USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 989 hydrogens (19 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 168 HIS : no HE2:sc= -0.526 K(o=-1.1,f=-13!) USER MOD Set 1.2: A 169 HIS :FLIP no HD1:sc= -0.608 F(o=-3.2,f=-1.1) USER MOD Set 2.1: A 81 MET CE :methyl -156:sc= -1.72 (180deg=-3.49!) USER MOD Set 2.2: A 153 MET CE :methyl -108:sc= -8.42! (180deg=-10.6!) USER MOD Set 3.1: A 35 SER OG : rot -122:sc= -2.29! USER MOD Set 3.2: A 71 THR OG1 : rot 45:sc= 0.00735 USER MOD Set 4.1: A 1 MET CE :methyl -156:sc= -6.52! (180deg=-8.29!) USER MOD Set 4.2: A 6 LYS NZ :NH3+ -179:sc= -0.275 (180deg=-0.0778) USER MOD Single : A 1 MET N :NH3+ -134:sc= 0.0257 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.46) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.402 USER MOD Single : A 16 GLN :FLIP amide:sc= -1.57 F(o=-2.5,f=-1.6) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -0.038 K(o=-0.038,f=-1.3!) USER MOD Single : A 21 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.208) USER MOD Single : A 37 SER OG : rot 180:sc= 0.00604 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.00798 USER MOD Single : A 39 LYS NZ :NH3+ 144:sc= -0.336 (180deg=-1.19) USER MOD Single : A 43 LYS NZ :NH3+ -143:sc= -1.7 (180deg=-3.58!) USER MOD Single : A 45 MET CE :methyl 161:sc= -6.83! (180deg=-9.78!) USER MOD Single : A 47 MET CE :methyl -118:sc= -6.67! (180deg=-8.11!) USER MOD Single : A 50 GLN : amide:sc= -0.575 K(o=-0.58,f=-4.1!) USER MOD Single : A 51 ASN : amide:sc= -0.544 K(o=-0.54,f=-2.2) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.38 USER MOD Single : A 58 GLN : amide:sc= -0.718 X(o=-0.72,f=-0.24) USER MOD Single : A 60 MET CE :methyl -168:sc= -4.92! (180deg=-5.44!) USER MOD Single : A 80 MET CE :methyl -138:sc= -4.38! (180deg=-8.57!) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -147:sc= -7.74! (180deg=-10!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ -118:sc= -0.0817 (180deg=-1.51) USER MOD Single : A 142 THR OG1 : rot -144:sc= 0.16! USER MOD Single : A 149 SER OG : rot -78:sc= 0.644 USER MOD Single : A 154 MET CE :methyl -110:sc= -14.1! (180deg=-20.7!) USER MOD Single : A 155 GLN : amide:sc= -0.636 K(o=-0.64,f=-1.1) USER MOD Single : A 163 LYS NZ :NH3+ 156:sc= -0.0893 (180deg=-0.7) USER MOD Single : A 165 HIS :FLIP no HD1:sc= -0.789 F(o=-1.4,f=-0.79) USER MOD Single : A 166 HIS : no HD1:sc= -0.702 K(o=-0.7,f=-3.7!) USER MOD Single : A 167 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=-0.46) USER MOD Single : A 170 HIS : no HE2:sc= -0.969 K(o=-0.97,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.950 8.507 18.992 1.00 0.00 N ATOM 2 CA MET A 1 -4.889 9.308 18.155 1.00 0.00 C ATOM 3 C MET A 1 -5.884 8.374 17.476 1.00 0.00 C ATOM 4 O MET A 1 -5.891 7.169 17.730 1.00 0.00 O ATOM 5 CB MET A 1 -4.093 10.078 17.099 1.00 0.00 C ATOM 6 CG MET A 1 -4.273 11.581 17.314 1.00 0.00 C ATOM 7 SD MET A 1 -5.279 12.268 15.975 1.00 0.00 S ATOM 8 CE MET A 1 -3.921 12.968 15.002 1.00 0.00 C ATOM 0 H1 MET A 1 -3.847 8.956 19.925 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.325 7.544 19.111 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.022 8.461 18.525 1.00 0.00 H new ATOM 0 HA MET A 1 -5.432 10.015 18.783 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.037 9.816 17.162 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.431 9.800 16.101 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.753 11.767 18.275 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.301 12.074 17.342 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.299 13.781 14.382 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.152 13.351 15.673 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.493 12.194 14.365 1.00 0.00 H new ATOM 20 N ASP A 2 -6.721 8.935 16.607 1.00 0.00 N ATOM 21 CA ASP A 2 -7.711 8.138 15.893 1.00 0.00 C ATOM 22 C ASP A 2 -7.156 7.662 14.551 1.00 0.00 C ATOM 23 O ASP A 2 -6.891 8.457 13.654 1.00 0.00 O ATOM 24 CB ASP A 2 -8.984 8.964 15.659 1.00 0.00 C ATOM 25 CG ASP A 2 -9.838 8.974 16.922 1.00 0.00 C ATOM 26 OD1 ASP A 2 -9.523 8.227 17.834 1.00 0.00 O ATOM 27 OD2 ASP A 2 -10.801 9.723 16.957 1.00 0.00 O1- ATOM 0 H ASP A 2 -6.733 9.930 16.382 1.00 0.00 H new ATOM 0 HA ASP A 2 -7.951 7.267 16.502 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -8.720 9.984 15.381 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -9.552 8.544 14.829 1.00 0.00 H new ATOM 32 N ASP A 3 -6.985 6.353 14.416 1.00 0.00 N ATOM 33 CA ASP A 3 -6.466 5.791 13.177 1.00 0.00 C ATOM 34 C ASP A 3 -7.424 6.065 12.027 1.00 0.00 C ATOM 35 O ASP A 3 -6.999 6.357 10.911 1.00 0.00 O ATOM 36 CB ASP A 3 -6.276 4.297 13.329 1.00 0.00 C ATOM 37 CG ASP A 3 -5.126 3.997 14.288 1.00 0.00 C ATOM 38 OD1 ASP A 3 -4.353 4.898 14.562 1.00 0.00 O ATOM 39 OD2 ASP A 3 -5.045 2.867 14.747 1.00 0.00 O1- ATOM 0 H ASP A 3 -7.196 5.667 15.141 1.00 0.00 H new ATOM 0 HA ASP A 3 -5.507 6.260 12.959 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -7.195 3.844 13.701 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -6.072 3.850 12.356 1.00 0.00 H new ATOM 44 N ILE A 4 -8.722 5.969 12.300 1.00 0.00 N ATOM 45 CA ILE A 4 -9.709 6.214 11.263 1.00 0.00 C ATOM 46 C ILE A 4 -9.462 7.584 10.637 1.00 0.00 C ATOM 47 O ILE A 4 -9.421 7.734 9.414 1.00 0.00 O ATOM 48 CB ILE A 4 -11.116 6.152 11.868 1.00 0.00 C ATOM 49 CG1 ILE A 4 -12.156 6.339 10.750 1.00 0.00 C ATOM 50 CG2 ILE A 4 -11.263 7.234 12.944 1.00 0.00 C ATOM 51 CD1 ILE A 4 -12.502 7.820 10.596 1.00 0.00 C ATOM 0 H ILE A 4 -9.106 5.728 13.214 1.00 0.00 H new ATOM 0 HA ILE A 4 -9.624 5.451 10.489 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.279 5.182 12.337 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -11.765 5.949 9.810 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -13.056 5.769 10.981 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -12.264 7.188 13.372 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -10.525 7.069 13.729 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -11.105 8.215 12.497 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -13.239 7.941 9.802 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.913 8.197 11.533 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -11.601 8.380 10.343 1.00 0.00 H new ATOM 63 N TYR A 5 -9.266 8.580 11.482 1.00 0.00 N ATOM 64 CA TYR A 5 -9.002 9.914 10.990 1.00 0.00 C ATOM 65 C TYR A 5 -7.614 9.966 10.382 1.00 0.00 C ATOM 66 O TYR A 5 -7.357 10.708 9.433 1.00 0.00 O ATOM 67 CB TYR A 5 -9.127 10.931 12.125 1.00 0.00 C ATOM 68 CG TYR A 5 -10.551 10.928 12.654 1.00 0.00 C ATOM 69 CD1 TYR A 5 -10.824 11.434 13.928 1.00 0.00 C ATOM 70 CD2 TYR A 5 -11.595 10.418 11.869 1.00 0.00 C ATOM 71 CE1 TYR A 5 -12.134 11.430 14.414 1.00 0.00 C ATOM 72 CE2 TYR A 5 -12.908 10.416 12.362 1.00 0.00 C ATOM 73 CZ TYR A 5 -13.176 10.922 13.634 1.00 0.00 C ATOM 74 OH TYR A 5 -14.468 10.923 14.122 1.00 0.00 O ATOM 0 H TYR A 5 -9.285 8.490 12.498 1.00 0.00 H new ATOM 0 HA TYR A 5 -9.735 10.165 10.223 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -8.430 10.685 12.926 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -8.863 11.926 11.767 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -10.023 11.828 14.536 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -11.388 10.026 10.884 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -12.342 11.822 15.399 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -13.711 10.023 11.757 1.00 0.00 H new ATOM 0 HH TYR A 5 -15.071 10.536 13.453 1.00 0.00 H new ATOM 84 N LYS A 6 -6.720 9.161 10.938 1.00 0.00 N ATOM 85 CA LYS A 6 -5.361 9.120 10.446 1.00 0.00 C ATOM 86 C LYS A 6 -5.380 8.766 8.961 1.00 0.00 C ATOM 87 O LYS A 6 -4.716 9.404 8.134 1.00 0.00 O ATOM 88 CB LYS A 6 -4.551 8.072 11.243 1.00 0.00 C ATOM 89 CG LYS A 6 -3.053 8.373 11.095 1.00 0.00 C ATOM 90 CD LYS A 6 -2.687 9.585 11.960 1.00 0.00 C ATOM 91 CE LYS A 6 -2.533 10.830 11.075 1.00 0.00 C ATOM 92 NZ LYS A 6 -2.799 12.051 11.887 1.00 0.00 N1+ ATOM 0 H LYS A 6 -6.913 8.536 11.721 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.888 10.093 10.575 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -4.837 8.097 12.295 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -4.771 7.069 10.876 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.465 7.506 11.398 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.813 8.572 10.051 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -3.460 9.754 12.710 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.758 9.393 12.497 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -1.527 10.870 10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.226 10.780 10.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.712 12.894 11.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -3.761 12.004 12.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.110 12.108 12.664 1.00 0.00 H new ATOM 106 N ALA A 7 -6.185 7.772 8.633 1.00 0.00 N ATOM 107 CA ALA A 7 -6.337 7.353 7.259 1.00 0.00 C ATOM 108 C ALA A 7 -6.951 8.485 6.458 1.00 0.00 C ATOM 109 O ALA A 7 -6.613 8.694 5.293 1.00 0.00 O ATOM 110 CB ALA A 7 -7.211 6.096 7.174 1.00 0.00 C ATOM 0 H ALA A 7 -6.742 7.242 9.303 1.00 0.00 H new ATOM 0 HA ALA A 7 -5.358 7.109 6.845 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.315 5.795 6.132 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -6.745 5.290 7.740 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.196 6.309 7.590 1.00 0.00 H new ATOM 116 N ALA A 8 -7.854 9.217 7.103 1.00 0.00 N ATOM 117 CA ALA A 8 -8.515 10.332 6.447 1.00 0.00 C ATOM 118 C ALA A 8 -7.472 11.314 5.932 1.00 0.00 C ATOM 119 O ALA A 8 -7.598 11.843 4.827 1.00 0.00 O ATOM 120 CB ALA A 8 -9.440 11.060 7.447 1.00 0.00 C ATOM 0 H ALA A 8 -8.140 9.058 8.069 1.00 0.00 H new ATOM 0 HA ALA A 8 -9.107 9.950 5.615 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.931 11.894 6.947 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.193 10.365 7.818 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.849 11.435 8.283 1.00 0.00 H new ATOM 126 N VAL A 9 -6.440 11.539 6.730 1.00 0.00 N ATOM 127 CA VAL A 9 -5.382 12.447 6.332 1.00 0.00 C ATOM 128 C VAL A 9 -4.702 11.921 5.075 1.00 0.00 C ATOM 129 O VAL A 9 -4.484 12.662 4.114 1.00 0.00 O ATOM 130 CB VAL A 9 -4.348 12.568 7.455 1.00 0.00 C ATOM 131 CG1 VAL A 9 -3.141 13.376 6.967 1.00 0.00 C ATOM 132 CG2 VAL A 9 -4.979 13.261 8.661 1.00 0.00 C ATOM 0 H VAL A 9 -6.315 11.110 7.647 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.813 13.428 6.132 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.016 11.571 7.745 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.409 13.458 7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.687 12.873 6.113 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.467 14.373 6.669 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.241 13.346 9.459 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.318 14.256 8.373 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.829 12.676 9.013 1.00 0.00 H new ATOM 142 N GLU A 10 -4.388 10.629 5.093 1.00 0.00 N ATOM 143 CA GLU A 10 -3.749 9.987 3.949 1.00 0.00 C ATOM 144 C GLU A 10 -4.722 9.882 2.779 1.00 0.00 C ATOM 145 O GLU A 10 -4.312 9.805 1.619 1.00 0.00 O ATOM 146 CB GLU A 10 -3.240 8.597 4.332 1.00 0.00 C ATOM 147 CG GLU A 10 -2.049 8.742 5.268 1.00 0.00 C ATOM 148 CD GLU A 10 -1.554 7.365 5.693 1.00 0.00 C ATOM 149 OE1 GLU A 10 -2.165 6.388 5.290 1.00 0.00 O ATOM 150 OE2 GLU A 10 -0.575 7.305 6.418 1.00 0.00 O1- ATOM 0 H GLU A 10 -4.565 10.009 5.883 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.901 10.601 3.644 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.032 8.027 4.818 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.951 8.043 3.439 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.248 9.288 4.770 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -2.333 9.323 6.145 1.00 0.00 H new ATOM 157 N GLN A 11 -6.010 9.886 3.100 1.00 0.00 N ATOM 158 CA GLN A 11 -7.054 9.797 2.088 1.00 0.00 C ATOM 159 C GLN A 11 -7.125 11.084 1.275 1.00 0.00 C ATOM 160 O GLN A 11 -7.367 11.051 0.069 1.00 0.00 O ATOM 161 CB GLN A 11 -8.406 9.526 2.753 1.00 0.00 C ATOM 162 CG GLN A 11 -8.496 8.051 3.150 1.00 0.00 C ATOM 163 CD GLN A 11 -8.454 7.174 1.901 1.00 0.00 C ATOM 164 OE1 GLN A 11 -7.469 6.473 1.667 1.00 0.00 O ATOM 165 NE2 GLN A 11 -9.475 7.166 1.084 1.00 0.00 N ATOM 0 H GLN A 11 -6.357 9.950 4.057 1.00 0.00 H new ATOM 0 HA GLN A 11 -6.813 8.974 1.415 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.523 10.158 3.633 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.216 9.779 2.069 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -7.671 7.793 3.814 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -9.418 7.869 3.702 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -10.290 7.748 1.280 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -9.457 6.578 0.251 1.00 0.00 H new ATOM 174 N LEU A 12 -6.914 12.214 1.940 1.00 0.00 N ATOM 175 CA LEU A 12 -6.961 13.497 1.253 1.00 0.00 C ATOM 176 C LEU A 12 -5.914 13.548 0.144 1.00 0.00 C ATOM 177 O LEU A 12 -4.715 13.600 0.411 1.00 0.00 O ATOM 178 CB LEU A 12 -6.715 14.644 2.241 1.00 0.00 C ATOM 179 CG LEU A 12 -7.717 14.556 3.391 1.00 0.00 C ATOM 180 CD1 LEU A 12 -7.670 15.836 4.220 1.00 0.00 C ATOM 181 CD2 LEU A 12 -9.122 14.344 2.818 1.00 0.00 C ATOM 0 H LEU A 12 -6.712 12.268 2.938 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.952 13.610 0.814 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -5.697 14.592 2.628 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.814 15.603 1.732 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.462 13.716 4.037 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -8.387 15.766 5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.667 15.970 4.626 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.922 16.688 3.588 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.842 14.280 3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.381 15.181 2.170 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.144 13.419 2.242 1.00 0.00 H new ATOM 193 N THR A 13 -6.383 13.538 -1.103 1.00 0.00 N ATOM 194 CA THR A 13 -5.483 13.587 -2.249 1.00 0.00 C ATOM 195 C THR A 13 -4.548 14.783 -2.132 1.00 0.00 C ATOM 196 O THR A 13 -4.636 15.561 -1.182 1.00 0.00 O ATOM 197 CB THR A 13 -6.287 13.680 -3.551 1.00 0.00 C ATOM 198 OG1 THR A 13 -5.397 13.824 -4.649 1.00 0.00 O ATOM 199 CG2 THR A 13 -7.219 14.887 -3.493 1.00 0.00 C ATOM 0 H THR A 13 -7.374 13.497 -1.342 1.00 0.00 H new ATOM 0 HA THR A 13 -4.889 12.673 -2.264 1.00 0.00 H new ATOM 0 HB THR A 13 -6.877 12.772 -3.676 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.911 13.882 -5.481 1.00 0.00 H new ATOM 0 HG21 THR A 13 -7.789 14.951 -4.420 1.00 0.00 H new ATOM 0 HG22 THR A 13 -7.904 14.778 -2.652 1.00 0.00 H new ATOM 0 HG23 THR A 13 -6.630 15.795 -3.366 1.00 0.00 H new ATOM 207 N GLU A 14 -3.644 14.918 -3.096 1.00 0.00 N ATOM 208 CA GLU A 14 -2.692 16.021 -3.080 1.00 0.00 C ATOM 209 C GLU A 14 -3.419 17.359 -3.037 1.00 0.00 C ATOM 210 O GLU A 14 -2.970 18.296 -2.381 1.00 0.00 O ATOM 211 CB GLU A 14 -1.815 15.960 -4.332 1.00 0.00 C ATOM 212 CG GLU A 14 -2.690 16.141 -5.578 1.00 0.00 C ATOM 213 CD GLU A 14 -1.836 16.034 -6.838 1.00 0.00 C ATOM 214 OE1 GLU A 14 -0.635 15.878 -6.705 1.00 0.00 O ATOM 215 OE2 GLU A 14 -2.400 16.108 -7.919 1.00 0.00 O1- ATOM 0 H GLU A 14 -3.551 14.285 -3.890 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.072 15.930 -2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -1.053 