0.00 N ATOM 347 CA PRO A 25 -21.494 -2.328 -9.994 1.00 0.00 C ATOM 348 C PRO A 25 -21.941 -1.784 -8.645 1.00 0.00 C ATOM 349 O PRO A 25 -22.780 -0.887 -8.565 1.00 0.00 O ATOM 350 CB PRO A 25 -20.776 -1.242 -10.806 1.00 0.00 C ATOM 351 CG PRO A 25 -21.794 -0.767 -11.781 1.00 0.00 C ATOM 352 CD PRO A 25 -22.633 -1.970 -12.107 1.00 0.00 C ATOM 0 HA PRO A 25 -20.854 -3.181 -9.769 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.432 -0.430 -10.165 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.898 -1.642 -11.313 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.402 0.031 -11.355 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.321 -0.364 -12.677 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.639 -1.691 -12.421 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.200 -2.561 -12.914 1.00 0.00 H new ATOM 360 N CYS A 26 -21.368 -2.331 -7.592 1.00 0.00 N ATOM 361 CA CYS A 26 -21.842 -2.070 -6.240 1.00 0.00 C ATOM 362 C CYS A 26 -21.219 -0.801 -5.632 1.00 0.00 C ATOM 363 O CYS A 26 -20.029 -0.554 -5.806 1.00 0.00 O ATOM 364 CB CYS A 26 -21.542 -3.279 -5.362 1.00 0.00 C ATOM 365 SG CYS A 26 -21.953 -3.053 -3.600 1.00 0.00 S ATOM 0 H CYS A 26 -20.569 -2.963 -7.643 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.917 -1.898 -6.290 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -22.096 -4.136 -5.744 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -20.482 -3.520 -5.447 1.00 0.00 H new ATOM 370 N PRO A 27 -22.038 -0.029 -4.872 1.00 0.00 N ATOM 371 CA PRO A 27 -21.687 1.250 -4.226 1.00 0.00 C ATOM 372 C PRO A 27 -20.206 1.458 -3.886 1.00 0.00 C ATOM 373 O PRO A 27 -19.572 2.397 -4.369 1.00 0.00 O ATOM 374 CB PRO A 27 -22.491 1.156 -2.931 1.00 0.00 C ATOM 375 CG PRO A 27 -23.722 0.374 -3.268 1.00 0.00 C ATOM 376 CD PRO A 27 -23.449 -0.343 -4.584 1.00 0.00 C ATOM 0 HA PRO A 27 -21.899 2.086 -4.892 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.915 0.661 -2.149 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.748 2.147 -2.558 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.952 -0.342 -2.479 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.585 1.034 -3.360 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.609 -1.417 -4.494 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -24.107 0.012 -5.377 1.00 0.00 H new ATOM 384 N ALA A 28 -19.665 0.565 -3.070 1.00 0.00 N ATOM 385 CA ALA A 28 -18.362 0.797 -2.462 1.00 0.00 C ATOM 386 C ALA A 28 -17.411 -0.362 -2.716 1.00 0.00 C ATOM 387 O ALA A 28 -16.252 -0.345 -2.302 1.00 0.00 O ATOM 388 CB ALA A 28 -18.511 1.037 -0.971 1.00 0.00 C ATOM 0 H ALA A 28 -20.103 -0.320 -2.815 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.934 1.686 -2.926 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.529 1.209 -0.530 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.141 1.910 -0.804 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.970 0.164 -0.506 1.00 0.00 H new ATOM 394 N CYS A 29 -17.908 -1.384 -3.382 1.00 0.00 N ATOM 395 CA CYS A 29 -17.073 -2.516 -3.745 1.00 0.00 C ATOM 396 C CYS A 29 -17.269 -2.835 -5.211 1.00 0.00 C ATOM 397 O CYS A 29 -18.140 -3.632 -5.573 1.00 0.00 O ATOM 398 CB CYS A 29 -17.392 -3.730 -2.872 1.00 0.00 C ATOM 399 SG CYS A 29 -19.120 -4.206 -2.887 1.00 0.00 S ATOM 0 H CYS A 29 -18.880 -1.457 -3.683 1.00 0.00 H new ATOM 0 HA CYS A 29 -16.028 -2.258 -3.575 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.790 -4.574 -3.208 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -17.094 -3.515 -1.846 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.590 -4.172 -1.675 1.00 0.00 H new ATOM 404 N SER A 30 -16.482 -2.188 -6.048 1.00 0.00 N ATOM 405 CA SER A 30 -16.601 -2.325 -7.481 1.00 0.00 C ATOM 406 C SER A 30 -16.017 -3.644 -7.988 1.00 0.00 C ATOM 407 O SER A 30 -15.099 -3.653 -8.808 1.00 0.00 O ATOM 408 CB SER A 30 -15.886 -1.140 -8.119 1.00 0.00 C ATOM 409 OG SER A 30 -16.177 0.045 -7.396 1.00 0.00 O ATOM 0 H SER A 30 -15.742 -1.552 -5.750 1.00 0.00 H new ATOM 0 HA SER A 30 -17.656 -2.336 -7.754 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.810 -1.315 -8.129 1.00 0.00 H new ATOM 0 HB3 SER A 30 -16.201 -1.030 -9.157 1.00 0.00 H new ATOM 0 HG SER A 30 -15.713 0.803 -7.810 1.00 0.00 H new ATOM 415 N GLY A 31 -16.530 -4.751 -7.472 1.00 0.00 N ATOM 416 CA GLY A 31 -16.108 -6.048 -7.946 1.00 0.00 C ATOM 417 C GLY A 31 -14.985 -6.602 -7.111 1.00 0.00 C ATOM 418 O GLY A 31 -14.040 -7.183 -7.632 1.00 0.00 O ATOM 0 H GLY A 31 -17.232 -4.772 -6.732 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.953 -6.737 -7.925 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.786 -5.970 -8.985 1.00 0.00 H new ATOM 422 N LYS A 32 -15.089 -6.424 -5.802 1.00 0.00 N ATOM 423 CA LYS A 32 -14.052 -6.855 -4.880 1.00 0.00 C ATOM 424 C LYS A 32 -14.618 -7.911 -3.938 1.00 0.00 C ATOM 425 O LYS A 32 -13.982 -8.922 -3.646 1.00 0.00 O ATOM 426 CB LYS A 32 -13.598 -5.660 -4.049 1.00 0.00 C ATOM 427 CG LYS A 32 -13.031 -4.498 -4.855 1.00 0.00 C ATOM 428 CD LYS A 32 -13.150 -3.186 -4.084 1.00 0.00 C ATOM 429 CE LYS A 32 -12.905 -3.404 -2.603 1.00 0.00 C ATOM 430 NZ LYS A 32 -13.014 -2.157 -1.802 1.00 0.00 N ATOM 0 H LYS A 32 -15.890 -5.980 -5.353 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.214 -7.267 -5.442 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -14.445 -5.299 -3.465 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.841 -5.995 -3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.985 -4.691 -5.091 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.562 -4.416 -5.803 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -12.432 -2.465 -4.473 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -14.142 -2.760 -4.234 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.622 -4.134 -2.226 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.912 -3.831 -2.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.536 -2.289 -0.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.565 -1.373 -2.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -14.017 -1.935 -1.639 1.00 0.00 H new ATOM 444 N GLY A 33 -15.829 -7.640 -3.452 1.00 0.00 N ATOM 445 CA GLY A 33 -16.469 -8.487 -2.481 1.00 0.00 C ATOM 446 C GLY A 33 -16.566 -7.782 -1.146 1.00 0.00 C ATOM 447 O GLY A 33 -17.597 -7.830 -0.478 1.00 0.00 O ATOM 0 H GLY A 33 -16.381 -6.828 -3.727 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.466 -8.760 -2.828 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.905 -9.413 -2.370 1.00 0.00 H new ATOM 451 N VAL A 34 -15.517 -7.053 -0.791 1.00 0.00 N ATOM 452 CA VAL A 34 -15.471 -6.361 0.491 1.00 0.00 C ATOM 453 C VAL A 34 -15.492 -4.840 0.325 1.00 0.00 C ATOM 454 O VAL A 34 -15.291 -4.315 -0.775 1.00 0.00 O ATOM 455 CB VAL A 34 -14.205 -6.765 1.281 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.233 -8.246 1.632 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.947 -6.431 0.491 1.00 0.00 C ATOM 0 H VAL A 34 -14.688 -6.925 -1.371 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.364 -6.659 1.041 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.192 -6.193 2.209 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.332 -8.505 2.187 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.110 -8.458 2.244 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.277 -8.836 0.717 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.068 -6.724 1.066 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.958 -6.971 -0.456 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.913 -5.359 0.297 1.00 0.00 H new ATOM 467 N ILE A 35 -15.765 -4.152 1.425 1.00 0.00 N ATOM 468 CA ILE A 35 -15.753 -2.695 1.472 1.00 0.00 C ATOM 469 C ILE A 35 -14.798 -2.193 2.551 1.00 0.00 C ATOM 470 O ILE A 35 -14.475 -2.910 3.492 1.00 0.00 O ATOM 471 CB ILE A 35 -17.160 -2.117 1.733 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.808 -2.799 2.941 1.00 0.00 C ATOM 473 CG2 ILE A 35 -18.032 -2.269 0.497 1.00 0.00 C ATOM 474 CD1 ILE A 35 -19.168 -2.239 3.304 1.00 0.00 C ATOM 0 H ILE A 35 -16.002 -4.590 2.315 1.00 0.00 H new ATOM 0 HA ILE A 35 -15.413 -2.352 0.495 1.00 0.00 H new ATOM 0 HB ILE A 35 -17.062 -1.055 1.956 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.908 -3.865 2.734 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -17.144 -2.702 3.800 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -19.021 -1.857 0.697 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -17.578 -1.734 -0.337 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -18.123 -3.325 0.244 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.562 -2.773 4.169 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -19.073 -1.180 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.848 -2.361 2.461 1.00 0.00 H new ATOM 486 N LEU A 36 -14.363 -0.951 2.399 1.00 0.00 N ATOM 487 CA LEU A 36 -13.308 -0.388 3.238 1.00 0.00 C ATOM 488 C LEU A 36 -13.829 0.217 4.529 1.00 0.00 C ATOM 489 O LEU A 36 -14.957 0.705 4.604 1.00 0.00 O ATOM 490 CB LEU A 36 -12.564 0.696 2.455 1.00 0.00 C ATOM 491 CG LEU A 36 -11.860 0.213 1.194 1.00 0.00 C ATOM 492 CD1 LEU A 36 -12.204 1.106 0.015 1.00 0.00 C ATOM 493 CD2 LEU A 36 -10.360 0.180 1.419 1.00 0.00 C ATOM 0 H LEU A 36 -14.726 -0.307 1.697 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.647 -1.212 3.507 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -13.274 1.476 2.180 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.825 1.155 3.112 1.00 0.00 H new ATOM 0 HG LEU A 36 -12.203 -0.796 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.692 0.745 -0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -13.281 1.088 -0.153 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.887 2.127 0.227 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.864 -0.167 0.513 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.007 1.181 1.666 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.130 -0.499 2.240 1.00 0.00 H new ATOM 505 N THR A 37 -12.974 0.174 5.539 1.00 0.00 N ATOM 506 CA THR A 37 -13.188 0.905 6.772 1.00 0.00 C ATOM 507 C THR A 37 -12.216 2.083 6.803 1.00 0.00 C ATOM 508 O THR A 37 -11.351 2.178 5.931 1.00 0.00 O ATOM 509 CB THR A 37 -12.981 0.008 8.017 1.00 0.00 C ATOM 510 OG1 THR A 37 -13.211 0.755 9.219 1.00 0.00 O ATOM 511 CG2 THR A 37 -11.577 -0.577 8.045 1.00 0.00 C ATOM 0 H THR A 37 -12.112 -0.371 5.524 1.00 0.00 H new ATOM 0 HA THR A 37 -14.219 1.256 6.802 1.00 0.00 H new ATOM 0 HB THR A 37 -13.699 -0.810 7.957 1.00 0.00 H new ATOM 0 HG1 THR A 37 -13.078 0.173 9.996 1.00 0.00 H new ATOM 0 HG21 THR A 37 -11.461 -1.202 8.930 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.416 -1.180 7.151 1.00 0.00 H new ATOM 0 HG23 THR A 37 -10.846 0.231 8.074 1.00 0.00 H new ATOM 519 N ALA A 38 -12.350 2.965 7.782 1.00 0.00 N ATOM 520 CA ALA A 38 -11.549 4.190 7.842 1.00 0.00 C ATOM 521 C ALA A 38 -10.049 3.911 7.743 1.00 0.00 C ATOM 522 O ALA A 38 -9.331 4.612 7.026 1.00 0.00 O ATOM 523 CB ALA A 38 -11.869 4.954 9.110 1.00 0.00 C ATOM 0 H ALA A 38 -13.009 2.859 8.553 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.813 4.798 6.977 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.270 5.864 9.148 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.927 5.216 9.120 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.641 4.333 9.976 1.00 0.00 H new ATOM 529 N GLN A 39 -9.576 2.894 8.457 1.00 0.00 N ATOM 530 CA GLN A 39 -8.169 2.508 8.388 1.00 0.00 C ATOM 531 C GLN A 39 -7.772 2.139 6.958 1.00 0.00 C ATOM 532 O GLN A 39 -6.725 2.563 6.464 1.00 0.00 O ATOM 533 CB GLN A 39 -7.885 1.337 9.324 1.00 0.00 C ATOM 534 CG GLN A 39 -6.407 1.024 9.452 1.00 0.00 C ATOM 535 CD GLN A 39 -6.112 -0.002 10.522 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.799 -0.074 11.538 1.00 0.00 O ATOM 537 NE2 GLN A 39 -5.089 -0.805 10.292 1.00 0.00 N ATOM 0 H GLN A 39 -10.142 2.325 9.087 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.573 3.365 8.704 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.290 1.562 10.311 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.407 0.453 8.959 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.034 0.660 8.495 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.865 1.942 9.677 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.547 -0.708 9.433 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.841 -1.523 10.973 1.00 0.00 H new ATOM 546 N GLY A 40 -8.625 1.364 6.295 1.00 0.00 N ATOM 547 CA GLY A 40 -8.381 0.981 4.921 1.00 0.00 C ATOM 548 C GLY A 40 -8.487 2.163 3.985 1.00 0.00 C ATOM 549 O GLY A 40 -7.816 2.218 2.958 1.00 0.00 O ATOM 0 H GLY A 40 -9.488 0.993 6.692 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.389 0.538 4.837 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.098 0.216 4.624 1.00 0.00 H new ATOM 553 N TYR A 41 -9.318 3.123 4.354 1.00 0.00 N ATOM 554 CA TYR A 41 -9.454 4.343 3.581 1.00 0.00 C ATOM 555 C TYR A 41 -8.193 5.192 3.669 1.00 0.00 C ATOM 556 O TYR A 41 -7.786 5.807 2.684 1.00 0.00 O ATOM 557 CB TYR A 41 -10.651 5.146 4.093 1.00 0.00 C ATOM 558 CG TYR A 41 -11.972 4.779 3.453 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.228 5.085 2.123 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.965 4.140 4.181 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.436 4.763 1.538 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.176 3.812 3.602 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.406 4.126 2.282 1.00 0.00 C ATOM 564 OH TYR A 41 -15.613 3.807 1.701 1.00 0.00 O ATOM 0 H TYR A 41 -9.908 3.080 5.185 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.611 4.071 2.537 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.732 5.006 5.171 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.461 6.206 3.923 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.470 5.583 1.537 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.789 3.895 5.218 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.620 5.009 0.503 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.938 3.312 4.182 1.00 0.00 H new ATOM 0 HH TYR A 41 -16.185 3.361 2.360 1.00 0.00 H new ATOM 574 N THR A 42 -7.552 5.202 4.824 1.00 0.00 N ATOM 575 CA THR A 42 -6.300 5.929 4.987 1.00 0.00 C ATOM 576 C THR A 42 -5.164 5.257 4.214 1.00 0.00 C ATOM 577 O THR A 42 -4.289 5.924 3.650 1.00 0.00 O ATOM 578 CB THR A 42 -5.917 6.001 6.473 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.048 6.427 7.234 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.755 6.957 6.695 1.00 0.00 C ATOM 0 H THR A 42 -7.874 4.718 5.662 1.00 0.00 H new ATOM 0 HA THR A 42 -6.450 6.934 4.592 1.00 0.00 H new ATOM 0 HB THR A 42 -5.604 5.009 6.798 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.717 5.711 7.254 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.506 6.987 7.756 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.889 6.615 6.129 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.036 7.955 6.360 1.00 0.00 H new ATOM 588 N LEU A 43 -5.214 3.936 4.144 1.00 0.00 N ATOM 589 CA LEU A 43 -4.148 3.167 3.527 1.00 0.00 C ATOM 590 C LEU A 43 -4.358 3.053 2.022 1.00 0.00 C ATOM 591 O LEU A 43 -3.426 2.738 1.291 1.00 0.00 O ATOM 592 CB LEU A 43 -4.067 1.770 4.162 1.00 0.00 C ATOM 593 CG LEU A 43 -2.975 1.583 5.232 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.111 2.615 6.342 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.041 0.180 5.808 1.00 0.00 C ATOM 0 H LEU A 43 -5.984 3.374 4.508 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.207 3.689 3.699 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.033 1.539 4.611 