USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 ASN : amide:sc= 0.581 K(o=1.2,f=-1.2) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.644 K(o=1.2,f=-0.3) USER MOD Set 2.1: A 55 THR OG1 : rot 134:sc= 1.37 USER MOD Set 2.2: A 57 SER OG : rot 180:sc= 0.75 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 2.25 (180deg=1.96) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -122:sc= 0.585 (180deg=-0.0647) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -78:sc= 0.097 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 119:sc= 1.29 USER MOD Single : A 25 ASN : amide:sc= -0.301 K(o=-0.3,f=-2.6!) USER MOD Single : A 27 LYS NZ :NH3+ -144:sc= 1.06 (180deg=-0.315!) USER MOD Single : A 29 LYS NZ :NH3+ 167:sc= 1.81 (180deg=1.64) USER MOD Single : A 31 GLN : amide:sc= -0.165 K(o=-0.17,f=-3.6!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 41 GLN : amide:sc= 1.28 K(o=1.3,f=-3.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 59 TYR OH : rot 70:sc= 0.39 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -150:sc= 0.0717 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 33.227 52.289 20.036 1.00 0.00 N ATOM 2 CA MET A 1 33.545 52.566 21.445 1.00 0.00 C ATOM 3 C MET A 1 35.052 52.785 21.603 1.00 0.00 C ATOM 4 O MET A 1 35.829 52.177 20.870 1.00 0.00 O ATOM 5 CB MET A 1 33.017 51.486 22.384 1.00 0.00 C ATOM 6 CG MET A 1 33.671 50.119 22.204 1.00 0.00 C ATOM 7 SD MET A 1 33.033 48.840 23.314 1.00 0.00 S ATOM 8 CE MET A 1 34.167 47.486 22.920 1.00 0.00 C ATOM 0 H1 MET A 1 32.196 52.309 19.902 1.00 0.00 H new ATOM 0 H2 MET A 1 33.668 53.011 19.432 1.00 0.00 H new ATOM 0 H3 MET A 1 33.592 51.350 19.776 1.00 0.00 H new ATOM 0 HA MET A 1 33.032 53.482 21.736 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.164 51.813 23.413 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.942 51.384 22.233 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.529 49.794 21.173 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.745 50.219 22.362 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.913 46.612 23.520 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.082 47.236 21.862 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.190 47.792 23.140 1.00 0.00 H new ATOM 20 N GLN A 2 35.472 53.590 22.574 1.00 0.00 N ATOM 21 CA GLN A 2 36.868 53.715 22.941 1.00 0.00 C ATOM 22 C GLN A 2 37.276 52.623 23.931 1.00 0.00 C ATOM 23 O GLN A 2 36.533 52.332 24.865 1.00 0.00 O ATOM 24 CB GLN A 2 37.183 55.100 23.496 1.00 0.00 C ATOM 25 CG GLN A 2 37.142 56.186 22.426 1.00 0.00 C ATOM 26 CD GLN A 2 37.625 57.556 22.906 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.957 57.791 24.066 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.663 58.547 22.020 1.00 0.00 N ATOM 0 H GLN A 2 34.846 54.175 23.128 1.00 0.00 H new ATOM 0 HA GLN A 2 37.456 53.586 22.032 1.00 0.00 H new ATOM 0 HB2 GLN A 2 36.468 55.343 24.282 1.00 0.00 H new ATOM 0 HB3 GLN A 2 38.171 55.086 23.956 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.756 55.872 21.582 1.00 0.00 H new ATOM 0 HG3 GLN A 2 36.120 56.281 22.059 1.00 0.00 H new ATOM 0 HE21 GLN A 2 37.392 58.376 21.052 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.963 59.478 22.309 1.00 0.00 H new ATOM 37 N ILE A 3 38.483 52.085 23.773 1.00 0.00 N ATOM 38 CA ILE A 3 39.204 51.332 24.778 1.00 0.00 C ATOM 39 C ILE A 3 40.621 51.890 24.930 1.00 0.00 C ATOM 40 O ILE A 3 41.143 52.504 24.002 1.00 0.00 O ATOM 41 CB ILE A 3 39.208 49.830 24.506 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.934 49.458 23.217 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.787 49.273 24.542 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.136 47.961 23.002 1.00 0.00 C ATOM 0 H ILE A 3 39.002 52.170 22.899 1.00 0.00 H new ATOM 0 HA ILE A 3 38.677 51.454 25.724 1.00 0.00 H new ATOM 0 HB ILE A 3 39.779 49.362 25.308 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.373 49.859 22.373 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.909 49.946 23.213 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.811 48.201 24.346 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.351 49.452 25.525 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.183 49.767 23.781 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.660 47.796 22.061 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.726 47.552 23.822 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.166 47.464 22.969 1.00 0.00 H new ATOM 56 N PHE A 4 41.247 51.671 26.082 1.00 0.00 N ATOM 57 CA PHE A 4 42.505 52.300 26.435 1.00 0.00 C ATOM 58 C PHE A 4 43.602 51.281 26.748 1.00 0.00 C ATOM 59 O PHE A 4 43.413 50.417 27.601 1.00 0.00 O ATOM 60 CB PHE A 4 42.296 53.244 27.616 1.00 0.00 C ATOM 61 CG PHE A 4 41.130 54.191 27.465 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.112 55.120 26.418 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.061 54.136 28.366 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.020 55.982 26.262 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.986 55.023 28.231 1.00 0.00 C ATOM 66 CZ PHE A 4 38.955 55.935 27.169 1.00 0.00 C ATOM 0 H PHE A 4 40.887 51.044 26.801 1.00 0.00 H new ATOM 0 HA PHE A 4 42.844 52.868 25.568 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.150 52.650 28.518 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.205 53.828 27.763 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.942 55.172 25.729 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.065 53.410 29.165 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.999 56.684 25.441 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.179 55.004 28.948 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.112 56.600 27.050 1.00 0.00 H new ATOM 76 N VAL A 5 44.757 51.391 26.099 1.00 0.00 N ATOM 77 CA VAL A 5 45.850 50.450 26.244 1.00 0.00 C ATOM 78 C VAL A 5 47.087 51.127 26.839 1.00 0.00 C ATOM 79 O VAL A 5 47.665 52.023 26.227 1.00 0.00 O ATOM 80 CB VAL A 5 46.158 49.755 24.921 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.098 48.574 25.155 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.916 49.205 24.226 1.00 0.00 C ATOM 0 H VAL A 5 44.958 52.150 25.448 1.00 0.00 H new ATOM 0 HA VAL A 5 45.539 49.677 26.947 1.00 0.00 H new ATOM 0 HB VAL A 5 46.608 50.518 24.286 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.311 48.085 24.205 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.028 48.931 25.596 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.626 47.862 25.832 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.205 48.724 23.292 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.429 48.476 24.874 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.225 50.022 24.015 1.00 0.00 H new ATOM 92 N LYS A 6 47.484 50.718 28.041 1.00 0.00 N ATOM 93 CA LYS A 6 48.567 51.266 28.830 1.00 0.00 C ATOM 94 C LYS A 6 49.918 50.632 28.496 1.00 0.00 C ATOM 95 O LYS A 6 50.002 49.414 28.353 1.00 0.00 O ATOM 96 CB LYS A 6 48.203 51.116 30.305 1.00 0.00 C ATOM 97 CG LYS A 6 49.165 51.843 31.238 1.00 0.00 C ATOM 98 CD LYS A 6 48.720 51.731 32.694 1.00 0.00 C ATOM 99 CE LYS A 6 49.742 52.430 33.586 1.00 0.00 C ATOM 100 NZ LYS A 6 49.416 52.285 35.013 1.00 0.00 N ATOM 0 H LYS A 6 47.022 49.942 28.515 1.00 0.00 H new ATOM 0 HA LYS A 6 48.689 52.322 28.590 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.195 51.498 30.464 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.188 50.057 30.563 1.00 0.00 H new ATOM 0 HG2 LYS A 6 50.166 51.425 31.129 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.225 52.894 30.954 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.737 52.184 32.822 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.627 50.683 32.979 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.732 52.016 33.396 1.00 0.00 H new ATOM 0 HE3 LYS A 6 49.784 53.488 33.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 50.134 52.774 35.