16.738 -4.293 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.293 15.004 -4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.474 15.383 -5.595 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.185 17.111 -5.546 1.00 0.00 H new ATOM 222 N GLU A 15 -4.539 17.447 -3.744 1.00 0.00 N ATOM 223 CA GLU A 15 -5.305 18.687 -3.774 1.00 0.00 C ATOM 224 C GLU A 15 -6.080 18.890 -2.471 1.00 0.00 C ATOM 225 O GLU A 15 -6.070 19.977 -1.892 1.00 0.00 O ATOM 226 CB GLU A 15 -6.286 18.653 -4.936 1.00 0.00 C ATOM 227 CG GLU A 15 -6.874 20.047 -5.134 1.00 0.00 C ATOM 228 CD GLU A 15 -7.784 20.054 -6.361 1.00 0.00 C ATOM 229 OE1 GLU A 15 -7.810 19.052 -7.058 1.00 0.00 O ATOM 230 OE2 GLU A 15 -8.442 21.057 -6.583 1.00 0.00 O1- ATOM 0 H GLU A 15 -4.933 16.686 -4.297 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.605 19.514 -3.895 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -5.781 18.325 -5.845 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.081 17.934 -4.736 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.438 20.343 -4.250 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -6.073 20.775 -5.260 1.00 0.00 H new ATOM 237 N GLN A 16 -6.762 17.838 -2.016 1.00 0.00 N ATOM 238 CA GLN A 16 -7.547 17.923 -0.789 1.00 0.00 C ATOM 239 C GLN A 16 -6.663 18.283 0.393 1.00 0.00 C ATOM 240 O GLN A 16 -6.983 19.184 1.170 1.00 0.00 O ATOM 241 CB GLN A 16 -8.227 16.577 -0.508 1.00 0.00 C ATOM 242 CG GLN A 16 -9.611 16.551 -1.157 1.00 0.00 C ATOM 243 CD GLN A 16 -10.077 15.111 -1.364 1.00 0.00 C ATOM 244 OE1 GLN A 16 -10.269 14.338 -0.331 1.00 0.00 O flip ATOM 245 NE2 GLN A 16 -10.278 14.680 -2.501 1.00 0.00 N flip ATOM 0 H GLN A 16 -6.786 16.927 -2.475 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.299 18.700 -0.923 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -7.617 15.762 -0.898 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -8.316 16.422 0.567 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -10.324 17.084 -0.528 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -9.580 17.071 -2.115 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -10.128 15.284 -3.309 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -10.594 13.719 -2.634 1.00 0.00 H new ATOM 254 N LYS A 17 -5.551 17.575 0.520 1.00 0.00 N ATOM 255 CA LYS A 17 -4.630 17.826 1.613 1.00 0.00 C ATOM 256 C LYS A 17 -4.024 19.213 1.460 1.00 0.00 C ATOM 257 O LYS A 17 -3.739 19.888 2.443 1.00 0.00 O ATOM 258 CB LYS A 17 -3.523 16.771 1.625 1.00 0.00 C ATOM 259 CG LYS A 17 -3.032 16.562 3.061 1.00 0.00 C ATOM 260 CD LYS A 17 -1.786 15.675 3.050 1.00 0.00 C ATOM 261 CE LYS A 17 -2.119 14.324 2.409 1.00 0.00 C ATOM 262 NZ LYS A 17 -0.912 13.451 2.433 1.00 0.00 N1+ ATOM 0 H LYS A 17 -5.268 16.829 -0.115 1.00 0.00 H new ATOM 0 HA LYS A 17 -5.174 17.772 2.556 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.897 15.832 1.217 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.696 17.089 0.989 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -2.803 17.523 3.522 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.816 16.099 3.661 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.985 16.164 2.496 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -1.425 15.526 4.068 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -2.937 13.846 2.947 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -2.455 14.470 1.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -1.138 12.534 1.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -0.143 13.907 1.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -0.611 13.302 3.417 1.00 0.00 H new ATOM 276 N ASN A 18 -3.830 19.635 0.212 1.00 0.00 N ATOM 277 CA ASN A 18 -3.257 20.947 -0.056 1.00 0.00 C ATOM 278 C ASN A 18 -4.145 22.042 0.529 1.00 0.00 C ATOM 279 O ASN A 18 -3.656 22.988 1.146 1.00 0.00 O ATOM 280 CB ASN A 18 -3.123 21.163 -1.570 1.00 0.00 C ATOM 281 CG ASN A 18 -2.272 22.399 -1.854 1.00 0.00 C ATOM 282 OD1 ASN A 18 -1.358 22.714 -1.091 1.00 0.00 O ATOM 283 ND2 ASN A 18 -2.517 23.116 -2.917 1.00 0.00 N ATOM 0 H ASN A 18 -4.059 19.092 -0.620 1.00 0.00 H new ATOM 0 HA ASN A 18 -2.272 20.994 0.409 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -2.668 20.286 -2.031 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -4.110 21.282 -2.016 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -1.951 23.940 -3.118 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -3.275 22.852 -3.547 1.00 0.00 H new ATOM 290 N GLU A 19 -5.453 21.900 0.342 1.00 0.00 N ATOM 291 CA GLU A 19 -6.393 22.882 0.862 1.00 0.00 C ATOM 292 C GLU A 19 -6.301 22.934 2.383 1.00 0.00 C ATOM 293 O GLU A 19 -6.131 24.002 2.982 1.00 0.00 O ATOM 294 CB GLU A 19 -7.819 22.508 0.435 1.00 0.00 C ATOM 295 CG GLU A 19 -8.450 23.671 -0.335 1.00 0.00 C ATOM 296 CD GLU A 19 -9.710 23.198 -1.057 1.00 0.00 C ATOM 297 OE1 GLU A 19 -10.224 22.154 -0.690 1.00 0.00 O ATOM 298 OE2 GLU A 19 -10.141 23.888 -1.969 1.00 0.00 O1- ATOM 0 H GLU A 19 -5.881 21.123 -0.160 1.00 0.00 H new ATOM 0 HA GLU A 19 -6.145 23.864 0.460 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.799 21.614 -0.189 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -8.421 22.271 1.312 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -8.697 24.481 0.351 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -7.736 24.070 -1.056 1.00 0.00 H new ATOM 305 N PHE A 20 -6.402 21.769 3.006 1.00 0.00 N ATOM 306 CA PHE A 20 -6.324 21.695 4.451 1.00 0.00 C ATOM 307 C PHE A 20 -4.932 22.109 4.922 1.00 0.00 C ATOM 308 O PHE A 20 -4.781 22.762 5.956 1.00 0.00 O ATOM 309 CB PHE A 20 -6.636 20.267 4.928 1.00 0.00 C ATOM 310 CG PHE A 20 -8.055 19.904 4.551 1.00 0.00 C ATOM 311 CD1 PHE A 20 -8.296 18.896 3.608 1.00 0.00 C ATOM 312 CD2 PHE A 20 -9.130 20.580 5.142 1.00 0.00 C ATOM 313 CE1 PHE A 20 -9.610 18.567 3.255 1.00 0.00 C ATOM 314 CE2 PHE A 20 -10.445 20.247 4.790 1.00 0.00 C ATOM 315 CZ PHE A 20 -10.684 19.242 3.847 1.00 0.00 C ATOM 0 H PHE A 20 -6.537 20.873 2.537 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.060 22.377 4.877 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -5.938 19.562 4.477 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.507 20.197 6.008 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -7.468 18.373 3.153 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.946 21.357 5.869 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.795 17.792 2.526 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -11.274 20.767 5.247 1.00 0.00 H new ATOM 0 HZ PHE A 20 -11.698 18.987 3.575 1.00 0.00 H new ATOM 325 N LYS A 21 -3.921 21.719 4.162 1.00 0.00 N ATOM 326 CA LYS A 21 -2.552 22.041 4.520 1.00 0.00 C ATOM 327 C LYS A 21 -2.392 23.548 4.633 1.00 0.00 C ATOM 328 O LYS A 21 -1.733 24.045 5.547 1.00 0.00 O ATOM 329 CB LYS A 21 -1.596 21.494 3.454 1.00 0.00 C ATOM 330 CG LYS A 21 -0.151 21.659 3.922 1.00 0.00 C ATOM 331 CD LYS A 21 0.035 20.885 5.225 1.00 0.00 C ATOM 332 CE LYS A 21 1.522 20.587 5.441 1.00 0.00 C ATOM 333 NZ LYS A 21 2.292 21.862 5.441 1.00 0.00 N1+ ATOM 0 H LYS A 21 -4.023 21.183 3.300 1.00 0.00 H new ATOM 0 HA LYS A 21 -2.315 21.584 5.481 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.809 20.442 3.266 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.746 22.022 2.512 1.00 0.00 H new ATOM 0 HG2 LYS A 21 0.537 21.289 3.162 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.079 22.714 4.073 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.355 21.464 6.062 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.531 19.954 5.190 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.665 20.064 6.387 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.889 19.928 4.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 3.234 21.698 5.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.393 22.207 4.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.787 22.572 6.009 1.00 0.00 H new ATOM 347 N ALA A 22 -3.013 24.269 3.708 1.00 0.00 N ATOM 348 CA ALA A 22 -2.945 25.718 3.725 1.00 0.00 C ATOM 349 C ALA A 22 -3.549 26.247 5.020 1.00 0.00 C ATOM 350 O ALA A 22 -3.004 27.157 5.644 1.00 0.00 O ATOM 351 CB ALA A 22 -3.720 26.285 2.534 1.00 0.00 C ATOM 0 H ALA A 22 -3.564 23.875 2.945 1.00 0.00 H new ATOM 0 HA ALA A 22 -1.902 26.027 3.659 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -3.667 27.374 2.550 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -3.284 25.914 1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.762 25.972 2.596 1.00 0.00 H new ATOM 357 N ALA A 23 -4.668 25.651 5.426 1.00 0.00 N ATOM 358 CA ALA A 23 -5.334 26.065 6.657 1.00 0.00 C ATOM 359 C ALA A 23 -4.397 25.884 7.844 1.00 0.00 C ATOM 360 O ALA A 23 -4.359 26.717 8.749 1.00 0.00 O ATOM 361 CB ALA A 23 -6.602 25.236 6.883 1.00 0.00 C ATOM 0 H ALA A 23 -5.127 24.889 4.927 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.606 27.117 6.564 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -7.087 25.557 7.805 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -7.284 25.379 6.045 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.338 24.181 6.960 1.00 0.00 H new ATOM 367 N PHE A 24 -3.632 24.802 7.822 1.00 0.00 N ATOM 368 CA PHE A 24 -2.690 24.533 8.898 1.00 0.00 C ATOM 369 C PHE A 24 -1.712 25.696 9.058 1.00 0.00 C ATOM 370 O PHE A 24 -1.492 26.188 10.167 1.00 0.00 O ATOM 371 CB PHE A 24 -1.905 23.258 8.603 1.00 0.00 C ATOM 372 CG PHE A 24 -0.692 23.182 9.508 1.00 0.00 C ATOM 373 CD1 PHE A 24 -0.819 22.837 10.863 1.00 0.00 C ATOM 374 CD2 PHE A 24 0.574 23.468 8.980 1.00 0.00 C ATOM 375 CE1 PHE A 24 0.318 22.779 11.680 1.00 0.00 C ATOM 376 CE2 PHE A 24 1.708 23.409 9.797 1.00 0.00 C ATOM 377 CZ PHE A 24 1.580 23.065 11.147 1.00 0.00 C ATOM 0 H PHE A 24 -3.644 24.103 7.079 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.256 24.410 9.822 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.540 22.385 8.756 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.593 23.246 7.559 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.792 22.616 11.275 1.00 0.00 H new ATOM 0 HD2 PHE A 24 0.675 23.735 7.938 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.220 22.513 12.722 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.682 23.629 9.386 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.455 23.020 11.778 1.00 0.00 H new ATOM 387 N ASP A 25 -1.134 26.131 7.943 1.00 0.00 N ATOM 388 CA ASP A 25 -0.184 27.239 7.965 1.00 0.00 C ATOM 389 C ASP A 25 -0.860 28.505 8.475 1.00 0.00 C ATOM 390 O ASP A 25 -0.282 29.256 9.260 1.00 0.00 O ATOM 391 CB ASP A 25 0.372 27.481 6.563 1.00 0.00 C ATOM 392 CG ASP A 25 1.449 28.561 6.607 1.00 0.00 C ATOM 393 OD1 ASP A 25 1.612 29.168 7.652 1.00 0.00 O ATOM 394 OD2 ASP A 25 2.096 28.764 5.593 1.00 0.00 O1- ATOM 0 H ASP A 25 -1.305 25.737 7.018 1.00 0.00 H new ATOM 0 HA ASP A 25 0.635 26.980 8.636 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.789 26.556 6.164 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.431 27.784 5.892 1.00 0.00 H new ATOM 399 N ILE A 26 -2.093 28.732 8.031 1.00 0.00 N ATOM 400 CA ILE A 26 -2.839 29.908 8.458 1.00 0.00 C ATOM 401 C ILE A 26 -3.011 29.911 9.969 1.00 0.00 C ATOM 402 O ILE A 26 -2.803 30.934 10.621 1.00 0.00 O ATOM 403 CB ILE A 26 -4.217 29.924 7.793 1.00 0.00 C ATOM 404 CG1 ILE A 26 -4.099 30.473 6.371 1.00 0.00 C ATOM 405 CG2 ILE A 26 -5.177 30.800 8.602 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.191 29.331 5.362 1.00 0.00 C ATOM 0 H ILE A 26 -2.591 28.123 7.382 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.279 30.795 8.161 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.605 28.906 7.757 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.891 31.198 6.185 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.151 30.999 6.253 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -6.156 30.806 8.122 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.270 30.401 9.612 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.789 31.818 8.649 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.106 29.731 4.351 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.383 28.622 5.541 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.150 28.824 5.472 1.00 0.00 H new ATOM 418 N PHE A 27 -3.380 28.766 10.523 1.00 0.00 N ATOM 419 CA PHE A 27 -3.561 28.671 11.960 1.00 0.00 C ATOM 420 C PHE A 27 -2.252 28.977 12.681 1.00 0.00 C ATOM 421 O PHE A 27 -2.241 29.664 13.701 1.00 0.00 O ATOM 422 CB PHE A 27 -4.044 27.277 12.345 1.00 0.00 C ATOM 423 CG PHE A 27 -5.540 27.224 12.284 1.00 0.00 C ATOM 424 CD1 PHE A 27 -6.183 27.058 11.067 1.00 0.00 C ATOM 425 CD2 PHE A 27 -6.280 27.321 13.461 1.00 0.00 C ATOM 426 CE1 PHE A 27 -7.576 26.987 11.017 1.00 0.00 C ATOM 427 CE2 PHE A 27 -7.674 27.258 13.420 1.00 0.00 C ATOM 428 CZ PHE A 27 -8.324 27.091 12.196 1.00 0.00 C ATOM 0 H PHE A 27 -3.557 27.904 10.008 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.312 29.402 12.259 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -3.617 26.535 11.671 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.703 27.028 13.350 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -5.606 26.984 10.157 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -5.774 27.445 14.407 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -8.077 26.852 10.070 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.247 27.338 14.332 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.402 27.042 12.158 1.00 0.00 H new ATOM 438 N VAL A 28 -1.154 28.472 12.130 1.00 0.00 N ATOM 439 CA VAL A 28 0.166 28.702 12.711 1.00 0.00 C ATOM 440 C VAL A 28 0.930 29.734 11.899 1.00 0.00 C ATOM 441 O VAL A 28 2.158 29.754 11.915 1.00 0.00 O ATOM 442 CB VAL A 28 0.966 27.404 12.752 1.00 0.00 C ATOM 443 CG1 VAL A 28 0.368 26.482 13.796 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.900 26.720 11.393 1.00 0.00 C ATOM 0 H VAL A 28 -1.150 27.902 11.284 1.00 0.00 H new ATOM 0 HA VAL A 28 0.027 29.071 13.727 1.00 0.00 H new ATOM 0 HB VAL A 28 2.004 27.627 13.001 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.936 25.553 13.829 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.405 26.965 14.772 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.668 26.264 13.538 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.472 25.793 11.424 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.138 26.498 11.148 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.319 27.379 10.633 1.00 0.00 H new ATOM 454 N LEU A 29 0.201 30.579 11.178 1.00 0.00 N ATOM 455 CA LEU A 29 0.831 31.603 10.356 1.00 0.00 C ATOM 456 C LEU A 29 1.813 32.422 11.192 1.00 0.00 C ATOM 457 O LEU A 29 1.408 33.246 12.013 1.00 0.00 O ATOM 458 CB LEU A 29 -0.241 32.528 9.767 1.00 0.00 C ATOM 459 CG LEU A 29 0.198 33.018 8.391 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.870 32.655 7.354 1.00 0.00 C ATOM 461 CD2 LEU A 29 0.371 34.536 8.431 1.00 0.00 C ATOM 0 H LEU A 29 -0.819 30.575 11.146 1.00 0.00 H new ATOM 0 HA LEU A 29 1.375 31.117 9.546 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.189 31.997 9.688 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.406 33.377 10.430 1.00 0.00 H new ATOM 0 HG LEU A 29 1.142 32.547 8.118 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.556 33.005 6.371 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.000 31.573 7.329 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.814 33.128 7.623 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.685 34.892 7.450 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.576 35.003 8.701 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.128 