USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, 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: B 1 FME CE :methyl -146:sc= -0.0303 (180deg=0) USER MOD Set 1.2: C 42 THR OG1 : rot 68:sc= 0.809 USER MOD Set 2.1: C 30 SER OG : rot 180:sc= 0.705 USER MOD Set 2.2: C 32 LYS NZ :NH3+ 149:sc= 0.745 (180deg=-0.079) USER MOD Set 3.1: B 30 SER OG : rot 180:sc= 0.552 USER MOD Set 3.2: B 32 LYS NZ :NH3+ 147:sc= 0.564 (180deg=-0.241) USER MOD Set 4.1: A 42 THR OG1 : rot 71:sc= 0.949 USER MOD Set 4.2: C 1 FME CE :methyl -148:sc= -0.0351 (180deg=0) USER MOD Set 5.1: A 30 SER OG : rot 180:sc= 0.669 USER MOD Set 5.2: A 32 LYS NZ :NH3+ 147:sc= 0.696 (180deg=-0.188) USER MOD Set 6.1: A 1 FME CE :methyl -147:sc= -0.122 (180deg=0) USER MOD Set 6.2: B 42 THR OG1 : rot 70:sc= 0.815 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.0551 USER MOD Single : A 14 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0655) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -167:sc= -0.218 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.263 K(o=-0.26,f=-3.5!) USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 1.33 (180deg=0.906!) USER MOD Single : A 50 HIS : +bothHN:sc= -1.89 K(o=-1.9,f=-6.8!) USER MOD Single : A 52 ASN : amide:sc= -0.555 X(o=-0.55,f=-0.72) USER MOD Single : A 53 LYS NZ :NH3+ -146:sc= 1.14 (180deg=0.535) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.145 USER MOD Single : B 14 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0367) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot -166:sc= -0.0841 USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.268 K(o=-0.27,f=-3.4!) USER MOD Single : B 49 LYS NZ :NH3+ 167:sc= 1.49 (180deg=1.2) USER MOD Single : B 50 HIS : +bothHN:sc= -2.04 K(o=-2,f=-6.6!) USER MOD Single : B 52 ASN : amide:sc= -0.749 X(o=-0.75,f=-0.93) USER MOD Single : B 53 LYS NZ :NH3+ -166:sc= 1.14 (180deg=1.06) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.0247 USER MOD Single : C 14 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0905) USER MOD Single : C 24 THR OG1 : rot 180:sc= 0 USER MOD Single : C 37 THR OG1 : rot -167:sc= -0.108 USER MOD Single : C 39 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 48 GLN : amide:sc= -0.246 K(o=-0.25,f=-3.3!) USER MOD Single : C 49 LYS NZ :NH3+ 170:sc= 1.38 (180deg=1.01) USER MOD Single : C 50 HIS : +bothHN:sc= -2.33 K(o=-2.3,f=-6.8!) USER MOD Single : C 52 ASN : amide:sc= -0.728 X(o=-0.73,f=-0.76) USER MOD Single : C 53 LYS NZ :NH3+ -131:sc= 1.18 (180deg=0.761) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 1.578 -11.810 13.507 1.00 0.00 N HETATM 2 CN FME A 1 2.725 -11.176 13.689 1.00 0.00 C HETATM 3 O1 FME A 1 3.645 -11.671 14.335 1.00 0.00 O HETATM 4 CA FME A 1 0.507 -11.207 12.730 1.00 0.00 C HETATM 5 CB FME A 1 -0.260 -12.286 11.962 1.00 0.00 C HETATM 6 CG FME A 1 -1.200 -11.733 10.902 1.00 0.00 C HETATM 7 SD FME A 1 -1.982 -13.031 9.924 1.00 0.00 S HETATM 8 CE FME A 1 -2.754 -12.056 8.633 1.00 0.00 C HETATM 9 C FME A 1 -0.435 -10.438 13.649 1.00 0.00 C HETATM 10 O FME A 1 -1.301 -11.021 14.298 1.00 0.00 O HETATM 0 HG3 FME A 1 -1.971 -11.131 11.383 1.00 0.00 H new HETATM 0 HG2 FME A 1 -0.645 -11.069 10.240 1.00 0.00 H new HETATM 0 HE3 FME A 1 -3.684 -12.533 8.324 1.00 0.00 H new HETATM 0 HE2 FME A 1 -2.967 -11.056 9.011 1.00 0.00 H new HETATM 0 HE1 FME A 1 -2.081 -11.985 7.779 1.00 0.00 H new HETATM 0 HCN FME A 1 2.857 -10.186 13.253 1.00 0.00 H new HETATM 0 HB3 FME A 1 0.455 -12.958 11.486 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.836 -12.883 12.670 1.00 0.00 H new HETATM 0 HA FME A 1 0.940 -10.511 12.011 1.00 0.00 H new HETATM 0 H FME A 1 1.443 -12.734 13.917 1.00 0.00 H new ATOM 21 N VAL A 2 -0.266 -9.125 13.694 1.00 0.00 N ATOM 22 CA VAL A 2 -1.066 -8.287 14.578 1.00 0.00 C ATOM 23 C VAL A 2 -2.125 -7.531 13.776 1.00 0.00 C ATOM 24 O VAL A 2 -3.075 -6.980 14.330 1.00 0.00 O ATOM 25 CB VAL A 2 -0.171 -7.289 15.355 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.480 -6.285 14.413 1.00 0.00 C ATOM 27 CG2 VAL A 2 -0.960 -6.577 16.447 1.00 0.00 C ATOM 0 H VAL A 2 0.416 -8.617 13.131 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.564 -8.934 15.301 1.00 0.00 H new ATOM 0 HB VAL A 2 0.623 -7.862 15.834 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.102 -5.598 14.987 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.098 -6.814 13.688 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.293 -5.723 13.889 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.306 -5.883 16.975 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.787 -6.026 15.998 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.353 -7.312 17.150 1.00 0.00 H new ATOM 37 N ILE A 3 -1.963 -7.529 12.463 1.00 0.00 N ATOM 38 CA ILE A 3 -2.933 -6.899 11.588 1.00 0.00 C ATOM 39 C ILE A 3 -3.624 -7.954 10.732 1.00 0.00 C ATOM 40 O ILE A 3 -2.975 -8.836 10.169 1.00 0.00 O ATOM 41 CB ILE A 3 -2.291 -5.810 10.690 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.377 -5.043 9.928 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.283 -6.419 9.720 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.849 -3.868 9.133 1.00 0.00 C ATOM 0 H ILE A 3 -1.171 -7.956 11.982 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.671 -6.402 12.218 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.755 -5.112 11.333 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -3.886 -5.729 9.251 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.122 -4.684 10.638 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.850 -5.631 9.104 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.493 -6.917 10.282 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.786 -7.145 9.081 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.675 -3.374 8.621 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.365 -3.161 9.807 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.126 -4.222 8.398 1.00 0.00 H new ATOM 56 N ALA A 4 -4.941 -7.892 10.689 1.00 0.00 N ATOM 57 CA ALA A 4 -5.720 -8.795 9.865 1.00 0.00 C ATOM 58 C ALA A 4 -6.586 -8.004 8.901 1.00 0.00 C ATOM 59 O ALA A 4 -7.006 -6.884 9.197 1.00 0.00 O ATOM 60 CB ALA A 4 -6.575 -9.700 10.738 1.00 0.00 C ATOM 0 H ALA A 4 -5.497 -7.221 11.219 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.041 -9.421 9.286 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.155 -10.373 10.106 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -5.932 -10.284 11.396 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.252 -9.092 11.338 1.00 0.00 H new ATOM 66 N THR A 5 -6.848 -8.603 7.746 1.00 0.00 N ATOM 67 CA THR A 5 -7.591 -7.955 6.673 1.00 0.00 C ATOM 68 C THR A 5 -9.022 -7.628 7.100 1.00 0.00 C ATOM 69 O THR A 5 -9.689 -6.813 6.477 1.00 0.00 O ATOM 70 CB THR A 5 -7.628 -8.868 5.433 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.366 -9.532 5.288 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.927 -8.072 4.171 1.00 0.00 C ATOM 0 H THR A 5 -6.551 -9.554 7.527 1.00 0.00 H new ATOM 0 HA THR A 5 -7.081 -7.022 6.434 1.00 0.00 H new ATOM 0 HB THR A 5 -8.423 -9.601 5.574 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.391 -10.114 4.500 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.946 -8.744 3.313 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.896 -7.582 4.271 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.153 -7.319 4.024 1.00 0.00 H new ATOM 80 N ASP A 6 -9.458 -8.233 8.196 1.00 0.00 N ATOM 81 CA ASP A 6 -10.838 -8.110 8.654 1.00 0.00 C ATOM 82 C ASP A 6 -11.066 -6.811 9.419 1.00 0.00 C ATOM 83 O ASP A 6 -12.198 -6.488 9.779 1.00 0.00 O ATOM 84 CB ASP A 6 -11.203 -9.294 9.555 1.00 0.00 C ATOM 85 CG ASP A 6 -11.142 -10.623 8.833 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.022 -11.135 8.608 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.209 -11.167 8.489 1.00 0.00 O ATOM 0 H ASP A 6 -8.872 -8.819 8.790 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.474 -8.104 7.769 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.525 -9.318 10.408 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.208 -9.147 9.951 1.00 0.00 H new ATOM 92 N ASP A 7 -9.997 -6.071 9.682 1.00 0.00 N ATOM 93 CA ASP A 7 -10.124 -4.789 10.371 1.00 0.00 C ATOM 94 C ASP A 7 -9.968 -3.626 9.401 1.00 0.00 C ATOM 95 O ASP A 7 -10.232 -2.474 9.751 1.00 0.00 O ATOM 96 CB ASP A 7 -9.075 -4.667 11.482 1.00 0.00 C ATOM 97 CG ASP A 7 -9.289 -5.654 12.612 1.00 0.00 C ATOM 98 OD1 ASP A 7 -8.836 -6.811 12.494 1.00 0.00 O ATOM 99 OD2 ASP A 7 -9.907 -5.275 13.631 1.00 0.00 O ATOM 0 H ASP A 7 -9.042 -6.330 9.433 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.121 -4.750 10.809 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.084 -4.821 11.056 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.096 -3.654 11.884 1.00 0.00 H new ATOM 104 N LEU A 8 -9.541 -3.922 8.181 1.00 0.00 N ATOM 105 CA LEU A 8 -9.336 -2.878 7.181 1.00 0.00 C ATOM 106 C LEU A 8 -10.226 -3.101 5.970 1.00 0.00 C ATOM 107 O LEU A 8 -10.536 -2.163 5.232 1.00 0.00 O ATOM 108 CB LEU A 8 -7.870 -2.802 6.757 1.00 0.00 C ATOM 109 CG LEU A 8 -6.908 -2.321 7.844 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.546 -3.448 8.799 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.660 -1.727 7.220 1.00 0.00 C ATOM 0 H LEU A 8 -9.331 -4.867 7.860 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.609 -1.927 7.638 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.552 -3.790 6.423 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.789 -2.134 5.900 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.412 -1.546 8.421 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.861 -3.074 9.560 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.450 -3.824 9.278 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.067 -4.255 8.245 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.985 -1.389 8.007 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.161 -2.483 6.614 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.935 -0.881 6.590 1.00 0.00 H new ATOM 123 N GLU A 9 -10.638 -4.342 5.783 1.00 0.00 N ATOM 124 CA GLU A 9 -11.585 -4.689 4.745 1.00 0.00 C ATOM 125 C GLU A 9 -12.700 -5.523 5.350 1.00 0.00 C ATOM 126 O GLU A 9 -12.455 -6.488 6.073 1.00 0.00 O ATOM 127 CB GLU A 9 -10.917 -5.437 3.583 1.00 0.00 C ATOM 128 CG GLU A 9 -9.967 -4.570 2.769 1.00 0.00 C ATOM 129 CD GLU A 9 -9.545 -5.210 1.459 1.00 0.00 C ATOM 130 OE1 GLU A 9 -8.596 -6.024 1.455 1.00 0.00 O ATOM 131 OE2 GLU A 9 -10.144 -4.873 0.414 1.00 0.00 O ATOM 0 H GLU A 9 -10.325 -5.133 6.346 1.00 0.00 H new ATOM 0 HA GLU A 9 -11.995 -3.768 4.331 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.368 -6.291 3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.690 -5.833 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.447 -3.614 2.560 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.079 -4.358 3.365 1.00 0.00 H new ATOM 138 N VAL A 10 -13.918 -5.133 5.065 1.00 0.00 N ATOM 139 CA VAL A 10 -15.081 -5.791 5.615 1.00 0.00 C ATOM 140 C VAL A 10 -15.989 -6.215 4.475 1.00 0.00 C ATOM 141 O VAL A 10 -16.148 -5.489 3.493 1.00 0.00 O ATOM 142 CB VAL A 10 -15.835 -4.865 6.604 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.267 -3.570 5.932 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.033 -5.578 7.214 1.00 0.00 C ATOM 0 H VAL A 10 -14.133 -4.351 4.446 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.763 -6.670 6.176 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.143 -4.611 7.407 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.793 -2.944 6.653 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.388 -3.040 5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.930 -3.797 5.097 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.544 -4.906 7.904 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.720 -5.877 6.423 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.694 -6.463 7.753 1.00 0.00 H new ATOM 154 N ALA A 11 -16.562 -7.397 4.588 1.00 0.00 N ATOM 155 CA ALA A 11 -17.395 -7.935 3.533 1.00 0.00 C ATOM 156 C ALA A 11 -18.632 -7.068 3.323 1.00 0.00 C ATOM 157 O ALA A 11 -19.312 -6.687 4.279 1.00 0.00 O ATOM 158 CB ALA A 11 -17.767 -9.367 3.885 1.00 0.00 C ATOM 0 H ALA A 11 -16.465 -8.004 5.402 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.845 -7.933 2.592 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.395 -9.784 3.098 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.861 -9.965 3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.312 -9.380 4.829 1.00 0.00 H new ATOM 164 N CYS A 12 -18.892 -6.750 2.052 1.00 0.00 N ATOM 165 CA CYS A 12 -19.892 -5.768 1.641 1.00 0.00 C ATOM 166 C CYS A 12 -21.314 -6.144 2.094 1.00 0.00 C ATOM 167 O CYS A 12 -21.551 -7.281 2.489 1.00 0.00 O ATOM 168 CB CYS A 12 -19.840 -5.690 0.111 1.00 0.00 C ATOM 169 SG CYS A 12 -20.075 -4.046 -0.595 1.00 0.00 S ATOM 0 H CYS A 12 -18.402 -7.178 1.266 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.665 -4.810 2.108 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.876 -6.074 -0.222 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.604 -6.353 -0.295 1.00 0.00 H new ATOM 174 N PRO A 13 -22.276 -5.196 2.036 1.00 0.00 N ATOM 175 CA PRO A 13 -23.691 -5.461 2.355 1.00 0.00 C ATOM 176 C PRO A 13 -24.257 -6.732 1.707 1.00 0.00 C ATOM 177 O PRO A 13 -25.075 -7.433 2.302 1.00 0.00 O ATOM 178 CB PRO A 13 -24.390 -4.238 1.760 1.00 0.00 C ATOM 179 CG PRO A 13 -23.414 -3.131 1.918 1.00 0.00 C ATOM 180 CD PRO A 13 -22.059 -3.764 1.715 1.00 0.00 C ATOM 0 HA PRO A 13 -23.830 -5.619 3.425 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.642 -4.397 0.711 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.322 -4.022 2.282 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.593 -2.342 1.188 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.492 -2.676 2.905 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.708 -3.634 0.691 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.309 -3.318 2.368 1.00 0.00 H new ATOM 188 N LYS A 14 -23.798 -7.036 0.496 1.00 0.00 N ATOM 189 CA LYS A 14 -24.474 -8.030 -0.333 1.00 0.00 C ATOM 190 C LYS A 14 -23.532 -8.809 -1.256 1.00 0.00 C ATOM 191 O LYS A 14 -23.780 -9.975 -1.550 1.00 0.00 O ATOM 192 CB LYS A 14 -25.550 -7.330 -1.177 1.00 0.00 C ATOM 193 CG LYS A 14 -26.083 -8.172 -2.330 1.00 0.00 C ATOM 194 CD LYS A 14 -27.113 -7.412 -3.156 1.00 0.00 C ATOM 195 CE LYS A 14 -27.427 -8.139 -4.456 1.00 0.00 C ATOM 196 NZ LYS A 14 -27.893 -9.532 -4.223 1.00 0.00 N ATOM 0 H LYS A 14 -22.972 -6.615 0.071 1.00 0.00 H new ATOM 0 HA LYS A 14 -24.913 -8.760 0.347 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.382 -7.053 -0.529 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.137 -6.405 -1.578 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.256 -8.476 -2.971 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -26.533 -9.084 -1.937 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.028 -7.289 -2.576 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -26.739 -6.413 -3.377 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.193 -7.588 -5.002 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.537 -8.156 -5.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -28.254 -9.931 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -27.100 -10.111 -3.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -28.652 -9.530 -3.512 1.00 0.00 H new ATOM 210 N CYS A 15 -22.456 -8.189 -1.724 1.00 0.00 N ATOM 211 CA CYS A 15 -21.699 -8.783 -2.825 1.00 0.00 C ATOM 212 C CYS A 15 -20.271 -9.166 -2.463 1.00 0.00 C ATOM 213 O CYS A 15 -19.345 -8.973 -3.257 1.00 0.00 O ATOM 214 CB CYS A 15 -21.635 -7.741 -3.920 1.00 0.00 C ATOM 215 SG CYS A 15 -20.881 -6.188 -3.362 1.00 0.00 S ATOM 0 H CYS A 15 -22.094 -7.302 -1.374 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.204 -9.704 -3.117 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.064 -8.137 -4.760 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.642 -7.541 -4.285 1.00 0.00 H new ATOM 220 N GLU A 16 -20.113 -9.803 -1.328 1.00 0.00 N ATOM 221 CA GLU A 16 -18.814 -10.233 -0.849 1.00 0.00 C ATOM 222 C GLU A 16 -18.555 -11.635 -1.349 1.00 0.00 C ATOM 223 O GLU A 16 -17.835 -12.418 -0.730 1.00 0.00 O ATOM 224 CB GLU A 16 -18.804 -10.244 0.683 1.00 0.00 C ATOM 225 CG GLU A 16 -20.043 -9.647 1.330 1.00 0.00 C ATOM 226 CD GLU A 16 -21.189 -10.638 1.378 1.00 0.00 C ATOM 227 OE1 GLU A 16 -21.854 -10.822 0.346 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.413 -11.258 2.438 1.00 0.00 O ATOM 0 H GLU A 16 -20.884 -10.041 -0.704 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.046 -9.550 -1.211 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.692 -11.273 1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -17.929 -9.696 1.031 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.803 -9.321 2.342 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.352 -8.762 0.774 1.00 0.00 H new ATOM 235 N ARG A 17 -19.147 -11.939 -2.490 1.00 0.00 N ATOM 236 CA ARG A 17 -19.264 -13.292 -2.966 1.00 0.00 C ATOM 237 C ARG A 17 -19.214 -13.249 -4.496 1.00 0.00 C ATOM 238 O ARG A 17 -18.899 -14.237 -5.154 1.00 0.00 O ATOM 239 CB ARG A 17 -20.576 -13.913 -2.467 1.00 0.00 C ATOM 240 CG ARG A 17 -21.823 -13.170 -2.927 1.00 0.00 C ATOM 241 CD ARG A 17 -23.040 -13.553 -2.101 1.00 0.00 C ATOM 242 NE ARG A 17 -22.963 -13.031 -0.735 1.00 0.00 N ATOM 243 CZ ARG A 17 -23.558 -13.588 0.315 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.297 -14.678 0.167 1.00 0.00 N ATOM 245 NH2 ARG A 17 -23.421 -13.043 1.516 1.00 0.00 N ATOM 0 H ARG A 17 -19.561 -11.244 -3.112 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.450 -13.911 -2.589 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.632 -14.946 -2.811 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.562 -13.941 -1.377 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.655 -12.096 -2.852 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.012 -13.391 -3.978 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -23.940 -13.173 -2.584 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.130 -14.639 -2.070 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.417 -12.184 -0.579 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.412 -15.095 -0.757 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.751 -15.100 0.977 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.860 -12.199 1.632 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.876 -13.468 2.324 1.00 0.00 H new ATOM 259 N ALA A 18 -19.527 -12.062 -5.049 1.00 0.00 N ATOM 260 CA ALA A 18 -19.646 -11.905 -6.499 1.00 0.00 C ATOM 261 C ALA