USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 55 THR OG1 : rot -55:sc= 2.27 USER MOD Set 1.2: A 57 SER OG : rot -35:sc= 1.1 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 2.37 (180deg=2.37) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -165:sc= 1.18 (180deg=1.03) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0.0029) USER MOD Single : A 27 LYS NZ :NH3+ -156:sc= 1.74 (180deg=1.25) USER MOD Single : A 29 LYS NZ :NH3+ -173:sc= 1.29 (180deg=1.19) USER MOD Single : A 31 GLN : amide:sc= -0.0388 K(o=-0.039,f=-0.66) USER MOD Single : A 33 LYS NZ :NH3+ -165:sc= 0.999 (180deg=0.866) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= 0.944 K(o=0.94,f=-2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 59 TYR OH : rot 150:sc= 0.407 USER MOD Single : A 60 ASN : amide:sc= -0.0873 K(o=-0.087,f=-0.73) USER MOD Single : A 62 GLN : amide:sc= -0.158 K(o=-0.16,f=-3.1!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 110:sc= 1.23 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.031) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.005 51.535 20.151 1.00 0.00 N ATOM 2 CA MET A 1 33.196 52.028 21.524 1.00 0.00 C ATOM 3 C MET A 1 34.680 52.299 21.779 1.00 0.00 C ATOM 4 O MET A 1 35.530 51.768 21.068 1.00 0.00 O ATOM 5 CB MET A 1 32.550 51.100 22.549 1.00 0.00 C ATOM 6 CG MET A 1 32.962 49.632 22.490 1.00 0.00 C ATOM 7 SD MET A 1 34.636 49.270 23.073 1.00 0.00 S ATOM 8 CE MET A 1 34.735 47.519 22.626 1.00 0.00 C ATOM 0 H1 MET A 1 31.995 51.353 19.985 1.00 0.00 H new ATOM 0 H2 MET A 1 33.344 52.249 19.475 1.00 0.00 H new ATOM 0 H3 MET A 1 33.541 50.654 20.021 1.00 0.00 H new ATOM 0 HA MET A 1 32.678 52.980 21.642 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.779 51.479 23.545 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.468 51.156 22.427 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.256 49.050 23.082 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.873 49.289 21.459 1.00 0.00 H new ATOM 0 HE1 MET A 1 35.709 47.124 22.914 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.952 46.966 23.145 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.604 47.410 21.549 1.00 0.00 H new ATOM 20 N GLN A 2 34.998 53.139 22.759 1.00 0.00 N ATOM 21 CA GLN A 2 36.360 53.492 23.107 1.00 0.00 C ATOM 22 C GLN A 2 36.932 52.540 24.159 1.00 0.00 C ATOM 23 O GLN A 2 36.220 52.189 25.095 1.00 0.00 O ATOM 24 CB GLN A 2 36.444 54.936 23.592 1.00 0.00 C ATOM 25 CG GLN A 2 36.110 55.947 22.499 1.00 0.00 C ATOM 26 CD GLN A 2 36.286 57.395 22.960 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.284 58.054 22.679 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.317 57.965 23.672 1.00 0.00 N ATOM 0 H GLN A 2 34.299 53.599 23.342 1.00 0.00 H new ATOM 0 HA GLN A 2 36.963 53.397 22.204 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.760 55.074 24.429 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.449 55.131 23.966 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.748 55.765 21.634 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.081 55.796 22.173 1.00 0.00 H new ATOM 0 HE21 GLN A 2 34.481 57.433 23.914 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.410 58.934 23.975 1.00 0.00 H new ATOM 37 N ILE A 3 38.214 52.196 24.065 1.00 0.00 N ATOM 38 CA ILE A 3 39.002 51.641 25.147 1.00 0.00 C ATOM 39 C ILE A 3 40.410 52.240 25.156 1.00 0.00 C ATOM 40 O ILE A 3 40.870 52.780 24.152 1.00 0.00 O ATOM 41 CB ILE A 3 39.073 50.116 25.167 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.844 49.462 24.025 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.708 49.466 25.378 1.00 0.00 C ATOM 44 CD1 ILE A 3 39.180 49.451 22.651 1.00 0.00 C ATOM 0 H ILE A 3 38.745 52.302 23.201 1.00 0.00 H new ATOM 0 HA ILE A 3 38.473 51.922 26.058 1.00 0.00 H new ATOM 0 HB ILE A 3 39.686 49.913 26.045 1.00 0.00 H new ATOM 0 HG12 ILE A 3 40.804 49.969 23.932 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.054 48.430 24.307 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.818 48.382 25.384 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.293 49.793 26.331 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.037 49.758 24.570 1.00 0.00 H new ATOM 0 HD11 ILE A 3 39.836 48.957 21.934 1.00 0.00 H new ATOM 0 HD12 ILE A 3 38.234 48.913 22.708 1.00 0.00 H new ATOM 0 HD13 ILE A 3 38.996 50.476 22.328 1.00 0.00 H new ATOM 56 N PHE A 4 41.103 52.111 26.283 1.00 0.00 N ATOM 57 CA PHE A 4 42.448 52.621 26.465 1.00 0.00 C ATOM 58 C PHE A 4 43.448 51.477 26.653 1.00 0.00 C ATOM 59 O PHE A 4 43.175 50.533 27.390 1.00 0.00 O ATOM 60 CB PHE A 4 42.471 53.600 27.636 1.00 0.00 C ATOM 61 CG PHE A 4 41.293 54.542 27.684 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.099 55.477 26.659 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.348 54.438 28.712 1.00 0.00 C ATOM 64 CE1 PHE A 4 39.959 56.290 26.655 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.218 55.264 28.721 1.00 0.00 C ATOM 66 CZ PHE A 4 39.021 56.191 27.690 1.00 0.00 C ATOM 0 H PHE A 4 40.734 51.639 27.108 1.00 0.00 H new ATOM 0 HA PHE A 4 42.753 53.159 25.567 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.506 53.034 28.567 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.388 54.187 27.585 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.830 55.571 25.870 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.492 53.716 29.502 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.803 56.995 25.852 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.498 55.186 29.523 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.148 56.827 27.693 1.00 0.00 H new ATOM 76 N VAL A 5 44.609 51.544 26.007 1.00 0.00 N ATOM 77 CA VAL A 5 45.678 50.573 26.126 1.00 0.00 C ATOM 78 C VAL A 5 46.910 51.245 26.733 1.00 0.00 C ATOM 79 O VAL A 5 47.378 52.254 26.208 1.00 0.00 O ATOM 80 CB VAL A 5 45.992 49.931 24.778 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.082 48.870 24.906 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.767 49.256 24.167 1.00 0.00 C ATOM 0 H VAL A 5 44.833 52.305 25.365 1.00 0.00 H new ATOM 0 HA VAL A 5 45.359 49.769 26.789 1.00 0.00 H new ATOM 0 HB VAL A 5 46.326 50.745 24.134 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.281 48.433 23.928 1.00 0.00 H new ATOM 0 HG12 VAL A 5 47.993 49.329 25.291 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.751 48.090 25.591 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.036 48.812 23.208 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.408 48.477 24.839 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.981 49.996 24.016 1.00 0.00 H new ATOM 92 N LYS A 6 47.431 50.706 27.832 1.00 0.00 N ATOM 93 CA LYS A 6 48.518 51.255 28.615 1.00 0.00 C ATOM 94 C LYS A 6 49.770 50.377 28.551 1.00 0.00 C ATOM 95 O LYS A 6 49.682 49.164 28.731 1.00 0.00 O ATOM 96 CB LYS A 6 48.002 51.481 30.033 1.00 0.00 C ATOM 97 CG LYS A 6 48.965 52.262 30.921 1.00 0.00 C ATOM 98 CD LYS A 6 48.346 52.715 32.241 1.00 0.00 C ATOM 99 CE LYS A 6 47.864 51.545 33.094 1.00 0.00 C ATOM 100 NZ LYS A 6 47.314 51.976 34.388 1.00 0.00 N ATOM 0 H LYS A 6 47.083 49.827 28.215 1.00 0.00 H new ATOM 0 HA LYS A 6 48.840 52.211 28.203 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.053 52.016 29.984 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.800 50.514 30.494 1.00 0.00 H new ATOM 0 HG2 LYS A 6 49.836 51.642 31.132 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.320 53.137 30.376 1.00 0.00 H new ATOM 0 HD2 LYS A 6 49.080 53.292 32.803 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.507 53.380 32.036 1.00 0.00 H new ATOM 0 HE2 LYS A 6 47.102 50.991 32.546 1.00 0.00 H new ATOM 0 HE3 LYS A 6 48.694 50.860 33.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 47.002 51.143 34.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 48.047 52.482 34.