34.797 9.171 1.00 0.00 H new ATOM 473 N GLY A 30 3.104 32.188 10.974 1.00 0.00 N ATOM 474 CA GLY A 30 4.141 32.905 11.711 1.00 0.00 C ATOM 475 C GLY A 30 4.525 32.162 12.987 1.00 0.00 C ATOM 476 O GLY A 30 5.291 32.670 13.806 1.00 0.00 O ATOM 0 H GLY A 30 3.456 31.511 10.297 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.021 33.027 11.080 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.787 33.905 11.962 1.00 0.00 H new ATOM 480 N ALA A 31 3.989 30.956 13.148 1.00 0.00 N ATOM 481 CA ALA A 31 4.285 30.151 14.327 1.00 0.00 C ATOM 482 C ALA A 31 5.758 29.755 14.344 1.00 0.00 C ATOM 483 O ALA A 31 6.314 29.355 13.321 1.00 0.00 O ATOM 484 CB ALA A 31 3.410 28.890 14.336 1.00 0.00 C ATOM 0 H ALA A 31 3.352 30.518 12.482 1.00 0.00 H new ATOM 0 HA ALA A 31 4.069 30.745 15.215 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.638 28.295 15.220 1.00 0.00 H new ATOM 0 HB2 ALA A 31 2.359 29.177 14.353 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.611 28.301 13.441 1.00 0.00 H new ATOM 490 N GLU A 32 6.385 29.876 15.509 1.00 0.00 N ATOM 491 CA GLU A 32 7.796 29.530 15.641 1.00 0.00 C ATOM 492 C GLU A 32 8.022 28.038 15.409 1.00 0.00 C ATOM 493 O GLU A 32 8.988 27.642 14.760 1.00 0.00 O ATOM 494 CB GLU A 32 8.294 29.905 17.034 1.00 0.00 C ATOM 495 CG GLU A 32 8.336 31.428 17.170 1.00 0.00 C ATOM 496 CD GLU A 32 8.748 31.813 18.586 1.00 0.00 C ATOM 497 OE1 GLU A 32 8.828 30.926 19.420 1.00 0.00 O ATOM 498 OE2 GLU A 32 8.976 32.990 18.817 1.00 0.00 O1- ATOM 0 H GLU A 32 5.945 30.207 16.367 1.00 0.00 H new ATOM 0 HA GLU A 32 8.351 30.087 14.886 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.637 29.480 17.793 1.00 0.00 H new ATOM 0 HB3 GLU A 32 9.287 29.487 17.201 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.040 31.846 16.451 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.357 31.849 16.940 1.00 0.00 H new ATOM 505 N ASP A 33 7.128 27.214 15.949 1.00 0.00 N ATOM 506 CA ASP A 33 7.250 25.766 15.796 1.00 0.00 C ATOM 507 C ASP A 33 6.380 25.266 14.645 1.00 0.00 C ATOM 508 O ASP A 33 6.597 24.175 14.118 1.00 0.00 O ATOM 509 CB ASP A 33 6.824 25.079 17.093 1.00 0.00 C ATOM 510 CG ASP A 33 5.365 25.402 17.400 1.00 0.00 C ATOM 511 OD1 ASP A 33 4.711 25.974 16.542 1.00 0.00 O ATOM 512 OD2 ASP A 33 4.924 25.080 18.490 1.00 0.00 O1- ATOM 0 H ASP A 33 6.319 27.519 16.491 1.00 0.00 H new ATOM 0 HA ASP A 33 8.290 25.527 15.573 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.955 24.001 17.003 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.459 25.410 17.915 1.00 0.00 H new ATOM 517 N GLY A 34 5.398 26.074 14.262 1.00 0.00 N ATOM 518 CA GLY A 34 4.497 25.710 13.172 1.00 0.00 C ATOM 519 C GLY A 34 3.322 24.886 13.691 1.00 0.00 C ATOM 520 O GLY A 34 2.373 24.616 12.959 1.00 0.00 O ATOM 0 H GLY A 34 5.205 26.981 14.687 1.00 0.00 H new ATOM 0 HA2 GLY A 34 4.127 26.612 12.684 1.00 0.00 H new ATOM 0 HA3 GLY A 34 5.042 25.140 12.419 1.00 0.00 H new ATOM 524 N SER A 35 3.397 24.491 14.960 1.00 0.00 N ATOM 525 CA SER A 35 2.331 23.699 15.563 1.00 0.00 C ATOM 526 C SER A 35 1.185 24.609 15.991 1.00 0.00 C ATOM 527 O SER A 35 1.416 25.680 16.549 1.00 0.00 O ATOM 528 CB SER A 35 2.864 22.938 16.776 1.00 0.00 C ATOM 529 OG SER A 35 3.063 23.845 17.853 1.00 0.00 O ATOM 0 H SER A 35 4.176 24.704 15.583 1.00 0.00 H new ATOM 0 HA SER A 35 1.965 22.984 14.826 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.160 22.158 17.068 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.802 22.443 16.525 1.00 0.00 H new ATOM 0 HG SER A 35 3.999 23.811 18.141 1.00 0.00 H new ATOM 535 N ILE A 36 -0.048 24.196 15.717 1.00 0.00 N ATOM 536 CA ILE A 36 -1.204 25.016 16.074 1.00 0.00 C ATOM 537 C ILE A 36 -1.441 24.993 17.581 1.00 0.00 C ATOM 538 O ILE A 36 -1.957 24.020 18.123 1.00 0.00 O ATOM 539 CB ILE A 36 -2.448 24.483 15.355 1.00 0.00 C ATOM 540 CG1 ILE A 36 -2.317 24.696 13.842 1.00 0.00 C ATOM 541 CG2 ILE A 36 -3.700 25.190 15.874 1.00 0.00 C ATOM 542 CD1 ILE A 36 -3.436 23.943 13.115 1.00 0.00 C ATOM 0 H ILE A 36 -0.273 23.314 15.257 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.008 26.044 15.769 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.536 23.415 15.555 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.370 25.759 13.609 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.345 24.343 13.498 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.577 24.803 15.356 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.802 25.010 16.944 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.615 26.261 15.692 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.339 24.097 12.040 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.362 22.878 13.337 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.403 24.317 13.450 1.00 0.00 H new ATOM 554 N SER A 37 -1.081 26.088 18.243 1.00 0.00 N ATOM 555 CA SER A 37 -1.272 26.201 19.680 1.00 0.00 C ATOM 556 C SER A 37 -2.523 27.014 19.964 1.00 0.00 C ATOM 557 O SER A 37 -2.997 27.749 19.103 1.00 0.00 O ATOM 558 CB SER A 37 -0.056 26.873 20.322 1.00 0.00 C ATOM 559 OG SER A 37 0.007 28.229 19.901 1.00 0.00 O ATOM 0 H SER A 37 -0.657 26.906 17.806 1.00 0.00 H new ATOM 0 HA SER A 37 -1.386 25.204 20.105 1.00 0.00 H new ATOM 0 HB2 SER A 37 -0.128 26.820 21.408 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.856 26.349 20.037 1.00 0.00 H new ATOM 0 HG SER A 37 0.784 28.663 20.312 1.00 0.00 H new ATOM 565 N THR A 38 -3.063 26.873 21.163 1.00 0.00 N ATOM 566 CA THR A 38 -4.269 27.598 21.511 1.00 0.00 C ATOM 567 C THR A 38 -4.198 29.023 20.989 1.00 0.00 C ATOM 568 O THR A 38 -5.212 29.608 20.611 1.00 0.00 O ATOM 569 CB THR A 38 -4.454 27.582 23.026 1.00 0.00 C ATOM 570 OG1 THR A 38 -3.184 27.664 23.659 1.00 0.00 O ATOM 571 CG2 THR A 38 -5.163 26.284 23.430 1.00 0.00 C ATOM 0 H THR A 38 -2.692 26.273 21.900 1.00 0.00 H new ATOM 0 HA THR A 38 -5.128 27.113 21.047 1.00 0.00 H new ATOM 0 HB THR A 38 -5.059 28.434 23.337 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.302 27.656 24.632 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.299 26.265 24.511 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.136 26.233 22.941 1.00 0.00 H new ATOM 0 HG23 THR A 38 -4.559 25.429 23.125 1.00 0.00 H new ATOM 579 N LYS A 39 -2.992 29.576 20.952 1.00 0.00 N ATOM 580 CA LYS A 39 -2.817 30.928 20.452 1.00 0.00 C ATOM 581 C LYS A 39 -2.936 30.946 18.933 1.00 0.00 C ATOM 582 O LYS A 39 -3.592 31.817 18.360 1.00 0.00 O ATOM 583 CB LYS A 39 -1.450 31.471 20.880 1.00 0.00 C ATOM 584 CG LYS A 39 -1.352 31.420 22.405 1.00 0.00 C ATOM 585 CD LYS A 39 -2.536 32.171 23.016 1.00 0.00 C ATOM 586 CE LYS A 39 -2.437 32.127 24.541 1.00 0.00 C ATOM 587 NZ LYS A 39 -3.638 32.783 25.131 1.00 0.00 N1+ ATOM 0 H LYS A 39 -2.135 29.116 21.258 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.597 31.563 20.872 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.652 30.879 20.431 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.324 32.495 20.528 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.349 30.385 22.746 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.414 31.867 22.735 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -2.541 33.205 22.671 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.473 31.721 22.689 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.368 31.094 24.883 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -1.531 32.634 24.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.915 32.283 26.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.417 33.774 25.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -4.422 32.751 24.448 1.00 0.00 H new ATOM 601 N GLU A 40 -2.307 29.964 18.289 1.00 0.00 N ATOM 602 CA GLU A 40 -2.353 29.857 16.835 1.00 0.00 C ATOM 603 C GLU A 40 -3.717 29.347 16.384 1.00 0.00 C ATOM 604 O GLU A 40 -4.116 29.535 15.236 1.00 0.00 O ATOM 605 CB GLU A 40 -1.262 28.912 16.332 1.00 0.00 C ATOM 606 CG GLU A 40 0.111 29.526 16.613 1.00 0.00 C ATOM 607 CD GLU A 40 0.066 31.037 16.400 1.00 0.00 C ATOM 608 OE1 GLU A 40 -0.211 31.743 17.356 1.00 0.00 O ATOM 609 OE2 GLU A 40 0.306 31.467 15.283 1.00 0.00 O1- ATOM 0 H GLU A 40 -1.762 29.235 18.750 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.184 30.849 16.416 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.348 27.944 16.826 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.382 28.736 15.263 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.414 29.304 17.636 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.858 29.081 15.956 1.00 0.00 H new ATOM 616 N LEU A 41 -4.417 28.681 17.297 1.00 0.00 N ATOM 617 CA LEU A 41 -5.732 28.135 16.992 1.00 0.00 C ATOM 618 C LEU A 41 -6.808 29.198 17.146 1.00 0.00 C ATOM 619 O LEU A 41 -7.632 29.396 16.254 1.00 0.00 O ATOM 620 CB LEU A 41 -6.040 26.949 17.909 1.00 0.00 C ATOM 621 CG LEU A 41 -7.192 26.135 17.313 1.00 0.00 C ATOM 622 CD1 LEU A 41 -6.899 24.642 17.471 1.00 0.00 C ATOM 623 CD2 LEU A 41 -8.493 26.479 18.044 1.00 0.00 C ATOM 0 H LEU A 41 -4.096 28.508 18.250 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.725 27.795 15.957 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.156 26.322 18.021 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.307 27.304 18.904 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.295 26.375 16.255 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.719 24.063 17.047 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -5.974 24.396 16.950 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.795 24.402 18.529 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.313 25.900 17.620 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.390 26.240 19.102 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.704 27.542 17.931 1.00 0.00 H new ATOM 635 N GLY A 42 -6.803 29.886 18.280 1.00 0.00 N ATOM 636 CA GLY A 42 -7.796 30.924 18.523 1.00 0.00 C ATOM 637 C GLY A 42 -7.670 32.059 17.496 1.00 0.00 C ATOM 638 O GLY A 42 -8.674 32.620 17.062 1.00 0.00 O ATOM 0 H GLY A 42 -6.133 29.747 19.036 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.796 30.494 18.474 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.670 31.324 19.529 1.00 0.00 H new ATOM 642 N LYS A 43 -6.437 32.397 17.106 1.00 0.00 N ATOM 643 CA LYS A 43 -6.228 33.465 16.125 1.00 0.00 C ATOM 644 C LYS A 43 -7.189 33.286 14.942 1.00 0.00 C ATOM 645 O LYS A 43 -8.030 34.146 14.673 1.00 0.00 O ATOM 646 CB LYS A 43 -4.780 33.426 15.628 1.00 0.00 C ATOM 647 CG LYS A 43 -4.373 31.986 15.375 1.00 0.00 C ATOM 648 CD LYS A 43 -3.886 31.839 13.932 1.00 0.00 C ATOM 649 CE LYS A 43 -2.446 32.356 13.826 1.00 0.00 C ATOM 650 NZ LYS A 43 -1.960 32.188 12.430 1.00 0.00 N1+ ATOM 0 H LYS A 43 -5.583 31.956 17.447 1.00 0.00 H new ATOM 0 HA LYS A 43 -6.423 34.428 16.596 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.682 34.009 14.712 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.118 33.878 16.366 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.584 31.693 16.068 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.218 31.321 15.554 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -3.933 30.794 13.625 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -4.535 32.398 13.258 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.403 33.407 14.113 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -1.801 31.811 14.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -0.954 31.923 12.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -2.509 31.441 11.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -2.076 33.082 11.912 1.00 0.00 H new ATOM 664 N VAL A 44 -7.083 32.147 14.263 1.00 0.00 N ATOM 665 CA VAL A 44 -7.960 31.836 13.145 1.00 0.00 C ATOM 666 C VAL A 44 -9.402 31.764 13.625 1.00 0.00 C ATOM 667 O VAL A 44 -10.327 32.133 12.903 1.00 0.00 O ATOM 668 CB VAL A 44 -7.532 30.513 12.497 1.00 0.00 C ATOM 669 CG1 VAL A 44 -8.687 29.960 11.695 1.00 0.00 C ATOM 670 CG2 VAL A 44 -6.352 30.760 11.553 1.00 0.00 C ATOM 0 H VAL A 44 -6.395 31.424 14.471 1.00 0.00 H new ATOM 0 HA VAL A 44 -7.885 32.624 12.396 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.239 29.807 13.275 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.390 29.019 11.231 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.538 29.787 12.354 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.967 30.674 10.920 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.050 29.819 11.094 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.649 31.464 10.776 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.516 31.174 12.116 1.00 0.00 H new ATOM 680 N MET A 45 -9.586 31.293 14.848 1.00 0.00 N ATOM 681 CA MET A 45 -10.923 31.189 15.405 1.00 0.00 C ATOM 682 C MET A 45 -11.592 32.566 15.422 1.00 0.00 C ATOM 683 O MET A 45 -12.754 32.701 15.046 1.00 0.00 O ATOM 684 CB MET A 45 -10.831 30.642 16.833 1.00 0.00 C ATOM 685 CG MET A 45 -10.448 29.162 16.817 1.00 0.00 C ATOM 686 SD MET A 45 -11.836 28.193 16.177 1.00 0.00 S ATOM 687 CE MET A 45 -12.899 28.367 17.633 1.00 0.00 C ATOM 0 H MET A 45 -8.837 30.981 15.466 1.00 0.00 H new ATOM 0 HA MET A 45 -11.520 30.515 14.791 1.00 0.00 H new ATOM 0 HB2 MET A 45 -10.091 31.209 17.399 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.787 30.771 17.340 1.00 0.00 H new ATOM 0 HG2 MET A 45 -9.566 29.009 16.196 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.191 28.830 17.823 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.930 28.145 17.359 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.572 27.673 18.407 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.835 29.388 18.010 1.00 0.00 H new ATOM 697 N ARG A 46 -10.839 33.583 15.825 1.00 0.00 N ATOM 698 CA ARG A 46 -11.351 34.951 15.853 1.00 0.00 C ATOM 699 C ARG A 46 -11.601 35.434 14.435 1.00 0.00 C ATOM 700 O ARG A 46 -12.513 36.219 14.181 1.00 0.00 O ATOM 701 CB ARG A 46 -10.353 35.869 16.568 1.00 0.00 C ATOM 702 CG ARG A 46 -10.345 35.528 18.058 1.00 0.00 C ATOM 703 CD ARG A 46 -8.927 35.676 18.591 1.00 0.00 C ATOM 704 NE ARG A 46 -8.832 35.158 19.951 1.00 0.00 N ATOM 705 CZ ARG A 46 -7.762 34.475 20.357 1.00 0.00 C ATOM 706 NH1 ARG A 46 -6.765 34.260 19.538 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 -7.706 34.014 21.576 1.00 0.00 N ATOM 0 H ARG A 46 -9.873 33.488 16.137 1.00 0.00 H new ATOM 0 HA ARG A 46 -12.293 34.973 16.401 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -9.356 35.742 16.147 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -10.630 36.913 16.422 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.022 36.189 18.599 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -10.702 34.510 18.213 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.232 35.142 17.943 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.635 36.726 18.575 1.00 0.00 H new ATOM 0 HE ARG A 46 -9.599 35.321 20.604 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -6.804 34.616 18.583 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -5.949 33.737 19.855 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -8.481 34.176 22.219 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.887 33.491 21.886 1.00 0.00 H new ATOM 721 N MET A 47 -10.777 34.951 13.516 1.00 0.00 N ATOM 722 CA MET A 47 -10.899 35.330 12.120 1.00 0.00 C ATOM 723 C MET A 47 -12.267 34.915 11.582 1.00 0.00 C ATOM 724 O MET A 47 -12.870 35.625 10.774 1.00 0.00 O ATOM 725 CB MET A 47 -9.794 34.667 11.291 1.00 0.00 C ATOM 726 CG MET A 47 -8.440 35.233 11.707 1.00 0.00 C ATOM 727 SD MET A 47 -7.318 35.224 10.286 1.00 0.00 S ATOM 728 CE MET A 47 -7.438 