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.902 1.040 3.369 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.005 1.727 4.755 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.327 2.458 7.083 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.018 3.616 5.921 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.086 2.511 6.818 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.264 0.060 6.563 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.018 0.019 6.264 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.888 -0.548 5.011 1.00 0.00 H new ATOM 607 N LEU A 44 -5.563 3.344 1.538 1.00 0.00 N ATOM 608 CA LEU A 44 -5.817 3.240 0.113 1.00 0.00 C ATOM 609 C LEU A 44 -5.370 4.515 -0.598 1.00 0.00 C ATOM 610 O LEU A 44 -4.789 4.454 -1.675 1.00 0.00 O ATOM 611 CB LEU A 44 -7.303 2.914 -0.170 1.00 0.00 C ATOM 612 CG LEU A 44 -8.282 4.095 -0.266 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.239 4.722 -1.654 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.696 3.635 0.039 1.00 0.00 C ATOM 0 H LEU A 44 -6.359 3.646 2.100 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.231 2.411 -0.284 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.353 2.358 -1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.657 2.247 0.616 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.980 4.843 0.468 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.940 5.556 -1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.231 5.084 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.515 3.976 -2.399 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.378 4.482 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.992 2.869 -0.678 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.735 3.223 1.047 1.00 0.00 H new ATOM 626 N ASP A 45 -5.610 5.666 0.023 1.00 0.00 N ATOM 627 CA ASP A 45 -5.255 6.950 -0.585 1.00 0.00 C ATOM 628 C ASP A 45 -3.747 7.134 -0.615 1.00 0.00 C ATOM 629 O ASP A 45 -3.210 7.791 -1.507 1.00 0.00 O ATOM 630 CB ASP A 45 -5.904 8.102 0.191 1.00 0.00 C ATOM 631 CG ASP A 45 -5.485 9.474 -0.316 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.123 9.983 -1.263 1.00 0.00 O ATOM 633 OD2 ASP A 45 -4.530 10.058 0.244 1.00 0.00 O ATOM 0 H ASP A 45 -6.046 5.739 0.942 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.626 6.955 -1.610 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -6.988 8.012 0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.642 8.015 1.245 1.00 0.00 H new ATOM 638 N PHE A 46 -3.061 6.502 0.322 1.00 0.00 N ATOM 639 CA PHE A 46 -1.609 6.568 0.366 1.00 0.00 C ATOM 640 C PHE A 46 -1.002 5.692 -0.707 1.00 0.00 C ATOM 641 O PHE A 46 -0.011 6.066 -1.336 1.00 0.00 O ATOM 642 CB PHE A 46 -1.128 6.086 1.731 1.00 0.00 C ATOM 643 CG PHE A 46 0.353 6.171 1.925 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.937 7.350 2.351 1.00 0.00 C ATOM 645 CD2 PHE A 46 1.163 5.071 1.687 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.301 7.432 2.535 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.526 5.149 1.868 1.00 0.00 C ATOM 648 CZ PHE A 46 3.094 6.332 2.292 1.00 0.00 C ATOM 0 H PHE A 46 -3.483 5.939 1.060 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.300 7.599 0.196 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.619 6.675 2.505 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.443 5.052 1.870 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.319 8.215 2.541 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.720 4.143 1.356 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.747 8.357 2.869 1.00 0.00 H new ATOM 0 HE2 PHE A 46 3.148 4.287 1.679 1.00 0.00 H new ATOM 0 HZ PHE A 46 4.163 6.396 2.434 1.00 0.00 H new ATOM 658 N ILE A 47 -1.604 4.547 -0.952 1.00 0.00 N ATOM 659 CA ILE A 47 -1.065 3.668 -1.960 1.00 0.00 C ATOM 660 C ILE A 47 -1.456 4.174 -3.338 1.00 0.00 C ATOM 661 O ILE A 47 -0.666 4.097 -4.279 1.00 0.00 O ATOM 662 CB ILE A 47 -1.515 2.203 -1.777 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.024 2.065 -2.006 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.139 1.722 -0.385 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.554 0.658 -1.852 1.00 0.00 C ATOM 0 H ILE A 47 -2.444 4.212 -0.480 1.00 0.00 H new ATOM 0 HA ILE A 47 0.020 3.676 -1.855 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.006 1.584 -2.516 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.546 2.716 -1.305 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.261 2.422 -3.008 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.458 0.687 -0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.058 1.787 -0.257 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.630 2.347 0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.629 0.653 -2.031 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.063 0.003 -2.572 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.353 0.302 -0.842 1.00 0.00 H new ATOM 677 N GLN A 48 -2.661 4.735 -3.435 1.00 0.00 N ATOM 678 CA GLN A 48 -3.098 5.426 -4.635 1.00 0.00 C ATOM 679 C GLN A 48 -2.048 6.435 -5.050 1.00 0.00 C ATOM 680 O GLN A 48 -1.394 6.286 -6.063 1.00 0.00 O ATOM 681 CB GLN A 48 -4.413 6.165 -4.381 1.00 0.00 C ATOM 682 CG GLN A 48 -5.645 5.280 -4.352 1.00 0.00 C ATOM 683 CD GLN A 48 -6.328 5.212 -5.700 1.00 0.00 C ATOM 684 OE1 GLN A 48 -6.280 6.167 -6.473 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.974 4.096 -5.987 1.00 0.00 N ATOM 0 H GLN A 48 -3.353 4.721 -2.686 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.246 4.687 -5.423 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.339 6.692 -3.430 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.544 6.921 -5.155 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.362 4.275 -4.038 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.347 5.660 -3.609 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.988 3.328 -5.316 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.459 4.002 -6.880 1.00 0.00 H new ATOM 694 N LYS A 49 -1.803 7.367 -4.160 1.00 0.00 N ATOM 695 CA LYS A 49 -1.063 8.583 -4.455 1.00 0.00 C ATOM 696 C LYS A 49 0.444 8.334 -4.530 1.00 0.00 C ATOM 697 O LYS A 49 1.231 9.258 -4.740 1.00 0.00 O ATOM 698 CB LYS A 49 -1.453 9.599 -3.373 1.00 0.00 C ATOM 699 CG LYS A 49 -0.626 10.875 -3.284 1.00 0.00 C ATOM 700 CD LYS A 49 -1.287 11.880 -2.343 1.00 0.00 C ATOM 701 CE LYS A 49 -1.797 11.210 -1.069 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.587 12.134 -0.216 1.00 0.00 N ATOM 0 H LYS A 49 -2.116 7.306 -3.191 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.318 8.970 -5.441 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.493 9.882 -3.535 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.405 9.098 -2.406 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.377 10.640 -2.928 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.517 11.314 -4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.571 12.660 -2.083 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.117 12.367 -2.855 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.413 10.351 -1.336 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.950 10.829 -0.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.439 11.647 0.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.011 12.436 0.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.865 12.968 -0.772 1.00 0.00 H new ATOM 716 N HIS A 50 0.869 7.085 -4.352 1.00 0.00 N ATOM 717 CA HIS A 50 2.251 6.791 -4.706 1.00 0.00 C ATOM 718 C HIS A 50 2.421 5.812 -5.867 1.00 0.00 C ATOM 719 O HIS A 50 3.537 5.682 -6.365 1.00 0.00 O ATOM 720 CB HIS A 50 3.013 6.287 -3.472 1.00 0.00 C ATOM 721 CG HIS A 50 3.046 7.305 -2.382 1.00 0.00 C ATOM 722 ND1 HIS A 50 3.457 8.590 -2.604 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.664 7.252 -1.085 1.00 0.00 C ATOM 724 CE1 HIS A 50 3.331 9.288 -1.501 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.849 8.506 -0.557 1.00 0.00 N ATOM 0 H HIS A 50 0.318 6.307 -3.989 1.00 0.00 H new ATOM 0 HA HIS A 50 2.670 7.733 -5.059 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.543 5.376 -3.103 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.033 6.027 -3.757 1.00 0.00 H new ATOM 0 HD1 HIS A 50 3.808 8.950 -3.491 1.00 0.00 H new ATOM 0 HD2 HIS A 50 2.285 6.386 -0.563 1.00 0.00 H new ATOM 0 HE1 HIS A 50 3.581 10.332 -1.386 1.00 0.00 H new ATOM 734 N LEU A 51 1.355 5.164 -6.349 1.00 0.00 N ATOM 735 CA LEU A 51 1.512 4.243 -7.489 1.00 0.00 C ATOM 736 C LEU A 51 0.453 4.454 -8.586 1.00 0.00 C ATOM 737 O LEU A 51 0.674 4.089 -9.740 1.00 0.00 O ATOM 738 CB LEU A 51 1.472 2.769 -7.046 1.00 0.00 C ATOM 739 CG LEU A 51 2.505 2.332 -5.994 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.503 0.821 -5.835 1.00 0.00 C ATOM 741 CD2 LEU A 51 3.895 2.799 -6.364 1.00 0.00 C ATOM 0 H LEU A 51 0.406 5.251 -5.987 1.00 0.00 H new ATOM 0 HA LEU A 51 2.492 4.476 -7.905 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.477 2.560 -6.653 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.603 2.145 -7.930 1.00 0.00 H new ATOM 0 HG LEU A 51 2.222 2.793 -5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.241 0.533 -5.086 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.515 0.490 -5.517 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.752 0.355 -6.788 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.603 2.475 -5.601 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.178 2.373 -7.326 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.907 3.887 -6.432 1.00 0.00 H new ATOM 753 N ASN A 52 -0.696 5.013 -8.233 1.00 0.00 N ATOM 754 CA ASN A 52 -1.810 5.150 -9.185 1.00 0.00 C ATOM 755 C ASN A 52 -2.313 6.590 -9.271 1.00 0.00 C ATOM 756 O ASN A 52 -2.934 6.987 -10.255 1.00 0.00 O ATOM 757 CB ASN A 52 -2.955 4.214 -8.796 1.00 0.00 C ATOM 758 CG ASN A 52 -2.939 2.906 -9.572 1.00 0.00 C ATOM 759 OD1 ASN A 52 -1.762 2.469 -9.997 1.00 0.00 O flip ATOM 760 ND2 ASN A 52 -3.985 2.293 -9.788 1.00 0.00 N flip ATOM 0 H ASN A 52 -0.889 5.380 -7.301 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.436 4.873 -10.170 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.895 3.999 -7.729 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.905 4.720 -8.966 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -4.872 2.661 -9.445 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -3.964 1.417 -10.310 1.00 0.00 H new ATOM 767 N LYS A 53 -2.042 7.355 -8.235 1.00 0.00 N ATOM 768 CA LYS A 53 -2.348 8.767 -8.196 1.00 0.00 C ATOM 769 C LYS A 53 -1.047 9.552 -8.295 1.00 0.00 C ATOM 770 O LYS A 53 -0.414 9.788 -7.253 1.00 0.00 O ATOM 771 CB LYS A 53 -3.048 9.123 -6.882 1.00 0.00 C ATOM 772 CG LYS A 53 -4.519 9.468 -7.021 1.00 0.00 C ATOM 773 CD LYS A 53 -5.000 10.229 -5.789 1.00 0.00 C ATOM 774 CE LYS A 53 -5.618 9.314 -4.747 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.873 8.679 -5.230 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.656 9.901 -9.432 1.00 0.00 O ATOM 0 H LYS A 53 -1.597 7.008 -7.385 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.008 9.015 -9.027 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.949 8.283 -6.194 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.532 9.969 -6.428 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.676 10.072 -7.915 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.104 8.557 -7.146 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.161 10.765 -5.346 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.732 10.978 -6.091 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.901 8.539 -4.476 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.827 9.885 -3.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.506 8.503 -4.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.344 9.312 -5.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.648 7.777 -5.697 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 8.362 7.056 13.236 1.00 0.00 N HETATM 792 CN FME B 1 7.394 7.872 12.856 1.00 0.00 C HETATM 793 O1 FME B 1 7.175 8.935 13.431 1.00 0.00 O HETATM 794 CA FME B 1 8.604 5.808 12.537 1.00 0.00 C HETATM 795 CB FME B 1 10.010 5.799 11.936 1.00 0.00 C HETATM 796 CG FME B 1 10.230 4.691 10.920 1.00 0.00 C HETATM 797 SD FME B 1 11.840 4.800 10.120 1.00 0.00 S HETATM 798 CE FME B 1 11.658 3.584 8.818 1.00 0.00 C HETATM 799 C FME B 1 8.438 4.635 13.491 1.00 0.00 C HETATM 800 O FME B 1 9.359 4.285 14.224 1.00 0.00 O HETATM 0 HG3 FME B 1 10.139 3.724 11.416 1.00 0.00 H new HETATM 0 HG2 FME B 1 9.447 4.736 10.163 1.00 0.00 H new HETATM 0 HE3 FME B 1 12.597 3.046 8.689 1.00 0.00 H new HETATM 0 HE2 FME B 1 10.870 2.880 9.085 1.00 0.00 H new HETATM 0 HE1 FME B 1 11.396 4.085 7.886 1.00 0.00 H new HETATM 0 HCN FME B 1 6.771 7.593 12.006 1.00 0.00 H new HETATM 0 HB3 FME B 1 10.198 6.761 11.459 1.00 0.00 H new HETATM 0 HB2 FME B 1 10.739 5.694 12.740 1.00 0.00 H new HETATM 0 HA FME B 1 7.878 5.714 11.729 1.00 0.00 H new HETATM 0 H FME B 1 8.947 7.308 14.032 1.00 0.00 H new ATOM 811 N VAL B 2 7.264 4.029 13.473 1.00 0.00 N ATOM 812 CA VAL B 2 6.964 2.926 14.373 1.00 0.00 C ATOM 813 C VAL B 2 6.983 1.600 13.608 1.00 0.00 C ATOM 814 O VAL B 2 6.602 0.549 14.124 1.00 0.00 O ATOM 815 CB VAL B 2 5.586 3.141 15.051 1.00 0.00 C ATOM 816 CG1 VAL B 2 4.455 3.011 14.041 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.389 2.189 16.223 1.00 0.00 C ATOM 0 H VAL B 2 6.501 4.281 12.845 1.00 0.00 H new ATOM 0 HA VAL B 2 7.728 2.891 15.150 1.00 0.00 H new ATOM 0 HB VAL B 2 5.567 4.156 15.447 1.00 0.00 H new ATOM 0 HG11 VAL B 2 3.500 3.166 14.542 1.00 0.00 H new ATOM 0 HG12 VAL B 2 4.579 3.759 13.257 1.00 0.00 H new ATOM 0 HG13 VAL B 2 4.475 2.015 13.599 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.413 2.366 16.676 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.443 1.160 15.869 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.169 2.359 16.965 1.00 0.00 H new ATOM 827 N ILE B 3 7.451 1.656 12.372 1.00 0.00 N ATOM 828 CA ILE B 3 7.496 0.478 11.526 1.00 0.00 C ATOM 829 C ILE B 3 8.741 0.497 10.646 1.00 0.00 C ATOM 830 O ILE B 3 9.151 1.551 10.156 1.00 0.00 O ATOM 831 CB ILE B 3 6.234 0.380 10.634 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.211 -0.953 9.877 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.170 1.558 9.661 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.950 -1.172 9.069 1.00 0.00 C ATOM 0 H ILE B 3 7.805 2.506 11.933 1.00 0.00 H new ATOM 0 HA ILE B 3 7.530 -0.394 12.179 1.00 0.00 H new ATOM 0 HB ILE B 3 5.355 0.422 11.277 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.072 -0.997 9.210 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.320 -1.769 10.592 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.276 1.471 9.043 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.134 2.492 10.222 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.054 1.552 9.023 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.006 -2.135 8.561 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.086 -1.161 9.733 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.849 -0.378 8.330 1.00 0.00 H new ATOM 846 N ALA B 4 9.357 -0.662 10.484 1.00 0.00 N ATOM 847 CA ALA B 4 10.450 -0.817 9.548 1.00 0.00 C ATOM 848 C ALA B 4 10.074 -1.845 8.494 1.00 0.00 C ATOM 849 O ALA B 4 9.100 -2.583 8.658 1.00 0.00 O ATOM 850 CB ALA B 4 11.724 -1.220 10.274 1.00 0.00 C ATOM 0 H ALA B 4 9.115 -1.512 10.993 1.00 0.00 H new ATOM 0 HA ALA B 4 10.638 0.137 9.056 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.534 -1.332 9.553 1.00 0.00 H new ATOM 0 HB2 ALA B 4 