USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 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 6 LYS NZ :NH3+ 171:sc= 0.997 (180deg=0) USER MOD Set 1.2: A 12 THR OG1 : rot 140:sc= 0.858 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 178:sc= 2.28 (180deg=2.24) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 11 LYS NZ :NH3+ -179:sc= 1.23 (180deg=1.23) USER MOD Single : A 14 THR OG1 : rot -57:sc= 0.0797 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.477 USER MOD Single : A 25 ASN : amide:sc= 0.683 K(o=0.68,f=-0.23) USER MOD Single : A 27 LYS NZ :NH3+ -151:sc= 1.35 (180deg=0.932!) USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0162) USER MOD Single : A 31 GLN : amide:sc=-0.00587 X(o=-0.0059,f=-0.43) USER MOD Single : A 33 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0344) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 41 GLN : amide:sc= 0.97 K(o=0.97,f=-1.9) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.0523 X(o=-0.052,f=0) USER MOD Single : A 55 THR OG1 : rot -57:sc= 1.22 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.243 USER MOD Single : A 60 ASN : amide:sc= -0.0504 K(o=-0.05,f=-0.58) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 87:sc= 1.18 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) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.554 52.195 20.180 1.00 0.00 N ATOM 2 CA MET A 1 32.872 52.302 21.612 1.00 0.00 C ATOM 3 C MET A 1 34.376 52.510 21.804 1.00 0.00 C ATOM 4 O MET A 1 35.157 51.947 21.040 1.00 0.00 O ATOM 5 CB MET A 1 32.365 51.082 22.377 1.00 0.00 C ATOM 6 CG MET A 1 32.512 51.234 23.888 1.00 0.00 C ATOM 7 SD MET A 1 31.813 52.745 24.596 1.00 0.00 S ATOM 8 CE MET A 1 30.044 52.452 24.342 1.00 0.00 C ATOM 0 H1 MET A 1 31.536 52.020 20.063 1.00 0.00 H new ATOM 0 H2 MET A 1 32.811 53.081 19.700 1.00 0.00 H new ATOM 0 H3 MET A 1 33.091 51.408 19.763 1.00 0.00 H new ATOM 0 HA MET A 1 32.359 53.172 22.022 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.316 50.915 22.133 1.00 0.00 H new ATOM 0 HB3 MET A 1 32.913 50.199 22.049 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.040 50.377 24.369 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.572 51.195 24.137 1.00 0.00 H new ATOM 0 HE1 MET A 1 29.476 53.298 24.728 1.00 0.00 H new ATOM 0 HE2 MET A 1 29.844 52.336 23.277 1.00 0.00 H new ATOM 0 HE3 MET A 1 29.746 51.545 24.868 1.00 0.00 H new ATOM 20 N GLN A 2 34.783 53.267 22.819 1.00 0.00 N ATOM 21 CA GLN A 2 36.178 53.443 23.168 1.00 0.00 C ATOM 22 C GLN A 2 36.682 52.353 24.116 1.00 0.00 C ATOM 23 O GLN A 2 36.012 51.997 25.083 1.00 0.00 O ATOM 24 CB GLN A 2 36.438 54.820 23.773 1.00 0.00 C ATOM 25 CG GLN A 2 36.390 55.925 22.722 1.00 0.00 C ATOM 26 CD GLN A 2 36.751 57.312 23.256 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.032 57.539 24.430 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.721 58.319 22.387 1.00 0.00 N ATOM 0 H GLN A 2 34.142 53.779 23.425 1.00 0.00 H new ATOM 0 HA GLN A 2 36.736 53.361 22.235 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.696 55.022 24.546 1.00 0.00 H new ATOM 0 HB3 GLN A 2 37.414 54.824 24.259 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.073 55.671 21.912 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.388 55.962 22.295 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.489 58.142 21.410 1.00 0.00 H new ATOM 0 HE22 GLN A 2 36.930 59.268 22.698 1.00 0.00 H new ATOM 37 N ILE A 3 37.915 51.914 23.876 1.00 0.00 N ATOM 38 CA ILE A 3 38.774 51.230 24.823 1.00 0.00 C ATOM 39 C ILE A 3 40.139 51.921 24.866 1.00 0.00 C ATOM 40 O ILE A 3 40.472 52.689 23.967 1.00 0.00 O ATOM 41 CB ILE A 3 38.896 49.740 24.524 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.545 49.463 23.170 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.538 49.059 24.672 1.00 0.00 C ATOM 44 CD1 ILE A 3 39.799 47.992 22.857 1.00 0.00 C ATOM 0 H ILE A 3 38.360 52.035 22.966 1.00 0.00 H new ATOM 0 HA ILE A 3 38.318 51.295 25.811 1.00 0.00 H new ATOM 0 HB ILE A 3 39.572 49.306 25.261 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.909 49.879 22.389 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.495 49.996 23.125 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.639 47.995 24.456 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.175 49.189 25.691 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.829 49.505 23.975 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.262 47.904 21.874 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.464 47.569 23.610 1.00 0.00 H new ATOM 0 HD13 ILE A 3 38.853 47.450 22.863 1.00 0.00 H new ATOM 56 N PHE A 4 40.948 51.633 25.881 1.00 0.00 N ATOM 57 CA PHE A 4 42.254 52.230 26.068 1.00 0.00 C ATOM 58 C PHE A 4 43.356 51.178 26.203 1.00 0.00 C ATOM 59 O PHE A 4 43.117 50.098 26.741 1.00 0.00 O ATOM 60 CB PHE A 4 42.243 53.151 27.285 1.00 0.00 C ATOM 61 CG PHE A 4 41.114 54.155 27.294 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.133 55.246 26.418 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.041 53.985 28.177 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.063 56.149 26.397 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.983 54.902 28.172 1.00 0.00 C ATOM 66 CZ PHE A 4 38.985 55.975 27.272 1.00 0.00 C ATOM 0 H PHE A 4 40.703 50.962 26.609 1.00 0.00 H new ATOM 0 HA PHE A 4 42.476 52.816 25.176 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.179 52.542 28.187 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.191 53.687 27.329 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.974 55.392 25.757 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.029 53.149 28.860 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.070 56.979 25.706 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.163 54.782 28.864 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.156 56.667 27.253 1.00 0.00 H new ATOM 76 N VAL A 5 44.571 51.499 25.767 1.00 0.00 N ATOM 77 CA VAL A 5 45.731 50.646 25.924 1.00 0.00 C ATOM 78 C VAL A 5 46.876 51.409 26.593 1.00 0.00 C ATOM 79 O VAL A 5 47.204 52.524 26.193 1.00 0.00 O ATOM 80 CB VAL A 5 46.168 50.019 24.603 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.233 48.949 24.830 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.008 49.365 23.857 1.00 0.00 C ATOM 0 H VAL A 5 44.774 52.376 25.287 1.00 0.00 H new ATOM 0 HA VAL A 5 45.446 49.822 26.578 1.00 0.00 H new ATOM 0 HB VAL A 5 46.566 50.838 24.004 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.526 48.519 23.872 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.104 49.398 25.308 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.830 48.165 25.472 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.372 48.934 22.924 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.575 48.579 24.475 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.248 50.115 23.638 1.00 0.00 H new ATOM 92 N LYS A 6 47.477 50.797 27.610 1.00 0.00 N ATOM 93 CA LYS A 6 48.647 51.250 28.335 1.00 0.00 C ATOM 94 C LYS A 6 49.897 50.571 27.771 1.00 0.00 C ATOM 95 O LYS A 6 50.028 49.353 27.874 1.00 0.00 O ATOM 96 CB LYS A 6 48.482 50.945 29.821 1.00 0.00 C ATOM 97 CG LYS A 6 47.261 51.562 30.495 1.00 0.00 C ATOM 98 CD LYS A 6 47.380 53.070 30.697 1.00 0.00 C ATOM 99 CE LYS A 6 46.088 53.632 31.284 1.00 0.00 C ATOM 100 NZ LYS A 6 46.277 55.013 31.751 1.00 0.00 N ATOM 0 H LYS A 6 47.129 49.908 27.970 1.00 0.00 H new ATOM 0 HA LYS A 6 48.758 52.328 28.217 1.00 0.00 H new ATOM 0 HB2 LYS A 6 48.435 49.863 29.947 1.00 0.00 H new ATOM 0 HB3 LYS A 6 49.374 51.289 30.344 1.00 0.00 H new ATOM 0 HG2 LYS A 6 46.377 51.352 29.893 1.00 0.00 H new ATOM 0 HG3 LYS A 6 47.108 51.084 31.463 1.00 0.00 H new ATOM 0 HD2 LYS A 6 48.215 53.289 31.363 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.595 53.555 29.745 1.00 0.00 H new ATOM 0 HE2 LYS A 6 45.300 53.604 30.531 1.00 0.00 H new ATOM 0 HE3 LYS A 6 45.759 53.006 32.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 45.355 55.423 32.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 46.897 55.015 32.