USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=17 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 -58:sc= 1.78 USER MOD Set 1.2: A 57 SER OG : rot -27:sc= 0.867 USER MOD Set 2.1: A 25 ASN : amide:sc= 0 K(o=1.2,f=-0.62) USER MOD Set 2.2: A 29 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.17) USER MOD Single : A 1 MET CE :methyl -172:sc= 0 (180deg=-0.0789) USER MOD Single : A 1 MET N :NH3+ -168:sc= 1.61 (180deg=1.44) USER MOD Single : A 2 GLN : amide:sc= 0.847 K(o=0.85,f=-0.096) USER MOD Single : A 6 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00587) USER MOD Single : A 11 LYS NZ :NH3+ 151:sc= 1.05 (180deg=0.089!) 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= 0.00868 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.298 USER MOD Single : A 27 LYS NZ :NH3+ -157:sc= -0.124 (180deg=-1.11!) USER MOD Single : A 31 GLN : amide:sc= -0.491 K(o=-0.49,f=-1.1) USER MOD Single : A 33 LYS NZ :NH3+ 175:sc= 0.63 (180deg=0.621) USER MOD Single : A 40 GLN : amide:sc= -0.0232 X(o=-0.023,f=-0.44) USER MOD Single : A 41 GLN : amide:sc= 1.54 K(o=1.5,f=-3.2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.0155 K(o=-0.015,f=-3.1!) USER MOD Single : A 59 TYR OH : rot 150:sc= 0.234 USER MOD Single : A 60 ASN : amide:sc= -0.137 X(o=-0.14,f=-0.14) USER MOD Single : A 62 GLN : amide:sc= 0.425 X(o=0.43,f=-0.0014) USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0255) USER MOD Single : A 65 SER OG : rot 103:sc= 1.2 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=-0.0063) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.857 52.335 20.198 1.00 0.00 N ATOM 2 CA MET A 1 33.159 52.507 21.629 1.00 0.00 C ATOM 3 C MET A 1 34.668 52.681 21.809 1.00 0.00 C ATOM 4 O MET A 1 35.435 52.271 20.941 1.00 0.00 O ATOM 5 CB MET A 1 32.593 51.384 22.493 1.00 0.00 C ATOM 6 CG MET A 1 33.235 50.018 22.272 1.00 0.00 C ATOM 7 SD MET A 1 32.605 48.721 23.367 1.00 0.00 S ATOM 8 CE MET A 1 33.815 47.418 23.033 1.00 0.00 C ATOM 0 H1 MET A 1 31.832 52.420 20.047 1.00 0.00 H new ATOM 0 H2 MET A 1 33.350 53.068 19.649 1.00 0.00 H new ATOM 0 H3 MET A 1 33.176 51.396 19.886 1.00 0.00 H new ATOM 0 HA MET A 1 32.658 53.409 21.980 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.709 51.658 23.542 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.523 51.302 22.301 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.074 49.715 21.237 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.312 50.107 22.414 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.498 46.494 23.517 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.889 47.257 21.957 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.788 47.717 23.423 1.00 0.00 H new ATOM 20 N GLN A 2 35.111 53.248 22.928 1.00 0.00 N ATOM 21 CA GLN A 2 36.514 53.467 23.216 1.00 0.00 C ATOM 22 C GLN A 2 37.074 52.488 24.250 1.00 0.00 C ATOM 23 O GLN A 2 36.367 52.069 25.163 1.00 0.00 O ATOM 24 CB GLN A 2 36.759 54.928 23.581 1.00 0.00 C ATOM 25 CG GLN A 2 36.297 55.290 24.990 1.00 0.00 C ATOM 26 CD GLN A 2 36.180 56.800 25.208 1.00 0.00 C ATOM 27 OE1 GLN A 2 36.936 57.601 24.664 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.221 57.228 26.025 1.00 0.00 N ATOM 0 H GLN A 2 34.489 53.572 23.669 1.00 0.00 H new ATOM 0 HA GLN A 2 37.075 53.255 22.306 1.00 0.00 H new ATOM 0 HB2 GLN A 2 37.824 55.143 23.490 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.242 55.565 22.863 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.330 54.824 25.181 1.00 0.00 H new ATOM 0 HG3 GLN A 2 36.999 54.877 25.715 1.00 0.00 H new ATOM 0 HE21 GLN A 2 34.596 56.558 26.474 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.110 58.226 26.203 1.00 0.00 H new ATOM 37 N ILE A 3 38.362 52.181 24.125 1.00 0.00 N ATOM 38 CA ILE A 3 39.163 51.494 25.118 1.00 0.00 C ATOM 39 C ILE A 3 40.528 52.173 25.260 1.00 0.00 C ATOM 40 O ILE A 3 40.971 52.862 24.344 1.00 0.00 O ATOM 41 CB ILE A 3 39.295 49.998 24.844 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.985 49.698 23.516 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.942 49.300 24.944 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.334 48.228 23.304 1.00 0.00 C ATOM 0 H ILE A 3 38.895 52.418 23.288 1.00 0.00 H new ATOM 0 HA ILE A 3 38.639 51.571 26.070 1.00 0.00 H new ATOM 0 HB ILE A 3 39.943 49.593 25.621 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.338 50.026 22.702 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.899 50.288 23.454 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.066 48.236 24.744 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.536 49.436 25.946 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.256 49.729 24.213 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.821 48.105 22.336 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.008 47.897 24.094 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.423 47.630 23.330 1.00 0.00 H new ATOM 56 N PHE A 4 41.196 51.959 26.389 1.00 0.00 N ATOM 57 CA PHE A 4 42.441 52.611 26.746 1.00 0.00 C ATOM 58 C PHE A 4 43.578 51.596 26.874 1.00 0.00 C ATOM 59 O PHE A 4 43.500 50.654 27.659 1.00 0.00 O ATOM 60 CB PHE A 4 42.255 53.409 28.033 1.00 0.00 C ATOM 61 CG PHE A 4 41.007 54.258 28.085 1.00 0.00 C ATOM 62 CD1 PHE A 4 40.843 55.339 27.210 1.00 0.00 C ATOM 63 CD2 PHE A 4 39.996 53.952 29.004 1.00 0.00 C ATOM 64 CE1 PHE A 4 39.672 56.105 27.251 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.835 54.731 29.057 1.00 0.00 C ATOM 66 CZ PHE A 4 38.666 55.807 28.178 1.00 0.00 C ATOM 0 H PHE A 4 40.871 51.305 27.101 1.00 0.00 H new ATOM 0 HA PHE A 4 42.718 53.301 25.949 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.239 52.715 28.873 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.122 54.056 28.170 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.622 55.582 26.502 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.113 53.113 29.674 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.544 56.929 26.565 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.066 54.501 29.779 1.00 0.00 H new ATOM 0 HZ PHE A 4 37.766 56.403 28.215 1.00 0.00 H new ATOM 76 N VAL A 5 44.649 51.784 26.108 1.00 0.00 N ATOM 77 CA VAL A 5 45.783 50.885 26.038 1.00 0.00 C ATOM 78 C VAL A 5 46.988 51.520 26.736 1.00 0.00 C ATOM 79 O VAL A 5 47.573 52.466 26.216 1.00 0.00 O ATOM 80 CB VAL A 5 46.075 50.537 24.582 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.262 49.586 24.457 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.877 49.877 23.905 1.00 0.00 C ATOM 0 H VAL A 5 44.749 52.597 25.500 1.00 0.00 H new ATOM 0 HA VAL A 5 45.557 49.954 26.557 1.00 0.00 H new ATOM 0 HB VAL A 5 46.302 51.483 24.091 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.439 49.361 23.405 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.150 50.054 24.883 1.00 0.00 H new ATOM 0 HG13 VAL A 5 47.046 48.662 24.994 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.126 49.645 22.870 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.623 48.957 24.432 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.025 50.557 23.930 1.00 0.00 H new ATOM 92 N LYS A 6 47.340 51.010 27.913 1.00 0.00 N ATOM 93 CA LYS A 6 48.462 51.439 28.722 1.00 0.00 C ATOM 94 C LYS A 6 49.781 50.798 28.282 1.00 0.00 C ATOM 95 O LYS A 6 49.790 49.629 27.903 1.00 0.00 O ATOM 96 CB LYS A 6 48.216 51.071 30.182 1.00 0.00 C ATOM 97 CG LYS A 6 47.260 51.997 30.930 1.00 0.00 C ATOM 98 CD LYS A 6 47.056 51.468 32.347 1.00 0.00 C ATOM 99 CE LYS A 6 46.279 52.423 33.248 1.00 0.00 C ATOM 100 NZ LYS A 6 47.062 53.615 33.607 1.00 0.00 N ATOM 0 H LYS A 6 46.819 50.247 28.345 1.00 0.00 H new ATOM 0 HA LYS A 6 48.546 52.518 28.597 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.821 50.056 30.223 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.172 51.062 30.705 1.00 0.00 H new ATOM 0 HG2 LYS A 6 47.664 53.009 30.961 1.00 0.00 H new ATOM 0 HG3 LYS A 6 46.305 52.052 30.408 1.00 0.00 H new ATOM 0 HD2 LYS A 6 46.527 50.516 32.298 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.029 51.269 32.796 1.00 0.00 H new ATOM 0 HE2 LYS A 6 45.364 52.731 32.743 1.00 0.00 H new ATOM 0 HE3 LYS A 6 45.981 51.900 34.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 46.505 54.217 34.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 47.940 53.324 34.