11.988 -0.451 11.000 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.565 -2.167 10.790 1.00 0.00 H new ATOM 856 N THR B 5 10.838 -1.900 7.410 1.00 0.00 N ATOM 857 CA THR B 5 10.556 -2.834 6.329 1.00 0.00 C ATOM 858 C THR B 5 10.773 -4.274 6.795 1.00 0.00 C ATOM 859 O THR B 5 10.320 -5.222 6.159 1.00 0.00 O ATOM 860 CB THR B 5 11.447 -2.541 5.105 1.00 0.00 C ATOM 861 OG1 THR B 5 11.505 -1.125 4.879 1.00 0.00 O ATOM 862 CG2 THR B 5 10.908 -3.229 3.856 1.00 0.00 C ATOM 0 H THR B 5 11.656 -1.310 7.257 1.00 0.00 H new ATOM 0 HA THR B 5 9.513 -2.708 6.040 1.00 0.00 H new ATOM 0 HB THR B 5 12.445 -2.928 5.310 1.00 0.00 H new ATOM 0 HG1 THR B 5 12.073 -0.941 4.102 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.556 -3.005 3.009 1.00 0.00 H new ATOM 0 HG22 THR B 5 10.881 -4.307 4.017 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.901 -2.868 3.648 1.00 0.00 H new ATOM 870 N ASP B 6 11.413 -4.419 7.951 1.00 0.00 N ATOM 871 CA ASP B 6 11.746 -5.727 8.499 1.00 0.00 C ATOM 872 C ASP B 6 10.546 -6.328 9.223 1.00 0.00 C ATOM 873 O ASP B 6 10.587 -7.482 9.651 1.00 0.00 O ATOM 874 CB ASP B 6 12.925 -5.618 9.473 1.00 0.00 C ATOM 875 CG ASP B 6 14.231 -5.238 8.799 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.404 -4.053 8.436 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.107 -6.121 8.653 1.00 0.00 O ATOM 0 H ASP B 6 11.714 -3.636 8.531 1.00 0.00 H new ATOM 0 HA ASP B 6 12.025 -6.377 7.669 1.00 0.00 H new ATOM 0 HB2 ASP B 6 12.689 -4.876 10.236 1.00 0.00 H new ATOM 0 HB3 ASP B 6 13.053 -6.572 9.985 1.00 0.00 H new ATOM 882 N ASP B 7 9.477 -5.543 9.355 1.00 0.00 N ATOM 883 CA ASP B 7 8.238 -6.033 9.955 1.00 0.00 C ATOM 884 C ASP B 7 7.220 -6.363 8.872 1.00 0.00 C ATOM 885 O ASP B 7 6.081 -6.732 9.161 1.00 0.00 O ATOM 886 CB ASP B 7 7.622 -4.971 10.880 1.00 0.00 C ATOM 887 CG ASP B 7 8.548 -4.501 11.986 1.00 0.00 C ATOM 888 OD1 ASP B 7 8.603 -5.161 13.045 1.00 0.00 O ATOM 889 OD2 ASP B 7 9.191 -3.441 11.819 1.00 0.00 O ATOM 0 H ASP B 7 9.445 -4.569 9.055 1.00 0.00 H new ATOM 0 HA ASP B 7 8.482 -6.927 10.529 1.00 0.00 H new ATOM 0 HB2 ASP B 7 7.324 -4.111 10.280 1.00 0.00 H new ATOM 0 HB3 ASP B 7 6.715 -5.377 11.328 1.00 0.00 H new ATOM 894 N LEU B 8 7.636 -6.229 7.622 1.00 0.00 N ATOM 895 CA LEU B 8 6.765 -6.519 6.490 1.00 0.00 C ATOM 896 C LEU B 8 7.411 -7.532 5.560 1.00 0.00 C ATOM 897 O LEU B 8 6.728 -8.360 4.951 1.00 0.00 O ATOM 898 CB LEU B 8 6.443 -5.232 5.734 1.00 0.00 C ATOM 899 CG LEU B 8 5.643 -4.206 6.530 1.00 0.00 C ATOM 900 CD1 LEU B 8 5.479 -2.921 5.739 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.286 -4.768 6.905 1.00 0.00 C ATOM 0 H LEU B 8 8.573 -5.921 7.364 1.00 0.00 H new ATOM 0 HA LEU B 8 5.837 -6.948 6.868 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.378 -4.773 5.412 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.886 -5.486 4.832 1.00 0.00 H new ATOM 0 HG LEU B 8 6.193 -3.980 7.444 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.905 -2.203 6.326 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.461 -2.504 5.515 1.00 0.00 H new ATOM 0 HD13 LEU B 8 4.953 -3.132 4.808 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.728 -4.023 7.473 1.00 0.00 H new ATOM 0 HD22 LEU B 8 3.735 -5.022 6.000 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.418 -5.663 7.513 1.00 0.00 H new ATOM 913 N GLU B 9 8.733 -7.490 5.506 1.00 0.00 N ATOM 914 CA GLU B 9 9.501 -8.377 4.652 1.00 0.00 C ATOM 915 C GLU B 9 10.851 -8.662 5.291 1.00 0.00 C ATOM 916 O GLU B 9 11.361 -7.868 6.082 1.00 0.00 O ATOM 917 CB GLU B 9 9.681 -7.809 3.235 1.00 0.00 C ATOM 918 CG GLU B 9 8.386 -7.757 2.436 1.00 0.00 C ATOM 919 CD GLU B 9 8.593 -7.632 0.939 1.00 0.00 C ATOM 920 OE1 GLU B 9 8.689 -8.680 0.255 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.609 -6.492 0.430 1.00 0.00 O ATOM 0 H GLU B 9 9.301 -6.842 6.052 1.00 0.00 H new ATOM 0 HA GLU B 9 8.943 -9.308 4.550 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.097 -6.804 3.304 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.407 -8.418 2.697 1.00 0.00 H new ATOM 0 HG2 GLU B 9 7.809 -8.659 2.639 1.00 0.00 H new ATOM 0 HG3 GLU B 9 7.790 -6.912 2.782 1.00 0.00 H new ATOM 928 N VAL B 10 11.407 -9.805 4.958 1.00 0.00 N ATOM 929 CA VAL B 10 12.662 -10.259 5.524 1.00 0.00 C ATOM 930 C VAL B 10 13.544 -10.815 4.410 1.00 0.00 C ATOM 931 O VAL B 10 13.037 -11.359 3.430 1.00 0.00 O ATOM 932 CB VAL B 10 12.398 -11.332 6.608 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.554 -12.471 6.053 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.697 -11.859 7.196 1.00 0.00 C ATOM 0 H VAL B 10 11.000 -10.452 4.282 1.00 0.00 H new ATOM 0 HA VAL B 10 13.177 -9.422 5.996 1.00 0.00 H new ATOM 0 HB VAL B 10 11.839 -10.855 7.413 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.383 -13.211 6.834 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.597 -12.080 5.708 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.077 -12.938 5.219 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.475 -12.610 7.954 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.299 -12.308 6.405 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.250 -11.037 7.651 1.00 0.00 H new ATOM 944 N ALA B 11 14.855 -10.663 4.546 1.00 0.00 N ATOM 945 CA ALA B 11 15.778 -11.102 3.510 1.00 0.00 C ATOM 946 C ALA B 11 15.736 -12.610 3.345 1.00 0.00 C ATOM 947 O ALA B 11 15.731 -13.362 4.320 1.00 0.00 O ATOM 948 CB ALA B 11 17.187 -10.636 3.835 1.00 0.00 C ATOM 0 H ALA B 11 15.301 -10.241 5.360 1.00 0.00 H new ATOM 0 HA ALA B 11 15.471 -10.656 2.564 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.870 -10.970 3.054 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.206 -9.548 3.893 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.497 -11.056 4.792 1.00 0.00 H new ATOM 954 N CYS B 12 15.691 -13.030 2.087 1.00 0.00 N ATOM 955 CA CYS B 12 15.444 -14.408 1.714 1.00 0.00 C ATOM 956 C CYS B 12 16.536 -15.376 2.182 1.00 0.00 C ATOM 957 O CYS B 12 17.639 -14.966 2.520 1.00 0.00 O ATOM 958 CB CYS B 12 15.330 -14.482 0.199 1.00 0.00 C ATOM 959 SG CYS B 12 13.855 -15.323 -0.373 1.00 0.00 S ATOM 0 H CYS B 12 15.828 -12.410 1.289 1.00 0.00 H new ATOM 0 HA CYS B 12 14.523 -14.717 2.208 1.00 0.00 H new ATOM 0 HB2 CYS B 12 15.341 -13.471 -0.207 1.00 0.00 H new ATOM 0 HB3 CYS B 12 16.206 -14.994 -0.198 1.00 0.00 H new ATOM 964 N PRO B 13 16.228 -16.689 2.193 1.00 0.00 N ATOM 965 CA PRO B 13 17.204 -17.745 2.493 1.00 0.00 C ATOM 966 C PRO B 13 18.536 -17.603 1.746 1.00 0.00 C ATOM 967 O PRO B 13 19.596 -17.910 2.291 1.00 0.00 O ATOM 968 CB PRO B 13 16.487 -18.999 1.991 1.00 0.00 C ATOM 969 CG PRO B 13 15.047 -18.731 2.218 1.00 0.00 C ATOM 970 CD PRO B 13 14.871 -17.249 1.991 1.00 0.00 C ATOM 0 HA PRO B 13 17.478 -17.736 3.548 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.694 -19.177 0.936 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.814 -19.886 2.534 1.00 0.00 H new ATOM 0 HG2 PRO B 13 14.428 -19.309 1.532 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.750 -19.011 3.229 1.00 0.00 H new ATOM 0 HD2 PRO B 13 14.499 -17.041 0.988 1.00 0.00 H new ATOM 0 HD3 PRO B 13 14.155 -16.821 2.692 1.00 0.00 H new ATOM 978 N LYS B 14 18.485 -17.134 0.498 1.00 0.00 N ATOM 979 CA LYS B 14 19.634 -17.277 -0.396 1.00 0.00 C ATOM 980 C LYS B 14 19.765 -16.152 -1.428 1.00 0.00 C ATOM 981 O LYS B 14 20.873 -15.826 -1.846 1.00 0.00 O ATOM 982 CB LYS B 14 19.534 -18.632 -1.116 1.00 0.00 C ATOM 983 CG LYS B 14 20.630 -18.893 -2.141 1.00 0.00 C ATOM 984 CD LYS B 14 20.350 -20.171 -2.927 1.00 0.00 C ATOM 985 CE LYS B 14 21.253 -20.301 -4.146 1.00 0.00 C ATOM 986 NZ LYS B 14 22.674 -20.543 -3.782 1.00 0.00 N ATOM 0 H LYS B 14 17.678 -16.662 0.090 1.00 0.00 H new ATOM 0 HA LYS B 14 20.528 -17.219 0.224 1.00 0.00 H new ATOM 0 HB2 LYS B 14 19.557 -19.426 -0.370 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.567 -18.692 -1.616 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.701 -18.048 -2.826 1.00 0.00 H new ATOM 0 HG3 LYS B 14 21.593 -18.976 -1.636 1.00 0.00 H new ATOM 0 HD2 LYS B 14 20.492 -21.035 -2.277 1.00 0.00 H new ATOM 0 HD3 LYS B 14 19.308 -20.180 -3.246 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.897 -21.120 -4.771 1.00 0.00 H new ATOM 0 HE3 LYS B 14 21.185 -19.392 -4.743 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 23.245 -20.624 -4.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 23.025 -19.750 -3.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.747 -21.425 -3.236 1.00 0.00 H new ATOM 1000 N CYS B 15 18.660 -15.562 -1.871 1.00 0.00 N ATOM 1001 CA CYS B 15 18.751 -14.647 -3.010 1.00 0.00 C ATOM 1002 C CYS B 15 18.373 -13.197 -2.695 1.00 0.00 C ATOM 1003 O CYS B 15 17.757 -12.521 -3.520 1.00 0.00 O ATOM 1004 CB CYS B 15 17.778 -15.164 -4.054 1.00 0.00 C ATOM 1005 SG CYS B 15 16.079 -15.261 -3.448 1.00 0.00 S ATOM 0 H CYS B 15 17.726 -15.690 -1.481 1.00 0.00 H new ATOM 0 HA CYS B 15 19.791 -14.627 -3.334 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.810 -14.512 -4.927 1.00 0.00 H new ATOM 0 HB3 CYS B 15 18.098 -16.153 -4.383 1.00 0.00 H new ATOM 1010 N GLU B 16 18.840 -12.691 -1.570 1.00 0.00 N ATOM 1011 CA GLU B 16 18.492 -11.349 -1.112 1.00 0.00 C ATOM 1012 C GLU B 16 19.498 -10.371 -1.661 1.00 0.00 C ATOM 1013 O GLU B 16 19.751 -9.315 -1.082 1.00 0.00 O ATOM 1014 CB GLU B 16 18.549 -11.271 0.422 1.00 0.00 C ATOM 1015 CG GLU B 16 18.724 -12.603 1.128 1.00 0.00 C ATOM 1016 CD GLU B 16 20.172 -13.057 1.127 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.603 -13.649 0.124 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.888 -12.804 2.119 1.00 0.00 O ATOM 0 H GLU B 16 19.471 -13.193 -0.945 1.00 0.00 H new ATOM 0 HA GLU B 16 17.484 -11.115 -1.454 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.372 -10.616 0.707 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.631 -10.805 0.781 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.371 -12.519 2.156 1.00 0.00 H new ATOM 0 HG3 GLU B 16 18.107 -13.357 0.639 1.00 0.00 H new ATOM 1025 N ARG B 17 20.071 -10.732 -2.791 1.00 0.00 N ATOM 1026 CA ARG B 17 21.288 -10.129 -3.253 1.00 0.00 C ATOM 1027 C ARG B 17 21.248 -10.137 -4.778 1.00 0.00 C ATOM 1028 O ARG B 17 21.828 -9.281 -5.441 1.00 0.00 O ATOM 1029 CB ARG B 17 22.492 -10.907 -2.721 1.00 0.00 C ATOM 1030 CG ARG B 17 22.450 -12.393 -3.054 1.00 0.00 C ATOM 1031 CD ARG B 17 23.462 -13.180 -2.244 1.00 0.00 C ATOM 1032 NE ARG B 17 23.111 -13.227 -0.825 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.994 -13.158 0.166 1.00 0.00 C ATOM 1034 NH1 ARG B 17 25.290 -13.042 -0.100 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.580 -13.203 1.425 1.00 0.00 N ATOM 0 H ARG B 17 19.700 -11.453 -3.410 1.00 0.00 H new ATOM 0 HA ARG B 17 21.383 -9.105 -2.892 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.404 -10.476 -3.133 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.543 -10.786 -1.639 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.450 -12.781 -2.861 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.647 -12.533 -4.117 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.528 -14.195 -2.635 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.448 -12.729 -2.359 1.00 0.00 H new ATOM 0 HE ARG B 17 22.125 -13.319 -0.580 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.611 -13.006 -1.068 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.965 -12.989 0.663 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.585 -13.290 1.632 1.00 0.00 H new ATOM 0 HH22 ARG B 17 24.257 -13.150 2.187 1.00 0.00 H new ATOM 1049 N ALA B 18 20.522 -11.130 -5.324 1.00 0.00 N ATOM 1050 CA ALA B 18 20.480 -11.342 -6.769 1.00 0.00 C ATOM 1051 C ALA B 18 19.062 -11.230 -7.326 1.00 0.00 C ATOM 1052 O ALA B 18 18.857 -10.716 -8.426 1.00 0.00 O ATOM 1053 CB ALA B 18 21.066 -12.702 -7.120 1.00 0.00 C ATOM 0 H ALA B 18 19.962 -11.790 -4.784 1.00 0.00 H new ATOM 0 HA ALA B 18 21.079 -10.555 -7.228 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.028 -12.847 -8.200 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.102 -12.750 -6.783 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.488 -13.485 -6.629 1.00 0.00 H new ATOM 1059 N GLY B 19 18.083 -11.705 -6.559 1.00 0.00 N ATOM 1060 CA GLY B 19 16.706 -11.669 -7.016 1.00 0.00 C ATOM 1061 C GLY B 19 16.299 -12.936 -7.754 1.00 0.00 C ATOM 1062 O GLY B 19 15.317 -12.948 -8.488 1.00 0.00 O ATOM 0 H GLY B 19 18.219 -12.112 -5.634 1.00 0.00 H new ATOM 0 HA2 GLY B 19 16.047 -11.525 -6.160 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.568 -10.810 -7.673 1.00 0.00 H new ATOM 1066 N GLU B 20 17.033 -14.012 -7.503 1.00 0.00 N ATOM 1067 CA GLU B 20 16.800 -15.308 -8.149 1.00 0.00 C ATOM 1068 C GLU B 20 17.649 -16.372 -7.475 1.00 0.00 C ATOM 1069 O GLU B 20 18.501 -16.055 -6.650 1.00 0.00 O ATOM 1070 CB GLU B 20 17.098 -15.284 -9.657 1.00 0.00 C ATOM 1071 CG GLU B 20 18.291 -14.432 -10.058 1.00 0.00 C ATOM 1072 CD GLU B 20 18.445 -14.334 -11.562 1.00 0.00 C ATOM 1073 OE1 GLU B 20 17.481 -13.916 -12.241 1.00 0.00 O ATOM 1074 OE2 GLU B 20 19.535 -14.657 -12.073 1.00 0.00 O ATOM 0 H GLU B 20 17.811 -14.016 -6.844 1.00 0.00 H new ATOM 0 HA GLU B 20 15.741 -15.539 -8.037 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.269 -16.306 -9.995 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.215 -14.918 -10.182 1.00 0.00 H new ATOM 0 HG2 GLU B 20 18.178 -13.432 -9.640 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.199 -14.856 -9.628 1.00 0.00 H new ATOM 1081 N ILE B 21 17.433 -17.619 -7.840 1.00 0.00 N ATOM 1082 CA ILE B 21 18.145 -18.731 -7.230 1.00 0.00 C ATOM 1083 C ILE B 21 18.458 -19.754 -8.291 1.00 0.00 C ATOM 1084 O ILE B 21 17.559 -20.248 -8.973 1.00 0.00 O ATOM 1085 CB ILE B 21 17.357 -19.377 -6.064 1.00 0.00 C ATOM 1086 CG1 ILE B 21 17.378 -18.434 -4.850 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.899 -20.751 -5.698 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.795 -19.006 -3.580 1.00 0.00 C ATOM 0 H ILE B 21 16.766 -17.892 -8.561 1.00 0.00 H new ATOM 0 HA ILE B 21 19.068 -18.344 -6.798 1.00 0.00 H new ATOM 0 HB ILE B 21 16.327 -19.527 -6.389 1.00 0.00 H new ATOM 0 HG12 ILE B 21 18.410 -18.140 -4.657 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.830 -17.527 -5.106 1.00 0.00 H new ATOM 0 HG21 ILE B 21 17.315 -21.165 -4.876 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.829 -21.412 -6.562 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.942 -20.662 -5.394 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.857 -18.263 -2.784 1.00 0.00 H new ATOM 0 HD12 ILE B 21 15.751 -19.273 -3.747 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.355 -19.895 -3.291 1.00 0.00 H new ATOM 1100 N GLU B 22 19.738 -20.062 -8.413 1.00 0.00 N ATOM 1101 CA GLU B 22 20.228 -20.918 -9.476 1.00 0.00 C ATOM 1102 C GLU B 22 19.678 -20.462 -10.834 1.00 0.00 C ATOM 1103 O GLU B 22 19.058 -21.230 -11.564 1.00 0.00 O ATOM 1104 CB GLU B 22 19.820 -22.352 -9.165 1.00 0.00 C ATOM 1105 CG GLU B 22 20.373 -23.402 -10.134 1.00 0.00 C ATOM 1106 CD GLU B 22 21.872 -23.610 -10.050 1.00 0.00 C ATOM 1107 OE1 GLU B 22 22.374 -23.961 -8.965 1.00 0.00 O ATOM 1108 OE2 GLU B 22 22.556 -23.437 -11.082 1.00 0.00 O ATOM 0 H GLU B 22 20.463 -19.726 -7.779 1.00 0.00 H new ATOM 0 HA GLU B 22 21.315 -20.857 -9.535 1.00 0.00 H new ATOM 0 HB2 GLU B 22 20.152 -22.599 -8.156 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.732 -22.414 -9.167 1.00 0.00 H new ATOM 0 HG2 GLU B 22 19.876 -24.353 -9.941 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.116 -23.109 -11.152 1.00 0.00 H new ATOM 1115 N GLY B 23 19.836 -19.177 -11.122 1.00 0.00 N ATOM 1116 CA GLY B 23 19.474 -18.662 -12.435 1.00 0.00 C ATOM 1117 C GLY B 23 17.983 -18.744 -12.707 1.00 0.00 C ATOM 1118 O GLY B 23 17.538 -18.609 -13.847 1.00 0.00 O ATOM 0 H GLY B 23 20.207 -18.481 -10.475 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.797 -17.624 -12.515 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.010 -19.223 -13.201 1.00 0.00 H new ATOM 1122 N THR B 24 17.228 -18.982 -11.656 1.00 0.00 N ATOM 1123 CA THR B 24 15.807 -19.239 -11.774 1.00 0.00 C ATOM 1124 C THR B 24 14.991 -18.389 -10.791 1.00 0.00 C ATOM 1125 O THR B 24 15.467 -18.055 -9.702 1.00 0.00 O ATOM 1126 CB THR B 24 15.583 -20.751 -11.554 1.00 0.00 C ATOM 1127 OG1 THR B 24 15.490 -21.420 -12.819 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.351 -21.060 -10.711 1.00 0.00 C ATOM 0 H THR B 24 17.579 -19.003 -10.699 1.00 0.00 H new ATOM 0 HA THR B 24 15.458 -18.954 -12.767 1.00 0.00 H new ATOM 0 HB THR B 24 16.444 -21.118 -10.996 1.00 0.00 H new ATOM 0 HG1 THR B 24 15.350 -22.379 -12.672 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.251 -22.139 -10.594 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.456 -20.597 -9.730 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.463 -20.665 -11.205 1.00 0.00 H new ATOM 1136 N PRO B 25 13.752 -18.007 -11.184 1.00 0.00 N ATOM 1137 CA PRO B 25 12.848 -17.211 -10.342 1.00 0.00 C ATOM 1138 C PRO B 25 12.583 -17.887 -9.001 1.00 0.00 C ATOM 1139 O PRO B 25 12.211 -19.059 -8.939 1.00 0.00 O ATOM 1140 CB PRO B 25 11.557 -17.115 -11.168 1.00 0.00 C ATOM 1141 CG PRO B 25 11.663 -18.222 -12.159 1.00 0.00 C ATOM 1142 CD PRO B 25 13.126 -18.336 -12.475 1.00 0.00 C ATOM 0 HA PRO B 25 13.270 -16.236 -10.097 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.674 -17.229 -10.539 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.473 -16.147 -11.662 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.276 -19.155 -11.749 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.083 -18.003 -13.056 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.392 -19.338 -12.813 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.427 -17.644 -13.261 1.00 0.00 H new ATOM 1150 N CYS B 26 12.765 -17.130 -7.936 1.00 0.00 N ATOM 1151 CA CYS B 26 12.770 -17.688 -6.593 1.00 0.00 C ATOM 1152 C CYS B 26 11.362 -17.807 -5.991 1.00 0.00 C ATOM 1153 O CYS B 26 10.544 -16.904 -6.142 1.00 0.00 O ATOM 1154 CB CYS B 26 13.654 -16.834 -5.698 1.00 0.00 C ATOM 1155 SG CYS B 26 13.648 -17.358 -3.956 1.00 0.00 S ATOM 0 H CYS B 26 12.912 -16.121 -7.973 1.00 0.00 H new ATOM 0 HA CYS B 26 13.166 -18.701 -6.660 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.676 -16.865 -6.075 1.00 0.00 H new ATOM 0 HB3 CYS B 26 13.324 -15.797 -5.758 1.00 0.00 H new ATOM 1160 N PRO B 27 11.109 -18.928 -5.266 1.00 0.00 N ATOM 1161 CA PRO B 27 9.829 -19.288 -4.628 1.00 0.00 C ATOM 1162 C PRO B 27 8.897 -18.131 -4.238 1.00 0.00 C ATOM 1163 O PRO B 27 7.760 -18.049 -4.699 1.00 0.00 O ATOM 1164 CB PRO B 27 10.315 -19.984 -3.359 1.00 0.00 C ATOM 1165 CG PRO B 27 11.619 -20.627 -3.713 1.00 0.00 C ATOM 1166 CD PRO B 27 12.087 -20.005 -5.019 1.00 0.00 C ATOM 0 HA PRO B 27 9.214 -19.863 -5.321 1.00 0.00 H new ATOM 0 HB2 PRO B 27 10.441 -19.269 -2.546 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.593 -20.727 -3.021 1.00 0.00 H new ATOM 0 HG2 PRO B 27 12.354 -20.465 -2.925 1.00 0.00 H new ATOM 0 HG3 PRO B 27 11.500 -21.705 -3.821 1.00 0.00 H new ATOM 0 HD2 PRO B 27 13.101 -19.613 -4.935 1.00 0.00 H new ATOM 0 HD3 PRO B 27 12.093 -20.734 -5.830 1.00 0.00 H new ATOM 1174 N ALA B 28 9.394 -17.237 -3.390 1.00 0.00 N ATOM 1175 CA ALA B 28 8.542 -16.247 -2.736 1.00 0.00 C ATOM 1176 C ALA B 28 9.066 -14.834 -2.956 1.00 0.00 C ATOM 1177 O ALA B 28 8.476 -13.854 -2.503 1.00 0.00 O ATOM 1178 CB ALA B 28 8.432 -16.556 -1.248 1.00 0.00 C ATOM 0 H ALA B 28 10.381 -17.176 -3.139 1.00 0.00 H new ATOM 0 HA ALA B 28 7.549 -16.302 -3.182 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.795 -15.813 -0.768 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.998 -17.547 -1.113 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.424 -16.529 -0.797 1.00 0.00 H new ATOM 1184 N CYS B 29 10.189 -14.735 -3.634 1.00 0.00 N ATOM 1185 CA CYS B 29 10.755 -13.444 -3.962 1.00 0.00 C ATOM 1186 C CYS B 29 11.101 -13.408 -5.435 1.00 0.00 C ATOM 1187 O CYS B 29 12.210 -13.773 -5.829 1.00 0.00 O ATOM 1188 CB CYS B 29 11.998 -13.179 -3.107 1.00 0.00 C ATOM 1189 SG CYS B 29 13.336 -14.373 -3.348 1.00 0.00 S ATOM 0 H CYS B 29 10.728 -15.533 -3.969 1.00 0.00 H new ATOM 0 HA CYS B 29 10.025 -12.662 -3.750 1.00 0.00 H new ATOM 0 HB2 CYS B 29 12.373 -12.181 -3.332 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.709 -13.182 -2.056 1.00 0.00 H new ATOM 1194 N SER B 30 10.158 -12.988 -6.261 1.00 0.00 N ATOM 1195 CA SER B 30 10.342 -13.025 -7.697 1.00 0.00 C ATOM 1196 C SER B 30 11.209 -11.867 -8.185 1.00 0.00 C ATOM 1197 O SER B 30 10.783 -11.057 -9.005 1.00 0.00 O ATOM 1198 CB SER B 30 8.972 -12.987 -8.367 1.00 0.00 C ATOM 1199 OG SER B 30 8.066 -13.848 -7.693 1.00 0.00 O ATOM 0 H SER B 30 9.257 -12.617 -5.959 1.00 0.00 H new ATOM 0 HA SER B 30 10.862 -13.945 -7.962 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.586 -11.968 -8.362 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.062 -13.289 -9.410 1.00 0.00 H new ATOM 0 HG SER B 30 7.191 -13.812 -8.133 1.00 0.00 H new ATOM 1205 N GLY B 31 12.420 -11.784 -7.659 1.00 0.00 N ATOM 1206 CA GLY B 31 13.346 -10.771 -8.102 1.00 0.00 C ATOM 1207 C GLY B 31 13.257 -9.538 -7.251 1.00 0.00 C ATOM 1208 O GLY B 31 13.293 -8.419 -7.753 1.00 0.00 O ATOM 0 H GLY B 31 12.777 -12.403 -6.931 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.362 -11.165 -8.069 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.137 -10.514 -9.140 1.00 0.00 H new ATOM 1212 N LYS B 32 13.140 -9.744 -5.950 1.00 0.00 N ATOM 1213 CA LYS B 32 12.994 -8.659 -5.005 1.00 0.00 C ATOM 1214 C LYS B 32 14.188 -8.648 -4.062 1.00 0.00 C ATOM 1215 O LYS B 32 14.747 -7.601 -3.747 1.00 0.00 O ATOM 1216 CB LYS B 32 11.732 -8.880 -4.180 1.00 0.00 C ATOM 1217 CG LYS B 32 10.443 -8.943 -4.985 1.00 0.00 C ATOM 1218 CD LYS B 32 9.363 -9.707 -4.227 1.00 0.00 C ATOM 1219 CE LYS B 32 9.442 -9.426 -2.735 1.00 0.00 C ATOM 1220 NZ LYS B 32 8.402 -10.140 -1.948 1.00 0.00 N ATOM 0 H LYS B 32 13.144 -10.670 -5.523 1.00 0.00 H new ATOM 0 HA LYS B 32 12.933 -7.714 -5.545 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.839 -9.809 -3.620 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.648 -8.076 -3.449 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.095 -7.933 -5.201 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.632 -9.427 -5.943 1.00 0.00 H new ATOM 0 HD2 LYS B 32 8.380 -9.423 -4.603 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.476 -10.776 -4.406 1.00 0.00 H new ATOM 0 HE2 LYS B 32 10.427 -9.715 -2.369 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.342 -8.353 -2.568 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 8.443 -9.830 -0.956 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 7.462 -9.925 -2.339 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 8.572 -11.165 -1.998 1.00 0.00 H new ATOM 1234 N GLY B 33 14.559 -9.845 -3.601 1.00 0.00 N ATOM 1235 CA GLY B 33 15.605 -9.992 -2.630 1.00 0.00 C ATOM 1236 C GLY B 33 15.043 -10.448 -1.300 1.00 0.00 C ATOM 1237 O GLY B 33 15.607 -11.323 -0.645 1.00 0.00 O ATOM 0 H GLY B 33 14.136 -10.724 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.340 -10.714 -2.986 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.126 -9.043 -2.504 1.00 0.00 H new ATOM 1241 N VAL B 34 13.890 -9.908 -0.931 1.00 0.00 N ATOM 1242 CA VAL B 34 13.270 -10.235 0.350 1.00 0.00 C ATOM 1243 C VAL B 34 11.964 -11.017 0.176 1.00 0.00 C ATOM 1244 O VAL B 34 11.412 -11.098 -0.925 1.00 0.00 O ATOM 1245 CB VAL B 34 12.986 -8.951 1.159 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.281 -8.236 1.515 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.065 -8.021 0.383 1.00 0.00 C ATOM 0 H VAL B 34 13.364 -9.243 -1.498 1.00 0.00 H new ATOM 0 HA VAL B 34 13.977 -10.865 0.890 1.00 0.00 H new ATOM 0 HB VAL B 34 12.489 -9.240 2.085 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.054 -7.335 2.085 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.908 -8.896 2.114 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.810 -7.964 0.601 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.877 -7.122 0.970 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.536 -7.746 -0.561 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.121 -8.528 0.183 1.00 0.00 H new ATOM 1257 N ILE B 35 11.506 -11.608 1.273 1.00 0.00 N ATOM 1258 CA ILE B 35 10.233 -12.323 1.307 1.00 0.00 C ATOM 1259 C ILE B 35 9.312 -11.769 2.384 1.00 0.00 C ATOM 1260 O ILE B 35 9.758 -11.154 3.346 1.00 0.00 O ATOM 1261 CB ILE B 35 10.421 -13.836 1.539 1.00 0.00 C ATOM 1262 CG1 ILE B 35 11.384 -14.093 2.703 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.903 -14.505 0.268 1.00 0.00 C ATOM 1264 CD1 ILE B 35 11.580 -15.561 3.018 1.00 0.00 C ATOM 0 H ILE B 35 12.004 -11.606 2.163 1.00 0.00 H new ATOM 0 HA ILE B 35 9.778 -12.174 0.328 1.00 0.00 H new ATOM 0 HB ILE B 35 9.458 -14.270 1.807 1.00 0.00 H new ATOM 0 HG12 ILE B 35 12.351 -13.649 2.468 1.00 0.00 H new ATOM 0 HG13 ILE B 35 11.008 -13.587 3.592 1.00 0.00 H new ATOM 0 HG21 ILE B 35 11.032 -15.573 0.445 1.00 0.00 H new ATOM 0 HG22 ILE B 35 10.169 -14.354 -0.523 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.856 -14.070 -0.033 1.00 0.00 H new ATOM 0 HD11 ILE B 35 12.274 -15.665 3.852 1.00 0.00 H new ATOM 0 HD12 ILE B 35 10.622 -16.007 3.285 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.985 -16.070 2.143 1.00 0.00 H new ATOM 1276 N LEU B 36 8.024 -12.016 2.209 1.00 0.00 N ATOM 1277 CA LEU B 36 6.998 -11.409 3.044 1.00 0.00 C ATOM 1278 C LEU B 36 6.726 -12.188 4.314 1.00 0.00 C ATOM 1279 O LEU B 36 6.860 -13.413 4.363 1.00 0.00 O ATOM 1280 CB LEU B 36 5.697 -11.303 2.249 1.00 0.00 C ATOM 1281 CG LEU B 36 5.769 -10.419 1.012 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.169 -11.134 -0.188 1.00 0.00 C ATOM 1283 CD2 LEU B 36 5.051 -9.110 1.270 1.00 0.00 C ATOM 0 H LEU B 36 7.661 -12.640 1.488 1.00 0.00 H new ATOM 0 HA LEU B 36 7.369 -10.426 3.335 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.392 -12.304 1.944 1.00 0.00 H new ATOM 0 HB3 LEU B 36 4.917 -10.919 2.907 1.00 0.00 H new ATOM 0 HG LEU B 36 6.815 -10.205 0.791 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.229 -10.488 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU B 36 5.722 -12.054 -0.377 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.125 -11.374 0.016 1.00 0.00 H new ATOM 0 HD21 LEU B 36 5.107 -8.483 0.380 1.00 0.00 H new ATOM 0 HD22 LEU B 36 4.006 -9.309 1.509 1.00 0.00 H new ATOM 0 HD23 LEU B 36 5.523 -8.595 2.107 1.00 0.00 H new ATOM 1295 N THR B 37 6.340 -11.449 5.340 1.00 0.00 N ATOM 1296 CA THR B 37 5.816 -12.030 6.555 1.00 0.00 C ATOM 1297 C THR B 37 4.312 -11.773 6.603 1.00 0.00 C ATOM 1298 O THR B 37 3.795 -11.031 5.768 1.00 0.00 O ATOM 1299 CB THR B 37 6.505 -11.452 7.815 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.003 -12.091 8.996 1.00 0.00 O ATOM 1301 CG2 THR B 37 6.297 -9.947 7.921 1.00 0.00 C ATOM 0 H THR B 37 6.383 -10.430 5.350 1.00 0.00 H new ATOM 0 HA THR B 37 6.018 -13.101 6.550 1.00 0.00 H new ATOM 0 HB THR B 37 7.574 -11.646 7.724 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.448 -11.717 9.785 1.00 0.00 H new ATOM 0 HG21 THR B 37 6.793 -9.573 8.817 1.00 0.00 H new ATOM 0 HG22 THR B 37 6.718 -9.459 7.042 1.00 0.00 H new ATOM 0 HG23 THR B 37 5.230 -9.730 7.980 1.00 0.00 H new ATOM 1309 N ALA B 38 3.621 -12.373 7.559 1.00 0.00 N ATOM 1310 CA ALA B 38 2.160 -12.313 7.626 1.00 0.00 C ATOM 1311 C ALA B 38 1.631 -10.882 7.557 1.00 0.00 C ATOM 1312 O ALA B 38 0.653 -10.611 6.856 1.00 0.00 O ATOM 1313 CB ALA B 38 1.683 -13.003 8.888 1.00 0.00 C ATOM 0 H ALA B 38 4.050 -12.914 8.310 1.00 0.00 H new ATOM 0 HA ALA B 38 1.764 -12.832 6.753 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.595 -12.958 8.938 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.003 -14.045 8.876 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.107 -12.503 9.759 1.00 0.00 H new ATOM 1319 N GLN B 39 2.269 -9.969 8.284 1.00 0.00 N ATOM 1320 CA GLN B 39 1.886 -8.562 8.242 1.00 0.00 C ATOM 1321 C GLN B 39 1.978 -8.012 6.821 1.00 0.00 C ATOM 1322 O GLN B 39 1.061 -7.341 6.346 1.00 0.00 O ATOM 1323 CB GLN B 39 2.774 -7.737 9.172 1.00 0.00 C ATOM 1324 CG GLN B 39 2.300 -6.304 9.334 1.00 0.00 C ATOM 1325 CD GLN B 39 3.052 -5.559 10.414 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.487 -6.144 11.404 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.212 -4.261 10.225 1.00 0.00 N ATOM 0 H GLN B 39 3.050 -10.177 8.906 1.00 0.00 H new ATOM 0 HA GLN B 39 0.852 -8.489 8.578 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.807 -8.215 10.151 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.793 -7.735 8.784 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.417 -5.778 8.387 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.236 -6.302 9.571 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.834 -3.817 9.388 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.714 -3.703 10.916 1.00 0.00 H new ATOM 1336 N GLY B 40 3.078 -8.317 6.143 1.00 0.00 N ATOM 1337 CA GLY B 40 3.264 -7.858 4.782 1.00 0.00 C ATOM 1338 C GLY B 40 2.329 -8.557 3.821 1.00 0.00 C ATOM 1339 O GLY B 40 1.951 -8.006 2.792 1.00 0.00 O ATOM 0 H GLY B 40 3.846 -8.876 6.514 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.096 -6.782 4.735 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.296 -8.033 4.477 1.00 0.00 H new ATOM 1343 N TYR B 41 1.933 -9.769 4.171 1.00 0.00 N ATOM 1344 CA TYR B 41 0.959 -10.503 3.386 1.00 0.00 C ATOM 1345 C TYR B 41 -0.411 -9.850 3.484 1.00 0.00 C ATOM 1346 O TYR B 41 -1.168 -9.836 2.511 1.00 0.00 O ATOM 1347 CB TYR B 41 0.887 -11.950 3.888 1.00 0.00 C ATOM 1348 CG TYR B 41 1.889 -12.882 3.242 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.766 -13.248 1.907 1.00 0.00 C ATOM 1350 CD2 TYR B 41 2.948 -13.409 3.968 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.669 -14.111 1.317 1.00 0.00 C ATOM 1352 CE2 TYR B 41 3.857 -14.268 3.386 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.714 -14.616 2.061 1.00 0.00 C ATOM 1354 OH TYR B 41 4.616 -15.481 1.484 1.00 0.00 O ATOM 0 H TYR B 41 2.272 -10.265 4.995 1.00 0.00 H new ATOM 0 HA TYR B 41 1.268 -10.494 2.341 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.045 -11.957 4.967 1.00 0.00 H new ATOM 0 HB3 TYR B 41 -0.117 -12.335 3.710 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.950 -12.851 1.321 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.063 -13.142 5.008 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.557 -14.388 0.279 1.00 0.00 H new ATOM 0 HE2 TYR B 41 4.677 -14.666 3.966 1.00 0.00 H new ATOM 0 HH TYR B 41 5.290 -15.741 2.146 1.00 0.00 H new ATOM 1364 N THR B 42 -0.718 -9.278 4.638 1.00 0.00 N ATOM 1365 CA THR B 42 -1.974 -8.571 4.826 1.00 0.00 C ATOM 1366 C THR B 42 -1.953 -7.233 4.097 1.00 0.00 C ATOM 1367 O THR B 42 -2.969 -6.778 3.561 1.00 0.00 O ATOM 1368 CB THR B 42 -2.242 -8.328 6.326 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.112 -9.559 7.047 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.632 -7.755 6.549 1.00 0.00 C ATOM 0 H THR B 42 -0.113 -9.290 5.459 1.00 0.00 H new ATOM 0 HA THR B 42 -2.770 -9.192 4.414 1.00 0.00 H new ATOM 0 HB THR B 42 -1.509 -7.607 6.689 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.173 -9.839 7.050 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.793 -7.594 7.615 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.723 -6.806 6.021 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.378 -8.454 6.171 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.776 -6.632 4.035 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.638 -5.315 3.447 1.00 0.00 C ATOM 1380 C LEU B 43 -0.456 -5.400 1.936 1.00 0.00 C ATOM 1381 O LEU B 43 -0.695 -4.427 1.233 1.00 0.00 O ATOM 1382 CB LEU B 43 0.543 -4.558 4.077 1.00 0.00 C ATOM 1383 CG LEU B 43 0.184 -3.544 5.181 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.671 -4.193 6.259 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.447 -2.967 5.798 1.00 0.00 C ATOM 0 H LEU B 43 0.093 -7.036 4.384 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.558 -4.767 3.651 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.236 -5.289 4.494 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.074 -4.030 3.285 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.391 -2.738 4.725 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.910 -3.456 7.026 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.593 -4.568 5.815 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.123 -5.020 6.709 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.178 -2.252 6.576 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.040 -3.772 6.233 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.030 -2.462 5.028 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.062 -6.559 1.416 1.00 0.00 N ATOM 1398 CA LEU B 44 0.132 -6.691 -0.021 1.00 0.00 C ATOM 1399 C LEU B 44 -1.201 -6.934 -0.724 1.00 0.00 C ATOM 1400 O LEU B 44 -1.450 -6.385 -1.790 1.00 0.00 O ATOM 1401 CB LEU B 44 1.160 -7.794 -0.345 1.00 0.00 C ATOM 1402 CG LEU B 44 0.661 -9.243 -0.370 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.041 -9.585 -1.718 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.809 -10.189 -0.084 1.00 0.00 C ATOM 0 H LEU B 44 0.126 -7.403 1.957 1.00 0.00 H new ATOM 0 HA LEU B 44 0.539 -5.753 -0.399 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.596 -7.572 -1.319 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.965 -7.728 0.387 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.104 -9.352 0.399 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.304 -10.619 -1.708 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.803 -8.922 -1.909 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.786 -9.459 -2.504 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.447 -11.217 -0.103 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.582 -10.062 -0.842 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.225 -9.969 0.899 1.00 0.00 H new ATOM 1416 N ASP B 45 -2.073 -7.723 -0.107 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.368 -8.041 -0.708 1.00 0.00 C ATOM 1418 C ASP B 45 -4.276 -6.824 -0.710 1.00 0.00 C ATOM 1419 O ASP B 45 -5.112 -6.661 -1.599 1.00 0.00 O ATOM 1420 CB ASP B 45 -4.037 -9.190 0.052 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.432 -9.513 -0.464 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.543 -10.320 -1.411 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.419 -8.977 0.090 1.00 0.00 O ATOM 0 H ASP B 45 -1.911 -8.153 0.804 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.198 -8.347 -1.740 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.413 -10.080 -0.024 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.098 -8.932 1.109 1.00 0.00 H new ATOM 1428 N PHE B 46 -4.074 -5.938 0.252 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.864 -4.722 0.327 1.00 0.00 C ATOM 1430 C PHE B 46 -4.422 -3.731 -0.726 1.00 0.00 C ATOM 1431 O PHE B 46 -5.246 -3.042 -1.329 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.690 -4.098 1.710 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.502 -2.860 1.925 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.821 -2.948 2.327 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.944 -1.607 1.728 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.572 -1.810 2.527 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.691 -0.467 1.926 1.00 0.00 C ATOM 1438 CZ PHE B 46 -7.006 -0.570 2.326 1.00 0.00 C ATOM 0 H PHE B 46 -3.374 -6.038 0.987 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.911 -4.972 0.153 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.962 -4.834 2.466 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.637 -3.860 1.860 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -7.268 -3.918 2.486 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.913 -1.524 1.416 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.602 -1.890 2.841 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.248 0.505 1.768 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.594 0.323 2.482 1.00 0.00 H new ATOM 1448 N ILE B 47 -3.133 -3.676 -0.982 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.646 -2.749 -1.969 1.00 0.00 C ATOM 1450 C ILE B 47 -2.894 -3.307 -3.362 1.00 0.00 C ATOM 1451 O ILE B 47 -3.237 -2.562 -4.280 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.151 -2.411 -1.780 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.277 -3.641 -2.048 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.924 -1.894 -0.370 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.208 -3.400 -1.891 1.00 0.00 C ATOM 0 H ILE B 47 -2.421 -4.250 -0.530 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.195 -1.816 -1.842 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.869 -1.639 -2.496 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.577 -4.439 -1.369 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.470 -3.995 -3.061 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.131 -1.655 -0.235 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.522 -0.997 -0.211 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.217 -2.658 0.349 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.750 -4.322 -2.099 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.527 -2.626 -2.589 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.418 -3.078 -0.871 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.759 -4.627 -3.494 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.138 -5.328 -4.711 1.00 0.00 C ATOM 1469 C GLN B 48 -4.537 -4.917 -5.123 1.00 0.00 C ATOM 1470 O GLN B 48 -4.734 -4.263 -6.129 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.128 -6.841 -4.488 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.751 -7.486 -4.490 1.00 0.00 C ATOM 1473 CD GLN B 48 -1.346 -7.977 -5.865 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -2.197 -8.341 -6.679 1.00 0.00 O ATOM 1475 NE2 GLN B 48 -0.051 -8.008 -6.130 1.00 0.00 N ATOM 0 H GLN B 48 -2.386 -5.233 -2.763 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.420 -5.069 -5.489 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.611 -7.055 -3.534 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.733 -7.311 -5.264 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.015 -6.766 -4.133 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.744 -8.323 -3.791 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.621 -7.698 -5.428 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.276 -8.342 -7.036 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.470 -5.193 -4.244 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.893 -5.155 -4.540 1.00 0.00 C ATOM 1486 C LYS B 49 -7.435 -3.726 -4.585 1.00 0.00 C ATOM 1487 O LYS B 49 -8.629 -3.502 -4.798 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.572 -6.024 -3.473 1.00 0.00 C ATOM 1489 CG LYS B 49 -9.089 -5.969 -3.389 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.615 -7.078 -2.477 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.774 -7.212 -1.206 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.129 -8.415 -0.408 1.00 0.00 N ATOM 0 H LYS B 49 -5.263 -5.457 -3.281 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.101 -5.547 -5.536 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.281 -7.060 -3.647 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.170 -5.739 -2.501 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.403 -4.997 -3.008 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.518 -6.075 -4.385 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.650 -6.868 -2.208 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -9.612 -8.025 -3.017 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.719 -7.259 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -8.907 -6.321 -0.592 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.260 -8.879 -0.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.706 -8.131 0.410 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.670 -9.077 -1.000 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.569 -2.737 -4.381 1.00 0.00 N ATOM 1507 CA HIS B 50 -7.007 -1.387 -4.703 1.00 0.00 C ATOM 1508 C HIS B 50 -6.234 -0.716 -5.841 1.00 0.00 C ATOM 1509 O HIS B 50 -6.664 0.338 -6.296 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.953 -0.513 -3.449 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.855 -1.018 -2.372 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -9.163 -1.354 -2.611 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.628 -1.298 -1.069 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.704 -1.818 -1.508 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.798 -1.800 -0.553 1.00 0.00 N ATOM 0 H HIS B 50 -5.621 -2.833 -4.018 1.00 0.00 H new ATOM 0 HA HIS B 50 -8.030 -1.487 -5.065 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.929 -0.477 -3.077 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.234 0.508 -3.707 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -9.641 -1.258 -3.507 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.701 -1.154 -0.534 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.724 -2.158 -1.402 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.142 -1.307 -6.340 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.420 -0.679 -7.465 1.00 0.00 C ATOM 1526 C LEU B 51 -4.058 -1.675 -8.580 1.00 0.00 C ATOM 1527 O LEU B 51 -3.812 -1.268 -9.714 1.00 0.00 O ATOM 1528 CB LEU B 51 -3.132 0.023 -7.006 1.00 0.00 C ATOM 1529 CG LEU B 51 -3.280 1.115 -5.935 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -1.973 1.870 -5.763 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -4.384 2.089 -6.287 1.00 0.00 C ATOM 0 H LEU B 51 -4.747 -2.185 -6.003 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.118 0.056 -7.866 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.449 -0.736 -6.624 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.658 0.468 -7.881 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.541 0.622 -4.999 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.095 2.640 -5.001 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.190 1.177 -5.456 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.695 2.336 -6.708 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -4.462 2.848 -5.508 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.157 2.568 -7.239 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.330 1.553 -6.367 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.999 -2.962 -8.267 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.571 -3.974 -9.248 1.00 0.00 C ATOM 1545 C ASN B 52 -4.588 -5.105 -9.376 1.00 0.00 C ATOM 1546 O ASN B 52 -4.663 -5.779 -10.404 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.208 -4.545 -8.855 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.054 -3.889 -9.594 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.215 -2.630 -9.971 1.00 0.00 O flip ATOM 1550 ND2 ASN B 52 -0.023 -4.521 -9.829 1.00 0.00 N flip ATOM 0 H ASN B 52 -4.239 -3.338 -7.350 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.495 -3.481 -10.217 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.063 -4.419 -7.782 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.198 -5.617 -9.055 1.00 0.00 H new ATOM 0 HD21 ASN B 52 0.063 -5.490 -9.522 1.00 0.00 H new ATOM 0 HD22 ASN B 52 0.745 -4.075 -10.331 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.361 -5.298 -8.328 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.433 -6.267 -8.300 1.00 0.00 C ATOM 1559 C LYS B 53 -7.757 -5.521 -8.351 1.00 0.00 C ATOM 1560 O LYS B 53 -8.317 -5.236 -7.280 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.375 -7.081 -7.005 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.941 -8.523 -7.169 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.380 -9.337 -5.956 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.298 -9.427 -4.895 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.118 -10.192 -5.370 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.205 -5.187 -9.469 1.00 0.00 O ATOM 0 H LYS B 53 -5.259 -4.776 -7.457 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.335 -6.942 -9.150 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.690 -6.588 -6.315 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.361 -7.066 -6.540 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -6.376 -8.942 -8.076 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.858 -8.576 -7.281 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.273 -8.885 -5.523 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.655 -10.342 -6.277 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.987 -8.423 -4.607 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.704 -9.903 -4.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -3.652 -10.649 -4.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -4.425 -10.918 -6.