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.504 52.608 34.228 1.00 0.00 H new ATOM 168 N LYS A 11 52.713 54.935 29.079 1.00 0.00 N ATOM 169 CA LYS A 11 52.205 55.554 27.871 1.00 0.00 C ATOM 170 C LYS A 11 50.833 54.970 27.530 1.00 0.00 C ATOM 171 O LYS A 11 50.670 53.755 27.629 1.00 0.00 O ATOM 172 CB LYS A 11 53.236 55.351 26.765 1.00 0.00 C ATOM 173 CG LYS A 11 52.926 56.010 25.424 1.00 0.00 C ATOM 174 CD LYS A 11 54.108 55.798 24.481 1.00 0.00 C ATOM 175 CE LYS A 11 53.899 56.329 23.066 1.00 0.00 C ATOM 176 NZ LYS A 11 52.899 55.546 22.325 1.00 0.00 N ATOM 0 HA LYS A 11 52.058 56.626 28.001 1.00 0.00 H new ATOM 0 HB2 LYS A 11 54.196 55.728 27.118 1.00 0.00 H new ATOM 0 HB3 LYS A 11 53.355 54.280 26.601 1.00 0.00 H new ATOM 0 HG2 LYS A 11 52.020 55.582 24.995 1.00 0.00 H new ATOM 0 HG3 LYS A 11 52.741 57.075 25.562 1.00 0.00 H new ATOM 0 HD2 LYS A 11 54.987 56.280 24.909 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.324 54.731 24.426 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.581 57.371 23.113 1.00 0.00 H new ATOM 0 HE3 LYS A 11 54.847 56.309 22.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.967 55.767 21.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.075 54.531 22.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.947 55.785 22.668 1.00 0.00 H new ATOM 190 N THR A 12 49.856 55.782 27.137 1.00 0.00 N ATOM 191 CA THR A 12 48.518 55.331 26.811 1.00 0.00 C ATOM 192 C THR A 12 48.137 55.594 25.353 1.00 0.00 C ATOM 193 O THR A 12 48.557 56.576 24.745 1.00 0.00 O ATOM 194 CB THR A 12 47.432 55.875 27.735 1.00 0.00 C ATOM 195 OG1 THR A 12 47.366 57.283 27.702 1.00 0.00 O ATOM 196 CG2 THR A 12 47.629 55.451 29.188 1.00 0.00 C ATOM 0 H THR A 12 49.980 56.789 27.036 1.00 0.00 H new ATOM 0 HA THR A 12 48.566 54.253 26.968 1.00 0.00 H new ATOM 0 HB THR A 12 46.503 55.449 27.357 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.658 57.592 28.305 1.00 0.00 H new ATOM 0 HG21 THR A 12 46.828 55.866 29.800 1.00 0.00 H new ATOM 0 HG22 THR A 12 47.610 54.363 29.255 1.00 0.00 H new ATOM 0 HG23 THR A 12 48.589 55.820 29.548 1.00 0.00 H new ATOM 204 N ILE A 13 47.317 54.707 24.795 1.00 0.00 N ATOM 205 CA ILE A 13 46.788 54.740 23.446 1.00 0.00 C ATOM 206 C ILE A 13 45.266 54.634 23.550 1.00 0.00 C ATOM 207 O ILE A 13 44.757 53.690 24.149 1.00 0.00 O ATOM 208 CB ILE A 13 47.366 53.601 22.611 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.891 53.607 22.547 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.801 53.644 21.194 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.500 52.272 22.129 1.00 0.00 C ATOM 0 H ILE A 13 46.986 53.894 25.314 1.00 0.00 H new ATOM 0 HA ILE A 13 47.066 55.668 22.946 1.00 0.00 H new ATOM 0 HB ILE A 13 47.070 52.679 23.112 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.212 54.377 21.845 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.284 53.884 23.525 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.222 52.826 20.609 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.716 53.543 21.232 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.061 54.594 20.727 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.586 52.358 22.108 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.211 51.501 22.843 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.138 52.002 21.137 1.00 0.00 H new ATOM 223 N THR A 14 44.526 55.570 22.961 1.00 0.00 N ATOM 224 CA THR A 14 43.088 55.472 22.808 1.00 0.00 C ATOM 225 C THR A 14 42.770 54.712 21.519 1.00 0.00 C ATOM 226 O THR A 14 43.378 54.965 20.482 1.00 0.00 O ATOM 227 CB THR A 14 42.415 56.841 22.816 1.00 0.00 C ATOM 228 OG1 THR A 14 42.690 57.536 24.012 1.00 0.00 O ATOM 229 CG2 THR A 14 40.894 56.757 22.722 1.00 0.00 C ATOM 0 H THR A 14 44.920 56.427 22.573 1.00 0.00 H new ATOM 0 HA THR A 14 42.688 54.926 23.662 1.00 0.00 H new ATOM 0 HB THR A 14 42.818 57.355 21.943 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.248 58.411 23.991 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.473 57.762 22.732 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.614 56.256 21.796 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.508 56.193 23.571 1.00 0.00 H new ATOM 237 N LEU A 15 41.824 53.780 21.580 1.00 0.00 N ATOM 238 CA LEU A 15 41.310 53.039 20.445 1.00 0.00 C ATOM 239 C LEU A 15 39.786 53.162 20.391 1.00 0.00 C ATOM 240 O LEU A 15 39.131 53.092 21.428 1.00 0.00 O ATOM 241 CB LEU A 15 41.708 51.571 20.567 1.00 0.00 C ATOM 242 CG LEU A 15 43.207 51.283 20.533 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.428 49.791 20.762 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.839 51.647 19.193 1.00 0.00 C ATOM 0 H LEU A 15 41.380 53.514 22.459 1.00 0.00 H new ATOM 0 HA LEU A 15 41.732 53.450 19.528 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.304 51.181 21.501 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.232 51.017 19.758 1.00 0.00 H new ATOM 0 HG LEU A 15 43.672 51.889 21.310 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.496 49.574 20.740 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.020 49.507 21.732 1.00 0.00 H new ATOM 0 HD13 LEU A 15 42.926 49.224 19.978 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.905 51.423 19.221 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.367 51.068 18.399 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.696 52.710 19.000 1.00 0.00 H new ATOM 256 N GLU A 16 39.223 53.273 19.192 1.00 0.00 N ATOM 257 CA GLU A 16 37.799 53.198 18.931 1.00 0.00 C ATOM 258 C GLU A 16 37.527 52.001 18.016 1.00 0.00 C ATOM 259 O GLU A 16 37.978 51.994 16.873 1.00 0.00 O ATOM 260 CB GLU A 16 37.332 54.531 18.354 1.00 0.00 C ATOM 261 CG GLU A 16 35.972 54.541 17.663 1.00 0.00 C ATOM 262 CD GLU A 16 34.818 54.058 18.544 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.519 54.687 19.582 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.162 53.061 18.173 1.00 0.00 O ATOM 0 H GLU A 16 39.772 53.423 18.346 1.00 0.00 H new ATOM 0 HA GLU A 16 37.227 53.033 19.844 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.308 55.262 19.162 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.080 54.872 17.638 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.756 55.554 17.324 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.024 53.912 16.774 1.00 0.00 H new ATOM 271 N VAL A 17 36.839 50.982 18.523 1.00 0.00 N ATOM 272 CA VAL A 17 36.580 49.725 17.850 1.00 0.00 C ATOM 273 C VAL A 17 35.219 49.143 18.237 1.00 0.00 C ATOM 274 O VAL A 17 34.653 49.478 19.276 1.00 0.00 O ATOM 275 CB VAL A 17 37.675 48.694 18.103 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.980 49.028 17.386 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.990 48.484 19.581 1.00 0.00 C ATOM 0 H VAL A 17 36.431 51.018 19.457 1.00 0.00 H new ATOM 0 HA VAL A 17 36.571 49.953 16.784 1.00 0.00 H new ATOM 0 HB VAL A 17 37.257 47.773 17.698 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.722 48.259 17.603 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.804 49.069 16.311 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.348 49.994 17.731 1.00 0.00 H new ATOM 0 HG21 VAL A 17 38.778 47.737 19.683 1.00 0.00 H new ATOM 0 HG22 VAL A 17 38.323 49.425 20.019 1.00 0.00 H new ATOM 0 HG23 VAL A 17 37.095 48.140 20.098 1.00 0.00 H new ATOM 287 N GLU A 18 34.680 48.252 17.411 1.00 0.00 N ATOM 288 CA GLU A 18 33.474 47.506 17.711 1.00 0.00 C ATOM 289 C GLU A 18 33.784 46.240 18.512 1.00 0.00 C ATOM 290 O GLU A 18 34.832 45.632 18.307 1.00 0.00 O ATOM 291 CB GLU A 18 32.716 47.191 16.425 1.00 0.00 C ATOM 292 CG GLU A 18 32.353 48.413 15.584 1.00 0.00 C ATOM 293 CD GLU A 18 31.581 49.489 16.347 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.924 50.685 16.236 1.00 0.00 O ATOM 295 OE2 GLU A 18 30.595 49.163 17.044 1.00 0.00 O ATOM 0 H GLU A 18 35.080 48.028 16.500 1.00 0.00 H new ATOM 0 HA GLU A 18 32.833 48.125 18.338 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.320 46.516 15.819 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.801 46.657 16.680 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.268 48.851 15.186 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.757 48.089 14.731 1.00 0.00 H new ATOM 302 N PRO A 19 32.913 45.784 19.408 1.00 0.00 N ATOM 303 CA PRO A 19 33.211 44.688 20.307 1.00 0.00 C ATOM 304 C PRO A 19 33.396 43.321 19.643 1.00 0.00 C ATOM 305 O PRO A 19 33.948 42.412 20.258 1.00 0.00 O ATOM 306 CB PRO A 19 32.063 44.664 21.314 1.00 0.00 C ATOM 307 CG PRO A 19 30.897 45.306 20.567 1.00 0.00 C ATOM 308 CD PRO A 19 31.615 46.350 19.714 1.00 0.00 C ATOM 0 HA PRO A 19 34.184 44.865 20.766 1.00 0.00 H new ATOM 0 HB2 PRO A 19 31.826 43.646 21.623 1.00 0.00 H new ATOM 0 HB3 PRO A 19 32.313 45.221 22.217 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.353 44.584 19.958 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.175 45.759 21.246 1.00 0.00 H