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 47.296 54.149 32.746 1.00 0.00 H new ATOM 168 N LYS A 11 52.710 55.666 28.433 1.00 0.00 N ATOM 169 CA LYS A 11 51.819 56.138 27.392 1.00 0.00 C ATOM 170 C LYS A 11 50.448 55.472 27.526 1.00 0.00 C ATOM 171 O LYS A 11 50.364 54.291 27.858 1.00 0.00 O ATOM 172 CB LYS A 11 52.465 55.884 26.034 1.00 0.00 C ATOM 173 CG LYS A 11 51.859 56.718 24.909 1.00 0.00 C ATOM 174 CD LYS A 11 52.573 56.461 23.586 1.00 0.00 C ATOM 175 CE LYS A 11 51.998 57.359 22.494 1.00 0.00 C ATOM 176 NZ LYS A 11 52.568 57.045 21.175 1.00 0.00 N ATOM 0 HA LYS A 11 51.654 57.211 27.490 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.532 56.099 26.101 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.368 54.827 25.786 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.800 56.480 24.806 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.925 57.776 25.161 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.641 56.650 23.698 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.463 55.414 23.302 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.915 57.242 22.460 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.198 58.402 22.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 51.874 57.272 20.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.430 57.608 21.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 52.803 56.033 21.130 1.00 0.00 H new ATOM 190 N THR A 12 49.379 56.206 27.233 1.00 0.00 N ATOM 191 CA THR A 12 48.037 55.676 27.097 1.00 0.00 C ATOM 192 C THR A 12 47.498 56.012 25.705 1.00 0.00 C ATOM 193 O THR A 12 47.402 57.182 25.339 1.00 0.00 O ATOM 194 CB THR A 12 47.100 56.191 28.186 1.00 0.00 C ATOM 195 OG1 THR A 12 47.611 55.840 29.453 1.00 0.00 O ATOM 196 CG2 THR A 12 45.721 55.540 28.104 1.00 0.00 C ATOM 0 H THR A 12 49.430 57.213 27.080 1.00 0.00 H new ATOM 0 HA THR A 12 48.084 54.594 27.217 1.00 0.00 H new ATOM 0 HB THR A 12 47.022 57.269 28.047 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.010 56.173 30.152 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.085 55.934 28.897 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.272 55.760 27.135 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.820 54.461 28.221 1.00 0.00 H new ATOM 204 N ILE A 13 47.157 54.996 24.918 1.00 0.00 N ATOM 205 CA ILE A 13 46.634 55.127 23.573 1.00 0.00 C ATOM 206 C ILE A 13 45.134 54.824 23.604 1.00 0.00 C ATOM 207 O ILE A 13 44.718 53.764 24.064 1.00 0.00 O ATOM 208 CB ILE A 13 47.391 54.240 22.588 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.907 54.415 22.605 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.909 54.538 21.172 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.655 53.590 23.647 1.00 0.00 C ATOM 0 H ILE A 13 47.243 54.024 25.216 1.00 0.00 H new ATOM 0 HA ILE A 13 46.778 56.147 23.217 1.00 0.00 H new ATOM 0 HB ILE A 13 47.183 53.217 22.900 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.295 54.160 21.619 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.131 55.468 22.773 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.447 53.907 20.464 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.841 54.334 21.101 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.095 55.586 20.937 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.724 53.791 23.571 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.305 53.859 24.644 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.472 52.530 23.472 1.00 0.00 H new ATOM 223 N THR A 14 44.315 55.746 23.105 1.00 0.00 N ATOM 224 CA THR A 14 42.880 55.579 23.000 1.00 0.00 C ATOM 225 C THR A 14 42.541 54.952 21.647 1.00 0.00 C ATOM 226 O THR A 14 43.019 55.403 20.608 1.00 0.00 O ATOM 227 CB THR A 14 42.154 56.906 23.204 1.00 0.00 C ATOM 228 OG1 THR A 14 42.495 57.449 24.460 1.00 0.00 O ATOM 229 CG2 THR A 14 40.636 56.748 23.206 1.00 0.00 C ATOM 0 H THR A 14 44.644 56.647 22.757 1.00 0.00 H new ATOM 0 HA THR A 14 42.539 54.910 23.790 1.00 0.00 H new ATOM 0 HB THR A 14 42.456 57.548 22.376 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.028 58.301 24.586 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.169 57.722 23.355 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.312 56.332 22.252 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.341 56.077 24.013 1.00 0.00 H new ATOM 237 N LEU A 15 41.733 53.896 21.659 1.00 0.00 N ATOM 238 CA LEU A 15 41.268 53.189 20.482 1.00 0.00 C ATOM 239 C LEU A 15 39.781 53.441 20.217 1.00 0.00 C ATOM 240 O LEU A 15 39.036 53.886 21.087 1.00 0.00 O ATOM 241 CB LEU A 15 41.599 51.706 20.615 1.00 0.00 C ATOM 242 CG LEU A 15 42.947 51.258 20.057 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.142 51.945 20.713 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.095 49.751 20.245 1.00 0.00 C ATOM 0 H LEU A 15 41.373 53.498 22.526 1.00 0.00 H new ATOM 0 HA LEU A 15 41.790 53.575 19.607 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.562 51.441 21.672 1.00 0.00 H new ATOM 0 HB3 LEU A 15 40.816 51.135 20.116 1.00 0.00 H new ATOM 0 HG LEU A 15 42.951 51.538 19.004 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.065 51.576 20.265 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.071 53.022 20.562 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.145 51.728 21.781 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.057 49.427 19.847 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.041 49.510 21.307 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.292 49.238 19.715 1.00 0.00 H new ATOM 256 N GLU A 16 39.335 53.112 19.008 1.00 0.00 N ATOM 257 CA GLU A 16 37.952 53.103 18.575 1.00 0.00 C ATOM 258 C GLU A 16 37.614 51.719 18.016 1.00 0.00 C ATOM 259 O GLU A 16 38.163 51.315 16.994 1.00 0.00 O ATOM 260 CB GLU A 16 37.744 54.219 17.556 1.00 0.00 C ATOM 261 CG GLU A 16 36.341 54.293 16.959 1.00 0.00 C ATOM 262 CD GLU A 16 35.262 54.348 18.042 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.302 55.280 18.874 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.401 53.443 18.069 1.00 0.00 O ATOM 0 H GLU A 16 39.973 52.828 18.264 1.00 0.00 H new ATOM 0 HA GLU A 16 37.275 53.292 19.408 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.971 55.173 18.033 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.461 54.089 16.746 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.263 55.175 16.324 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.172 53.425 16.322 1.00 0.00 H new ATOM 271 N VAL A 17 36.752 50.997 18.726 1.00 0.00 N ATOM 272 CA VAL A 17 36.507 49.575 18.599 1.00 0.00 C ATOM 273 C VAL A 17 35.013 49.245 18.626 1.00 0.00 C ATOM 274 O VAL A 17 34.194 50.038 19.084 1.00 0.00 O ATOM 275 CB VAL A 17 37.245 48.791 19.681 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.731 49.128 19.750 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.685 49.008 21.084 1.00 0.00 C ATOM 0 H VAL A 17 36.172 51.422 19.450 1.00 0.00 H new ATOM 0 HA VAL A 17 36.894 49.273 17.626 1.00 0.00 H new ATOM 0 HB VAL A 17 37.099 47.754 19.379 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.201 48.539 20.538 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.201 48.897 18.794 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.854 50.189 19.968 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.259 48.420 21.800 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.754 50.064 21.344 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.641 48.695 21.111 1.00 0.00 H new ATOM 287 N GLU A 18 34.657 48.037 18.197 1.00 0.00 N ATOM 288 CA GLU A 18 33.365 47.414 18.400 1.00 0.00 C ATOM 289 C GLU A 18 33.527 46.092 19.154 1.00 0.00 C ATOM 290 O GLU A 18 34.562 45.448 19.002 1.00 0.00 O ATOM 291 CB GLU A 18 32.684 47.133 17.064 1.00 0.00 C ATOM 292 CG GLU A 18 32.519 48.334 16.136 1.00 0.00 C ATOM 293 CD GLU A 18 31.710 49.479 16.747 1.00 0.00 C ATOM 294 OE1 GLU A 18 32.051 50.659 16.510 1.00 0.00 O ATOM 295 OE2 GLU A 18 30.689 49.225 17.420 1.00 0.00 O ATOM 0 H GLU A 18 35.298 47.442 17.673 1.00 0.00 H new ATOM 0 HA GLU A 18 32.751 48.102 18.982 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.257 46.369 16.539 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.698 46.713 17.262 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.506 48.706 15.859 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.032 48.007 15.217 1.00 0.00 H new ATOM 302 N PRO A 19 32.539 45.610 19.903 1.00 0.00 N ATOM 303 CA PRO A 19 32.598 44.303 20.529 1.00 0.00 C ATOM 304 C PRO A 19 32.844 43.148 19.557 1.00 0.00 C ATOM 305 O PRO A 19 33.427 