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -3.449 -9.545 -5.834 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.219 3.520 13.370 1.00 0.00 N HETATM 1582 CN FME C 1 -10.483 2.293 12.946 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.340 1.590 13.476 1.00 0.00 O HETATM 1584 CA FME C 1 -9.234 4.349 12.700 1.00 0.00 C HETATM 1585 CB FME C 1 -9.912 5.579 12.097 1.00 0.00 C HETATM 1586 CG FME C 1 -9.056 6.316 11.081 1.00 0.00 C HETATM 1587 SD FME C 1 -9.944 7.677 10.300 1.00 0.00 S HETATM 1588 CE FME C 1 -8.816 8.112 8.978 1.00 0.00 C HETATM 1589 C FME C 1 -8.143 4.769 13.674 1.00 0.00 C HETATM 1590 O FME C 1 -8.314 5.708 14.451 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.163 6.702 11.573 1.00 0.00 H new HETATM 0 HG2 FME C 1 -8.721 5.616 10.315 1.00 0.00 H new HETATM 0 HE3 FME C 1 -8.816 9.193 8.841 1.00 0.00 H new HETATM 0 HE2 FME C 1 -7.810 7.778 9.233 1.00 0.00 H new HETATM 0 HE1 FME C 1 -9.135 7.629 8.054 1.00 0.00 H new HETATM 0 HCN FME C 1 -9.922 1.895 12.100 1.00 0.00 H new HETATM 0 HB3 FME C 1 -10.842 5.272 11.619 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.178 6.266 12.900 1.00 0.00 H new HETATM 0 HA FME C 1 -8.774 3.771 11.898 1.00 0.00 H new HETATM 0 H FME C 1 -10.716 3.888 14.181 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.022 4.068 13.630 1.00 0.00 N ATOM 1602 CA VAL C 2 -5.909 4.354 14.524 1.00 0.00 C ATOM 1603 C VAL C 2 -4.783 5.051 13.754 1.00 0.00 C ATOM 1604 O VAL C 2 -3.696 5.296 14.277 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.391 3.049 15.182 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -4.715 2.149 14.155 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.460 3.345 16.351 1.00 0.00 C ATOM 0 H VAL C 2 -6.857 3.296 12.984 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.257 5.019 15.314 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.255 2.515 15.579 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.361 1.241 14.644 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.430 1.886 13.375 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -3.870 2.675 13.711 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.116 2.408 16.788 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.602 3.917 15.997 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -4.995 3.922 17.105 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.064 5.393 12.505 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.076 6.032 11.656 1.00 0.00 C ATOM 1619 C ILE C 3 -4.725 7.105 10.790 1.00 0.00 C ATOM 1620 O ILE C 3 -5.847 6.936 10.313 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.356 5.000 10.752 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.201 5.662 9.992 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.343 4.356 9.778 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.379 4.695 9.169 1.00 0.00 C ATOM 0 H ILE C 3 -5.968 5.238 12.060 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.336 6.496 12.309 1.00 0.00 H new ATOM 0 HB ILE C 3 -2.943 4.217 11.388 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.605 6.432 9.335 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.548 6.163 10.707 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.818 3.634 9.152 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.128 3.847 10.338 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.788 5.126 9.148 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.581 5.237 8.661 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.945 3.939 9.823 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.018 4.212 8.430 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.037 8.224 10.635 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.463 9.256 9.708 1.00 0.00 C ATOM 1638 C ALA C 4 -3.392 9.450 8.647 1.00 0.00 C ATOM 1639 O ALA C 4 -2.282 8.934 8.784 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.743 10.560 10.442 1.00 0.00 C ATOM 0 H ALA C 4 -3.178 8.440 11.142 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.390 8.945 9.226 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.061 11.319 9.727 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.532 10.401 11.177 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -3.837 10.895 10.948 1.00 0.00 H new ATOM 1646 N THR C 5 -3.711 10.190 7.595 1.00 0.00 N ATOM 1647 CA THR C 5 -2.760 10.409 6.517 1.00 0.00 C ATOM 1648 C THR C 5 -1.615 11.304 6.988 1.00 0.00 C ATOM 1649 O THR C 5 -0.559 11.371 6.360 1.00 0.00 O ATOM 1650 CB THR C 5 -3.446 11.043 5.290 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.703 10.397 5.048 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.569 10.917 4.051 1.00 0.00 C ATOM 0 H THR C 5 -4.614 10.646 7.466 1.00 0.00 H new ATOM 0 HA THR C 5 -2.359 9.438 6.226 1.00 0.00 H new ATOM 0 HB THR C 5 -3.607 12.101 5.499 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.136 10.804 4.269 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.075 11.372 3.199 1.00 0.00 H new ATOM 0 HG22 THR C 5 -1.620 11.426 4.223 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.383 9.863 3.842 1.00 0.00 H new ATOM 1660 N ASP C 6 -1.808 11.931 8.143 1.00 0.00 N ATOM 1661 CA ASP C 6 -0.832 12.863 8.689 1.00 0.00 C ATOM 1662 C ASP C 6 0.278 12.107 9.402 1.00 0.00 C ATOM 1663 O ASP C 6 1.264 12.698 9.838 1.00 0.00 O ATOM 1664 CB ASP C 6 -1.503 13.831 9.671 1.00 0.00 C ATOM 1665 CG ASP C 6 -2.518 14.740 9.006 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -3.667 14.298 8.791 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -2.175 15.905 8.706 1.00 0.00 O ATOM 0 H ASP C 6 -2.639 11.808 8.722 1.00 0.00 H new ATOM 0 HA ASP C 6 -0.407 13.433 7.863 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -1.996 13.259 10.457 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -0.738 14.440 10.152 1.00 0.00 H new ATOM 1672 N ASP C 7 0.120 10.791 9.513 1.00 0.00 N ATOM 1673 CA ASP C 7 1.157 9.951 10.103 1.00 0.00 C ATOM 1674 C ASP C 7 1.940 9.241 9.008 1.00 0.00 C ATOM 1675 O ASP C 7 2.811 8.417 9.281 1.00 0.00 O ATOM 1676 CB ASP C 7 0.539 8.893 11.031 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.383 9.474 12.087 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.119 10.090 13.050 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.619 9.306 11.964 1.00 0.00 O ATOM 0 H ASP C 7 -0.711 10.286 9.204 1.00 0.00 H new ATOM 0 HA ASP C 7 1.821 10.594 10.680 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.019 8.175 10.429 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.340 8.342 11.524 1.00 0.00 H new ATOM 1684 N LEU C 8 1.630 9.578 7.764 1.00 0.00 N ATOM 1685 CA LEU C 8 2.302 8.981 6.617 1.00 0.00 C ATOM 1686 C LEU C 8 2.848 10.058 5.692 1.00 0.00 C ATOM 1687 O LEU C 8 3.899 9.882 5.067 1.00 0.00 O ATOM 1688 CB LEU C 8 1.338 8.069 5.859 1.00 0.00 C ATOM 1689 CG LEU C 8 0.859 6.852 6.645 1.00 0.00 C ATOM 1690 CD1 LEU C 8 -0.173 6.071 5.855 1.00 0.00 C ATOM 1691 CD2 LEU C 8 2.033 5.959 7.001 1.00 0.00 C ATOM 0 H LEU C 8 0.915 10.264 7.522 1.00 0.00 H new ATOM 0 HA LEU C 8 3.140 8.385 6.979 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.469 8.653 5.556 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.826 7.726 4.947 1.00 0.00 H new ATOM 0 HG LEU C 8 0.392 7.203 7.565 1.00 0.00 H new ATOM 0 HD11 LEU C 8 -0.499 5.208 6.436 1.00 0.00 H new ATOM 0 HD12 LEU C 8 -1.030 6.711 5.643 1.00 0.00 H new ATOM 0 HD13 LEU C 8 0.267 5.732 4.917 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.676 5.095 7.562 1.00 0.00 H new ATOM 0 HD22 LEU C 8 2.524 5.622 6.088 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.744 6.518 7.610 1.00 0.00 H new ATOM 1703 N GLU C 9 2.153 11.186 5.650 1.00 0.00 N ATOM 1704 CA GLU C 9 2.539 12.303 4.802 1.00 0.00 C ATOM 1705 C GLU C 9 2.123 13.611 5.459 1.00 0.00 C ATOM 1706 O GLU C 9 1.210 13.646 6.279 1.00 0.00 O ATOM 1707 CB GLU C 9 1.942 12.195 3.386 1.00 0.00 C ATOM 1708 CG GLU C 9 2.531 11.054 2.566 1.00 0.00 C ATOM 1709 CD GLU C 9 2.316 11.199 1.071 1.00 0.00 C ATOM 1710 OE1 GLU C 9 3.176 11.812 0.392 1.00 0.00 O ATOM 1711 OE2 GLU C 9 1.314 10.660 0.556 1.00 0.00 O ATOM 0 H GLU C 9 1.310 11.352 6.200 1.00 0.00 H new ATOM 0 HA GLU C 9 3.623 12.278 4.690 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.864 12.057 3.464 1.00 0.00 H new ATOM 0 HB3 GLU C 9 2.106 13.134 2.858 1.00 0.00 H new ATOM 0 HG2 GLU C 9 3.601 10.990 2.765 1.00 0.00 H new ATOM 0 HG3 GLU C 9 2.089 10.115 2.898 1.00 0.00 H new ATOM 1718 N VAL C 10 2.825 14.669 5.116 1.00 0.00 N ATOM 1719 CA VAL C 10 2.590 15.979 5.689 1.00 0.00 C ATOM 1720 C VAL C 10 2.622 17.030 4.581 1.00 0.00 C ATOM 1721 O VAL C 10 3.352 16.879 3.605 1.00 0.00 O ATOM 1722 CB VAL C 10 3.657 16.282 6.773 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.063 16.111 6.214 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.474 17.675 7.360 1.00 0.00 C ATOM 0 H VAL C 10 3.578 14.646 4.429 1.00 0.00 H new ATOM 0 HA VAL C 10 1.609 16.002 6.164 1.00 0.00 H new ATOM 0 HB VAL C 10 3.520 15.562 7.580 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.793 16.329 6.993 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.195 15.085 5.869 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.208 16.796 5.379 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.238 17.854 8.116 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.566 18.418 6.568 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.487 17.751 7.816 1.00 0.00 H new ATOM 1734 N ALA C 11 1.815 18.077 4.720 1.00 0.00 N ATOM 1735 CA ALA C 11 1.721 19.105 3.692 1.00 0.00 C ATOM 1736 C ALA C 11 3.042 19.846 3.541 1.00 0.00 C ATOM 1737 O ALA C 11 3.669 20.232 4.526 1.00 0.00 O ATOM 1738 CB ALA C 11 0.594 20.068 4.032 1.00 0.00 C ATOM 0 H ALA C 11 1.219 18.235 5.532 1.00 0.00 H new ATOM 0 HA ALA C 11 1.501 18.628 2.737 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.526 20.836 3.261 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.348 19.522 4.084 1.00 0.00 H new ATOM 0 HB3 ALA C 11 0.795 20.538 4.995 1.00 0.00 H new ATOM 1744 N CYS C 12 3.444 20.033 2.286 1.00 0.00 N ATOM 1745 CA CYS C 12 4.776 20.507 1.947 1.00 0.00 C ATOM 1746 C CYS C 12 5.062 21.933 2.417 1.00 0.00 C ATOM 1747 O CYS C 12 4.147 22.674 2.756 1.00 0.00 O ATOM 1748 CB CYS C 12 4.977 20.437 0.440 1.00 0.00 C ATOM 1749 SG CYS C 12 6.457 19.533 0.006 1.00 0.00 S ATOM 0 H CYS C 12 2.850 19.858 1.475 1.00 0.00 H new ATOM 0 HA CYS C 12 5.472 19.853 2.471 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.112 19.959 -0.020 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.036 21.447 0.034 1.00 0.00 H new ATOM 1754 N PRO C 13 6.351 22.328 2.446 1.00 0.00 N ATOM 1755 CA PRO C 13 6.766 23.704 2.747 1.00 0.00 C ATOM 1756 C PRO C 13 5.953 24.782 2.020 1.00 0.00 C ATOM 1757 O PRO C 13 5.647 25.831 2.588 1.00 0.00 O ATOM 1758 CB PRO C 13 8.203 23.728 2.231 1.00 0.00 C ATOM 1759 CG PRO C 13 8.712 22.350 2.455 1.00 0.00 C ATOM 1760 CD PRO C 13 7.524 21.441 2.254 1.00 0.00 C ATOM 0 HA PRO C 13 6.633 23.931 3.805 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.239 23.996 1.175 1.00 0.00 H new ATOM 0 HB3 PRO C 13 8.803 24.463 2.767 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.513 22.109 1.756 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.123 22.242 3.459 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.528 20.995 1.259 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.524 20.620 2.971 1.00 0.00 H new ATOM 1768 N LYS C 14 5.598 24.512 0.764 1.00 0.00 N ATOM 1769 CA LYS C 14 5.115 25.570 -0.120 1.00 0.00 C ATOM 1770 C LYS C 14 4.057 25.106 -1.124 1.00 0.00 C ATOM 1771 O LYS C 14 3.182 25.882 -1.504 1.00 0.00 O ATOM 1772 CB LYS C 14 6.319 26.158 -0.867 1.00 0.00 C ATOM 1773 CG LYS C 14 5.980 27.237 -1.882 1.00 0.00 C ATOM 1774 CD LYS C 14 7.219 27.642 -2.665 1.00 0.00 C ATOM 1775 CE LYS C 14 6.858 28.487 -3.868 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.371 29.841 -3.479 1.00 0.00 N ATOM 0 H LYS C 14 5.635 23.584 0.341 1.00 0.00 H new ATOM 0 HA LYS C 14 4.623 26.317 0.503 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.014 26.573 -0.137 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.840 25.349 -1.379 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.214 26.873 -2.566 1.00 0.00 H new ATOM 0 HG3 LYS C 14 5.565 28.106 -1.372 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.896 28.199 -2.017 1.00 0.00 H new ATOM 0 HD3 LYS C 14 7.753 26.750 -2.992 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.730 28.588 -4.514 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.088 27.979 -4.449 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.136 30.384 -4.334 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 5.523 29.747 -2.884 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 7.114 30.338 -2.947 1.00 0.00 H new ATOM 1790 N CYS C 15 4.112 23.856 -1.569 1.00 0.00 N ATOM 1791 CA CYS C 15 3.292 23.474 -2.709 1.00 0.00 C ATOM 1792 C CYS C 15 2.219 22.423 -2.404 1.00 0.00 C ATOM 1793 O CYS C 15 1.931 21.556 -3.241 1.00 0.00 O ATOM 1794 CB CYS C 15 4.261 22.901 -3.722 1.00 0.00 C ATOM 1795 SG CYS C 15 5.371 21.663 -2.975 1.00 0.00 S ATOM 0 H CYS C 15 4.693 23.116 -1.175 1.00 0.00 H new ATOM 0 HA CYS C 15 2.742 24.350 -3.052 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.704 22.443 -4.539 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.854 23.707 -4.154 1.00 0.00 H new ATOM 1800 N GLU C 16 1.540 22.577 -1.277 1.00 0.00 N ATOM 1801 CA GLU C 16 0.524 21.623 -0.836 1.00 0.00 C ATOM 1802 C GLU C 16 -0.819 22.044 -1.377 1.00 0.00 C ATOM 1803 O GLU C 16 -1.867 21.724 -0.820 1.00 0.00 O ATOM 1804 CB GLU C 16 0.434 21.606 0.699 1.00 0.00 C ATOM 1805 CG GLU C 16 1.492 22.426 1.408 1.00 0.00 C ATOM 1806 CD GLU C 16 1.133 23.897 1.427 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.471 24.601 0.458 1.00 0.00 O ATOM 1808 OE2 GLU C 16 0.474 24.349 2.388 1.00 0.00 O ATOM 0 H GLU C 16 1.675 23.363 -0.641 1.00 0.00 H new ATOM 0 HA GLU C 16 0.797 20.632 -1.199 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.549 21.973 0.995 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.505 20.574 1.041 1.00 0.00 H new ATOM 0 HG2 GLU C 16 1.609 22.066 2.430 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.452 22.291 0.911 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.782 22.749 -2.487 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.911 23.515 -2.935 1.00 0.00 C ATOM 1817 C ARG C 17 -1.874 23.516 -4.458 1.00 0.00 C ATOM 1818 O ARG C 17 -2.892 23.687 -5.126 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.838 24.939 -2.382 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.534 25.650 -2.712 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.344 26.894 -1.862 1.00 0.00 C ATOM 1822 NE ARG C 17 -0.118 26.566 -0.455 1.00 0.00 N ATOM 1823 CZ ARG C 17 -0.639 27.245 0.566 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -1.429 28.286 0.343 1.00 0.00 N ATOM 1825 NH2 ARG C 17 -0.370 26.872 1.810 1.00 0.00 N ATOM 0 H ARG C 17 0.032 22.803 -3.099 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.846 23.081 -2.580 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.670 25.519 -2.781 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.962 24.907 -1.300 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.302 24.969 -2.553 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.526 25.925 -3.767 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.502 27.467 -2.241 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -1.224 27.531 -1.949 1.00 0.00 H new ATOM 0 HE ARG C 17 0.477 25.766 -0.241 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -1.640 28.570 -0.614 1.00 0.00 H new ATOM 0 HH12 ARG C 17 -1.826 28.803 1.128 1.00 0.00 H new ATOM 0 HH21 ARG C 17 0.234 26.068 1.982 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -0.767 27.389 2.595 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.662 23.301 -4.998 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.432 23.397 -6.434 1.00 0.00 C ATOM 1841 C ALA C 18 0.143 22.105 -7.008 1.00 0.00 C ATOM 1842 O ALA C 18 -0.217 21.688 -8.107 1.00 0.00 O ATOM 1843 CB ALA C 18 0.505 24.558 -6.734 1.00 0.00 C ATOM 0 H ALA C 18 0.167 23.060 -4.455 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.397 23.570 -6.910 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.672 24.623 -7.809 1.00 0.00 H new ATOM 0 HB2 ALA C 18 0.058 25.487 -6.380 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.457 24.397 -6.228 1.00 0.00 H new ATOM 1849 N GLY C 19 1.028 21.461 -6.250 1.00 0.00 N ATOM 1850 CA GLY C 19 1.675 20.256 -6.737 1.00 0.00 C ATOM 1851 C GLY C 19 2.966 20.554 -7.487 1.00 0.00 C ATOM 1852 O GLY C 19 3.459 19.727 -8.243 1.00 0.00 O ATOM 0 H GLY C 19 1.307 21.751 -5.313 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.890 19.597 -5.896 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.991 19.720 -7.395 1.00 0.00 H new ATOM 1856 N GLU C 20 3.530 21.723 -7.219 1.00 0.00 N ATOM 1857 CA GLU C 20 4.756 22.184 -7.871 1.00 0.00 C ATOM 1858 C GLU C 20 5.244 23.445 -7.189 1.00 0.00 C ATOM 1859 O GLU C 20 4.547 24.002 -6.350 1.00 0.00 O ATOM 1860 CB GLU C 20 4.573 22.449 -9.374 1.00 0.00 C ATOM 