new ATOM 0 HD2 PRO A 19 31.056 46.562 18.803 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.716 47.292 20.252 1.00 0.00 H new ATOM 316 N SER A 20 32.962 43.152 18.398 1.00 0.00 N ATOM 317 CA SER A 20 33.184 41.949 17.620 1.00 0.00 C ATOM 318 C SER A 20 34.514 41.928 16.865 1.00 0.00 C ATOM 319 O SER A 20 34.805 40.936 16.198 1.00 0.00 O ATOM 320 CB SER A 20 32.015 41.727 16.663 1.00 0.00 C ATOM 321 OG SER A 20 31.935 42.768 15.715 1.00 0.00 O ATOM 0 H SER A 20 32.435 43.866 17.895 1.00 0.00 H new ATOM 0 HA SER A 20 33.244 41.128 18.334 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.135 40.772 16.151 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.084 41.671 17.227 1.00 0.00 H new ATOM 0 HG SER A 20 31.180 42.604 15.112 1.00 0.00 H new ATOM 327 N ASP A 21 35.329 42.976 16.926 1.00 0.00 N ATOM 328 CA ASP A 21 36.631 43.000 16.290 1.00 0.00 C ATOM 329 C ASP A 21 37.606 42.072 17.017 1.00 0.00 C ATOM 330 O ASP A 21 37.501 41.872 18.225 1.00 0.00 O ATOM 331 CB ASP A 21 37.126 44.440 16.207 1.00 0.00 C ATOM 332 CG ASP A 21 37.916 44.794 14.945 1.00 0.00 C ATOM 333 OD1 ASP A 21 38.307 45.975 14.824 1.00 0.00 O ATOM 334 OD2 ASP A 21 38.026 43.974 14.008 1.00 0.00 O ATOM 0 H ASP A 21 35.098 43.836 17.423 1.00 0.00 H new ATOM 0 HA ASP A 21 36.556 42.619 15.271 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.266 45.106 16.275 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.753 44.641 17.075 1.00 0.00 H new ATOM 339 N THR A 22 38.540 41.461 16.292 1.00 0.00 N ATOM 340 CA THR A 22 39.400 40.412 16.802 1.00 0.00 C ATOM 341 C THR A 22 40.771 40.913 17.259 1.00 0.00 C ATOM 342 O THR A 22 41.292 41.878 16.702 1.00 0.00 O ATOM 343 CB THR A 22 39.554 39.240 15.837 1.00 0.00 C ATOM 344 OG1 THR A 22 40.080 39.655 14.597 1.00 0.00 O ATOM 345 CG2 THR A 22 38.238 38.519 15.563 1.00 0.00 C ATOM 0 H THR A 22 38.719 41.691 15.314 1.00 0.00 H new ATOM 0 HA THR A 22 38.879 40.046 17.687 1.00 0.00 H new ATOM 0 HB THR A 22 40.241 38.554 16.333 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.168 38.880 14.003 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.412 37.696 14.870 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.836 38.128 16.498 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.525 39.217 15.125 1.00 0.00 H new ATOM 353 N ILE A 23 41.385 40.237 18.225 1.00 0.00 N ATOM 354 CA ILE A 23 42.600 40.681 18.878 1.00 0.00 C ATOM 355 C ILE A 23 43.718 40.979 17.876 1.00 0.00 C ATOM 356 O ILE A 23 44.327 42.044 17.953 1.00 0.00 O ATOM 357 CB ILE A 23 43.018 39.694 19.964 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.299 39.924 21.289 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.507 39.745 20.290 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.788 39.708 21.308 1.00 0.00 C ATOM 0 H ILE A 23 41.039 39.345 18.580 1.00 0.00 H new ATOM 0 HA ILE A 23 42.392 41.631 19.371 1.00 0.00 H new ATOM 0 HB ILE A 23 42.750 38.729 19.533 1.00 0.00 H new ATOM 0 HG12 ILE A 23 42.744 39.265 22.034 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.498 40.947 21.609 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.734 39.018 21.070 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.084 39.510 19.395 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.769 40.744 20.638 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.405 39.905 22.309 1.00 0.00 H new ATOM 0 HD12 ILE A 23 40.315 40.386 20.598 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.564 38.678 21.030 1.00 0.00 H new ATOM 372 N GLU A 24 43.994 40.110 16.908 1.00 0.00 N ATOM 373 CA GLU A 24 45.084 40.336 15.979 1.00 0.00 C ATOM 374 C GLU A 24 44.797 41.433 14.952 1.00 0.00 C ATOM 375 O GLU A 24 45.723 42.090 14.482 1.00 0.00 O ATOM 376 CB GLU A 24 45.486 39.003 15.354 1.00 0.00 C ATOM 377 CG GLU A 24 46.833 39.066 14.639 1.00 0.00 C ATOM 378 CD GLU A 24 47.234 37.691 14.102 1.00 0.00 C ATOM 379 OE1 GLU A 24 46.472 37.125 13.289 1.00 0.00 O ATOM 380 OE2 GLU A 24 48.286 37.155 14.513 1.00 0.00 O ATOM 0 H GLU A 24 43.476 39.246 16.751 1.00 0.00 H new ATOM 0 HA GLU A 24 45.936 40.730 16.534 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.528 38.241 16.132 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.718 38.693 14.645 1.00 0.00 H new ATOM 0 HG2 GLU A 24 46.779 39.780 13.817 1.00 0.00 H new ATOM 0 HG3 GLU A 24 47.597 39.429 15.327 1.00 0.00 H new ATOM 387 N ASN A 25 43.534 41.715 14.646 1.00 0.00 N ATOM 388 CA ASN A 25 43.145 42.890 13.893 1.00 0.00 C ATOM 389 C ASN A 25 43.259 44.176 14.714 1.00 0.00 C ATOM 390 O ASN A 25 43.627 45.208 14.158 1.00 0.00 O ATOM 391 CB ASN A 25 41.754 42.692 13.298 1.00 0.00 C ATOM 392 CG ASN A 25 41.821 41.974 11.948 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.577 40.776 11.826 1.00 0.00 O ATOM 394 ND2 ASN A 25 42.214 42.677 10.889 1.00 0.00 N ATOM 0 H ASN A 25 42.748 41.125 14.919 1.00 0.00 H new ATOM 0 HA ASN A 25 43.848 43.014 13.069 1.00 0.00 H new ATOM 0 HB2 ASN A 25 41.140 42.114 13.989 1.00 0.00 H new ATOM 0 HB3 ASN A 25 41.269 43.660 13.173 1.00 0.00 H new ATOM 0 HD21 ASN A 25 42.311 42.221 9.982 1.00 0.00 H new ATOM 0 HD22 ASN A 25 42.418 43.672 10.984 1.00 0.00 H new ATOM 401 N VAL A 26 43.041 44.136 16.025 1.00 0.00 N ATOM 402 CA VAL A 26 43.283 45.255 16.914 1.00 0.00 C ATOM 403 C VAL A 26 44.780 45.528 17.067 1.00 0.00 C ATOM 404 O VAL A 26 45.196 46.680 16.955 1.00 0.00 O ATOM 405 CB VAL A 26 42.578 45.067 18.253 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.904 46.188 19.238 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.062 45.058 18.081 1.00 0.00 C ATOM 0 H VAL A 26 42.685 43.308 16.502 1.00 0.00 H new ATOM 0 HA VAL A 26 42.849 46.146 16.461 1.00 0.00 H new ATOM 0 HB VAL A 26 42.934 44.113 18.641 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.379 46.011 20.177 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.978 46.210 19.421 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.587 47.143 18.820 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.586 44.922 19.052 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.739 46.005 17.648 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.776 44.240 17.420 1.00 0.00 H new ATOM 417 N LYS A 27 45.618 44.503 17.194 1.00 0.00 N ATOM 418 CA LYS A 27 47.061 44.622 17.170 1.00 0.00 C ATOM 419 C LYS A 27 47.572 45.275 15.884 1.00 0.00 C ATOM 420 O LYS A 27 48.478 46.104 15.935 1.00 0.00 O ATOM 421 CB LYS A 27 47.719 43.261 17.382 1.00 0.00 C ATOM 422 CG LYS A 27 47.533 42.688 18.784 1.00 0.00 C ATOM 423 CD LYS A 27 48.122 41.285 18.900 1.00 0.00 C ATOM 424 CE LYS A 27 47.973 40.756 20.324 1.00 0.00 C ATOM 425 NZ LYS A 27 48.505 39.390 20.440 1.00 0.00 N ATOM 0 H LYS A 27 45.297 43.543 17.320 1.00 0.00 H new ATOM 0 HA LYS A 27 47.339 45.280 17.994 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.312 42.556 16.657 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.786 43.350 17.176 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.009 43.345 19.512 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.471 42.659 19.028 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.619 40.615 18.203 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.176 41.303 18.621 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.498 41.414 21.016 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.921 40.766 20.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.053 38.908 21.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.306 38.865 19.