42.132 19.932 1.00 0.00 O ATOM 306 CB PRO A 19 31.268 44.129 21.256 1.00 0.00 C ATOM 307 CG PRO A 19 30.842 45.563 21.557 1.00 0.00 C ATOM 308 CD PRO A 19 31.340 46.306 20.322 1.00 0.00 C ATOM 0 HA PRO A 19 33.455 44.267 21.202 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.535 43.613 20.636 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.382 43.543 22.168 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.762 45.651 21.679 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.298 45.941 22.472 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.588 46.301 19.533 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.553 47.350 20.553 1.00 0.00 H new ATOM 316 N SER A 20 32.425 43.296 18.303 1.00 0.00 N ATOM 317 CA SER A 20 32.587 42.342 17.223 1.00 0.00 C ATOM 318 C SER A 20 33.886 42.483 16.429 1.00 0.00 C ATOM 319 O SER A 20 34.031 41.868 15.375 1.00 0.00 O ATOM 320 CB SER A 20 31.359 42.411 16.319 1.00 0.00 C ATOM 321 OG SER A 20 31.156 43.729 15.861 1.00 0.00 O ATOM 0 H SER A 20 31.934 44.138 18.001 1.00 0.00 H new ATOM 0 HA SER A 20 32.670 41.355 17.678 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.487 41.740 15.469 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.479 42.070 16.864 1.00 0.00 H new ATOM 0 HG SER A 20 30.366 43.756 15.281 1.00 0.00 H new ATOM 327 N ASP A 21 34.845 43.284 16.882 1.00 0.00 N ATOM 328 CA ASP A 21 36.192 43.309 16.348 1.00 0.00 C ATOM 329 C ASP A 21 37.057 42.190 16.930 1.00 0.00 C ATOM 330 O ASP A 21 36.867 41.755 18.064 1.00 0.00 O ATOM 331 CB ASP A 21 36.853 44.666 16.569 1.00 0.00 C ATOM 332 CG ASP A 21 36.232 45.811 15.765 1.00 0.00 C ATOM 333 OD1 ASP A 21 35.707 45.565 14.659 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.367 46.970 16.212 1.00 0.00 O ATOM 0 H ASP A 21 34.700 43.945 17.645 1.00 0.00 H new ATOM 0 HA ASP A 21 36.109 43.140 15.274 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.801 44.913 17.629 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.909 44.588 16.311 1.00 0.00 H new ATOM 339 N THR A 22 38.032 41.724 16.155 1.00 0.00 N ATOM 340 CA THR A 22 38.940 40.656 16.520 1.00 0.00 C ATOM 341 C THR A 22 40.160 41.160 17.293 1.00 0.00 C ATOM 342 O THR A 22 40.562 42.314 17.161 1.00 0.00 O ATOM 343 CB THR A 22 39.399 39.873 15.293 1.00 0.00 C ATOM 344 OG1 THR A 22 40.169 40.701 14.451 1.00 0.00 O ATOM 345 CG2 THR A 22 38.249 39.327 14.451 1.00 0.00 C ATOM 0 H THR A 22 38.213 42.097 15.223 1.00 0.00 H new ATOM 0 HA THR A 22 38.377 39.994 17.178 1.00 0.00 H new ATOM 0 HB THR A 22 39.974 39.033 15.683 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.461 40.190 13.667 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.650 38.782 13.596 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.642 38.655 15.057 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.633 40.154 14.097 1.00 0.00 H new ATOM 353 N ILE A 23 40.830 40.282 18.034 1.00 0.00 N ATOM 354 CA ILE A 23 42.097 40.599 18.662 1.00 0.00 C ATOM 355 C ILE A 23 43.189 40.870 17.626 1.00 0.00 C ATOM 356 O ILE A 23 44.022 41.748 17.843 1.00 0.00 O ATOM 357 CB ILE A 23 42.465 39.511 19.668 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.452 39.370 20.801 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.864 39.691 20.248 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.091 40.641 21.565 1.00 0.00 C ATOM 0 H ILE A 23 40.505 39.332 18.213 1.00 0.00 H new ATOM 0 HA ILE A 23 41.997 41.530 19.220 1.00 0.00 H new ATOM 0 HB ILE A 23 42.449 38.588 19.088 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.535 38.951 20.386 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.840 38.643 21.515 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.070 38.889 20.956 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.598 39.662 19.443 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.925 40.651 20.760 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.364 40.405 22.342 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.988 41.058 22.023 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.663 41.370 20.877 1.00 0.00 H new ATOM 372 N GLU A 24 43.147 40.231 16.460 1.00 0.00 N ATOM 373 CA GLU A 24 44.006 40.560 15.341 1.00 0.00 C ATOM 374 C GLU A 24 43.827 42.009 14.884 1.00 0.00 C ATOM 375 O GLU A 24 44.821 42.690 14.643 1.00 0.00 O ATOM 376 CB GLU A 24 43.762 39.584 14.193 1.00 0.00 C ATOM 377 CG GLU A 24 44.589 39.880 12.946 1.00 0.00 C ATOM 378 CD GLU A 24 44.395 38.829 11.851 1.00 0.00 C ATOM 379 OE1 GLU A 24 45.106 37.801 11.861 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.531 39.020 10.967 1.00 0.00 O ATOM 0 H GLU A 24 42.505 39.461 16.270 1.00 0.00 H new ATOM 0 HA GLU A 24 45.040 40.464 15.672 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.986 38.573 14.534 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.705 39.605 13.930 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.315 40.861 12.557 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.644 39.928 13.216 1.00 0.00 H new ATOM 387 N ASN A 25 42.593 42.501 14.820 1.00 0.00 N ATOM 388 CA ASN A 25 42.283 43.877 14.485 1.00 0.00 C ATOM 389 C ASN A 25 42.767 44.859 15.553 1.00 0.00 C ATOM 390 O ASN A 25 43.331 45.892 15.196 1.00 0.00 O ATOM 391 CB ASN A 25 40.786 43.992 14.212 1.00 0.00 C ATOM 392 CG ASN A 25 40.319 45.429 13.967 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.823 46.101 14.868 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.413 45.936 12.742 1.00 0.00 N ATOM 0 H ASN A 25 41.765 41.936 15.005 1.00 0.00 H new ATOM 0 HA ASN A 25 42.825 44.156 13.582 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.535 43.384 13.343 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.237 43.579 15.059 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.074 46.879 12.553 1.00 0.00 H new ATOM 0 HD22 ASN A 25 40.824 45.382 11.991 1.00 0.00 H new ATOM 401 N VAL A 26 42.654 44.543 16.840 1.00 0.00 N ATOM 402 CA VAL A 26 43.206 45.370 17.894 1.00 0.00 C ATOM 403 C VAL A 26 44.729 45.467 17.778 1.00 0.00 C ATOM 404 O VAL A 26 45.268 46.571 17.776 1.00 0.00 O ATOM 405 CB VAL A 26 42.794 44.896 19.285 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.364 45.788 20.384 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.278 44.913 19.460 1.00 0.00 C ATOM 0 H VAL A 26 42.177 43.706 17.175 1.00 0.00 H new ATOM 0 HA VAL A 26 42.786 46.367 17.762 1.00 0.00 H new ATOM 0 HB VAL A 26 43.185 43.882 19.371 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.046 45.414 21.357 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.453 45.781 20.330 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.001 46.807 20.250 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.024 44.569 20.463 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.907 45.928 19.320 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.819 44.254 18.723 1.00 0.00 H new ATOM 417 N LYS A 27 45.423 44.351 17.579 1.00 0.00 N ATOM 418 CA LYS A 27 46.849 44.339 17.328 1.00 0.00 C ATOM 419 C LYS A 27 47.225 45.095 16.052 1.00 0.00 C ATOM 420 O LYS A 27 48.250 45.773 16.046 1.00 0.00 O ATOM 421 CB LYS A 27 47.384 42.912 17.265 1.00 0.00 C ATOM 422 CG LYS A 27 47.399 42.186 18.608 1.00 0.00 C ATOM 423 CD LYS A 27 48.067 40.824 18.451 1.00 0.00 C ATOM 424 CE LYS A 27 47.916 39.960 19.699 1.00 0.00 C ATOM 425 NZ LYS A 27 48.379 38.587 19.441 1.00 0.00 N ATOM 0 H LYS A 27 45.001 43.422 17.589 1.00 0.00 H new ATOM 0 HA LYS A 27 47.313 44.857 18.167 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.778 42.340 16.563 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.398 42.934 16.866 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.935 42.781 19.348 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.381 42.062 18.976 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.632 40.305 17.597 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.126 40.964 18.234 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.488 40.394 20.519 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.872 39.944 20.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 47.932 37.937 20.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.120 38.310 18.