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 48.482 52.702 35.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 49.401 51.276 35.265 1.00 0.00 H new ATOM 168 N LYS A 11 52.241 55.765 28.872 1.00 0.00 N ATOM 169 CA LYS A 11 51.305 56.217 27.861 1.00 0.00 C ATOM 170 C LYS A 11 50.009 55.408 27.945 1.00 0.00 C ATOM 171 O LYS A 11 50.021 54.259 28.379 1.00 0.00 O ATOM 172 CB LYS A 11 51.913 56.138 26.463 1.00 0.00 C ATOM 173 CG LYS A 11 53.208 56.932 26.318 1.00 0.00 C ATOM 174 CD LYS A 11 53.537 57.255 24.863 1.00 0.00 C ATOM 175 CE LYS A 11 53.705 56.015 23.989 1.00 0.00 C ATOM 176 NZ LYS A 11 53.971 56.375 22.587 1.00 0.00 N ATOM 0 HA LYS A 11 51.074 57.265 28.053 1.00 0.00 H new ATOM 0 HB2 LYS A 11 52.107 55.094 26.218 1.00 0.00 H new ATOM 0 HB3 LYS A 11 51.187 56.506 25.738 1.00 0.00 H new ATOM 0 HG2 LYS A 11 53.126 57.860 26.883 1.00 0.00 H new ATOM 0 HG3 LYS A 11 54.029 56.364 26.755 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.744 57.878 24.449 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.455 57.842 24.828 1.00 0.00 H new ATOM 0 HE2 LYS A 11 54.525 55.407 24.372 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.803 55.405 24.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 53.241 55.955 21.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.954 57.410 22.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 54.906 56.015 22.307 1.00 0.00 H new ATOM 190 N THR A 12 48.900 55.979 27.484 1.00 0.00 N ATOM 191 CA THR A 12 47.644 55.285 27.282 1.00 0.00 C ATOM 192 C THR A 12 47.116 55.578 25.876 1.00 0.00 C ATOM 193 O THR A 12 46.781 56.714 25.547 1.00 0.00 O ATOM 194 CB THR A 12 46.600 55.568 28.357 1.00 0.00 C ATOM 195 OG1 THR A 12 46.452 56.938 28.656 1.00 0.00 O ATOM 196 CG2 THR A 12 46.936 54.856 29.665 1.00 0.00 C ATOM 0 H THR A 12 48.855 56.967 27.235 1.00 0.00 H new ATOM 0 HA THR A 12 47.847 54.218 27.375 1.00 0.00 H new ATOM 0 HB THR A 12 45.668 55.195 27.933 1.00 0.00 H new ATOM 0 HG1 THR A 12 45.768 57.050 29.349 1.00 0.00 H new ATOM 0 HG21 THR A 12 46.171 55.080 30.408 1.00 0.00 H new ATOM 0 HG22 THR A 12 46.972 53.780 29.495 1.00 0.00 H new ATOM 0 HG23 THR A 12 47.905 55.199 30.027 1.00 0.00 H new ATOM 204 N ILE A 13 47.114 54.547 25.036 1.00 0.00 N ATOM 205 CA ILE A 13 46.741 54.599 23.638 1.00 0.00 C ATOM 206 C ILE A 13 45.228 54.405 23.522 1.00 0.00 C ATOM 207 O ILE A 13 44.705 53.402 24.003 1.00 0.00 O ATOM 208 CB ILE A 13 47.519 53.548 22.851 1.00 0.00 C ATOM 209 CG1 ILE A 13 49.022 53.528 23.112 1.00 0.00 C ATOM 210 CG2 ILE A 13 47.264 53.697 21.354 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.770 54.839 22.888 1.00 0.00 C ATOM 0 H ILE A 13 47.387 53.610 25.333 1.00 0.00 H new ATOM 0 HA ILE A 13 46.994 55.570 23.211 1.00 0.00 H new ATOM 0 HB ILE A 13 47.138 52.593 23.214 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.185 53.214 24.143 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.469 52.767 22.473 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.828 52.938 20.812 1.00 0.00 H new ATOM 0 HG22 ILE A 13 46.200 53.572 21.152 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.581 54.687 21.028 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.828 54.696 23.106 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.653 55.152 21.851 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.364 55.607 23.547 1.00 0.00 H new ATOM 223 N THR A 14 44.525 55.343 22.893 1.00 0.00 N ATOM 224 CA THR A 14 43.090 55.280 22.696 1.00 0.00 C ATOM 225 C THR A 14 42.760 54.611 21.360 1.00 0.00 C ATOM 226 O THR A 14 43.158 55.113 20.312 1.00 0.00 O ATOM 227 CB THR A 14 42.459 56.667 22.770 1.00 0.00 C ATOM 228 OG1 THR A 14 42.668 57.212 24.053 1.00 0.00 O ATOM 229 CG2 THR A 14 40.947 56.644 22.563 1.00 0.00 C ATOM 0 H THR A 14 44.951 56.183 22.500 1.00 0.00 H new ATOM 0 HA THR A 14 42.669 54.678 23.501 1.00 0.00 H new ATOM 0 HB THR A 14 42.926 57.253 21.979 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.037 56.810 24.686 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.556 57.659 22.627 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.720 56.229 21.581 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.484 56.028 23.333 1.00 0.00 H new ATOM 237 N LEU A 15 42.022 53.505 21.390 1.00 0.00 N ATOM 238 CA LEU A 15 41.609 52.754 20.222 1.00 0.00 C ATOM 239 C LEU A 15 40.097 52.839 20.012 1.00 0.00 C ATOM 240 O LEU A 15 39.337 52.653 20.961 1.00 0.00 O ATOM 241 CB LEU A 15 42.032 51.294 20.364 1.00 0.00 C ATOM 242 CG LEU A 15 43.506 51.045 20.667 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.733 49.540 20.785 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.434 51.586 19.584 1.00 0.00 C ATOM 0 H LEU A 15 41.686 53.097 22.263 1.00 0.00 H new ATOM 0 HA LEU A 15 42.097 53.191 19.351 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.438 50.841 21.158 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.780 50.773 19.440 1.00 0.00 H new ATOM 0 HG LEU A 15 43.740 51.567 21.595 1.00 0.00 H new ATOM 0 HD11 LEU A 15 44.784 49.346 21.002 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.117 49.141 21.591 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.461 49.056 19.847 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.469 51.379 19.855 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.204 51.104 18.634 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.292 52.662 19.488 1.00 0.00 H new ATOM 256 N GLU A 16 39.671 53.066 18.773 1.00 0.00 N ATOM 257 CA GLU A 16 38.277 53.093 18.378 1.00 0.00 C ATOM 258 C GLU A 16 37.886 51.744 17.771 1.00 0.00 C ATOM 259 O GLU A 16 38.380 51.340 16.721 1.00 0.00 O ATOM 260 CB GLU A 16 38.049 54.298 17.471 1.00 0.00 C ATOM 261 CG GLU A 16 36.643 54.454 16.897 1.00 0.00 C ATOM 262 CD GLU A 16 35.549 54.553 17.961 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.453 55.592 18.649 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.735 53.613 18.081 1.00 0.00 O ATOM 0 H GLU A 16 40.310 53.241 17.997 1.00 0.00 H new ATOM 0 HA GLU A 16 37.614 53.224 19.233 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.292 55.200 18.033 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.753 54.240 16.641 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.612 55.348 16.274 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.430 53.605 16.248 1.00 0.00 H new ATOM 271 N VAL A 17 37.045 51.006 18.490 1.00 0.00 N ATOM 272 CA VAL A 17 36.741 49.609 18.258 1.00 0.00 C ATOM 273 C VAL A 17 35.236 49.334 18.319 1.00 0.00 C ATOM 274 O VAL A 17 34.466 50.128 18.855 1.00 0.00 O ATOM 275 CB VAL A 17 37.478 48.706 19.243 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.993 48.812 19.104 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.103 48.984 20.697 1.00 0.00 C ATOM 0 H VAL A 17 36.536 51.390 19.286 1.00 0.00 H new ATOM 0 HA VAL A 17 37.087 49.379 17.250 1.00 0.00 H new ATOM 0 HB VAL A 17 37.161 47.696 18.985 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.472 48.151 19.826 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.287 48.521 18.095 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.304 49.840 19.291 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.658 48.312 21.351 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.349 50.017 20.945 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.034 48.822 20.834 1.00 0.00 H new ATOM 287 N GLU A 18 34.822 48.170 17.825 1.00 0.00 N ATOM 288 CA GLU A 18 33.503 47.614 18.055 1.00 0.00 C ATOM 289 C GLU A 18 33.618 46.296 18.823 1.00 0.00 C ATOM 290 O GLU A 18 34.645 45.632 18.705 1.00 0.00 O ATOM 291 CB GLU A 18 32.773 47.414 16.730 1.00 0.00 C ATOM 292 CG GLU A 18 32.586 48.682 15.903 1.00 0.00 C ATOM 293 CD GLU A 18 31.845 49.800 16.638 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.865 49.531 17.366 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.210 