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.712 55.579 30.995 1.00 0.00 H new ATOM 168 N LYS A 11 52.468 55.121 27.913 1.00 0.00 N ATOM 169 CA LYS A 11 51.558 55.965 27.163 1.00 0.00 C ATOM 170 C LYS A 11 50.136 55.402 27.214 1.00 0.00 C ATOM 171 O LYS A 11 49.979 54.183 27.213 1.00 0.00 O ATOM 172 CB LYS A 11 52.074 56.046 25.730 1.00 0.00 C ATOM 173 CG LYS A 11 51.359 57.043 24.821 1.00 0.00 C ATOM 174 CD LYS A 11 51.992 56.968 23.434 1.00 0.00 C ATOM 175 CE LYS A 11 51.432 58.036 22.501 1.00 0.00 C ATOM 176 NZ LYS A 11 52.076 57.955 21.181 1.00 0.00 N ATOM 0 HA LYS A 11 51.517 56.964 27.596 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.133 56.304 25.759 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.000 55.056 25.281 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.295 56.811 24.766 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.445 58.052 25.223 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.072 57.089 23.520 1.00 0.00 H new ATOM 0 HD3 LYS A 11 51.815 55.981 23.006 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.355 57.907 22.395 1.00 0.00 H new ATOM 0 HE3 LYS A 11 51.594 59.024 22.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 51.696 58.700 20.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.103 58.084 21.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.886 57.024 20.758 1.00 0.00 H new ATOM 190 N THR A 12 49.118 56.258 27.199 1.00 0.00 N ATOM 191 CA THR A 12 47.728 55.860 27.116 1.00 0.00 C ATOM 192 C THR A 12 47.149 56.228 25.748 1.00 0.00 C ATOM 193 O THR A 12 47.075 57.411 25.419 1.00 0.00 O ATOM 194 CB THR A 12 46.886 56.477 28.228 1.00 0.00 C ATOM 195 OG1 THR A 12 47.496 56.301 29.488 1.00 0.00 O ATOM 196 CG2 THR A 12 45.512 55.820 28.306 1.00 0.00 C ATOM 0 H THR A 12 49.246 57.269 27.246 1.00 0.00 H new ATOM 0 HA THR A 12 47.693 54.778 27.242 1.00 0.00 H new ATOM 0 HB THR A 12 46.794 57.537 27.991 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.389 57.117 30.020 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.934 56.280 29.107 1.00 0.00 H new ATOM 0 HG22 THR A 12 44.990 55.955 27.359 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.629 54.755 28.508 1.00 0.00 H new ATOM 204 N ILE A 13 46.745 55.238 24.959 1.00 0.00 N ATOM 205 CA ILE A 13 46.174 55.414 23.640 1.00 0.00 C ATOM 206 C ILE A 13 44.700 55.004 23.593 1.00 0.00 C ATOM 207 O ILE A 13 44.326 53.988 24.174 1.00 0.00 O ATOM 208 CB ILE A 13 47.012 54.744 22.554 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.205 53.246 22.767 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.348 55.467 22.414 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.984 52.525 21.671 1.00 0.00 C ATOM 0 H ILE A 13 46.811 54.258 25.236 1.00 0.00 H new ATOM 0 HA ILE A 13 46.199 56.482 23.422 1.00 0.00 H new ATOM 0 HB ILE A 13 46.455 54.829 21.621 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.720 53.094 23.715 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.224 52.780 22.859 1.00 0.00 H new ATOM 0 HG21 ILE A 13 48.943 54.985 21.638 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.172 56.508 22.143 1.00 0.00 H new ATOM 0 HG23 ILE A 13 48.885 55.425 23.361 1.00 0.00 H new ATOM 0 HD11 ILE A 13 48.065 51.467 21.918 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.463 52.637 20.720 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.982 52.956 21.590 1.00 0.00 H new ATOM 223 N THR A 14 43.876 55.778 22.893 1.00 0.00 N ATOM 224 CA THR A 14 42.452 55.568 22.719 1.00 0.00 C ATOM 225 C THR A 14 42.172 54.842 21.401 1.00 0.00 C ATOM 226 O THR A 14 42.586 55.316 20.345 1.00 0.00 O ATOM 227 CB THR A 14 41.704 56.898 22.697 1.00 0.00 C ATOM 228 OG1 THR A 14 41.961 57.677 23.844 1.00 0.00 O ATOM 229 CG2 THR A 14 40.189 56.720 22.635 1.00 0.00 C ATOM 0 H THR A 14 44.207 56.612 22.408 1.00 0.00 H new ATOM 0 HA THR A 14 42.108 54.965 23.559 1.00 0.00 H new ATOM 0 HB THR A 14 42.069 57.395 21.798 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.717 57.169 24.646 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.708 57.698 22.622 1.00 0.00 H new ATOM 0 HG22 THR A 14 39.924 56.173 21.730 1.00 0.00 H new ATOM 0 HG23 THR A 14 39.852 56.162 23.509 1.00 0.00 H new ATOM 237 N LEU A 15 41.426 53.742 21.444 1.00 0.00 N ATOM 238 CA LEU A 15 41.015 52.980 20.282 1.00 0.00 C ATOM 239 C LEU A 15 39.490 52.932 20.172 1.00 0.00 C ATOM 240 O LEU A 15 38.820 52.534 21.122 1.00 0.00 O ATOM 241 CB LEU A 15 41.596 51.570 20.358 1.00 0.00 C ATOM 242 CG LEU A 15 43.108 51.454 20.529 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.502 49.980 20.515 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.891 52.158 19.424 1.00 0.00 C ATOM 0 H LEU A 15 41.083 53.348 22.320 1.00 0.00 H new ATOM 0 HA LEU A 15 41.397 53.472 19.387 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.120 51.051 21.190 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.316 51.038 19.449 1.00 0.00 H new ATOM 0 HG LEU A 15 43.354 51.934 21.476 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.581 49.891 20.637 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.001 49.462 21.332 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.206 49.533 19.566 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.960 52.039 19.603 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.633 51.720 18.460 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.640 53.219 19.419 1.00 0.00 H new ATOM 256 N GLU A 16 38.946 53.294 19.013 1.00 0.00 N ATOM 257 CA GLU A 16 37.547 53.108 18.689 1.00 0.00 C ATOM 258 C GLU A 16 37.328 51.722 18.079 1.00 0.00 C ATOM 259 O GLU A 16 38.022 51.325 17.146 1.00 0.00 O ATOM 260 CB GLU A 16 37.098 54.231 17.760 1.00 0.00 C ATOM 261 CG GLU A 16 35.624 54.212 17.365 1.00 0.00 C ATOM 262 CD GLU A 16 34.640 54.430 18.516 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.998 54.984 19.577 1.00 0.00 O ATOM 264 OE2 GLU A 16 33.455 54.063 18.360 1.00 0.00 O ATOM 0 H GLU A 16 39.481 53.732 18.263 1.00 0.00 H new ATOM 0 HA GLU A 16 36.938 53.155 19.592 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.314 55.185 18.242 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.699 54.189 16.852 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.456 54.983 16.613 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.402 53.254 16.895 1.00 0.00 H new ATOM 271 N VAL A 17 36.380 50.963 18.622 1.00 0.00 N ATOM 272 CA VAL A 17 36.136 49.566 18.326 1.00 0.00 C ATOM 273 C VAL A 17 34.648 49.214 18.388 1.00 0.00 C ATOM 274 O VAL A 17 33.853 49.923 18.999 1.00 0.00 O ATOM 275 CB VAL A 17 36.903 48.660 19.286 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.416 48.737 19.094 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.586 48.944 20.750 1.00 0.00 C ATOM 0 H VAL A 17 35.730 51.332 19.317 1.00 0.00 H new ATOM 0 HA VAL A 17 36.488 49.402 17.307 1.00 0.00 H new ATOM 0 HB VAL A 17 36.563 47.655 19.037 1.00 0.00 H new ATOM 0 HG11 VAL A 17 38.907 48.072 19.804 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.670 48.435 18.078 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.753 49.760 19.263 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.161 48.269 21.384 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.849 49.975 20.986 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.522 48.791 20.928 1.00 0.00 H new ATOM 287 N GLU A 18 34.289 48.065 17.821 1.00 0.00 N ATOM 288 CA GLU A 18 33.051 47.358 18.079 1.00 0.00 C ATOM 289 C GLU A 18 33.351 45.959 18.620 1.00 0.00 C ATOM 290 O GLU A 18 34.447 45.451 18.391 1.00 0.00 O ATOM 291 CB GLU A 18 32.218 47.273 16.802 1.00 0.00 C ATOM 292 CG GLU A 18 31.588 48.598 16.382 1.00 0.00 C ATOM 293 CD GLU A 18 31.093 48.492 14.938 1.00 0.00 C ATOM 294 OE1 GLU A 18 29.914 48.142 14.711 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.922 48.704 14.029 1.00 0.00 O ATOM 0 H GLU A 18 34.882 47.587 17.142 1.00 0.00 H new ATOM 0 HA GLU A 18 32.478 47.905 18.828 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.850 46.910 15.992 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.428 46.536 16.944 1.00 0.00 H new ATOM 0 HG2 GLU A 18 30.759 48.845 17.045 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.317 49.404 16.470 1.00 0.00 H new ATOM 302 N PRO A 19 32.435 45.280 19.306 1.00 0.00 N ATOM 303 CA PRO A 19 32.759 44.053 20.006 1.00 0.00 C ATOM 304 C PRO A 19 33.185 42.881 19.119 1.00 0.00 C ATOM 305 O PRO A 19 33.832 41.956 19.606 1.00 0.00 O ATOM 306 CB PRO A 19 31.545 43.719 20.868 1.00 0.00 C ATOM 307 CG PRO A 19 30.877 45.077 21.064 1.00 0.00 C ATOM 308 CD PRO A 19 31.119 45.733 19.707 1.00 0.00 C ATOM 0 HA PRO A 19 33.653 44.220 20.607 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.881 43.011 20.372 