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.412 38.543 19.549 1.00 0.00 H new ATOM 439 N ALA A 28 46.404 45.051 15.007 1.00 0.00 N ATOM 440 CA ALA A 28 46.620 45.778 13.773 1.00 0.00 C ATOM 441 C ALA A 28 46.432 47.289 13.914 1.00 0.00 C ATOM 442 O ALA A 28 47.180 48.053 13.308 1.00 0.00 O ATOM 443 CB ALA A 28 45.710 45.203 12.690 1.00 0.00 C ATOM 0 H ALA A 28 45.550 44.493 15.001 1.00 0.00 H new ATOM 0 HA ALA A 28 47.664 45.646 13.490 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.867 45.745 11.757 1.00 0.00 H new ATOM 0 HB2 ALA A 28 45.944 44.149 12.540 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.669 45.304 12.998 1.00 0.00 H new ATOM 449 N LYS A 29 45.503 47.745 14.750 1.00 0.00 N ATOM 450 CA LYS A 29 45.334 49.145 15.079 1.00 0.00 C ATOM 451 C LYS A 29 46.533 49.682 15.862 1.00 0.00 C ATOM 452 O LYS A 29 47.051 50.755 15.560 1.00 0.00 O ATOM 453 CB LYS A 29 44.023 49.348 15.836 1.00 0.00 C ATOM 454 CG LYS A 29 42.813 49.231 14.914 1.00 0.00 C ATOM 455 CD LYS A 29 41.494 49.315 15.677 1.00 0.00 C ATOM 456 CE LYS A 29 40.350 49.306 14.667 1.00 0.00 C ATOM 457 NZ LYS A 29 39.034 49.274 15.324 1.00 0.00 N ATOM 0 H LYS A 29 44.837 47.134 15.223 1.00 0.00 H new ATOM 0 HA LYS A 29 45.284 49.718 14.153 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.945 48.609 16.633 1.00 0.00 H new ATOM 0 HB3 LYS A 29 44.025 50.329 16.310 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.850 50.024 14.167 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.859 48.284 14.376 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.399 48.474 16.364 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.461 50.223 16.279 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.418 50.191 14.035 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.450 48.439 14.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.290 49.166 14.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.996 48.472 15.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.885 50.161 15.846 1.00 0.00 H new ATOM 471 N ILE A 30 47.041 48.894 16.806 1.00 0.00 N ATOM 472 CA ILE A 30 48.260 49.176 17.537 1.00 0.00 C ATOM 473 C ILE A 30 49.479 49.144 16.613 1.00 0.00 C ATOM 474 O ILE A 30 50.355 49.997 16.738 1.00 0.00 O ATOM 475 CB ILE A 30 48.375 48.232 18.730 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.288 48.567 19.747 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.753 48.288 19.383 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.098 47.513 20.834 1.00 0.00 C ATOM 0 H ILE A 30 46.599 48.019 17.087 1.00 0.00 H new ATOM 0 HA ILE A 30 48.222 50.190 17.934 1.00 0.00 H new ATOM 0 HB ILE A 30 48.241 47.213 18.366 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.530 49.519 20.219 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.344 48.703 19.220 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.784 47.599 20.227 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.513 48.005 18.655 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.948 49.301 19.735 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.307 47.830 21.514 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.823 46.563 20.376 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.028 47.392 21.390 1.00 0.00 H new ATOM 490 N GLN A 31 49.527 48.239 15.640 1.00 0.00 N ATOM 491 CA GLN A 31 50.565 48.178 14.630 1.00 0.00 C ATOM 492 C GLN A 31 50.612 49.452 13.785 1.00 0.00 C ATOM 493 O GLN A 31 51.706 49.911 13.463 1.00 0.00 O ATOM 494 CB GLN A 31 50.363 46.929 13.777 1.00 0.00 C ATOM 495 CG GLN A 31 51.473 46.653 12.767 1.00 0.00 C ATOM 496 CD GLN A 31 51.178 45.450 11.870 1.00 0.00 C ATOM 497 OE1 GLN A 31 50.092 44.873 11.845 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.154 45.014 11.079 1.00 0.00 N ATOM 0 H GLN A 31 48.822 47.509 15.534 1.00 0.00 H new ATOM 0 HA GLN A 31 51.535 48.111 15.122 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.271 46.067 14.438 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.419 47.022 13.240 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.619 47.536 12.145 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.408 46.481 13.301 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.062 45.479 11.085 1.00 0.00 H new ATOM 0 HE22 GLN A 31 51.995 44.214 10.466 1.00 0.00 H new ATOM 507 N ASP A 32 49.482 50.077 13.467 1.00 0.00 N ATOM 508 CA ASP A 32 49.467 51.362 12.798 1.00 0.00 C ATOM 509 C ASP A 32 49.851 52.504 13.741 1.00 0.00 C ATOM 510 O ASP A 32 50.837 53.189 13.473 1.00 0.00 O ATOM 511 CB ASP A 32 48.131 51.623 12.106 1.00 0.00 C ATOM 512 CG ASP A 32 48.197 52.864 11.211 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.359 53.778 11.362 1.00 0.00 O ATOM 514 OD2 ASP A 32 49.095 52.932 10.345 1.00 0.00 O ATOM 0 H ASP A 32 48.555 49.702 13.668 1.00 0.00 H new ATOM 0 HA ASP A 32 50.230 51.324 12.021 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.854 50.755 11.507 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.351 51.755 12.856 1.00 0.00 H new ATOM 519 N LYS A 33 49.135 52.704 14.844 1.00 0.00 N ATOM 520 CA LYS A 33 49.334 53.822 15.744 1.00 0.00 C ATOM 521 C LYS A 33 50.729 53.849 16.371 1.00 0.00 C ATOM 522 O LYS A 33 51.384 54.888 16.363 1.00 0.00 O ATOM 523 CB LYS A 33 48.246 53.865 16.814 1.00 0.00 C ATOM 524 CG LYS A 33 46.870 54.207 16.251 1.00 0.00 C ATOM 525 CD LYS A 33 45.786 54.536 17.275 1.00 0.00 C ATOM 526 CE LYS A 33 46.050 55.849 18.007 1.00 0.00 C ATOM 527 NZ LYS A 33 44.870 56.379 18.708 1.00 0.00 N ATOM 0 H LYS A 33 48.386 52.077 15.138 1.00 0.00 H new ATOM 0 HA LYS A 33 49.257 54.723 15.136 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.198 52.898 17.314 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.517 54.602 17.570 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.977 55.059 15.579 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.528 53.366 15.648 1.00 0.00 H new ATOM 0 HD2 LYS A 33 44.821 54.593 16.772 1.00 0.00 H new ATOM 0 HD3 LYS A 33 45.720 53.726 18.001 1.00 0.00 H new ATOM 0 HE2 LYS A 33 46.854 55.698 18.728 1.00 0.00 H new ATOM 0 HE3 LYS A 33 46.400 56.591 17.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 45.139 57.224 19.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.139 56.633 18.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.497 55.655 19.355 1.00 0.00 H new ATOM 541 N GLU A 34 51.218 52.713 16.864 1.00 0.00 N ATOM 542 CA GLU A 34 52.445 52.602 17.627 1.00 0.00 C ATOM 543 C GLU A 34 53.599 51.919 16.893 1.00 0.00 C ATOM 544 O GLU A 34 54.712 51.870 17.414 1.00 0.00 O ATOM 545 CB GLU A 34 52.158 51.918 18.961 1.00 0.00 C ATOM 546 CG GLU A 34 51.151 52.660 19.835 1.00 0.00 C ATOM 547 CD GLU A 34 51.620 54.081 20.154 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.643 54.251 20.853 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.033 55.065 19.653 1.00 0.00 O ATOM 0 H GLU A 34 50.749 51.817 16.735 1.00 0.00 H new ATOM 0 HA GLU A 34 52.794 53.621 17.792 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.785 50.912 18.769 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.093 51.812 19.512 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.187 52.700 19.327 1.00 0.00 H new ATOM 0 HG3 GLU A 34 50.999 52.109 20.763 1.00 0.00 H new ATOM 556 N GLY A 35 53.385 51.400 15.687 1.00 0.00 N ATOM 557 CA GLY A 35 54.438 50.844 14.861 1.00 0.00 C ATOM 558 C GLY A 35 55.004 49.497 15.317 1.00 0.00 C ATOM 559 O GLY A 35 56.014 49.062 14.771 1.00 0.00 O ATOM 0 H GLY A 35 52.462 51.356 15.256 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.056 50.731 13.846 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.256 51.563 14.816 1.00 0.00 H new ATOM 563 N ILE A 36 54.385 48.825 16.284 1.00 0.00 N ATOM 564 CA ILE A 36 54.882 47.585 16.847 1.00 0.00 C ATOM 565 C ILE A 36 54.317 46.412 16.045 1.00 0.00 C ATOM 566 O ILE A 36 53.097 46.266 16.004 1.00 0.00 O ATOM 567 CB ILE A 36 54.534 47.472 18.329 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.049 48.640 19.164 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.100 46.182 18.915 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.236 48.843 20.439 1.00 0.00 C ATOM 0 H ILE A 36 53.509 49.137 16.702 1.00 0.00 H new ATOM 0 HA ILE A 36 55.970 47.569 16.780 1.00 0.00 H new ATOM 0 HB ILE A 36 53.445 47.479 18.375 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.093 48.465 19.425 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.019 49.552 18.567 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.842 46.119 19.972 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.679 45.327 18.387 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.184 46.178 18.805 