33.460 9.912 1.00 0.00 C ATOM 0 H MET A 47 -10.019 34.298 13.714 1.00 0.00 H new ATOM 0 HA MET A 47 -10.798 36.413 12.043 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.811 33.587 11.440 1.00 0.00 H new ATOM 0 HB3 MET A 47 -9.964 34.845 10.229 1.00 0.00 H new ATOM 0 HG2 MET A 47 -8.559 36.249 12.083 1.00 0.00 H new ATOM 0 HG3 MET A 47 -8.020 34.639 12.519 1.00 0.00 H new ATOM 0 HE1 MET A 47 -6.457 32.997 10.021 1.00 0.00 H new ATOM 0 HE2 MET A 47 -8.140 32.989 10.600 1.00 0.00 H new ATOM 0 HE3 MET A 47 -7.789 33.328 8.889 1.00 0.00 H new ATOM 738 N LEU A 48 -12.742 33.759 12.032 1.00 0.00 N ATOM 739 CA LEU A 48 -14.033 33.243 11.593 1.00 0.00 C ATOM 740 C LEU A 48 -15.150 33.742 12.510 1.00 0.00 C ATOM 741 O LEU A 48 -16.311 33.357 12.355 1.00 0.00 O ATOM 742 CB LEU A 48 -14.011 31.722 11.614 1.00 0.00 C ATOM 743 CG LEU A 48 -12.802 31.229 10.830 1.00 0.00 C ATOM 744 CD1 LEU A 48 -12.762 29.715 10.901 1.00 0.00 C ATOM 745 CD2 LEU A 48 -12.904 31.670 9.364 1.00 0.00 C ATOM 0 H LEU A 48 -12.253 33.162 12.699 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.221 33.597 10.579 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -13.965 31.361 12.641 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -14.928 31.327 11.178 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.893 31.651 11.259 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.901 29.347 10.343 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.681 29.402 11.942 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -13.675 29.306 10.469 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.034 31.311 8.815 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -13.809 31.254 8.921 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.942 32.758 9.313 1.00 0.00 H new ATOM 757 N GLY A 49 -14.789 34.595 13.468 1.00 0.00 N ATOM 758 CA GLY A 49 -15.765 35.132 14.411 1.00 0.00 C ATOM 759 C GLY A 49 -15.713 34.380 15.737 1.00 0.00 C ATOM 760 O GLY A 49 -16.420 34.723 16.685 1.00 0.00 O ATOM 0 H GLY A 49 -13.835 34.926 13.610 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.568 36.190 14.581 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.766 35.058 13.986 1.00 0.00 H new ATOM 764 N GLN A 50 -14.879 33.351 15.795 1.00 0.00 N ATOM 765 CA GLN A 50 -14.752 32.552 17.011 1.00 0.00 C ATOM 766 C GLN A 50 -13.758 33.176 17.975 1.00 0.00 C ATOM 767 O GLN A 50 -12.629 33.484 17.602 1.00 0.00 O ATOM 768 CB GLN A 50 -14.259 31.162 16.669 1.00 0.00 C ATOM 769 CG GLN A 50 -15.096 30.585 15.517 1.00 0.00 C ATOM 770 CD GLN A 50 -16.563 30.480 15.933 1.00 0.00 C ATOM 771 OE1 GLN A 50 -17.260 31.493 16.015 1.00 0.00 O ATOM 772 NE2 GLN A 50 -17.082 29.310 16.188 1.00 0.00 N ATOM 0 H GLN A 50 -14.284 33.050 15.023 1.00 0.00 H new ATOM 0 HA GLN A 50 -15.736 32.508 17.478 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.207 31.198 16.385 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.331 30.515 17.543 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -15.004 31.221 14.637 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -14.717 29.601 15.240 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -16.506 28.471 16.120 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -18.064 29.235 16.455 1.00 0.00 H new ATOM 781 N ASN A 51 -14.165 33.337 19.222 1.00 0.00 N ATOM 782 CA ASN A 51 -13.271 33.914 20.212 1.00 0.00 C ATOM 783 C ASN A 51 -13.206 33.045 21.455 1.00 0.00 C ATOM 784 O ASN A 51 -13.556 33.480 22.550 1.00 0.00 O ATOM 785 CB ASN A 51 -13.775 35.305 20.600 1.00 0.00 C ATOM 786 CG ASN A 51 -12.837 35.963 21.611 1.00 0.00 C ATOM 787 OD1 ASN A 51 -11.652 35.633 21.668 1.00 0.00 O ATOM 788 ND2 ASN A 51 -13.300 36.884 22.420 1.00 0.00 N ATOM 0 H ASN A 51 -15.090 33.082 19.569 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.273 33.980 19.779 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -13.852 35.929 19.710 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.776 35.228 21.024 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -12.679 37.327 23.097 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -14.282 37.158 22.373 1.00 0.00 H new ATOM 795 N PRO A 52 -12.757 31.836 21.299 1.00 0.00 N ATOM 796 CA PRO A 52 -12.632 30.876 22.430 1.00 0.00 C ATOM 797 C PRO A 52 -11.459 31.215 23.352 1.00 0.00 C ATOM 798 O PRO A 52 -10.407 31.660 22.894 1.00 0.00 O ATOM 799 CB PRO A 52 -12.423 29.538 21.724 1.00 0.00 C ATOM 800 CG PRO A 52 -11.801 29.872 20.412 1.00 0.00 C ATOM 801 CD PRO A 52 -12.325 31.247 20.021 1.00 0.00 C ATOM 0 HA PRO A 52 -13.502 30.886 23.087 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.777 28.883 22.309 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -13.369 29.014 21.588 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.714 29.879 20.489 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -12.062 29.129 19.659 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.551 31.849 19.545 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -13.152 31.174 19.315 1.00 0.00 H new ATOM 809 N THR A 53 -11.646 30.991 24.651 1.00 0.00 N ATOM 810 CA THR A 53 -10.592 31.268 25.623 1.00 0.00 C ATOM 811 C THR A 53 -9.493 30.222 25.531 1.00 0.00 C ATOM 812 O THR A 53 -9.712 29.108 25.060 1.00 0.00 O ATOM 813 CB THR A 53 -11.176 31.282 27.036 1.00 0.00 C ATOM 814 OG1 THR A 53 -11.712 30.002 27.341 1.00 0.00 O ATOM 815 CG2 THR A 53 -12.273 32.341 27.120 1.00 0.00 C ATOM 0 H THR A 53 -12.509 30.622 25.052 1.00 0.00 H new ATOM 0 HA THR A 53 -10.164 32.245 25.400 1.00 0.00 H new ATOM 0 HB THR A 53 -10.392 31.520 27.755 1.00 0.00 H new ATOM 0 HG1 THR A 53 -12.085 30.011 28.247 1.00 0.00 H new ATOM 0 HG21 THR A 53 -12.691 32.353 28.127 1.00 0.00 H new ATOM 0 HG22 THR A 53 -11.852 33.320 26.890 1.00 0.00 H new ATOM 0 HG23 THR A 53 -13.060 32.107 26.403 1.00 0.00 H new ATOM 823 N PRO A 54 -8.321 30.567 25.972 1.00 0.00 N ATOM 824 CA PRO A 54 -7.144 29.647 25.947 1.00 0.00 C ATOM 825 C PRO A 54 -7.402 28.367 26.735 1.00 0.00 C ATOM 826 O PRO A 54 -7.018 27.279 26.315 1.00 0.00 O ATOM 827 CB PRO A 54 -6.033 30.468 26.602 1.00 0.00 C ATOM 828 CG PRO A 54 -6.462 31.884 26.451 1.00 0.00 C ATOM 829 CD PRO A 54 -7.977 31.873 26.542 1.00 0.00 C ATOM 0 HA PRO A 54 -6.902 29.318 24.936 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -5.912 30.202 27.652 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.073 30.292 26.116 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -6.029 32.509 27.232 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -6.131 32.292 25.496 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -8.322 31.970 27.571 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -8.423 32.692 25.978 1.00 0.00 H new ATOM 837 N GLU A 55 -8.062 28.509 27.882 1.00 0.00 N ATOM 838 CA GLU A 55 -8.370 27.357 28.719 1.00 0.00 C ATOM 839 C GLU A 55 -9.288 26.390 27.976 1.00 0.00 C ATOM 840 O GLU A 55 -9.117 25.175 28.051 1.00 0.00 O ATOM 841 CB GLU A 55 -9.039 27.815 30.017 1.00 0.00 C ATOM 842 CG GLU A 55 -8.011 28.543 30.886 1.00 0.00 C ATOM 843 CD GLU A 55 -7.956 30.020 30.511 1.00 0.00 C ATOM 844 OE1 GLU A 55 -8.567 30.383 29.519 1.00 0.00 O ATOM 845 OE2 GLU A 55 -7.300 30.768 31.218 1.00 0.00 O1- ATOM 0 H GLU A 55 -8.390 29.402 28.249 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.439 26.843 28.959 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.877 28.476 29.794 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.443 26.957 30.554 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.274 28.437 31.939 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.028 28.090 30.756 1.00 0.00 H new ATOM 852 N GLU A 56 -10.257 26.945 27.251 1.00 0.00 N ATOM 853 CA GLU A 56 -11.193 26.125 26.490 1.00 0.00 C ATOM 854 C GLU A 56 -10.530 25.647 25.197 1.00 0.00 C ATOM 855 O GLU A 56 -10.715 24.503 24.761 1.00 0.00 O ATOM 856 CB GLU A 56 -12.456 26.936 26.173 1.00 0.00 C ATOM 857 CG GLU A 56 -13.692 26.075 26.442 1.00 0.00 C ATOM 858 CD GLU A 56 -13.917 25.946 27.947 1.00 0.00 C ATOM 859 OE1 GLU A 56 -13.386 25.014 28.529 1.00 0.00 O ATOM 860 OE2 GLU A 56 -14.616 26.783 28.496 1.00 0.00 O1- ATOM 0 H GLU A 56 -10.413 27.950 27.175 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.475 25.255 27.083 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.486 27.837 26.785 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.443 27.258 25.132 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.567 26.523 25.972 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.562 25.088 25.999 1.00 0.00 H new ATOM 867 N LEU A 57 -9.729 26.530 24.602 1.00 0.00 N ATOM 868 CA LEU A 57 -9.010 26.202 23.378 1.00 0.00 C ATOM 869 C LEU A 57 -8.065 25.036 23.613 1.00 0.00 C ATOM 870 O LEU A 57 -7.865 24.198 22.733 1.00 0.00 O ATOM 871 CB LEU A 57 -8.239 27.412 22.858 1.00 0.00 C ATOM 872 CG LEU A 57 -9.212 28.323 22.126 1.00 0.00 C ATOM 873 CD1 LEU A 57 -8.527 29.615 21.780 1.00 0.00 C ATOM 874 CD2 LEU A 57 -9.642 27.683 20.819 1.00 0.00 C ATOM 0 H LEU A 57 -9.564 27.475 24.949 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.741 25.913 22.623 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.768 27.945 23.684 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.440 27.094 22.188 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.073 28.494 22.773 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.225 30.268 21.255 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.190 30.104 22.694 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.669 29.412 21.139 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.339 28.343 20.302 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.767 27.516 20.191 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.129 26.730 21.024 1.00 0.00 H new ATOM 886 N GLN A 58 -7.486 24.990 24.803 1.00 0.00 N ATOM 887 CA GLN A 58 -6.559 23.924 25.145 1.00 0.00 C ATOM 888 C GLN A 58 -7.244 22.566 25.029 1.00 0.00 C ATOM 889 O GLN A 58 -6.655 21.609 24.526 1.00 0.00 O ATOM 890 CB GLN A 58 -6.048 24.116 26.577 1.00 0.00 C ATOM 891 CG GLN A 58 -5.024 23.029 26.910 1.00 0.00 C ATOM 892 CD GLN A 58 -5.609 22.060 27.934 1.00 0.00 C ATOM 893 OE1 GLN A 58 -5.391 20.853 27.839 1.00 0.00 O ATOM 894 NE2 GLN A 58 -6.347 22.518 28.909 1.00 0.00 N ATOM 0 H GLN A 58 -7.641 25.674 25.544 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.719 23.959 24.451 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.594 25.101 26.682 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -6.880 24.072 27.279 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -4.745 22.490 26.004 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.114 23.482 27.304 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -6.526 23.519 28.986 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -6.744 21.875 29.594 1.00 0.00 H new ATOM 903 N GLU A 59 -8.485 22.487 25.494 1.00 0.00 N ATOM 904 CA GLU A 59 -9.227 21.236 25.429 1.00 0.00 C ATOM 905 C GLU A 59 -9.444 20.833 23.976 1.00 0.00 C ATOM 906 O GLU A 59 -9.312 19.659 23.604 1.00 0.00 O ATOM 907 CB GLU A 59 -10.586 21.413 26.118 1.00 0.00 C ATOM 908 CG GLU A 59 -10.374 21.663 27.611 1.00 0.00 C ATOM 909 CD GLU A 59 -9.746 20.437 28.258 1.00 0.00 C ATOM 910 OE1 GLU A 59 -9.884 19.362 27.700 1.00 0.00 O ATOM 911 OE2 GLU A 59 -9.131 20.591 29.301 1.00 0.00 O1- ATOM 0 H GLU A 59 -8.993 23.265 25.915 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.657 20.456 25.934 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.125 22.249 25.672 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.198 20.523 25.971 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.731 22.531 27.755 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -11.327 21.890 28.089 1.00 0.00 H new ATOM 918 N MET A 60 -9.771 21.824 23.156 1.00 0.00 N ATOM 919 CA MET A 60 -10.007 21.577 21.741 1.00 0.00 C ATOM 920 C MET A 60 -8.718 21.114 21.070 1.00 0.00 C ATOM 921 O MET A 60 -8.729 20.204 20.240 1.00 0.00 O ATOM 922 CB MET A 60 -10.512 22.847 21.034 1.00 0.00 C ATOM 923 CG MET A 60 -11.037 23.858 22.054 1.00 0.00 C ATOM 924 SD MET A 60 -12.390 23.113 22.994 1.00 0.00 S ATOM 925 CE MET A 60 -13.200 24.660 23.456 1.00 0.00 C ATOM 0 H MET A 60 -9.878 22.797 23.443 1.00 0.00 H new ATOM 0 HA MET A 60 -10.769 20.802 21.660 1.00 0.00 H new ATOM 0 HB2 MET A 60 -9.704 23.293 20.455 1.00 0.00 H new ATOM 0 HB3 MET A 60 -11.303 22.588 20.330 1.00 0.00 H new ATOM 0 HG2 MET A 60 -10.236 24.162 22.727 1.00 0.00 H new ATOM 0 HG3 MET A 60 -11.384 24.757 21.546 1.00 0.00 H new ATOM 0 HE1 MET A 60 -13.949 24.463 24.223 1.00 0.00 H new ATOM 0 HE2 MET A 60 -12.458 25.358 23.844 1.00 0.00 H new ATOM 0 HE3 MET A 60 -13.682 25.094 22.580 1.00 0.00 H new ATOM 935 N ILE A 61 -7.613 21.748 21.445 1.00 0.00 N ATOM 936 CA ILE A 61 -6.313 21.400 20.886 1.00 0.00 C ATOM 937 C ILE A 61 -5.952 19.954 21.213 1.00 0.00 C ATOM 938 O ILE A 61 -5.523 19.195 20.344 1.00 0.00 O ATOM 939 CB ILE A 61 -5.243 22.302 21.469 1.00 0.00 C ATOM 940 CG1 ILE A 61 -5.455 23.731 20.938 1.00 0.00 C ATOM 941 CG2 ILE A 61 -3.880 21.755 21.059 1.00 0.00 C ATOM 942 CD1 ILE A 61 -4.149 24.510 20.925 1.00 0.00 C ATOM 0 H ILE A 61 -7.591 22.503 22.131 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.368 21.525 19.805 1.00 0.00 H new ATOM 0 HB ILE A 61 -5.298 22.330 22.557 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.868 23.690 19.930 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.185 24.249 21.560 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.095 22.390 21.469 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.764 20.742 21.443 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.805 21.742 19.972 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.329 25.516 20.545 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.751 24.570 21.938 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.429 24.003 20.282 1.00 0.00 H new ATOM 954 N ASP A 62 -6.132 19.588 22.479 1.00 0.00 N ATOM 955 CA ASP A 62 -5.827 18.238 22.937 1.00 0.00 C ATOM 956 C ASP A 62 -6.666 17.213 22.188 1.00 0.00 C ATOM 957 O ASP A 62 -6.248 16.070 22.003 1.00 0.00 O ATOM 958 CB ASP A 62 -6.079 18.122 24.437 1.00 0.00 C ATOM 959 CG ASP A 62 -5.683 16.727 24.922 1.00 0.00 C ATOM 960 OD1 ASP A 62 -4.514 16.394 24.821 1.00 0.00 O ATOM 961 OD2 ASP A 62 -6.558 16.010 25.385 1.00 0.00 O1- ATOM 0 H ASP A 62 -6.488 20.209 23.206 1.00 0.00 H new ATOM 0 HA ASP A 62 -4.775 18.037 22.736 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -5.505 18.879 24.971 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.131 18.307 24.654 1.00 0.00 H new ATOM 966 N GLU A 63 -7.854 17.626 21.765 1.00 0.00 N ATOM 967 CA GLU A 63 -8.749 16.730 21.041 1.00 0.00 C ATOM 968 C GLU A 63 -8.031 16.129 19.834 1.00 0.00 C ATOM 969 O GLU A 63 -8.220 14.958 19.510 1.00 0.00 O ATOM 970 CB GLU A 63 -9.966 17.509 20.550 1.00 0.00 C ATOM 971 CG GLU A 63 -10.969 16.553 19.912 1.00 0.00 C ATOM 972 CD GLU A 63 -11.596 15.667 20.985 1.00 0.00 C ATOM 973 OE1 GLU A 63 -11.411 15.966 22.155 1.00 0.00 O ATOM 974 OE2 GLU A 63 -12.258 14.707 20.626 1.00 0.00 O1- ATOM 0 H GLU A 63 -8.219 18.568 21.909 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.062 15.931 21.713 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.432 18.037 21.382 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -9.658 18.264 19.826 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.745 17.118 19.395 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.472 15.936 19.164 1.00 0.00 H new ATOM 981 N VAL A 64 -7.206 16.937 19.173 1.00 0.00 N ATOM 982 CA VAL A 64 -6.463 