A 18 -18.993 -10.619 -7.015 1.00 0.00 C ATOM 262 O ALA A 18 -18.472 -10.588 -8.130 1.00 0.00 O ATOM 263 CB ALA A 18 -21.109 -11.956 -6.911 1.00 0.00 C ATOM 0 H ALA A 18 -19.699 -11.210 -4.515 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.106 -12.735 -6.954 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.187 -11.838 -7.992 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.536 -12.915 -6.619 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.654 -11.151 -6.418 1.00 0.00 H new ATOM 269 N GLY A 19 -19.006 -9.566 -6.198 1.00 0.00 N ATOM 270 CA GLY A 19 -18.386 -8.308 -6.595 1.00 0.00 C ATOM 271 C GLY A 19 -19.296 -7.414 -7.425 1.00 0.00 C ATOM 272 O GLY A 19 -18.824 -6.570 -8.181 1.00 0.00 O ATOM 0 H GLY A 19 -19.433 -9.560 -5.272 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.077 -7.767 -5.701 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.483 -8.522 -7.166 1.00 0.00 H new ATOM 276 N GLU A 20 -20.592 -7.568 -7.242 1.00 0.00 N ATOM 277 CA GLU A 20 -21.586 -6.865 -8.042 1.00 0.00 C ATOM 278 C GLU A 20 -22.687 -6.300 -7.138 1.00 0.00 C ATOM 279 O GLU A 20 -22.458 -6.078 -5.960 1.00 0.00 O ATOM 280 CB GLU A 20 -22.128 -7.778 -9.169 1.00 0.00 C ATOM 281 CG GLU A 20 -22.571 -9.171 -8.734 1.00 0.00 C ATOM 282 CD GLU A 20 -23.813 -9.166 -7.867 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.925 -8.993 -8.417 1.00 0.00 O ATOM 284 OE2 GLU A 20 -23.678 -9.320 -6.635 1.00 0.00 O ATOM 0 H GLU A 20 -20.991 -8.184 -6.534 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.119 -6.015 -8.539 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.974 -7.278 -9.641 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.355 -7.883 -9.930 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -22.758 -9.777 -9.620 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -21.758 -9.648 -8.187 1.00 0.00 H new ATOM 291 N ILE A 21 -23.849 -6.074 -7.716 1.00 0.00 N ATOM 292 CA ILE A 21 -25.030 -5.526 -7.042 1.00 0.00 C ATOM 293 C ILE A 21 -26.113 -5.581 -8.083 1.00 0.00 C ATOM 294 O ILE A 21 -26.205 -4.694 -8.928 1.00 0.00 O ATOM 295 CB ILE A 21 -24.960 -4.062 -6.500 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.079 -3.933 -5.255 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.365 -3.570 -6.153 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.551 -4.739 -4.056 1.00 0.00 C ATOM 0 H ILE A 21 -24.013 -6.271 -8.703 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.176 -6.117 -6.138 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.517 -3.457 -7.291 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.066 -4.245 -5.509 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -24.027 -2.882 -4.971 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.310 -2.549 -5.776 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.990 -3.594 -7.046 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.799 -4.216 -5.390 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.866 -4.586 -3.222 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.551 -4.413 -3.769 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.575 -5.797 -4.316 1.00 0.00 H new ATOM 310 N GLU A 22 -26.900 -6.640 -8.049 1.00 0.00 N ATOM 311 CA GLU A 22 -27.958 -6.820 -9.022 1.00 0.00 C ATOM 312 C GLU A 22 -27.378 -6.874 -10.445 1.00 0.00 C ATOM 313 O GLU A 22 -27.852 -6.172 -11.341 1.00 0.00 O ATOM 314 CB GLU A 22 -28.934 -5.647 -8.900 1.00 0.00 C ATOM 315 CG GLU A 22 -30.344 -5.971 -9.333 1.00 0.00 C ATOM 316 CD GLU A 22 -31.020 -6.927 -8.373 1.00 0.00 C ATOM 317 OE1 GLU A 22 -31.585 -6.458 -7.362 1.00 0.00 O ATOM 318 OE2 GLU A 22 -30.989 -8.152 -8.614 1.00 0.00 O ATOM 0 H GLU A 22 -26.826 -7.387 -7.359 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.475 -7.760 -8.831 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.952 -5.309 -7.864 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.563 -4.816 -9.500 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.925 -5.051 -9.399 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.326 -6.409 -10.331 1.00 0.00 H new ATOM 325 N GLY A 23 -26.326 -7.677 -10.656 1.00 0.00 N ATOM 326 CA GLY A 23 -25.691 -7.737 -11.973 1.00 0.00 C ATOM 327 C GLY A 23 -24.985 -6.451 -12.349 1.00 0.00 C ATOM 328 O GLY A 23 -24.423 -6.316 -13.436 1.00 0.00 O ATOM 0 H GLY A 23 -25.907 -8.280 -9.948 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.973 -8.557 -11.987 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.447 -7.963 -12.725 1.00 0.00 H new ATOM 332 N THR A 24 -25.028 -5.522 -11.439 1.00 0.00 N ATOM 333 CA THR A 24 -24.637 -4.158 -11.682 1.00 0.00 C ATOM 334 C THR A 24 -23.467 -3.749 -10.773 1.00 0.00 C ATOM 335 O THR A 24 -23.352 -4.239 -9.648 1.00 0.00 O ATOM 336 CB THR A 24 -25.910 -3.326 -11.436 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.738 -3.362 -12.604 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.646 -1.888 -11.016 1.00 0.00 C ATOM 0 H THR A 24 -25.343 -5.693 -10.484 1.00 0.00 H new ATOM 0 HA THR A 24 -24.266 -4.002 -12.695 1.00 0.00 H new ATOM 0 HB THR A 24 -26.420 -3.786 -10.590 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.549 -2.834 -12.447 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.595 -1.373 -10.864 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.075 -1.879 -10.088 1.00 0.00 H new ATOM 0 HG23 THR A 24 -25.079 -1.380 -11.796 1.00 0.00 H new ATOM 346 N PRO A 25 -22.560 -2.878 -11.278 1.00 0.00 N ATOM 347 CA PRO A 25 -21.353 -2.449 -10.551 1.00 0.00 C ATOM 348 C PRO A 25 -21.665 -1.883 -9.166 1.00 0.00 C ATOM 349 O PRO A 25 -22.417 -0.920 -9.018 1.00 0.00 O ATOM 350 CB PRO A 25 -20.734 -1.376 -11.463 1.00 0.00 C ATOM 351 CG PRO A 25 -21.840 -0.977 -12.379 1.00 0.00 C ATOM 352 CD PRO A 25 -22.637 -2.230 -12.596 1.00 0.00 C ATOM 0 HA PRO A 25 -20.683 -3.287 -10.357 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.372 -0.526 -10.885 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.883 -1.770 -12.018 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.453 -0.191 -11.938 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.452 -0.588 -13.320 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.666 -2.014 -12.884 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.210 -2.853 -13.382 1.00 0.00 H new ATOM 360 N CYS A 26 -21.093 -2.526 -8.157 1.00 0.00 N ATOM 361 CA CYS A 26 -21.334 -2.188 -6.760 1.00 0.00 C ATOM 362 C CYS A 26 -20.728 -0.841 -6.325 1.00 0.00 C ATOM 363 O CYS A 26 -19.581 -0.536 -6.645 1.00 0.00 O ATOM 364 CB CYS A 26 -20.794 -3.317 -5.889 1.00 0.00 C ATOM 365 SG CYS A 26 -21.137 -3.127 -4.106 1.00 0.00 S ATOM 0 H CYS A 26 -20.444 -3.302 -8.285 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.411 -2.073 -6.636 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.223 -4.259 -6.230 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.716 -3.387 -6.033 1.00 0.00 H new ATOM 370 N PRO A 27 -21.521 -0.049 -5.563 1.00 0.00 N ATOM 371 CA PRO A 27 -21.172 1.299 -5.064 1.00 0.00 C ATOM 372 C PRO A 27 -19.700 1.523 -4.696 1.00 0.00 C ATOM 373 O PRO A 27 -19.026 2.377 -5.271 1.00 0.00 O ATOM 374 CB PRO A 27 -22.011 1.383 -3.790 1.00 0.00 C ATOM 375 CG PRO A 27 -23.249 0.603 -4.073 1.00 0.00 C ATOM 376 CD PRO A 27 -22.893 -0.409 -5.146 1.00 0.00 C ATOM 0 HA PRO A 27 -21.355 2.045 -5.837 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.472 0.968 -2.938 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.248 2.418 -3.544 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.605 0.103 -3.172 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.051 1.259 -4.411 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.935 -1.427 -4.759 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.588 -0.358 -5.984 1.00 0.00 H new ATOM 384 N ALA A 28 -19.205 0.717 -3.762 1.00 0.00 N ATOM 385 CA ALA A 28 -17.954 1.028 -3.071 1.00 0.00 C ATOM 386 C ALA A 28 -16.925 -0.082 -3.229 1.00 0.00 C ATOM 387 O ALA A 28 -15.772 0.059 -2.825 1.00 0.00 O ATOM 388 CB ALA A 28 -18.223 1.297 -1.598 1.00 0.00 C ATOM 0 H ALA A 28 -19.647 -0.153 -3.466 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.537 1.924 -3.530 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.285 1.527 -1.093 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.904 2.142 -1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.673 0.414 -1.143 1.00 0.00 H new ATOM 394 N CYS A 29 -17.342 -1.192 -3.809 1.00 0.00 N ATOM 395 CA CYS A 29 -16.426 -2.285 -4.072 1.00 0.00 C ATOM 396 C CYS A 29 -16.575 -2.722 -5.523 1.00 0.00 C ATOM 397 O CYS A 29 -17.451 -3.523 -5.855 1.00 0.00 O ATOM 398 CB CYS A 29 -16.673 -3.454 -3.095 1.00 0.00 C ATOM 399 SG CYS A 29 -18.224 -4.368 -3.349 1.00 0.00 S ATOM 0 H CYS A 29 -18.303 -1.360 -4.105 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.401 -1.950 -3.912 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.841 -4.154 -3.175 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.664 -3.063 -2.078 1.00 0.00 H new ATOM 404 N SER A 30 -15.747 -2.149 -6.389 1.00 0.00 N ATOM 405 CA SER A 30 -15.779 -2.419 -7.823 1.00 0.00 C ATOM 406 C SER A 30 -15.341 -3.843 -8.184 1.00 0.00 C ATOM 407 O SER A 30 -14.475 -4.039 -9.033 1.00 0.00 O ATOM 408 CB SER A 30 -14.877 -1.401 -8.518 1.00 0.00 C ATOM 409 OG SER A 30 -13.655 -1.242 -7.807 1.00 0.00 O ATOM 0 H SER A 30 -15.029 -1.479 -6.114 1.00 0.00 H new ATOM 0 HA SER A 30 -16.812 -2.330 -8.159 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.670 -1.727 -9.537 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.390 -0.442 -8.588 1.00 0.00 H new ATOM 0 HG SER A 30 -13.091 -0.587 -8.269 1.00 0.00 H new ATOM 415 N GLY A 31 -15.940 -4.829 -7.541 1.00 0.00 N ATOM 416 CA GLY A 31 -15.697 -6.201 -7.911 1.00 0.00 C ATOM 417 C GLY A 31 -14.597 -6.828 -7.100 1.00 0.00 C ATOM 418 O GLY A 31 -13.710 -7.479 -7.647 1.00 0.00 O ATOM 0 H GLY A 31 -16.592 -4.702 -6.767 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.613 -6.777 -7.782 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.437 -6.249 -8.969 1.00 0.00 H new ATOM 422 N LYS A 32 -14.647 -6.632 -5.793 1.00 0.00 N ATOM 423 CA LYS A 32 -13.668 -7.219 -4.900 1.00 0.00 C ATOM 424 C LYS A 32 -14.370 -8.107 -3.876 1.00 0.00 C ATOM 425 O LYS A 32 -13.852 -9.144 -3.474 1.00 0.00 O ATOM 426 CB LYS A 32 -12.862 -6.120 -4.195 1.00 0.00 C ATOM 427 CG LYS A 32 -11.931 -5.364 -5.132 1.00 0.00 C ATOM 428 CD LYS A 32 -12.507 -4.037 -5.608 1.00 0.00 C ATOM 429 CE LYS A 32 -12.407 -2.949 -4.545 1.00 0.00 C ATOM 430 NZ LYS A 32 -12.365 -1.593 -5.162 1.00 0.00 N ATOM 0 H LYS A 32 -15.359 -6.069 -5.328 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.978 -7.830 -5.482 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.551 -5.414 -3.731 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.275 -6.567 -3.393 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.985 -5.180 -4.623 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.711 -5.989 -5.998 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.979 -3.715 -6.505 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -13.552 -4.176 -5.886 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.260 -3.018 -3.870 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.511 -3.106 -3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.839 -0.912 -4.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.375 -1.305 -5.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.851 -1.615 -6.081 1.00 0.00 H new ATOM 444 N GLY A 33 -15.561 -7.683 -3.453 1.00 0.00 N ATOM 445 CA GLY A 33 -16.329 -8.437 -2.501 1.00 0.00 C ATOM 446 C GLY A 33 -16.388 -7.715 -1.179 1.00 0.00 C ATOM 447 O GLY A 33 -17.437 -7.645 -0.540 1.00 0.00 O ATOM 0 H GLY A 33 -16.003 -6.818 -3.764 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.338 -8.594 -2.882 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.883 -9.422 -2.364 1.00 0.00 H new ATOM 451 N VAL A 34 -15.275 -7.109 -0.806 1.00 0.00 N ATOM 452 CA VAL A 34 -15.175 -6.405 0.459 1.00 0.00 C ATOM 453 C VAL A 34 -15.038 -4.901 0.245 1.00 0.00 C ATOM 454 O VAL A 34 -14.725 -4.442 -0.858 1.00 0.00 O ATOM 455 CB VAL A 34 -13.965 -6.912 1.276 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.156 -8.367 1.684 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.678 -6.753 0.484 1.00 0.00 C ATOM 0 H VAL A 34 -14.423 -7.091 -1.366 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.094 -6.603 1.011 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.894 -6.308 2.180 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.291 -8.701 2.258 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.054 -8.459 2.295 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.259 -8.984 0.792 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.839 -7.116 1.077 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.745 -7.328 -0.439 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.525 -5.700 0.245 1.00 0.00 H new ATOM 467 N ILE A 35 -15.317 -4.149 1.297 1.00 0.00 N ATOM 468 CA ILE A 35 -15.121 -2.708 1.301 1.00 0.00 C ATOM 469 C ILE A 35 -14.220 -2.312 2.463 1.00 0.00 C ATOM 470 O ILE A 35 -14.043 -3.076 3.406 1.00 0.00 O ATOM 471 CB ILE A 35 -16.459 -1.942 1.415 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.299 -2.501 2.567 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.226 -2.005 0.105 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.597 -1.756 2.800 1.00 0.00 C ATOM 0 H ILE A 35 -15.686 -4.520 2.173 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.656 -2.440 0.352 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.241 -0.896 1.628 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.524 -3.548 2.364 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.707 -2.474 3.482 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.164 -1.460 0.206 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.629 -1.555 -0.688 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.436 -3.045 -0.144 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.134 -2.212 3.632 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.381 -0.714 3.035 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.211 -1.805 1.901 1.00 0.00 H new ATOM 486 N LEU A 36 -13.656 -1.119 2.389 1.00 0.00 N ATOM 487 CA LEU A 36 -12.654 -0.691 3.356 1.00 0.00 C ATOM 488 C LEU A 36 -13.265 0.009 4.562 1.00 0.00 C ATOM 489 O LEU A 36 -14.418 0.446 4.541 1.00 0.00 O ATOM 490 CB LEU A 36 -11.638 0.237 2.690 1.00 0.00 C ATOM 491 CG LEU A 36 -10.965 -0.339 1.446 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.724 0.045 0.184 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.524 0.115 1.372 1.00 0.00 C ATOM 0 H LEU A 36 -13.873 -0.428 1.671 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.159 -1.593 3.715 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.139 1.166 2.418 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.868 0.492 3.418 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.980 -1.426 1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.222 -0.379 -0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.742 -0.341 0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.753 1.131 0.093 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.056 -0.303 0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.487 1.203 1.325 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.989 -0.228 2.257 1.00 0.00 H new ATOM 505 N THR A 37 -12.453 0.124 5.603 1.00 0.00 N ATOM 506 CA THR A 37 -12.821 0.837 6.814 1.00 0.00 C ATOM 507 C THR A 37 -12.088 2.172 6.829 1.00 0.00 C ATOM 508 O THR A 37 -11.364 2.468 5.888 1.00 0.00 O ATOM 509 CB THR A 37 -12.422 0.026 8.066 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.000 -0.173 8.082 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.112 -1.329 8.086 1.00 0.00 C ATOM 0 H THR A 37 -11.516 -0.277 5.630 1.00 0.00 H new ATOM 0 HA THR A 37 -13.900 0.989 6.828 1.00 0.00 H new ATOM 0 HB THR A 37 -12.733 0.590 8.945 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.772 -0.848 8.755 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.812 -1.877 8.979 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.193 -1.187 8.094 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.827 -1.896 7.200 1.00 0.00 H new ATOM 519 N ALA A 38 -12.253 2.976 7.871 1.00 0.00 N ATOM 520 CA ALA A 38 -11.559 4.261 7.936 1.00 0.00 C ATOM 521 C ALA A 38 -10.047 4.060 7.922 1.00 0.00 C ATOM 522 O ALA A 38 -9.323 4.770 7.217 1.00 0.00 O ATOM 523 CB ALA A 38 -11.992 5.048 9.159 1.00 0.00 C ATOM 0 H ALA A 38 -12.850 2.769 8.672 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.830 4.839 7.053 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.462 6.000 9.185 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.065 5.231 9.112 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.760 4.479 10.059 1.00 0.00 H new ATOM 529 N GLN A 39 -9.574 3.085 8.689 1.00 0.00 N ATOM 530 CA GLN A 39 -8.168 2.712 8.662 1.00 0.00 C ATOM 531 C GLN A 39 -7.763 2.241 7.268 1.00 0.00 C ATOM 532 O GLN A 39 -6.719 2.638 6.750 1.00 0.00 O ATOM 533 CB GLN A 39 -7.867 1.622 9.694 1.00 0.00 C ATOM 534 CG GLN A 39 -6.469 1.043 9.551 1.00 0.00 C ATOM 535 CD GLN A 39 -6.069 0.142 10.698 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.907 -0.492 11.338 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.774 0.076 10.952 1.00 0.00 N ATOM 0 H GLN A 39 -10.144 2.540 9.336 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.584 3.596 8.917 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.983 2.035 10.696 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.599 0.821 9.593 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.411 0.480 8.620 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.752 1.860 9.474 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.116 0.621 10.394 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.432 -0.519 11.706 1.00 0.00 H new ATOM 546 N GLY A 40 -8.605 1.417 6.652 1.00 0.00 N ATOM 547 CA GLY A 40 -8.312 0.923 5.322 1.00 0.00 C ATOM 548 C GLY A 40 -8.353 2.031 4.293 1.00 0.00 C ATOM 549 O GLY A 40 -7.607 2.020 3.320 1.00 0.00 O ATOM 0 H GLY A 40 -9.483 1.084 7.050 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.327 0.457 5.316 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.032 0.150 5.054 1.00 0.00 H new ATOM 553 N TYR A 41 -9.213 3.007 4.529 1.00 0.00 N ATOM 554 CA TYR A 41 -9.330 4.158 3.655 1.00 0.00 C ATOM 555 C TYR A 41 -8.113 5.057 3.765 1.00 0.00 C ATOM 556 O TYR A 41 -7.704 5.672 2.780 1.00 0.00 O ATOM 557 CB TYR A 41 -10.593 4.945 4.009 1.00 0.00 C ATOM 558 CG TYR A 41 -11.773 4.650 3.110 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.642 3.602 