1861 CG GLU C 20 3.225 23.036 -9.755 1.00 0.00 C ATOM 1862 CD GLU C 20 3.089 23.221 -11.250 1.00 0.00 C ATOM 1863 OE1 GLU C 20 3.040 22.205 -11.975 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.028 24.383 -11.706 1.00 0.00 O ATOM 0 H GLU C 20 3.151 22.384 -6.541 1.00 0.00 H new ATOM 0 HA GLU C 20 5.491 21.385 -7.776 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.357 23.128 -9.707 1.00 0.00 H new ATOM 0 HB3 GLU C 20 4.712 21.512 -9.914 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.430 22.381 -9.397 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.095 23.997 -9.258 1.00 0.00 H new ATOM 1871 N ILE C 21 6.423 23.900 -7.564 1.00 0.00 N ATOM 1872 CA ILE C 21 7.027 25.072 -6.954 1.00 0.00 C ATOM 1873 C ILE C 21 7.739 25.855 -8.021 1.00 0.00 C ATOM 1874 O ILE C 21 8.587 25.316 -8.731 1.00 0.00 O ATOM 1875 CB ILE C 21 8.001 24.708 -5.805 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.195 24.237 -4.585 1.00 0.00 C ATOM 1877 CG2 ILE C 21 8.919 25.868 -5.443 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.996 24.009 -3.321 1.00 0.00 C ATOM 0 H ILE C 21 6.989 23.471 -8.297 1.00 0.00 H new ATOM 0 HA ILE C 21 6.235 25.672 -6.506 1.00 0.00 H new ATOM 0 HB ILE C 21 8.647 23.899 -6.146 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.422 24.976 -4.375 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.687 23.308 -4.844 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.584 25.567 -4.633 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.512 26.149 -6.314 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.320 26.720 -5.122 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.331 23.679 -2.523 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.752 23.245 -3.502 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.483 24.939 -3.026 1.00 0.00 H new ATOM 1890 N GLU C 22 7.378 27.119 -8.123 1.00 0.00 N ATOM 1891 CA GLU C 22 7.863 27.973 -9.182 1.00 0.00 C ATOM 1892 C GLU C 22 7.723 27.290 -10.547 1.00 0.00 C ATOM 1893 O GLU C 22 8.686 27.172 -11.301 1.00 0.00 O ATOM 1894 CB GLU C 22 9.314 28.316 -8.907 1.00 0.00 C ATOM 1895 CG GLU C 22 9.866 29.418 -9.812 1.00 0.00 C ATOM 1896 CD GLU C 22 9.207 30.773 -9.619 1.00 0.00 C ATOM 1897 OE1 GLU C 22 9.478 31.431 -8.595 1.00 0.00 O ATOM 1898 OE2 GLU C 22 8.422 31.193 -10.498 1.00 0.00 O ATOM 0 H GLU C 22 6.741 27.580 -7.473 1.00 0.00 H new ATOM 0 HA GLU C 22 7.267 28.885 -9.209 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.414 28.628 -7.867 1.00 0.00 H new ATOM 0 HB3 GLU C 22 9.920 27.419 -9.031 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.936 29.518 -9.631 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.745 29.113 -10.851 1.00 0.00 H new ATOM 1905 N GLY C 23 6.538 26.769 -10.822 1.00 0.00 N ATOM 1906 CA GLY C 23 6.269 26.212 -12.136 1.00 0.00 C ATOM 1907 C GLY C 23 7.096 24.976 -12.426 1.00 0.00 C ATOM 1908 O GLY C 23 7.195 24.529 -13.571 1.00 0.00 O ATOM 0 H GLY C 23 5.759 26.720 -10.165 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.211 25.962 -12.211 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.473 26.967 -12.895 1.00 0.00 H new ATOM 1912 N THR C 24 7.698 24.437 -11.387 1.00 0.00 N ATOM 1913 CA THR C 24 8.635 23.343 -11.529 1.00 0.00 C ATOM 1914 C THR C 24 8.313 22.186 -10.576 1.00 0.00 C ATOM 1915 O THR C 24 7.780 22.404 -9.485 1.00 0.00 O ATOM 1916 CB THR C 24 10.056 23.909 -11.303 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.703 24.114 -12.562 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.925 23.024 -10.419 1.00 0.00 C ATOM 0 H THR C 24 7.553 24.743 -10.425 1.00 0.00 H new ATOM 0 HA THR C 24 8.564 22.918 -12.530 1.00 0.00 H new ATOM 0 HB THR C 24 9.934 24.856 -10.777 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.602 24.474 -12.413 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.908 23.480 -10.302 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.457 22.915 -9.441 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.033 22.043 -10.881 1.00 0.00 H new ATOM 1926 N PRO C 25 8.609 20.934 -10.998 1.00 0.00 N ATOM 1927 CA PRO C 25 8.384 19.737 -10.181 1.00 0.00 C ATOM 1928 C PRO C 25 9.106 19.833 -8.848 1.00 0.00 C ATOM 1929 O PRO C 25 10.301 20.113 -8.789 1.00 0.00 O ATOM 1930 CB PRO C 25 8.954 18.591 -11.025 1.00 0.00 C ATOM 1931 CG PRO C 25 9.852 19.258 -12.007 1.00 0.00 C ATOM 1932 CD PRO C 25 9.213 20.587 -12.294 1.00 0.00 C ATOM 0 HA PRO C 25 7.330 19.598 -9.939 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.501 17.878 -10.408 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.161 18.036 -11.526 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.855 19.384 -11.599 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.950 18.665 -12.916 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.945 21.329 -12.613 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.466 20.516 -13.084 1.00 0.00 H new ATOM 1940 N CYS C 26 8.373 19.591 -7.786 1.00 0.00 N ATOM 1941 CA CYS C 26 8.857 19.883 -6.453 1.00 0.00 C ATOM 1942 C CYS C 26 9.671 18.722 -5.848 1.00 0.00 C ATOM 1943 O CYS C 26 9.321 17.558 -6.031 1.00 0.00 O ATOM 1944 CB CYS C 26 7.676 20.227 -5.561 1.00 0.00 C ATOM 1945 SG CYS C 26 8.168 20.735 -3.901 1.00 0.00 S ATOM 0 H CYS C 26 7.435 19.191 -7.818 1.00 0.00 H new ATOM 0 HA CYS C 26 9.537 20.732 -6.522 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.100 21.028 -6.024 1.00 0.00 H new ATOM 0 HB3 CYS C 26 7.018 19.361 -5.490 1.00 0.00 H new ATOM 1950 N PRO C 27 10.756 19.069 -5.098 1.00 0.00 N ATOM 1951 CA PRO C 27 11.725 18.147 -4.474 1.00 0.00 C ATOM 1952 C PRO C 27 11.207 16.755 -4.100 1.00 0.00 C ATOM 1953 O PRO C 27 11.717 15.743 -4.575 1.00 0.00 O ATOM 1954 CB PRO C 27 12.086 18.904 -3.196 1.00 0.00 C ATOM 1955 CG PRO C 27 11.982 20.355 -3.536 1.00 0.00 C ATOM 1956 CD PRO C 27 11.165 20.459 -4.816 1.00 0.00 C ATOM 0 HA PRO C 27 12.531 17.923 -5.173 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.408 18.644 -2.383 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.093 18.652 -2.864 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.502 20.906 -2.727 1.00 0.00 H new ATOM 0 HG3 PRO C 27 12.972 20.790 -3.675 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.300 21.110 -4.685 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.755 20.874 -5.633 1.00 0.00 H new ATOM 1964 N ALA C 28 10.190 16.718 -3.249 1.00 0.00 N ATOM 1965 CA ALA C 28 9.763 15.469 -2.622 1.00 0.00 C ATOM 1966 C ALA C 28 8.277 15.221 -2.836 1.00 0.00 C ATOM 1967 O ALA C 28 7.720 14.220 -2.387 1.00 0.00 O ATOM 1968 CB ALA C 28 10.087 15.496 -1.135 1.00 0.00 C ATOM 0 H ALA C 28 9.645 17.536 -2.976 1.00 0.00 H new ATOM 0 HA ALA C 28 10.307 14.650 -3.092 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.765 14.561 -0.676 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.162 15.616 -0.999 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.566 16.330 -0.664 1.00 0.00 H new ATOM 1974 N CYS C 29 7.633 16.159 -3.496 1.00 0.00 N ATOM 1975 CA CYS C 29 6.224 16.031 -3.806 1.00 0.00 C ATOM 1976 C CYS C 29 6.008 16.319 -5.280 1.00 0.00 C ATOM 1977 O CYS C 29 5.746 17.459 -5.666 1.00 0.00 O ATOM 1978 CB CYS C 29 5.399 16.992 -2.931 1.00 0.00 C ATOM 1979 SG CYS C 29 5.743 18.751 -3.207 1.00 0.00 S ATOM 0 H CYS C 29 8.063 17.021 -3.830 1.00 0.00 H new ATOM 0 HA CYS C 29 5.892 15.015 -3.593 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.340 16.810 -3.114 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.586 16.759 -1.883 1.00 0.00 H new ATOM 1984 N SER C 30 6.141 15.301 -6.120 1.00 0.00 N ATOM 1985 CA SER C 30 6.060 15.492 -7.555 1.00 0.00 C ATOM 1986 C SER C 30 4.617 15.659 -8.026 1.00 0.00 C ATOM 1987 O SER C 30 4.130 14.897 -8.857 1.00 0.00 O ATOM 1988 CB SER C 30 6.716 14.299 -8.247 1.00 0.00 C ATOM 1989 OG SER C 30 7.893 13.912 -7.557 1.00 0.00 O ATOM 0 H SER C 30 6.305 14.337 -5.829 1.00 0.00 H new ATOM 0 HA SER C 30 6.585 16.411 -7.816 1.00 0.00 H new ATOM 0 HB2 SER C 30 6.017 13.463 -8.284 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.959 14.557 -9.278 1.00 0.00 H new ATOM 0 HG SER C 30 8.301 13.145 -8.011 1.00 0.00 H new ATOM 1995 N GLY C 31 3.937 16.648 -7.471 1.00 0.00 N ATOM 1996 CA GLY C 31 2.594 16.952 -7.895 1.00 0.00 C ATOM 1997 C GLY C 31 1.572 16.259 -7.040 1.00 0.00 C ATOM 1998 O GLY C 31 0.590 15.719 -7.541 1.00 0.00 O ATOM 0 H GLY C 31 4.297 17.248 -6.729 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.434 18.029 -7.853 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.463 16.651 -8.934 1.00 0.00 H new ATOM 2002 N LYS C 32 1.799 16.274 -5.735 1.00 0.00 N ATOM 2003 CA LYS C 32 0.927 15.600 -4.797 1.00 0.00 C ATOM 2004 C LYS C 32 0.333 16.616 -3.830 1.00 0.00 C ATOM 2005 O LYS C 32 -0.854 16.583 -3.515 1.00 0.00 O ATOM 2006 CB LYS C 32 1.738 14.588 -3.995 1.00 0.00 C ATOM 2007 CG LYS C 32 2.439 13.524 -4.832 1.00 0.00 C ATOM 2008 CD LYS C 32 3.655 12.965 -4.101 1.00 0.00 C ATOM 2009 CE LYS C 32 3.393 12.860 -2.608 1.00 0.00 C ATOM 2010 NZ LYS C 32 4.544 12.306 -1.849 1.00 0.00 N ATOM 0 H LYS C 32 2.589 16.752 -5.303 1.00 0.00 H new ATOM 0 HA LYS C 32 0.130 15.098 -5.346 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.487 15.124 -3.412 1.00 0.00 H new ATOM 0 HB3 LYS C 32 1.075 14.093 -3.285 1.00 0.00 H new ATOM 0 HG2 LYS C 32 1.743 12.716 -5.057 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.749 13.952 -5.785 1.00 0.00 H new ATOM 0 HD2 LYS C 32 3.903 11.982 -4.500 1.00 0.00 H new ATOM 0 HD3 LYS C 32 4.517 13.608 -4.278 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.151 13.849 -2.218 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.520 12.229 -2.442 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 4.237 12.054 -0.888 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 4.902 11.458 -2.332 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 5.300 13.019 -1.795 1.00 0.00 H new ATOM 2024 N GLY C 33 1.193 17.513 -3.353 1.00 0.00 N ATOM 2025 CA GLY C 33 0.807 18.477 -2.362 1.00 0.00 C ATOM 2026 C GLY C 33 1.498 18.197 -1.044 1.00 0.00 C ATOM 2027 O GLY C 33 1.967 19.111 -0.373 1.00 0.00 O ATOM 0 H GLY C 33 2.167 17.581 -3.649 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.061 19.480 -2.705 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.274 18.451 -2.224 1.00 0.00 H new ATOM 2031 N VAL C 34 1.618 16.922 -0.701 1.00 0.00 N ATOM 2032 CA VAL C 34 2.219 16.527 0.568 1.00 0.00 C ATOM 2033 C VAL C 34 3.544 15.787 0.371 1.00 0.00 C ATOM 2034 O VAL C 34 3.879 15.364 -0.740 1.00 0.00 O ATOM 2035 CB VAL C 34 1.252 15.626 1.368 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.007 16.389 1.749 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.892 14.377 0.575 1.00 0.00 C ATOM 0 H VAL C 34 1.308 16.143 -1.282 1.00 0.00 H new ATOM 0 HA VAL C 34 2.417 17.444 1.122 1.00 0.00 H new ATOM 0 HB VAL C 34 1.760 15.319 2.282 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.673 15.735 2.311 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.261 17.249 2.363 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.512 16.731 0.846 1.00 0.00 H new ATOM 0 HG21 VAL C 34 0.210 13.759 1.159 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.410 14.665 -0.359 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.798 13.811 0.356 1.00 0.00 H new ATOM 2047 N ILE C 35 4.298 15.668 1.460 1.00 0.00 N ATOM 2048 CA ILE C 35 5.551 14.917 1.471 1.00 0.00 C ATOM 2049 C ILE C 35 5.539 13.833 2.536 1.00 0.00 C ATOM 2050 O ILE C 35 4.788 13.902 3.502 1.00 0.00 O ATOM 2051 CB ILE C 35 6.774 15.822 1.705 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.530 16.784 2.875 1.00 0.00 C ATOM 2053 CG2 ILE C 35 7.112 16.571 0.435 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.708 17.685 3.186 1.00 0.00 C ATOM 0 H ILE C 35 4.059 16.088 2.358 1.00 0.00 H new ATOM 0 HA ILE C 35 5.634 14.463 0.484 1.00 0.00 H new ATOM 0 HB ILE C 35 7.627 15.198 1.972 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.662 17.403 2.648 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.284 16.204 3.764 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.978 17.209 0.609 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.339 15.859 -0.358 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.262 17.186 0.138 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.458 18.335 4.024 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.574 17.076 3.445 1.00 0.00 H new ATOM 0 HD13 ILE C 35 7.941 18.293 2.312 1.00 0.00 H new ATOM 2066 N LEU C 36 6.400 12.847 2.350 1.00 0.00 N ATOM 2067 CA LEU C 36 6.394 11.650 3.175 1.00 0.00 C ATOM 2068 C LEU C 36 7.218 11.793 4.438 1.00 0.00 C ATOM 2069 O LEU C 36 8.215 12.515 4.479 1.00 0.00 O ATOM 2070 CB LEU C 36 6.945 10.476 2.369 1.00 0.00 C ATOM 2071 CG LEU C 36 6.131 10.109 1.137 1.00 0.00 C ATOM 2072 CD1 LEU C 36 7.036 9.961 -0.072 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.361 8.828 1.390 1.00 0.00 C ATOM 0 H LEU C 36 7.119 12.853 1.627 1.00 0.00 H new ATOM 0 HA LEU C 36 5.359 11.480 3.473 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.962 10.713 2.057 1.00 0.00 H new ATOM 0 HB3 LEU C 36 7.006 9.604 3.020 1.00 0.00 H new ATOM 0 HG LEU C 36 5.420 10.909 0.932 1.00 0.00 H new ATOM 0 HD11 LEU C 36 6.438 9.698 -0.944 1.00 0.00 H new ATOM 0 HD12 LEU C 36 7.553 10.903 -0.257 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.768 9.176 0.116 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.781 8.571 0.504 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.060 8.021 1.612 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.688 8.969 2.236 1.00 0.00 H new ATOM 2085 N THR C 37 6.779 11.081 5.461 1.00 0.00 N ATOM 2086 CA THR C 37 7.551 10.903 6.670 1.00 0.00 C ATOM 2087 C THR C 37 8.082 9.471 6.692 1.00 0.00 C ATOM 2088 O THR C 37 7.690 8.665 5.849 1.00 0.00 O ATOM 2089 CB THR C 37 6.703 11.184 7.934 1.00 0.00 C ATOM 2090 OG1 THR C 37 7.495 11.021 9.116 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.495 10.263 8.004 1.00 0.00 C ATOM 0 H THR C 37 5.874 10.610 5.473 1.00 0.00 H new ATOM 0 HA THR C 37 8.377 11.615 6.676 1.00 0.00 H new ATOM 0 HB THR C 37 6.353 12.214 7.871 1.00 0.00 H new ATOM 0 HG1 THR C 37 6.945 11.204 9.906 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.920 10.485 8.903 1.00 0.00 H new ATOM 0 HG22 THR C 37 4.869 10.417 7.125 1.00 0.00 H new ATOM 0 HG23 THR C 37 5.829 9.226 8.034 1.00 0.00 H new ATOM 2099 N ALA C 38 8.955 9.159 7.638 1.00 0.00 N ATOM 2100 CA ALA C 38 9.631 7.861 7.683 1.00 0.00 C ATOM 2101 C ALA C 38 8.655 6.688 7.604 1.00 0.00 C ATOM 2102 O ALA C 38 8.899 5.716 6.885 1.00 0.00 O ATOM 2103 CB ALA C 38 10.472 7.767 8.940 1.00 0.00 C ATOM 0 H ALA C 38 9.217 9.791 8.394 1.00 0.00 H new ATOM 0 HA ALA C 38 10.273 7.794 6.804 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.974 6.800 8.971 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.217 8.563 8.940 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.831 7.871 9.815 1.00 0.00 H new ATOM 2109 N GLN C 39 7.557 6.772 8.347 1.00 0.00 N ATOM 2110 CA GLN C 39 6.526 5.742 8.293 1.00 0.00 C ATOM 2111 C GLN C 39 5.997 5.572 6.871 1.00 0.00 C ATOM 2112 O GLN C 39 5.894 4.452 6.368 1.00 0.00 O ATOM 2113 CB GLN C 39 5.373 6.086 9.230 1.00 0.00 C ATOM 2114 CG GLN C 39 4.361 4.963 9.370 1.00 0.00 C ATOM 2115 CD GLN C 39 3.360 5.214 10.476 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.677 5.835 11.487 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.143 4.731 10.287 1.00 0.00 N ATOM 0 H GLN C 39 7.358 7.538 8.990 1.00 0.00 H new ATOM 0 HA GLN C 39 6.978 4.803 