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.836 43.272 21.818 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.815 44.983 21.291 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.328 45.642 21.879 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.361 45.435 18.983 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.080 46.820 19.781 1.00 0.00 H new ATOM 316 N SER A 20 32.860 42.910 17.831 1.00 0.00 N ATOM 317 CA SER A 20 33.263 41.941 16.832 1.00 0.00 C ATOM 318 C SER A 20 34.686 42.126 16.298 1.00 0.00 C ATOM 319 O SER A 20 35.140 41.301 15.509 1.00 0.00 O ATOM 320 CB SER A 20 32.281 41.971 15.664 1.00 0.00 C ATOM 321 OG SER A 20 32.303 43.229 15.028 1.00 0.00 O ATOM 0 H SER A 20 32.278 43.651 17.441 1.00 0.00 H new ATOM 0 HA SER A 20 33.254 40.976 17.338 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.537 41.191 14.947 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.274 41.757 16.023 1.00 0.00 H new ATOM 0 HG SER A 20 31.669 43.229 14.281 1.00 0.00 H new ATOM 327 N ASP A 21 35.398 43.183 16.680 1.00 0.00 N ATOM 328 CA ASP A 21 36.794 43.355 16.334 1.00 0.00 C ATOM 329 C ASP A 21 37.664 42.311 17.036 1.00 0.00 C ATOM 330 O ASP A 21 37.484 42.024 18.217 1.00 0.00 O ATOM 331 CB ASP A 21 37.261 44.774 16.645 1.00 0.00 C ATOM 332 CG ASP A 21 36.870 45.739 15.523 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.536 45.683 14.467 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.895 46.512 15.647 1.00 0.00 O ATOM 0 H ASP A 21 35.015 43.944 17.241 1.00 0.00 H new ATOM 0 HA ASP A 21 36.900 43.202 15.260 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.822 45.107 17.585 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.343 44.784 16.777 1.00 0.00 H new ATOM 339 N THR A 22 38.604 41.729 16.296 1.00 0.00 N ATOM 340 CA THR A 22 39.522 40.731 16.807 1.00 0.00 C ATOM 341 C THR A 22 40.654 41.351 17.627 1.00 0.00 C ATOM 342 O THR A 22 40.984 42.526 17.476 1.00 0.00 O ATOM 343 CB THR A 22 40.102 39.850 15.705 1.00 0.00 C ATOM 344 OG1 THR A 22 40.841 40.650 14.811 1.00 0.00 O ATOM 345 CG2 THR A 22 39.034 39.110 14.904 1.00 0.00 C ATOM 0 H THR A 22 38.746 41.945 15.309 1.00 0.00 H new ATOM 0 HA THR A 22 38.926 40.099 17.466 1.00 0.00 H new ATOM 0 HB THR A 22 40.728 39.106 16.197 1.00 0.00 H new ATOM 0 HG1 THR A 22 41.217 40.087 14.102 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.512 38.501 14.136 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.459 38.468 15.571 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.368 39.832 14.432 1.00 0.00 H new ATOM 353 N ILE A 23 41.325 40.543 18.442 1.00 0.00 N ATOM 354 CA ILE A 23 42.551 40.939 19.105 1.00 0.00 C ATOM 355 C ILE A 23 43.638 41.273 18.081 1.00 0.00 C ATOM 356 O ILE A 23 44.398 42.213 18.298 1.00 0.00 O ATOM 357 CB ILE A 23 42.958 39.875 20.120 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.913 39.635 21.205 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.313 40.160 20.762 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.411 40.863 21.959 1.00 0.00 C ATOM 0 H ILE A 23 41.028 39.592 18.659 1.00 0.00 H new ATOM 0 HA ILE A 23 42.391 41.858 19.669 1.00 0.00 H new ATOM 0 HB ILE A 23 43.039 38.960 19.533 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.055 39.143 20.747 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.331 38.938 21.931 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.551 39.371 21.475 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.081 40.195 19.990 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.276 41.118 21.280 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.673 40.558 22.701 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.248 41.351 22.458 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.952 41.559 21.257 1.00 0.00 H new ATOM 372 N GLU A 24 43.666 40.620 16.923 1.00 0.00 N ATOM 373 CA GLU A 24 44.539 40.988 15.828 1.00 0.00 C ATOM 374 C GLU A 24 44.198 42.347 15.215 1.00 0.00 C ATOM 375 O GLU A 24 45.116 43.117 14.939 1.00 0.00 O ATOM 376 CB GLU A 24 44.573 39.856 14.804 1.00 0.00 C ATOM 377 CG GLU A 24 45.766 39.943 13.858 1.00 0.00 C ATOM 378 CD GLU A 24 45.861 38.750 12.903 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.812 38.187 12.522 1.00 0.00 O ATOM 380 OE2 GLU A 24 46.984 38.398 12.482 1.00 0.00 O ATOM 0 H GLU A 24 43.075 39.813 16.723 1.00 0.00 H new ATOM 0 HA GLU A 24 45.546 41.122 16.223 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.601 38.901 15.328 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.652 39.873 14.221 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.695 40.862 13.276 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.683 40.006 14.444 1.00 0.00 H new ATOM 387 N ASN A 25 42.929 42.726 15.095 1.00 0.00 N ATOM 388 CA ASN A 25 42.544 44.070 14.715 1.00 0.00 C ATOM 389 C ASN A 25 43.009 45.108 15.740 1.00 0.00 C ATOM 390 O ASN A 25 43.533 46.153 15.362 1.00 0.00 O ATOM 391 CB ASN A 25 41.038 44.205 14.513 1.00 0.00 C ATOM 392 CG ASN A 25 40.444 43.493 13.296 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.111 42.796 12.535 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.138 43.646 13.090 1.00 0.00 N ATOM 0 H ASN A 25 42.139 42.102 15.261 1.00 0.00 H new ATOM 0 HA ASN A 25 43.041 44.262 13.764 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.539 43.828 15.406 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.798 45.266 14.438 1.00 0.00 H new ATOM 0 HD21 ASN A 25 38.689 43.184 12.299 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.586 44.225 13.723 1.00 0.00 H new ATOM 401 N VAL A 26 42.871 44.840 17.035 1.00 0.00 N ATOM 402 CA VAL A 26 43.350 45.723 18.080 1.00 0.00 C ATOM 403 C VAL A 26 44.870 45.892 18.008 1.00 0.00 C ATOM 404 O VAL A 26 45.354 47.020 18.039 1.00 0.00 O ATOM 405 CB VAL A 26 42.892 45.241 19.453 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.463 46.079 20.594 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.374 45.324 19.575 1.00 0.00 C ATOM 0 H VAL A 26 42.419 43.996 17.386 1.00 0.00 H new ATOM 0 HA VAL A 26 42.912 46.708 17.920 1.00 0.00 H new ATOM 0 HB VAL A 26 43.250 44.215 19.534 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.103 45.690 21.547 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.552 46.032 20.571 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.142 47.115 20.481 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.069 44.976 20.562 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.054 46.357 19.440 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.913 44.699 18.811 1.00 0.00 H new ATOM 417 N LYS A 27 45.615 44.810 17.803 1.00 0.00 N ATOM 418 CA LYS A 27 47.044 44.855 17.561 1.00 0.00 C ATOM 419 C LYS A 27 47.408 45.659 16.310 1.00 0.00 C ATOM 420 O LYS A 27 48.403 46.380 16.340 1.00 0.00 O ATOM 421 CB LYS A 27 47.595 43.439 17.433 1.00 0.00 C ATOM 422 CG LYS A 27 47.664 42.656 18.741 1.00 0.00 C ATOM 423 CD LYS A 27 48.076 41.224 18.412 1.00 0.00 C ATOM 424 CE LYS A 27 48.638 40.494 19.630 1.00 0.00 C ATOM 425 NZ LYS A 27 49.419 39.326 19.199 1.00 0.00 N ATOM 0 H LYS A 27 45.232 43.865 17.801 1.00 0.00 H new ATOM 0 HA LYS A 27 47.494 45.361 18.415 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.975 42.886 16.728 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.596 43.492 17.005 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.383 43.113 19.421 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.697 42.668 19.244 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.214 40.678 18.029 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.824 41.235 17.620 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.267 41.169 20.210 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.824 40.177 20.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 49.382 38.593 19.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 49.021 38.949 18.