50.982 16.463 1.00 0.00 O ATOM 0 H GLU A 18 35.412 47.578 17.241 1.00 0.00 H new ATOM 0 HA GLU A 18 32.922 48.313 18.657 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.324 46.687 16.134 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.793 46.982 16.933 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.565 49.050 15.595 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.038 48.433 14.994 1.00 0.00 H new ATOM 302 N PRO A 19 32.614 45.860 19.579 1.00 0.00 N ATOM 303 CA PRO A 19 32.656 44.604 20.301 1.00 0.00 C ATOM 304 C PRO A 19 32.959 43.367 19.453 1.00 0.00 C ATOM 305 O PRO A 19 33.520 42.398 19.961 1.00 0.00 O ATOM 306 CB PRO A 19 31.297 44.471 20.984 1.00 0.00 C ATOM 307 CG PRO A 19 30.856 45.920 21.170 1.00 0.00 C ATOM 308 CD PRO A 19 31.418 46.600 19.926 1.00 0.00 C ATOM 0 HA PRO A 19 33.491 44.638 21.001 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.591 43.911 20.370 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.375 43.948 21.937 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.771 46.010 21.226 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.259 46.352 22.086 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.696 46.581 19.110 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.649 47.647 20.123 1.00 0.00 H new ATOM 316 N SER A 20 32.628 43.406 18.166 1.00 0.00 N ATOM 317 CA SER A 20 32.936 42.383 17.188 1.00 0.00 C ATOM 318 C SER A 20 34.371 42.384 16.659 1.00 0.00 C ATOM 319 O SER A 20 34.727 41.482 15.904 1.00 0.00 O ATOM 320 CB SER A 20 31.968 42.502 16.015 1.00 0.00 C ATOM 321 OG SER A 20 32.089 43.771 15.413 1.00 0.00 O ATOM 0 H SER A 20 32.114 44.190 17.764 1.00 0.00 H new ATOM 0 HA SER A 20 32.826 41.437 17.718 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.175 41.722 15.282 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.945 42.351 16.361 1.00 0.00 H new ATOM 0 HG SER A 20 31.465 43.837 14.660 1.00 0.00 H new ATOM 327 N ASP A 21 35.201 43.367 16.998 1.00 0.00 N ATOM 328 CA ASP A 21 36.602 43.374 16.628 1.00 0.00 C ATOM 329 C ASP A 21 37.346 42.227 17.316 1.00 0.00 C ATOM 330 O ASP A 21 37.025 41.854 18.443 1.00 0.00 O ATOM 331 CB ASP A 21 37.279 44.701 16.954 1.00 0.00 C ATOM 332 CG ASP A 21 36.844 45.878 16.078 1.00 0.00 C ATOM 333 OD1 ASP A 21 36.199 45.690 15.025 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.210 47.031 16.397 1.00 0.00 O ATOM 0 H ASP A 21 34.913 44.182 17.540 1.00 0.00 H new ATOM 0 HA ASP A 21 36.645 43.238 15.547 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.078 44.949 17.996 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.358 44.575 16.859 1.00 0.00 H new ATOM 339 N THR A 22 38.356 41.676 16.650 1.00 0.00 N ATOM 340 CA THR A 22 39.150 40.564 17.131 1.00 0.00 C ATOM 341 C THR A 22 40.571 40.980 17.519 1.00 0.00 C ATOM 342 O THR A 22 41.078 41.999 17.057 1.00 0.00 O ATOM 343 CB THR A 22 39.180 39.404 16.141 1.00 0.00 C ATOM 344 OG1 THR A 22 39.591 39.849 14.868 1.00 0.00 O ATOM 345 CG2 THR A 22 37.817 38.747 15.942 1.00 0.00 C ATOM 0 H THR A 22 38.649 42.006 15.731 1.00 0.00 H new ATOM 0 HA THR A 22 38.652 40.217 18.036 1.00 0.00 H new ATOM 0 HB THR A 22 39.875 38.682 16.571 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.419 39.392 14.613 1.00 0.00 H new ATOM 0 HG21 THR A 22 37.908 37.930 15.226 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.459 38.357 16.895 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.110 39.484 15.563 1.00 0.00 H new ATOM 353 N ILE A 23 41.218 40.199 18.379 1.00 0.00 N ATOM 354 CA ILE A 23 42.471 40.571 19.003 1.00 0.00 C ATOM 355 C ILE A 23 43.594 40.837 17.998 1.00 0.00 C ATOM 356 O ILE A 23 44.357 41.777 18.206 1.00 0.00 O ATOM 357 CB ILE A 23 42.822 39.535 20.067 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.849 39.526 21.242 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.251 39.660 20.589 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.706 40.820 22.037 1.00 0.00 C ATOM 0 H ILE A 23 40.878 39.280 18.662 1.00 0.00 H new ATOM 0 HA ILE A 23 42.346 41.535 19.497 1.00 0.00 H new ATOM 0 HB ILE A 23 42.736 38.583 19.544 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.864 39.251 20.864 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.157 38.739 21.930 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.432 38.893 21.342 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.952 39.531 19.764 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.391 40.645 21.034 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.985 40.675 22.841 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.672 41.095 22.461 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.359 41.616 21.378 1.00 0.00 H new ATOM 372 N GLU A 24 43.679 40.124 16.878 1.00 0.00 N ATOM 373 CA GLU A 24 44.686 40.381 15.869 1.00 0.00 C ATOM 374 C GLU A 24 44.436 41.660 15.067 1.00 0.00 C ATOM 375 O GLU A 24 45.385 42.303 14.624 1.00 0.00 O ATOM 376 CB GLU A 24 44.918 39.146 15.004 1.00 0.00 C ATOM 377 CG GLU A 24 44.214 39.067 13.652 1.00 0.00 C ATOM 378 CD GLU A 24 42.688 38.957 13.690 1.00 0.00 C ATOM 379 OE1 GLU A 24 42.058 39.161 14.750 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.088 38.657 12.635 1.00 0.00 O ATOM 0 H GLU A 24 43.050 39.354 16.651 1.00 0.00 H new ATOM 0 HA GLU A 24 45.621 40.581 16.391 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.990 39.061 14.826 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.621 38.273 15.585 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.479 39.953 13.075 1.00 0.00 H new ATOM 0 HG3 GLU A 24 44.606 38.206 13.111 1.00 0.00 H new ATOM 387 N ASN A 25 43.178 42.067 14.926 1.00 0.00 N ATOM 388 CA ASN A 25 42.797 43.344 14.356 1.00 0.00 C ATOM 389 C ASN A 25 43.037 44.504 15.325 1.00 0.00 C ATOM 390 O ASN A 25 43.523 45.555 14.916 1.00 0.00 O ATOM 391 CB ASN A 25 41.341 43.284 13.903 1.00 0.00 C ATOM 392 CG ASN A 25 40.873 44.611 13.303 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.093 45.352 13.895 1.00 0.00 O ATOM 394 ND2 ASN A 25 41.338 44.957 12.105 1.00 0.00 N ATOM 0 H ASN A 25 42.380 41.500 15.214 1.00 0.00 H new ATOM 0 HA ASN A 25 43.431 43.537 13.491 1.00 0.00 H new ATOM 0 HB2 ASN A 25 41.223 42.491 13.165 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.707 43.026 14.752 1.00 0.00 H new ATOM 0 HD21 ASN A 25 41.046 45.837 11.679 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.986 44.342 11.612 1.00 0.00 H new ATOM 401 N VAL A 26 42.792 44.321 16.620 1.00 0.00 N ATOM 402 CA VAL A 26 43.112 45.315 17.625 1.00 0.00 C ATOM 403 C VAL A 26 44.622 45.558 17.681 1.00 0.00 C ATOM 404 O VAL A 26 45.050 46.707 17.749 1.00 0.00 O ATOM 405 CB VAL A 26 42.512 44.942 18.978 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.901 45.913 20.089 1.00 0.00 C ATOM 407 CG2 VAL A 26 40.987 44.951 18.908 1.00 0.00 C ATOM 0 H VAL A 26 42.365 43.475 16.997 1.00 0.00 H new ATOM 0 HA VAL A 26 42.654 46.263 17.343 1.00 0.00 H new ATOM 0 HB VAL A 26 42.904 43.951 19.206 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.444 45.595 21.026 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.985 45.924 20.199 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.552 46.914 19.836 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.577 44.683 19.881 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.641 45.947 18.630 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.653 44.230 18.162 1.00 0.00 H new ATOM 417 N LYS A 27 45.443 44.523 17.526 1.00 0.00 N ATOM 418 CA LYS A 27 46.876 44.669 17.366 1.00 0.00 C ATOM 419 C LYS A 27 47.265 45.415 16.088 1.00 0.00 C ATOM 420 O LYS A 27 48.174 46.241 16.124 1.00 0.00 O ATOM 421 CB LYS A 27 47.543 43.298 17.426 1.00 0.00 C ATOM 422 CG LYS A 27 47.463 42.679 18.817 1.00 0.00 C ATOM 423 CD LYS A 27 47.939 41.229 18.779 1.00 0.00 C ATOM 424 CE LYS A 27 47.802 40.619 20.171 1.00 0.00 C ATOM 425 NZ LYS A 27 48.299 39.234 20.177 1.00 0.00 N ATOM 0 H LYS A 27 45.124 43.554 17.509 1.00 0.00 H new ATOM 0 HA LYS A 27 47.234 45.285 18.191 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.067 42.632 16.706 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.588 43.391 17.131 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.075 43.252 19.513 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.437 42.723 19.184 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.351 40.659 18.060 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.977 41.183 18.449 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.360 41.215 20.893 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.757 40.638 20.