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.533 39.430 20.594 1.00 0.00 H new ATOM 439 N ALA A 28 46.959 44.972 14.743 1.00 0.00 N ATOM 440 CA ALA A 28 47.257 45.622 13.483 1.00 0.00 C ATOM 441 C ALA A 28 46.790 47.076 13.408 1.00 0.00 C ATOM 442 O ALA A 28 47.489 47.915 12.842 1.00 0.00 O ATOM 443 CB ALA A 28 46.673 44.769 12.360 1.00 0.00 C ATOM 0 H ALA A 28 46.233 44.259 14.673 1.00 0.00 H new ATOM 0 HA ALA A 28 48.340 45.691 13.380 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.884 45.238 11.399 1.00 0.00 H new ATOM 0 HB2 ALA A 28 47.122 43.776 12.386 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.594 44.683 12.492 1.00 0.00 H new ATOM 449 N LYS A 29 45.681 47.435 14.048 1.00 0.00 N ATOM 450 CA LYS A 29 45.257 48.815 14.173 1.00 0.00 C ATOM 451 C LYS A 29 46.213 49.634 15.043 1.00 0.00 C ATOM 452 O LYS A 29 46.452 50.798 14.727 1.00 0.00 O ATOM 453 CB LYS A 29 43.820 48.894 14.680 1.00 0.00 C ATOM 454 CG LYS A 29 42.840 48.526 13.570 1.00 0.00 C ATOM 455 CD LYS A 29 41.384 48.449 14.023 1.00 0.00 C ATOM 456 CE LYS A 29 40.543 48.080 12.804 1.00 0.00 C ATOM 457 NZ LYS A 29 39.112 47.951 13.113 1.00 0.00 N ATOM 0 H LYS A 29 45.052 46.768 14.495 1.00 0.00 H new ATOM 0 HA LYS A 29 45.287 49.261 13.179 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.689 48.220 15.527 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.610 49.901 15.039 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.922 49.261 12.770 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.130 47.563 13.149 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.266 47.704 14.810 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.060 49.404 14.437 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.676 48.840 12.034 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.906 47.139 12.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.609 47.585 12.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.987 47.294 13.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.727 48.883 13.369 1.00 0.00 H new ATOM 471 N ILE A 30 46.817 49.033 16.063 1.00 0.00 N ATOM 472 CA ILE A 30 47.901 49.623 16.823 1.00 0.00 C ATOM 473 C ILE A 30 49.129 49.823 15.932 1.00 0.00 C ATOM 474 O ILE A 30 49.707 50.908 15.952 1.00 0.00 O ATOM 475 CB ILE A 30 48.191 48.821 18.087 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.022 48.897 19.064 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.476 49.284 18.769 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.061 47.857 20.180 1.00 0.00 C ATOM 0 H ILE A 30 46.557 48.102 16.387 1.00 0.00 H new ATOM 0 HA ILE A 30 47.599 50.613 17.165 1.00 0.00 H new ATOM 0 HB ILE A 30 48.327 47.783 17.782 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.003 49.891 19.511 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.092 48.780 18.508 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.647 48.688 19.665 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.316 49.160 18.085 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.384 50.335 19.044 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.193 47.985 20.827 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.047 46.857 19.746 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.972 47.985 20.765 1.00 0.00 H new ATOM 490 N GLN A 31 49.504 48.853 15.104 1.00 0.00 N ATOM 491 CA GLN A 31 50.593 48.983 14.158 1.00 0.00 C ATOM 492 C GLN A 31 50.423 50.184 13.226 1.00 0.00 C ATOM 493 O GLN A 31 51.372 50.942 13.039 1.00 0.00 O ATOM 494 CB GLN A 31 50.766 47.705 13.343 1.00 0.00 C ATOM 495 CG GLN A 31 52.068 47.735 12.546 1.00 0.00 C ATOM 496 CD GLN A 31 52.275 46.534 11.622 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.377 45.762 11.291 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.500 46.354 11.136 1.00 0.00 N ATOM 0 H GLN A 31 49.048 47.941 15.076 1.00 0.00 H new ATOM 0 HA GLN A 31 51.494 49.154 14.747 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.763 46.842 14.009 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.922 47.586 12.663 1.00 0.00 H new ATOM 0 HG2 GLN A 31 52.092 48.646 11.948 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.904 47.789 13.243 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.253 46.988 11.403 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.686 45.582 10.496 1.00 0.00 H new ATOM 507 N ASP A 32 49.231 50.409 12.681 1.00 0.00 N ATOM 508 CA ASP A 32 48.981 51.514 11.777 1.00 0.00 C ATOM 509 C ASP A 32 49.138 52.904 12.400 1.00 0.00 C ATOM 510 O ASP A 32 49.296 53.864 11.650 1.00 0.00 O ATOM 511 CB ASP A 32 47.588 51.393 11.167 1.00 0.00 C ATOM 512 CG ASP A 32 47.416 50.247 10.168 1.00 0.00 C ATOM 513 OD1 ASP A 32 48.359 49.901 9.424 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.282 49.729 10.079 1.00 0.00 O ATOM 0 H ASP A 32 48.413 49.826 12.858 1.00 0.00 H new ATOM 0 HA ASP A 32 49.754 51.434 11.013 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.865 51.264 11.973 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.344 52.330 10.667 1.00 0.00 H new ATOM 519 N LYS A 33 49.089 53.036 13.722 1.00 0.00 N ATOM 520 CA LYS A 33 49.160 54.299 14.429 1.00 0.00 C ATOM 521 C LYS A 33 50.445 54.515 15.231 1.00 0.00 C ATOM 522 O LYS A 33 50.944 55.637 15.261 1.00 0.00 O ATOM 523 CB LYS A 33 47.902 54.453 15.277 1.00 0.00 C ATOM 524 CG LYS A 33 47.711 55.874 15.803 1.00 0.00 C ATOM 525 CD LYS A 33 46.312 56.119 16.359 1.00 0.00 C ATOM 526 CE LYS A 33 46.043 55.430 17.694 1.00 0.00 C ATOM 527 NZ LYS A 33 44.609 55.484 18.018 1.00 0.00 N ATOM 0 H LYS A 33 48.995 52.235 14.347 1.00 0.00 H new ATOM 0 HA LYS A 33 49.203 55.092 13.683 1.00 0.00 H new ATOM 0 HB2 LYS A 33 47.033 54.171 14.683 1.00 0.00 H new ATOM 0 HB3 LYS A 33 47.951 53.763 16.119 1.00 0.00 H new ATOM 0 HG2 LYS A 33 48.446 56.069 16.584 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.906 56.583 14.998 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.163 57.192 16.480 1.00 0.00 H new ATOM 0 HD3 LYS A 33 45.578 55.775 15.630 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.373 54.392 17.648 1.00 0.00 H new ATOM 0 HE3 LYS A 33 46.619 55.913 18.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.471 55.248 19.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.247 56.442 17.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.094 54.800 17.428 1.00 0.00 H new ATOM 541 N GLU A 34 50.995 53.468 15.840 1.00 0.00 N ATOM 542 CA GLU A 34 52.165 53.515 16.693 1.00 0.00 C ATOM 543 C GLU A 34 53.348 52.692 16.175 1.00 0.00 C ATOM 544 O GLU A 34 54.412 52.691 16.789 1.00 0.00 O ATOM 545 CB GLU A 34 51.782 53.060 18.099 1.00 0.00 C ATOM 546 CG GLU A 34 50.751 53.941 18.797 1.00 0.00 C ATOM 547 CD GLU A 34 51.255 55.354 19.104 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.377 55.511 19.635 1.00 0.00 O ATOM 549 OE2 GLU A 34 50.522 56.333 18.851 1.00 0.00 O ATOM 0 H GLU A 34 50.616 52.526 15.744 1.00 0.00 H new ATOM 0 HA GLU A 34 52.506 54.550 16.700 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.393 52.043 18.043 1.00 0.00 H new ATOM 0 HB3 GLU A 34 52.683 53.023 18.712 1.00 0.00 H new ATOM 0 HG2 GLU A 34 49.862 54.010 18.171 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.448 53.462 19.728 1.00 0.00 H new ATOM 556 N GLY A 35 53.203 51.978 15.064 1.00 0.00 N ATOM 557 CA GLY A 35 54.291 51.319 14.369 1.00 0.00 C ATOM 558 C GLY A 35 54.766 49.981 14.940 1.00 0.00 C ATOM 559 O GLY A 35 55.654 49.371 14.350 1.00 0.00 O ATOM 0 H GLY A 35 52.298 51.841 14.614 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.985 51.158 13.335 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.142 52.000 14.347 1.00 0.00 H new ATOM 563 N ILE A 36 54.198 49.498 16.041 1.00 0.00 N ATOM 564 CA ILE A 36 54.581 48.257 16.684 1.00 0.00 C ATOM 565 C ILE A 36 53.965 47.078 15.929 1.00 0.00 C ATOM 566 O ILE A 36 52.739 46.999 15.881 1.00 0.00 O ATOM 567 CB ILE A 36 54.162 48.239 18.150 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.640 49.465 18.924 1.00 0.00 C ATOM 569 CG2 ILE A 36 54.670 46.968 18.825 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.090 49.567 20.344 1.00 0.00 C ATOM 0 H ILE A 36 53.436 49.978 16.520 1.00 0.00 H new ATOM 0 HA ILE A 36 55.667 48.172 16.656 1.00 0.00 H new ATOM 0 HB ILE A 36 53.072 48.260 18.164 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.729 49.449 18.969 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.357 50.361 18.372 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.365 46.965 19.872 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.250 46.097 18.323 1.00 0.00 H new ATOM 0 HG23 ILE A 36 55.758 46.933 18.764 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.480 50.466 20.821 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.002 49.617 20.310 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.395 48.691 20.916 1.00 0.00 H new ATOM 582 N PRO A 37 54.724 46.137 15.375 1.00 0.00 N ATOM 583 CA PRO A 37 54.165 45.025 14.633 1.00 0.00 C ATOM 584 C PRO A 37 53.397 44.050 15.528 1.00 0.00 C ATOM 585 O PRO A 37 53.751 43.880 16.692 1.00 0.00 O ATOM 586 CB PRO A 37 55.344 44.379 13.911 1.00 0.00 C ATOM 587 CG PRO A 37 56.524 44.675 14.833 1.00 0.00 C ATOM 588 CD PRO A 37 56.170 46.046 15.401 1.00 0.00 C ATOM 0 HA PRO