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.642 49.686 20.999 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.197 49.046 20.180 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.288 47.942 21.051 1.00 0.00 H new ATOM 582 N PRO A 37 55.129 45.549 15.440 1.00 0.00 N ATOM 583 CA PRO A 37 54.639 44.404 14.700 1.00 0.00 C ATOM 584 C PRO A 37 54.012 43.361 15.626 1.00 0.00 C ATOM 585 O PRO A 37 54.470 43.225 16.759 1.00 0.00 O ATOM 586 CB PRO A 37 55.844 43.857 13.939 1.00 0.00 C ATOM 587 CG PRO A 37 57.018 44.230 14.840 1.00 0.00 C ATOM 588 CD PRO A 37 56.578 45.563 15.440 1.00 0.00 C ATOM 0 HA PRO A 37 53.840 44.682 14.012 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.774 42.779 13.793 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.935 44.307 12.950 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.191 43.478 15.610 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.945 44.328 14.276 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.966 45.681 16.452 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.959 46.399 14.853 1.00 0.00 H new ATOM 596 N PRO A 38 53.002 42.610 15.197 1.00 0.00 N ATOM 597 CA PRO A 38 52.240 41.729 16.059 1.00 0.00 C ATOM 598 C PRO A 38 53.047 40.731 16.894 1.00 0.00 C ATOM 599 O PRO A 38 52.683 40.492 18.043 1.00 0.00 O ATOM 600 CB PRO A 38 51.263 40.997 15.142 1.00 0.00 C ATOM 601 CG PRO A 38 50.985 42.034 14.056 1.00 0.00 C ATOM 602 CD PRO A 38 52.337 42.724 13.914 1.00 0.00 C ATOM 0 HA PRO A 38 51.757 42.342 16.820 1.00 0.00 H new ATOM 0 HB2 PRO A 38 51.698 40.086 14.731 1.00 0.00 H new ATOM 0 HB3 PRO A 38 50.353 40.707 15.668 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.665 41.570 13.123 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.201 42.732 14.351 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.930 42.255 13.128 1.00 0.00 H new ATOM 0 HD3 PRO A 38 52.210 43.770 13.636 1.00 0.00 H new ATOM 610 N ASP A 39 54.151 40.187 16.391 1.00 0.00 N ATOM 611 CA ASP A 39 54.973 39.245 17.125 1.00 0.00 C ATOM 612 C ASP A 39 55.712 39.847 18.322 1.00 0.00 C ATOM 613 O ASP A 39 56.203 39.106 19.171 1.00 0.00 O ATOM 614 CB ASP A 39 55.937 38.516 16.194 1.00 0.00 C ATOM 615 CG ASP A 39 57.141 39.358 15.763 1.00 0.00 C ATOM 616 OD1 ASP A 39 57.023 40.112 14.773 1.00 0.00 O ATOM 617 OD2 ASP A 39 58.227 39.218 16.364 1.00 0.00 O ATOM 0 H ASP A 39 54.499 40.393 15.454 1.00 0.00 H new ATOM 0 HA ASP A 39 54.275 38.524 17.551 1.00 0.00 H new ATOM 0 HB2 ASP A 39 56.296 37.615 16.692 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.394 38.194 15.305 1.00 0.00 H new ATOM 622 N GLN A 40 55.792 41.170 18.422 1.00 0.00 N ATOM 623 CA GLN A 40 56.371 41.886 19.541 1.00 0.00 C ATOM 624 C GLN A 40 55.327 42.317 20.573 1.00 0.00 C ATOM 625 O GLN A 40 55.694 42.701 21.681 1.00 0.00 O ATOM 626 CB GLN A 40 57.188 43.064 19.017 1.00 0.00 C ATOM 627 CG GLN A 40 58.393 42.631 18.187 1.00 0.00 C ATOM 628 CD GLN A 40 59.191 43.786 17.577 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.022 44.965 17.879 1.00 0.00 O ATOM 630 NE2 GLN A 40 60.109 43.481 16.665 1.00 0.00 N ATOM 0 H GLN A 40 55.440 41.792 17.694 1.00 0.00 H new ATOM 0 HA GLN A 40 57.035 41.207 20.076 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.546 43.703 18.410 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.531 43.665 19.859 1.00 0.00 H new ATOM 0 HG2 GLN A 40 59.058 42.039 18.816 1.00 0.00 H new ATOM 0 HG3 GLN A 40 58.050 41.979 17.384 1.00 0.00 H new ATOM 0 HE21 GLN A 40 60.263 42.508 16.402 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.659 44.220 16.228 1.00 0.00 H new ATOM 639 N GLN A 41 54.036 42.239 20.262 1.00 0.00 N ATOM 640 CA GLN A 41 52.945 42.647 21.124 1.00 0.00 C ATOM 641 C GLN A 41 52.420 41.503 21.995 1.00 0.00 C ATOM 642 O GLN A 41 52.340 40.365 21.538 1.00 0.00 O ATOM 643 CB GLN A 41 51.769 43.168 20.304 1.00 0.00 C ATOM 644 CG GLN A 41 52.034 44.329 19.349 1.00 0.00 C ATOM 645 CD GLN A 41 50.756 44.806 18.656 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.652 44.706 19.185 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.824 45.355 17.446 1.00 0.00 N ATOM 0 H GLN A 41 53.715 41.874 19.365 1.00 0.00 H new ATOM 0 HA GLN A 41 53.355 43.428 21.764 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.371 42.337 19.721 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.986 43.475 20.997 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.478 45.158 19.901 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.761 44.021 18.597 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.726 45.452 16.980 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.974 45.679 16.984 1.00 0.00 H new ATOM 656 N ARG A 42 51.918 41.811 23.187 1.00 0.00 N ATOM 657 CA ARG A 42 50.858 41.086 23.860 1.00 0.00 C ATOM 658 C ARG A 42 49.826 42.057 24.438 1.00 0.00 C ATOM 659 O ARG A 42 50.188 43.162 24.836 1.00 0.00 O ATOM 660 CB ARG A 42 51.383 40.184 24.973 1.00 0.00 C ATOM 661 CG ARG A 42 52.200 39.014 24.432 1.00 0.00 C ATOM 662 CD ARG A 42 52.465 37.971 25.513 1.00 0.00 C ATOM 663 NE ARG A 42 53.375 36.927 25.039 1.00 0.00 N ATOM 664 CZ ARG A 42 53.146 35.996 24.104 1.00 0.00 C ATOM 665 NH1 ARG A 42 51.979 35.863 23.459 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.152 35.165 23.796 1.00 0.00 N ATOM 0 H ARG A 42 52.256 42.606 23.729 1.00 0.00 H new ATOM 0 HA ARG A 42 50.389 40.451 23.108 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.000 40.771 25.653 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.544 39.801 25.554 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.668 38.551 23.601 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.148 39.381 24.039 1.00 0.00 H new ATOM 0 HD2 ARG A 42 52.892 38.456 26.391 1.00 0.00 H new ATOM 0 HD3 ARG A 42 51.523 37.520 25.824 1.00 0.00 H new ATOM 0 HE ARG A 42 54.297 36.906 25.475 1.00 0.00 H new ATOM 0 HH11 ARG A 42 51.204 36.492 23.671 1.00 0.00 H new ATOM 0 HH12 ARG A 42 51.865 35.133 22.756 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.051 35.256 24.269 1.00 0.00 H new ATOM 0 HH22 ARG A 42 54.018 34.442 23.089 1.00 0.00 H new ATOM 680 N LEU A 43 48.568 41.634 24.517 1.00 0.00 N ATOM 681 CA LEU A 43 47.469 42.412 25.052 1.00 0.00 C ATOM 682 C LEU A 43 46.867 41.705 26.269 1.00 0.00 C ATOM 683 O LEU A 43 46.350 40.598 26.150 1.00 0.00 O ATOM 684 CB LEU A 43 46.436 42.655 23.956 1.00 0.00 C ATOM 685 CG LEU A 43 46.957 43.297 22.673 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.808 43.449 21.681 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.562 44.681 22.892 1.00 0.00 C ATOM 0 H LEU A 43 48.282 40.708 24.198 1.00 0.00 H new ATOM 0 HA LEU A 43 47.830 43.383 25.391 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.976 41.700 23.700 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.648 43.289 24.362 1.00 0.00 H new ATOM 0 HG LEU A 43 47.741 42.639 22.298 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.178 43.907 20.764 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.391 42.468 21.454 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.033 44.081 22.116 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.913 45.080 21.940 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.806 45.347 23.308 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.400 44.606 23.585 1.00 0.00 H new ATOM 699 N ILE A 44 46.938 42.350 27.430 1.00 0.00 N ATOM 700 CA ILE A 44 46.503 41.812 28.703 1.00 0.00 C ATOM 701 C ILE A 44 45.365 42.662 29.272 1.00 0.00 C ATOM 702 O ILE A 44 45.549 43.841 29.567 1.00 0.00 O ATOM 703 CB ILE A 44 47.645 41.670 29.706 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.892 41.049 29.083 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.178 40.852 30.906 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.027 40.761 30.060 1.00 0.00 C ATOM 0 H ILE A 44 47.314 43.295 27.506 1.00 0.00 H new ATOM 0 HA ILE A 44 46.134 40.803 28.521 1.00 0.00 H new ATOM 0 HB ILE A 44 47.924 42.671 30.034 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.609 40.117 28.593 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.263 41.718 28.306 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.996 40.753 31.619 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.338 41.355 31.385 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.866 39.862 30.572 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.867 40.321 29.522 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.345 