3.383 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.014 5.424 1.984 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.717 3.334 2.558 1.00 0.00 C ATOM 562 CE2 TYR A 41 -13.087 5.163 1.156 1.00 0.00 C ATOM 563 CZ TYR A 41 -13.934 4.118 1.445 1.00 0.00 C ATOM 564 OH TYR A 41 -15.000 3.856 0.616 1.00 0.00 O ATOM 0 H TYR A 41 -9.846 3.023 5.328 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.395 3.803 2.627 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.870 4.723 5.040 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.370 6.011 3.961 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -12.475 2.986 4.254 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -11.351 6.244 1.752 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -14.384 2.515 2.784 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -13.261 5.777 0.285 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.009 4.503 -0.120 1.00 0.00 H new ATOM 574 N THR A 42 -7.512 5.107 4.941 1.00 0.00 N ATOM 575 CA THR A 42 -6.286 5.863 5.127 1.00 0.00 C ATOM 576 C THR A 42 -5.135 5.172 4.406 1.00 0.00 C ATOM 577 O THR A 42 -4.216 5.818 3.903 1.00 0.00 O ATOM 578 CB THR A 42 -5.943 5.989 6.621 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.086 6.465 7.341 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.769 6.935 6.840 1.00 0.00 C ATOM 0 H THR A 42 -7.852 4.635 5.779 1.00 0.00 H new ATOM 0 HA THR A 42 -6.436 6.860 4.713 1.00 0.00 H new ATOM 0 HB THR A 42 -5.660 5.003 6.989 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.763 5.758 7.384 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.551 7.003 7.906 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.893 6.556 6.314 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.022 7.924 6.458 1.00 0.00 H new ATOM 588 N LEU A 43 -5.222 3.852 4.314 1.00 0.00 N ATOM 589 CA LEU A 43 -4.176 3.077 3.677 1.00 0.00 C ATOM 590 C LEU A 43 -4.412 2.996 2.178 1.00 0.00 C ATOM 591 O LEU A 43 -3.468 2.838 1.414 1.00 0.00 O ATOM 592 CB LEU A 43 -4.090 1.658 4.260 1.00 0.00 C ATOM 593 CG LEU A 43 -3.039 1.429 5.358 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.317 2.300 6.572 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.013 -0.037 5.762 1.00 0.00 C ATOM 0 H LEU A 43 -6.003 3.302 4.671 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.231 3.586 3.870 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.068 1.396 4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.886 0.966 3.443 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.064 1.706 4.956 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.558 2.117 7.333 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.292 3.350 6.280 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.300 2.059 6.975 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.265 -0.187 6.540 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.993 -0.328 6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.763 -0.649 4.895 1.00 0.00 H new ATOM 607 N LEU A 44 -5.660 3.138 1.734 1.00 0.00 N ATOM 608 CA LEU A 44 -5.960 3.000 0.322 1.00 0.00 C ATOM 609 C LEU A 44 -5.577 4.278 -0.407 1.00 0.00 C ATOM 610 O LEU A 44 -5.001 4.238 -1.489 1.00 0.00 O ATOM 611 CB LEU A 44 -7.455 2.639 0.112 1.00 0.00 C ATOM 612 CG LEU A 44 -8.457 3.794 -0.111 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.374 4.345 -1.532 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.880 3.328 0.148 1.00 0.00 C ATOM 0 H LEU A 44 -6.464 3.345 2.326 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.373 2.182 -0.096 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.519 1.971 -0.747 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.787 2.073 0.982 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.191 4.584 0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.093 5.155 -1.651 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.368 4.722 -1.718 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.601 3.551 -2.244 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.569 4.156 -0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.125 2.513 -0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.967 2.980 1.177 1.00 0.00 H new ATOM 626 N ASP A 45 -5.882 5.413 0.202 1.00 0.00 N ATOM 627 CA ASP A 45 -5.590 6.701 -0.406 1.00 0.00 C ATOM 628 C ASP A 45 -4.094 6.968 -0.386 1.00 0.00 C ATOM 629 O ASP A 45 -3.566 7.728 -1.202 1.00 0.00 O ATOM 630 CB ASP A 45 -6.337 7.807 0.334 1.00 0.00 C ATOM 631 CG ASP A 45 -6.171 9.157 -0.322 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.915 9.442 -1.284 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.301 9.935 0.116 1.00 0.00 O ATOM 0 H ASP A 45 -6.331 5.468 1.116 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.923 6.685 -1.444 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.397 7.557 0.380 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.977 7.859 1.362 1.00 0.00 H new ATOM 638 N PHE A 46 -3.410 6.305 0.529 1.00 0.00 N ATOM 639 CA PHE A 46 -1.964 6.371 0.599 1.00 0.00 C ATOM 640 C PHE A 46 -1.339 5.552 -0.513 1.00 0.00 C ATOM 641 O PHE A 46 -0.372 5.980 -1.140 1.00 0.00 O ATOM 642 CB PHE A 46 -1.525 5.805 1.949 1.00 0.00 C ATOM 643 CG PHE A 46 -0.058 5.910 2.244 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.822 4.930 1.814 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.437 6.979 2.973 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.167 5.016 2.102 1.00 0.00 C ATOM 647 CE2 PHE A 46 1.783 7.070 3.262 1.00 0.00 C ATOM 648 CZ PHE A 46 2.647 6.087 2.826 1.00 0.00 C ATOM 0 H PHE A 46 -3.838 5.711 1.239 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.641 7.406 0.489 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.075 6.321 2.736 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.813 4.755 1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.450 4.090 1.247 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.237 7.749 3.318 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.844 4.246 1.761 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.159 7.909 3.828 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.701 6.156 3.052 1.00 0.00 H new ATOM 658 N ILE A 47 -1.901 4.392 -0.793 1.00 0.00 N ATOM 659 CA ILE A 47 -1.323 3.556 -1.818 1.00 0.00 C ATOM 660 C ILE A 47 -1.708 4.076 -3.195 1.00 0.00 C ATOM 661 O ILE A 47 -0.909 4.024 -4.129 1.00 0.00 O ATOM 662 CB ILE A 47 -1.720 2.071 -1.674 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.217 1.872 -1.929 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.348 1.581 -0.286 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.680 0.438 -1.799 1.00 0.00 C ATOM 0 H ILE A 47 -2.734 4.018 -0.338 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.241 3.605 -1.697 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.178 1.490 -2.420 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.779 2.489 -1.228 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.455 2.230 -2.931 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.628 0.533 -0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.273 1.686 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.876 2.172 0.462 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.751 0.382 -1.995 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.147 -0.183 -2.519 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.476 0.080 -0.790 1.00 0.00 H new ATOM 677 N GLN A 48 -2.919 4.618 -3.291 1.00 0.00 N ATOM 678 CA GLN A 48 -3.356 5.334 -4.476 1.00 0.00 C ATOM 679 C GLN A 48 -2.313 6.373 -4.862 1.00 0.00 C ATOM 680 O GLN A 48 -1.598 6.219 -5.834 1.00 0.00 O ATOM 681 CB GLN A 48 -4.684 6.049 -4.202 1.00 0.00 C ATOM 682 CG GLN A 48 -5.918 5.158 -4.219 1.00 0.00 C ATOM 683 CD GLN A 48 -6.413 4.871 -5.623 1.00 0.00 C ATOM 684 OE1 GLN A 48 -6.216 5.670 -6.536 1.00 0.00 O ATOM 685 NE2 GLN A 48 -7.082 3.743 -5.800 1.00 0.00 N ATOM 0 H GLN A 48 -3.619 4.571 -2.551 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.487 4.617 -5.286 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.621 6.536 -3.229 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.814 6.836 -4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.688 4.217 -3.720 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.714 5.636 -3.648 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.224 3.106 -5.016 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.455 3.511 -6.720 1.00 0.00 H new ATOM 694 N LYS A 49 -2.141 7.340 -3.988 1.00 0.00 N ATOM 695 CA LYS A 49 -1.478 8.600 -4.309 1.00 0.00 C ATOM 696 C LYS A 49 0.053 8.475 -4.370 1.00 0.00 C ATOM 697 O LYS A 49 0.753 9.453 -4.631 1.00 0.00 O ATOM 698 CB LYS A 49 -1.929 9.620 -3.251 1.00 0.00 C ATOM 699 CG LYS A 49 -1.295 10.996 -3.346 1.00 0.00 C ATOM 700 CD LYS A 49 -1.285 11.719 -1.998 1.00 0.00 C ATOM 701 CE LYS A 49 -2.643 11.695 -1.300 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.777 10.548 -0.357 1.00 0.00 N ATOM 0 H LYS A 49 -2.459 7.280 -3.021 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.764 8.924 -5.310 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.011 9.734 -3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.715 9.210 -2.264 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.273 10.899 -3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.840 11.596 -4.075 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.541 11.257 -1.349 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.978 12.754 -2.149 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.785 12.628 -0.755 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.433 11.640 -2.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.680 10.622 0.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.753 9.655 -0.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.991 10.565 0.324 1.00 0.00 H new ATOM 716 N HIS A 50 0.599 7.285 -4.128 1.00 0.00 N ATOM 717 CA HIS A 50 2.020 7.113 -4.438 1.00 0.00 C ATOM 718 C HIS A 50 2.284 6.089 -5.543 1.00 0.00 C ATOM 719 O HIS A 50 3.427 5.950 -5.973 1.00 0.00 O ATOM 720 CB HIS A 50 2.786 6.708 -3.174 1.00 0.00 C ATOM 721 CG HIS A 50 2.535 7.625 -2.018 1.00 0.00 C ATOM 722 ND1 HIS A 50 1.951 7.211 -0.845 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.756 8.950 -1.877 1.00 0.00 C ATOM 724 CE1 HIS A 50 1.823 8.239 -0.035 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.300 9.311 -0.633 1.00 0.00 N ATOM 0 H HIS A 50 0.118 6.472 -3.743 1.00 0.00 H new ATOM 0 HA HIS A 50 2.371 8.076 -4.808 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.503 5.693 -2.894 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.854 6.692 -3.393 1.00 0.00 H new ATOM 0 HD1 HIS A 50 1.662 6.256 -0.635 1.00 0.00 H new ATOM 0 HD2 HIS A 50 3.208 9.605 -2.608 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.397 8.209 0.957 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.326 10.251 -0.239 1.00 0.00 H new ATOM 734 N LEU A 51 1.254 5.394 -6.027 1.00 0.00 N ATOM 735 CA LEU A 51 1.447 4.450 -7.139 1.00 0.00 C ATOM 736 C LEU A 51 0.464 4.705 -8.285 1.00 0.00 C ATOM 737 O LEU A 51 0.864 4.781 -9.448 1.00 0.00 O ATOM 738 CB LEU A 51 1.323 2.982 -6.690 1.00 0.00 C ATOM 739 CG LEU A 51 2.404 2.465 -5.726 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.444 0.943 -5.723 1.00 0.00 C ATOM 741 CD2 LEU A 51 3.769 3.008 -6.090 1.00 0.00 C ATOM 0 H LEU A 51 0.297 5.460 -5.680 1.00 0.00 H new ATOM 0 HA LEU A 51 2.463 4.623 -7.495 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.351 2.852 -6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.329 2.352 -7.579 1.00 0.00 H new ATOM 0 HG LEU A 51 2.144 2.817 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.216 0.601 -5.034 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.476 0.554 -5.406 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.668 0.583 -6.727 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.512 2.625 -5.390 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.027 2.694 -7.101 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.752 4.097 -6.041 1.00 0.00 H new ATOM 753 N ASN A 52 -0.811 4.853 -7.954 1.00 0.00 N ATOM 754 CA ASN A 52 -1.871 4.947 -8.962 1.00 0.00 C ATOM 755 C ASN A 52 -2.400 6.373 -9.105 1.00 0.00 C ATOM 756 O ASN A 52 -2.945 6.745 -10.145 1.00 0.00 O ATOM 757 CB ASN A 52 -3.017 3.997 -8.597 1.00 0.00 C ATOM 758 CG ASN A 52 -2.849 2.618 -9.209 1.00 0.00 C ATOM 759 OD1 ASN A 52 -1.731 2.137 -9.388 1.00 0.00 O ATOM 760 ND2 ASN A 52 -3.959 1.977 -9.544 1.00 0.00 N ATOM 0 H ASN A 52 -1.143 4.911 -6.991 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.443 4.659 -9.922 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -3.076 3.904 -7.513 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.961 4.427 -8.932 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -3.905 1.050 -9.967 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -4.868 2.410 -9.379 1.00 0.00 H new ATOM 767 N LYS A 53 -2.233 7.164 -8.066 1.00 0.00 N ATOM 768 CA LYS A 53 -2.652 8.550 -8.064 1.00 0.00 C ATOM 769 C LYS A 53 -1.433 9.464 -8.102 1.00 0.00 C ATOM 770 O LYS A 53 -1.156 10.130 -7.087 1.00 0.00 O ATOM 771 CB LYS A 53 -3.449 8.848 -6.799 1.00 0.00 C ATOM 772 CG LYS A 53 -4.937 8.997 -7.007 1.00 0.00 C ATOM 773 CD LYS A 53 -5.523 9.864 -5.905 1.00 0.00 C ATOM 774 CE LYS A 53 -6.123 9.059 -4.776 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.862 9.939 -3.835 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.748 9.497 -9.147 1.00 0.00 O ATOM 0 H LYS A 53 -1.800 6.862 -7.193 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.272 8.727 -8.943 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.275 8.047 -6.080 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -3.065 9.765 -6.353 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.135 9.446 -7.980 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.414 8.017 -7.005 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.743 10.512 -5.507 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.290 10.512 -6.329 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -6.797 8.304 -5.180 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.334 8.529 -4.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.769 9.569 -2.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.468 10.901 -3.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.867 9.964 -4.100 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 9.338 7.031 13.648 1.00 0.00 N HETATM 792 CN FME B 1 8.194 7.633 13.928 1.00 0.00 C HETATM 793 O1 FME B 1 8.141 8.655 14.610 1.00 0.00 O HETATM 794 CA FME B 1 9.368 5.815 12.852 1.00 0.00 C HETATM 795 CB FME B 1 10.689 5.715 12.085 1.00 0.00 C HETATM 796 CG FME B 1 10.690 4.651 10.998 1.00 0.00 C HETATM 797 SD FME B 1 12.188 4.695 9.995 1.00 0.00 S HETATM 798 CE FME B 1 11.776 3.514 8.712 1.00 0.00 C HETATM 799 C FME B 1 9.184 4.603 13.756 1.00 0.00 C HETATM 800 O FME B 1 10.115 4.171 14.433 1.00 0.00 O HETATM 0 HG3 FME B 1 10.592 3.667 11.456 1.00 0.00 H new HETATM 0 HG2 FME B 1 9.821 4.791 10.355 1.00 0.00 H new HETATM 0 HE3 FME B 1 12.676 2.982 8.405 1.00 0.00 H new HETATM 0 HE2 FME B 1 11.046 2.801 9.095 1.00 0.00 H new HETATM 0 HE1 FME B 1 11.355 4.040 7.855 1.00 0.00 H new HETATM 0 HCN FME B 1 7.267 7.209 13.541 1.00 0.00 H new HETATM 0 HB3 FME B 1 10.910 6.682 11.634 1.00 0.00 H new HETATM 0 HB2 FME B 1 11.492 5.501 12.790 1.00 0.00 H new HETATM 0 HA FME B 1 8.553 5.843 12.129 1.00 0.00 H new HETATM 0 H FME B 1 10.212 7.426 13.996 1.00 0.00 H new ATOM 811 N VAL B 2 7.971 4.068 13.774 1.00 0.00 N ATOM 812 CA VAL B 2 7.654 2.937 14.633 1.00 0.00 C ATOM 813 C VAL B 2 7.555 1.656 13.808 1.00 0.00 C ATOM 814 O VAL B 2 7.615 0.547 14.338 1.00 0.00 O ATOM 815 CB VAL B 2 6.334 3.179 15.407 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.145 3.259 14.459 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.113 2.106 16.464 1.00 0.00 C ATOM 0 H VAL B 2 7.192 4.399 13.204 1.00 0.00 H new ATOM 0 HA VAL B 2 8.459 2.828 15.360 1.00 0.00 H new ATOM 0 HB VAL B 2 6.422 4.139 15.915 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.234 3.429 15.032 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.292 4.081 13.759 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.057 2.324 13.906 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.179 2.302 16.991 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.061 1.128 15.985 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.940 2.119 17.174 1.00 0.00 H new ATOM 827 N ILE B 3 7.428 1.821 12.500 1.00 0.00 N ATOM 828 CA ILE B 3 7.370 0.685 11.600 1.00 0.00 C ATOM 829 C ILE B 3 8.626 0.640 10.740 1.00 0.00 C ATOM 830 O ILE B 3 9.060 1.658 10.200 1.00 0.00 O ATOM 831 CB ILE B 3 6.105 0.711 10.703 1.00 0.00 C ATOM 832 CG1 ILE B 3 5.990 -0.596 9.912 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.123 1.910 9.760 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.710 -0.716 9.113 1.00 0.00 C ATOM 0 H ILE B 3 7.363 2.730 12.041 1.00 0.00 H new ATOM 0 HA ILE B 3 7.313 -0.216 12.211 1.00 0.00 H new ATOM 0 HB ILE B 3 5.232 0.808 11.348 1.00 0.00 H new ATOM 0 HG12 ILE B 3 6.840 -0.675 9.234 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.055 -1.436 10.604 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.224 1.902 9.144 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.155 2.831 10.343 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.003 1.855 9.119 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.701 -1.667 8.580 1.00 0.00 H new ATOM 0 HD12 ILE B 3 3.855 -0.670 9.787 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.651 0.102 8.395 1.00 0.00 H new ATOM 846 N ALA B 4 9.234 -0.529 10.666 1.00 0.00 N ATOM 847 CA ALA B 4 10.406 -0.726 9.837 1.00 0.00 C ATOM 848 C ALA B 4 10.158 -1.845 8.842 1.00 0.00 C ATOM 849 O ALA B 4 9.382 -2.766 9.104 1.00 0.00 O ATOM 850 CB ALA B 4 11.611 -1.038 10.704 1.00 0.00 C ATOM 0 H ALA B 4 8.933 -1.361 11.174 1.00 0.00 H new ATOM 0 HA ALA B 4 10.608 0.191 9.283 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.486 -1.184 10.071 1.00 0.00 H new ATOM 0 HB2 ALA B 4 11.792 -0.209 11.388 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.422 -1.946 11.277 1.00 0.00 H new ATOM 856 N THR B 5 10.835 -1.761 7.705 1.00 0.00 N ATOM 857 CA THR B 5 10.643 -2.699 6.610 1.00 0.00 C ATOM 858 C THR B 5 11.090 -4.108 7.002 1.00 0.00 C ATOM 859 O THR B 5 10.728 -5.083 6.354 1.00 0.00 O ATOM 860 CB THR B 5 11.428 -2.235 5.366 1.00 0.00 C ATOM 861 OG1 THR B 5 11.299 -0.812 5.218 1.00 0.00 O ATOM 862 CG2 THR B 5 10.914 -2.914 4.105 1.00 0.00 C ATOM 0 H THR B 5 11.532 -1.041 7.517 1.00 0.00 H new ATOM 0 HA THR B 5 9.578 -2.727 6.379 1.00 0.00 H new ATOM 0 HB THR B 5 12.474 -2.507 5.506 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.800 -0.519 4.428 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.487 -2.567 3.245 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.025 -3.994 4.202 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.862 -2.669 3.963 1.00 0.00 H new ATOM 870 N ASP B 6 11.826 -4.207 8.105 1.00 0.00 N ATOM 871 CA ASP B 6 12.408 -5.477 8.535 1.00 0.00 C ATOM 872 C ASP B 6 11.386 -6.345 9.258 1.00 0.00 C ATOM 873 O ASP B 6 11.661 -7.504 9.566 1.00 0.00 O ATOM 874 CB ASP B 6 13.596 -5.238 9.472 1.00 0.00 C ATOM 875 CG ASP B 6 14.719 -4.454 8.829 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.707 -3.208 8.923 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.631 -5.075 8.245 1.00 0.00 O ATOM 0 H ASP B 6 12.035 -3.421 8.720 1.00 0.00 H new ATOM 0 HA ASP B 6 12.741 -5.994 7.635 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.250 -4.704 10.357 1.00 0.00 H new ATOM 0 HB3 ASP B 6 13.981 -6.200 9.811 1.00 0.00 H new ATOM 882 N ASP B 7 10.213 -5.794 9.539 1.00 0.00 N ATOM 883 CA ASP B 7 9.170 -6.560 10.215 1.00 0.00 C ATOM 884 C ASP B 7 8.089 -7.004 9.239 1.00 0.00 C ATOM 885 O ASP B 7 7.249 -7.844 9.567 1.00 0.00 O ATOM 886 CB ASP B 7 8.528 -5.731 11.335 1.00 0.00 C ATOM 887 CG ASP B 7 9.481 -5.434 12.475 1.00 0.00 C ATOM 888 OD1 ASP B 7 9.575 -6.260 13.406 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.135 -4.369 12.450 1.00 0.00 O ATOM 0 H ASP B 7 9.960 -4.832 9.314 1.00 0.00 H new ATOM 0 HA ASP B 7 9.643 -7.444 10.642 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.163 -4.791 10.920 1.00 0.00 H new ATOM 0 HB3 ASP B 7 7.661 -6.266 11.724 1.00 0.00 H new ATOM 894 N LEU B 8 8.113 -6.452 8.036 1.00 0.00 N ATOM 895 CA LEU B 8 7.108 -6.787 7.036 1.00 0.00 C ATOM 896 C LEU B 8 7.749 -7.424 5.816 1.00 0.00 C ATOM 897 O LEU B 8 7.094 -8.148 5.062 1.00 0.00 O ATOM 898 CB LEU B 8 6.303 -5.552 6.632 1.00 0.00 C ATOM 899 CG LEU B 8 5.409 -4.979 7.732 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.206 -4.118 8.700 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.269 -4.185 7.123 1.00 0.00 C ATOM 0 H LEU B 8 8.811 -5.775 7.729 1.00 0.00 H new ATOM 0 HA LEU B 8 6.424 -7.509 7.482 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.995 -4.776 6.305 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.681 -5.806 5.774 1.00 0.00 H new ATOM 0 HG LEU B 8 4.992 -5.813 8.297 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.542 -3.726 9.470 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.985 -4.721 9.166 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.663 -3.290 8.159 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.640 -3.783 7.918 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.673 -3.365 6.530 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.673 -4.836 6.483 1.00 0.00 H new ATOM 913 N GLU B 9 9.031 -7.157 5.638 1.00 0.00 N ATOM 914 CA GLU B 9 9.807 -7.776 4.585 1.00 0.00 C ATOM 915 C GLU B 9 11.096 -8.325 5.173 1.00 0.00 C ATOM 916 O GLU B 9 11.809 -7.639 5.907 1.00 0.00 O ATOM 917 CB GLU B 9 10.102 -6.799 3.438 1.00 0.00 C ATOM 918 CG GLU B 9 8.862 -6.405 2.647 1.00 0.00 C ATOM 919 CD GLU B 9 9.180 -5.693 1.345 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.388 -4.462 1.362 1.00 0.00 O ATOM 921 OE2 GLU B 9 9.190 -6.362 0.288 1.00 0.00 O ATOM 0 H GLU B 9 9.560 -6.506 6.219 1.00 0.00 H new ATOM 0 HA GLU B 9 9.222 -8.591 4.159 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.565 -5.900 3.846 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.827 -7.252 2.762 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.279 -7.300 2.430 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.237 -5.758 3.263 1.00 0.00 H new ATOM 928 N VAL B 10 11.377 -9.567 4.858 1.00 0.00 N ATOM 929 CA VAL B 10 12.530 -10.255 5.391 1.00 0.00 C ATOM 930 C VAL B 10 13.349 -10.800 4.236 1.00 0.00 C ATOM 931 O VAL B 10 12.798 -11.268 3.238 1.00 0.00 O ATOM 932 CB VAL B 10 12.111 -11.396 6.357 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.203 -12.403 5.665 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.333 -12.087 6.949 1.00 0.00 C ATOM 0 H VAL B 10 10.812 -10.131 4.223 1.00 0.00 H new ATOM 0 HA VAL B 10 13.131 -9.552 5.969 1.00 0.00 H new ATOM 0 HB VAL B 10 11.547 -10.945 7.173 1.00 0.00 H new ATOM 0 HG11 VAL B 10 10.928 -13.189 6.369 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.303 -11.899 5.313 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.727 -12.843 4.817 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.011 -12.882 7.622 1.00 0.00 H new ATOM 0 HG22 VAL B 10 13.935 -12.513 6.146 1.00 0.00 H new ATOM 0 HG23 VAL B 10 13.928 -11.361 7.503 1.00 0.00 H new ATOM 944 N ALA B 11 14.660 -10.710 4.353 1.00 0.00 N ATOM 945 CA ALA B 11 15.544 -11.141 3.289 1.00 0.00 C ATOM 946 C ALA B 11 15.412 -12.638 3.049 1.00 0.00 C ATOM 947 O ALA B 11 15.413 -13.437 3.989 1.00 0.00 O ATOM 948 CB ALA B 11 16.972 -10.760 3.647 1.00 0.00 C ATOM 0 H ALA B 11 15.136 -10.341 5.176 1.00 0.00 H new ATOM 0 HA ALA B 11 15.267 -10.643 2.360 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.644 -11.081 2.851 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.041 -9.679 3.767 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.255 -11.247 4.580 1.00 0.00 H new ATOM 954 N CYS B 12 15.278 -12.994 1.768 1.00 0.00 N ATOM 955 CA CYS B 12 14.928 -14.337 1.334 1.00 0.00 C ATOM 956 C CYS B 12 15.965 -15.389 1.760 1.00 0.00 C ATOM 957 O CYS B 12 17.069 -15.038 2.166 1.00 0.00 O ATOM 958 CB CYS B 12 14.810 -14.318 -0.193 1.00 0.00 C ATOM 959 SG CYS B 12 13.463 -15.316 -0.850 1.00 0.00 S ATOM 0 H CYS B 12 15.413 -12.342 0.996 1.00 0.00 H new ATOM 0 HA CYS B 12 13.987 -14.619 1.807 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.676 -13.287 -0.522 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.748 -14.670 -0.622 1.00 0.00 H new ATOM 964 N PRO B 13 15.626 -16.696 1.674 1.00 0.00 N ATOM 965 CA PRO B 13 16.571 -17.789 1.952 1.00 0.00 C ATOM 966 C PRO B 13 17.941 -17.620 1.283 1.00 0.00 C ATOM 967 O PRO B 13 18.969 -17.981 1.854 1.00 0.00 O ATOM 968 CB PRO B 13 15.857 -18.993 1.338 1.00 0.00 C ATOM 969 CG PRO B 13 14.412 -18.714 1.526 1.00 0.00 C ATOM 970 CD PRO B 13 14.273 -17.219 1.369 1.00 0.00 C ATOM 0 HA PRO B 13 16.795 -17.857 3.017 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.104 -19.103 0.282 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.148 -19.920 1.832 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.809 -19.245 0.789 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.073 -19.040 2.509 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.960 -16.952 0.360 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.526 -16.814 2.052 1.00 0.00 H new ATOM 978 N LYS B 14 17.947 -17.054 0.074 1.00 0.00 N ATOM 979 CA LYS B 14 19.138 -17.105 -0.774 1.00 0.00 C ATOM 980 C LYS B 14 19.302 -15.887 -1.689 1.00 0.00 C ATOM 981 O LYS B 14 20.424 -15.521 -2.029 1.00 0.00 O ATOM 982 CB LYS B 14 19.095 -18.385 -1.626 1.00 0.00 C ATOM 983 CG LYS B 14 20.101 -18.406 -2.770 1.00 0.00 C ATOM 984 CD LYS B 14 19.948 -19.658 -3.621 1.00 0.00 C ATOM 985 CE LYS B 14 20.705 -19.538 -4.939 1.00 0.00 C ATOM 986 NZ LYS B 14 22.154 -19.266 -4.742 1.00 0.00 N ATOM 0 H LYS B 14 17.152 -16.562 -0.335 1.00 0.00 H new ATOM 0 HA LYS B 14 19.999 -17.102 -0.105 1.00 0.00 H new ATOM 0 HB2 LYS B 14 19.277 -19.244 -0.981 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.092 -18.502 -2.036 1.00 0.00 H new ATOM 0 HG2 LYS B 14 19.964 -17.522 -3.393 1.00 0.00 H new ATOM 0 HG3 LYS B 14 21.113 -18.359 -2.368 1.00 0.00 H new ATOM 0 HD2 LYS B 14 20.316 -20.522 -3.067 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.891 -19.835 -3.823 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.586 -20.460 -5.508 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.266 -18.737 -5.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.646 -19.328 -5.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 22.277 -18.312 -4.346 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.553 -19.968 -4.086 1.00 0.00 H new ATOM 1000 N CYS B 15 18.214 -15.249 -2.110 1.00 0.00 N ATOM 1001 CA CYS B 15 18.332 -14.265 -3.187 1.00 0.00 C ATOM 1002 C CYS B 15 17.992 -12.841 -2.780 1.00 0.00 C ATOM 1003 O CYS B 15 17.385 -12.099 -3.554 1.00 0.00 O ATOM 1004 CB CYS B 15 17.344 -14.672 -4.262 1.00 0.00 C ATOM 1005 SG CYS B 15 15.673 -14.969 -3.620 1.00 0.00 S ATOM 0 H CYS B 15 17.273 -15.385 -1.740 1.00 0.00 H new ATOM 0 HA CYS B 15 19.374 -14.261 -3.508 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.301 -13.891 -5.022 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.704 -15.576 -4.754 1.00 0.00 H new ATOM 1010 N GLU B 16 18.478 -12.431 -1.637 1.00 0.00 N ATOM 1011 CA GLU B 16 18.212 -11.103 -1.118 1.00 0.00 C ATOM 1012 C GLU B 16 19.291 -10.163 -1.604 1.00 0.00 C ATOM 1013 O GLU B 16 19.617 -9.171 -0.955 1.00 0.00 O ATOM 1014 CB GLU B 16 18.234 -11.131 0.414 1.00 0.00 C ATOM 1015 CG GLU B 16 18.336 -12.520 1.024 1.00 0.00 C ATOM 1016 CD GLU B 16 19.767 -13.028 1.050 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.256 -13.478 -0.002 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.414 -12.955 2.114 1.00 0.00 O ATOM 0 H GLU B 16 19.070 -13.004 -1.035 1.00 0.00 H new ATOM 0 HA GLU B 16 17.233 -10.768 -1.462 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.076 -10.534 0.762 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.328 -10.652 0.785 1.00 0.00 H new ATOM 0 HG2 GLU B 16 17.940 -12.500 2.039 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.716 -13.212 0.454 1.00 0.00 H new ATOM 1025 N ARG B 17 19.837 -10.486 -2.763 1.00 0.00 N ATOM 1026 CA ARG B 17 21.067 -9.901 -3.222 1.00 0.00 C ATOM 1027 C ARG B 17 21.017 -9.838 -4.750 1.00 0.00 C ATOM 1028 O ARG B 17 21.690 -9.025 -5.381 1.00 0.00 O ATOM 1029 CB ARG B 17 22.256 -10.737 -2.740 1.00 0.00 C ATOM 1030 CG ARG B 17 22.236 -12.176 -3.240 1.00 0.00 C ATOM 1031 CD ARG B 17 23.187 -13.060 -2.447 1.00 0.00 C ATOM 1032 NE ARG B 17 22.729 -13.258 -1.071 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.535 -13.486 -0.039 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.849 -13.557 -0.222 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.022 -13.639 1.177 1.00 0.00 N ATOM 0 H ARG B 17 19.432 -11.164 -3.408 1.00 0.00 H new ATOM 0 HA ARG B 17 21.191 -8.895 -2.820 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.180 -10.261 -3.068 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.268 -10.741 -1.650 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.223 -12.573 -3.166 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.512 -12.199 -4.294 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.281 -14.027 -2.941 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.179 -12.609 -2.438 1.00 0.00 H new ATOM 0 HE ARG B 17 21.726 -13.218 -0.892 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.241 -13.436 -1.156 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.466 -13.732 0.571 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.013 -13.581 1.316 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.637 -13.814 1.972 1.00 0.00 H new ATOM 1049 N ALA B 18 20.194 -10.722 -5.334 1.00 0.00 N ATOM 1050 CA ALA B 18 20.150 -10.870 -6.789 1.00 0.00 C ATOM 1051 C ALA B 18 18.727 -10.973 -7.325 1.00 0.00 C ATOM 1052 O ALA B 18 18.447 -10.546 -8.447 1.00 0.00 O ATOM 1053 CB ALA B 18 20.959 -12.082 -7.224 1.00 0.00 C ATOM 0 H ALA B 18 19.559 -11.336 -4.825 1.00 0.00 H new ATOM 0 HA ALA B 18 20.590 -9.966 -7.211 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.916 -12.178 -8.309 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.996 -11.959 -6.911 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.546 -12.980 -6.764 1.00 0.00 H new ATOM 1059 N GLY B 19 17.834 -11.541 -6.522 1.00 0.00 N ATOM 1060 CA GLY B 19 16.447 -11.672 -6.927 1.00 0.00 C ATOM 1061 C GLY B 19 16.175 -12.915 -7.757 1.00 0.00 C ATOM 1062 O GLY B 19 15.194 -12.964 -8.496 1.00 0.00 O ATOM 0 H GLY B 19 18.046 -11.914 -5.597 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.817 -11.693 -6.038 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.159 -10.791 -7.501 1.00 0.00 H new ATOM 1066 N GLU B 20 17.001 -13.940 -7.588 1.00 0.00 N ATOM 1067 CA GLU B 20 16.864 -15.166 -8.366 1.00 0.00 C ATOM 1068 C GLU B 20 17.162 -16.390 -7.516 1.00 0.00 C ATOM 1069 O GLU B 20 17.707 -16.292 -6.428 1.00 0.00 O ATOM 1070 CB GLU B 20 17.785 -15.161 -9.598 1.00 0.00 C ATOM 1071 CG GLU B 20 19.213 -14.696 -9.326 1.00 0.00 C ATOM 1072 CD GLU B 20 20.033 -15.701 -8.535 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.459 -16.723 -9.124 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.249 -15.481 -7.328 1.00 0.00 O ATOM 0 H GLU B 20 17.772 -13.947 -6.920 1.00 0.00 H new ATOM 0 HA GLU B 20 15.829 -15.211 -8.706 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.818 -16.168 -10.014 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.346 -14.516 -10.360 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.710 -14.499 -10.276 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.183 -13.753 -8.780 1.00 0.00 H new ATOM 1081 N ILE B 21 16.761 -17.534 -8.000 1.00 0.00 N ATOM 1082 CA ILE B 21 17.172 -18.793 -7.427 1.00 0.00 C ATOM 1083 C ILE B 21 17.784 -19.622 -8.526 1.00 0.00 C ATOM 1084 O ILE B 21 17.069 -20.145 -9.373 1.00 0.00 O ATOM 1085 CB ILE B 21 15.995 -19.572 -6.796 1.00 0.00 C ATOM 1086 CG1 ILE B 21 15.418 -18.821 -5.590 1.00 0.00 C ATOM 1087 CG2 ILE B 21 16.436 -20.972 -6.385 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.373 -18.679 -4.419 1.00 0.00 C ATOM 0 H ILE B 21 16.139 -17.623 -8.804 1.00 0.00 H new ATOM 0 HA ILE B 21 17.884 -18.591 -6.627 1.00 0.00 H new ATOM 0 HB ILE B 21 15.212 -19.659 -7.549 1.00 0.00 H new ATOM 0 HG12 ILE B 21 15.108 -17.827 -5.912 1.00 0.00 H new ATOM 0 HG13 ILE B 21 14.522 -19.340 -5.250 1.00 0.00 H new ATOM 0 HG21 ILE B 21 15.593 -21.504 -5.943 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.788 -21.515 -7.262 1.00 0.00 H new ATOM 0 HG23 ILE B 21 17.242 -20.900 -5.655 1.00 0.00 H new ATOM 0 HD11 ILE B 21 15.881 -18.136 -3.612 1.00 0.00 H new ATOM 0 HD12 ILE B 21 16.665 -19.668 -4.065 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.260 -18.131 -4.737 1.00 0.00 H new ATOM 1100 N GLU B 22 19.103 -19.699 -8.531 1.00 0.00 N ATOM 1101 CA GLU B 22 19.813 -20.478 -9.527 1.00 0.00 C ATOM 1102 C GLU B 22 19.557 -19.925 -10.934 1.00 0.00 C ATOM 1103 O GLU B 22 19.199 -20.673 -11.843 1.00 0.00 O ATOM 1104 CB GLU B 22 19.341 -21.933 -9.437 1.00 0.00 C ATOM 1105 CG GLU B 22 20.380 -22.945 -9.860 1.00 0.00 C ATOM 1106 CD GLU B 22 21.587 -22.925 -8.943 1.00 0.00 C ATOM 1107 OE1 GLU B 22 21.501 -23.489 -7.834 1.00 0.00 O ATOM 1108 OE2 GLU B 22 22.618 -22.326 -9.318 1.00 0.00 O ATOM 0 H GLU B 22 19.705 -19.230 -7.854 1.00 0.00 H new ATOM 0 HA GLU B 22 20.885 -20.421 -9.336 1.00 0.00 H new ATOM 0 HB2 GLU B 22 19.041 -22.144 -8.411 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.455 -22.056 -10.060 1.00 0.00 H new ATOM 0 HG2 GLU B 22 19.939 -23.942 -9.859 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.696 -22.737 -10.882 1.00 0.00 H new ATOM 1115 N GLY B 23 19.714 -18.609 -11.119 1.00 0.00 N ATOM 1116 CA GLY B 23 19.439 -18.007 -12.423 1.00 0.00 C ATOM 1117 C GLY B 23 17.973 -18.063 -12.799 1.00 0.00 C ATOM 1118 O GLY B 23 17.569 -17.658 -13.888 1.00 0.00 O ATOM 0 H GLY B 23 20.023 -17.956 -10.399 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.768 -16.968 -12.415 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.025 -18.520 -13.186 1.00 0.00 H new ATOM 1122 N THR B 24 17.199 -18.566 -11.880 1.00 0.00 N ATOM 1123 CA THR B 24 15.828 -18.941 -12.125 1.00 0.00 C ATOM 1124 C THR B 24 14.867 -18.164 -11.213 1.00 0.00 C ATOM 1125 O THR B 24 15.198 -17.861 -10.069 1.00 0.00 O ATOM 1126 CB THR B 24 15.761 -20.469 -11.914 1.00 0.00 C ATOM 1127 OG1 THR B 24 16.109 -21.136 -13.130 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.416 -20.970 -11.412 1.00 0.00 C ATOM 0 H THR B 24 17.505 -18.731 -10.921 1.00 0.00 H new ATOM 0 HA THR B 24 15.512 -18.689 -13.137 1.00 0.00 H new ATOM 0 HB THR B 24 16.478 -20.701 -11.126 1.00 0.00 H new ATOM 0 HG1 THR B 24 16.068 -22.106 -12.995 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.453 -22.053 -11.290 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.189 -20.505 -10.453 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.640 -20.713 -12.133 1.00 0.00 H new ATOM 1136 N PRO B 25 13.673 -17.800 -11.730 1.00 0.00 N ATOM 1137 CA PRO B 25 12.691 -16.986 -10.995 1.00 0.00 C ATOM 1138 C PRO B 25 12.357 -17.576 -9.625 1.00 0.00 C ATOM 1139 O PRO B 25 11.955 -18.734 -9.507 1.00 0.00 O ATOM 1140 CB PRO B 25 11.456 -16.979 -11.909 1.00 0.00 C ATOM 1141 CG PRO B 25 11.679 -18.109 -12.857 1.00 0.00 C ATOM 1142 CD PRO B 25 13.166 -18.168 -13.060 1.00 0.00 C ATOM 0 HA PRO B 25 13.071 -15.987 -10.783 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.539 -17.118 -11.336 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.361 -16.031 -12.438 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.300 -19.046 -12.448 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.160 -17.940 -13.800 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.497 -19.162 -13.362 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.500 -17.473 -13.830 1.00 0.00 H new ATOM 1150 N CYS B 26 12.534 -16.757 -8.596 1.00 0.00 N ATOM 1151 CA CYS B 26 12.431 -17.198 -7.214 1.00 0.00 C ATOM 1152 C CYS B 26 10.979 -17.364 -6.743 1.00 0.00 C ATOM 1153 O CYS B 26 10.131 -16.520 -7.021 1.00 0.00 O ATOM 1154 CB CYS B 26 13.158 -16.187 -6.335 1.00 0.00 C ATOM 1155 SG CYS B 26 13.219 -16.629 -4.571 1.00 0.00 S ATOM 0 H CYS B 26 12.753 -15.766 -8.698 1.00 0.00 H new ATOM 0 HA CYS B 26 12.888 -18.184 -7.137 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.177 -16.071 -6.703 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.670 -15.218 -6.437 1.00 0.00 H new ATOM 1160 N PRO B 27 10.720 -18.458 -5.984 1.00 0.00 N ATOM 1161 CA PRO B 27 9.397 -18.846 -5.462 1.00 0.00 C ATOM 1162 C PRO B 27 8.466 -17.696 -5.067 1.00 0.00 C ATOM 1163 O PRO B 27 7.382 -17.538 -5.625 1.00 0.00 O ATOM 1164 CB PRO B 27 9.775 -19.626 -4.203 1.00 0.00 C ATOM 1165 CG PRO B 27 11.074 -20.287 -4.514 1.00 0.00 C ATOM 1166 CD PRO B 27 11.739 -19.461 -5.600 1.00 0.00 C ATOM 0 HA PRO B 27 8.832 -19.377 -6.228 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.869 -18.962 -3.344 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.011 -20.362 -3.954 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.704 -20.337 -3.626 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.915 -21.312 -4.850 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.647 -18.983 -5.234 1.00 0.00 H new ATOM 0 HD3 PRO B 27 12.025 -20.081 -6.450 1.00 0.00 H new ATOM 1174 N ALA B 28 8.920 -16.876 -4.126 1.00 0.00 N ATOM 1175 CA ALA B 28 8.024 -15.967 -3.414 1.00 0.00 C ATOM 1176 C ALA B 28 8.468 -14.518 -3.544 1.00 0.00 C ATOM 1177 O ALA B 28 7.773 -13.603 -3.109 1.00 0.00 O ATOM 1178 CB ALA B 28 7.934 -16.364 -1.947 1.00 0.00 C ATOM 0 H ALA B 28 9.897 -16.820 -3.838 1.00 0.00 H new ATOM 0 HA ALA B 28 7.037 -16.049 -3.870 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.264 -15.680 -1.426 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.549 -17.381 -1.868 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.925 -16.316 -1.496 1.00 0.00 H new ATOM 1184 N CYS B 29 9.636 -14.313 -4.125 1.00 0.00 N ATOM 1185 CA CYS B 29 10.132 -12.969 -4.359 1.00 0.00 C ATOM 1186 C CYS B 29 10.581 -12.844 -5.809 1.00 0.00 C ATOM 1187 O CYS B 29 11.704 -13.212 -6.155 1.00 0.00 O ATOM 1188 CB CYS B 29 11.276 -12.632 -3.378 1.00 0.00 C ATOM 1189 SG CYS B 29 12.832 -13.533 -3.652 1.00 0.00 S ATOM 0 H CYS B 29 10.257 -15.057 -4.443 1.00 0.00 H new ATOM 0 HA CYS B 29 9.333 -12.249 -4.180 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.480 -11.563 -3.438 1.00 0.00 H new ATOM 0 HB3 CYS B 29 10.933 -12.834 -2.363 1.00 0.00 H new ATOM 1194 N SER B 30 9.683 -12.367 -6.662 1.00 0.00 N ATOM 1195 CA SER B 30 9.947 -12.232 -8.089 1.00 0.00 C ATOM 1196 C SER B 30 10.971 -11.138 -8.418 1.00 0.00 C ATOM 1197 O SER B 30 10.710 -10.253 -9.229 1.00 0.00 O ATOM 1198 CB SER B 30 8.623 -11.943 -8.792 1.00 0.00 C ATOM 1199 OG SER B 30 7.869 -10.982 -8.064 1.00 0.00 O ATOM 0 H SER B 30 8.750 -12.063 -6.384 1.00 0.00 H new ATOM 0 HA SER B 30 10.386 -13.166 -8.440 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.813 -11.576 -9.801 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.049 -12.864 -8.891 1.00 0.00 H new ATOM 0 HG SER B 30 7.025 -10.808 -8.530 1.00 0.00 H new ATOM 1205 N GLY B 31 12.131 -11.202 -7.784 1.00 0.00 N ATOM 1206 CA GLY B 31 13.213 -10.318 -8.141 1.00 0.00 C ATOM 1207 C GLY B 31 13.244 -9.071 -7.298 1.00 0.00 C ATOM 1208 O GLY B 31 13.482 -7.979 -7.806 1.00 0.00 O ATOM 0 H GLY B 31 12.340 -11.853 -7.027 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.160 -10.847 -8.035 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.119 -10.040 -9.191 1.00 0.00 H new ATOM 1212 N LYS B 32 13.012 -9.229 -6.004 1.00 0.00 N ATOM 1213 CA LYS B 32 13.039 -8.106 -5.088 1.00 0.00 C ATOM 1214 C LYS B 32 14.153 -8.303 -4.065 1.00 0.00 C ATOM 1215 O LYS B 32 14.796 -7.350 -3.634 1.00 0.00 O ATOM 1216 CB LYS B 32 11.684 -7.960 -4.384 1.00 0.00 C ATOM 1217 CG LYS B 32 10.567 -7.514 -5.317 1.00 0.00 C ATOM 1218 CD LYS B 32 9.692 -8.664 -5.798 1.00 0.00 C ATOM 1219 CE LYS B 32 8.725 -9.144 -4.723 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.516 -9.768 -5.327 1.00 0.00 N ATOM 0 H LYS B 32 12.803 -10.127 -5.567 1.00 0.00 H new ATOM 0 HA LYS B 32 13.233 -7.192 -5.650 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.412 -8.914 -3.933 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.780 -7.239 -3.572 1.00 0.00 H new ATOM 0 HG2 LYS B 32 9.944 -6.782 -4.803 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.003 -7.012 -6.181 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.128 -8.346 -6.675 1.00 0.00 H new ATOM 0 HD3 LYS B 32 10.326 -9.494 -6.110 1.00 0.00 H new ATOM 0 HE2 LYS B 32 9.225 -9.865 -4.076 1.00 0.00 H new ATOM 0 HE3 LYS B 32 8.429 -8.304 -4.095 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.176 -10.533 -4.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 6.771 -9.050 -5.432 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.756 -10.157 -6.261 1.00 0.00 H new ATOM 1234 N GLY B 33 14.368 -9.556 -3.673 1.00 0.00 N ATOM 1235 CA GLY B 33 15.404 -9.877 -2.729 1.00 0.00 C ATOM 1236 C GLY B 33 14.810 -10.304 -1.412 1.00 0.00 C ATOM 1237 O GLY B 33 15.267 -11.262 -0.791 1.00 0.00 O ATOM 0 H GLY B 33 13.831 -10.358 -4.002 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.031 -10.675 -3.127 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.048 -9.010 -2.579 1.00 0.00 H new ATOM 1241 N VAL B 34 13.741 -9.635 -1.021 1.00 0.00 N ATOM 1242 CA VAL B 34 13.086 -9.919 0.241 1.00 0.00 C ATOM 1243 C VAL B 34 11.717 -10.548 0.019 1.00 0.00 C ATOM 1244 O VAL B 34 11.159 -10.485 -1.081 1.00 0.00 O ATOM 1245 CB VAL B 34 12.922 -8.632 1.081 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.277 -8.073 1.489 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.134 -7.585 0.308 1.00 0.00 C ATOM 0 H VAL B 34 13.307 -8.888 -1.563 1.00 0.00 H new ATOM 0 HA VAL B 34 13.719 -10.623 0.782 1.00 0.00 H new ATOM 0 HB VAL B 34 12.370 -8.889 1.985 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.134 -7.168 2.079 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.812 -8.813 2.084 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.857 -7.837 0.597 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.029 -6.686 0.916 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.661 -7.340 -0.614 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.146 -7.978 0.067 1.00 0.00 H new ATOM 1257 N ILE B 35 11.210 -11.185 1.060 1.00 0.00 N ATOM 1258 CA ILE B 35 9.867 -11.740 1.054 1.00 0.00 C ATOM 1259 C ILE B 35 9.074 -11.182 2.230 1.00 0.00 C ATOM 1260 O ILE B 35 9.648 -10.667 3.183 1.00 0.00 O ATOM 1261 CB ILE B 35 9.877 -13.283 1.135 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.790 -13.752 2.271 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.310 -13.886 -0.191 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.802 -15.253 2.471 1.00 0.00 C ATOM 0 H ILE B 35 11.717 -11.332 1.933 1.00 0.00 H new ATOM 0 HA ILE B 35 9.400 -11.455 0.111 1.00 0.00 H new ATOM 0 HB ILE B 35 8.864 -13.625 1.347 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.807 -13.414 2.069 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.474 -13.275 3.198 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.311 -14.973 -0.113 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.617 -13.578 -0.974 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.313 -13.539 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.472 -15.505 3.293 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.795 -15.597 2.705 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.148 -15.739 1.559 1.00 0.00 H new ATOM 1276 N LEU B 36 7.759 -11.287 2.154 1.00 0.00 N ATOM 1277 CA LEU B 36 6.887 -10.660 3.139 1.00 0.00 C ATOM 1278 C LEU B 36 6.603 -11.563 4.332 1.00 0.00 C ATOM 1279 O LEU B 36 6.819 -12.775 4.288 1.00 0.00 O ATOM 1280 CB LEU B 36 5.567 -10.247 2.484 1.00 0.00 C ATOM 1281 CG LEU B 36 5.715 -9.350 1.256 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.763 -10.173 -0.024 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.592 -8.340 1.209 1.00 0.00 C ATOM 0 H LEU B 36 7.269 -11.800 1.421 1.00 0.00 H new ATOM 0 HA LEU B 36 7.413 -9.781 3.513 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.023 -11.147 2.196 1.00 0.00 H new ATOM 0 HB3 LEU B 36 4.957 -9.729 3.224 1.00 0.00 H new ATOM 0 HG LEU B 36 6.660 -8.813 1.336 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.869 -9.507 -0.881 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.613 -10.854 0.013 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.842 -10.747 -0.122 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.709 -7.707 0.330 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.636 -8.861 1.157 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.620 -7.723 2.107 1.00 0.00 H new ATOM 1295 N THR B 37 6.097 -10.943 5.390 1.00 0.00 N ATOM 1296 CA THR B 37 5.672 -11.648 6.587 1.00 0.00 C ATOM 1297 C THR B 37 4.149 -11.687 6.608 1.00 0.00 C ATOM 1298 O THR B 37 3.526 -11.179 5.684 1.00 0.00 O ATOM 1299 CB THR B 37 6.177 -10.930 7.859 1.00 0.00 C ATOM 1300 OG1 THR B 37 5.617 -9.608 7.933 1.00 0.00 O ATOM 1301 CG2 THR B 37 7.694 -10.828 7.865 1.00 0.00 C ATOM 0 H THR B 37 5.970 -9.932 5.440 1.00 0.00 H new ATOM 0 HA THR B 37 6.087 -12.656 6.573 1.00 0.00 H new ATOM 0 HB THR B 37 5.861 -11.517 8.722 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.105 -9.083 8.601 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.021 -10.318 8.771 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.126 -11.828 7.835 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.024 -10.264 6.993 1.00 0.00 H new ATOM 1309 N ALA B 38 3.540 -12.262 7.637 1.00 0.00 N ATOM 1310 CA ALA B 38 2.082 -12.315 7.701 1.00 0.00 C ATOM 1311 C ALA B 38 1.496 -10.908 7.717 1.00 0.00 C ATOM 1312 O ALA B 38 0.519 -10.625 7.019 1.00 0.00 O ATOM 1313 CB ALA B 38 1.619 -13.110 8.909 1.00 0.00 C ATOM 0 H ALA B 38 4.021 -12.692 8.427 1.00 0.00 H new ATOM 0 HA ALA B 38 1.720 -12.825 6.808 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.530 -13.134 8.933 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.003 -14.128 8.844 1.00 0.00 H new ATOM 0 HB3 ALA B 38 1.992 -12.639 9.819 1.00 0.00 H new ATOM 1319 N GLN B 39 2.099 -10.024 8.504 1.00 0.00 N ATOM 1320 CA GLN B 39 1.711 -8.620 8.500 1.00 0.00 C ATOM 1321 C GLN B 39 1.911 -8.009 7.116 1.00 0.00 C ATOM 1322 O GLN B 39 1.040 -7.295 6.614 1.00 0.00 O ATOM 1323 CB GLN B 39 2.501 -7.826 9.542 1.00 0.00 C ATOM 1324 CG GLN B 39 2.296 -6.325 9.421 1.00 0.00 C ATOM 1325 CD GLN B 39 2.873 -5.546 10.579 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.841 -5.962 11.210 1.00 0.00 O ATOM 1327 NE2 GLN B 39 2.280 -4.399 10.856 1.00 0.00 N ATOM 0 H GLN B 39 2.855 -10.254 9.150 1.00 0.00 H new ATOM 0 HA GLN B 39 0.653 -8.569 8.758 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.204 -8.149 10.540 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.562 -8.053 9.436 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.753 -5.977 8.495 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.229 -6.116 9.348 1.00 0.00 H new ATOM 0 HE21 GLN B 39 1.478 -4.093 10.305 1.00 0.00 H new ATOM 0 HE22 GLN B 39 2.624 -3.819 11.621 1.00 0.00 H new ATOM 1336 N GLY B 40 3.045 -8.310 6.491 1.00 0.00 N ATOM 1337 CA GLY B 40 3.321 -7.783 5.170 1.00 0.00 C ATOM 1338 C GLY B 40 2.380 -8.354 4.132 1.00 0.00 C ATOM 1339 O GLY B 40 2.017 -7.684 3.172 1.00 0.00 O ATOM 0 H GLY B 40 3.776 -8.909 6.876 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.230 -6.697 5.185 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.350 -8.013 4.894 1.00 0.00 H new ATOM 1343 N TYR B 41 1.964 -9.589 4.347 1.00 0.00 N ATOM 1344 CA TYR B 41 1.024 -10.247 3.463 1.00 0.00 C ATOM 1345 C TYR B 41 -0.360 -9.641 3.585 1.00 0.00 C ATOM 1346 O TYR B 41 -1.095 -9.569 2.601 1.00 0.00 O ATOM 1347 CB TYR B 41 0.971 -11.739 3.794 1.00 0.00 C ATOM 1348 CG TYR B 41 1.818 -12.599 2.884 1.00 0.00 C ATOM 1349 CD1 TYR B 41 3.157 -12.841 3.162 1.00 0.00 C ATOM 1350 CD2 TYR B 41 1.273 -13.172 1.743 1.00 0.00 C ATOM 1351 CE1 TYR B 41 3.929 -13.626 2.327 1.00 0.00 C ATOM 1352 CE2 TYR B 41 2.038 -13.958 0.904 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.363 -14.183 1.202 1.00 0.00 C ATOM 1354 OH TYR B 41 4.126 -14.961 0.366 1.00 0.00 O ATOM 0 H TYR B 41 2.267 -10.160 5.136 1.00 0.00 H new ATOM 0 HA TYR B 41 1.362 -10.109 2.436 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.298 -11.885 4.823 1.00 0.00 H new ATOM 0 HB3 TYR B 41 -0.064 -12.077 3.738 1.00 0.00 H new ATOM 0 HD1 TYR B 41 3.602 -12.408 4.046 1.00 0.00 H new ATOM 0 HD2 TYR B 41 0.233 -13.000 1.508 1.00 0.00 H new ATOM 0 HE1 TYR B 41 4.970 -13.802 2.555 1.00 0.00 H new ATOM 0 HE2 TYR B 41 1.599 -14.394 0.019 1.00 0.00 H new ATOM 0 HH TYR B 41 3.575 -15.278 -0.380 1.00 0.00 H new ATOM 1364 N THR B 42 -0.702 -9.169 4.770 1.00 0.00 N ATOM 1365 CA THR B 42 -1.972 -8.492 4.970 1.00 0.00 C ATOM 1366 C THR B 42 -1.958 -7.142 4.268 1.00 0.00 C ATOM 1367 O THR B 42 -2.982 -6.667 3.773 1.00 0.00 O ATOM 1368 CB THR B 42 -2.244 -8.275 6.469 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.067 -9.506 7.177 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.653 -7.746 6.704 1.00 0.00 C ATOM 0 H THR B 42 -0.122 -9.241 5.606 1.00 0.00 H new ATOM 0 HA THR B 42 -2.760 -9.119 4.552 1.00 0.00 H new ATOM 0 HB THR B 42 -1.536 -7.533 6.838 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.116 -9.744 7.186 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.814 -7.603 7.772 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.775 -6.794 6.188 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.379 -8.462 6.320 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.774 -6.551 4.185 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.632 -5.247 3.570 1.00 0.00 C ATOM 1380 C LEU B 43 -0.443 -5.385 2.069 1.00 0.00 C ATOM 1381 O LEU B 43 -0.770 -4.470 1.323 1.00 0.00 O ATOM 1382 CB LEU B 43 0.552 -4.466 4.164 1.00 0.00 C ATOM 1383 CG LEU B 43 0.224 -3.466 5.285 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.387 -4.172 6.483 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.480 -2.719 5.704 1.00 0.00 C ATOM 0 H LEU B 43 0.095 -6.954 4.535 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.548 -4.692 3.774 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.275 -5.185 4.549 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.042 -3.923 3.356 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.505 -2.752 4.901 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.609 -3.442 7.261 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.307 -4.672 6.180 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.317 -4.910 6.868 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.236 -2.014 6.498 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.223 -3.430 6.066 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.883 -2.177 4.849 1.00 0.00 H new ATOM 1397 N LEU B 44 0.052 -6.529 1.604 1.00 0.00 N ATOM 1398 CA LEU B 44 0.316 -6.693 0.187 1.00 0.00 C ATOM 1399 C LEU B 44 -0.986 -6.986 -0.545 1.00 0.00 C ATOM 1400 O LEU B 44 -1.243 -6.439 -1.612 1.00 0.00 O ATOM 1401 CB LEU B 44 1.377 -7.800 -0.047 1.00 0.00 C ATOM 1402 CG LEU B 44 0.881 -9.243 -0.294 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.356 -9.423 -1.715 1.00 0.00 C ATOM 1404 CD2 LEU B 44 2.000 -10.243 -0.059 1.00 0.00 C ATOM 0 H LEU B 44 0.274 -7.341 2.181 1.00 0.00 H new ATOM 0 HA LEU B 44 0.728 -5.768 -0.216 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.984 -7.505 -0.903 1.00 0.00 H new ATOM 0 HB3 LEU B 44 2.037 -7.818 0.820 1.00 0.00 H new ATOM 0 HG LEU B 44 0.068 -9.422 0.409 1.00 0.00 H new ATOM 0 HD11 LEU B 44 0.017 -10.450 -1.850 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.477 -8.740 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU B 44 1.153 -9.207 -2.427 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.630 -11.252 -0.238 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.825 -10.033 -0.740 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.350 -10.162 0.970 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.820 -7.832 0.047 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.083 -8.205 -0.572 1.00 0.00 C ATOM 1418 C ASP B 45 -4.059 -7.042 -0.521 1.00 0.00 C ATOM 1419 O ASP B 45 -4.983 -6.945 -1.333 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.675 -9.424 0.133 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.918 -9.942 -0.557 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.777 -10.693 -1.544 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.035 -9.596 -0.125 1.00 0.00 O ATOM 0 H ASP B 45 -1.645 -8.270 0.951 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.899 -8.459 -1.616 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.927 -10.216 0.172 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.917 -9.163 1.163 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.826 -6.139 0.416 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.605 -4.920 0.515 1.00 0.00 C ATOM 1430 C PHE B 46 -4.208 -3.946 -0.577 1.00 0.00 C ATOM 1431 O PHE B 46 -5.061 -3.304 -1.187 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.328 -4.286 1.876 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.154 -3.077 2.203 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -4.748 -1.814 1.801 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -6.324 -3.202 2.932 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -5.495 -0.701 2.119 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -7.076 -2.091 3.251 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.660 -0.840 2.844 1.00 0.00 C ATOM 0 H PHE B 46 -3.097 -6.230 1.124 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.664 -5.154 0.404 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.493 -5.037 2.648 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.275 -4.009 1.921 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -3.837 -1.701 1.233 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -6.651 -4.180 3.254 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -5.169 0.278 1.801 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -7.989 -2.200 3.818 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.247 0.031 3.093 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.923 -3.850 -0.854 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.488 -2.913 -1.862 1.00 0.00 C ATOM 1450 C ILE B 47 -2.745 -3.483 -3.247 1.00 0.00 C ATOM 1451 O ILE B 47 -3.101 -2.748 -4.166 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.006 -2.510 -1.711 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.080 -3.700 -1.985 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.772 -1.962 -0.316 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.392 -3.375 -1.860 1.00 0.00 C ATOM 0 H ILE B 47 -2.183 -4.393 -0.409 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.072 -2.003 -1.725 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.776 -1.738 -2.445 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.324 -4.505 -1.291 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.275 -4.075 -2.990 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.274 -1.677 -0.208 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.404 -1.088 -0.157 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.018 -2.726 0.421 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.981 -4.268 -2.069 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.654 -2.593 -2.573 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.604 -3.029 -0.848 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.608 -4.802 -3.370 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.011 -5.510 -4.571 1.00 0.00 C ATOM 1469 C GLN B 48 -4.431 -5.112 -4.940 1.00 0.00 C ATOM 1470 O GLN B 48 -4.659 -4.396 -5.895 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.971 -7.026 -4.340 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.583 -7.653 -4.369 1.00 0.00 C ATOM 1473 CD GLN B 48 -1.061 -7.866 -5.780 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.834 -8.030 -6.723 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.254 -7.893 -5.931 1.00 0.00 N ATOM 0 H GLN B 48 -2.217 -5.401 -2.643 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.322 -5.249 -5.375 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.429 -7.242 -3.375 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.586 -7.509 -5.100 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -0.889 -7.014 -3.823 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.611 -8.610 -3.849 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.863 -7.753 -5.125 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.658 -8.054 -6.854 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.343 -5.445 -4.059 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.767 -5.500 -4.365 1.00 0.00 C ATOM 1486 C LYS B 49 -7.425 -4.114 -4.426 1.00 0.00 C ATOM 1487 O LYS B 49 -8.622 -3.999 -4.693 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.413 -6.362 -3.280 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.908 -6.580 -3.421 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.565 -6.971 -2.097 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.863 -8.136 -1.404 1.00 0.00 C ATOM 1492 NZ LYS B 49 -7.793 -7.684 -0.470 1.00 0.00 N ATOM 0 H LYS B 49 -5.122 -5.690 -3.094 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.909 -5.925 -5.359 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.921 -7.335 -3.273 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.221 -5.900 -2.312 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.372 -5.669 -3.799 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.091 -7.361 -4.159 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.569 -6.108 -1.431 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.606 -7.238 -2.279 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -9.598 -8.723 -0.853 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -8.429 -8.794 -2.