16.470 18.008 1.00 0.00 C ATOM 983 C VAL A 64 -4.972 16.368 18.314 1.00 0.00 C ATOM 984 O VAL A 64 -4.177 16.004 17.448 1.00 0.00 O ATOM 985 CB VAL A 64 -6.685 17.420 16.832 1.00 0.00 C ATOM 986 CG1 VAL A 64 -8.025 17.086 16.176 1.00 0.00 C ATOM 987 CG2 VAL A 64 -6.729 18.858 17.343 1.00 0.00 C ATOM 0 H VAL A 64 -7.036 17.911 19.423 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.829 15.477 17.747 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.874 17.312 16.112 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.196 17.758 15.335 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.009 16.056 15.821 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.827 17.206 16.905 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.887 19.537 16.505 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.546 18.966 18.057 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.785 19.099 17.832 1.00 0.00 H new ATOM 997 N ASP A 65 -4.597 16.689 19.548 1.00 0.00 N ATOM 998 CA ASP A 65 -3.196 16.627 19.941 1.00 0.00 C ATOM 999 C ASP A 65 -2.836 15.212 20.378 1.00 0.00 C ATOM 1000 O ASP A 65 -3.282 14.748 21.427 1.00 0.00 O ATOM 1001 CB ASP A 65 -2.931 17.607 21.083 1.00 0.00 C ATOM 1002 CG ASP A 65 -1.438 17.710 21.348 1.00 0.00 C ATOM 1003 OD1 ASP A 65 -0.709 16.847 20.888 1.00 0.00 O ATOM 1004 OD2 ASP A 65 -1.040 18.660 22.001 1.00 0.00 O1- ATOM 0 H ASP A 65 -5.235 16.991 20.284 1.00 0.00 H new ATOM 0 HA ASP A 65 -2.578 16.901 19.086 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.332 18.589 20.830 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.446 17.275 21.984 1.00 0.00 H new ATOM 1009 N GLU A 66 -2.044 14.524 19.563 1.00 0.00 N ATOM 1010 CA GLU A 66 -1.652 13.153 19.877 1.00 0.00 C ATOM 1011 C GLU A 66 -0.801 13.104 21.146 1.00 0.00 C ATOM 1012 O GLU A 66 -1.062 12.307 22.048 1.00 0.00 O ATOM 1013 CB GLU A 66 -0.854 12.568 18.719 1.00 0.00 C ATOM 1014 CG GLU A 66 -0.864 11.043 18.808 1.00 0.00 C ATOM 1015 CD GLU A 66 -0.010 10.450 17.692 1.00 0.00 C ATOM 1016 OE1 GLU A 66 1.173 10.257 17.916 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -0.553 10.200 16.627 1.00 0.00 O1- ATOM 0 H GLU A 66 -1.664 14.887 18.689 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.558 12.570 20.039 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -1.282 12.890 17.770 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.171 12.937 18.747 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.482 10.725 19.778 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.886 10.673 18.731 1.00 0.00 H new ATOM 1024 N ASP A 67 0.217 13.959 21.213 1.00 0.00 N ATOM 1025 CA ASP A 67 1.093 13.994 22.381 1.00 0.00 C ATOM 1026 C ASP A 67 0.554 14.963 23.430 1.00 0.00 C ATOM 1027 O ASP A 67 1.080 15.046 24.539 1.00 0.00 O ATOM 1028 CB ASP A 67 2.498 14.424 21.957 1.00 0.00 C ATOM 1029 CG ASP A 67 2.453 15.820 21.344 1.00 0.00 C ATOM 1030 OD1 ASP A 67 1.425 16.466 21.467 1.00 0.00 O ATOM 1031 OD2 ASP A 67 3.441 16.219 20.751 1.00 0.00 O1- ATOM 0 H ASP A 67 0.454 14.629 20.482 1.00 0.00 H new ATOM 0 HA ASP A 67 1.131 12.996 22.817 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.165 14.418 22.819 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.903 13.714 21.236 1.00 0.00 H new ATOM 1036 N GLY A 68 -0.502 15.684 23.076 1.00 0.00 N ATOM 1037 CA GLY A 68 -1.107 16.632 24.003 1.00 0.00 C ATOM 1038 C GLY A 68 -0.150 17.779 24.316 1.00 0.00 C ATOM 1039 O GLY A 68 -0.227 18.390 25.382 1.00 0.00 O ATOM 0 H GLY A 68 -0.954 15.632 22.163 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.027 17.028 23.574 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.380 16.120 24.926 1.00 0.00 H new ATOM 1043 N SER A 69 0.745 18.067 23.379 1.00 0.00 N ATOM 1044 CA SER A 69 1.712 19.144 23.560 1.00 0.00 C ATOM 1045 C SER A 69 1.018 20.499 23.548 1.00 0.00 C ATOM 1046 O SER A 69 1.668 21.541 23.607 1.00 0.00 O ATOM 1047 CB SER A 69 2.765 19.095 22.451 1.00 0.00 C ATOM 1048 OG SER A 69 2.177 18.584 21.265 1.00 0.00 O ATOM 0 H SER A 69 0.822 17.573 22.490 1.00 0.00 H new ATOM 0 HA SER A 69 2.198 19.009 24.526 1.00 0.00 H new ATOM 0 HB2 SER A 69 3.166 20.092 22.271 1.00 0.00 H new ATOM 0 HB3 SER A 69 3.601 18.466 22.756 1.00 0.00 H new ATOM 1054 N GLY A 70 -0.306 20.474 23.469 1.00 0.00 N ATOM 1055 CA GLY A 70 -1.079 21.707 23.452 1.00 0.00 C ATOM 1056 C GLY A 70 -0.965 22.391 22.096 1.00 0.00 C ATOM 1057 O GLY A 70 -1.289 23.570 21.954 1.00 0.00 O ATOM 0 H GLY A 70 -0.862 19.621 23.416 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.125 21.490 23.669 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.723 22.377 24.235 1.00 0.00 H new ATOM 1061 N THR A 71 -0.503 21.638 21.105 1.00 0.00 N ATOM 1062 CA THR A 71 -0.350 22.172 19.760 1.00 0.00 C ATOM 1063 C THR A 71 -0.743 21.132 18.712 1.00 0.00 C ATOM 1064 O THR A 71 -0.261 19.997 18.733 1.00 0.00 O ATOM 1065 CB THR A 71 1.100 22.602 19.544 1.00 0.00 C ATOM 1066 OG1 THR A 71 1.967 21.633 20.113 1.00 0.00 O ATOM 1067 CG2 THR A 71 1.340 23.966 20.196 1.00 0.00 C ATOM 0 H THR A 71 -0.229 20.661 21.208 1.00 0.00 H new ATOM 0 HA THR A 71 -1.009 23.033 19.651 1.00 0.00 H new ATOM 0 HB THR A 71 1.300 22.683 18.476 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.663 20.735 19.864 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.376 24.267 20.039 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.675 24.705 19.749 1.00 0.00 H new ATOM 0 HG23 THR A 71 1.140 23.898 21.265 1.00 0.00 H new ATOM 1075 N VAL A 72 -1.611 21.538 17.792 1.00 0.00 N ATOM 1076 CA VAL A 72 -2.067 20.656 16.723 1.00 0.00 C ATOM 1077 C VAL A 72 -1.288 20.938 15.435 1.00 0.00 C ATOM 1078 O VAL A 72 -1.540 21.919 14.741 1.00 0.00 O ATOM 1079 CB VAL A 72 -3.588 20.827 16.490 1.00 0.00 C ATOM 1080 CG1 VAL A 72 -4.082 22.137 17.123 1.00 0.00 C ATOM 1081 CG2 VAL A 72 -3.873 20.856 14.989 1.00 0.00 C ATOM 0 H VAL A 72 -2.014 22.475 17.765 1.00 0.00 H new ATOM 0 HA VAL A 72 -1.882 19.624 17.020 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.110 19.989 16.952 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.153 22.243 16.951 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -3.887 22.119 18.195 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -3.557 22.979 16.673 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.944 20.976 14.824 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -3.340 21.690 14.533 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -3.539 19.922 14.537 1.00 0.00 H new ATOM 1091 N ASP A 73 -0.350 20.065 15.114 1.00 0.00 N ATOM 1092 CA ASP A 73 0.441 20.236 13.905 1.00 0.00 C ATOM 1093 C ASP A 73 -0.385 19.884 12.677 1.00 0.00 C ATOM 1094 O ASP A 73 -1.607 19.786 12.752 1.00 0.00 O ATOM 1095 CB ASP A 73 1.667 19.343 13.965 1.00 0.00 C ATOM 1096 CG ASP A 73 2.505 19.682 15.190 1.00 0.00 C ATOM 1097 OD1 ASP A 73 2.774 20.851 15.394 1.00 0.00 O ATOM 1098 OD2 ASP A 73 2.860 18.763 15.911 1.00 0.00 O1- ATOM 0 H ASP A 73 -0.118 19.239 15.665 1.00 0.00 H new ATOM 0 HA ASP A 73 0.751 21.279 13.835 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.363 18.297 14.002 1.00 0.00 H new ATOM 0 HB3 ASP A 73 2.263 19.470 13.061 1.00 0.00 H new ATOM 1103 N PHE A 74 0.292 19.698 11.549 1.00 0.00 N ATOM 1104 CA PHE A 74 -0.394 19.366 10.308 1.00 0.00 C ATOM 1105 C PHE A 74 -1.223 18.098 10.467 1.00 0.00 C ATOM 1106 O PHE A 74 -2.392 18.063 10.087 1.00 0.00 O ATOM 1107 CB PHE A 74 0.622 19.171 9.181 1.00 0.00 C ATOM 1108 CG PHE A 74 -0.071 18.579 7.972 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -1.396 18.930 7.670 1.00 0.00 C ATOM 1110 CD2 PHE A 74 0.618 17.679 7.148 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -2.030 18.379 6.545 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -0.015 17.131 6.027 1.00 0.00 C ATOM 1113 CZ PHE A 74 -1.338 17.480 5.725 1.00 0.00 C ATOM 0 H PHE A 74 1.306 19.771 11.469 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.061 20.192 10.060 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.079 20.126 8.920 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.425 18.513 9.511 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.928 19.624 8.303 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.638 17.408 7.378 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -3.050 18.648 6.313 1.00 0.00 H new ATOM 0 HE2 PHE A 74 0.517 16.437 5.393 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.824 17.055 4.859 1.00 0.00 H new ATOM 1123 N ASP A 75 -0.616 17.060 11.022 1.00 0.00 N ATOM 1124 CA ASP A 75 -1.317 15.795 11.210 1.00 0.00 C ATOM 1125 C ASP A 75 -2.476 15.957 12.193 1.00 0.00 C ATOM 1126 O ASP A 75 -3.592 15.518 11.927 1.00 0.00 O ATOM 1127 CB ASP A 75 -0.353 14.752 11.752 1.00 0.00 C ATOM 1128 CG ASP A 75 0.972 14.825 10.999 1.00 0.00 C ATOM 1129 OD1 ASP A 75 1.834 15.575 11.430 1.00 0.00 O ATOM 1130 OD2 ASP A 75 1.110 14.128 10.008 1.00 0.00 O1- ATOM 0 H ASP A 75 0.351 17.065 11.348 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.712 15.477 10.245 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -0.186 14.918 12.816 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.785 13.757 11.649 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.202 16.585 13.335 1.00 0.00 N ATOM 1136 CA GLU A 76 -3.231 16.788 14.351 1.00 0.00 C ATOM 1137 C GLU A 76 -4.361 17.661 13.801 1.00 0.00 C ATOM 1138 O GLU A 76 -5.542 17.395 14.026 1.00 0.00 O ATOM 1139 CB GLU A 76 -2.601 17.464 15.579 1.00 0.00 C ATOM 1140 CG GLU A 76 -1.668 16.474 16.287 1.00 0.00 C ATOM 1141 CD GLU A 76 -0.837 17.185 17.358 1.00 0.00 C ATOM 1142 OE1 GLU A 76 -1.375 18.042 18.035 1.00 0.00 O ATOM 1143 OE2 GLU A 76 0.334 16.866 17.475 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.285 16.959 13.578 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.648 15.822 14.635 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.044 18.350 15.274 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.381 17.798 16.263 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -2.255 15.677 16.744 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -1.007 16.005 15.558 1.00 0.00 H new ATOM 1150 N PHE A 77 -3.994 18.702 13.063 1.00 0.00 N ATOM 1151 CA PHE A 77 -4.990 19.589 12.488 1.00 0.00 C ATOM 1152 C PHE A 77 -5.789 18.847 11.420 1.00 0.00 C ATOM 1153 O PHE A 77 -7.006 18.996 11.320 1.00 0.00 O ATOM 1154 CB PHE A 77 -4.299 20.833 11.892 1.00 0.00 C ATOM 1155 CG PHE A 77 -4.575 20.914 10.416 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -5.795 21.415 9.966 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -3.621 20.471 9.501 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -6.063 21.468 8.602 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -3.890 20.528 8.136 1.00 0.00 C ATOM 1160 CZ PHE A 77 -5.109 21.026 7.689 1.00 0.00 C ATOM 0 H PHE A 77 -3.027 18.948 12.852 1.00 0.00 H new ATOM 0 HA PHE A 77 -5.679 19.917 13.267 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.661 21.733 12.388 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -3.224 20.782 12.068 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -6.532 21.762 10.676 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.675 20.084 9.850 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -7.010 21.851 8.252 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -3.153 20.186 7.425 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.317 21.070 6.630 1.00 0.00 H new ATOM 1170 N LEU A 78 -5.091 18.055 10.624 1.00 0.00 N ATOM 1171 CA LEU A 78 -5.740 17.306 9.567 1.00 0.00 C ATOM 1172 C LEU A 78 -6.847 16.449 10.163 1.00 0.00 C ATOM 1173 O LEU A 78 -7.940 16.355 9.605 1.00 0.00 O ATOM 1174 CB LEU A 78 -4.703 16.434 8.855 1.00 0.00 C ATOM 1175 CG LEU A 78 -5.015 16.363 7.364 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -6.428 15.903 7.153 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -4.907 17.735 6.748 1.00 0.00 C ATOM 0 H LEU A 78 -4.083 17.916 10.690 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.181 17.988 8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.705 16.845 9.007 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.704 15.432 9.283 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.307 15.671 6.908 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.640 15.856 6.085 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.558 14.914 7.593 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.114 16.604 7.628 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.131 17.674 5.683 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -5.616 18.407 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.895 18.116 6.884 1.00 0.00 H new ATOM 1189 N VAL A 79 -6.564 15.856 11.320 1.00 0.00 N ATOM 1190 CA VAL A 79 -7.554 15.043 12.007 1.00 0.00 C ATOM 1191 C VAL A 79 -8.763 15.892 12.363 1.00 0.00 C ATOM 1192 O VAL A 79 -9.904 15.474 12.201 1.00 0.00 O ATOM 1193 CB VAL A 79 -6.957 14.433 13.270 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -8.079 13.849 14.123 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -5.987 13.313 12.885 1.00 0.00 C ATOM 0 H VAL A 79 -5.664 15.924 11.795 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.865 14.236 11.344 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.426 15.202 13.831 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.658 13.411 15.028 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -8.779 14.639 14.394 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.603 13.079 13.557 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.559 12.876 13.787 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.522 12.544 12.328 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.188 13.721 12.265 1.00 0.00 H new ATOM 1205 N MET A 80 -8.510 17.096 12.839 1.00 0.00 N ATOM 1206 CA MET A 80 -9.603 17.987 13.192 1.00 0.00 C ATOM 1207 C MET A 80 -10.581 18.116 12.028 1.00 0.00 C ATOM 1208 O MET A 80 -11.795 18.059 12.221 1.00 0.00 O ATOM 1209 CB MET A 80 -9.050 19.363 13.547 1.00 0.00 C ATOM 1210 CG MET A 80 -10.168 20.416 13.506 1.00 0.00 C ATOM 1211 SD MET A 80 -9.446 22.046 13.173 1.00 0.00 S ATOM 1212 CE MET A 80 -8.022 21.922 14.285 1.00 0.00 C ATOM 0 H MET A 80 -7.576 17.477 12.989 1.00 0.00 H new ATOM 0 HA MET A 80 -10.129 17.571 14.051 1.00 0.00 H new ATOM 0 HB2 MET A 80 -8.602 19.337 14.541 1.00 0.00 H new ATOM 0 HB3 MET A 80 -8.259 19.636 12.848 1.00 0.00 H new ATOM 0 HG2 MET A 80 -10.894 20.162 12.733 1.00 0.00 H new ATOM 0 HG3 MET A 80 -10.705 20.430 14.455 1.00 0.00 H new ATOM 0 HE1 MET A 80 -7.888 22.867 14.811 1.00 0.00 H new ATOM 0 HE2 MET A 80 -8.194 21.125 15.009 1.00 0.00 H new ATOM 0 HE3 MET A 80 -7.126 21.699 13.706 1.00 0.00 H new ATOM 1222 N MET A 81 -10.045 18.292 10.826 1.00 0.00 N ATOM 1223 CA MET A 81 -10.883 18.432 9.639 1.00 0.00 C ATOM 1224 C MET A 81 -11.742 17.194 9.429 1.00 0.00 C ATOM 1225 O MET A 81 -12.947 17.292 9.193 1.00 0.00 O ATOM 1226 CB MET A 81 -9.994 18.634 8.418 1.00 0.00 C ATOM 1227 CG MET A 81 -9.380 20.025 8.438 1.00 0.00 C ATOM 1228 SD MET A 81 -10.659 21.258 8.074 1.00 0.00 S ATOM 1229 CE MET A 81 -10.945 21.824 9.766 1.00 0.00 C ATOM 0 H MET A 81 -9.042 18.341 10.647 1.00 0.00 H new ATOM 0 HA MET A 81 -11.539 19.291 9.779 1.00 0.00 H new ATOM 0 HB2 MET A 81 -9.206 17.881 8.405 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.578 18.500 7.508 1.00 0.00 H new ATOM 0 HG2 MET A 81 -8.936 20.224 9.413 1.00 0.00 H new ATOM 0 HG3 MET A 81 -8.578 20.090 7.703 1.00 0.00 H new ATOM 0 HE1 MET A 81 -11.946 22.250 9.843 1.00 0.00 H new ATOM 0 HE2 MET A 81 -10.855 20.981 10.452 1.00 0.00 H new