41.690 30.533 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.681 40.065 30.824 1.00 0.00 H new ATOM 718 N PHE A 45 44.204 42.045 29.467 1.00 0.00 N ATOM 719 CA PHE A 45 43.032 42.641 30.078 1.00 0.00 C ATOM 720 C PHE A 45 42.617 41.824 31.302 1.00 0.00 C ATOM 721 O PHE A 45 42.595 40.597 31.228 1.00 0.00 O ATOM 722 CB PHE A 45 41.912 42.734 29.046 1.00 0.00 C ATOM 723 CG PHE A 45 40.556 43.048 29.631 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.245 44.351 30.038 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.626 42.022 29.836 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.011 44.630 30.638 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.389 42.296 30.431 1.00 0.00 C ATOM 728 CZ PHE A 45 38.083 43.601 30.837 1.00 0.00 C ATOM 0 H PHE A 45 44.053 41.075 29.190 1.00 0.00 H new ATOM 0 HA PHE A 45 43.257 43.652 30.418 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.168 43.503 28.317 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.852 41.790 28.505 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.961 45.146 29.888 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.864 41.013 29.533 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.775 45.638 30.947 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.671 41.502 30.577 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.132 43.813 31.303 1.00 0.00 H new ATOM 738 N ALA A 46 42.281 42.477 32.411 1.00 0.00 N ATOM 739 CA ALA A 46 41.845 41.851 33.643 1.00 0.00 C ATOM 740 C ALA A 46 42.722 40.675 34.075 1.00 0.00 C ATOM 741 O ALA A 46 42.229 39.614 34.454 1.00 0.00 O ATOM 742 CB ALA A 46 40.354 41.544 33.539 1.00 0.00 C ATOM 0 H ALA A 46 42.308 43.495 32.472 1.00 0.00 H new ATOM 0 HA ALA A 46 41.979 42.550 34.469 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.014 41.072 34.461 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.802 42.470 33.381 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.179 40.870 32.701 1.00 0.00 H new ATOM 748 N GLY A 47 44.038 40.829 33.959 1.00 0.00 N ATOM 749 CA GLY A 47 45.035 39.848 34.337 1.00 0.00 C ATOM 750 C GLY A 47 45.173 38.623 33.432 1.00 0.00 C ATOM 751 O GLY A 47 45.846 37.674 33.833 1.00 0.00 O ATOM 0 H GLY A 47 44.451 41.682 33.581 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.003 40.347 34.383 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.806 39.502 35.345 1.00 0.00 H new ATOM 755 N LYS A 48 44.571 38.598 32.247 1.00 0.00 N ATOM 756 CA LYS A 48 44.566 37.481 31.324 1.00 0.00 C ATOM 757 C LYS A 48 44.961 37.902 29.907 1.00 0.00 C ATOM 758 O LYS A 48 44.657 39.009 29.469 1.00 0.00 O ATOM 759 CB LYS A 48 43.192 36.816 31.331 1.00 0.00 C ATOM 760 CG LYS A 48 42.826 36.098 32.626 1.00 0.00 C ATOM 761 CD LYS A 48 43.476 34.728 32.799 1.00 0.00 C ATOM 762 CE LYS A 48 42.817 33.677 31.910 1.00 0.00 C ATOM 763 NZ LYS A 48 43.222 32.311 32.277 1.00 0.00 N ATOM 0 H LYS A 48 44.049 39.399 31.892 1.00 0.00 H new ATOM 0 HA LYS A 48 45.316 36.764 31.658 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.437 37.576 31.129 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.149 36.099 30.512 1.00 0.00 H new ATOM 0 HG2 LYS A 48 43.110 36.729 33.468 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.743 35.980 32.667 1.00 0.00 H new ATOM 0 HD2 LYS A 48 44.537 34.795 32.559 1.00 0.00 H new ATOM 0 HD3 LYS A 48 43.404 34.420 33.842 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.733 33.766 31.986 1.00 0.00 H new ATOM 0 HE3 LYS A 48 43.081 33.866 30.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 42.752 31.629 31.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 44.253 32.217 32.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 42.948 32.120 33.262 1.00 0.00 H new ATOM 777 N GLN A 49 45.611 37.000 29.176 1.00 0.00 N ATOM 778 CA GLN A 49 46.036 37.188 27.804 1.00 0.00 C ATOM 779 C GLN A 49 44.864 37.105 26.825 1.00 0.00 C ATOM 780 O GLN A 49 43.964 36.287 27.000 1.00 0.00 O ATOM 781 CB GLN A 49 47.076 36.130 27.447 1.00 0.00 C ATOM 782 CG GLN A 49 48.393 36.239 28.209 1.00 0.00 C ATOM 783 CD GLN A 49 49.262 37.423 27.780 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.098 38.013 26.714 1.00 0.00 O ATOM 785 NE2 GLN A 49 50.250 37.803 28.585 1.00 0.00 N ATOM 0 H GLN A 49 45.863 36.083 29.544 1.00 0.00 H new ATOM 0 HA GLN A 49 46.466 38.186 27.721 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.648 35.145 27.630 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.285 36.193 26.379 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.179 36.325 29.274 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.958 35.317 28.071 1.00 0.00 H new ATOM 0 HE21 GLN A 49 50.398 37.323 29.473 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.860 38.575 28.315 1.00 0.00 H new ATOM 794 N LEU A 50 44.898 37.919 25.774 1.00 0.00 N ATOM 795 CA LEU A 50 43.931 37.925 24.694 1.00 0.00 C ATOM 796 C LEU A 50 44.481 37.178 23.478 1.00 0.00 C ATOM 797 O LEU A 50 45.614 37.417 23.066 1.00 0.00 O ATOM 798 CB LEU A 50 43.565 39.371 24.372 1.00 0.00 C ATOM 799 CG LEU A 50 42.941 40.161 25.519 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.852 41.645 25.176 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.523 39.690 25.830 1.00 0.00 C ATOM 0 H LEU A 50 45.631 38.618 25.652 1.00 0.00 H new ATOM 0 HA LEU A 50 43.024 37.401 24.995 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.465 39.891 24.043 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.870 39.373 23.532 1.00 0.00 H new ATOM 0 HG LEU A 50 43.587 39.998 26.382 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.404 42.185 26.010 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.852 42.035 24.987 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.237 41.776 24.286 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.116 40.279 26.652 1.00 0.00 H new ATOM 0 HD22 LEU A 50 40.896 39.817 24.948 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.543 38.637 26.112 1.00 0.00 H new ATOM 813 N GLU A 51 43.693 36.278 22.898 1.00 0.00 N ATOM 814 CA GLU A 51 44.075 35.395 21.814 1.00 0.00 C ATOM 815 C GLU A 51 43.543 35.845 20.452 1.00 0.00 C ATOM 816 O GLU A 51 42.390 36.249 20.319 1.00 0.00 O ATOM 817 CB GLU A 51 43.654 33.968 22.151 1.00 0.00 C ATOM 818 CG GLU A 51 44.077 32.901 21.145 1.00 0.00 C ATOM 819 CD GLU A 51 45.584 32.894 20.882 1.00 0.00 C ATOM 820 OE1 GLU A 51 46.001 33.366 19.801 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.370 32.457 21.749 1.00 0.00 O ATOM 0 H GLU A 51 42.725 36.142 23.189 1.00 0.00 H new ATOM 0 HA GLU A 51 45.160 35.434 21.718 1.00 0.00 H new ATOM 0 HB2 GLU A 51 44.067 33.707 23.126 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.569 33.941 22.247 1.00 0.00 H new ATOM 0 HG2 GLU A 51 43.773 31.921 21.513 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.550 33.066 20.205 1.00 0.00 H new ATOM 828 N ASP A 52 44.360 35.707 19.411 1.00 0.00 N ATOM 829 CA ASP A 52 44.130 36.220 18.076 1.00 0.00 C ATOM 830 C ASP A 52 42.914 35.637 17.354 1.00 0.00 C ATOM 831 O ASP A 52 42.438 36.213 16.379 1.00 0.00 O ATOM 832 CB ASP A 52 45.364 35.947 17.221 1.00 0.00 C ATOM 833 CG ASP A 52 46.548 36.855 17.561 1.00 0.00 C ATOM 834 OD1 ASP A 52 46.399 38.095 17.521 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.668 36.342 17.779 1.00 0.00 O ATOM 0 H ASP A 52 45.246 35.207 19.487 1.00 0.00 H new ATOM 0 HA ASP A 52 43.929 37.284 18.205 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.664 34.907 17.350 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.105 36.077 16.170 1.00 0.00 H new ATOM 840 N GLY A 53 42.411 34.491 17.804 1.00 0.00 N ATOM 841 CA GLY A 53 41.242 33.838 17.249 1.00 0.00 C ATOM 842 C GLY A 53 39.900 34.420 17.699 1.00 0.00 C ATOM 843 O GLY A 53 38.884 34.057 17.110 1.00 0.00 O ATOM 0 H GLY A 53 42.821 33.981 18.587 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.297 33.891 16.162 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.272 32.782 17.519 1.00 0.00 H new ATOM 847 N ARG A 54 39.864 35.284 18.708 1.00 0.00 N ATOM 848 CA ARG A 54 38.655 35.743 19.365 1.00 0.00 C ATOM 849 C ARG A 54 38.361 37.230 19.153 1.00 0.00 C ATOM 850 O ARG A 54 39.133 37.949 18.521 1.00 0.00 O ATOM 851 CB ARG A 54 38.717 35.393 20.848 1.00 0.00 C ATOM 852 CG ARG A 54 38.945 33.926 21.204 1.00 0.00 C ATOM 853 CD ARG A 54 38.109 32.901 20.441 1.00 0.00 C ATOM 854 NE ARG A 54 36.665 33.117 20.523 1.00 0.00 