A 37 53.413 45.361 13.919 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.196 43.307 13.778 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.491 44.806 12.919 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.623 43.925 15.618 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.468 44.694 14.289 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.548 46.155 16.418 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.620 46.841 14.807 1.00 0.00 H new ATOM 596 N PRO A 38 52.340 43.406 15.041 1.00 0.00 N ATOM 597 CA PRO A 38 51.399 42.682 15.873 1.00 0.00 C ATOM 598 C PRO A 38 52.017 41.480 16.589 1.00 0.00 C ATOM 599 O PRO A 38 51.660 41.190 17.729 1.00 0.00 O ATOM 600 CB PRO A 38 50.265 42.260 14.943 1.00 0.00 C ATOM 601 CG PRO A 38 50.936 42.184 13.575 1.00 0.00 C ATOM 602 CD PRO A 38 51.930 43.340 13.653 1.00 0.00 C ATOM 0 HA PRO A 38 51.048 43.320 16.684 1.00 0.00 H new ATOM 0 HB2 PRO A 38 49.842 41.299 15.236 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.450 42.983 14.950 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.433 41.227 13.415 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.222 42.312 12.761 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.785 43.167 12.999 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.470 44.275 13.335 1.00 0.00 H new ATOM 610 N ASP A 39 52.994 40.814 15.980 1.00 0.00 N ATOM 611 CA ASP A 39 53.747 39.719 16.556 1.00 0.00 C ATOM 612 C ASP A 39 54.668 40.125 17.708 1.00 0.00 C ATOM 613 O ASP A 39 55.113 39.252 18.451 1.00 0.00 O ATOM 614 CB ASP A 39 54.470 38.955 15.450 1.00 0.00 C ATOM 615 CG ASP A 39 55.299 39.850 14.527 1.00 0.00 C ATOM 616 OD1 ASP A 39 56.546 39.778 14.573 1.00 0.00 O ATOM 617 OD2 ASP A 39 54.691 40.624 13.757 1.00 0.00 O ATOM 0 H ASP A 39 53.291 41.038 15.030 1.00 0.00 H new ATOM 0 HA ASP A 39 53.031 39.048 17.031 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.124 38.210 15.903 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.735 38.414 14.854 1.00 0.00 H new ATOM 622 N GLN A 40 54.885 41.412 17.958 1.00 0.00 N ATOM 623 CA GLN A 40 55.552 41.900 19.148 1.00 0.00 C ATOM 624 C GLN A 40 54.601 42.115 20.327 1.00 0.00 C ATOM 625 O GLN A 40 55.057 42.211 21.465 1.00 0.00 O ATOM 626 CB GLN A 40 56.300 43.186 18.809 1.00 0.00 C ATOM 627 CG GLN A 40 57.475 43.460 19.743 1.00 0.00 C ATOM 628 CD GLN A 40 58.132 44.808 19.440 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.113 45.732 20.249 1.00 0.00 O ATOM 630 NE2 GLN A 40 58.735 44.967 18.265 1.00 0.00 N ATOM 0 H GLN A 40 54.594 42.155 17.323 1.00 0.00 H new ATOM 0 HA GLN A 40 56.255 41.132 19.472 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.665 43.127 17.784 1.00 0.00 H new ATOM 0 HB3 GLN A 40 55.606 44.025 18.853 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.130 43.447 20.777 1.00 0.00 H new ATOM 0 HG3 GLN A 40 58.213 42.664 19.643 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.751 44.200 17.592 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.181 45.855 18.037 1.00 0.00 H new ATOM 639 N GLN A 41 53.294 42.186 20.093 1.00 0.00 N ATOM 640 CA GLN A 41 52.319 42.647 21.061 1.00 0.00 C ATOM 641 C GLN A 41 51.656 41.506 21.836 1.00 0.00 C ATOM 642 O GLN A 41 50.974 40.675 21.241 1.00 0.00 O ATOM 643 CB GLN A 41 51.244 43.481 20.369 1.00 0.00 C ATOM 644 CG GLN A 41 51.741 44.707 19.609 1.00 0.00 C ATOM 645 CD GLN A 41 50.592 45.420 18.893 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.464 45.473 19.379 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.783 45.966 17.695 1.00 0.00 N ATOM 0 H GLN A 41 52.879 41.917 19.201 1.00 0.00 H new ATOM 0 HA GLN A 41 52.865 43.254 21.783 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.705 42.839 19.672 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.526 43.809 21.120 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.224 45.396 20.302 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.495 44.406 18.881 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.707 45.939 17.264 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.006 46.412 17.208 1.00 0.00 H new ATOM 656 N ARG A 42 51.745 41.515 23.163 1.00 0.00 N ATOM 657 CA ARG A 42 50.849 40.807 24.055 1.00 0.00 C ATOM 658 C ARG A 42 49.806 41.792 24.584 1.00 0.00 C ATOM 659 O ARG A 42 50.186 42.831 25.119 1.00 0.00 O ATOM 660 CB ARG A 42 51.587 40.161 25.223 1.00 0.00 C ATOM 661 CG ARG A 42 52.876 39.405 24.912 1.00 0.00 C ATOM 662 CD ARG A 42 53.392 38.727 26.177 1.00 0.00 C ATOM 663 NE ARG A 42 54.810 38.375 26.087 1.00 0.00 N ATOM 664 CZ ARG A 42 55.356 37.236 25.642 1.00 0.00 C ATOM 665 NH1 ARG A 42 54.647 36.242 25.088 1.00 0.00 N ATOM 666 NH2 ARG A 42 56.684 37.064 25.706 1.00 0.00 N ATOM 0 H ARG A 42 52.470 42.035 23.658 1.00 0.00 H new ATOM 0 HA ARG A 42 50.373 40.004 23.493 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.822 40.942 25.946 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.901 39.469 25.713 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.694 38.660 24.137 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.628 40.092 24.524 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.239 39.390 27.029 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.809 37.826 26.366 1.00 0.00 H new ATOM 0 HE ARG A 42 55.466 39.089 26.404 1.00 0.00 H new ATOM 0 HH11 ARG A 42 53.636 36.331 24.988 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.119 35.397 24.767 1.00 0.00 H new ATOM 0 HH21 ARG A 42 57.275 37.799 26.093 1.00 0.00 H new ATOM 0 HH22 ARG A 42 57.103 36.198 25.368 1.00 0.00 H new ATOM 680 N LEU A 43 48.518 41.480 24.462 1.00 0.00 N ATOM 681 CA LEU A 43 47.440 42.290 24.991 1.00 0.00 C ATOM 682 C LEU A 43 46.755 41.585 26.165 1.00 0.00 C ATOM 683 O LEU A 43 46.479 40.390 26.101 1.00 0.00 O ATOM 684 CB LEU A 43 46.455 42.670 23.891 1.00 0.00 C ATOM 685 CG LEU A 43 46.990 43.646 22.847 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.944 43.862 21.757 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.324 45.014 23.436 1.00 0.00 C ATOM 0 H LEU A 43 48.195 40.640 23.982 1.00 0.00 H new ATOM 0 HA LEU A 43 47.861 43.219 25.377 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.134 41.761 23.383 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.570 43.107 24.353 1.00 0.00 H new ATOM 0 HG LEU A 43 47.902 43.201 22.450 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.331 44.560 21.014 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.717 42.910 21.277 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.036 44.271 22.200 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.700 45.667 22.649 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.426 45.451 23.872 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.085 44.902 24.208 1.00 0.00 H new ATOM 699 N ILE A 44 46.506 42.330 27.237 1.00 0.00 N ATOM 700 CA ILE A 44 46.007 41.830 28.501 1.00 0.00 C ATOM 701 C ILE A 44 44.845 42.702 28.981 1.00 0.00 C ATOM 702 O ILE A 44 44.926 43.926 28.910 1.00 0.00 O ATOM 703 CB ILE A 44 47.112 41.743 29.550 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.436 41.162 29.063 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.665 40.895 30.737 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.422 42.191 28.516 1.00 0.00 C ATOM 0 H ILE A 44 46.654 43.339 27.243 1.00 0.00 H new ATOM 0 HA ILE A 44 45.641 40.815 28.349 1.00 0.00 H new ATOM 0 HB ILE A 44 47.289 42.784 29.821 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.909 40.629 29.888 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.230 40.427 28.285 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.468 40.846 31.472 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.782 41.344 31.193 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.425 39.888 30.395 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.333 41.687 28.194 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.975 42.708 27.667 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.663 42.914 29.295 1.00 0.00 H new ATOM 718 N PHE A 45 43.791 42.091 29.514 1.00 0.00 N ATOM 719 CA PHE A 45 42.781 42.764 30.305 1.00 0.00 C ATOM 720 C PHE A 45 42.686 42.117 31.688 1.00 0.00 C ATOM 721 O PHE A 45 42.415 40.922 31.783 1.00 0.00 O ATOM 722 CB PHE A 45 41.427 42.723 29.602 1.00 0.00 C ATOM 723 CG PHE A 45 40.324 43.431 30.354 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.437 