ATOM 0 HE3 MET A 81 -10.207 22.583 10.025 1.00 0.00 H new ATOM 1239 N VAL A 82 -11.125 16.031 9.540 1.00 0.00 N ATOM 1240 CA VAL A 82 -11.853 14.778 9.369 1.00 0.00 C ATOM 1241 C VAL A 82 -12.717 14.487 10.591 1.00 0.00 C ATOM 1242 O VAL A 82 -13.734 13.801 10.492 1.00 0.00 O ATOM 1243 CB VAL A 82 -10.882 13.613 9.116 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -9.504 13.976 9.638 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -11.366 12.356 9.841 1.00 0.00 C ATOM 0 H VAL A 82 -10.132 15.924 9.746 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.503 14.882 8.500 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.838 13.422 8.044 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.817 13.149 9.458 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.143 14.866 9.123 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.561 14.174 10.708 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.670 11.538 9.654 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.418 12.551 10.912 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.355 12.082 9.474 1.00 0.00 H new ATOM 1255 N ARG A 83 -12.306 15.002 11.740 1.00 0.00 N ATOM 1256 CA ARG A 83 -13.058 14.769 12.963 1.00 0.00 C ATOM 1257 C ARG A 83 -14.474 15.310 12.843 1.00 0.00 C ATOM 1258 O ARG A 83 -15.436 14.637 13.217 1.00 0.00 O ATOM 1259 CB ARG A 83 -12.354 15.436 14.149 1.00 0.00 C ATOM 1260 CG ARG A 83 -11.191 14.566 14.633 1.00 0.00 C ATOM 1261 CD ARG A 83 -10.574 15.197 15.882 1.00 0.00 C ATOM 1262 NE ARG A 83 -9.577 14.299 16.458 1.00 0.00 N ATOM 1263 CZ ARG A 83 -9.942 13.289 17.244 1.00 0.00 C ATOM 1264 NH1 ARG A 83 -11.205 13.091 17.511 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 83 -9.037 12.494 17.746 1.00 0.00 N ATOM 0 H ARG A 83 -11.470 15.575 11.851 1.00 0.00 H new ATOM 0 HA ARG A 83 -13.109 13.693 13.128 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -11.985 16.419 13.856 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.064 15.592 14.962 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -11.543 13.559 14.856 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -10.440 14.474 13.849 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -10.112 16.150 15.627 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -11.353 15.407 16.615 1.00 0.00 H new ATOM 0 HE ARG A 83 -8.588 14.448 16.255 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -11.913 13.711 17.117 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -11.484 12.317 18.114 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -8.051 12.647 17.536 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -9.316 11.720 18.349 1.00 0.00 H new ATOM 1279 N SER A 84 -14.603 16.517 12.311 1.00 0.00 N ATOM 1280 CA SER A 84 -15.917 17.117 12.143 1.00 0.00 C ATOM 1281 C SER A 84 -16.470 16.810 10.757 1.00 0.00 C ATOM 1282 O SER A 84 -17.669 16.939 10.516 1.00 0.00 O ATOM 1283 CB SER A 84 -15.828 18.628 12.337 1.00 0.00 C ATOM 1284 OG SER A 84 -15.126 19.199 11.241 1.00 0.00 O ATOM 0 H SER A 84 -13.824 17.093 11.992 1.00 0.00 H new ATOM 0 HA SER A 84 -16.588 16.695 12.891 1.00 0.00 H new ATOM 0 HB2 SER A 84 -16.827 19.057 12.408 1.00 0.00 H new ATOM 0 HB3 SER A 84 -15.316 18.857 13.272 1.00 0.00 H new ATOM 0 HG SER A 84 -15.068 20.170 11.360 1.00 0.00 H new ATOM 1290 N MET A 85 -15.585 16.405 9.849 1.00 0.00 N ATOM 1291 CA MET A 85 -15.985 16.079 8.482 1.00 0.00 C ATOM 1292 C MET A 85 -16.880 14.848 8.449 1.00 0.00 C ATOM 1293 O MET A 85 -17.911 14.835 7.778 1.00 0.00 O ATOM 1294 CB MET A 85 -14.745 15.823 7.633 1.00 0.00 C ATOM 1295 CG MET A 85 -14.539 16.985 6.661 1.00 0.00 C ATOM 1296 SD MET A 85 -12.819 17.552 6.685 1.00 0.00 S ATOM 1297 CE MET A 85 -12.028 15.941 6.501 1.00 0.00 C ATOM 0 H MET A 85 -14.588 16.295 10.034 1.00 0.00 H new ATOM 0 HA MET A 85 -16.545 16.924 8.082 1.00 0.00 H new ATOM 0 HB2 MET A 85 -13.870 15.712 8.274 1.00 0.00 H new ATOM 0 HB3 MET A 85 -14.856 14.890 7.081 1.00 0.00 H new ATOM 0 HG2 MET A 85 -14.809 16.672 5.652 1.00 0.00 H new ATOM 0 HG3 MET A 85 -15.201 17.809 6.927 1.00 0.00 H new ATOM 0 HE1 MET A 85 -11.083 15.936 7.044 1.00 0.00 H new ATOM 0 HE2 MET A 85 -12.682 15.167 6.903 1.00 0.00 H new ATOM 0 HE3 MET A 85 -11.841 15.746 5.445 1.00 0.00 H new ATOM 1307 N LYS A 86 -16.480 13.812 9.175 1.00 0.00 N ATOM 1308 CA LYS A 86 -17.259 12.583 9.214 1.00 0.00 C ATOM 1309 C LYS A 86 -18.648 12.858 9.775 1.00 0.00 C ATOM 1310 O LYS A 86 -19.648 12.367 9.251 1.00 0.00 O ATOM 1311 CB LYS A 86 -16.542 11.540 10.074 1.00 0.00 C ATOM 1312 CG LYS A 86 -17.345 10.240 10.088 1.00 0.00 C ATOM 1313 CD LYS A 86 -16.385 9.051 10.149 1.00 0.00 C ATOM 1314 CE LYS A 86 -17.075 7.865 10.822 1.00 0.00 C ATOM 1315 NZ LYS A 86 -16.236 6.644 10.658 1.00 0.00 N1+ ATOM 0 H LYS A 86 -15.630 13.798 9.739 1.00 0.00 H new ATOM 0 HA LYS A 86 -17.362 12.198 8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -15.542 11.356 9.681 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -16.421 11.914 11.091 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -18.017 10.224 10.946 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -17.967 10.174 9.195 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -16.067 8.776 9.143 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -15.487 9.324 10.704 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -17.230 8.073 11.881 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -18.059 7.705 10.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -16.705 5.836 11.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.110 6.443 9.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -15.307 6.800 11.098 1.00 0.00 H new ATOM 1329 N ASP A 87 -18.703 13.651 10.839 1.00 0.00 N ATOM 1330 CA ASP A 87 -19.978 13.989 11.457 1.00 0.00 C ATOM 1331 C ASP A 87 -20.376 15.420 11.106 1.00 0.00 C ATOM 1332 O ASP A 87 -21.218 16.021 11.775 1.00 0.00 O ATOM 1333 CB ASP A 87 -19.885 13.845 12.978 1.00 0.00 C ATOM 1334 CG ASP A 87 -18.930 14.888 13.545 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -18.402 15.665 12.766 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -18.748 14.901 14.752 1.00 0.00 O1- ATOM 0 H ASP A 87 -17.887 14.068 11.288 1.00 0.00 H new ATOM 0 HA ASP A 87 -20.735 13.303 11.076 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -20.873 13.965 13.423 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -19.538 12.844 13.236 1.00 0.00 H new ATOM 1341 N ASP A 88 -19.759 15.963 10.060 1.00 0.00 N ATOM 1342 CA ASP A 88 -20.054 17.330 9.639 1.00 0.00 C ATOM 1343 C ASP A 88 -21.531 17.474 9.294 1.00 0.00 C ATOM 1344 O ASP A 88 -22.186 18.430 9.712 1.00 0.00 O ATOM 1345 CB ASP A 88 -19.212 17.692 8.414 1.00 0.00 C ATOM 1346 CG ASP A 88 -19.501 19.126 7.983 1.00 0.00 C ATOM 1347 OD1 ASP A 88 -20.399 19.725 8.551 1.00 0.00 O ATOM 1348 OD2 ASP A 88 -18.825 19.602 7.086 1.00 0.00 O1- ATOM 0 H ASP A 88 -19.059 15.484 9.493 1.00 0.00 H new ATOM 0 HA ASP A 88 -19.812 18.003 10.461 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -18.153 17.580 8.646 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -19.433 17.007 7.596 1.00 0.00 H new ATOM 1353 N SER A 89 -22.050 16.521 8.532 1.00 0.00 N ATOM 1354 CA SER A 89 -23.454 16.550 8.141 1.00 0.00 C ATOM 1355 C SER A 89 -23.867 17.958 7.730 1.00 0.00 C ATOM 1356 O SER A 89 -25.039 18.313 7.839 1.00 0.00 O ATOM 1357 CB SER A 89 -24.332 16.090 9.301 1.00 0.00 C ATOM 1358 OG SER A 89 -24.022 14.742 9.623 1.00 0.00 O ATOM 0 H SER A 89 -21.525 15.723 8.174 1.00 0.00 H new ATOM 0 HA SER A 89 -23.584 15.877 7.294 1.00 0.00 H new ATOM 0 HB2 SER A 89 -24.170 16.729 10.169 1.00 0.00 H new ATOM 0 HB3 SER A 89 -25.385 16.178 9.032 1.00 0.00 H new ATOM 0 HG SER A 89 -24.584 14.446 10.369 1.00 0.00 H new ATOM 1364 N LYS A 90 -22.893 18.746 7.265 1.00 0.00 N ATOM 1365 CA LYS A 90 -23.148 20.125 6.841 1.00 0.00 C ATOM 1366 C LYS A 90 -24.624 20.478 6.999 1.00 0.00 C ATOM 1367 O LYS A 90 -25.129 20.574 8.117 1.00 0.00 O ATOM 1368 CB LYS A 90 -22.718 20.309 5.385 1.00 0.00 C ATOM 1369 CG LYS A 90 -22.955 19.007 4.628 1.00 0.00 C ATOM 1370 CD LYS A 90 -22.497 19.160 3.180 1.00 0.00 C ATOM 1371 CE LYS A 90 -23.686 19.560 2.305 1.00 0.00 C ATOM 1372 NZ LYS A 90 -23.280 19.528 0.870 1.00 0.00 N1+ ATOM 0 H LYS A 90 -21.921 18.452 7.173 1.00 0.00 H new ATOM 0 HA LYS A 90 -22.567 20.794 7.476 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -23.283 21.120 4.925 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -21.665 20.587 5.336 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -22.411 18.193 5.107 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -24.013 18.745 4.659 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -21.714 19.915 3.114 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -22.068 18.224 2.823 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -24.520 18.879 2.473 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -24.030 20.559 2.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -24.088 19.800 0.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -22.497 20.194 0.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -22.972 18.567 0.618 1.00 0.00 H new ATOM 1386 N GLY A 136 -25.315 20.658 5.878 1.00 0.00 N ATOM 1387 CA GLY A 136 -26.733 20.987 5.915 1.00 0.00 C ATOM 1388 C GLY A 136 -26.942 22.477 6.151 1.00 0.00 C ATOM 1389 O GLY A 136 -25.989 23.218 6.391 1.00 0.00 O ATOM 0 H GLY A 136 -24.919 20.582 4.941 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -27.202 20.695 4.976 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -27.221 20.418 6.706 1.00 0.00 H new ATOM 1393 N LYS A 137 -28.196 22.907 6.083 1.00 0.00 N ATOM 1394 CA LYS A 137 -28.523 24.313 6.294 1.00 0.00 C ATOM 1395 C LYS A 137 -30.000 24.564 6.008 1.00 0.00 C ATOM 1396 O LYS A 137 -30.775 24.864 6.915 1.00 0.00 O ATOM 1397 CB LYS A 137 -27.663 25.189 5.382 1.00 0.00 C ATOM 1398 CG LYS A 137 -27.110 26.370 6.183 1.00 0.00 C ATOM 1399 CD LYS A 137 -25.671 26.655 5.746 1.00 0.00 C ATOM 1400 CE LYS A 137 -24.726 26.431 6.927 1.00 0.00 C ATOM 1401 NZ LYS A 137 -23.533 25.666 6.470 1.00 0.00 N1+ ATOM 0 H LYS A 137 -28.998 22.308 5.885 1.00 0.00 H new ATOM 0 HA LYS A 137 -28.319 24.567 7.334 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -26.844 24.604 4.964 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -28.256 25.551 4.542 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -27.731 27.252 6.025 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -27.140 26.146 7.249 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -25.395 26.003 4.917 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -25.585 27.681 5.387 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -24.418 27.389 7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -25.239 25.886 7.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -22.890 25.513 7.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -23.835 24.747 6.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -23.039 26.203 5.728 1.00 0.00 H new ATOM 1415 N PHE A 138 -30.379 24.435 4.741 1.00 0.00 N ATOM 1416 CA PHE A 138 -31.766 24.643 4.341 1.00 0.00 C ATOM 1417 C PHE A 138 -32.309 23.413 3.623 1.00 0.00 C ATOM 1418 O PHE A 138 -33.520 23.267 3.453 1.00 0.00 O ATOM 1419 CB PHE A 138 -31.868 25.862 3.422 1.00 0.00 C ATOM 1420 CG PHE A 138 -32.144 27.096 4.247 1.00 0.00 C ATOM 1421 CD1 PHE A 138 -31.122 28.022 4.492 1.00 0.00 C ATOM 1422 CD2 PHE A 138 -33.425 27.315 4.766 1.00 0.00 C ATOM 1423 CE1 PHE A 138 -31.385 29.167 5.258 1.00 0.00 C ATOM 1424 CE2 PHE A 138 -33.687 28.457 5.530 1.00 0.00 C ATOM 1425 CZ PHE A 138 -32.667 29.384 5.776 1.00 0.00 C ATOM 0 H PHE A 138 -29.749 24.189 3.977 1.00 0.00 H new ATOM 0 HA PHE A 138 -32.360 24.815 5.238 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -30.941 25.986 2.862 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -32.664 25.714 2.692 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -30.133 27.855 4.092 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -34.213 26.601 4.576 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -30.598 29.882 5.448 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -34.676 28.624 5.930 1.00 0.00 H new ATOM 0 HZ PHE A 138 -32.869 30.266 6.365 1.00 0.00 H new ATOM 1435 N LYS A 139 -31.408 22.530 3.203 1.00 0.00 N ATOM 1436 CA LYS A 139 -31.816 21.314 2.503 1.00 0.00 C ATOM 1437 C LYS A 139 -31.757 20.106 3.430 1.00 0.00 C ATOM 1438 O LYS A 139 -32.342 19.060 3.145 1.00 0.00 O ATOM 1439 CB LYS A 139 -30.919 21.079 1.294 1.00 0.00 C ATOM 1440 CG LYS A 139 -29.471 21.191 1.732 1.00 0.00 C ATOM 1441 CD LYS A 139 -28.554 20.851 0.554 1.00 0.00 C ATOM 1442 CE LYS A 139 -28.630 19.350 0.262 1.00 0.00 C ATOM 1443 NZ LYS A 139 -27.946 18.593 1.347 1.00 0.00 N1+ ATOM 0 H LYS A 139 -30.401 22.630 3.333 1.00 0.00 H new ATOM 0 HA LYS A 139 -32.845 21.444 2.169 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -31.110 20.094 0.868 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -31.136 21.810 0.515 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -29.265 22.200 2.088 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -29.278 20.514 2.564 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -28.852 21.419 -0.327 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -27.527 21.136 0.785 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -29.671 19.036 0.187 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -28.162 19.132 -0.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -27.141 18.068 0.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -27.604 19.257 2.