N ATOM 855 CZ ARG A 54 35.740 32.172 20.314 1.00 0.00 C ATOM 856 NH1 ARG A 54 36.072 30.929 19.936 1.00 0.00 N ATOM 857 NH2 ARG A 54 34.433 32.431 20.462 1.00 0.00 N ATOM 0 H ARG A 54 40.710 35.696 19.102 1.00 0.00 H new ATOM 0 HA ARG A 54 37.819 35.222 18.898 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.516 35.980 21.302 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.784 35.713 21.311 1.00 0.00 H new ATOM 0 HG2 ARG A 54 39.998 33.696 21.042 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.751 33.799 22.269 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.407 32.915 19.393 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.338 31.906 20.824 1.00 0.00 H new ATOM 0 HE ARG A 54 36.339 34.055 20.756 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.052 30.682 19.800 1.00 0.00 H new ATOM 0 HH12 ARG A 54 35.344 30.231 19.784 1.00 0.00 H new ATOM 0 HH21 ARG A 54 34.126 33.363 20.739 1.00 0.00 H new ATOM 0 HH22 ARG A 54 33.746 31.696 20.297 1.00 0.00 H new ATOM 871 N THR A 55 37.240 37.686 19.702 1.00 0.00 N ATOM 872 CA THR A 55 36.751 39.049 19.673 1.00 0.00 C ATOM 873 C THR A 55 36.702 39.707 21.053 1.00 0.00 C ATOM 874 O THR A 55 36.767 39.021 22.071 1.00 0.00 O ATOM 875 CB THR A 55 35.351 39.124 19.070 1.00 0.00 C ATOM 876 OG1 THR A 55 34.437 38.437 19.896 1.00 0.00 O ATOM 877 CG2 THR A 55 35.263 38.547 17.659 1.00 0.00 C ATOM 0 H THR A 55 36.611 37.066 20.212 1.00 0.00 H new ATOM 0 HA THR A 55 37.468 39.590 19.055 1.00 0.00 H new ATOM 0 HB THR A 55 35.105 40.184 19.004 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.727 37.507 20.002 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.240 38.634 17.294 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.932 39.098 16.998 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.554 37.497 17.677 1.00 0.00 H new ATOM 885 N LEU A 56 36.509 41.022 21.107 1.00 0.00 N ATOM 886 CA LEU A 56 36.258 41.728 22.347 1.00 0.00 C ATOM 887 C LEU A 56 35.036 41.185 23.089 1.00 0.00 C ATOM 888 O LEU A 56 35.065 41.092 24.314 1.00 0.00 O ATOM 889 CB LEU A 56 36.064 43.221 22.096 1.00 0.00 C ATOM 890 CG LEU A 56 37.331 44.034 21.843 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.907 43.798 20.450 1.00 0.00 C ATOM 892 CD2 LEU A 56 37.018 45.524 21.952 1.00 0.00 C ATOM 0 H LEU A 56 36.524 41.625 20.285 1.00 0.00 H new ATOM 0 HA LEU A 56 37.137 41.569 22.972 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.403 43.341 21.237 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.549 43.649 22.956 1.00 0.00 H new ATOM 0 HG LEU A 56 38.058 43.715 22.590 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.807 44.400 20.322 1.00 0.00 H new ATOM 0 HD12 LEU A 56 38.156 42.743 20.333 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.170 44.082 19.699 1.00 0.00 H new ATOM 0 HD21 LEU A 56 37.925 46.101 21.771 1.00 0.00 H new ATOM 0 HD22 LEU A 56 36.264 45.792 21.212 1.00 0.00 H new ATOM 0 HD23 LEU A 56 36.641 45.745 22.951 1.00 0.00 H new ATOM 904 N SER A 57 33.984 40.799 22.371 1.00 0.00 N ATOM 905 CA SER A 57 32.769 40.245 22.930 1.00 0.00 C ATOM 906 C SER A 57 32.966 38.885 23.603 1.00 0.00 C ATOM 907 O SER A 57 32.369 38.636 24.647 1.00 0.00 O ATOM 908 CB SER A 57 31.670 40.172 21.873 1.00 0.00 C ATOM 909 OG SER A 57 31.929 39.255 20.833 1.00 0.00 O ATOM 0 H SER A 57 33.960 40.868 21.354 1.00 0.00 H new ATOM 0 HA SER A 57 32.462 40.930 23.720 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.733 39.899 22.358 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.529 41.163 21.442 1.00 0.00 H new ATOM 0 HG SER A 57 32.897 39.145 20.727 1.00 0.00 H new ATOM 915 N ASP A 58 33.860 38.035 23.105 1.00 0.00 N ATOM 916 CA ASP A 58 34.200 36.788 23.762 1.00 0.00 C ATOM 917 C ASP A 58 34.801 37.015 25.151 1.00 0.00 C ATOM 918 O ASP A 58 34.561 36.237 26.069 1.00 0.00 O ATOM 919 CB ASP A 58 35.199 35.999 22.920 1.00 0.00 C ATOM 920 CG ASP A 58 34.597 35.528 21.594 1.00 0.00 C ATOM 921 OD1 ASP A 58 35.182 35.810 20.526 1.00 0.00 O ATOM 922 OD2 ASP A 58 33.569 34.817 21.616 1.00 0.00 O ATOM 0 H ASP A 58 34.366 38.196 22.234 1.00 0.00 H new ATOM 0 HA ASP A 58 33.272 36.227 23.873 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.072 36.620 22.720 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.546 35.135 23.487 1.00 0.00 H new ATOM 927 N TYR A 59 35.535 38.112 25.314 1.00 0.00 N ATOM 928 CA TYR A 59 36.125 38.541 26.567 1.00 0.00 C ATOM 929 C TYR A 59 35.259 39.527 27.355 1.00 0.00 C ATOM 930 O TYR A 59 35.683 39.957 28.425 1.00 0.00 O ATOM 931 CB TYR A 59 37.534 39.053 26.285 1.00 0.00 C ATOM 932 CG TYR A 59 38.443 38.017 25.668 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.778 36.872 26.401 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.949 38.193 24.375 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.628 35.905 25.850 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.833 37.255 23.828 1.00 0.00 C ATOM 937 CZ TYR A 59 40.171 36.102 24.565 1.00 0.00 C ATOM 938 OH TYR A 59 41.022 35.179 24.033 1.00 0.00 O ATOM 0 H TYR A 59 35.740 38.748 24.543 1.00 0.00 H new ATOM 0 HA TYR A 59 36.186 37.683 27.237 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.472 39.913 25.618 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.977 39.404 27.217 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.379 36.734 27.395 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.656 39.057 23.796 1.00 0.00 H new ATOM 0 HE1 TYR A 59 39.866 35.012 26.408 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.254 37.414 22.846 1.00 0.00 H new ATOM 0 HH TYR A 59 40.933 35.177 23.057 1.00 0.00 H new ATOM 948 N ASN A 60 34.049 39.839 26.903 1.00 0.00 N ATOM 949 CA ASN A 60 33.108 40.712 27.576 1.00 0.00 C ATOM 950 C ASN A 60 33.665 42.105 27.875 1.00 0.00 C ATOM 951 O ASN A 60 33.290 42.731 28.863 1.00 0.00 O ATOM 952 CB ASN A 60 32.523 39.944 28.758 1.00 0.00 C ATOM 953 CG ASN A 60 31.295 40.595 29.397 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.336 41.061 30.534 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.158 40.625 28.710 1.00 0.00 N ATOM 0 H ASN A 60 33.688 39.473 26.022 1.00 0.00 H new ATOM 0 HA ASN A 60 32.282 40.968 26.913 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.254 38.941 28.425 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.295 39.831 29.519 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.321 41.034 29.126 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.122 40.239 27.767 1.00 0.00 H new ATOM 962 N ILE A 61 34.561 42.612 27.033 1.00 0.00 N ATOM 963 CA ILE A 61 35.261 43.868 27.213 1.00 0.00 C ATOM 964 C ILE A 61 34.319 45.023 26.866 1.00 0.00 C ATOM 965 O ILE A 61 34.006 45.240 25.697 1.00 0.00 O ATOM 966 CB ILE A 61 36.538 43.907 26.379 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.498 42.788 26.775 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.252 45.249 26.512 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.713 42.640 25.865 1.00 0.00 C ATOM 0 H ILE A 61 34.826 42.134 26.172 1.00 0.00 H new ATOM 0 HA ILE A 61 35.565 43.968 28.255 1.00 0.00 H new ATOM 0 HB ILE A 61 36.236 43.766 25.341 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.843 42.967 27.793 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.951 41.845 26.785 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.157 45.241 25.905 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.593 46.047 26.171 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.517 45.418 27.556 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.338 41.822 26.223 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.382 42.427 24.849 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.288 43.566 25.873 1.00 0.00 H new ATOM 981 N GLN A 62 33.856 45.758 27.872 1.00 0.00 N ATOM 982 CA GLN A 62 32.924 46.856 27.715 1.00 0.00 C ATOM 983 C GLN A 62 33.606 48.157 27.282 1.00 0.00 C ATOM 984 O GLN A 62 34.829 48.275 27.310 1.00 0.00 O ATOM 985 CB GLN A 62 32.146 47.059 29.012 1.00 0.00 C ATOM 986 CG GLN A 62 31.462 45.810 29.562 1.00 0.00 C ATOM 987 CD GLN A 62 30.494 45.145 28.581 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.631 45.775 27.973 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.611 43.837 28.375 1.00 0.00 N ATOM 0 H GLN A 62 34.129 45.598 28.842 1.00 0.00 H new ATOM 0 HA GLN A 62 32.236 46.589 26.912 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.828 47.444 29.770 