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -7.500 -8.479 0.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -6.976 -7.344 -1.016 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -8.156 -6.913 0.126 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.678 -3.047 -4.164 1.00 0.00 N ATOM 1507 CA HIS B 50 -7.254 -1.735 -4.451 1.00 0.00 C ATOM 1508 C HIS B 50 -6.512 -0.972 -5.545 1.00 0.00 C ATOM 1509 O HIS B 50 -6.977 0.090 -5.955 1.00 0.00 O ATOM 1510 CB HIS B 50 -7.295 -0.892 -3.172 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.956 -1.597 -2.029 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -7.298 -1.934 -0.871 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -9.217 -2.065 -1.891 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -8.121 -2.578 -0.074 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -9.295 -2.677 -0.665 1.00 0.00 N ATOM 0 H HIS B 50 -5.734 -3.054 -3.779 1.00 0.00 H new ATOM 0 HA HIS B 50 -8.263 -1.915 -4.822 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -6.278 -0.624 -2.887 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.825 0.039 -3.373 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -6.323 -1.718 -0.662 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -10.016 -1.974 -2.612 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -7.876 -2.963 0.905 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -10.122 -3.132 -0.277 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.397 -1.505 -6.043 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.681 -0.848 -7.146 1.00 0.00 C ATOM 1526 C LEU B 51 -4.403 -1.810 -8.304 1.00 0.00 C ATOM 1527 O LEU B 51 -4.648 -1.482 -9.464 1.00 0.00 O ATOM 1528 CB LEU B 51 -3.350 -0.228 -6.687 1.00 0.00 C ATOM 1529 CG LEU B 51 -3.441 0.938 -5.690 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -2.137 1.721 -5.655 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -4.585 1.866 -6.038 1.00 0.00 C ATOM 0 H LEU B 51 -4.973 -2.372 -5.712 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.342 -0.053 -7.491 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.745 -1.015 -6.236 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.814 0.120 -7.570 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.626 0.513 -4.704 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.224 2.541 -4.943 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.324 1.061 -5.351 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.927 2.122 -6.646 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -4.625 2.681 -5.316 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.432 2.274 -7.037 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.523 1.312 -6.012 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.891 -2.992 -7.983 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.435 -3.942 -8.999 1.00 0.00 C ATOM 1545 C ASN B 52 -4.386 -5.130 -9.152 1.00 0.00 C ATOM 1546 O ASN B 52 -4.385 -5.808 -10.180 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.029 -4.436 -8.652 1.00 0.00 C ATOM 1548 CG ASN B 52 -0.940 -3.574 -9.266 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.123 -2.375 -9.480 1.00 0.00 O ATOM 1550 ND2 ASN B 52 0.204 -4.177 -9.551 1.00 0.00 N ATOM 0 H ASN B 52 -3.779 -3.320 -7.024 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.418 -3.418 -9.954 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -1.909 -4.449 -7.569 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -1.913 -5.463 -8.998 1.00 0.00 H new ATOM 0 HD21 ASN B 52 0.972 -3.646 -9.962 1.00 0.00 H new ATOM 0 HD22 ASN B 52 0.318 -5.172 -9.359 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.179 -5.385 -8.126 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.167 -6.444 -8.157 1.00 0.00 C ATOM 1559 C LYS B 53 -7.573 -5.859 -8.203 1.00 0.00 C ATOM 1560 O LYS B 53 -8.145 -5.606 -7.128 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.027 -7.358 -6.932 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.335 -8.673 -7.247 1.00 0.00 C ATOM 1563 CD LYS B 53 -5.739 -9.767 -6.270 1.00 0.00 C ATOM 1564 CE LYS B 53 -4.926 -9.732 -4.991 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.308 -10.839 -4.075 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.106 -5.683 -9.319 1.00 0.00 O ATOM 0 H LYS B 53 -5.155 -4.863 -7.250 1.00 0.00 H new ATOM 0 HA LYS B 53 -5.997 -7.036 -9.056 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.466 -6.835 -6.158 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.017 -7.563 -6.524 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.584 -8.981 -8.262 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.255 -8.534 -7.212 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -6.796 -9.661 -6.028 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.617 -10.739 -6.748 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -3.865 -9.805 -5.230 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.074 -8.775 -4.490 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -4.917 -10.657 -3.129 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.345 -10.899 -4.016 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -4.930 -11.737 -4.439 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.855 4.566 13.698 1.00 0.00 N HETATM 1582 CN FME C 1 -10.862 3.265 13.942 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.733 2.735 14.633 1.00 0.00 O HETATM 1584 CA FME C 1 -9.808 5.175 12.894 1.00 0.00 C HETATM 1585 CB FME C 1 -10.359 6.381 12.128 1.00 0.00 C HETATM 1586 CG FME C 1 -9.424 6.908 11.051 1.00 0.00 C HETATM 1587 SD FME C 1 -10.174 8.223 10.067 1.00 0.00 S HETATM 1588 CE FME C 1 -8.947 8.416 8.776 1.00 0.00 C HETATM 1589 C FME C 1 -8.654 5.598 13.791 1.00 0.00 C HETATM 1590 O FME C 1 -8.723 6.623 14.469 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.513 7.282 11.517 1.00 0.00 H new HETATM 0 HG2 FME C 1 -9.133 6.088 10.394 1.00 0.00 H new HETATM 0 HE3 FME C 1 -8.921 9.456 8.451 1.00 0.00 H new HETATM 0 HE2 FME C 1 -7.967 8.131 9.160 1.00 0.00 H new HETATM 0 HE1 FME C 1 -9.205 7.778 7.931 1.00 0.00 H new HETATM 0 HCN FME C 1 -10.073 2.644 13.518 1.00 0.00 H new HETATM 0 HB3 FME C 1 -11.307 6.104 11.668 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.570 7.183 12.836 1.00 0.00 H new HETATM 0 HA FME C 1 -9.445 4.446 12.170 1.00 0.00 H new HETATM 0 H FME C 1 -11.597 5.152 14.081 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.597 4.801 13.799 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.454 5.066 14.661 1.00 0.00 C ATOM 1603 C VAL C 2 -5.285 5.613 13.844 1.00 0.00 C ATOM 1604 O VAL C 2 -4.353 6.209 14.383 1.00 0.00 O ATOM 1605 CB VAL C 2 -6.024 3.786 15.421 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.507 2.721 14.463 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.986 4.106 16.489 1.00 0.00 C ATOM 0 H VAL C 2 -7.506 3.966 13.220 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.751 5.815 15.395 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.907 3.386 15.918 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -5.213 1.836 15.027 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -6.292 2.456 13.755 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.645 3.108 13.920 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.702 3.190 17.007 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -4.106 4.546 16.020 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.407 4.812 17.205 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.356 5.435 12.536 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.331 5.955 11.652 1.00 0.00 C ATOM 1619 C ILE C 3 -4.900 7.084 10.804 1.00 0.00 C ATOM 1620 O ILE C 3 -5.994 6.970 10.249 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.727 4.852 10.745 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.530 5.404 9.963 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.776 4.288 9.791 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.794 4.358 9.154 1.00 0.00 C ATOM 0 H ILE C 3 -6.111 4.936 12.065 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.523 6.339 12.275 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.384 4.038 11.383 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.877 6.190 9.293 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.833 5.866 10.662 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.324 3.517 9.168 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.595 3.856 10.365 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.159 5.088 9.158 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.960 4.824 8.629 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.415 3.583 9.820 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.476 3.912 8.429 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.179 8.188 10.752 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.577 9.316 9.934 1.00 0.00 C ATOM 1638 C ALA C 4 -3.471 9.664 8.954 1.00 0.00 C ATOM 1639 O ALA C 4 -2.289 9.449 9.229 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.914 10.511 10.809 1.00 0.00 C ATOM 0 H ALA C 4 -3.311 8.327 11.269 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.469 9.045 9.369 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.211 11.350 10.180 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.734 10.252 11.479 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.039 10.790 11.397 1.00 0.00 H new ATOM 1646 N THR C 5 -3.874 10.201 7.811 1.00 0.00 N ATOM 1647 CA THR C 5 -2.959 10.522 6.726 1.00 0.00 C ATOM 1648 C THR C 5 -1.945 11.588 7.141 1.00 0.00 C ATOM 1649 O THR C 5 -0.908 11.743 6.509 1.00 0.00 O ATOM 1650 CB THR C 5 -3.751 11.024 5.504 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.966 10.270 5.378 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.935 10.887 4.227 1.00 0.00 C ATOM 0 H THR C 5 -4.848 10.427 7.610 1.00 0.00 H new ATOM 0 HA THR C 5 -2.415 9.612 6.472 1.00 0.00 H new ATOM 0 HB THR C 5 -3.980 12.079 5.654 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.471 10.590 4.602 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.519 11.249 3.381 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.021 11.474 4.314 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.679 9.839 4.069 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.231 12.274 8.241 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.417 13.402 8.684 1.00 0.00 C ATOM 1662 C ASP C 6 -0.166 12.938 9.420 1.00 0.00 C ATOM 1663 O ASP C 6 0.702 13.745 9.750 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.230 14.310 9.612 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.446 14.910 8.936 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.491 14.226 8.871 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.366 16.069 8.478 1.00 0.00 O ATOM 0 H ASP C 6 -3.025 12.068 8.847 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.114 13.952 7.793 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.550 13.737 10.482 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.590 15.114 9.977 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.068 11.643 9.684 1.00 0.00 N ATOM 1673 CA ASP C 7 1.106 11.105 10.359 1.00 0.00 C ATOM 1674 C ASP C 7 2.022 10.383 9.382 1.00 0.00 C ATOM 1675 O ASP C 7 3.158 10.039 9.719 1.00 0.00 O ATOM 1676 CB ASP C 7 0.690 10.142 11.476 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.016 10.841 12.618 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.677 11.411 13.488 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.261 10.827 12.652 1.00 0.00 O ATOM 0 H ASP C 7 -0.778 10.951 9.445 1.00 0.00 H new ATOM 0 HA ASP C 7 1.650 11.945 10.790 1.00 0.00 H new ATOM 0 HB2 ASP C 7 0.034 9.376 11.064 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.574 9.632 11.859 1.00 0.00 H new ATOM 1684 N LEU C 8 1.537 10.161 8.170 1.00 0.00 N ATOM 1685 CA LEU C 8 2.320 9.460 7.158 1.00 0.00 C ATOM 1686 C LEU C 8 2.558 10.346 5.947 1.00 0.00 C ATOM 1687 O LEU C 8 3.513 10.145 5.195 1.00 0.00 O ATOM 1688 CB LEU C 8 1.636 8.158 6.740 1.00 0.00 C ATOM 1689 CG LEU C 8 1.573 7.085 7.826 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.430 7.346 8.796 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.441 5.709 7.202 1.00 0.00 C ATOM 0 H LEU C 8 0.610 10.454 7.862 1.00 0.00 H new ATOM 0 HA LEU C 8 3.286 9.212 7.598 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.621 8.386 6.416 1.00 0.00 H new ATOM 0 HB3 LEU C 8 2.162 7.750 5.877 1.00 0.00 H new ATOM 0 HG LEU C 8 2.504 7.124 8.392 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.412 6.565 9.556 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.573 8.315 9.274 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.515 7.345 8.253 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.397 4.956 7.988 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.529 5.665 6.607 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.302 5.516 6.562 1.00 0.00 H new ATOM 1703 N GLU C 9 1.690 11.326 5.778 1.00 0.00 N ATOM 1704 CA GLU C 9 1.848 12.325 4.742 1.00 0.00 C ATOM 1705 C GLU C 9 1.695 13.703 5.360 1.00 0.00 C ATOM 1706 O GLU C 9 0.754 13.969 6.104 1.00 0.00 O ATOM 1707 CB GLU C 9 0.846 12.130 3.595 1.00 0.00 C ATOM 1708 CG GLU C 9 1.096 10.871 2.775 1.00 0.00 C ATOM 1709 CD GLU C 9 0.313 10.839 1.474 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.864 10.423 1.479 1.00 0.00 O ATOM 1711 OE2 GLU C 9 0.892 11.201 0.425 1.00 0.00 O ATOM 0 H GLU C 9 0.858 11.450 6.355 1.00 0.00 H new ATOM 0 HA GLU C 9 2.843 12.220 4.309 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.162 12.091 4.007 1.00 0.00 H new ATOM 0 HB3 GLU C 9 0.888 12.997 2.936 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.160 10.795 2.553 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.832 9.998 3.372 1.00 0.00 H new ATOM 1718 N VAL C 10 2.638 14.564 5.062 1.00 0.00 N ATOM 1719 CA VAL C 10 2.668 15.895 5.620 1.00 0.00 C ATOM 1720 C VAL C 10 2.740 16.898 4.484 1.00 0.00 C ATOM 1721 O VAL C 10 3.416 16.662 3.481 1.00 0.00 O ATOM 1722 CB VAL C 10 3.867 16.070 6.587 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.187 15.785 5.887 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.874 17.463 7.202 1.00 0.00 C ATOM 0 H VAL C 10 3.408 14.361 4.424 1.00 0.00 H new ATOM 0 HA VAL C 10 1.761 16.063 6.200 1.00 0.00 H new ATOM 0 HB VAL C 10 3.750 15.343 7.391 1.00 0.00 H new ATOM 0 HG11 VAL C 10 6.008 15.916 6.592 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.188 14.760 5.515 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.312 16.474 5.052 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.725 17.559 7.876 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.951 18.209 6.411 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.950 17.619 7.759 1.00 0.00 H new ATOM 1734 N ALA C 11 2.018 17.996 4.616 1.00 0.00 N ATOM 1735 CA ALA C 11 1.962 18.990 3.564 1.00 0.00 C ATOM 1736 C ALA C 11 3.331 19.609 3.344 1.00 0.00 C ATOM 1737 O ALA C 11 4.026 19.976 4.295 1.00 0.00 O ATOM 1738 CB ALA C 11 0.927 20.046 3.931 1.00 0.00 C ATOM 0 H ALA C 11 1.463 18.220 5.442 1.00 0.00 H new ATOM 0 HA ALA C 11 1.665 18.518 2.628 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.879 20.798 3.143 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.050 19.575 4.043 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.210 20.522 4.870 1.00 0.00 H new ATOM 1744 N CYS C 12 3.719 19.693 2.075 1.00 0.00 N ATOM 1745 CA CYS C 12 5.068 20.053 1.675 1.00 0.00 C ATOM 1746 C CYS C 12 5.475 21.464 2.119 1.00 0.00 C ATOM 1747 O CYS C 12 4.634 22.252 2.544 1.00 0.00 O ATOM 1748 CB CYS C 12 5.150 19.973 0.157 1.00 0.00 C ATOM 1749 SG CYS C 12 6.462 18.912 -0.461 1.00 0.00 S ATOM 0 H CYS C 12 3.095 19.510 1.289 1.00 0.00 H new ATOM 0 HA CYS C 12 5.753 19.358 2.161 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.196 19.612 -0.228 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.294 20.978 -0.240 1.00 0.00 H new ATOM 1754 N PRO C 13 6.774 21.801 2.012 1.00 0.00 N ATOM 1755 CA PRO C 13 7.279 23.149 2.301 1.00 0.00 C ATOM 1756 C PRO C 13 6.460 24.264 1.652 1.00 0.00 C ATOM 1757 O PRO C 13 6.253 25.320 2.247 1.00 0.00 O ATOM 1758 CB PRO C 13 8.670 23.118 1.670 