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -28.615 17.925 1.779 1.00 0.00 H new ATOM 1457 N ARG A 140 -31.042 20.256 4.539 1.00 0.00 N ATOM 1458 CA ARG A 140 -30.905 19.176 5.508 1.00 0.00 C ATOM 1459 C ARG A 140 -31.525 19.566 6.846 1.00 0.00 C ATOM 1460 O ARG A 140 -31.996 20.690 7.025 1.00 0.00 O ATOM 1461 CB ARG A 140 -29.428 18.837 5.703 1.00 0.00 C ATOM 1462 CG ARG A 140 -29.026 17.724 4.733 1.00 0.00 C ATOM 1463 CD ARG A 140 -28.203 16.675 5.486 1.00 0.00 C ATOM 1464 NE ARG A 140 -28.651 15.333 5.132 1.00 0.00 N ATOM 1465 CZ ARG A 140 -28.106 14.255 5.691 1.00 0.00 C ATOM 1466 NH1 ARG A 140 -27.150 14.388 6.570 1.00 0.00 N1+ ATOM 1467 NH2 ARG A 140 -28.528 13.066 5.359 1.00 0.00 N ATOM 0 H ARG A 140 -30.549 21.113 4.789 1.00 0.00 H new ATOM 0 HA ARG A 140 -31.431 18.302 5.124 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -28.815 19.722 5.531 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -29.249 18.520 6.731 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -29.914 17.264 4.299 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -28.445 18.136 3.908 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -27.146 16.789 5.244 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -28.302 16.828 6.561 1.00 0.00 H new ATOM 0 HE ARG A 140 -29.395 15.219 4.444 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -26.821 15.318 6.828 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -26.732 13.562 6.998 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -29.275 12.963 4.672 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -28.111 12.239 5.787 1.00 0.00 H new ATOM 1481 N PRO A 141 -31.553 18.647 7.773 1.00 0.00 N ATOM 1482 CA PRO A 141 -32.136 18.866 9.128 1.00 0.00 C ATOM 1483 C PRO A 141 -31.431 19.981 9.889 1.00 0.00 C ATOM 1484 O PRO A 141 -30.236 20.216 9.697 1.00 0.00 O ATOM 1485 CB PRO A 141 -31.954 17.513 9.831 1.00 0.00 C ATOM 1486 CG PRO A 141 -31.736 16.525 8.736 1.00 0.00 C ATOM 1487 CD PRO A 141 -31.013 17.287 7.639 1.00 0.00 C ATOM 0 HA PRO A 141 -33.178 19.183 9.076 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -31.105 17.536 10.514 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -32.833 17.256 10.423 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -31.142 15.679 9.083 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -32.683 16.123 8.376 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -29.932 17.266 7.778 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -31.216 16.867 6.654 1.00 0.00 H new ATOM 1495 N THR A 142 -32.174 20.666 10.751 1.00 0.00 N ATOM 1496 CA THR A 142 -31.603 21.756 11.533 1.00 0.00 C ATOM 1497 C THR A 142 -30.652 21.207 12.591 1.00 0.00 C ATOM 1498 O THR A 142 -29.771 20.410 12.278 1.00 0.00 O ATOM 1499 CB THR A 142 -32.712 22.565 12.200 1.00 0.00 C ATOM 1500 OG1 THR A 142 -32.137 23.590 12.997 1.00 0.00 O ATOM 1501 CG2 THR A 142 -33.526 21.635 13.072 1.00 0.00 C ATOM 0 H THR A 142 -33.163 20.488 10.925 1.00 0.00 H new ATOM 0 HA THR A 142 -31.044 22.408 10.862 1.00 0.00 H new ATOM 0 HB THR A 142 -33.352 23.021 11.445 1.00 0.00 H new ATOM 0 HG1 THR A 142 -32.678 23.720 13.804 1.00 0.00 H new ATOM 0 HG21 THR A 142 -34.324 22.197 13.557 1.00 0.00 H new ATOM 0 HG22 THR A 142 -33.959 20.846 12.457 1.00 0.00 H new ATOM 0 HG23 THR A 142 -32.882 21.191 13.831 1.00 0.00 H new ATOM 1509 N LEU A 143 -30.837 21.637 13.838 1.00 0.00 N ATOM 1510 CA LEU A 143 -29.988 21.180 14.936 1.00 0.00 C ATOM 1511 C LEU A 143 -28.716 22.017 15.014 1.00 0.00 C ATOM 1512 O LEU A 143 -28.456 22.855 14.148 1.00 0.00 O ATOM 1513 CB LEU A 143 -29.626 19.710 14.750 1.00 0.00 C ATOM 1514 CG LEU A 143 -30.899 18.910 14.478 1.00 0.00 C ATOM 1515 CD1 LEU A 143 -30.538 17.443 14.272 1.00 0.00 C ATOM 1516 CD2 LEU A 143 -31.847 19.035 15.674 1.00 0.00 C ATOM 0 H LEU A 143 -31.564 22.298 14.112 1.00 0.00 H new ATOM 0 HA LEU A 143 -30.543 21.296 15.867 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -28.927 19.597 13.921 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -29.127 19.330 15.642 1.00 0.00 H new ATOM 0 HG LEU A 143 -31.388 19.297 13.584 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -31.444 16.869 14.078 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -29.861 17.351 13.423 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -30.051 17.059 15.168 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -32.755 18.464 15.480 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -31.358 18.647 16.568 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -32.103 20.083 15.827 1.00 0.00 H new ATOM 1528 N ARG A 144 -27.929 21.792 16.061 1.00 0.00 N ATOM 1529 CA ARG A 144 -26.688 22.538 16.245 1.00 0.00 C ATOM 1530 C ARG A 144 -25.560 21.896 15.438 1.00 0.00 C ATOM 1531 O ARG A 144 -25.576 21.921 14.207 1.00 0.00 O ATOM 1532 CB ARG A 144 -26.316 22.557 17.730 1.00 0.00 C ATOM 1533 CG ARG A 144 -27.058 23.694 18.435 1.00 0.00 C ATOM 1534 CD ARG A 144 -26.289 25.002 18.247 1.00 0.00 C ATOM 1535 NE ARG A 144 -26.822 25.743 17.110 1.00 0.00 N ATOM 1536 CZ ARG A 144 -26.117 26.708 16.531 1.00 0.00 C ATOM 1537 NH1 ARG A 144 -24.927 27.005 16.976 1.00 0.00 N1+ ATOM 1538 NH2 ARG A 144 -26.617 27.363 15.518 1.00 0.00 N ATOM 0 H ARG A 144 -28.125 21.106 16.789 1.00 0.00 H new ATOM 0 HA ARG A 144 -26.833 23.560 15.894 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -26.572 21.603 18.191 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -25.240 22.687 17.843 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -28.065 23.791 18.030 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -27.162 23.471 19.497 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -26.361 25.607 19.151 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -25.231 24.791 18.089 1.00 0.00 H new ATOM 0 HE ARG A 144 -27.751 25.517 16.754 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -24.537 26.496 17.769 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -24.386 27.746 16.531 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -27.549 27.133 15.172 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -26.076 28.104 15.073 1.00 0.00 H new ATOM 1552 N ARG A 145 -24.589 21.316 16.137 1.00 0.00 N ATOM 1553 CA ARG A 145 -23.464 20.665 15.477 1.00 0.00 C ATOM 1554 C ARG A 145 -22.835 21.598 14.449 1.00 0.00 C ATOM 1555 O ARG A 145 -22.482 21.176 13.349 1.00 0.00 O ATOM 1556 CB ARG A 145 -23.934 19.379 14.789 1.00 0.00 C ATOM 1557 CG ARG A 145 -25.050 18.739 15.616 1.00 0.00 C ATOM 1558 CD ARG A 145 -24.551 18.461 17.034 1.00 0.00 C ATOM 1559 NE ARG A 145 -25.541 18.906 18.009 1.00 0.00 N ATOM 1560 CZ ARG A 145 -26.700 18.273 18.153 1.00 0.00 C ATOM 1561 NH1 ARG A 145 -26.974 17.235 17.411 1.00 0.00 N1+ ATOM 1562 NH2 ARG A 145 -27.566 18.693 19.034 1.00 0.00 N ATOM 0 H ARG A 145 -24.559 21.284 17.156 1.00 0.00 H new ATOM 0 HA ARG A 145 -22.716 20.418 16.231 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -24.293 19.601 13.784 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -23.101 18.684 14.683 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -25.916 19.401 15.649 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -25.376 17.811 15.147 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -24.360 17.395 17.158 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -23.605 18.976 17.203 1.00 0.00 H new ATOM 0 HE ARG A 145 -25.339 19.719 18.591 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -26.298 16.909 16.720 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -27.864 16.749 17.522 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -27.353 19.507 19.611 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -28.456 18.208 19.146 1.00 0.00 H new ATOM 1576 N VAL A 146 -22.704 22.869 14.810 1.00 0.00 N ATOM 1577 CA VAL A 146 -22.121 23.850 13.903 1.00 0.00 C ATOM 1578 C VAL A 146 -20.603 23.879 14.049 1.00 0.00 C ATOM 1579 O VAL A 146 -19.872 23.840 13.060 1.00 0.00 O ATOM 1580 CB VAL A 146 -22.689 25.234 14.206 1.00 0.00 C ATOM 1581 CG1 VAL A 146 -22.241 26.220 13.126 1.00 0.00 C ATOM 1582 CG2 VAL A 146 -24.214 25.150 14.239 1.00 0.00 C ATOM 0 H VAL A 146 -22.990 23.242 15.715 1.00 0.00 H new ATOM 0 HA VAL A 146 -22.370 23.568 12.880 1.00 0.00 H new ATOM 0 HB VAL A 146 -22.324 25.581 15.173 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -22.647 27.208 13.344 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -21.152 26.271 13.109 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -22.604 25.885 12.154 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -24.628 26.135 14.455 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -24.580 24.806 13.272 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -24.523 24.449 15.014 1.00 0.00 H new ATOM 1592 N ARG A 147 -20.140 23.943 15.292 1.00 0.00 N ATOM 1593 CA ARG A 147 -18.708 23.971 15.572 1.00 0.00 C ATOM 1594 C ARG A 147 -17.990 24.886 14.583 1.00 0.00 C ATOM 1595 O ARG A 147 -18.624 25.685 13.895 1.00 0.00 O ATOM 1596 CB ARG A 147 -18.139 22.556 15.469 1.00 0.00 C ATOM 1597 CG ARG A 147 -18.309 21.847 16.811 1.00 0.00 C ATOM 1598 CD ARG A 147 -19.778 21.464 16.987 1.00 0.00 C ATOM 1599 NE ARG A 147 -19.955 20.688 18.211 1.00 0.00 N ATOM 1600 CZ ARG A 147 -19.709 19.381 18.241 1.00 0.00 C ATOM 1601 NH1 ARG A 147 -19.301 18.767 17.164 1.00 0.00 N1+ ATOM 1602 NH2 ARG A 147 -19.875 18.712 19.349 1.00 0.00 N ATOM 0 H ARG A 147 -20.733 23.976 16.121 1.00 0.00 H new ATOM 0 HA ARG A 147 -18.554 24.355 16.580 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -18.652 22.001 14.684 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -17.085 22.594 15.195 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -17.680 20.957 16.849 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -17.989 22.498 17.624 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -20.393 22.363 17.026 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -20.115 20.884 16.128 1.00 0.00 H new ATOM 0 HE ARG A 147 -20.273 21.157 19.059 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -19.170 19.289 16.298 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -19.113 17.765 17.189 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -20.193 19.191 20.191 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -19.687 17.710 19.373 1.00 0.00 H new ATOM 1616 N ILE A 148 -16.668 24.762 14.513 1.00 0.00 N ATOM 1617 CA ILE A 148 -15.886 25.584 13.598 1.00 0.00 C ATOM 1618 C ILE A 148 -16.142 25.161 12.152 1.00 0.00 C ATOM 1619 O ILE A 148 -15.321 24.486 11.530 1.00 0.00 O ATOM 1620 CB ILE A 148 -14.396 25.449 13.924 1.00 0.00 C ATOM 1621 CG1 ILE A 148 -13.606 26.503 13.147 1.00 0.00 C ATOM 1622 CG2 ILE A 148 -13.905 24.057 13.528 1.00 0.00 C ATOM 1623 CD1 ILE A 148 -12.203 26.628 13.742 1.00 0.00 C ATOM 0 H ILE A 148 -16.121 24.108 15.073 1.00 0.00 H new ATOM 0 HA ILE A 148 -16.187 26.625 13.716 1.00 0.00 H new ATOM 0 HB ILE A 148 -14.248 25.595 14.994 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -13.543 26.224 12.095 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -14.119 27.464 13.192 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -12.844 23.965 13.762 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -14.465 23.303 14.081 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -14.055 23.909 12.459 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -11.639 27.379 13.189 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -12.277 26.927 14.788 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -11.692 25.668 13.674 1.00 0.00 H new ATOM 1635 N SER A 149 -17.290 25.564 11.616 1.00 0.00 N ATOM 1636 CA SER A 149 -17.636 25.219 10.244 1.00 0.00 C ATOM 1637 C SER A 149 -16.384 25.189 9.375 1.00 0.00 C ATOM 1638 O SER A 149 -15.819 26.233 9.055 1.00 0.00 O ATOM 1639 CB SER A 149 -18.628 26.238 9.682 1.00 0.00 C ATOM 1640 OG SER A 149 -19.840 25.577 9.347 1.00 0.00 O ATOM 0 H SER A 149 -17.989 26.123 12.105 1.00 0.00 H new ATOM 0 HA SER A 149 -18.095 24.230 10.239 1.00 0.00 H new ATOM 0 HB2 SER A 149 -18.818 27.021 10.416 1.00 0.00 H new ATOM 0 HB3 SER A 149 -18.209 26.723 8.800 1.00 0.00 H new ATOM 0 HG SER A 149 -19.730 25.104 8.496 1.00 0.00 H new ATOM 1646 N ALA A 150 -15.959 23.987 9.000 1.00 0.00 N ATOM 1647 CA ALA A 150 -14.767 23.827 8.172 1.00 0.00 C ATOM 1648 C ALA A 150 -14.940 24.553 6.845 1.00 0.00 C ATOM 1649 O ALA A 150 -14.000 25.163 6.335 1.00 0.00 O ATOM 1650 CB ALA A 150 -14.508 22.341 7.911 1.00 0.00 C ATOM 0 H ALA A 150 -16.419 23.113 9.254 1.00 0.00 H new ATOM 0 HA ALA A 150 -13.917 24.256 8.703 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -13.617 22.230 7.293 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -14.358 21.826 8.860 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -15.364 21.908 7.394 1.00 0.00 H new ATOM 1656 N ASP A 151 -16.145 24.481 6.290 1.00 0.00 N ATOM 1657 CA ASP A 151 -16.431 25.136 5.019 1.00 0.00 C ATOM 1658 C ASP A 151 -15.824 26.535 4.995 1.00 0.00 C ATOM 1659 O ASP A 151 -14.719 26.736 4.498 1.00 0.00 O ATOM 1660 CB ASP A 151 -17.945 25.237 4.805 1.00 0.00 C ATOM 1661 CG ASP A 151 -18.679 24.374 5.827 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -18.545 24.648 7.008 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -19.358 23.449 5.414 1.00 0.00 O1- ATOM 0 H ASP A 151 -16.934 23.979 6.697 1.00 0.00 H new ATOM 0 HA ASP A 151 -15.991 24.540 4.219 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -18.265 26.275 4.898 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -18.200 24.914 3.795 1.00 0.00 H new ATOM 1668 N ALA A 152 -16.549 27.496 5.547 1.00 0.00 N ATOM 1669 CA ALA A 152 -16.079 28.873 5.589 1.00 0.00 C ATOM 1670 C ALA A 152 -14.785 28.989 6.378 1.00 0.00 C ATOM 1671 O ALA A 152 -13.934 29.822 6.070 1.00 0.00 O ATOM 1672 CB ALA A 152 -17.137 29.760 6.219 1.00 0.00 C ATOM 0 H ALA A 152 -17.464 27.348 5.972 1.00 0.00 H new ATOM 0 HA ALA A 152 -15.888 29.195 4.565 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -16.779 30.789 6.247 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -18.052 29.710 5.629 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -17.341 29.419 7.234 1.00 0.00 H new ATOM 1678 N MET A 153 -14.647 28.165 7.406 1.00 0.00 N ATOM 1679 CA MET A 153 -13.454 28.208 8.234 1.00 0.00 C ATOM 1680 C MET A 153 -12.209 28.213 7.364 1.00 0.00 C ATOM 1681 O MET A 153 -11.329 29.053 7.538 1.00 0.00 O ATOM 1682 CB MET A 153 -13.428 26.979 9.153 1.00 0.00 C ATOM 1683 CG MET A 153 -12.055 26.843 9.820 1.00 0.00 C ATOM 1684 SD MET A 153 -11.820 25.133 10.373 1.00 0.00 S ATOM 1685 CE MET A 153 -10.039 25.249 10.679 1.00 0.00 C ATOM 0 H MET A 153 -15.337 27.467 7.683 1.00 0.00 H new ATOM 0 HA MET A 153 -13.471 29.119 8.833 1.00 0.00 H new ATOM 0 HB2 MET A 153 -14.203 27.069 9.915 1.00 0.00 H new ATOM 0 HB3 MET A 153 -13.651 26.081 8.577 1.00 0.00 H new ATOM 0 HG2 MET A 153 -11.269 27.121 9.118 1.00 0.00 H new ATOM 0 HG3 MET A 153 -11.981 27.524 10.668 1.00 0.00 H new ATOM 0 HE1 MET A 153 -9.501 24.695 9.910 1.00 0.00 H new ATOM 0 HE2 MET A 153 -9.733 26.295 10.654 1.00 0.00 H new ATOM 0 HE3 MET A 153 -9.810 24.828 11.658 1.00 0.00 H new ATOM 1695 N MET A 154 -12.143 27.289 6.420 1.00 0.00 N ATOM 1696 CA MET A 154 -11.001 27.226 5.529 1.00 0.00 C ATOM 1697 C MET A 154 -11.085 28.320 4.476 1.00 0.00 C ATOM 1698 O MET A 154 -10.066 28.761 3.945 1.00 0.00 O ATOM 1699 CB MET A 154 -10.934 25.866 4.850 1.00 0.00 C ATOM 1700 CG MET A 154 -10.351 24.839 5.819 1.00 0.00 C ATOM 1701 SD MET A 154 -9.215 23.758 4.920 1.00 0.00 S ATOM 1702 CE MET A 154 -8.077 25.058 4.376 1.00 0.00 C ATOM 0 H MET A 154 -12.858 26.581 6.253 1.00 0.00 H new ATOM 0 HA MET A 154 -10.098 27.374 6.121 1.00 0.00 H new ATOM 0 HB2 MET A 154 -11.930 25.557 4.532 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.318 25.926 3.953 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.827 25.343 6.631 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.150 24.252 6.271 1.00 0.00 H new ATOM 0 HE1 MET A 154 -8.173 25.199 3.299 1.00 0.00 H new ATOM 0 HE2 MET A 154 -8.319 25.990 4.887 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.053 24.769 4.614 1.00 0.00 H new ATOM 1712 N GLN A 155 -12.309 28.743 4.164 1.00 0.00 N ATOM 1713 CA GLN A 155 -12.506 29.776 3.157 1.00 0.00 C ATOM 1714 C GLN A 155 -11.803 31.060 3.572 1.00 0.00 C ATOM 1715 O GLN A 155 -11.149 31.710 2.755 1.00 0.00 O ATOM 1716 CB GLN A 155 -14.003 30.060 2.970 1.00 0.00 C ATOM 1717 CG GLN A 155 -14.674 28.864 2.304 1.00 0.00 C ATOM 1718 CD GLN A 155 -16.131 29.179 1.983 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -16.443 30.270 1.507 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -17.046 28.276 2.212 1.00 0.00 N ATOM 0 H GLN A 155 -13.166 28.390 4.589 1.00 0.00 H new ATOM 0 HA GLN A 155 -12.085 29.420 2.217 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -14.468 30.259 3.935 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -14.140 30.953 2.360 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -14.142 28.604 1.389 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -14.620 27.996 2.962 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -16.784 27.373 2.607 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -18.023 28.474 1.996 1.00 0.00 H new ATOM 1729 N ALA A 156 -11.933 31.416 4.844 1.00 0.00 N ATOM 1730 CA ALA A 156 -11.296 32.622 5.352 1.00 0.00 C ATOM 1731 C ALA A 156 -9.776 32.504 5.271 1.00 0.00 C ATOM 1732 O ALA A 156 -9.089 33.434 4.848 1.00 0.00 O ATOM 1733 CB ALA A 156 -11.713 32.851 6.808 1.00 0.00 C ATOM 0 H ALA A 156 -12.469 