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.389 47.825 28.847 1.00 0.00 H new ATOM 0 HG2 GLN A 62 32.226 45.087 29.849 1.00 0.00 H new ATOM 0 HG3 GLN A 62 30.918 46.076 30.469 1.00 0.00 H new ATOM 0 HE21 GLN A 62 31.323 43.304 28.874 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.988 43.366 27.718 1.00 0.00 H new ATOM 998 N LYS A 63 32.821 49.173 26.937 1.00 0.00 N ATOM 999 CA LYS A 63 33.289 50.527 26.721 1.00 0.00 C ATOM 1000 C LYS A 63 34.044 51.097 27.924 1.00 0.00 C ATOM 1001 O LYS A 63 33.724 50.765 29.063 1.00 0.00 O ATOM 1002 CB LYS A 63 32.127 51.416 26.289 1.00 0.00 C ATOM 1003 CG LYS A 63 31.233 52.014 27.370 1.00 0.00 C ATOM 1004 CD LYS A 63 30.375 51.032 28.165 1.00 0.00 C ATOM 1005 CE LYS A 63 29.701 51.710 29.354 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.797 52.801 28.960 1.00 0.00 N ATOM 0 H LYS A 63 31.816 49.069 26.798 1.00 0.00 H new ATOM 0 HA LYS A 63 34.021 50.501 25.914 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.538 52.239 25.704 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.494 50.834 25.619 1.00 0.00 H new ATOM 0 HG2 LYS A 63 31.864 52.561 28.071 1.00 0.00 H new ATOM 0 HG3 LYS A 63 30.572 52.743 26.901 1.00 0.00 H new ATOM 0 HD2 LYS A 63 29.616 50.601 27.513 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.996 50.209 28.519 1.00 0.00 H new ATOM 0 HE2 LYS A 63 29.138 50.966 29.918 1.00 0.00 H new ATOM 0 HE3 LYS A 63 30.467 52.104 30.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.331 53.188 29.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.343 53.552 28.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 28.077 52.436 28.305 1.00 0.00 H new ATOM 1020 N GLU A 64 35.025 51.964 27.686 1.00 0.00 N ATOM 1021 CA GLU A 64 35.922 52.505 28.687 1.00 0.00 C ATOM 1022 C GLU A 64 36.671 51.458 29.514 1.00 0.00 C ATOM 1023 O GLU A 64 37.023 51.687 30.669 1.00 0.00 O ATOM 1024 CB GLU A 64 35.255 53.591 29.526 1.00 0.00 C ATOM 1025 CG GLU A 64 34.970 54.881 28.763 1.00 0.00 C ATOM 1026 CD GLU A 64 33.559 54.953 28.178 1.00 0.00 C ATOM 1027 OE1 GLU A 64 32.586 54.904 28.961 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.413 55.175 26.956 1.00 0.00 O ATOM 0 H GLU A 64 35.219 52.319 26.750 1.00 0.00 H new ATOM 0 HA GLU A 64 36.719 52.992 28.125 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.318 53.203 29.925 1.00 0.00 H new ATOM 0 HB3 GLU A 64 35.894 53.820 30.379 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.120 55.728 29.432 1.00 0.00 H new ATOM 0 HG3 GLU A 64 35.694 54.981 27.954 1.00 0.00 H new ATOM 1035 N SER A 65 36.951 50.304 28.913 1.00 0.00 N ATOM 1036 CA SER A 65 37.888 49.342 29.459 1.00 0.00 C ATOM 1037 C SER A 65 39.338 49.790 29.271 1.00 0.00 C ATOM 1038 O SER A 65 39.700 50.323 28.224 1.00 0.00 O ATOM 1039 CB SER A 65 37.721 47.957 28.840 1.00 0.00 C ATOM 1040 OG SER A 65 36.462 47.417 29.172 1.00 0.00 O ATOM 0 H SER A 65 36.529 50.014 28.030 1.00 0.00 H new ATOM 0 HA SER A 65 37.662 49.284 30.524 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.821 48.022 27.757 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.512 47.296 29.194 1.00 0.00 H new ATOM 0 HG SER A 65 35.859 47.496 28.403 1.00 0.00 H new ATOM 1046 N THR A 66 40.181 49.490 30.255 1.00 0.00 N ATOM 1047 CA THR A 66 41.620 49.657 30.219 1.00 0.00 C ATOM 1048 C THR A 66 42.308 48.298 30.077 1.00 0.00 C ATOM 1049 O THR A 66 41.942 47.351 30.769 1.00 0.00 O ATOM 1050 CB THR A 66 42.109 50.373 31.476 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.523 51.653 31.559 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.620 50.583 31.502 1.00 0.00 C ATOM 0 H THR A 66 39.856 49.105 31.142 1.00 0.00 H new ATOM 0 HA THR A 66 41.875 50.269 29.354 1.00 0.00 H new ATOM 0 HB THR A 66 41.825 49.730 32.309 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.840 52.106 32.368 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.900 51.097 32.422 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.122 49.617 31.459 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.918 51.186 30.644 1.00 0.00 H new ATOM 1060 N LEU A 67 43.324 48.201 29.224 1.00 0.00 N ATOM 1061 CA LEU A 67 44.176 47.039 29.071 1.00 0.00 C ATOM 1062 C LEU A 67 45.649 47.432 28.930 1.00 0.00 C ATOM 1063 O LEU A 67 45.964 48.576 28.609 1.00 0.00 O ATOM 1064 CB LEU A 67 43.637 46.150 27.955 1.00 0.00 C ATOM 1065 CG LEU A 67 43.732 46.655 26.517 1.00 0.00 C ATOM 1066 CD1 LEU A 67 45.112 46.458 25.896 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.760 45.864 25.646 1.00 0.00 C ATOM 0 H LEU A 67 43.582 48.964 28.598 1.00 0.00 H new ATOM 0 HA LEU A 67 44.150 46.437 29.979 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.161 45.196 28.008 1.00 0.00 H new ATOM 0 HB3 LEU A 67 42.587 45.949 28.168 1.00 0.00 H new ATOM 0 HG LEU A 67 43.508 47.721 26.556 1.00 0.00 H new ATOM 0 HD11 LEU A 67 45.109 46.839 24.875 1.00 0.00 H new ATOM 0 HD12 LEU A 67 45.855 46.998 26.482 1.00 0.00 H new ATOM 0 HD13 LEU A 67 45.359 45.396 25.887 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.822 46.219 24.617 1.00 0.00 H new ATOM 0 HD22 LEU A 67 43.019 44.806 25.681 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.744 46.002 26.017 1.00 0.00 H new ATOM 1079 N HIS A 68 46.564 46.494 29.154 1.00 0.00 N ATOM 1080 CA HIS A 68 47.987 46.686 28.966 1.00 0.00 C ATOM 1081 C HIS A 68 48.441 46.179 27.596 1.00 0.00 C ATOM 1082 O HIS A 68 48.142 45.046 27.225 1.00 0.00 O ATOM 1083 CB HIS A 68 48.785 45.991 30.066 1.00 0.00 C ATOM 1084 CG HIS A 68 48.351 46.320 31.468 1.00 0.00 C ATOM 1085 ND1 HIS A 68 47.775 45.417 32.360 1.00 0.00 N ATOM 1086 CD2 HIS A 68 48.483 47.533 32.094 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.547 46.099 33.484 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.956 47.372 33.360 1.00 0.00 N ATOM 0 H HIS A 68 46.324 45.558 29.479 1.00 0.00 H new ATOM 0 HA HIS A 68 48.177 47.758 29.019 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.712 44.913 29.922 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.836 46.257 29.955 1.00 0.00 H new ATOM 0 HD2 HIS A 68 48.913 48.433 31.680 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.095 45.684 34.373 1.00 0.00 H new ATOM 0 HE2 HIS A 68 47.889 48.095 34.077 1.00 0.00 H new ATOM 1096 N LEU A 69 49.226 46.990 26.892 1.00 0.00 N ATOM 1097 CA LEU A 69 50.064 46.564 25.791 1.00 0.00 C ATOM 1098 C LEU A 69 51.452 46.251 26.356 1.00 0.00 C ATOM 1099 O LEU A 69 52.153 47.135 26.843 1.00 0.00 O ATOM 1100 CB LEU A 69 50.079 47.652 24.722 1.00 0.00 C ATOM 1101 CG LEU A 69 51.162 47.549 23.652 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.052 46.276 22.818 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.038 48.757 22.728 1.00 0.00 C ATOM 0 H LEU A 69 49.294 47.990 27.083 1.00 0.00 H new ATOM 0 HA LEU A 69 49.685 45.662 25.310 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.109 47.653 24.225 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.183 48.616 25.220 1.00 0.00 H new ATOM 0 HG LEU A 69 52.128 47.521 24.157 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.848 46.259 22.074 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.144 45.406 23.468 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.085 46.253 22.315 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.804 48.703 21.954 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.052 48.760 22.263 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.169 49.672 23.306 1.00 0.00 H new ATOM 1115 N VAL A 70 51.835 44.978 26.312 1.00 0.00 N ATOM 1116 CA VAL A 70 53.113 44.479 26.778 1.00 0.00 C ATOM 1117 C VAL A 70 54.014 44.223 25.567 1.00 0.00 C ATOM 1118 O VAL A 70 53.581 43.590 24.607 1.00 0.00 O ATOM 1119 CB VAL A 70 52.914 43.229 27.629 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.236 42.644 28.119 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.038 43.530 28.842 1.00 0.00 C ATOM 0 H VAL A 70 51.237 44.243 25.935 1.00 0.00 H new ATOM 0 HA VAL A 70 53.600 45.217 27.415 1.00 0.00 H new ATOM 0 HB VAL A 70 52.426 42.497 26.985 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.040 41.756 28.720 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.854 42.374 27.263 1.00 0.00 H new ATOM 0 HG13 VAL A 70 54.759 43.384 28.725 1.00 0.00 H new ATOM 0 HG21 VAL A 70 51.911 42.623 29.433 1.00 0.00 H new ATOM 0 HG22 VAL A 70 52.514 44.297 29.453 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.063 43.885 28.508 1.00 0.00 H new