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 47.713 38.658 20.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.250 38.844 19.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.285 39.221 20.507 1.00 0.00 H new ATOM 439 N ALA A 28 46.557 45.213 14.981 1.00 0.00 N ATOM 440 CA ALA A 28 46.756 45.988 13.773 1.00 0.00 C ATOM 441 C ALA A 28 46.358 47.457 13.936 1.00 0.00 C ATOM 442 O ALA A 28 47.033 48.335 13.402 1.00 0.00 O ATOM 443 CB ALA A 28 46.027 45.311 12.617 1.00 0.00 C ATOM 0 H ALA A 28 45.828 44.504 14.902 1.00 0.00 H new ATOM 0 HA ALA A 28 47.823 46.011 13.551 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.174 45.890 11.705 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.424 44.306 12.476 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.962 45.253 12.843 1.00 0.00 H new ATOM 449 N LYS A 29 45.329 47.764 14.720 1.00 0.00 N ATOM 450 CA LYS A 29 44.951 49.115 15.084 1.00 0.00 C ATOM 451 C LYS A 29 45.997 49.788 15.973 1.00 0.00 C ATOM 452 O LYS A 29 46.205 50.992 15.847 1.00 0.00 O ATOM 453 CB LYS A 29 43.567 49.129 15.726 1.00 0.00 C ATOM 454 CG LYS A 29 42.434 48.843 14.745 1.00 0.00 C ATOM 455 CD LYS A 29 41.078 48.786 15.443 1.00 0.00 C ATOM 456 CE LYS A 29 39.964 48.709 14.402 1.00 0.00 C ATOM 457 NZ LYS A 29 38.626 48.908 14.981 1.00 0.00 N ATOM 0 H LYS A 29 44.721 47.055 15.129 1.00 0.00 H new ATOM 0 HA LYS A 29 44.905 49.704 14.168 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.539 48.389 16.525 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.400 50.102 16.187 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.415 49.616 13.977 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.622 47.896 14.239 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.034 47.918 16.101 1.00 0.00 H new ATOM 0 HD3 LYS A 29 40.943 49.668 16.069 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.138 49.463 13.634 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.000 47.738 13.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 37.937 49.065 14.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.354 48.064 15.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.640 49.736 15.611 1.00 0.00 H new ATOM 471 N ILE A 30 46.707 49.031 16.807 1.00 0.00 N ATOM 472 CA ILE A 30 47.845 49.490 17.578 1.00 0.00 C ATOM 473 C ILE A 30 49.060 49.751 16.685 1.00 0.00 C ATOM 474 O ILE A 30 49.727 50.767 16.872 1.00 0.00 O ATOM 475 CB ILE A 30 48.161 48.528 18.720 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.056 48.588 19.771 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.507 48.818 19.377 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.091 47.439 20.774 1.00 0.00 C ATOM 0 H ILE A 30 46.492 48.046 16.965 1.00 0.00 H new ATOM 0 HA ILE A 30 47.579 50.446 18.030 1.00 0.00 H new ATOM 0 HB ILE A 30 48.218 47.529 18.289 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.134 49.531 20.312 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.089 48.588 19.267 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.680 48.104 20.182 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.301 48.728 18.635 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.503 49.829 19.784 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.275 47.554 21.487 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.981 46.492 20.246 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.042 47.450 21.306 1.00 0.00 H new ATOM 490 N GLN A 31 49.338 48.917 15.687 1.00 0.00 N ATOM 491 CA GLN A 31 50.407 49.152 14.737 1.00 0.00 C ATOM 492 C GLN A 31 50.214 50.480 14.002 1.00 0.00 C ATOM 493 O GLN A 31 51.181 51.201 13.770 1.00 0.00 O ATOM 494 CB GLN A 31 50.506 47.993 13.749 1.00 0.00 C ATOM 495 CG GLN A 31 51.787 48.047 12.922 1.00 0.00 C ATOM 496 CD GLN A 31 51.735 47.089 11.731 1.00 0.00 C ATOM 497 OE1 GLN A 31 52.140 45.930 11.796 1.00 0.00 O ATOM 498 NE2 GLN A 31 51.227 47.535 10.585 1.00 0.00 N ATOM 0 H GLN A 31 48.821 48.054 15.518 1.00 0.00 H new ATOM 0 HA GLN A 31 51.344 49.215 15.291 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.467 47.050 14.294 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.644 48.012 13.082 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.946 49.064 12.564 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.639 47.795 13.554 1.00 0.00 H new ATOM 0 HE21 GLN A 31 50.887 48.494 10.517 1.00 0.00 H new ATOM 0 HE22 GLN A 31 51.177 46.918 9.775 1.00 0.00 H new ATOM 507 N ASP A 32 48.978 50.866 13.699 1.00 0.00 N ATOM 508 CA ASP A 32 48.669 52.134 13.068 1.00 0.00 C ATOM 509 C ASP A 32 49.014 53.368 13.903 1.00 0.00 C ATOM 510 O ASP A 32 49.138 54.458 13.351 1.00 0.00 O ATOM 511 CB ASP A 32 47.201 52.142 12.648 1.00 0.00 C ATOM 512 CG ASP A 32 46.983 52.995 11.397 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.543 52.623 10.344 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.260 54.014 11.455 1.00 0.00 O ATOM 0 H ASP A 32 48.155 50.295 13.890 1.00 0.00 H new ATOM 0 HA ASP A 32 49.316 52.211 12.194 1.00 0.00 H new ATOM 0 HB2 ASP A 32 46.870 51.121 12.456 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.590 52.527 13.464 1.00 0.00 H new ATOM 519 N LYS A 33 49.185 53.212 15.212 1.00 0.00 N ATOM 520 CA LYS A 33 49.496 54.257 16.166 1.00 0.00 C ATOM 521 C LYS A 33 50.923 54.224 16.717 1.00 0.00 C ATOM 522 O LYS A 33 51.541 55.278 16.849 1.00 0.00 O ATOM 523 CB LYS A 33 48.475 54.221 17.301 1.00 0.00 C ATOM 524 CG LYS A 33 47.152 54.866 16.900 1.00 0.00 C ATOM 525 CD LYS A 33 46.108 54.719 18.003 1.00 0.00 C ATOM 526 CE LYS A 33 44.885 55.595 17.741 1.00 0.00 C ATOM 527 NZ LYS A 33 45.063 56.952 18.278 1.00 0.00 N ATOM 0 H LYS A 33 49.104 52.297 15.655 1.00 0.00 H new ATOM 0 HA LYS A 33 49.435 55.198 15.620 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.299 53.187 17.598 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.881 54.737 18.171 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.310 55.923 16.685 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.783 54.406 15.983 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.800 53.676 18.076 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.551 54.989 18.962 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.700 55.650 16.668 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.006 55.137 18.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.213 57.518 18.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 45.215 56.902 19.