44.791 30.660 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.194 42.722 30.779 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.440 45.440 31.398 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.194 43.368 31.516 1.00 0.00 C ATOM 728 CZ PHE A 45 38.316 44.725 31.832 1.00 0.00 C ATOM 0 H PHE A 45 43.617 41.092 29.402 1.00 0.00 H new ATOM 0 HA PHE A 45 43.069 43.809 30.422 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.528 43.174 28.615 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.139 41.683 29.449 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.301 45.345 30.324 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.093 41.674 30.538 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.537 46.490 31.632 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.325 42.816 31.842 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.548 45.219 32.408 1.00 0.00 H new ATOM 738 N ALA A 46 42.919 42.879 32.754 1.00 0.00 N ATOM 739 CA ALA A 46 42.813 42.425 34.126 1.00 0.00 C ATOM 740 C ALA A 46 43.494 41.082 34.387 1.00 0.00 C ATOM 741 O ALA A 46 42.904 40.151 34.931 1.00 0.00 O ATOM 742 CB ALA A 46 41.345 42.489 34.539 1.00 0.00 C ATOM 0 H ALA A 46 43.195 43.858 32.678 1.00 0.00 H new ATOM 0 HA ALA A 46 43.380 43.095 34.773 1.00 0.00 H new ATOM 0 HB1 ALA A 46 41.242 42.151 35.570 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.988 43.516 34.456 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.755 41.846 33.886 1.00 0.00 H new ATOM 748 N GLY A 47 44.731 40.932 33.919 1.00 0.00 N ATOM 749 CA GLY A 47 45.531 39.731 34.042 1.00 0.00 C ATOM 750 C GLY A 47 45.173 38.574 33.107 1.00 0.00 C ATOM 751 O GLY A 47 45.931 37.609 33.054 1.00 0.00 O ATOM 0 H GLY A 47 45.217 41.680 33.424 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.574 39.997 33.872 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.456 39.375 35.070 1.00 0.00 H new ATOM 755 N LYS A 48 44.094 38.651 32.331 1.00 0.00 N ATOM 756 CA LYS A 48 43.772 37.708 31.280 1.00 0.00 C ATOM 757 C LYS A 48 44.515 38.090 29.998 1.00 0.00 C ATOM 758 O LYS A 48 44.232 39.143 29.431 1.00 0.00 O ATOM 759 CB LYS A 48 42.270 37.687 31.014 1.00 0.00 C ATOM 760 CG LYS A 48 41.427 37.204 32.190 1.00 0.00 C ATOM 761 CD LYS A 48 39.946 37.203 31.819 1.00 0.00 C ATOM 762 CE LYS A 48 39.119 36.518 32.904 1.00 0.00 C ATOM 763 NZ LYS A 48 37.677 36.633 32.639 1.00 0.00 N ATOM 0 H LYS A 48 43.404 39.396 32.425 1.00 0.00 H new ATOM 0 HA LYS A 48 44.082 36.714 31.601 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.948 38.692 30.741 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.075 37.045 30.155 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.737 36.200 32.479 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.592 37.849 33.053 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.599 38.227 31.683 1.00 0.00 H new ATOM 0 HD3 LYS A 48 39.804 36.689 30.868 1.00 0.00 H new ATOM 0 HE2 LYS A 48 39.396 35.465 32.963 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.348 36.963 33.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 37.146 36.157 33.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 37.409 37.637 32.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 37.455 36.186 31.726 1.00 0.00 H new ATOM 777 N GLN A 49 45.445 37.262 29.530 1.00 0.00 N ATOM 778 CA GLN A 49 46.040 37.438 28.221 1.00 0.00 C ATOM 779 C GLN A 49 45.020 37.099 27.131 1.00 0.00 C ATOM 780 O GLN A 49 44.367 36.061 27.204 1.00 0.00 O ATOM 781 CB GLN A 49 47.312 36.609 28.065 1.00 0.00 C ATOM 782 CG GLN A 49 48.467 37.079 28.945 1.00 0.00 C ATOM 783 CD GLN A 49 49.826 36.509 28.532 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.965 35.736 27.587 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.906 36.902 29.202 1.00 0.00 N ATOM 0 H GLN A 49 45.801 36.458 30.047 1.00 0.00 H new ATOM 0 HA GLN A 49 46.328 38.484 28.115 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.088 35.569 28.301 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.627 36.638 27.022 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.515 38.168 28.915 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.263 36.797 29.978 1.00 0.00 H new ATOM 0 HE21 GLN A 49 50.812 37.543 29.990 1.00 0.00 H new ATOM 0 HE22 GLN A 49 51.828 36.562 28.928 1.00 0.00 H new ATOM 794 N LEU A 50 44.864 37.978 26.145 1.00 0.00 N ATOM 795 CA LEU A 50 43.799 37.934 25.164 1.00 0.00 C ATOM 796 C LEU A 50 44.256 37.210 23.896 1.00 0.00 C ATOM 797 O LEU A 50 45.337 37.491 23.382 1.00 0.00 O ATOM 798 CB LEU A 50 43.303 39.349 24.879 1.00 0.00 C ATOM 799 CG LEU A 50 42.988 40.213 26.095 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.504 41.586 25.638 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.913 39.609 26.993 1.00 0.00 C ATOM 0 H LEU A 50 45.500 38.764 26.008 1.00 0.00 H new ATOM 0 HA LEU A 50 42.962 37.362 25.564 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.057 39.862 24.281 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.404 39.279 24.267 1.00 0.00 H new ATOM 0 HG LEU A 50 43.911 40.284 26.671 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.280 42.201 26.509 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.282 42.067 25.045 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.604 41.472 25.033 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.733 40.270 27.841 1.00 0.00 H new ATOM 0 HD22 LEU A 50 40.990 39.488 26.425 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.246 38.637 27.356 1.00 0.00 H new ATOM 813 N GLU A 51 43.478 36.245 23.415 1.00 0.00 N ATOM 814 CA GLU A 51 43.879 35.317 22.375 1.00 0.00 C ATOM 815 C GLU A 51 43.630 35.837 20.958 1.00 0.00 C ATOM 816 O GLU A 51 42.566 36.368 20.648 1.00 0.00 O ATOM 817 CB GLU A 51 43.192 33.971 22.581 1.00 0.00 C ATOM 818 CG GLU A 51 43.583 33.221 23.852 1.00 0.00 C ATOM 819 CD GLU A 51 45.014 32.681 23.808 1.00 0.00 C ATOM 820 OE1 GLU A 51 45.918 33.369 24.329 1.00 0.00 O ATOM 821 OE2 GLU A 51 45.235 31.579 23.263 1.00 0.00 O ATOM 0 H GLU A 51 42.528 36.087 23.750 1.00 0.00 H new ATOM 0 HA GLU A 51 44.959 35.199 22.465 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.114 34.131 22.592 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.412 33.336 21.723 1.00 0.00 H new ATOM 0 HG2 GLU A 51 43.478 33.887 24.708 1.00 0.00 H new ATOM 0 HG3 GLU A 51 42.892 32.392 24.006 1.00 0.00 H new ATOM 828 N ASP A 52 44.597 35.621 20.071 1.00 0.00 N ATOM 829 CA ASP A 52 44.664 36.232 18.758 1.00 0.00 C ATOM 830 C ASP A 52 43.490 35.913 17.829 1.00 0.00 C ATOM 831 O ASP A 52 43.145 36.742 16.989 1.00 0.00 O ATOM 832 CB ASP A 52 45.982 35.864 18.083 1.00 0.00 C ATOM 833 CG ASP A 52 47.194 36.559 18.707 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.975 35.886 19.414 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.385 37.777 18.499 1.00 0.00 O ATOM 0 H ASP A 52 45.379 34.994 20.258 1.00 0.00 H new ATOM 0 HA ASP A 52 44.602 37.306 18.935 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.122 34.784 18.138 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.926 36.124 17.026 1.00 0.00 H new ATOM 840 N GLY A 53 42.850 34.756 17.975 1.00 0.00 N ATOM 841 CA GLY A 53 41.697 34.336 17.206 1.00 0.00 C ATOM 842 C GLY A 53 40.331 34.710 17.783 1.00 0.00 C ATOM 843 O GLY A 53 39.320 34.287 17.225 1.00 0.00 O ATOM 0 H GLY A 53 43.138 34.061 18.663 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.776 34.764 16.207 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.736 33.253 17.092 1.00 0.00 H new ATOM 847 N ARG A 54 40.265 35.439 18.893 1.00 0.00 N ATOM 848 CA ARG A 54 39.045 35.781 19.595 1.00 0.00 C ATOM 849 C ARG A 54 38.631 37.240 19.396 1.00 0.00 C ATOM 850 O ARG A 54 39.406 38.043 18.881 1.00 0.00 O ATOM 851 CB ARG A 54 39.171 35.415 21.071 1.00 0.00 C ATOM 852 CG ARG A 54 39.543 33.959 21.332 1.00 0.00 C ATOM 853 CD ARG A 54 38.618 32.919 20.708 1.00 0.00 C ATOM 854 NE ARG A 54 37.303 32.864 21.346 1.00 0.00 N ATOM 855 CZ ARG A 54 36.745 31.796 21.931 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.299 30.577 21.969 1.00 0.00 N ATOM 857 NH2 ARG A 54 35.540 31.904 22.509 1.00 0.00 N ATOM 0 H ARG A 54 41.098 35.820 19.342 1.00 0.00 H new ATOM 0 HA ARG A 54 38.238 35.191 19.160 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.924 36.057 21.528 