30.892 5.536 1.00 0.00 H new ATOM 0 HA ALA A 156 -11.615 33.466 4.740 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -11.235 33.755 7.186 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -12.796 32.964 6.863 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -11.406 31.998 7.413 1.00 0.00 H new ATOM 1739 N LEU A 157 -9.262 31.348 5.678 1.00 0.00 N ATOM 1740 CA LEU A 157 -7.821 31.110 5.667 1.00 0.00 C ATOM 1741 C LEU A 157 -7.279 31.177 4.248 1.00 0.00 C ATOM 1742 O LEU A 157 -6.227 31.766 4.002 1.00 0.00 O ATOM 1743 CB LEU A 157 -7.503 29.738 6.261 1.00 0.00 C ATOM 1744 CG LEU A 157 -8.622 29.311 7.213 1.00 0.00 C ATOM 1745 CD1 LEU A 157 -8.226 28.029 7.926 1.00 0.00 C ATOM 1746 CD2 LEU A 157 -8.877 30.395 8.254 1.00 0.00 C ATOM 0 H LEU A 157 -9.818 30.564 6.018 1.00 0.00 H new ATOM 0 HA LEU A 157 -7.347 31.885 6.270 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -7.392 29.003 5.463 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -6.553 29.774 6.795 1.00 0.00 H new ATOM 0 HG LEU A 157 -9.529 29.150 6.630 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -9.025 27.728 8.603 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -8.057 27.242 7.192 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -7.312 28.197 8.495 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -9.676 30.076 8.923 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -7.968 30.567 8.830 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -9.170 31.318 7.754 1.00 0.00 H new ATOM 1758 N LEU A 158 -8.004 30.569 3.320 1.00 0.00 N ATOM 1759 CA LEU A 158 -7.586 30.568 1.929 1.00 0.00 C ATOM 1760 C LEU A 158 -8.010 31.866 1.250 1.00 0.00 C ATOM 1761 O LEU A 158 -7.547 32.185 0.155 1.00 0.00 O ATOM 1762 CB LEU A 158 -8.208 29.376 1.198 1.00 0.00 C ATOM 1763 CG LEU A 158 -7.757 28.079 1.864 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -8.409 26.883 1.163 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.235 27.951 1.770 1.00 0.00 C ATOM 0 H LEU A 158 -8.877 30.075 3.504 1.00 0.00 H new ATOM 0 HA LEU A 158 -6.500 30.486 1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.295 29.449 1.220 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.909 29.382 0.150 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.057 28.095 2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -8.084 25.959 1.642 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -9.493 26.967 1.234 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.114 26.871 0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -5.918 27.024 2.247 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -5.935 27.942 0.722 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -5.767 28.797 2.274 1.00 0.00 H new ATOM 1777 N GLY A 159 -8.892 32.622 1.900 1.00 0.00 N ATOM 1778 CA GLY A 159 -9.352 33.882 1.328 1.00 0.00 C ATOM 1779 C GLY A 159 -10.011 33.651 -0.030 1.00 0.00 C ATOM 1780 O GLY A 159 -9.947 34.507 -0.912 1.00 0.00 O ATOM 0 H GLY A 159 -9.296 32.389 2.807 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -10.061 34.357 2.006 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -8.510 34.566 1.217 1.00 0.00 H new ATOM 1784 N ALA A 160 -10.633 32.488 -0.193 1.00 0.00 N ATOM 1785 CA ALA A 160 -11.290 32.154 -1.454 1.00 0.00 C ATOM 1786 C ALA A 160 -10.262 31.760 -2.509 1.00 0.00 C ATOM 1787 O ALA A 160 -10.621 31.325 -3.604 1.00 0.00 O ATOM 1788 CB ALA A 160 -12.095 33.355 -1.957 1.00 0.00 C ATOM 0 H ALA A 160 -10.697 31.766 0.525 1.00 0.00 H new ATOM 0 HA ALA A 160 -11.958 31.311 -1.278 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -12.582 33.098 -2.898 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -12.851 33.622 -1.218 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -11.426 34.201 -2.114 1.00 0.00 H new ATOM 1794 N ARG A 161 -8.983 31.911 -2.170 1.00 0.00 N ATOM 1795 CA ARG A 161 -7.905 31.573 -3.094 1.00 0.00 C ATOM 1796 C ARG A 161 -8.366 31.721 -4.539 1.00 0.00 C ATOM 1797 O ARG A 161 -7.977 30.935 -5.402 1.00 0.00 O ATOM 1798 CB ARG A 161 -7.442 30.133 -2.861 1.00 0.00 C ATOM 1799 CG ARG A 161 -8.662 29.210 -2.798 1.00 0.00 C ATOM 1800 CD ARG A 161 -8.209 27.787 -2.480 1.00 0.00 C ATOM 1801 NE ARG A 161 -7.530 27.206 -3.635 1.00 0.00 N ATOM 1802 CZ ARG A 161 -8.217 26.609 -4.605 1.00 0.00 C ATOM 1803 NH1 ARG A 161 -9.517 26.533 -4.534 1.00 0.00 N1+ ATOM 1804 NH2 ARG A 161 -7.590 26.101 -5.633 1.00 0.00 N ATOM 0 H ARG A 161 -8.670 32.264 -1.266 1.00 0.00 H new ATOM 0 HA ARG A 161 -7.078 32.259 -2.912 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -6.776 29.819 -3.665 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -6.874 30.068 -1.933 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -9.357 29.561 -2.035 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -9.195 29.229 -3.748 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -7.539 27.794 -1.620 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -9.069 27.175 -2.209 1.00 0.00 H new ATOM 0 HE ARG A 161 -6.513 27.259 -3.699 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -10.008 26.932 -3.734 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -10.043 26.075 -5.279 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -6.574 26.162 -5.692 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -8.117 25.643 -6.377 1.00 0.00 H new ATOM 1818 N ALA A 162 -9.201 32.727 -4.794 1.00 0.00 N ATOM 1819 CA ALA A 162 -9.716 32.964 -6.140 1.00 0.00 C ATOM 1820 C ALA A 162 -10.312 31.682 -6.718 1.00 0.00 C ATOM 1821 O ALA A 162 -9.631 30.664 -6.833 1.00 0.00 O ATOM 1822 CB ALA A 162 -8.597 33.471 -7.051 1.00 0.00 C ATOM 0 H ALA A 162 -9.533 33.387 -4.091 1.00 0.00 H new ATOM 0 HA ALA A 162 -10.499 33.720 -6.081 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -8.993 33.644 -8.052 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -8.198 34.404 -6.652 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -7.802 32.727 -7.099 1.00 0.00 H new ATOM 1828 N LYS A 163 -11.591 31.731 -7.075 1.00 0.00 N ATOM 1829 CA LYS A 163 -12.251 30.556 -7.628 1.00 0.00 C ATOM 1830 C LYS A 163 -11.546 30.096 -8.899 1.00 0.00 C ATOM 1831 O LYS A 163 -11.340 30.880 -9.825 1.00 0.00 O ATOM 1832 CB LYS A 163 -13.710 30.888 -7.946 1.00 0.00 C ATOM 1833 CG LYS A 163 -14.469 31.152 -6.644 1.00 0.00 C ATOM 1834 CD LYS A 163 -15.903 31.585 -6.965 1.00 0.00 C ATOM 1835 CE LYS A 163 -16.643 30.430 -7.638 1.00 0.00 C ATOM 1836 NZ LYS A 163 -16.711 29.271 -6.704 1.00 0.00 N1+ ATOM 0 H LYS A 163 -12.183 32.558 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 163 -12.208 29.753 -6.892 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -13.762 31.763 -8.594 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -14.172 30.063 -8.488 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -14.479 30.253 -6.028 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -13.964 31.927 -6.068 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -16.419 31.879 -6.051 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -15.894 32.456 -7.620 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -17.648 30.743 -7.919 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -16.130 30.141 -8.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -17.518 28.666 -6.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -15.831 28.720 -6.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -16.831 29.616 -5.730 1.00 0.00 H new ATOM 1850 N GLY A 164 -11.179 28.818 -8.936 1.00 0.00 N ATOM 1851 CA GLY A 164 -10.500 28.260 -10.099 1.00 0.00 C ATOM 1852 C GLY A 164 -11.501 27.877 -11.183 1.00 0.00 C ATOM 1853 O GLY A 164 -12.701 27.790 -10.929 1.00 0.00 O ATOM 0 H GLY A 164 -11.340 28.154 -8.179 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -9.791 28.987 -10.494 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -9.925 27.382 -9.803 1.00 0.00 H new ATOM 1857 N HIS A 165 -10.996 27.643 -12.390 1.00 0.00 N ATOM 1858 CA HIS A 165 -11.856 27.262 -13.503 1.00 0.00 C ATOM 1859 C HIS A 165 -11.174 27.554 -14.836 1.00 0.00 C ATOM 1860 O HIS A 165 -10.827 26.636 -15.582 1.00 0.00 O ATOM 1861 CB HIS A 165 -13.177 28.028 -13.431 1.00 0.00 C ATOM 1862 CG HIS A 165 -14.290 27.077 -13.085 1.00 0.00 C ATOM 1863 ND1 HIS A 165 -14.324 25.945 -12.309 1.00 0.00 N flip ATOM 1864 CD2 HIS A 165 -15.579 27.244 -13.568 1.00 0.00 C flip ATOM 1865 CE1 HIS A 165 -15.612 25.416 -12.308 1.00 0.00 C flip ATOM 1866 NE2 HIS A 165 -16.328 26.237 -13.082 1.00 0.00 N flip ATOM 0 H HIS A 165 -10.005 27.710 -12.621 1.00 0.00 H new ATOM 0 HA HIS A 165 -12.050 26.192 -13.432 1.00 0.00 H new ATOM 0 HB2 HIS A 165 -13.112 28.817 -12.681 1.00 0.00 H new ATOM 0 HB3 HIS A 165 -13.382 28.512 -14.386 1.00 0.00 H new ATOM 0 HD2 HIS A 165 -15.920 28.038 -14.216 1.00 0.00 H new ATOM 0 HE1 HIS A 165 -15.958 24.532 -11.793 1.00 0.00 H new ATOM 0 HE2 HIS A 165 -17.321 26.115 -13.280 1.00 0.00 H new ATOM 1874 N HIS A 166 -10.986 28.837 -15.128 1.00 0.00 N ATOM 1875 CA HIS A 166 -10.345 29.242 -16.373 1.00 0.00 C ATOM 1876 C HIS A 166 -9.665 30.597 -16.214 1.00 0.00 C ATOM 1877 O HIS A 166 -9.980 31.360 -15.301 1.00 0.00 O ATOM 1878 CB HIS A 166 -11.387 29.320 -17.490 1.00 0.00 C ATOM 1879 CG HIS A 166 -12.411 30.369 -17.144 1.00 0.00 C ATOM 1880 ND1 HIS A 166 -13.440 30.125 -16.248 1.00 0.00 N ATOM 1881 CD2 HIS A 166 -12.577 31.665 -17.563 1.00 0.00 C ATOM 1882 CE1 HIS A 166 -14.174 31.250 -16.158 1.00 0.00 C ATOM 1883 NE2 HIS A 166 -13.692 32.220 -16.939 1.00 0.00 N ATOM 0 H HIS A 166 -11.266 29.609 -14.524 1.00 0.00 H new ATOM 0 HA HIS A 166 -9.589 28.500 -16.629 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -10.905 29.565 -18.436 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -11.871 28.352 -17.620 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -11.940 32.177 -18.269 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -15.047 31.355 -15.530 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -14.061 33.164 -17.054 1.00 0.00 H new ATOM 1891 N HIS A 167 -8.731 30.888 -17.113 1.00 0.00 N ATOM 1892 CA HIS A 167 -8.009 32.155 -17.074 1.00 0.00 C ATOM 1893 C HIS A 167 -7.385 32.465 -18.430 1.00 0.00 C ATOM 1894 O HIS A 167 -7.235 31.580 -19.275 1.00 0.00 O ATOM 1895 CB HIS A 167 -6.922 32.101 -15.999 1.00 0.00 C ATOM 1896 CG HIS A 167 -5.967 30.980 -16.305 1.00 0.00 C ATOM 1897 ND1 HIS A 167 -6.234 29.668 -15.947 1.00 0.00 N ATOM 1898 CD2 HIS A 167 -4.751 30.956 -16.941 1.00 0.00 C ATOM 1899 CE1 HIS A 167 -5.200 28.916 -16.363 1.00 0.00 C ATOM 1900 NE2 HIS A 167 -4.269 29.650 -16.976 1.00 0.00 N ATOM 0 H HIS A 167 -8.457 30.267 -17.874 1.00 0.00 H new ATOM 0 HA HIS A 167 -8.717 32.948 -16.832 1.00 0.00 H new ATOM 0 HB2 HIS A 167 -6.386 33.049 -15.961 1.00 0.00 H new ATOM 0 HB3 HIS A 167 -7.373 31.951 -15.018 1.00 0.00 H new ATOM 0 HD2 HIS A 167 -4.246 31.818 -17.351 1.00 0.00 H new ATOM 0 HE1 HIS A 167 -5.131 27.848 -16.219 1.00 0.00 H new ATOM 0 HE2 HIS A 167 -3.392 29.324 -17.383 1.00 0.00 H new ATOM 1908 N HIS A 168 -7.023 33.727 -18.633 1.00 0.00 N ATOM 1909 CA HIS A 168 -6.420 34.150 -19.892 1.00 0.00 C ATOM 1910 C HIS A 168 -5.471 35.323 -19.664 1.00 0.00 C ATOM 1911 O HIS A 168 -4.949 35.507 -18.564 1.00 0.00 O ATOM 1912 CB HIS A 168 -7.513 34.538 -20.895 1.00 0.00 C ATOM 1913 CG HIS A 168 -8.341 35.664 -20.343 1.00 0.00 C ATOM 1914 ND1 HIS A 168 -8.074 36.992 -20.633 1.00 0.00 N ATOM 1915 CD2 HIS A 168 -9.420 35.676 -19.495 1.00 0.00 C ATOM 1916 CE1 HIS A 168 -8.973 37.742 -19.971 1.00 0.00 C ATOM 1917 NE2 HIS A 168 -9.818 36.988 -19.262 1.00 0.00 N ATOM 0 H HIS A 168 -7.136 34.472 -17.946 1.00 0.00 H new ATOM 0 HA HIS A 168 -5.846 33.318 -20.300 1.00 0.00 H new ATOM 0 HB2 HIS A 168 -7.061 34.838 -21.840 1.00 0.00 H new ATOM 0 HB3 HIS A 168 -8.148 33.677 -21.104 1.00 0.00 H new ATOM 0 HD1 HIS A 168 -7.330 37.338 -21.239 1.00 0.00 H new ATOM 0 HD2 HIS A 168 -9.889 34.800 -19.073 1.00 0.00 H new ATOM 0 HE1 HIS A 168 -9.008 38.821 -20.008 1.00 0.00 H new ATOM 1925 N HIS A 169 -5.240 36.101 -20.713 1.00 0.00 N ATOM 1926 CA HIS A 169 -4.339 37.243 -20.624 1.00 0.00 C ATOM 1927 C HIS A 169 -4.832 38.229 -19.569 1.00 0.00 C ATOM 1928 O HIS A 169 -4.132 39.178 -19.214 1.00 0.00 O ATOM 1929 CB HIS A 169 -4.254 37.950 -21.980 1.00 0.00 C ATOM 1930 CG HIS A 169 -5.541 38.686 -22.244 1.00 0.00 C ATOM 1931 ND1 HIS A 169 -6.693 38.321 -22.899 1.00 0.00 N flip ATOM 1932 CD2 HIS A 169 -5.749 39.984 -21.808 1.00 0.00 C flip ATOM 1933 CE1 HIS A 169 -7.601 39.377 -22.870 1.00 0.00 C flip ATOM 1934 NE2 HIS A 169 -6.982 40.353 -22.202 1.00 0.00 N flip ATOM 0 H HIS A 169 -5.662 35.964 -21.632 1.00 0.00 H new ATOM 0 HA HIS A 169 -3.351 36.881 -20.340 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -3.416 38.647 -21.987 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -4.070 37.223 -22.771 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -5.049 40.590 -21.253 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -8.593 39.401 -23.296 1.00 0.00 H new ATOM 0 HE2 HIS A 169 -7.393 41.267 -22.013 1.00 0.00 H new ATOM 1942 N HIS A 170 -6.043 37.997 -19.074 1.00 0.00 N ATOM 1943 CA HIS A 170 -6.625 38.869 -18.061 1.00 0.00 C ATOM 1944 C HIS A 170 -6.638 40.316 -18.543 1.00 0.00 C ATOM 1945 O HIS A 170 -5.597 40.949 -18.485 1.00 0.00 O ATOM 1946 CB HIS A 170 -5.825 38.768 -16.761 1.00 0.00 C ATOM 1947 CG HIS A 170 -6.135 37.461 -16.082 1.00 0.00 C ATOM 1948 ND1 HIS A 170 -7.383 37.182 -15.550 1.00 0.00 N ATOM 1949 CD2 HIS A 170 -5.366 36.349 -15.833 1.00 0.00 C ATOM 1950 CE1 HIS A 170 -7.333 35.949 -15.015 1.00 0.00 C ATOM 1951 NE2 HIS A 170 -6.125 35.396 -15.160 1.00 0.00 N ATOM 1952 OXT HIS A 170 -7.691 40.770 -18.962 1.00 0.00 O ATOM 0 H HIS A 170 -6.637 37.217 -19.356 1.00 0.00 H new ATOM 0 HA HIS A 170 -7.651 38.549 -17.880 1.00 0.00 H new ATOM 0 HB2 HIS A 170 -4.758 38.836 -16.972 1.00 0.00 H new ATOM 0 HB3 HIS A 170 -6.074 39.600 -16.103 1.00 0.00 H new ATOM 0 HD1 HIS A 170 -8.194 37.800 -15.562 1.00 0.00 H new ATOM 0 HD2 HIS A 170 -4.330 36.233 -16.116 1.00 0.00 H new ATOM 0 HE1 HIS A 170 -8.167 35.465 -14.528 1.00 0.00 H new TER 1960 HIS A 170 HETATM 1961 CA CA A 200 0.329 18.264 19.671 1.00 0.00 CA HETATM 1962 CL1 V8Y A 201 -10.476 18.435 17.377 1.00 0.00 CL HETATM 1963 C1 V8Y A 201 -13.223 22.867 18.461 1.00 0.00 C HETATM 1964 N1 V8Y A 201 -14.973 24.957 19.034 1.00 0.00 N HETATM 1965 O1 V8Y A 201 -13.399 25.165 17.011 1.00 0.00 O HETATM 1966 S1 V8Y A 201 -13.472 24.626 18.451 1.00 0.00 S HETATM 1967 C2 V8Y A 201 -14.229 22.090 19.054 1.00 0.00 C HETATM 1968 O2 V8Y A 201 -12.367 25.283 19.280 1.00 0.00 O HETATM 1969 C3 V8Y A 201 -14.134 20.695 19.118 1.00 0.00 C HETATM 1970 O3 V8Y A 201 -19.836 30.052 24.223 1.00 0.00 O HETATM 1971 C4 V8Y A 201 -13.013 20.049 18.575 1.00 0.00 C HETATM 1972 O4 V8Y A 201 -20.593 28.126 25.059 1.00 0.00 O HETATM 1973 C5 V8Y A 201 -10.786 20.161 17.400 1.00 0.00 C HETATM 1974 C6 V8Y A 201 -9.784 20.941 16.806 1.00 0.00 C HETATM 1975 C7 V8Y A 201 -9.901 22.337 16.757 1.00 0.00 C HETATM 1976 C8 V8Y A 201 -11.031 22.964 17.297 1.00 0.00 C HETATM 1977 C9 V8Y A 201 -12.067 22.225 17.905 1.00 0.00 C HETATM 1978 C10 V8Y A 201 -11.957 20.791 17.965 1.00 0.00 C HETATM 1979 C11 V8Y A 201 -15.275 26.392 19.156 1.00 0.00 C HETATM 1980 C12 V8Y A 201 -16.721 26.552 19.601 1.00 0.00 C HETATM 1981 C13 V8Y A 201 -16.833 26.473 21.126 1.00 0.00 C HETATM 1982 C14 V8Y A 201 -18.282 26.530 21.631 1.00 0.00 C HETATM 1983 C15 V8Y A 201 -18.472 27.439 22.847 1.00 0.00 C HETATM 1984 C16 V8Y A 201 -19.828 28.146 22.806 1.00 0.00 C HETATM 1985 C17 V8Y A 201 -20.110 28.836 24.149 1.00 0.00 C