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.887 57.398 17.828 1.00 0.00 H new ATOM 541 N GLU A 34 51.447 53.047 17.047 1.00 0.00 N ATOM 542 CA GLU A 34 52.741 52.856 17.672 1.00 0.00 C ATOM 543 C GLU A 34 53.784 52.190 16.773 1.00 0.00 C ATOM 544 O GLU A 34 54.972 52.250 17.084 1.00 0.00 O ATOM 545 CB GLU A 34 52.574 52.053 18.959 1.00 0.00 C ATOM 546 CG GLU A 34 51.965 52.832 20.121 1.00 0.00 C ATOM 547 CD GLU A 34 52.941 53.859 20.697 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.808 53.507 21.524 1.00 0.00 O ATOM 549 OE2 GLU A 34 52.868 55.052 20.328 1.00 0.00 O ATOM 0 H GLU A 34 50.958 52.168 16.877 1.00 0.00 H new ATOM 0 HA GLU A 34 53.126 53.854 17.883 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.946 51.186 18.752 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.549 51.675 19.264 1.00 0.00 H new ATOM 0 HG2 GLU A 34 51.062 53.340 19.783 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.665 52.137 20.906 1.00 0.00 H new ATOM 556 N GLY A 35 53.388 51.569 15.665 1.00 0.00 N ATOM 557 CA GLY A 35 54.276 50.944 14.705 1.00 0.00 C ATOM 558 C GLY A 35 54.777 49.542 15.053 1.00 0.00 C ATOM 559 O GLY A 35 55.437 48.925 14.220 1.00 0.00 O ATOM 0 H GLY A 35 52.404 51.488 15.407 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.761 50.894 13.746 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.142 51.592 14.569 1.00 0.00 H new ATOM 563 N ILE A 36 54.454 49.008 16.227 1.00 0.00 N ATOM 564 CA ILE A 36 54.875 47.697 16.678 1.00 0.00 C ATOM 565 C ILE A 36 54.148 46.602 15.895 1.00 0.00 C ATOM 566 O ILE A 36 52.920 46.577 15.941 1.00 0.00 O ATOM 567 CB ILE A 36 54.648 47.539 18.178 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.357 48.597 19.018 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.059 46.151 18.662 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.867 48.677 18.817 1.00 0.00 C ATOM 0 H ILE A 36 53.873 49.496 16.909 1.00 0.00 H new ATOM 0 HA ILE A 36 55.944 47.597 16.491 1.00 0.00 H new ATOM 0 HB ILE A 36 53.576 47.675 18.319 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.923 49.571 18.790 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.156 48.398 20.071 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.884 46.073 19.735 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.470 45.395 18.142 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.117 45.992 18.455 1.00 0.00 H new ATOM 0 HD11 ILE A 36 57.278 49.458 19.457 1.00 0.00 H new ATOM 0 HD12 ILE A 36 57.320 47.720 19.076 1.00 0.00 H new ATOM 0 HD13 ILE A 36 57.083 48.911 17.775 1.00 0.00 H new ATOM 582 N PRO A 37 54.833 45.678 15.228 1.00 0.00 N ATOM 583 CA PRO A 37 54.188 44.608 14.494 1.00 0.00 C ATOM 584 C PRO A 37 53.351 43.681 15.378 1.00 0.00 C ATOM 585 O PRO A 37 53.746 43.391 16.505 1.00 0.00 O ATOM 586 CB PRO A 37 55.301 43.842 13.784 1.00 0.00 C ATOM 587 CG PRO A 37 56.392 44.898 13.632 1.00 0.00 C ATOM 588 CD PRO A 37 56.254 45.676 14.937 1.00 0.00 C ATOM 0 HA PRO A 37 53.472 45.029 13.788 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.642 42.989 14.370 1.00 0.00 H new ATOM 0 HB3 PRO A 37 54.974 43.456 12.819 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.381 44.452 13.524 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.230 45.531 12.759 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.820 45.203 15.740 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.636 46.691 14.833 1.00 0.00 H new ATOM 596 N PRO A 38 52.215 43.178 14.903 1.00 0.00 N ATOM 597 CA PRO A 38 51.262 42.456 15.721 1.00 0.00 C ATOM 598 C PRO A 38 51.797 41.144 16.298 1.00 0.00 C ATOM 599 O PRO A 38 51.354 40.740 17.371 1.00 0.00 O ATOM 600 CB PRO A 38 50.040 42.237 14.833 1.00 0.00 C ATOM 601 CG PRO A 38 50.607 42.273 13.416 1.00 0.00 C ATOM 602 CD PRO A 38 51.687 43.342 13.563 1.00 0.00 C ATOM 0 HA PRO A 38 51.023 43.038 16.611 1.00 0.00 H new ATOM 0 HB2 PRO A 38 49.557 41.284 15.046 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.291 43.015 14.984 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.018 41.310 13.111 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.854 42.546 12.677 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.469 43.215 12.815 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.272 44.340 13.424 1.00 0.00 H new ATOM 610 N ASP A 39 52.793 40.508 15.687 1.00 0.00 N ATOM 611 CA ASP A 39 53.399 39.300 16.209 1.00 0.00 C ATOM 612 C ASP A 39 54.269 39.535 17.446 1.00 0.00 C ATOM 613 O ASP A 39 54.510 38.595 18.200 1.00 0.00 O ATOM 614 CB ASP A 39 54.157 38.561 15.111 1.00 0.00 C ATOM 615 CG ASP A 39 55.426 39.279 14.647 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.305 40.367 14.044 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.536 38.744 14.863 1.00 0.00 O ATOM 0 H ASP A 39 53.201 40.825 14.808 1.00 0.00 H new ATOM 0 HA ASP A 39 52.582 38.665 16.552 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.424 37.568 15.472 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.496 38.422 14.256 1.00 0.00 H new ATOM 622 N GLN A 40 54.680 40.770 17.716 1.00 0.00 N ATOM 623 CA GLN A 40 55.386 41.153 18.922 1.00 0.00 C ATOM 624 C GLN A 40 54.440 41.523 20.066 1.00 0.00 C ATOM 625 O GLN A 40 54.849 41.515 21.225 1.00 0.00 O ATOM 626 CB GLN A 40 56.355 42.285 18.597 1.00 0.00 C ATOM 627 CG GLN A 40 57.432 42.424 19.669 1.00 0.00 C ATOM 628 CD GLN A 40 58.454 43.538 19.434 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.337 44.379 18.544 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.488 43.578 20.268 1.00 0.00 N ATOM 0 H GLN A 40 54.524 41.551 17.079 1.00 0.00 H new ATOM 0 HA GLN A 40 55.949 40.291 19.279 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.824 42.098 17.631 1.00 0.00 H new ATOM 0 HB3 GLN A 40 55.805 43.222 18.508 1.00 0.00 H new ATOM 0 HG2 GLN A 40 56.945 42.598 20.628 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.965 41.477 19.749 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.578 42.877 21.003 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.192 44.310 20.173 1.00 0.00 H new ATOM 639 N GLN A 41 53.180 41.836 19.779 1.00 0.00 N ATOM 640 CA GLN A 41 52.261 42.377 20.761 1.00 0.00 C ATOM 641 C GLN A 41 51.562 41.290 21.581 1.00 0.00 C ATOM 642 O GLN A 41 50.801 40.499 21.029 1.00 0.00 O ATOM 643 CB GLN A 41 51.207 43.255 20.095 1.00 0.00 C ATOM 644 CG GLN A 41 51.720 44.469 19.326 1.00 0.00 C ATOM 645 CD GLN A 41 50.563 45.269 18.724 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.488 45.393 19.306 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.689 45.821 17.521 1.00 0.00 N ATOM 0 H GLN A 41 52.771 41.719 18.852 1.00 0.00 H new ATOM 0 HA GLN A 41 52.866 42.975 21.442 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.630 42.635 19.409 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.518 43.604 20.864 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.299 45.107 19.993 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.393 44.143 18.533 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.568 45.737 17.011 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.907 46.329 17.108 1.00 0.00 H new ATOM 656 N ARG A 42 51.717 41.306 22.902 1.00 0.00 N ATOM 657 CA ARG A 42 50.770 40.714 23.825 1.00 0.00 C ATOM 658 C ARG A 42 49.766 41.777 24.275 1.00 0.00 C ATOM 659 O ARG A 42 50.174 42.897 24.574 1.00 0.00 O ATOM 660 CB ARG A 42 51.446 40.146 25.070 1.00 0.00 C ATOM 661 CG ARG A 42 52.648 39.233 24.845 1.00 0.00 C ATOM 662 CD ARG A 42 53.135 38.761 26.211 1.00 0.00 C ATOM 663 NE ARG A 42 54.475 38.177 26.147 1.00 0.00 N ATOM 664 CZ ARG A 42 54.814 36.903 25.909 1.00 0.00 C ATOM 665 NH1 ARG A 42 53.909 35.955 25.626 1.00 0.00 N ATOM 666 NH2 ARG A 42 56.108 36.560 25.965 1.00 0.00 N ATOM 0 H ARG A 42 52.518 41.739 23.362 1.00 0.00 H new ATOM 0 HA ARG A 42 50.278 39.897 23.297 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.766 40.981 25.694 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.700 39.591 25.638 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.371 38.382 24.223 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.440 39.767 24.320 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.140 39.602 26.904 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.438 38.024 26.609 1.00 0.00 H new ATOM 0 HE ARG A 42 55.250 38.822 26.304 1.00 0.00 H new ATOM 0 HH11 ARG A 42 52.918 36.192 25.585 1.00 0.00 H new ATOM 0 HH12 ARG A 42 54.212 34.997 25.451 1.00 0.00 H new ATOM 0 HH21 ARG A 42 56.813 37.263 26.185 1.00 0.00 H new ATOM 0 HH22 ARG A 42 56.388 35.595 25.787 1.00 0.00 H new ATOM 680 N LEU A 43 48.491 41.419 24.398 1.00 0.00 N