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 50.407 39.608 19.041 1.00 0.00 H new ATOM 439 N ALA A 28 46.613 45.600 15.246 1.00 0.00 N ATOM 440 CA ALA A 28 46.820 46.376 14.040 1.00 0.00 C ATOM 441 C ALA A 28 46.617 47.879 14.240 1.00 0.00 C ATOM 442 O ALA A 28 47.327 48.668 13.620 1.00 0.00 O ATOM 443 CB ALA A 28 45.913 45.826 12.943 1.00 0.00 C ATOM 0 H ALA A 28 45.791 44.997 15.203 1.00 0.00 H new ATOM 0 HA ALA A 28 47.865 46.272 13.747 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.058 46.401 12.028 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.159 44.781 12.757 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.873 45.903 13.259 1.00 0.00 H new ATOM 449 N LYS A 29 45.734 48.299 15.141 1.00 0.00 N ATOM 450 CA LYS A 29 45.605 49.683 15.550 1.00 0.00 C ATOM 451 C LYS A 29 46.794 50.143 16.396 1.00 0.00 C ATOM 452 O LYS A 29 47.265 51.268 16.244 1.00 0.00 O ATOM 453 CB LYS A 29 44.315 49.911 16.334 1.00 0.00 C ATOM 454 CG LYS A 29 43.030 49.625 15.563 1.00 0.00 C ATOM 455 CD LYS A 29 41.820 49.834 16.470 1.00 0.00 C ATOM 456 CE LYS A 29 40.505 49.415 15.820 1.00 0.00 C ATOM 457 NZ LYS A 29 40.239 50.144 14.572 1.00 0.00 N ATOM 0 H LYS A 29 45.080 47.673 15.611 1.00 0.00 H new ATOM 0 HA LYS A 29 45.580 50.273 14.634 1.00 0.00 H new ATOM 0 HB2 LYS A 29 44.334 49.283 17.225 1.00 0.00 H new ATOM 0 HB3 LYS A 29 44.293 50.946 16.675 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.963 50.282 14.696 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.041 48.602 15.188 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.961 49.266 17.390 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.761 50.886 16.750 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.529 48.345 15.614 1.00 0.00 H new ATOM 0 HE3 LYS A 29 39.687 49.586 16.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.312 49.861 14.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 40.239 51.167 14.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 40.978 49.921 13.875 1.00 0.00 H new ATOM 471 N ILE A 30 47.322 49.280 17.258 1.00 0.00 N ATOM 472 CA ILE A 30 48.542 49.524 18.001 1.00 0.00 C ATOM 473 C ILE A 30 49.739 49.617 17.054 1.00 0.00 C ATOM 474 O ILE A 30 50.622 50.443 17.275 1.00 0.00 O ATOM 475 CB ILE A 30 48.718 48.485 19.104 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.584 48.574 20.121 1.00 0.00 C ATOM 477 CG2 ILE A 30 50.066 48.637 19.804 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.486 47.364 21.045 1.00 0.00 C ATOM 0 H ILE A 30 46.900 48.373 17.460 1.00 0.00 H new ATOM 0 HA ILE A 30 48.473 50.490 18.502 1.00 0.00 H new ATOM 0 HB ILE A 30 48.689 47.502 18.633 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.721 49.470 20.726 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.640 48.690 19.589 1.00 0.00 H new ATOM 0 HG21 ILE A 30 50.158 47.881 20.584 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.869 48.509 19.078 1.00 0.00 H new ATOM 0 HG23 ILE A 30 50.134 49.629 20.250 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.657 47.502 21.739 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.317 46.466 20.451 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.415 47.259 21.606 1.00 0.00 H new ATOM 490 N GLN A 31 49.755 48.868 15.955 1.00 0.00 N ATOM 491 CA GLN A 31 50.730 49.014 14.893 1.00 0.00 C ATOM 492 C GLN A 31 50.614 50.357 14.171 1.00 0.00 C ATOM 493 O GLN A 31 51.641 50.953 13.851 1.00 0.00 O ATOM 494 CB GLN A 31 50.611 47.840 13.925 1.00 0.00 C ATOM 495 CG GLN A 31 51.804 47.731 12.981 1.00 0.00 C ATOM 496 CD GLN A 31 51.707 46.526 12.044 1.00 0.00 C ATOM 497 OE1 GLN A 31 50.632 46.024 11.723 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.823 46.023 11.522 1.00 0.00 N ATOM 0 H GLN A 31 49.074 48.129 15.780 1.00 0.00 H new ATOM 0 HA GLN A 31 51.723 49.004 15.342 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.517 46.914 14.493 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.698 47.949 13.339 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.877 48.642 12.388 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.720 47.658 13.567 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.728 46.422 11.772 1.00 0.00 H new ATOM 0 HE22 GLN A 31 52.773 45.239 10.872 1.00 0.00 H new ATOM 507 N ASP A 32 49.417 50.893 13.951 1.00 0.00 N ATOM 508 CA ASP A 32 49.266 52.241 13.442 1.00 0.00 C ATOM 509 C ASP A 32 49.861 53.284 14.390 1.00 0.00 C ATOM 510 O ASP A 32 50.624 54.144 13.954 1.00 0.00 O ATOM 511 CB ASP A 32 47.813 52.578 13.115 1.00 0.00 C ATOM 512 CG ASP A 32 47.663 54.015 12.615 1.00 0.00 C ATOM 513 OD1 ASP A 32 48.307 54.369 11.604 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.934 54.817 13.238 1.00 0.00 O ATOM 0 H ASP A 32 48.537 50.407 14.120 1.00 0.00 H new ATOM 0 HA ASP A 32 49.830 52.275 12.510 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.442 51.889 12.357 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.198 52.436 14.004 1.00 0.00 H new ATOM 519 N LYS A 33 49.545 53.201 15.679 1.00 0.00 N ATOM 520 CA LYS A 33 49.921 54.206 16.652 1.00 0.00 C ATOM 521 C LYS A 33 51.383 54.136 17.097 1.00 0.00 C ATOM 522 O LYS A 33 52.059 55.161 17.135 1.00 0.00 O ATOM 523 CB LYS A 33 48.930 54.194 17.813 1.00 0.00 C ATOM 524 CG LYS A 33 47.576 54.724 17.348 1.00 0.00 C ATOM 525 CD LYS A 33 46.585 54.935 18.490 1.00 0.00 C ATOM 526 CE LYS A 33 45.208 55.332 17.967 1.00 0.00 C ATOM 527 NZ LYS A 33 45.213 56.630 17.276 1.00 0.00 N ATOM 0 H LYS A 33 49.016 52.424 16.075 1.00 0.00 H new ATOM 0 HA LYS A 33 49.860 55.176 16.159 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.820 53.180 18.198 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.308 54.807 18.631 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.724 55.669 16.825 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.148 54.026 16.629 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.503 54.020 19.076 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.959 55.710 19.159 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.849 54.563 17.283 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.506 55.372 18.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.240 56.889 17.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 45.609 57.357 17.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.794 56.563 16.416 1.00 0.00 H new ATOM 541 N GLU A 34 51.903 52.950 17.397 1.00 0.00 N ATOM 542 CA GLU A 34 53.202 52.746 18.007 1.00 0.00 C ATOM 543 C GLU A 34 54.129 51.823 17.212 1.00 0.00 C ATOM 544 O GLU A 34 55.250 51.560 17.642 1.00 0.00 O ATOM 545 CB GLU A 34 53.022 52.260 19.442 1.00 0.00 C ATOM 546 CG GLU A 34 52.058 53.072 20.302 1.00 0.00 C ATOM 547 CD GLU A 34 52.395 54.562 20.393 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.549 54.920 20.714 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.508 55.410 20.158 1.00 0.00 O ATOM 0 H GLU A 34 51.410 52.076 17.213 1.00 0.00 H new ATOM 0 HA GLU A 34 53.707 53.712 18.007 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.674 51.228 19.415 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.997 52.255 19.929 1.00 0.00 H new ATOM 0 HG2 GLU A 34 51.051 52.963 19.899 1.00 0.00 H new ATOM 0 HG3 GLU A 34 52.046 52.652 21.308 1.00 0.00 H new ATOM 556 N GLY A 35 53.715 51.337 16.045 1.00 0.00 N ATOM 557 CA GLY A 35 54.602 50.705 15.090 1.00 0.00 C ATOM 558 C GLY A 35 54.981 49.244 15.346 1.00 0.00 C ATOM 559 O GLY A 35 55.792 48.708 14.595 1.00 0.00 O ATOM 0 H GLY A 35 52.743 51.374 15.739 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.137 50.766 14.106 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.521 51.289 15.045 1.00 0.00 H new ATOM 563 N ILE A 36 54.417 48.591 16.358 1.00 0.00 N ATOM 564 CA ILE A 36 54.773 47.247 16.765 1.00 0.00 C ATOM 565 C ILE A 36 54.044 46.220 15.895 1.00 0.00 C ATOM 566 O ILE A 36 52.816 46.260 15.873 1.00 0.00 O ATOM 567 CB ILE A 36 54.466 46.999 18.239 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.907 48.108 19.190 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.117 45.688 18.670 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.290 48.011 20.582 1.00 0.00 C ATOM 0 H ILE A 36 53.678 49.000 16.931 1.00 0.00 H new ATOM 0 HA ILE A 36 55.849 47.137 16.629 1.00 0.00 H new ATOM 0 HB ILE A 36 53.379 46.963 18.311 1.00 0.00 H new ATOM 0 HG12 ILE A 36 55.993 48.084 19.282 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.646 49.072 18.754 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.902 45.504 19.723 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.719 44.870 18.070 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.195 45.753 18.526 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.652 48.834 21.199 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.204 48.067 20.503 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.572 47.063 21.040 1.00 0.00 H new ATOM 582 N PRO A 37 54.701 45.271 15.235 1.00 0.00 N ATOM 583 CA PRO