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.225 35.630 21.568 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.554 33.789 20.961 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.568 33.797 22.410 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.492 33.143 19.649 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.088 31.938 20.773 1.00 0.00 H new ATOM 0 HE ARG A 54 36.756 33.725 21.345 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.207 30.416 21.533 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.813 29.810 22.434 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.050 32.798 22.503 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.114 31.092 22.955 1.00 0.00 H new ATOM 871 N THR A 55 37.408 37.572 19.798 1.00 0.00 N ATOM 872 CA THR A 55 36.862 38.914 19.809 1.00 0.00 C ATOM 873 C THR A 55 37.075 39.612 21.154 1.00 0.00 C ATOM 874 O THR A 55 37.330 38.954 22.159 1.00 0.00 O ATOM 875 CB THR A 55 35.372 38.933 19.476 1.00 0.00 C ATOM 876 OG1 THR A 55 34.612 38.307 20.485 1.00 0.00 O ATOM 877 CG2 THR A 55 35.031 38.260 18.150 1.00 0.00 C ATOM 0 H THR A 55 36.745 36.877 20.140 1.00 0.00 H new ATOM 0 HA THR A 55 37.406 39.456 19.036 1.00 0.00 H new ATOM 0 HB THR A 55 35.121 39.991 19.400 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.945 37.396 20.628 1.00 0.00 H new ATOM 0 HG21 THR A 55 33.955 38.313 17.981 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.551 38.770 17.339 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.343 37.216 18.181 1.00 0.00 H new ATOM 885 N LEU A 56 36.880 40.927 21.213 1.00 0.00 N ATOM 886 CA LEU A 56 36.765 41.624 22.478 1.00 0.00 C ATOM 887 C LEU A 56 35.556 41.150 23.287 1.00 0.00 C ATOM 888 O LEU A 56 35.650 40.996 24.502 1.00 0.00 O ATOM 889 CB LEU A 56 36.730 43.132 22.246 1.00 0.00 C ATOM 890 CG LEU A 56 37.901 43.707 21.453 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.748 45.219 21.326 1.00 0.00 C ATOM 892 CD2 LEU A 56 39.256 43.424 22.097 1.00 0.00 C ATOM 0 H LEU A 56 36.799 41.528 20.393 1.00 0.00 H new ATOM 0 HA LEU A 56 37.646 41.387 23.074 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.805 43.379 21.724 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.692 43.629 23.215 1.00 0.00 H new ATOM 0 HG LEU A 56 37.878 43.219 20.479 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.587 45.623 20.759 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.816 45.448 20.809 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.731 45.668 22.319 1.00 0.00 H new ATOM 0 HD21 LEU A 56 40.047 43.858 21.486 1.00 0.00 H new ATOM 0 HD22 LEU A 56 39.284 43.864 23.094 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.405 42.347 22.172 1.00 0.00 H new ATOM 904 N SER A 57 34.453 40.822 22.621 1.00 0.00 N ATOM 905 CA SER A 57 33.248 40.305 23.236 1.00 0.00 C ATOM 906 C SER A 57 33.402 38.941 23.914 1.00 0.00 C ATOM 907 O SER A 57 32.681 38.671 24.872 1.00 0.00 O ATOM 908 CB SER A 57 32.086 40.295 22.248 1.00 0.00 C ATOM 909 OG SER A 57 32.126 39.200 21.360 1.00 0.00 O ATOM 0 H SER A 57 34.377 40.914 21.608 1.00 0.00 H new ATOM 0 HA SER A 57 33.028 41.000 24.046 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.147 40.273 22.801 1.00 0.00 H new ATOM 0 HB3 SER A 57 32.097 41.222 21.674 1.00 0.00 H new ATOM 0 HG SER A 57 33.058 38.985 21.148 1.00 0.00 H new ATOM 915 N ASP A 58 34.366 38.115 23.518 1.00 0.00 N ATOM 916 CA ASP A 58 34.702 36.888 24.210 1.00 0.00 C ATOM 917 C ASP A 58 35.231 37.129 25.626 1.00 0.00 C ATOM 918 O ASP A 58 35.172 36.236 26.469 1.00 0.00 O ATOM 919 CB ASP A 58 35.729 36.091 23.411 1.00 0.00 C ATOM 920 CG ASP A 58 35.138 35.423 22.167 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.392 34.434 22.331 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.502 35.802 21.033 1.00 0.00 O ATOM 0 H ASP A 58 34.941 38.288 22.694 1.00 0.00 H new ATOM 0 HA ASP A 58 33.776 36.320 24.300 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.539 36.755 23.109 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.166 35.326 24.053 1.00 0.00 H new ATOM 927 N TYR A 59 35.712 38.335 25.912 1.00 0.00 N ATOM 928 CA TYR A 59 36.145 38.796 27.215 1.00 0.00 C ATOM 929 C TYR A 59 35.184 39.811 27.839 1.00 0.00 C ATOM 930 O TYR A 59 35.450 40.319 28.926 1.00 0.00 O ATOM 931 CB TYR A 59 37.568 39.331 27.087 1.00 0.00 C ATOM 932 CG TYR A 59 38.525 38.318 26.504 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.017 37.292 27.321 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.870 38.366 25.147 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.845 36.302 26.780 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.717 37.394 24.602 1.00 0.00 C ATOM 937 CZ TYR A 59 40.198 36.349 25.416 1.00 0.00 C ATOM 938 OH TYR A 59 40.984 35.375 24.873 1.00 0.00 O ATOM 0 H TYR A 59 35.813 39.054 25.195 1.00 0.00 H new ATOM 0 HA TYR A 59 36.138 37.956 27.910 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.561 40.221 26.458 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.926 39.638 28.070 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.757 37.265 28.369 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.482 39.155 24.520 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.213 35.503 27.407 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.001 37.445 23.561 1.00 0.00 H new ATOM 0 HH TYR A 59 40.757 35.261 23.927 1.00 0.00 H new ATOM 948 N ASN A 60 34.074 40.102 27.167 1.00 0.00 N ATOM 949 CA ASN A 60 33.044 41.046 27.551 1.00 0.00 C ATOM 950 C ASN A 60 33.570 42.417 27.982 1.00 0.00 C ATOM 951 O ASN A 60 33.129 42.983 28.981 1.00 0.00 O ATOM 952 CB ASN A 60 32.086 40.389 28.541 1.00 0.00 C ATOM 953 CG ASN A 60 30.765 41.155 28.632 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.207 41.597 27.630 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.203 41.328 29.825 1.00 0.00 N ATOM 0 H ASN A 60 33.861 39.649 26.278 1.00 0.00 H new ATOM 0 HA ASN A 60 32.471 41.296 26.658 1.00 0.00 H new ATOM 0 HB2 ASN A 60 31.892 39.361 28.234 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.552 40.345 29.526 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.315 41.824 29.903 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.660 40.964 30.661 1.00 0.00 H new ATOM 962 N ILE A 61 34.544 42.952 27.253 1.00 0.00 N ATOM 963 CA ILE A 61 35.156 44.233 27.544 1.00 0.00 C ATOM 964 C ILE A 61 34.140 45.348 27.291 1.00 0.00 C ATOM 965 O ILE A 61 33.686 45.544 26.166 1.00 0.00 O ATOM 966 CB ILE A 61 36.440 44.399 26.734 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.491 43.368 27.137 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.021 45.799 26.907 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.582 43.160 26.092 1.00 0.00 C ATOM 0 H ILE A 61 34.934 42.495 26.429 1.00 0.00 H new ATOM 0 HA ILE A 61 35.444 44.287 28.594 1.00 0.00 H new ATOM 0 HB ILE A 61 36.176 44.245 25.688 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.953 43.681 28.073 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.997 42.415 27.328 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.935 45.889 26.319 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.296 46.538 26.566 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.248 45.971 27.959 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.291 42.414 26.450 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.133 42.816 25.160 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.103 44.101 25.918 1.00 0.00 H new ATOM 981 N GLN A 62 33.777 46.078 28.342 1.00 0.00 N ATOM 982 CA GLN A 62 32.820 47.165 28.277 1.00 0.00 C ATOM 983 C GLN A 62 33.477 48.470 27.821 1.00 0.00 C ATOM 984 O GLN A 62 34.693 48.629 27.906 1.00 0.00 O ATOM 985 CB GLN A 62 32.125 47.339 29.624 1.00 0.00 C ATOM 986 CG GLN A 62 31.465 46.102 30.229 1.00 0.00 C ATOM 987 CD GLN A 62 30.304 45.490 29.444 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.044 45.779 28.278 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.538 44.600 30.067 1.00 0.00 N ATOM 0 H GLN A 62 34.150 45.923 29.278 1.00 0.00 H new ATOM 0 HA GLN A 62 32.069 46.908 27.530 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.858 47.715 30.337 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.363 48.110 29.515 1.00 0.00 H new ATOM 0 HG2 GLN A 62 32.230 45.336 30.357 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.104 46.361 31.224 1.00 0.00 H new ATOM 0 HE21 GLN A 62 29.736 44.345 31.035 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.752 44.172 29.577 1.00 0.00 H new ATOM 998 N LYS A 63 32.673 49.429 27.373 1.00 0.00 N ATOM 999 CA LYS A 63 33.118 50.741 26.948 1.00 0.00 C ATOM 1000 C LYS A 63 33.967 51.457 27.999 1.00 0.00 C ATOM 1001 O LYS A 63 33.726 51.326 29.197 1.00 0.00 O ATOM 1002 CB LYS A 63 31.929 51.575 26.480 1.00 0.00 C ATOM 1003 CG LYS A 63 30.835 51.895 27.495 1.00 0.00 C ATOM 1004 CD LYS A 63 31.073 53.159 28.317 1.00 0.00 C ATOM 1005 CE LYS A 63 29.839 53.487 29.154 1.00 0.00 C ATOM 1006 NZ LYS A 63 30.060 54.668 30.001 1.00 0.00 N ATOM 0 H LYS A 63 31.664 49.305 27.295 1.00 0.00 H new ATOM 0 HA LYS A 63 33.787 50.603 26.099 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.314 52.519 26.095 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.465 51.055 25.642 1.00 0.00 H new ATOM 0 HG2 LYS A 63 29.887 51.996 26.967 1.00 0.00 H new ATOM 0 HG3 LYS A 63 30.732 51.050 28.176 1.00 0.00 H new ATOM 0 HD2 LYS A 63 31.936 53.020 28.968 1.00 0.00 H new ATOM 0 HD3 LYS A 63 31.304 53.993 27.655 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.988 53.664 28.496 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.585 52.632 29.