ATOM 681 CA LEU A 43 47.490 42.247 25.041 1.00 0.00 C ATOM 682 C LEU A 43 46.957 41.558 26.299 1.00 0.00 C ATOM 683 O LEU A 43 46.792 40.340 26.312 1.00 0.00 O ATOM 684 CB LEU A 43 46.379 42.613 24.060 1.00 0.00 C ATOM 685 CG LEU A 43 46.821 43.414 22.839 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.619 43.726 21.952 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.482 44.745 23.186 1.00 0.00 C ATOM 0 H LEU A 43 48.125 40.534 24.048 1.00 0.00 H new ATOM 0 HA LEU A 43 47.951 43.183 25.357 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.903 41.694 23.718 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.620 43.186 24.594 1.00 0.00 H new ATOM 0 HG LEU A 43 47.554 42.787 22.331 1.00 0.00 H new ATOM 0 HD11 LEU A 43 45.946 44.298 21.084 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.160 42.795 21.621 1.00 0.00 H new ATOM 0 HD13 LEU A 43 44.891 44.309 22.517 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.770 45.259 22.269 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.781 45.365 23.744 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.369 44.563 23.793 1.00 0.00 H new ATOM 699 N ILE A 44 46.726 42.336 27.353 1.00 0.00 N ATOM 700 CA ILE A 44 46.287 41.861 28.650 1.00 0.00 C ATOM 701 C ILE A 44 45.098 42.686 29.145 1.00 0.00 C ATOM 702 O ILE A 44 45.145 43.913 29.110 1.00 0.00 O ATOM 703 CB ILE A 44 47.440 41.835 29.649 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.642 41.063 29.113 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.002 41.272 30.998 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.856 40.988 30.036 1.00 0.00 C ATOM 0 H ILE A 44 46.845 43.348 27.320 1.00 0.00 H new ATOM 0 HA ILE A 44 45.946 40.831 28.549 1.00 0.00 H new ATOM 0 HB ILE A 44 47.748 42.870 29.796 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.322 40.047 28.883 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.953 41.520 28.174 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.849 41.269 31.683 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.205 41.891 31.409 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.638 40.253 30.866 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.647 40.416 29.551 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.214 41.995 30.248 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.574 40.499 30.969 1.00 0.00 H new ATOM 718 N PHE A 45 44.047 42.021 29.617 1.00 0.00 N ATOM 719 CA PHE A 45 42.853 42.624 30.175 1.00 0.00 C ATOM 720 C PHE A 45 42.389 41.859 31.416 1.00 0.00 C ATOM 721 O PHE A 45 42.287 40.634 31.366 1.00 0.00 O ATOM 722 CB PHE A 45 41.753 42.634 29.117 1.00 0.00 C ATOM 723 CG PHE A 45 40.373 42.958 29.635 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.047 44.279 29.967 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.420 41.945 29.797 1.00 0.00 C ATOM 726 CE1 PHE A 45 38.777 44.582 30.473 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.145 42.247 30.291 1.00 0.00 C ATOM 728 CZ PHE A 45 37.825 43.567 30.631 1.00 0.00 C ATOM 0 H PHE A 45 44.009 41.002 29.618 1.00 0.00 H new ATOM 0 HA PHE A 45 43.078 43.647 30.475 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.016 43.360 28.348 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.724 41.657 28.636 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.776 45.065 29.833 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.669 40.926 29.540 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.531 45.599 30.742 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.411 41.464 30.409 1.00 0.00 H new ATOM 0 HZ PHE A 45 36.844 43.803 31.015 1.00 0.00 H new ATOM 738 N ALA A 46 42.126 42.544 32.525 1.00 0.00 N ATOM 739 CA ALA A 46 41.759 41.951 33.795 1.00 0.00 C ATOM 740 C ALA A 46 42.665 40.797 34.228 1.00 0.00 C ATOM 741 O ALA A 46 42.208 39.787 34.758 1.00 0.00 O ATOM 742 CB ALA A 46 40.270 41.614 33.778 1.00 0.00 C ATOM 0 H ALA A 46 42.166 43.563 32.559 1.00 0.00 H new ATOM 0 HA ALA A 46 41.928 42.687 34.581 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.987 41.167 34.731 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.693 42.525 33.619 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.066 40.909 32.972 1.00 0.00 H new ATOM 748 N GLY A 47 43.962 40.901 33.954 1.00 0.00 N ATOM 749 CA GLY A 47 44.962 39.883 34.204 1.00 0.00 C ATOM 750 C GLY A 47 45.011 38.718 33.213 1.00 0.00 C ATOM 751 O GLY A 47 45.932 37.908 33.300 1.00 0.00 O ATOM 0 H GLY A 47 44.357 41.741 33.531 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.941 40.362 34.217 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.793 39.476 35.201 1.00 0.00 H new ATOM 755 N LYS A 48 44.085 38.615 32.264 1.00 0.00 N ATOM 756 CA LYS A 48 44.056 37.592 31.238 1.00 0.00 C ATOM 757 C LYS A 48 45.038 37.934 30.116 1.00 0.00 C ATOM 758 O LYS A 48 44.922 39.006 29.527 1.00 0.00 O ATOM 759 CB LYS A 48 42.662 37.458 30.632 1.00 0.00 C ATOM 760 CG LYS A 48 41.579 37.103 31.648 1.00 0.00 C ATOM 761 CD LYS A 48 40.213 36.998 30.977 1.00 0.00 C ATOM 762 CE LYS A 48 39.180 36.530 31.999 1.00 0.00 C ATOM 763 NZ LYS A 48 37.839 36.409 31.407 1.00 0.00 N ATOM 0 H LYS A 48 43.307 39.270 32.191 1.00 0.00 H new ATOM 0 HA LYS A 48 44.337 36.651 31.711 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.396 38.396 30.145 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.685 36.692 29.857 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.824 36.157 32.131 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.547 37.861 32.430 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.922 37.965 30.566 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.258 36.298 30.143 1.00 0.00 H new ATOM 0 HE2 LYS A 48 39.485 35.567 32.408 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.148 37.234 32.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 37.167 36.089 32.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 37.537 37.334 31.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 37.864 35.719 30.630 1.00 0.00 H new ATOM 777 N GLN A 49 45.947 37.024 29.774 1.00 0.00 N ATOM 778 CA GLN A 49 46.713 37.127 28.549 1.00 0.00 C ATOM 779 C GLN A 49 45.820 36.738 27.369 1.00 0.00 C ATOM 780 O GLN A 49 45.343 35.609 27.280 1.00 0.00 O ATOM 781 CB GLN A 49 47.983 36.281 28.595 1.00 0.00 C ATOM 782 CG GLN A 49 48.995 36.765 29.630 1.00 0.00 C ATOM 783 CD GLN A 49 50.354 36.073 29.518 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.653 35.316 28.597 1.00 0.00 O ATOM 785 NE2 GLN A 49 51.276 36.309 30.447 1.00 0.00 N ATOM 0 H GLN A 49 46.167 36.203 30.338 1.00 0.00 H new ATOM 0 HA GLN A 49 47.042 38.159 28.426 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.715 35.248 28.815 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.450 36.286 27.610 1.00 0.00 H new ATOM 0 HG2 GLN A 49 49.133 37.840 29.518 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.591 36.598 30.629 1.00 0.00 H new ATOM 0 HE21 GLN A 49 51.066 36.932 31.227 1.00 0.00 H new ATOM 0 HE22 GLN A 49 52.193 35.867 30.379 1.00 0.00 H new ATOM 794 N LEU A 50 45.545 37.699 26.492 1.00 0.00 N ATOM 795 CA LEU A 50 44.561 37.557 25.438 1.00 0.00 C ATOM 796 C LEU A 50 45.110 36.767 24.248 1.00 0.00 C ATOM 797 O LEU A 50 46.305 36.803 23.964 1.00 0.00 O ATOM 798 CB LEU A 50 44.007 38.922 25.040 1.00 0.00 C ATOM 799 CG LEU A 50 43.472 39.771 26.190 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.918 41.084 25.643 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.373 39.069 26.981 1.00 0.00 C ATOM 0 H LEU A 50 46.008 38.608 26.498 1.00 0.00 H new ATOM 0 HA LEU A 50 43.728 36.969 25.822 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.794 39.481 24.533 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.205 38.773 24.317 1.00 0.00 H new ATOM 0 HG LEU A 50 44.308 39.949 26.866 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.536 41.689 26.466 