A 37 54.033 44.205 14.516 1.00 0.00 C ATOM 584 C PRO A 37 53.114 43.358 15.399 1.00 0.00 C ATOM 585 O PRO A 37 53.420 43.178 16.574 1.00 0.00 O ATOM 586 CB PRO A 37 55.135 43.348 13.900 1.00 0.00 C ATOM 587 CG PRO A 37 56.324 44.300 13.808 1.00 0.00 C ATOM 588 CD PRO A 37 56.134 45.195 15.029 1.00 0.00 C ATOM 0 HA PRO A 37 53.375 44.633 13.760 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.363 42.482 14.521 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.847 42.970 12.919 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.274 43.766 13.842 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.313 44.873 12.881 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.634 44.778 15.903 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.559 46.184 14.860 1.00 0.00 H new ATOM 596 N PRO A 38 52.019 42.799 14.890 1.00 0.00 N ATOM 597 CA PRO A 38 51.059 42.097 15.717 1.00 0.00 C ATOM 598 C PRO A 38 51.621 40.821 16.348 1.00 0.00 C ATOM 599 O PRO A 38 51.301 40.528 17.497 1.00 0.00 O ATOM 600 CB PRO A 38 49.853 41.827 14.821 1.00 0.00 C ATOM 601 CG PRO A 38 50.440 41.828 13.412 1.00 0.00 C ATOM 602 CD PRO A 38 51.571 42.847 13.513 1.00 0.00 C ATOM 0 HA PRO A 38 50.782 42.705 16.578 1.00 0.00 H new ATOM 0 HB2 PRO A 38 49.384 40.872 15.058 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.089 42.595 14.937 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.809 40.842 13.128 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.700 42.119 12.666 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.383 42.601 12.828 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.223 43.846 13.249 1.00 0.00 H new ATOM 610 N ASP A 39 52.529 40.111 15.685 1.00 0.00 N ATOM 611 CA ASP A 39 53.221 38.969 16.247 1.00 0.00 C ATOM 612 C ASP A 39 54.282 39.337 17.287 1.00 0.00 C ATOM 613 O ASP A 39 54.847 38.453 17.928 1.00 0.00 O ATOM 614 CB ASP A 39 53.769 38.078 15.137 1.00 0.00 C ATOM 615 CG ASP A 39 54.945 38.675 14.361 1.00 0.00 C ATOM 616 OD1 ASP A 39 54.807 39.795 13.824 1.00 0.00 O ATOM 617 OD2 ASP A 39 55.984 37.995 14.215 1.00 0.00 O ATOM 0 H ASP A 39 52.805 40.322 14.726 1.00 0.00 H new ATOM 0 HA ASP A 39 52.482 38.397 16.808 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.083 37.129 15.573 1.00 0.00 H new ATOM 0 HB3 ASP A 39 52.964 37.856 14.436 1.00 0.00 H new ATOM 622 N GLN A 40 54.536 40.625 17.502 1.00 0.00 N ATOM 623 CA GLN A 40 55.435 41.171 18.498 1.00 0.00 C ATOM 624 C GLN A 40 54.693 41.891 19.625 1.00 0.00 C ATOM 625 O GLN A 40 55.269 42.724 20.322 1.00 0.00 O ATOM 626 CB GLN A 40 56.498 42.035 17.823 1.00 0.00 C ATOM 627 CG GLN A 40 57.334 41.236 16.827 1.00 0.00 C ATOM 628 CD GLN A 40 58.516 42.005 16.234 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.772 43.173 16.514 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.291 41.342 15.379 1.00 0.00 N ATOM 0 H GLN A 40 54.089 41.355 16.948 1.00 0.00 H new ATOM 0 HA GLN A 40 55.948 40.345 18.990 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.017 42.866 17.308 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.151 42.466 18.582 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.710 40.341 17.323 1.00 0.00 H new ATOM 0 HG3 GLN A 40 56.689 40.903 16.014 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.079 40.372 15.146 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.097 41.804 14.957 1.00 0.00 H new ATOM 639 N GLN A 41 53.421 41.564 19.834 1.00 0.00 N ATOM 640 CA GLN A 41 52.587 42.056 20.912 1.00 0.00 C ATOM 641 C GLN A 41 51.894 40.907 21.647 1.00 0.00 C ATOM 642 O GLN A 41 51.533 39.909 21.028 1.00 0.00 O ATOM 643 CB GLN A 41 51.516 42.992 20.359 1.00 0.00 C ATOM 644 CG GLN A 41 51.993 44.261 19.659 1.00 0.00 C ATOM 645 CD GLN A 41 50.813 45.049 19.085 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.789 45.237 19.738 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.869 45.527 17.845 1.00 0.00 N ATOM 0 H GLN A 41 52.925 40.916 19.222 1.00 0.00 H new ATOM 0 HA GLN A 41 53.233 42.588 21.610 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.905 42.427 19.655 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.865 43.285 21.183 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.542 44.885 20.364 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.685 44.000 18.858 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.707 45.385 17.281 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.074 46.035 17.458 1.00 0.00 H new ATOM 656 N ARG A 42 51.571 41.099 22.923 1.00 0.00 N ATOM 657 CA ARG A 42 50.490 40.430 23.618 1.00 0.00 C ATOM 658 C ARG A 42 49.814 41.404 24.585 1.00 0.00 C ATOM 659 O ARG A 42 50.494 42.265 25.141 1.00 0.00 O ATOM 660 CB ARG A 42 50.994 39.145 24.267 1.00 0.00 C ATOM 661 CG ARG A 42 49.919 38.362 25.015 1.00 0.00 C ATOM 662 CD ARG A 42 50.375 36.939 25.325 1.00 0.00 C ATOM 663 NE ARG A 42 51.397 36.863 26.369 1.00 0.00 N ATOM 664 CZ ARG A 42 52.677 36.491 26.227 1.00 0.00 C ATOM 665 NH1 ARG A 42 53.288 36.394 25.039 1.00 0.00 N ATOM 666 NH2 ARG A 42 53.396 36.223 27.326 1.00 0.00 N ATOM 0 H ARG A 42 52.079 41.752 23.519 1.00 0.00 H new ATOM 0 HA ARG A 42 49.718 40.119 22.915 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.424 38.506 23.496 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.798 39.392 24.961 1.00 0.00 H new ATOM 0 HG2 ARG A 42 49.673 38.877 25.944 1.00 0.00 H new ATOM 0 HG3 ARG A 42 49.008 38.331 24.417 1.00 0.00 H new ATOM 0 HD2 ARG A 42 49.511 36.349 25.631 1.00 0.00 H new ATOM 0 HD3 ARG A 42 50.765 36.485 24.414 1.00 0.00 H new ATOM 0 HE ARG A 42 51.103 37.122 27.311 1.00 0.00 H new ATOM 0 HH11 ARG A 42 52.776 36.608 24.183 1.00 0.00 H new ATOM 0 HH12 ARG A 42 54.265 36.106 24.990 1.00 0.00 H new ATOM 0 HH21 ARG A 42 52.967 36.304 28.248 1.00 0.00 H new ATOM 0 HH22 ARG A 42 54.372 35.938 27.240 1.00 0.00 H new ATOM 680 N LEU A 43 48.499 41.298 24.758 1.00 0.00 N ATOM 681 CA LEU A 43 47.678 42.226 25.510 1.00 0.00 C ATOM 682 C LEU A 43 47.051 41.569 26.741 1.00 0.00 C ATOM 683 O LEU A 43 46.585 40.433 26.677 1.00 0.00 O ATOM 684 CB LEU A 43 46.609 42.824 24.600 1.00 0.00 C ATOM 685 CG LEU A 43 47.119 43.508 23.335 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.946 44.021 22.504 1.00 0.00 C ATOM 687 CD2 LEU A 43 48.039 44.690 23.627 1.00 0.00 C ATOM 0 H LEU A 43 47.960 40.529 24.359 1.00 0.00 H new ATOM 0 HA LEU A 43 48.320 43.027 25.877 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.921 42.030 24.309 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.033 43.549 25.175 1.00 0.00 H new ATOM 0 HG LEU A 43 47.689 42.753 22.793 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.323 44.507 21.604 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.305 43.185 22.224 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.371 44.738 23.090 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.369 45.135 22.688 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.500 45.435 24.212 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.907 44.345 24.190 1.00 0.00 H new ATOM 699 N ILE A 44 47.031 42.313 27.844 1.00 0.00 N ATOM 700 CA ILE A 44 46.457 41.935 29.120 1.00 0.00 C ATOM 701 C ILE A 44 45.192 42.747 29.399 1.00 0.00 C ATOM 702 O ILE A 44 45.185 43.965 29.237 1.00 0.00 O ATOM 703 CB ILE A 44 47.474 42.083 30.248 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.837 41.453 29.976 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.924 41.573 31.577 1.00 0.00 C ATOM 706 CD1 ILE A 44 48.843 39.960 29.660 1.00 0.00 C ATOM 0 H ILE A 44 47.440 43.247 27.866 1.00 0.00 H new ATOM 0 HA ILE A 44 46.179 40.882 29.071 1.00 0.00 H new ATOM 0 HB ILE A 44 47.644 43.158 30.307 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.297 41.981 29.141 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.471 41.621 30.847 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.678 41.696 32.354 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.032 42.141 31.844 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.668 40.518 31.484 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.867 39.629 29.486 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.421 39.409 30.500 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.245 39.775 28.768 1.00 0.00 H new ATOM 718 N PHE A 45 44.134 42.085 29.861 1.00 0.00 N ATOM 719 CA PHE A 45 42.893 42.669 30.326 1.00 0.00 C ATOM 720 C PHE A 45 42.360 41.869 31.517 1.00 0.00 