1.00 0.00 C ATOM 1759 CG PRO C 13 9.122 21.712 1.813 1.00 0.00 C ATOM 1760 CD PRO C 13 7.875 20.877 1.656 1.00 0.00 C ATOM 0 HA PRO C 13 7.247 23.365 3.369 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.636 23.417 0.623 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.349 23.805 2.176 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.864 21.458 1.056 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.588 21.545 2.784 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.770 20.506 0.637 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.893 20.007 2.312 1.00 0.00 H new ATOM 1768 N LYS C 14 5.985 24.013 0.432 1.00 0.00 N ATOM 1769 CA LYS C 14 5.445 25.083 -0.394 1.00 0.00 C ATOM 1770 C LYS C 14 4.304 24.640 -1.314 1.00 0.00 C ATOM 1771 O LYS C 14 3.419 25.437 -1.618 1.00 0.00 O ATOM 1772 CB LYS C 14 6.581 25.676 -1.237 1.00 0.00 C ATOM 1773 CG LYS C 14 6.111 26.582 -2.370 1.00 0.00 C ATOM 1774 CD LYS C 14 7.275 27.068 -3.225 1.00 0.00 C ATOM 1775 CE LYS C 14 6.792 27.750 -4.495 1.00 0.00 C ATOM 1776 NZ LYS C 14 5.847 28.860 -4.206 1.00 0.00 N ATOM 0 H LYS C 14 5.965 23.089 0.001 1.00 0.00 H new ATOM 0 HA LYS C 14 5.019 25.824 0.283 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.245 26.243 -0.584 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.169 24.861 -1.659 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.400 26.042 -2.996 1.00 0.00 H new ATOM 0 HG3 LYS C 14 5.582 27.440 -1.954 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.885 27.763 -2.648 1.00 0.00 H new ATOM 0 HD3 LYS C 14 7.913 26.224 -3.485 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.649 28.137 -5.047 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.304 27.017 -5.137 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 5.687 29.414 -5.071 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 4.943 28.468 -3.874 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 6.249 29.475 -3.470 1.00 0.00 H new ATOM 1790 N CYS C 15 4.294 23.383 -1.755 1.00 0.00 N ATOM 1791 CA CYS C 15 3.400 23.002 -2.852 1.00 0.00 C ATOM 1792 C CYS C 15 2.304 22.021 -2.457 1.00 0.00 C ATOM 1793 O CYS C 15 1.935 21.150 -3.249 1.00 0.00 O ATOM 1794 CB CYS C 15 4.269 22.316 -3.902 1.00 0.00 C ATOM 1795 SG CYS C 15 5.366 21.049 -3.204 1.00 0.00 S ATOM 0 H CYS C 15 4.874 22.630 -1.385 1.00 0.00 H new ATOM 0 HA CYS C 15 2.901 23.907 -3.199 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.626 21.857 -4.653 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.871 23.067 -4.413 1.00 0.00 H new ATOM 1800 N GLU C 16 1.706 22.234 -1.309 1.00 0.00 N ATOM 1801 CA GLU C 16 0.669 21.356 -0.803 1.00 0.00 C ATOM 1802 C GLU C 16 -0.672 21.844 -1.291 1.00 0.00 C ATOM 1803 O GLU C 16 -1.704 21.626 -0.655 1.00 0.00 O ATOM 1804 CB GLU C 16 0.673 21.383 0.730 1.00 0.00 C ATOM 1805 CG GLU C 16 1.842 22.137 1.349 1.00 0.00 C ATOM 1806 CD GLU C 16 1.598 23.633 1.398 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.629 24.276 0.333 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.356 24.170 2.499 1.00 0.00 O ATOM 0 H GLU C 16 1.922 23.020 -0.696 1.00 0.00 H new ATOM 0 HA GLU C 16 0.853 20.341 -1.154 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.257 21.835 1.074 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.684 20.357 1.098 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.017 21.766 2.359 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.746 21.937 0.774 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.653 22.501 -2.436 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.772 23.283 -2.890 1.00 0.00 C ATOM 1817 C ARG C 17 -1.798 23.225 -4.419 1.00 0.00 C ATOM 1818 O ARG C 17 -2.831 23.431 -5.049 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.639 24.728 -2.397 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.377 25.424 -2.886 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.073 26.673 -2.075 1.00 0.00 C ATOM 1822 NE ARG C 17 0.324 26.357 -0.702 1.00 0.00 N ATOM 1823 CZ ARG C 17 0.151 27.175 0.332 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -0.415 28.364 0.157 1.00 0.00 N ATOM 1825 NH2 ARG C 17 0.547 26.799 1.543 1.00 0.00 N ATOM 0 H ARG C 17 0.143 22.503 -3.073 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.705 22.885 -2.492 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.509 25.297 -2.726 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.648 24.734 -1.307 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.466 24.736 -2.823 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.493 25.691 -3.936 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.724 27.235 -2.562 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -0.953 27.316 -2.058 1.00 0.00 H new ATOM 0 HE ARG C 17 0.761 25.452 -0.527 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -0.719 28.652 -0.773 1.00 0.00 H new ATOM 0 HH12 ARG C 17 -0.546 28.989 0.953 1.00 0.00 H new ATOM 0 HH21 ARG C 17 0.982 25.886 1.677 1.00 0.00 H new ATOM 0 HH22 ARG C 17 0.416 27.423 2.339 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.625 22.931 -5.006 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.468 22.977 -6.461 1.00 0.00 C ATOM 1841 C ALA C 18 0.338 21.799 -7.001 1.00 0.00 C ATOM 1842 O ALA C 18 0.122 21.355 -8.125 1.00 0.00 O ATOM 1843 CB ALA C 18 0.176 24.290 -6.884 1.00 0.00 C ATOM 0 H ALA C 18 0.217 22.662 -4.497 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.468 22.907 -6.890 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.286 24.309 -7.968 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.453 25.122 -6.569 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.157 24.381 -6.418 1.00 0.00 H new ATOM 1849 N GLY C 19 1.264 21.293 -6.195 1.00 0.00 N ATOM 1850 CA GLY C 19 2.069 20.163 -6.616 1.00 0.00 C ATOM 1851 C GLY C 19 3.275 20.558 -7.453 1.00 0.00 C ATOM 1852 O GLY C 19 3.781 19.751 -8.227 1.00 0.00 O ATOM 0 H GLY C 19 1.471 21.644 -5.260 1.00 0.00 H new ATOM 0 HA2 GLY C 19 2.410 19.621 -5.734 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.446 19.477 -7.191 1.00 0.00 H new ATOM 1856 N GLU C 20 3.769 21.775 -7.259 1.00 0.00 N ATOM 1857 CA GLU C 20 4.904 22.266 -8.033 1.00 0.00 C ATOM 1858 C GLU C 20 5.814 23.132 -7.176 1.00 0.00 C ATOM 1859 O GLU C 20 5.447 23.563 -6.091 1.00 0.00 O ATOM 1860 CB GLU C 20 4.446 23.054 -9.272 1.00 0.00 C ATOM 1861 CG GLU C 20 3.357 24.089 -9.002 1.00 0.00 C ATOM 1862 CD GLU C 20 3.836 25.272 -8.176 1.00 0.00 C ATOM 1863 OE1 GLU C 20 4.569 26.130 -8.721 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.482 25.343 -6.981 1.00 0.00 O ATOM 0 H GLU C 20 3.404 22.438 -6.575 1.00 0.00 H new ATOM 0 HA GLU C 20 5.463 21.393 -8.371 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.310 23.559 -9.704 1.00 0.00 H new ATOM 0 HB3 GLU C 20 4.082 22.350 -10.020 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.969 24.453 -9.953 1.00 0.00 H new ATOM 0 HG3 GLU C 20 2.528 23.606 -8.484 1.00 0.00 H new ATOM 1871 N ILE C 21 7.013 23.345 -7.654 1.00 0.00 N ATOM 1872 CA ILE C 21 7.916 24.305 -7.065 1.00 0.00 C ATOM 1873 C ILE C 21 8.351 25.257 -8.152 1.00 0.00 C ATOM 1874 O ILE C 21 9.184 24.905 -8.985 1.00 0.00 O ATOM 1875 CB ILE C 21 9.166 23.640 -6.437 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.786 22.768 -5.236 1.00 0.00 C ATOM 1877 CG2 ILE C 21 10.188 24.691 -6.021 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.196 23.534 -4.067 1.00 0.00 C ATOM 0 H ILE C 21 7.393 22.857 -8.465 1.00 0.00 H new ATOM 0 HA ILE C 21 7.393 24.821 -6.260 1.00 0.00 H new ATOM 0 HB ILE C 21 9.614 22.999 -7.196 1.00 0.00 H new ATOM 0 HG12 ILE C 21 8.067 22.016 -5.562 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.673 22.235 -4.895 1.00 0.00 H new ATOM 0 HG21 ILE C 21 11.057 24.200 -5.583 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.497 25.264 -6.895 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.742 25.362 -5.287 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.956 22.840 -3.261 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.919 24.268 -3.711 1.00 0.00 H new ATOM 0 HD13 ILE C 21 7.288 24.045 -4.388 1.00 0.00 H new ATOM 1890 N GLU C 22 7.757 26.441 -8.159 1.00 0.00 N ATOM 1891 CA GLU C 22 8.086 27.452 -9.146 1.00 0.00 C ATOM 1892 C GLU C 22 7.729 26.964 -10.557 1.00 0.00 C ATOM 1893 O GLU C 22 8.566 26.996 -11.458 1.00 0.00 O ATOM 1894 CB GLU C 22 9.589 27.749 -9.045 1.00 0.00 C ATOM 1895 CG GLU C 22 9.986 29.134 -9.493 1.00 0.00 C ATOM 1896 CD GLU C 22 9.468 30.205 -8.556 1.00 0.00 C ATOM 1897 OE1 GLU C 22 9.975 30.298 -7.415 1.00 0.00 O ATOM 1898 OE2 GLU C 22 8.555 30.956 -8.956 1.00 0.00 O ATOM 0 H GLU C 22 7.042 26.724 -7.488 1.00 0.00 H new ATOM 0 HA GLU C 22 7.512 28.359 -8.955 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.905 27.611 -8.011 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.132 27.018 -9.644 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.073 29.198 -9.551 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.602 29.314 -10.497 1.00 0.00 H new ATOM 1905 N GLY C 23 6.494 26.482 -10.752 1.00 0.00 N ATOM 1906 CA GLY C 23 6.102 25.961 -12.061 1.00 0.00 C ATOM 1907 C GLY C 23 6.881 24.727 -12.462 1.00 0.00 C ATOM 1908 O GLY C 23 6.769 24.231 -13.581 1.00 0.00 O ATOM 0 H GLY C 23 5.768 26.443 -10.037 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.038 25.724 -12.048 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.247 26.736 -12.813 1.00 0.00 H new ATOM 1912 N THR C 24 7.670 24.260 -11.535 1.00 0.00 N ATOM 1913 CA THR C 24 8.670 23.253 -11.791 1.00 0.00 C ATOM 1914 C THR C 24 8.472 22.023 -10.896 1.00 0.00 C ATOM 1915 O THR C 24 8.065 22.150 -9.744 1.00 0.00 O ATOM 1916 CB THR C 24 10.030 23.946 -11.572 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.402 24.653 -12.758 1.00 0.00 O ATOM 1918 CG2 THR C 24 11.152 23.009 -11.144 1.00 0.00 C ATOM 0 H THR C 24 7.638 24.571 -10.564 1.00 0.00 H new ATOM 0 HA THR C 24 8.603 22.864 -12.807 1.00 0.00 H new ATOM 0 HB THR C 24 9.891 24.634 -10.738 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.266 25.095 -12.618 1.00 0.00 H new ATOM 0 HG21 THR C 24 12.072 23.579 -11.013 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.885 22.528 -10.203 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.303 22.248 -11.910 1.00 0.00 H new ATOM 1926 N PRO C 25 8.733 20.813 -11.437 1.00 0.00 N ATOM 1927 CA PRO C 25 8.504 19.542 -10.730 1.00 0.00 C ATOM 1928 C PRO C 25 9.187 19.507 -9.368 1.00 0.00 C ATOM 1929 O PRO C 25 10.391 19.742 -9.249 1.00 0.00 O ATOM 1930 CB PRO C 25 9.099 18.484 -11.671 1.00 0.00 C ATOM 1931 CG PRO C 25 9.977 19.253 -12.595 1.00 0.00 C ATOM 1932 CD PRO C 25 9.299 20.580 -12.770 1.00 0.00 C ATOM 0 HA PRO C 25 7.447 19.381 -10.518 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.666 17.735 -11.118 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.318 17.954 -12.216 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.977 19.374 -12.178 1.00 0.00 H new ATOM 0 HG3 PRO C 25 10.089 18.739 -13.550 1.00 0.00 H new ATOM 0 HD2 PRO C 25 10.002 21.362 -13.057 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.528 20.546 -13.540 1.00 0.00 H new ATOM 1940 N CYS C 26 8.398 19.213 -8.346 1.00 0.00 N ATOM 1941 CA CYS C 26 8.836 19.337 -6.971 1.00 0.00 C ATOM 1942 C CYS C 26 9.692 18.155 -6.493 1.00 0.00 C ATOM 1943 O CYS C 26 9.372 16.998 -6.761 1.00 0.00 O ATOM 1944 CB CYS C 26 7.609 19.496 -6.086 1.00 0.00 C ATOM 1945 SG CYS C 26 8.005 19.714 -4.339 1.00 0.00 S ATOM 0 H CYS C 26 7.439 18.883 -8.450 1.00 0.00 H new ATOM 0 HA CYS C 26 9.480 20.214 -6.905 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.032 20.355 -6.429 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.973 18.618 -6.199 1.00 0.00 H new ATOM 1950 N PRO C 27 10.771 18.474 -5.729 1.00 0.00 N ATOM 1951 CA PRO C 27 11.764 17.523 -5.195 1.00 0.00 C ATOM 1952 C PRO C 27 11.229 16.144 -4.807 1.00 0.00 C ATOM 1953 O PRO C 27 11.652 15.123 -5.346 1.00 0.00 O ATOM 1954 CB PRO C 27 12.229 18.237 -3.928 1.00 0.00 C ATOM 1955 CG PRO C 27 12.164 19.690 -4.241 1.00 0.00 C ATOM 1956 CD PRO C 27 11.134 19.857 -5.345 1.00 0.00 C ATOM 0 HA PRO C 27 12.517 17.302 -5.951 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.589 17.989 -3.081 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.242 17.939 -3.659 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.880 20.263 -3.358 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.138 20.060 -4.562 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.264 20.413 -4.995 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.545 20.408 -6.191 1.00 0.00 H new ATOM 1964 N ALA C 28 10.282 16.134 -3.879 1.00 0.00 N ATOM 1965 CA ALA C 28 9.908 14.905 -3.190 1.00 0.00 C ATOM 1966 C ALA C 28 8.422 14.613 -3.334 1.00 0.00 C ATOM 1967 O ALA C 28 7.943 13.557 -2.928 1.00 0.00 O ATOM 1968 CB ALA C 28 10.295 14.986 -1.719 1.00 0.00 C ATOM 0 H ALA C 28 9.760 16.960 -3.586 1.00 0.00 H new ATOM 0 HA ALA C 28 10.452 14.083 -3.655 1.00 0.00 H new ATOM 0 HB1 ALA C 28 10.010 14.062 -1.216 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.372 15.128 -1.633 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.780 15.826 -1.253 1.00 0.00 H new ATOM 1974 N CYS C 29 7.694 15.554 -3.910 1.00 0.00 N ATOM 1975 CA CYS C 29 6.274 15.369 -4.141 1.00 0.00 C ATOM 1976 C CYS C 29 5.952 15.682 -5.596 1.00 0.00 C ATOM 1977 O CYS C 29 5.720 16.835 -5.955 1.00 0.00 O ATOM 1978 CB CYS C 29 5.453 16.253 -3.176 1.00 0.00 C ATOM 1979 SG CYS C 29 5.554 18.042 -3.478 1.00 0.00 S ATOM 0 H CYS C 29 8.063 16.451 -4.225 1.00 0.00 H new ATOM 0 HA CYS C 29 6.003 14.332 -3.944 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.407 15.951 -3.234 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.786 16.055 -2.157 1.00 0.00 H new ATOM 1984 N SER C 30 5.981 14.655 -6.444 1.00 0.00 N ATOM 1985 CA SER C 30 5.725 14.804 -7.873 1.00 0.00 C ATOM 1986 C SER C 30 4.263 15.140 -8.193 1.00 0.00 C ATOM 1987 O SER C 30 3.611 14.451 -8.975 1.00 0.00 O ATOM 1988 CB SER C 30 6.129 13.505 -8.567 1.00 0.00 C ATOM 1989 OG SER C 30 5.674 12.378 -7.828 1.00 0.00 O ATOM 0 H SER C 30 6.183 13.697 -6.158 1.00 0.00 H new ATOM 0 HA SER C 30 6.314 15.646 -8.236 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.711 13.479 -9.573 1.00 0.00 H new ATOM 0 HB3 SER C 30 7.213 13.464 -8.671 1.00 0.00 H new ATOM 0 HG SER C 30 5.941 11.555 -8.289 1.00 0.00 H new ATOM 1995 N GLY C 31 3.752 16.188 -7.571 1.00 0.00 N ATOM 1996 CA GLY C 31 2.449 16.697 -7.929 1.00 0.00 C ATOM 1997 C GLY C 31 1.348 16.086 -7.103 1.00 0.00 C ATOM 1998 O GLY C 31 0.300 15.721 -7.630 1.00 0.00 O ATOM 0 H GLY C 31 4.219 16.697 -6.821 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.437 17.779 -7.802 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.261 16.498 -8.984 1.00 0.00 H new ATOM 2002 N LYS C 32 1.579 15.972 -5.801 1.00 0.00 N ATOM 2003 CA LYS C 32 0.584 15.425 -4.895 1.00 0.00 C ATOM 2004 C LYS C 32 0.195 16.474 -3.858 1.00 0.00 C ATOM 2005 O LYS C 32 -0.954 16.548 -3.428 1.00 0.00 O ATOM 2006 CB LYS C 32 1.123 14.168 -4.199 1.00 0.00 C ATOM 2007 CG LYS C 32 1.283 12.985 -5.139 1.00 0.00 C ATOM 2008 CD LYS C 32 2.713 12.800 -5.629 1.00 0.00 C ATOM 2009 CE LYS C 32 3.607 12.162 -4.573 1.00 0.00 C ATOM 2010 NZ LYS C 32 4.727 11.413 -5.205 1.00 0.00 N ATOM 0 H LYS C 32 2.450 16.253 -5.351 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.299 15.148 -5.471 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.088 14.397 -3.746 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.448 13.891 -3.389 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.960 12.077 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS C 32 0.626 13.120 -5.998 1.00 0.00 H new ATOM 0 HD2 LYS C 32 2.711 12.178 -6.524 1.00 0.00 H new ATOM 0 HD3 LYS C 32 3.125 13.768 -5.915 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.006 12.934 -3.915 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.018 11.487 -3.952 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 5.559 11.440 -4.581 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 4.441 10.425 -5.358 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 4.965 11.850 -6.118 1.00 0.00 H new ATOM 2024 N GLY C 33 1.174 17.280 -3.446 1.00 0.00 N ATOM 2025 CA GLY C 33 0.934 18.326 -2.489 1.00 0.00 C ATOM 2026 C GLY C 33 1.604 18.012 -1.175 1.00 0.00 C ATOM 2027 O GLY C 33 2.200 18.882 -0.541 1.00 0.00 O ATOM 0 H GLY C 33 2.139 17.217 -3.770 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.309 19.273 -2.877 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.138 18.446 -2.336 1.00 0.00 H new ATOM 2031 N VAL C 34 1.568 16.747 -0.802 1.00 0.00 N ATOM 2032 CA VAL C 34 2.133 16.304 0.457 1.00 0.00 C ATOM 2033 C VAL C 34 3.356 15.424 0.229 1.00 0.00 C ATOM 2034 O VAL C 34 3.587 14.931 -0.881 1.00 0.00 O ATOM 2035 CB VAL C 34 1.089 15.519 1.283 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.063 16.421 1.701 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.566 14.331 0.491 1.00 0.00 C ATOM 0 H VAL C 34 1.149 16.002 -1.359 1.00 0.00 H new ATOM 0 HA VAL C 34 2.433 17.194 1.009 1.00 0.00 H new ATOM 0 HB VAL C 34 1.580 15.150 2.184 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.784 15.845 2.281 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.319 17.241 2.309 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.550 16.824 0.813 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.168 13.790 1.088 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.097 14.684 -0.427 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.393 13.666 0.244 1.00 0.00 H new ATOM 2047 N ILE C 35 4.147 15.266 1.275 1.00 0.00 N ATOM 2048 CA ILE C 35 5.284 14.362 1.262 1.00 0.00 C ATOM 2049 C ILE C 35 5.174 13.374 2.415 1.00 0.00 C ATOM 2050 O ILE C 35 4.435 13.602 3.367 1.00 0.00 O ATOM 2051 CB ILE C 35 6.632 15.109 1.369 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.586 16.138 2.506 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.984 15.769 0.048 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.889 16.878 2.722 1.00 0.00 C ATOM 0 H ILE C 35 4.020 15.761 2.158 1.00 0.00 H new ATOM 0 HA ILE C 35 5.264 13.839 0.306 1.00 0.00 H new ATOM 0 HB ILE C 35 7.413 14.385 1.600 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.800 16.863 2.294 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.311 15.630 3.431 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.937 16.290 0.144 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.063 15.009 -0.729 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.206 16.483 -0.221 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.773 