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.711 41.628 25.130 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.110 40.874 24.942 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.031 39.720 27.786 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.538 38.841 26.319 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.764 38.144 27.404 1.00 0.00 H new ATOM 813 N GLU A 51 44.228 36.049 23.559 1.00 0.00 N ATOM 814 CA GLU A 51 44.533 35.156 22.459 1.00 0.00 C ATOM 815 C GLU A 51 43.934 35.661 21.145 1.00 0.00 C ATOM 816 O GLU A 51 42.841 36.221 21.110 1.00 0.00 O ATOM 817 CB GLU A 51 44.056 33.745 22.792 1.00 0.00 C ATOM 818 CG GLU A 51 44.855 33.108 23.926 1.00 0.00 C ATOM 819 CD GLU A 51 44.333 31.729 24.333 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.887 30.944 23.470 1.00 0.00 O ATOM 821 OE2 GLU A 51 44.376 31.400 25.538 1.00 0.00 O ATOM 0 H GLU A 51 43.230 36.080 23.768 1.00 0.00 H new ATOM 0 HA GLU A 51 45.614 35.130 22.319 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.002 33.777 23.069 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.133 33.120 21.902 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.898 33.019 23.621 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.832 33.768 24.793 1.00 0.00 H new ATOM 828 N ASP A 52 44.653 35.459 20.043 1.00 0.00 N ATOM 829 CA ASP A 52 44.425 36.163 18.797 1.00 0.00 C ATOM 830 C ASP A 52 43.154 35.759 18.045 1.00 0.00 C ATOM 831 O ASP A 52 42.673 36.535 17.224 1.00 0.00 O ATOM 832 CB ASP A 52 45.670 36.075 17.920 1.00 0.00 C ATOM 833 CG ASP A 52 46.814 36.937 18.458 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.021 38.066 17.964 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.535 36.512 19.387 1.00 0.00 O ATOM 0 H ASP A 52 45.421 34.789 19.997 1.00 0.00 H new ATOM 0 HA ASP A 52 44.240 37.204 19.063 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.997 35.037 17.858 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.423 36.392 16.907 1.00 0.00 H new ATOM 840 N GLY A 53 42.555 34.607 18.332 1.00 0.00 N ATOM 841 CA GLY A 53 41.378 34.111 17.647 1.00 0.00 C ATOM 842 C GLY A 53 40.022 34.655 18.100 1.00 0.00 C ATOM 843 O GLY A 53 39.011 34.262 17.522 1.00 0.00 O ATOM 0 H GLY A 53 42.887 33.981 19.066 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.490 34.326 16.584 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.359 33.026 17.752 1.00 0.00 H new ATOM 847 N ARG A 54 39.965 35.495 19.129 1.00 0.00 N ATOM 848 CA ARG A 54 38.755 35.855 19.842 1.00 0.00 C ATOM 849 C ARG A 54 38.311 37.303 19.627 1.00 0.00 C ATOM 850 O ARG A 54 39.139 38.160 19.326 1.00 0.00 O ATOM 851 CB ARG A 54 38.949 35.541 21.322 1.00 0.00 C ATOM 852 CG ARG A 54 39.007 34.047 21.625 1.00 0.00 C ATOM 853 CD ARG A 54 39.503 33.803 23.048 1.00 0.00 C ATOM 854 NE ARG A 54 39.590 32.378 23.368 1.00 0.00 N ATOM 855 CZ ARG A 54 38.698 31.643 24.046 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.466 32.081 24.338 1.00 0.00 N ATOM 857 NH2 ARG A 54 39.025 30.415 24.469 1.00 0.00 N ATOM 0 H ARG A 54 40.795 35.958 19.499 1.00 0.00 H new ATOM 0 HA ARG A 54 37.941 35.258 19.432 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.871 36.010 21.667 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.133 35.987 21.890 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.018 33.607 21.499 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.669 33.552 20.914 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.484 34.262 23.172 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.831 34.291 23.754 1.00 0.00 H new ATOM 0 HE ARG A 54 40.422 31.890 23.038 1.00 0.00 H new ATOM 0 HH11 ARG A 54 37.172 33.012 24.041 1.00 0.00 H new ATOM 0 HH12 ARG A 54 36.822 31.484 24.857 1.00 0.00 H new ATOM 0 HH21 ARG A 54 39.953 30.039 24.275 1.00 0.00 H new ATOM 0 HH22 ARG A 54 38.346 29.856 24.985 1.00 0.00 H new ATOM 871 N THR A 55 37.021 37.585 19.792 1.00 0.00 N ATOM 872 CA THR A 55 36.472 38.926 19.792 1.00 0.00 C ATOM 873 C THR A 55 36.648 39.647 21.130 1.00 0.00 C ATOM 874 O THR A 55 36.827 39.029 22.176 1.00 0.00 O ATOM 875 CB THR A 55 35.000 38.995 19.397 1.00 0.00 C ATOM 876 OG1 THR A 55 34.198 38.275 20.306 1.00 0.00 O ATOM 877 CG2 THR A 55 34.699 38.457 18.001 1.00 0.00 C ATOM 0 H THR A 55 36.315 36.863 19.933 1.00 0.00 H new ATOM 0 HA THR A 55 37.058 39.435 19.026 1.00 0.00 H new ATOM 0 HB THR A 55 34.767 40.060 19.410 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.416 38.813 20.550 1.00 0.00 H new ATOM 0 HG21 THR A 55 33.631 38.543 17.800 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.255 39.033 17.261 1.00 0.00 H new ATOM 0 HG23 THR A 55 34.996 37.410 17.943 1.00 0.00 H new ATOM 885 N LEU A 56 36.528 40.972 21.121 1.00 0.00 N ATOM 886 CA LEU A 56 36.406 41.763 22.328 1.00 0.00 C ATOM 887 C LEU A 56 35.175 41.361 23.143 1.00 0.00 C ATOM 888 O LEU A 56 35.263 41.276 24.366 1.00 0.00 O ATOM 889 CB LEU A 56 36.368 43.246 21.971 1.00 0.00 C ATOM 890 CG LEU A 56 37.654 43.830 21.393 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.452 45.316 21.107 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.841 43.708 22.344 1.00 0.00 C ATOM 0 H LEU A 56 36.513 41.526 20.264 1.00 0.00 H new ATOM 0 HA LEU A 56 37.278 41.572 22.954 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.565 43.405 21.251 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.108 43.808 22.868 1.00 0.00 H new ATOM 0 HG LEU A 56 37.873 43.263 20.488 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.370 45.735 20.694 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.641 45.442 20.390 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.201 45.834 22.033 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.726 44.140 21.878 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.622 44.240 23.270 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.024 42.656 22.565 1.00 0.00 H new ATOM 904 N SER A 57 34.052 41.052 22.501 1.00 0.00 N ATOM 905 CA SER A 57 32.850 40.563 23.145 1.00 0.00 C ATOM 906 C SER A 57 32.984 39.167 23.759 1.00 0.00 C ATOM 907 O SER A 57 32.414 38.922 24.820 1.00 0.00 O ATOM 908 CB SER A 57 31.671 40.610 22.178 1.00 0.00 C ATOM 909 OG SER A 57 31.909 39.861 21.007 1.00 0.00 O ATOM 0 H SER A 57 33.957 41.140 21.489 1.00 0.00 H new ATOM 0 HA SER A 57 32.671 41.236 23.984 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.780 40.228 22.676 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.466 41.646 21.909 1.00 0.00 H new ATOM 0 HG SER A 57 31.128 39.918 20.418 1.00 0.00 H new ATOM 915 N ASP A 58 33.786 38.273 23.189 1.00 0.00 N ATOM 916 CA ASP A 58 34.121 36.992 23.779 1.00 0.00 C ATOM 917 C ASP A 58 34.886 37.166 25.094 1.00 0.00 C ATOM 918 O ASP A 58 34.590 36.487 26.074 1.00 0.00 O ATOM 919 CB ASP A 58 34.931 36.151 22.797 1.00 0.00 C ATOM 920 CG ASP A 58 35.233 34.762 23.364 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.344 33.886 23.291 1.00 0.00 O ATOM 922 OD2 ASP A 58 36.334 34.537 23.913 1.00 0.00 O ATOM 0 H ASP A 58 34.229 38.428 22.283 1.00 0.00 H new ATOM 0 HA ASP A 58 33.189 36.472 24.003 1.00 0.00 H new ATOM 0 HB2 ASP A 58 34.381 36.051 21.861 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.866 36.661 22.564 1.00 0.00 H new ATOM 927 N TYR A 59 35.795 38.134 25.155 1.00 0.00 N ATOM 928 CA TYR A 59 36.458 38.558 26.371 1.00 0.00 C ATOM 929 C TYR A 59 35.633 39.500 27.249 1.00 0.00 C ATOM 930 O TYR A 59 36.106 39.875 28.320 1.00 0.00 O ATOM 931 CB TYR A 59 37.828 39.137 26.026 1.00 0.00 C ATOM 932 CG TYR A 59 38.879 38.090 25.743 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.280 37.235 26.777 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.475 37.994 24.480 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.265 36.265 26.555 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.489 37.055 24.257 1.00 0.00 C ATOM 937 CZ TYR A 59 40.880 36.180 25.291 1.00 0.00 C ATOM 