C ATOM 721 O PHE A 45 42.432 40.643 31.501 1.00 0.00 O ATOM 722 CB PHE A 45 41.874 42.659 29.190 1.00 0.00 C ATOM 723 CG PHE A 45 40.457 42.948 29.624 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.094 44.234 30.041 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.525 41.907 29.696 1.00 0.00 C ATOM 726 CE1 PHE A 45 38.806 44.474 30.536 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.232 42.144 30.180 1.00 0.00 C ATOM 728 CZ PHE A 45 37.876 43.430 30.604 1.00 0.00 C ATOM 0 H PHE A 45 44.127 41.067 29.921 1.00 0.00 H new ATOM 0 HA PHE A 45 43.068 43.697 30.643 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.171 43.397 28.445 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.901 41.685 28.702 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.808 45.042 29.981 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.804 40.914 29.376 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.530 45.465 30.865 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.514 41.339 30.226 1.00 0.00 H new ATOM 0 HZ PHE A 45 36.882 43.617 30.984 1.00 0.00 H new ATOM 738 N ALA A 46 41.831 42.535 32.539 1.00 0.00 N ATOM 739 CA ALA A 46 41.278 41.917 33.728 1.00 0.00 C ATOM 740 C ALA A 46 42.162 40.819 34.322 1.00 0.00 C ATOM 741 O ALA A 46 41.701 39.724 34.639 1.00 0.00 O ATOM 742 CB ALA A 46 39.834 41.502 33.461 1.00 0.00 C ATOM 0 H ALA A 46 41.776 43.553 32.558 1.00 0.00 H new ATOM 0 HA ALA A 46 41.261 42.659 34.527 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.418 41.037 34.355 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.245 42.381 33.201 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.807 40.790 32.636 1.00 0.00 H new ATOM 748 N GLY A 47 43.462 41.080 34.428 1.00 0.00 N ATOM 749 CA GLY A 47 44.453 40.165 34.954 1.00 0.00 C ATOM 750 C GLY A 47 44.786 38.947 34.090 1.00 0.00 C ATOM 751 O GLY A 47 45.469 38.054 34.585 1.00 0.00 O ATOM 0 H GLY A 47 43.863 41.972 34.137 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.374 40.722 35.127 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.108 39.810 35.925 1.00 0.00 H new ATOM 755 N LYS A 48 44.312 38.865 32.850 1.00 0.00 N ATOM 756 CA LYS A 48 44.455 37.736 31.954 1.00 0.00 C ATOM 757 C LYS A 48 44.965 38.141 30.571 1.00 0.00 C ATOM 758 O LYS A 48 44.735 39.263 30.124 1.00 0.00 O ATOM 759 CB LYS A 48 43.114 37.018 31.821 1.00 0.00 C ATOM 760 CG LYS A 48 42.663 36.338 33.111 1.00 0.00 C ATOM 761 CD LYS A 48 41.371 35.566 32.859 1.00 0.00 C ATOM 762 CE LYS A 48 40.852 34.905 34.132 1.00 0.00 C ATOM 763 NZ LYS A 48 39.605 34.172 33.860 1.00 0.00 N ATOM 0 H LYS A 48 43.789 39.631 32.426 1.00 0.00 H new ATOM 0 HA LYS A 48 45.201 37.070 32.387 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.354 37.736 31.512 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.187 36.271 31.031 1.00 0.00 H new ATOM 0 HG2 LYS A 48 43.439 35.661 33.467 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.507 37.083 33.891 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.613 36.243 32.466 1.00 0.00 H new ATOM 0 HD3 LYS A 48 41.544 34.805 32.098 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.604 34.222 34.527 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.677 35.662 34.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.265 33.728 34.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.885 34.832 33.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 39.783 33.437 33.146 1.00 0.00 H new ATOM 777 N GLN A 49 45.640 37.229 29.876 1.00 0.00 N ATOM 778 CA GLN A 49 46.126 37.437 28.526 1.00 0.00 C ATOM 779 C GLN A 49 45.103 37.054 27.455 1.00 0.00 C ATOM 780 O GLN A 49 44.352 36.093 27.609 1.00 0.00 O ATOM 781 CB GLN A 49 47.483 36.768 28.330 1.00 0.00 C ATOM 782 CG GLN A 49 47.488 35.248 28.461 1.00 0.00 C ATOM 783 CD GLN A 49 48.904 34.681 28.343 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.690 34.703 29.287 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.302 34.201 27.168 1.00 0.00 N ATOM 0 H GLN A 49 45.866 36.307 30.249 1.00 0.00 H new ATOM 0 HA GLN A 49 46.273 38.509 28.394 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.860 37.032 27.342 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.181 37.181 29.058 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.059 34.963 29.422 1.00 0.00 H new ATOM 0 HG3 GLN A 49 46.855 34.813 27.688 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.655 34.180 26.380 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.255 33.854 27.055 1.00 0.00 H new ATOM 794 N LEU A 50 45.081 37.809 26.361 1.00 0.00 N ATOM 795 CA LEU A 50 44.143 37.663 25.266 1.00 0.00 C ATOM 796 C LEU A 50 44.785 37.011 24.040 1.00 0.00 C ATOM 797 O LEU A 50 46.006 37.030 23.908 1.00 0.00 O ATOM 798 CB LEU A 50 43.542 39.025 24.932 1.00 0.00 C ATOM 799 CG LEU A 50 43.007 39.841 26.105 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.362 41.115 25.564 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.973 39.091 26.940 1.00 0.00 C ATOM 0 H LEU A 50 45.745 38.569 26.212 1.00 0.00 H new ATOM 0 HA LEU A 50 43.345 36.990 25.580 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.302 39.618 24.423 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.728 38.874 24.223 1.00 0.00 H new ATOM 0 HG LEU A 50 43.854 40.058 26.756 1.00 0.00 H new ATOM 0 HD11 LEU A 50 41.975 41.707 26.393 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.106 41.696 25.019 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.544 40.852 24.893 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.634 39.728 27.757 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.123 38.823 26.312 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.422 38.186 27.348 1.00 0.00 H new ATOM 813 N GLU A 51 43.985 36.444 23.141 1.00 0.00 N ATOM 814 CA GLU A 51 44.441 35.664 22.008 1.00 0.00 C ATOM 815 C GLU A 51 43.941 36.173 20.655 1.00 0.00 C ATOM 816 O GLU A 51 42.766 36.492 20.488 1.00 0.00 O ATOM 817 CB GLU A 51 44.067 34.197 22.200 1.00 0.00 C ATOM 818 CG GLU A 51 44.851 33.553 23.339 1.00 0.00 C ATOM 819 CD GLU A 51 44.562 32.056 23.465 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.489 31.684 23.989 1.00 0.00 O ATOM 821 OE2 GLU A 51 45.414 31.237 23.055 1.00 0.00 O ATOM 0 H GLU A 51 42.969 36.521 23.188 1.00 0.00 H new ATOM 0 HA GLU A 51 45.525 35.774 21.980 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.999 34.119 22.405 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.255 33.651 21.276 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.918 33.703 23.174 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.601 34.050 24.276 1.00 0.00 H new ATOM 828 N ASP A 52 44.837 36.216 19.673 1.00 0.00 N ATOM 829 CA ASP A 52 44.700 36.882 18.393 1.00 0.00 C ATOM 830 C ASP A 52 43.462 36.527 17.566 1.00 0.00 C ATOM 831 O ASP A 52 42.952 37.383 16.848 1.00 0.00 O ATOM 832 CB ASP A 52 45.945 36.593 17.560 1.00 0.00 C ATOM 833 CG ASP A 52 47.178 37.343 18.070 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.607 37.117 19.221 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.745 38.175 17.329 1.00 0.00 O ATOM 0 H ASP A 52 45.740 35.751 19.763 1.00 0.00 H new ATOM 0 HA ASP A 52 44.578 37.937 18.636 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.145 35.522 17.571 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.757 36.872 16.523 1.00 0.00 H new ATOM 840 N GLY A 53 42.994 35.284 17.632 1.00 0.00 N ATOM 841 CA GLY A 53 41.827 34.818 16.911 1.00 0.00 C ATOM 842 C GLY A 53 40.481 35.199 17.531 1.00 0.00 C ATOM 843 O GLY A 53 39.461 35.095 16.854 1.00 0.00 O ATOM 0 H GLY A 53 43.430 34.560 18.203 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.866 35.213 15.896 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.878 33.732 16.833 1.00 0.00 H new ATOM 847 N ARG A 54 40.454 35.636 18.787 1.00 0.00 N ATOM 848 CA ARG A 54 39.250 35.969 19.521 1.00 0.00 C ATOM 849 C ARG A 54 38.844 37.430 19.315 1.00 0.00 C ATOM 850 O ARG A 54 39.630 38.247 18.840 1.00 0.00 O ATOM 851 CB ARG A 54 39.416 35.609 20.994 1.00 0.00 C ATOM 852 CG ARG A 54 39.737 34.141 21.263 1.00 0.00 C ATOM 853 CD ARG A 54 38.657 33.175 20.786 1.00 0.00 C ATOM 854 NE ARG A 54 39.096 31.786 20.922 1.00 0.00 N ATOM 855 CZ ARG A 54 38.590 30.719 20.289 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.473 30.792 19.553 1.00 0.00 N ATOM 857 NH2 ARG A 54 39.192 29.527 20.392 1.00 0.00 N ATOM 0 H ARG A 54 41.303 