8.613 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.773 6.330 10.214 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.867 6.978 8.861 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.830 4.838 8.426 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.886 4.028 9.566 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.924 4.221 9.431 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.424 4.869 10.997 1.00 0.00 H new ATOM 2126 N GLY C 40 5.686 6.689 6.222 1.00 0.00 N ATOM 2127 CA GLY C 40 5.193 6.649 4.860 1.00 0.00 C ATOM 2128 C GLY C 40 6.258 6.189 3.889 1.00 0.00 C ATOM 2129 O GLY C 40 5.960 5.596 2.856 1.00 0.00 O ATOM 0 H GLY C 40 5.768 7.625 6.618 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.336 5.978 4.804 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.842 7.640 4.572 1.00 0.00 H new ATOM 2133 N TYR C 41 7.508 6.441 4.237 1.00 0.00 N ATOM 2134 CA TYR C 41 8.627 5.977 3.435 1.00 0.00 C ATOM 2135 C TYR C 41 8.749 4.462 3.505 1.00 0.00 C ATOM 2136 O TYR C 41 9.094 3.816 2.514 1.00 0.00 O ATOM 2137 CB TYR C 41 9.920 6.633 3.932 1.00 0.00 C ATOM 2138 CG TYR C 41 10.222 7.967 3.285 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.573 8.046 1.943 1.00 0.00 C ATOM 2140 CD2 TYR C 41 10.157 9.147 4.013 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.847 9.261 1.346 1.00 0.00 C ATOM 2142 CE2 TYR C 41 10.432 10.366 3.424 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.775 10.417 2.091 1.00 0.00 C ATOM 2144 OH TYR C 41 11.041 11.631 1.500 1.00 0.00 O ATOM 0 H TYR C 41 7.774 6.965 5.071 1.00 0.00 H new ATOM 0 HA TYR C 41 8.454 6.257 2.396 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.854 6.771 5.011 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.753 5.955 3.748 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.633 7.141 1.356 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.887 9.112 5.058 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.116 9.304 0.301 1.00 0.00 H new ATOM 0 HE2 TYR C 41 10.378 11.274 4.006 1.00 0.00 H new ATOM 0 HH TYR C 41 10.945 12.346 2.163 1.00 0.00 H new ATOM 2154 N THR C 42 8.426 3.891 4.654 1.00 0.00 N ATOM 2155 CA THR C 42 8.447 2.445 4.816 1.00 0.00 C ATOM 2156 C THR C 42 7.278 1.804 4.083 1.00 0.00 C ATOM 2157 O THR C 42 7.391 0.707 3.526 1.00 0.00 O ATOM 2158 CB THR C 42 8.379 2.073 6.309 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.387 2.790 7.030 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.572 0.578 6.516 1.00 0.00 C ATOM 0 H THR C 42 8.146 4.406 5.489 1.00 0.00 H new ATOM 0 HA THR C 42 9.379 2.072 4.392 1.00 0.00 H new ATOM 0 HB THR C 42 7.391 2.344 6.681 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.159 3.743 7.051 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.519 0.348 7.580 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.790 0.033 5.987 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.546 0.280 6.129 1.00 0.00 H new ATOM 2168 N LEU C 43 6.165 2.519 4.042 1.00 0.00 N ATOM 2169 CA LEU C 43 4.953 1.988 3.452 1.00 0.00 C ATOM 2170 C LEU C 43 4.926 2.214 1.944 1.00 0.00 C ATOM 2171 O LEU C 43 4.210 1.521 1.234 1.00 0.00 O ATOM 2172 CB LEU C 43 3.714 2.622 4.101 1.00 0.00 C ATOM 2173 CG LEU C 43 3.029 1.789 5.201 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.027 1.376 6.272 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.890 2.577 5.829 1.00 0.00 C ATOM 0 H LEU C 43 6.079 3.466 4.410 1.00 0.00 H new ATOM 0 HA LEU C 43 4.939 0.914 3.636 1.00 0.00 H new ATOM 0 HB2 LEU C 43 4.003 3.583 4.527 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.983 2.827 3.319 1.00 0.00 H new ATOM 0 HG LEU C 43 2.626 0.887 4.740 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.518 0.789 7.037 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.818 0.776 5.821 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.461 2.266 6.727 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.416 1.975 6.604 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.281 3.494 6.270 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.155 2.827 5.064 1.00 0.00 H new ATOM 2187 N LEU C 44 5.718 3.154 1.438 1.00 0.00 N ATOM 2188 CA LEU C 44 5.731 3.404 0.004 1.00 0.00 C ATOM 2189 C LEU C 44 6.601 2.373 -0.709 1.00 0.00 C ATOM 2190 O LEU C 44 6.243 1.890 -1.776 1.00 0.00 O ATOM 2191 CB LEU C 44 6.177 4.847 -0.308 1.00 0.00 C ATOM 2192 CG LEU C 44 7.685 5.133 -0.351 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.267 4.774 -1.711 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.941 6.597 -0.055 1.00 0.00 C ATOM 0 H LEU C 44 6.345 3.742 1.986 1.00 0.00 H new ATOM 0 HA LEU C 44 4.714 3.298 -0.373 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.755 5.128 -1.273 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.732 5.505 0.438 1.00 0.00 H new ATOM 0 HG LEU C 44 8.172 4.518 0.406 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.336 4.986 -1.717 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.106 3.714 -1.907 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.776 5.365 -2.484 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.013 6.793 -0.087 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.437 7.212 -0.800 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.557 6.840 0.936 1.00 0.00 H new ATOM 2206 N ASP C 45 7.721 2.002 -0.099 1.00 0.00 N ATOM 2207 CA ASP C 45 8.642 1.049 -0.716 1.00 0.00 C ATOM 2208 C ASP C 45 8.047 -0.350 -0.735 1.00 0.00 C ATOM 2209 O ASP C 45 8.331 -1.144 -1.633 1.00 0.00 O ATOM 2210 CB ASP C 45 9.977 1.036 0.033 1.00 0.00 C ATOM 2211 CG ASP C 45 10.951 0.009 -0.519 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.508 0.245 -1.611 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.168 -1.037 0.133 1.00 0.00 O ATOM 0 H ASP C 45 8.014 2.343 0.817 1.00 0.00 H new ATOM 0 HA ASP C 45 8.813 1.366 -1.745 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.429 2.026 -0.023 1.00 0.00 H new ATOM 0 HB3 ASP C 45 9.795 0.828 1.087 1.00 0.00 H new ATOM 2218 N PHE C 46 7.181 -0.635 0.221 1.00 0.00 N ATOM 2219 CA PHE C 46 6.516 -1.925 0.272 1.00 0.00 C ATOM 2220 C PHE C 46 5.431 -2.010 -0.781 1.00 0.00 C ATOM 2221 O PHE C 46 5.248 -3.051 -1.414 1.00 0.00 O ATOM 2222 CB PHE C 46 5.893 -2.110 1.652 1.00 0.00 C ATOM 2223 CG PHE C 46 5.232 -3.438 1.853 1.00 0.00 C ATOM 2224 CD1 PHE C 46 5.968 -4.535 2.259 1.00 0.00 C ATOM 2225 CD2 PHE C 46 3.872 -3.587 1.642 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.361 -5.755 2.448 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.260 -4.806 1.829 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.007 -5.892 2.232 1.00 0.00 C ATOM 0 H PHE C 46 6.922 0.007 0.970 1.00 0.00 H new ATOM 0 HA PHE C 46 7.250 -2.708 0.080 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.668 -1.984 2.408 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.158 -1.322 1.815 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.030 -4.434 2.429 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.284 -2.737 1.327 1.00 0.00 H new ATOM 0 HE1 PHE C 46 5.946 -6.606 2.766 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.198 -4.911 1.661 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.531 -6.850 2.378 1.00 0.00 H new ATOM 2238 N ILE C 47 4.733 -0.915 -0.999 1.00 0.00 N ATOM 2239 CA ILE C 47 3.674 -0.935 -1.979 1.00 0.00 C ATOM 2240 C ILE C 47 4.264 -0.840 -3.376 1.00 0.00 C ATOM 2241 O ILE C 47 3.764 -1.466 -4.310 1.00 0.00 O ATOM 2242 CB ILE C 47 2.637 0.186 -1.760 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.261 1.559 -2.016 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.086 0.102 -0.345 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.310 2.720 -1.844 1.00 0.00 C ATOM 0 H ILE C 47 4.875 -0.024 -0.524 1.00 0.00 H new ATOM 0 HA ILE C 47 3.144 -1.881 -1.863 1.00 0.00 H new ATOM 0 HB ILE C 47 1.819 0.054 -2.468 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.104 1.693 -1.339 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.660 1.580 -3.030 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.354 0.895 -0.192 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.608 -0.867 -0.197 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.900 0.218 0.370 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.836 3.654 -2.045 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.478 2.615 -2.540 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.929 2.730 -0.823 1.00 0.00 H new ATOM 2257 N GLN C 48 5.358 -0.089 -3.494 1.00 0.00 N ATOM 2258 CA GLN C 48 6.141 -0.050 -4.717 1.00 0.00 C ATOM 2259 C GLN C 48 6.476 -1.464 -5.149 1.00 0.00 C ATOM 2260 O GLN C 48 5.992 -1.949 -6.153 1.00 0.00 O ATOM 2261 CB GLN C 48 7.446 0.718 -4.496 1.00 0.00 C ATOM 2262 CG GLN C 48 7.303 2.231 -4.461 1.00 0.00 C ATOM 2263 CD GLN C 48 7.534 2.861 -5.817 1.00 0.00 C ATOM 2264 OE1 GLN C 48 8.302 2.343 -6.626 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.884 3.984 -6.072 1.00 0.00 N ATOM 0 H GLN C 48 5.720 0.504 -2.747 1.00 0.00 H new ATOM 0 HA GLN C 48 5.554 0.452 -5.486 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.889 0.388 -3.556 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.145 0.452 -5.289 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.305 2.491 -4.107 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.013 2.644 -3.745 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.256 4.380 -5.373 1.00 0.00 H new ATOM 0 HE22 GLN C 48 7.011 4.454 -6.968 1.00 0.00 H new ATOM 2274 N LYS C 49 7.180 -2.150 -4.281 1.00 0.00 N ATOM 2275 CA LYS C 49 7.860 -3.397 -4.599 1.00 0.00 C ATOM 2276 C LYS C 49 6.897 -4.583 -4.657 1.00 0.00 C ATOM 2277 O LYS C 49 7.304 -5.721 -4.897 1.00 0.00 O ATOM 2278 CB LYS C 49 8.959 -3.564 -3.542 1.00 0.00 C ATOM 2279 CG LYS C 49 9.661 -4.912 -3.469 1.00 0.00 C ATOM 2280 CD LYS C 49 10.889 -4.825 -2.564 1.00 0.00 C ATOM 2281 CE LYS C 49 10.593 -4.042 -1.286 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.815 -3.762 -0.492 1.00 0.00 N ATOM 0 H LYS C 49 7.303 -1.857 -3.312 1.00 0.00 H new ATOM 0 HA LYS C 49 8.297 -3.365 -5.597 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.715 -2.799 -3.719 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.521 -3.359 -2.565 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.973 -5.667 -3.088 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.960 -5.228 -4.468 1.00 0.00 H new ATOM 0 HD2 LYS C 49 11.223 -5.830 -2.306 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.706 -4.346 -3.104 1.00 0.00 H new ATOM 0 HE2 LYS C 49 10.109 -3.100 -1.545 1.00 0.00 H new ATOM 0 HE3 LYS C 49 9.888 -4.605 -0.674 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.789 -2.781 -0.149 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.858 -4.412 0.319 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.656 -3.897 -1.089 1.00 0.00 H new ATOM 2296 N HIS C 50 5.608 -4.339 -4.438 1.00 0.00 N ATOM 2297 CA HIS C 50 4.661 -5.396 -4.766 1.00 0.00 C ATOM 2298 C HIS C 50 3.693 -5.055 -5.897 1.00 0.00 C ATOM 2299 O HIS C 50 3.001 -5.954 -6.370 1.00 0.00 O ATOM 2300 CB HIS C 50 3.884 -5.805 -3.510 1.00 0.00 C ATOM 2301 CG HIS C 50 4.785 -6.324 -2.441 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.716 -7.297 -2.681 1.00 0.00 N ATOM 2303 CD2 HIS C 50 4.939 -5.968 -1.148 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.406 -7.523 -1.588 1.00 0.00 C ATOM 2305 NE2 HIS C 50 5.961 -6.727 -0.637 1.00 0.00 N ATOM 0 H HIS C 50 5.214 -3.477 -4.060 1.00 0.00 H new ATOM 0 HA HIS C 50 5.260 -6.228 -5.137 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.329 -4.947 -3.131 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.151 -6.569 -3.770 1.00 0.00 H new ATOM 0 HD2 HIS C 50 4.365 -5.224 -0.615 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.205 -8.242 -1.485 1.00 0.00 H new ATOM 0 HE2 HIS C 50 6.316 -6.683 0.318 1.00 0.00 H new ATOM 2314 N LEU C 51 3.651 -3.807 -6.377 1.00 0.00 N ATOM 2315 CA LEU C 51 2.748 -3.480 -7.495 1.00 0.00 C ATOM 2316 C LEU C 51 3.442 -2.686 -8.612 1.00 0.00 C ATOM 2317 O LEU C 51 3.036 -2.756 -9.767 1.00 0.00 O ATOM 2318 CB LEU C 51 1.514 -2.694 -7.022 1.00 0.00 C ATOM 2319 CG LEU C 51 0.637 -3.367 -5.957 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.659 -2.598 -5.772 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.330 -4.802 -6.326 1.00 0.00 C ATOM 0 H LEU C 51 4.209 -3.028 -6.026 1.00 0.00 H new ATOM 0 HA LEU C 51 2.435 -4.443 -7.900 1.00 0.00 H new ATOM 0 HB2 LEU C 51 1.851 -1.735 -6.629 1.00 0.00 H new ATOM 0 HB3 LEU C 51 0.892 -2.482 -7.891 1.00 0.00 H new ATOM 0 HG LEU C 51 1.194 -3.363 -5.020 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.268 -3.089 -5.013 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.436 -1.580 -5.454 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -1.205 -2.572 -6.715 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -0.293 -5.251 -5.552 1.00 0.00 H new ATOM 0 HD22 LEU C 51 -0.200 -4.827 -7.278 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.261 -5.362 -6.414 1.00 0.00 H new ATOM 2333 N ASN C 52 4.474 -1.924 -8.276 1.00 0.00 N ATOM 2334 CA ASN C 52 5.130 -1.040 -9.251 1.00 0.00 C ATOM 2335 C ASN C 52 6.620 -1.347 -9.384 1.00 0.00 C ATOM 2336 O ASN C 52 7.248 -1.032 -10.395 1.00 0.00 O ATOM 2337 CB ASN C 52 4.933 0.420 -8.844 1.00 0.00 C ATOM 2338 CG ASN C 52 3.778 1.085 -9.572 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.783 0.306 -9.972 1.00 0.00 O flip ATOM 2340 ND2 ASN C 52 3.786 2.298 -9.781 1.00 0.00 N flip ATOM 0 H ASN C 52 4.880 -1.895 -7.341 1.00 0.00 H new ATOM 0 HA ASN C 52 4.668 -1.217 -10.222 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.757 0.472 -7.770 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.850 0.975 -9.044 1.00 0.00 H new ATOM 0 HD21 ASN C 52 4.569 2.866 -9.458 1.00 0.00 H new ATOM 0 HD22 ASN C 52 3.009 2.735 -10.277 1.00 0.00 H new ATOM 2347 N LYS C 53 7.172 -1.955 -8.357 1.00 0.00 N ATOM 2348 CA LYS C 53 8.543 -2.409 -8.353 1.00 0.00 C ATOM 2349 C LYS C 53 8.550 -3.929 -8.433 1.00 0.00 C ATOM 2350 O LYS C 53 8.597 -4.581 -7.378 1.00 0.00 O ATOM 2351 CB LYS C 53 9.243 -1.967 -7.065 1.00 0.00 C ATOM 2352 CG LYS C 53 10.274 -0.869 -7.243 1.00 0.00 C ATOM 2353 CD LYS C 53 11.209 -0.825 -6.039 1.00 0.00 C ATOM 2354 CE LYS C 53 10.764 0.189 -5.003 1.00 0.00 C ATOM 2355 NZ LYS C 53 10.803 1.578 -5.532 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.461 -4.458 -9.562 1.00 0.00 O ATOM 0 H LYS C 53 6.673 -2.150 -7.489 1.00 0.00 H new ATOM 0 HA LYS C 53 9.071 -1.980 -9.205 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.488 -1.625 -6.357 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.730 -2.834 -6.618 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.849 -1.043 -8.153 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.775 0.093 -7.361 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.255 -1.813 -5.581 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.217 -0.581 -6.373 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.751 -0.047 -4.677 1.00 0.00 H new ATOM 0 HE3 LYS C 53 11.407 0.117 -4.125 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.031 2.237 -4.760 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 11.530 1.647 -6.273 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 9.875 1.823 -5.933 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -20.983 -4.493 -2.526 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 14.438 -16.052 -2.507 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 7.071 20.229 -2.135 1.00 0.00 ZN