17.586 3.542 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.676 16.165 2.966 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.157 17.416 1.813 1.00 0.00 H new ATOM 2066 N LEU C 36 5.914 12.286 2.325 1.00 0.00 N ATOM 2067 CA LEU C 36 5.794 11.204 3.292 1.00 0.00 C ATOM 2068 C LEU C 36 6.719 11.385 4.486 1.00 0.00 C ATOM 2069 O LEU C 36 7.671 12.167 4.449 1.00 0.00 O ATOM 2070 CB LEU C 36 6.085 9.862 2.619 1.00 0.00 C ATOM 2071 CG LEU C 36 5.239 9.575 1.379 1.00 0.00 C ATOM 2072 CD1 LEU C 36 5.943 10.041 0.112 1.00 0.00 C ATOM 2073 CD2 LEU C 36 4.905 8.102 1.305 1.00 0.00 C ATOM 0 H LEU C 36 6.606 12.125 1.593 1.00 0.00 H new ATOM 0 HA LEU C 36 4.769 11.222 3.663 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.138 9.832 2.339 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.925 9.064 3.344 1.00 0.00 H new ATOM 0 HG LEU C 36 4.309 10.137 1.461 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.317 9.823 -0.753 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.122 11.115 0.169 1.00 0.00 H new ATOM 0 HD13 LEU C 36 6.895 9.519 0.012 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.302 7.910 0.418 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.826 7.522 1.250 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.345 7.811 2.194 1.00 0.00 H new ATOM 2085 N THR C 37 6.426 10.630 5.536 1.00 0.00 N ATOM 2086 CA THR C 37 7.245 10.596 6.735 1.00 0.00 C ATOM 2087 C THR C 37 8.029 9.291 6.745 1.00 0.00 C ATOM 2088 O THR C 37 7.894 8.509 5.815 1.00 0.00 O ATOM 2089 CB THR C 37 6.368 10.670 8.003 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.488 9.535 8.062 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.538 11.944 8.021 1.00 0.00 C ATOM 0 H THR C 37 5.609 10.021 5.578 1.00 0.00 H new ATOM 0 HA THR C 37 7.918 11.453 6.732 1.00 0.00 H new ATOM 0 HB THR C 37 7.032 10.670 8.868 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.797 9.692 8.739 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.930 11.969 8.925 1.00 0.00 H new ATOM 0 HG22 THR C 37 6.200 12.810 8.004 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.888 11.967 7.146 1.00 0.00 H new ATOM 2099 N ALA C 38 8.831 9.037 7.770 1.00 0.00 N ATOM 2100 CA ALA C 38 9.595 7.792 7.822 1.00 0.00 C ATOM 2101 C ALA C 38 8.661 6.588 7.819 1.00 0.00 C ATOM 2102 O ALA C 38 8.896 5.608 7.107 1.00 0.00 O ATOM 2103 CB ALA C 38 10.509 7.768 9.034 1.00 0.00 C ATOM 0 H ALA C 38 8.970 9.661 8.564 1.00 0.00 H new ATOM 0 HA ALA C 38 10.220 7.738 6.931 1.00 0.00 H new ATOM 0 HB1 ALA C 38 11.067 6.832 9.051 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.206 8.605 8.981 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.912 7.850 9.942 1.00 0.00 H new ATOM 2109 N GLN C 39 7.594 6.667 8.608 1.00 0.00 N ATOM 2110 CA GLN C 39 6.560 5.642 8.585 1.00 0.00 C ATOM 2111 C GLN C 39 5.934 5.536 7.196 1.00 0.00 C ATOM 2112 O GLN C 39 5.762 4.436 6.670 1.00 0.00 O ATOM 2113 CB GLN C 39 5.480 5.930 9.630 1.00 0.00 C ATOM 2114 CG GLN C 39 4.268 5.023 9.497 1.00 0.00 C ATOM 2115 CD GLN C 39 3.293 5.154 10.644 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.186 6.203 11.277 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.563 4.083 10.907 1.00 0.00 N ATOM 0 H GLN C 39 7.424 7.426 9.267 1.00 0.00 H new ATOM 0 HA GLN C 39 7.030 4.689 8.829 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.906 5.814 10.626 1.00 0.00 H new ATOM 0 HB3 GLN C 39 5.162 6.968 9.539 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.753 5.251 8.564 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.603 3.988 9.431 1.00 0.00 H new ATOM 0 HE21 GLN C 39 2.686 3.234 10.355 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.877 4.106 11.662 1.00 0.00 H new ATOM 2126 N GLY C 40 5.623 6.682 6.595 1.00 0.00 N ATOM 2127 CA GLY C 40 5.035 6.683 5.270 1.00 0.00 C ATOM 2128 C GLY C 40 6.000 6.156 4.230 1.00 0.00 C ATOM 2129 O GLY C 40 5.599 5.523 3.259 1.00 0.00 O ATOM 0 H GLY C 40 5.768 7.606 7.002 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.132 6.072 5.272 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.733 7.697 5.006 1.00 0.00 H new ATOM 2133 N TYR C 41 7.280 6.394 4.455 1.00 0.00 N ATOM 2134 CA TYR C 41 8.320 5.915 3.566 1.00 0.00 C ATOM 2135 C TYR C 41 8.472 4.409 3.662 1.00 0.00 C ATOM 2136 O TYR C 41 8.770 3.750 2.668 1.00 0.00 O ATOM 2137 CB TYR C 41 9.647 6.594 3.913 1.00 0.00 C ATOM 2138 CG TYR C 41 9.993 7.768 3.023 1.00 0.00 C ATOM 2139 CD1 TYR C 41 9.537 9.048 3.310 1.00 0.00 C ATOM 2140 CD2 TYR C 41 10.785 7.592 1.895 1.00 0.00 C ATOM 2141 CE1 TYR C 41 9.862 10.119 2.499 1.00 0.00 C ATOM 2142 CE2 TYR C 41 11.112 8.657 1.080 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.648 9.917 1.384 1.00 0.00 C ATOM 2144 OH TYR C 41 10.978 10.981 0.577 1.00 0.00 O ATOM 0 H TYR C 41 7.625 6.923 5.256 1.00 0.00 H new ATOM 0 HA TYR C 41 8.037 6.163 2.543 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.608 6.935 4.947 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.447 5.856 3.850 1.00 0.00 H new ATOM 0 HD1 TYR C 41 8.919 9.209 4.181 1.00 0.00 H new ATOM 0 HD2 TYR C 41 11.151 6.605 1.652 1.00 0.00 H new ATOM 0 HE1 TYR C 41 9.502 11.109 2.737 1.00 0.00 H new ATOM 0 HE2 TYR C 41 11.729 8.502 0.207 1.00 0.00 H new ATOM 0 HH TYR C 41 11.537 10.668 -0.164 1.00 0.00 H new ATOM 2154 N THR C 42 8.230 3.857 4.837 1.00 0.00 N ATOM 2155 CA THR C 42 8.263 2.414 5.010 1.00 0.00 C ATOM 2156 C THR C 42 7.078 1.774 4.299 1.00 0.00 C ATOM 2157 O THR C 42 7.166 0.655 3.792 1.00 0.00 O ATOM 2158 CB THR C 42 8.213 2.044 6.504 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.216 2.776 7.217 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.424 0.551 6.710 1.00 0.00 C ATOM 0 H THR C 42 8.009 4.382 5.683 1.00 0.00 H new ATOM 0 HA THR C 42 9.194 2.043 4.581 1.00 0.00 H new ATOM 0 HB THR C 42 7.226 2.304 6.886 1.00 0.00 H new ATOM 0 HG1 THR C 42 8.981 3.727 7.228 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.383 0.321 7.775 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.642 -0.002 6.189 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.398 0.263 6.314 1.00 0.00 H new ATOM 2168 N LEU C 43 5.981 2.513 4.228 1.00 0.00 N ATOM 2169 CA LEU C 43 4.775 2.003 3.603 1.00 0.00 C ATOM 2170 C LEU C 43 4.806 2.255 2.106 1.00 0.00 C ATOM 2171 O LEU C 43 4.184 1.524 1.345 1.00 0.00 O ATOM 2172 CB LEU C 43 3.513 2.643 4.204 1.00 0.00 C ATOM 2173 CG LEU C 43 2.802 1.852 5.316 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.713 1.654 6.515 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.533 2.573 5.740 1.00 0.00 C ATOM 0 H LEU C 43 5.903 3.462 4.594 1.00 0.00 H new ATOM 0 HA LEU C 43 4.740 0.930 3.792 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.783 3.621 4.601 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.800 2.813 3.397 1.00 0.00 H new ATOM 0 HG LEU C 43 2.542 0.870 4.920 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.184 1.092 7.285 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.602 1.102 6.209 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.008 2.625 6.913 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.037 2.005 6.527 1.00 0.00 H new ATOM 0 HD22 LEU C 43 1.786 3.566 6.113 1.00 0.00 H new ATOM 0 HD23 LEU C 43 0.864 2.666 4.884 1.00 0.00 H new ATOM 2187 N LEU C 44 5.556 3.260 1.661 1.00 0.00 N ATOM 2188 CA LEU C 44 5.580 3.592 0.249 1.00 0.00 C ATOM 2189 C LEU C 44 6.478 2.612 -0.492 1.00 0.00 C ATOM 2190 O LEU C 44 6.130 2.132 -1.564 1.00 0.00 O ATOM 2191 CB LEU C 44 6.026 5.063 0.042 1.00 0.00 C ATOM 2192 CG LEU C 44 7.526 5.340 -0.205 1.00 0.00 C ATOM 2193 CD1 LEU C 44 7.932 4.994 -1.634 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.854 6.801 0.054 1.00 0.00 C ATOM 0 H LEU C 44 6.145 3.848 2.251 1.00 0.00 H new ATOM 0 HA LEU C 44 4.575 3.504 -0.163 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.469 5.465 -0.804 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.722 5.631 0.922 1.00 0.00 H new ATOM 0 HG LEU C 44 8.083 4.707 0.486 1.00 0.00 H new ATOM 0 HD11 LEU C 44 8.993 5.202 -1.771 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.742 3.937 -1.820 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.351 5.596 -2.333 1.00 0.00 H new ATOM 0 HD21 LEU C 44 8.915 6.973 -0.126 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.266 7.430 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.617 7.049 1.088 1.00 0.00 H new ATOM 2206 N ASP C 45 7.621 2.294 0.099 1.00 0.00 N ATOM 2207 CA ASP C 45 8.569 1.390 -0.534 1.00 0.00 C ATOM 2208 C ASP C 45 8.032 -0.031 -0.515 1.00 0.00 C ATOM 2209 O ASP C 45 8.392 -0.864 -1.351 1.00 0.00 O ATOM 2210 CB ASP C 45 9.918 1.457 0.177 1.00 0.00 C ATOM 2211 CG ASP C 45 10.972 0.622 -0.516 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.569 1.115 -1.496 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.198 -0.530 -0.097 1.00 0.00 O ATOM 0 H ASP C 45 7.913 2.646 1.011 1.00 0.00 H new ATOM 0 HA ASP C 45 8.707 1.697 -1.571 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.251 2.494 0.223 1.00 0.00 H new ATOM 0 HB3 ASP C 45 9.802 1.113 1.205 1.00 0.00 H new ATOM 2218 N PHE C 46 7.134 -0.289 0.418 1.00 0.00 N ATOM 2219 CA PHE C 46 6.454 -1.566 0.491 1.00 0.00 C ATOM 2220 C PHE C 46 5.411 -1.679 -0.603 1.00 0.00 C ATOM 2221 O PHE C 46 5.278 -2.725 -1.236 1.00 0.00 O ATOM 2222 CB PHE C 46 5.763 -1.661 1.850 1.00 0.00 C ATOM 2223 CG PHE C 46 5.121 -2.981 2.150 1.00 0.00 C ATOM 2224 CD1 PHE C 46 3.827 -3.248 1.734 1.00 0.00 C ATOM 2225 CD2 PHE C 46 5.806 -3.946 2.867 1.00 0.00 C ATOM 2226 CE1 PHE C 46 3.230 -4.455 2.026 1.00 0.00 C ATOM 2227 CE2 PHE C 46 5.213 -5.156 3.160 1.00 0.00 C ATOM 2228 CZ PHE C 46 3.924 -5.409 2.739 1.00 0.00 C ATOM 0 H PHE C 46 6.858 0.376 1.141 1.00 0.00 H new ATOM 0 HA PHE C 46 7.179 -2.370 0.364 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.496 -1.447 2.628 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.001 -0.884 1.907 1.00 0.00 H new ATOM 0 HD1 PHE C 46 3.281 -2.503 1.175 1.00 0.00 H new ATOM 0 HD2 PHE C 46 6.814 -3.750 3.200 1.00 0.00 H new ATOM 0 HE1 PHE C 46 2.221 -4.653 1.697 1.00 0.00 H new ATOM 0 HE2 PHE C 46 5.757 -5.904 3.718 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.458 -6.356 2.968 1.00 0.00 H new ATOM 2238 N ILE C 47 4.689 -0.607 -0.858 1.00 0.00 N ATOM 2239 CA ILE C 47 3.661 -0.673 -1.871 1.00 0.00 C ATOM 2240 C ILE C 47 4.288 -0.591 -3.254 1.00 0.00 C ATOM 2241 O ILE C 47 3.818 -1.234 -4.190 1.00 0.00 O ATOM 2242 CB ILE C 47 2.583 0.418 -1.705 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.166 1.811 -1.962 1.00 0.00 C ATOM 2244 CG2 ILE C 47 1.993 0.336 -0.309 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.165 2.935 -1.819 1.00 0.00 C ATOM 0 H ILE C 47 4.791 0.295 -0.392 1.00 0.00 H new ATOM 0 HA ILE C 47 3.156 -1.632 -1.751 1.00 0.00 H new ATOM 0 HB ILE C 47 1.796 0.249 -2.440 1.00 0.00 H new ATOM 0 HG12 ILE C 47 3.990 1.982 -1.269 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.585 1.838 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.231 1.106 -0.190 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.543 -0.646 -0.161 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.781 0.488 0.429 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.657 3.887 -2.017 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.352 2.791 -2.531 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.763 2.938 -0.806 1.00 0.00 H new ATOM 2257 N GLN C 48 5.376 0.167 -3.354 1.00 0.00 N ATOM 2258 CA GLN C 48 6.195 0.183 -4.554 1.00 0.00 C ATOM 2259 C GLN C 48 6.547 -1.244 -4.942 1.00 0.00 C ATOM 2260 O GLN C 48 6.044 -1.778 -5.909 1.00 0.00 O ATOM 2261 CB GLN C 48 7.495 0.958 -4.308 1.00 0.00 C ATOM 2262 CG GLN C 48 7.357 2.474 -4.326 1.00 0.00 C ATOM 2263 CD GLN C 48 7.328 3.038 -5.735 1.00 0.00 C ATOM 2264 OE1 GLN C 48 7.903 2.462 -6.658 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.677 4.178 -5.908 1.00 0.00 N ATOM 0 H GLN C 48 5.710 0.781 -2.611 1.00 0.00 H new ATOM 0 HA GLN C 48 5.632 0.668 -5.352 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.902 0.657 -3.342 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.223 0.666 -5.065 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.443 2.759 -3.805 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.188 2.918 -3.777 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.213 4.625 -5.118 1.00 0.00 H new ATOM 0 HE22 GLN C 48 6.640 4.609 -6.832 1.00 0.00 H new ATOM 2274 N LYS C 49 7.279 -1.890 -4.065 1.00 0.00 N ATOM 2275 CA LYS C 49 8.027 -3.098 -4.388 1.00 0.00 C ATOM 2276 C LYS C 49 7.141 -4.345 -4.472 1.00 0.00 C ATOM 2277 O LYS C 49 7.624 -5.441 -4.755 1.00 0.00 O ATOM 2278 CB LYS C 49 9.094 -3.258 -3.304 1.00 0.00 C ATOM 2279 CG LYS C 49 10.020 -4.449 -3.469 1.00 0.00 C ATOM 2280 CD LYS C 49 10.699 -4.842 -2.156 1.00 0.00 C ATOM 2281 CE LYS C 49 11.361 -3.662 -1.451 1.00 0.00 C ATOM 2282 NZ LYS C 49 10.435 -2.964 -0.515 1.00 0.00 N ATOM 0 H LYS C 49 7.378 -1.594 -3.094 1.00 0.00 H new ATOM 0 HA LYS C 49 8.472 -2.997 -5.378 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.698 -2.351 -3.277 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.596 -3.338 -2.338 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.452 -5.298 -3.850 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.781 -4.214 -4.213 1.00 0.00 H new ATOM 0 HD2 LYS C 49 9.960 -5.288 -1.490 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.450 -5.606 -2.356 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.232 -4.015 -0.899 1.00 0.00 H new ATOM 0 HE3 LYS C 49 11.721 -2.953 -2.196 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 10.971 -2.284 0.061 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 9.707 -2.459 -1.059 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 9.980 -3.662 0.108 1.00 0.00 H new ATOM 2296 N HIS C 50 5.846 -4.215 -4.209 1.00 0.00 N ATOM 2297 CA HIS C 50 4.982 -5.352 -4.511 1.00 0.00 C ATOM 2298 C HIS C 50 3.955 -5.062 -5.603 1.00 0.00 C ATOM 2299 O HIS C 50 3.256 -5.979 -6.030 1.00 0.00 O ATOM 2300 CB HIS C 50 4.268 -5.808 -3.235 1.00 0.00 C ATOM 2301 CG HIS C 50 5.214 -6.068 -2.104 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.191 -5.353 -0.932 1.00 0.00 N ATOM 2303 CD2 HIS C 50 6.248 -6.933 -1.991 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.167 -5.760 -0.151 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.831 -6.718 -0.766 1.00 0.00 N ATOM 0 H HIS C 50 5.392 -3.392 -3.813 1.00 0.00 H new ATOM 0 HA HIS C 50 5.627 -6.143 -4.894 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.549 -5.046 -2.934 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.702 -6.715 -3.445 1.00 0.00 H new ATOM 0 HD1 HIS C 50 4.520 -4.619 -0.703 1.00 0.00 H new ATOM 0 HD2 HIS C 50 6.558 -7.659 -2.728 1.00 0.00 H new ATOM 0 HE1 HIS C 50 6.388 -5.373 0.833 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.641 -7.215 -0.395 1.00 0.00 H new ATOM 2314 N LEU C 51 3.879 -3.821 -6.085 1.00 0.00 N ATOM 2315 CA LEU C 51 2.963 -3.502 -7.189 1.00 0.00 C ATOM 2316 C LEU C 51 3.669 -2.766 -8.332 1.00 0.00 C ATOM 2317 O LEU C 51 3.509 -3.126 -9.498 1.00 0.00 O ATOM 2318 CB LEU C 51 1.762 -2.662 -6.721 1.00 0.00 C ATOM 2319 CG LEU C 51 0.789 -3.340 -5.746 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.541 -2.604 -5.709 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.558 -4.787 -6.122 1.00 0.00 C ATOM 0 H LEU C 51 4.427 -3.033 -5.740 1.00 0.00 H new ATOM 0 HA LEU C 51 2.603 -4.463 -7.556 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.143 -1.757 -6.248 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.200 -2.350 -7.601 1.00 0.00 H new ATOM 0 HG LEU C 51 1.243 -3.304 -4.756 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.214 -3.103 -5.011 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.379 -1.576 -5.385 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -0.985 -2.605 -6.704 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -0.135 -5.241 -5.414 1.00 0.00 H new ATOM 0 HD22 LEU C 51 0.137 -4.839 -7.126 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.506 -5.325 -6.098 1.00 0.00 H new ATOM 2333 N ASN C 52 4.448 -1.746 -7.996 1.00 0.00 N ATOM 2334 CA ASN C 52 5.058 -0.870 -9.001 1.00 0.00 C ATOM 2335 C ASN C 52 6.559 -1.121 -9.153 1.00 0.00 C ATOM 2336 O ASN C 52 7.151 -0.788 -10.179 1.00 0.00 O ATOM 2337 CB ASN C 52 4.808 0.597 -8.637 1.00 0.00 C ATOM 2338 CG ASN C 52 3.543 1.150 -9.269 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.576 0.425 -9.498 1.00 0.00 O ATOM 2340 ND2 ASN C 52 3.542 2.441 -9.566 1.00 0.00 N ATOM 0 H ASN C 52 4.676 -1.500 -7.033 1.00 0.00 H new ATOM 0 HA ASN C 52 4.590 -1.098 -9.959 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.739 0.692 -7.553 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.661 1.197 -8.956 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.721 2.864 -9.999 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.362 3.012 -9.362 1.00 0.00 H new ATOM 2347 N LYS C 53 7.165 -1.698 -8.133 1.00 0.00 N ATOM 2348 CA LYS C 53 8.564 -2.065 -8.171 1.00 0.00 C ATOM 2349 C LYS C 53 8.690 -3.579 -8.241 1.00 0.00 C ATOM 2350 O LYS C 53 8.697 -4.227 -7.182 1.00 0.00 O ATOM 2351 CB LYS C 53 9.304 -1.527 -6.936 1.00 0.00 C ATOM 2352 CG LYS C 53 10.144 -0.295 -7.235 1.00 0.00 C ATOM 2353 CD LYS C 53 11.261 -0.104 -6.216 1.00 0.00 C ATOM 2354 CE LYS C 53 10.784 0.607 -4.963 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.916 0.935 -4.058 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.754 -4.117 -9.367 1.00 0.00 O ATOM 0 H LYS C 53 6.699 -1.925 -7.255 1.00 0.00 H new ATOM 0 HA LYS C 53 9.019 -1.622 -9.057 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.577 -1.285 -6.161 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.948 -2.310 -6.535 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.575 -0.383 -8.232 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.504 0.587 -7.241 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.672 -1.076 -5.945 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.070 0.469 -6.670 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.261 1.522 -5.240 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.067 -0.023 -4.437 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.688 0.627 -3.091 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.774 0.446 -4.384 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.079 1.962 -4.065 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -20.147 -4.433 -2.881 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 13.755 -15.240 -3.152 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.782 19.665 -2.641 1.00 0.00 ZN