35.771 19.336 1.00 0.00 H new ATOM 0 HA ARG A 54 38.428 35.373 19.125 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.211 36.223 21.416 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.499 35.868 21.522 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.678 33.889 20.773 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.888 34.002 22.334 1.00 0.00 H new ATOM 0 HD2 ARG A 54 37.745 33.330 21.363 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.414 33.382 19.744 1.00 0.00 H new ATOM 0 HE ARG A 54 39.868 31.612 21.566 1.00 0.00 H new ATOM 0 HH11 ARG A 54 36.980 31.680 19.461 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.116 29.959 19.084 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.038 29.430 20.953 1.00 0.00 H new ATOM 0 HH22 ARG A 54 38.804 28.717 19.909 1.00 0.00 H new ATOM 871 N THR A 55 37.605 37.754 19.677 1.00 0.00 N ATOM 872 CA THR A 55 37.031 39.083 19.605 1.00 0.00 C ATOM 873 C THR A 55 36.910 39.741 20.980 1.00 0.00 C ATOM 874 O THR A 55 36.894 39.060 22.004 1.00 0.00 O ATOM 875 CB THR A 55 35.673 39.090 18.909 1.00 0.00 C ATOM 876 OG1 THR A 55 34.697 38.426 19.680 1.00 0.00 O ATOM 877 CG2 THR A 55 35.691 38.449 17.525 1.00 0.00 C ATOM 0 H THR A 55 36.950 37.063 20.044 1.00 0.00 H new ATOM 0 HA THR A 55 37.728 39.669 19.006 1.00 0.00 H new ATOM 0 HB THR A 55 35.426 40.146 18.796 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.989 37.508 19.857 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.692 38.490 17.092 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.387 38.989 16.883 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.007 37.409 17.610 1.00 0.00 H new ATOM 885 N LEU A 56 36.755 41.062 21.016 1.00 0.00 N ATOM 886 CA LEU A 56 36.487 41.791 22.239 1.00 0.00 C ATOM 887 C LEU A 56 35.243 41.286 22.973 1.00 0.00 C ATOM 888 O LEU A 56 35.223 41.250 24.201 1.00 0.00 O ATOM 889 CB LEU A 56 36.363 43.275 21.909 1.00 0.00 C ATOM 890 CG LEU A 56 37.653 43.944 21.440 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.335 45.368 20.994 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.707 44.021 22.540 1.00 0.00 C ATOM 0 H LEU A 56 36.813 41.655 20.188 1.00 0.00 H new ATOM 0 HA LEU A 56 37.321 41.627 22.922 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.606 43.397 21.134 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.001 43.799 22.794 1.00 0.00 H new ATOM 0 HG LEU A 56 38.054 43.340 20.626 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.249 45.856 20.657 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.615 45.341 20.176 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.913 45.926 21.830 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.603 44.505 22.152 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.317 44.598 23.378 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.956 43.015 22.877 1.00 0.00 H new ATOM 904 N SER A 57 34.232 40.830 22.239 1.00 0.00 N ATOM 905 CA SER A 57 33.032 40.230 22.785 1.00 0.00 C ATOM 906 C SER A 57 33.268 38.885 23.476 1.00 0.00 C ATOM 907 O SER A 57 32.607 38.613 24.476 1.00 0.00 O ATOM 908 CB SER A 57 31.992 40.060 21.681 1.00 0.00 C ATOM 909 OG SER A 57 30.703 39.965 22.243 1.00 0.00 O ATOM 0 H SER A 57 34.231 40.872 21.220 1.00 0.00 H new ATOM 0 HA SER A 57 32.674 40.914 23.555 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.037 40.906 20.995 1.00 0.00 H new ATOM 0 HB3 SER A 57 32.211 39.165 21.099 1.00 0.00 H new ATOM 0 HG SER A 57 30.041 39.858 21.528 1.00 0.00 H new ATOM 915 N ASP A 58 34.228 38.069 23.048 1.00 0.00 N ATOM 916 CA ASP A 58 34.532 36.801 23.681 1.00 0.00 C ATOM 917 C ASP A 58 35.042 36.958 25.115 1.00 0.00 C ATOM 918 O ASP A 58 34.859 36.069 25.945 1.00 0.00 O ATOM 919 CB ASP A 58 35.568 36.027 22.871 1.00 0.00 C ATOM 920 CG ASP A 58 35.031 35.566 21.515 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.141 34.688 21.488 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.502 36.058 20.466 1.00 0.00 O ATOM 0 H ASP A 58 34.819 38.277 22.243 1.00 0.00 H new ATOM 0 HA ASP A 58 33.592 36.250 23.717 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.445 36.655 22.716 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.895 35.158 23.442 1.00 0.00 H new ATOM 927 N TYR A 59 35.631 38.109 25.425 1.00 0.00 N ATOM 928 CA TYR A 59 36.075 38.514 26.744 1.00 0.00 C ATOM 929 C TYR A 59 35.119 39.491 27.430 1.00 0.00 C ATOM 930 O TYR A 59 35.407 39.945 28.534 1.00 0.00 O ATOM 931 CB TYR A 59 37.492 39.067 26.634 1.00 0.00 C ATOM 932 CG TYR A 59 38.478 38.144 25.958 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.929 36.998 26.624 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.941 38.433 24.669 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.858 36.147 26.013 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.887 37.603 24.056 1.00 0.00 C ATOM 937 CZ TYR A 59 40.351 36.457 24.730 1.00 0.00 C ATOM 938 OH TYR A 59 41.279 35.655 24.133 1.00 0.00 O ATOM 0 H TYR A 59 35.819 38.820 24.719 1.00 0.00 H new ATOM 0 HA TYR A 59 36.078 37.637 27.392 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.459 40.007 26.084 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.857 39.296 27.635 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.559 36.770 27.613 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.567 39.300 24.145 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.195 35.257 26.523 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.259 37.841 23.070 1.00 0.00 H new ATOM 0 HH TYR A 59 41.159 34.732 24.439 1.00 0.00 H new ATOM 948 N ASN A 60 33.984 39.812 26.814 1.00 0.00 N ATOM 949 CA ASN A 60 32.989 40.753 27.288 1.00 0.00 C ATOM 950 C ASN A 60 33.561 42.123 27.655 1.00 0.00 C ATOM 951 O ASN A 60 33.282 42.664 28.723 1.00 0.00 O ATOM 952 CB ASN A 60 32.151 40.096 28.381 1.00 0.00 C ATOM 953 CG ASN A 60 30.865 40.865 28.687 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.183 41.380 27.804 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.467 40.926 29.956 1.00 0.00 N ATOM 0 H ASN A 60 33.725 39.395 25.920 1.00 0.00 H new ATOM 0 HA ASN A 60 32.319 40.994 26.463 1.00 0.00 H new ATOM 0 HB2 ASN A 60 31.898 39.080 28.077 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.746 40.017 29.291 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.596 41.400 30.195 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.033 40.499 30.689 1.00 0.00 H new ATOM 962 N ILE A 61 34.397 42.689 26.789 1.00 0.00 N ATOM 963 CA ILE A 61 35.042 43.970 26.998 1.00 0.00 C ATOM 964 C ILE A 61 34.071 45.093 26.632 1.00 0.00 C ATOM 965 O ILE A 61 33.784 45.319 25.459 1.00 0.00 O ATOM 966 CB ILE A 61 36.367 44.031 26.244 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.361 43.025 26.818 1.00 0.00 C ATOM 968 CG2 ILE A 61 36.982 45.426 26.315 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.558 42.719 25.923 1.00 0.00 C ATOM 0 H ILE A 61 34.647 42.253 25.901 1.00 0.00 H new ATOM 0 HA ILE A 61 35.296 44.101 28.050 1.00 0.00 H new ATOM 0 HB ILE A 61 36.156 43.787 25.203 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.727 43.403 27.772 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.834 42.094 27.025 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.925 45.436 25.768 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.297 46.149 25.871 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.164 45.691 27.357 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.206 41.995 26.417 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.209 42.307 24.976 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.116 43.636 25.735 1.00 0.00 H new ATOM 981 N GLN A 62 33.544 45.786 27.639 1.00 0.00 N ATOM 982 CA GLN A 62 32.552 46.836 27.527 1.00 0.00 C ATOM 983 C GLN A 62 33.162 48.236 27.627 1.00 0.00 C ATOM 984 O GLN A 62 34.381 48.381 27.669 1.00 0.00 O ATOM 985 CB GLN A 62 31.467 46.580 28.569 1.00 0.00 C ATOM 986 CG GLN A 62 30.752 45.247 28.364 1.00 0.00 C ATOM 987 CD GLN A 62 29.545 45.070 29.287 1.00 0.00 C ATOM 988 OE1 GLN A 62 28.392 45.235 28.893 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.749 44.745 30.560 1.00 0.00 N ATOM 0 H GLN A 62 33.818 45.615 28.607 1.00 0.00 H new ATOM 0 HA GLN A 62 32.104 46.809 26.534 1.00 0.00 H new ATOM 0 HB2 GLN A 62 31.913 46.599 29.563 1.00 0.00 H new ATOM 0 HB3 GLN A 62 30.737 47.388 28.532 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.424 45.172 