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.202 54.863 30.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.856 54.489 30.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 30.278 55.489 29.401 1.00 0.00 H new ATOM 1020 N GLU A 64 34.959 52.225 27.555 1.00 0.00 N ATOM 1021 CA GLU A 64 35.858 53.028 28.358 1.00 0.00 C ATOM 1022 C GLU A 64 36.657 52.248 29.405 1.00 0.00 C ATOM 1023 O GLU A 64 37.121 52.807 30.396 1.00 0.00 O ATOM 1024 CB GLU A 64 35.150 54.278 28.871 1.00 0.00 C ATOM 1025 CG GLU A 64 34.659 55.181 27.742 1.00 0.00 C ATOM 1026 CD GLU A 64 33.827 56.369 28.228 1.00 0.00 C ATOM 1027 OE1 GLU A 64 32.858 56.747 27.534 1.00 0.00 O ATOM 1028 OE2 GLU A 64 34.124 56.951 29.294 1.00 0.00 O ATOM 0 H GLU A 64 35.164 52.303 26.559 1.00 0.00 H new ATOM 0 HA GLU A 64 36.654 53.374 27.699 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.302 53.983 29.490 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.831 54.840 29.510 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.519 55.554 27.185 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.062 54.589 27.048 1.00 0.00 H new ATOM 1035 N SER A 65 36.855 50.953 29.176 1.00 0.00 N ATOM 1036 CA SER A 65 37.768 50.111 29.923 1.00 0.00 C ATOM 1037 C SER A 65 39.236 50.368 29.576 1.00 0.00 C ATOM 1038 O SER A 65 39.541 50.889 28.506 1.00 0.00 O ATOM 1039 CB SER A 65 37.444 48.636 29.706 1.00 0.00 C ATOM 1040 OG SER A 65 36.134 48.325 30.124 1.00 0.00 O ATOM 0 H SER A 65 36.364 50.449 28.438 1.00 0.00 H new ATOM 0 HA SER A 65 37.629 50.370 30.973 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.558 48.389 28.650 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.157 48.022 30.255 1.00 0.00 H new ATOM 0 HG SER A 65 35.578 48.129 29.341 1.00 0.00 H new ATOM 1046 N THR A 66 40.148 49.968 30.457 1.00 0.00 N ATOM 1047 CA THR A 66 41.583 50.052 30.267 1.00 0.00 C ATOM 1048 C THR A 66 42.230 48.666 30.223 1.00 0.00 C ATOM 1049 O THR A 66 41.944 47.816 31.064 1.00 0.00 O ATOM 1050 CB THR A 66 42.238 50.919 31.338 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.701 52.222 31.297 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.743 51.092 31.161 1.00 0.00 C ATOM 0 H THR A 66 39.892 49.561 31.357 1.00 0.00 H new ATOM 0 HA THR A 66 41.748 50.527 29.300 1.00 0.00 H new ATOM 0 HB THR A 66 42.042 50.399 32.276 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.125 52.772 31.988 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.134 51.721 31.961 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.228 50.116 31.196 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.944 51.563 30.199 1.00 0.00 H new ATOM 1060 N LEU A 67 43.125 48.456 29.263 1.00 0.00 N ATOM 1061 CA LEU A 67 43.892 47.257 28.996 1.00 0.00 C ATOM 1062 C LEU A 67 45.391 47.541 29.121 1.00 0.00 C ATOM 1063 O LEU A 67 45.814 48.693 29.064 1.00 0.00 O ATOM 1064 CB LEU A 67 43.581 46.758 27.588 1.00 0.00 C ATOM 1065 CG LEU A 67 42.299 45.947 27.432 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.016 46.772 27.478 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.326 45.218 26.091 1.00 0.00 C ATOM 0 H LEU A 67 43.348 49.193 28.594 1.00 0.00 H new ATOM 0 HA LEU A 67 43.619 46.495 29.726 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.525 47.620 26.923 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.417 46.147 27.248 1.00 0.00 H new ATOM 0 HG LEU A 67 42.279 45.268 28.284 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.156 46.114 27.359 1.00 0.00 H new ATOM 0 HD12 LEU A 67 40.949 47.287 28.436 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.026 47.505 26.672 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.411 44.637 25.974 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.399 45.946 25.283 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.187 44.551 26.057 1.00 0.00 H new ATOM 1079 N HIS A 68 46.212 46.500 29.208 1.00 0.00 N ATOM 1080 CA HIS A 68 47.659 46.586 29.194 1.00 0.00 C ATOM 1081 C HIS A 68 48.280 45.990 27.930 1.00 0.00 C ATOM 1082 O HIS A 68 47.763 45.033 27.355 1.00 0.00 O ATOM 1083 CB HIS A 68 48.250 45.947 30.448 1.00 0.00 C ATOM 1084 CG HIS A 68 48.049 46.753 31.702 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.930 46.699 32.532 1.00 0.00 N ATOM 1086 CD2 HIS A 68 48.967 47.604 32.260 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.178 47.519 33.556 1.00 0.00 C ATOM 1088 NE2 HIS A 68 48.400 48.065 33.431 1.00 0.00 N ATOM 0 H HIS A 68 45.872 45.542 29.293 1.00 0.00 H new ATOM 0 HA HIS A 68 47.910 47.647 29.188 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.803 44.963 30.586 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.318 45.793 30.295 1.00 0.00 H new ATOM 0 HD2 HIS A 68 49.938 47.862 31.864 1.00 0.00 H new ATOM 0 HE1 HIS A 68 46.494 47.716 34.369 1.00 0.00 H new ATOM 0 HE2 HIS A 68 48.835 48.711 34.090 1.00 0.00 H new ATOM 1096 N LEU A 69 49.428 46.531 27.533 1.00 0.00 N ATOM 1097 CA LEU A 69 50.261 46.086 26.435 1.00 0.00 C ATOM 1098 C LEU A 69 51.665 45.748 26.939 1.00 0.00 C ATOM 1099 O LEU A 69 52.360 46.604 27.482 1.00 0.00 O ATOM 1100 CB LEU A 69 50.267 47.173 25.363 1.00 0.00 C ATOM 1101 CG LEU A 69 51.273 47.025 24.225 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.111 45.734 23.429 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.126 48.186 23.246 1.00 0.00 C ATOM 0 H LEU A 69 49.821 47.345 28.005 1.00 0.00 H new ATOM 0 HA LEU A 69 49.864 45.172 25.994 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.269 47.223 24.927 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.449 48.129 25.853 1.00 0.00 H new ATOM 0 HG LEU A 69 52.254 47.012 24.701 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.860 45.698 22.638 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.243 44.879 24.092 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.115 45.701 22.988 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.847 48.073 22.437 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.117 48.189 22.835 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.309 49.126 23.766 1.00 0.00 H new ATOM 1115 N VAL A 70 52.095 44.511 26.712 1.00 0.00 N ATOM 1116 CA VAL A 70 53.404 43.986 27.044 1.00 0.00 C ATOM 1117 C VAL A 70 54.107 43.532 25.763 1.00 0.00 C ATOM 1118 O VAL A 70 53.486 42.918 24.898 1.00 0.00 O ATOM 1119 CB VAL A 70 53.290 42.866 28.075 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.632 42.215 28.393 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.728 43.390 29.393 1.00 0.00 C ATOM 0 H VAL A 70 51.501 43.812 26.266 1.00 0.00 H new ATOM 0 HA VAL A 70 54.011 44.768 27.501 1.00 0.00 H new ATOM 0 HB VAL A 70 52.625 42.129 27.625 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.488 41.426 29.132 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.054 41.787 27.483 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.315 42.965 28.792 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.657 42.572 30.109 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.388 44.162 29.788 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.737 43.811 29.224 1.00 0.00 H new