27.327 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.456 44.433 28.535 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.699 44.604 30.905 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.956 44.636 31.192 1.00 0.00 H new ATOM 998 N LYS A 63 32.326 49.271 27.637 1.00 0.00 N ATOM 999 CA LYS A 63 32.676 50.677 27.605 1.00 0.00 C ATOM 1000 C LYS A 63 33.898 51.083 28.430 1.00 0.00 C ATOM 1001 O LYS A 63 33.996 50.788 29.619 1.00 0.00 O ATOM 1002 CB LYS A 63 31.466 51.535 27.964 1.00 0.00 C ATOM 1003 CG LYS A 63 30.902 51.315 29.365 1.00 0.00 C ATOM 1004 CD LYS A 63 29.833 52.327 29.766 1.00 0.00 C ATOM 1005 CE LYS A 63 29.570 52.202 31.264 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.448 53.045 31.706 1.00 0.00 N ATOM 0 H LYS A 63 31.316 49.133 27.670 1.00 0.00 H new ATOM 0 HA LYS A 63 32.980 50.861 26.575 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.743 52.584 27.862 1.00 0.00 H new ATOM 0 HB3 LYS A 63 30.676 51.342 27.238 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.479 50.312 29.423 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.718 51.358 30.086 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.161 53.338 29.524 1.00 0.00 H new ATOM 0 HD3 LYS A 63 28.915 52.148 29.206 1.00 0.00 H new ATOM 0 HE2 LYS A 63 29.358 51.161 31.508 1.00 0.00 H new ATOM 0 HE3 LYS A 63 30.469 52.481 31.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.307 52.927 32.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 28.660 54.042 31.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 27.583 52.763 31.203 1.00 0.00 H new ATOM 1020 N GLU A 64 34.812 51.813 27.796 1.00 0.00 N ATOM 1021 CA GLU A 64 35.916 52.510 28.424 1.00 0.00 C ATOM 1022 C GLU A 64 36.853 51.632 29.257 1.00 0.00 C ATOM 1023 O GLU A 64 37.516 52.094 30.183 1.00 0.00 O ATOM 1024 CB GLU A 64 35.401 53.760 29.133 1.00 0.00 C ATOM 1025 CG GLU A 64 34.802 54.786 28.176 1.00 0.00 C ATOM 1026 CD GLU A 64 34.470 56.090 28.904 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.931 57.167 28.469 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.734 56.049 29.915 1.00 0.00 O ATOM 0 H GLU A 64 34.797 51.936 26.784 1.00 0.00 H new ATOM 0 HA GLU A 64 36.588 52.836 27.630 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.647 53.471 29.865 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.220 54.221 29.685 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.504 54.986 27.367 1.00 0.00 H new ATOM 0 HG3 GLU A 64 33.899 54.380 27.721 1.00 0.00 H new ATOM 1035 N SER A 65 36.918 50.352 28.901 1.00 0.00 N ATOM 1036 CA SER A 65 37.838 49.383 29.462 1.00 0.00 C ATOM 1037 C SER A 65 39.290 49.679 29.083 1.00 0.00 C ATOM 1038 O SER A 65 39.561 50.207 28.007 1.00 0.00 O ATOM 1039 CB SER A 65 37.489 47.971 29.000 1.00 0.00 C ATOM 1040 OG SER A 65 36.199 47.602 29.432 1.00 0.00 O ATOM 0 H SER A 65 36.307 49.953 28.188 1.00 0.00 H new ATOM 0 HA SER A 65 37.739 49.456 30.545 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.541 47.917 27.913 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.223 47.265 29.390 1.00 0.00 H new ATOM 0 HG SER A 65 35.535 47.911 28.781 1.00 0.00 H new ATOM 1046 N THR A 66 40.228 49.285 29.939 1.00 0.00 N ATOM 1047 CA THR A 66 41.649 49.527 29.778 1.00 0.00 C ATOM 1048 C THR A 66 42.428 48.213 29.705 1.00 0.00 C ATOM 1049 O THR A 66 42.199 47.296 30.491 1.00 0.00 O ATOM 1050 CB THR A 66 42.183 50.450 30.869 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.526 51.696 30.811 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.671 50.759 30.730 1.00 0.00 C ATOM 0 H THR A 66 40.007 48.771 30.792 1.00 0.00 H new ATOM 0 HA THR A 66 41.796 50.041 28.828 1.00 0.00 H new ATOM 0 HB THR A 66 42.007 49.919 31.804 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.873 52.282 31.516 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.982 51.420 31.539 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.241 49.831 30.779 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.853 51.246 29.772 1.00 0.00 H new ATOM 1060 N LEU A 67 43.357 48.124 28.758 1.00 0.00 N ATOM 1061 CA LEU A 67 44.248 47.008 28.512 1.00 0.00 C ATOM 1062 C LEU A 67 45.703 47.427 28.731 1.00 0.00 C ATOM 1063 O LEU A 67 46.033 48.608 28.641 1.00 0.00 O ATOM 1064 CB LEU A 67 44.046 46.452 27.106 1.00 0.00 C ATOM 1065 CG LEU A 67 42.648 45.924 26.794 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.714 46.987 26.224 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.736 44.818 25.747 1.00 0.00 C ATOM 0 H LEU A 67 43.513 48.887 28.099 1.00 0.00 H new ATOM 0 HA LEU A 67 44.010 46.216 29.222 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.286 47.236 26.388 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.762 45.645 26.949 1.00 0.00 H new ATOM 0 HG LEU A 67 42.247 45.571 27.744 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.738 46.545 26.025 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.605 47.799 26.943 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.131 47.378 25.296 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.736 44.444 25.528 1.00 0.00 H new ATOM 0 HD22 LEU A 67 43.183 45.215 24.836 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.352 44.004 26.129 1.00 0.00 H new ATOM 1079 N HIS A 68 46.586 46.470 28.999 1.00 0.00 N ATOM 1080 CA HIS A 68 47.981 46.705 29.313 1.00 0.00 C ATOM 1081 C HIS A 68 48.925 45.897 28.420 1.00 0.00 C ATOM 1082 O HIS A 68 48.611 44.770 28.043 1.00 0.00 O ATOM 1083 CB HIS A 68 48.228 46.380 30.784 1.00 0.00 C ATOM 1084 CG HIS A 68 47.619 47.328 31.781 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.349 48.153 32.634 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.288 47.448 32.089 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.458 48.769 33.413 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.210 48.374 33.110 1.00 0.00 N ATOM 0 H HIS A 68 46.337 45.481 29.002 1.00 0.00 H new ATOM 0 HA HIS A 68 48.195 47.757 29.123 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.845 45.379 30.984 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.304 46.349 30.953 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.466 46.923 31.626 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.706 49.486 34.181 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.354 48.701 33.557 1.00 0.00 H new ATOM 1096 N LEU A 69 50.106 46.443 28.150 1.00 0.00 N ATOM 1097 CA LEU A 69 51.263 45.745 27.626 1.00 0.00 C ATOM 1098 C LEU A 69 52.486 46.062 28.489 1.00 0.00 C ATOM 1099 O LEU A 69 52.678 47.202 28.906 1.00 0.00 O ATOM 1100 CB LEU A 69 51.431 46.061 26.143 1.00 0.00 C ATOM 1101 CG LEU A 69 52.513 45.258 25.428 1.00 0.00 C ATOM 1102 CD1 LEU A 69 52.181 45.058 23.952 1.00 0.00 C ATOM 1103 CD2 LEU A 69 53.878 45.940 25.465 1.00 0.00 C ATOM 0 H LEU A 69 50.286 47.436 28.300 1.00 0.00 H new ATOM 0 HA LEU A 69 51.129 44.665 27.682 1.00 0.00 H new ATOM 0 HB2 LEU A 69 50.480 45.887 25.640 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.658 47.122 26.037 1.00 0.00 H new ATOM 0 HG LEU A 69 52.550 44.309 25.963 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.974 44.482 23.475 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.237 44.520 23.861 1.00 0.00 H new ATOM 0 HD13 LEU A 69 52.094 46.029 23.464 1.00 0.00 H new ATOM 0 HD21 LEU A 69 54.608 45.323 24.941 1.00 0.00 H new ATOM 0 HD22 LEU A 69 53.811 46.914 24.980 1.00 0.00 H new ATOM 0 HD23 LEU A 69 54.191 46.071 26.501 1.00 0.00 H new ATOM 1115 N VAL A 70 53.305 45.052 28.768 1.00 0.00 N ATOM 1116 CA VAL A 70 54.461 45.078 29.641 1.00 0.00 C ATOM 1117 C VAL A 70 55.618 44.262 29.060 1.00 0.00 C ATOM 1118 O VAL A 70 55.453 43.588 28.045 1.00 0.00 O ATOM 1119 CB VAL A 70 54.106 44.609 31.049 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.219 45.618 31.774 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.425 43.244 31.095 1.00 0.00 C ATOM 0 H VAL A 70 53.162 44.130 28.357 1.00 0.00 H new ATOM 0 HA VAL A 70 54.792 46.114 29.713 1.00 0.00 H new ATOM 0 HB VAL A 70 55.068 44.520 31.554 1.00 0.00 H new ATOM 0 HG11 VAL A 70 52.988 45.248 32.773 1.00 0.00 H new ATOM 0 HG12 VAL A 70 53.741 46.572 31.852 1.00 0.00 H new ATOM 0 HG13 VAL A 70 52.293 45.756 31.215 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.205 42.982 32.130 1.00 0.00 H new ATOM 0 HG22 VAL A 70 52.497 43.281 30.525 1.00 0.00 H new ATOM 0 HG23 VAL A 70 54.086 42.493 30.663 1.00 0.00 H new