938 OH TYR A 59 41.882 35.280 25.078 1.00 0.00 O ATOM 0 H TYR A 59 36.095 38.657 24.332 1.00 0.00 H new ATOM 0 HA TYR A 59 36.584 37.671 26.992 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.729 39.784 25.154 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.166 39.763 26.852 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.826 37.324 27.753 1.00 0.00 H new ATOM 0 HD2 TYR A 59 39.153 38.643 23.679 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.551 35.588 27.346 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.972 37.001 23.293 1.00 0.00 H new ATOM 0 HH TYR A 59 41.513 34.372 25.082 1.00 0.00 H new ATOM 948 N ASN A 60 34.403 39.841 26.875 1.00 0.00 N ATOM 949 CA ASN A 60 33.527 40.743 27.593 1.00 0.00 C ATOM 950 C ASN A 60 34.139 42.119 27.866 1.00 0.00 C ATOM 951 O ASN A 60 33.942 42.713 28.924 1.00 0.00 O ATOM 952 CB ASN A 60 32.961 40.023 28.814 1.00 0.00 C ATOM 953 CG ASN A 60 31.690 40.650 29.391 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.046 41.521 28.811 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.247 40.171 30.549 1.00 0.00 N ATOM 0 H ASN A 60 33.977 39.476 26.023 1.00 0.00 H new ATOM 0 HA ASN A 60 32.685 41.003 26.952 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.750 38.988 28.544 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.724 40.000 29.592 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.379 40.527 30.949 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.775 39.448 31.037 1.00 0.00 H new ATOM 962 N ILE A 61 34.913 42.631 26.912 1.00 0.00 N ATOM 963 CA ILE A 61 35.507 43.952 26.929 1.00 0.00 C ATOM 964 C ILE A 61 34.459 44.979 26.495 1.00 0.00 C ATOM 965 O ILE A 61 33.609 44.709 25.648 1.00 0.00 O ATOM 966 CB ILE A 61 36.788 43.956 26.100 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.843 43.070 26.757 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.342 45.366 25.913 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.021 42.690 25.865 1.00 0.00 C ATOM 0 H ILE A 61 35.150 42.106 26.070 1.00 0.00 H new ATOM 0 HA ILE A 61 35.813 44.238 27.935 1.00 0.00 H new ATOM 0 HB ILE A 61 36.540 43.562 25.115 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.227 43.583 27.639 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.361 42.156 27.104 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.254 45.323 25.317 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.603 45.982 25.401 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.565 45.801 26.887 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.713 42.061 26.425 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.657 42.144 24.995 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.536 43.593 25.538 1.00 0.00 H new ATOM 981 N GLN A 62 34.479 46.146 27.132 1.00 0.00 N ATOM 982 CA GLN A 62 33.378 47.087 27.171 1.00 0.00 C ATOM 983 C GLN A 62 33.847 48.526 26.943 1.00 0.00 C ATOM 984 O GLN A 62 35.041 48.820 26.971 1.00 0.00 O ATOM 985 CB GLN A 62 32.676 46.915 28.515 1.00 0.00 C ATOM 986 CG GLN A 62 31.903 45.602 28.616 1.00 0.00 C ATOM 987 CD GLN A 62 31.493 45.221 30.040 1.00 0.00 C ATOM 988 OE1 GLN A 62 31.626 45.968 31.006 1.00 0.00 O ATOM 989 NE2 GLN A 62 31.003 44.004 30.258 1.00 0.00 N ATOM 0 H GLN A 62 35.295 46.469 27.652 1.00 0.00 H new ATOM 0 HA GLN A 62 32.680 46.882 26.359 1.00 0.00 H new ATOM 0 HB2 GLN A 62 33.416 46.958 29.314 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.990 47.748 28.671 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.007 45.673 27.999 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.514 44.801 28.200 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.879 43.357 29.479 1.00 0.00 H new ATOM 0 HE22 GLN A 62 30.751 43.718 31.204 1.00 0.00 H new ATOM 998 N LYS A 63 32.915 49.449 26.730 1.00 0.00 N ATOM 999 CA LYS A 63 33.173 50.863 26.542 1.00 0.00 C ATOM 1000 C LYS A 63 34.010 51.442 27.684 1.00 0.00 C ATOM 1001 O LYS A 63 33.641 51.316 28.850 1.00 0.00 O ATOM 1002 CB LYS A 63 31.831 51.572 26.386 1.00 0.00 C ATOM 1003 CG LYS A 63 31.959 53.087 26.261 1.00 0.00 C ATOM 1004 CD LYS A 63 30.610 53.743 25.980 1.00 0.00 C ATOM 1005 CE LYS A 63 30.772 55.259 25.992 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.507 55.940 25.675 1.00 0.00 N ATOM 0 H LYS A 63 31.922 49.219 26.683 1.00 0.00 H new ATOM 0 HA LYS A 63 33.767 51.017 25.641 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.323 51.183 25.503 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.202 51.337 27.245 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.378 53.495 27.181 1.00 0.00 H new ATOM 0 HG3 LYS A 63 32.656 53.329 25.459 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.228 53.415 25.013 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.881 53.438 26.731 1.00 0.00 H new ATOM 0 HE2 LYS A 63 31.123 55.580 26.972 1.00 0.00 H new ATOM 0 HE3 LYS A 63 31.534 55.550 25.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.653 56.970 25.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.185 55.652 24.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 28.787 55.681 26.380 1.00 0.00 H new ATOM 1020 N GLU A 64 35.115 52.100 27.345 1.00 0.00 N ATOM 1021 CA GLU A 64 36.102 52.667 28.241 1.00 0.00 C ATOM 1022 C GLU A 64 36.918 51.655 29.049 1.00 0.00 C ATOM 1023 O GLU A 64 37.604 52.040 29.993 1.00 0.00 O ATOM 1024 CB GLU A 64 35.512 53.799 29.076 1.00 0.00 C ATOM 1025 CG GLU A 64 35.030 54.980 28.238 1.00 0.00 C ATOM 1026 CD GLU A 64 34.335 56.043 29.092 1.00 0.00 C ATOM 1027 OE1 GLU A 64 34.785 56.318 30.225 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.333 56.633 28.637 1.00 0.00 O ATOM 0 H GLU A 64 35.355 52.259 26.367 1.00 0.00 H new ATOM 0 HA GLU A 64 36.860 53.107 27.594 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.677 53.413 29.661 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.263 54.148 29.785 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.879 55.428 27.721 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.342 54.624 27.471 1.00 0.00 H new ATOM 1035 N SER A 65 36.901 50.374 28.691 1.00 0.00 N ATOM 1036 CA SER A 65 37.737 49.363 29.306 1.00 0.00 C ATOM 1037 C SER A 65 39.231 49.614 29.096 1.00 0.00 C ATOM 1038 O SER A 65 39.655 50.136 28.067 1.00 0.00 O ATOM 1039 CB SER A 65 37.393 47.963 28.805 1.00 0.00 C ATOM 1040 OG SER A 65 36.223 47.487 29.433 1.00 0.00 O ATOM 0 H SER A 65 36.296 50.010 27.955 1.00 0.00 H new ATOM 0 HA SER A 65 37.528 49.429 30.374 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.251 47.982 27.724 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.222 47.285 29.006 1.00 0.00 H new ATOM 0 HG SER A 65 36.263 46.510 29.501 1.00 0.00 H new ATOM 1046 N THR A 66 40.029 49.202 30.077 1.00 0.00 N ATOM 1047 CA THR A 66 41.458 49.426 30.143 1.00 0.00 C ATOM 1048 C THR A 66 42.255 48.124 30.029 1.00 0.00 C ATOM 1049 O THR A 66 41.855 47.099 30.577 1.00 0.00 O ATOM 1050 CB THR A 66 41.848 50.165 31.420 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.512 49.424 32.572 1.00 0.00 O ATOM 1052 CG2 THR A 66 41.175 51.530 31.537 1.00 0.00 C ATOM 0 H THR A 66 39.676 48.681 30.879 1.00 0.00 H new ATOM 0 HA THR A 66 41.710 50.049 29.285 1.00 0.00 H new ATOM 0 HB THR A 66 42.928 50.298 31.355 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.777 49.925 33.372 1.00 0.00 H new ATOM 0 HG21 THR A 66 41.488 52.012 32.463 1.00 0.00 H new ATOM 0 HG22 THR A 66 41.464 52.152 30.689 1.00 0.00 H new ATOM 0 HG23 THR A 66 40.092 51.403 31.542 1.00 0.00 H new ATOM 1060 N LEU A 67 43.379 48.165 29.320 1.00 0.00 N ATOM 1061 CA LEU A 67 44.238 47.046 28.990 1.00 0.00 C ATOM 1062 C LEU A 67 45.713 47.405 29.174 1.00 0.00 C ATOM 1063 O LEU A 67 46.064 48.583 29.194 1.00 0.00 O ATOM 1064 CB LEU A 67 44.009 46.632 27.539 1.00 0.00 C ATOM 1065 CG LEU A 67 42.611 46.142 27.173 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.710 47.249 26.634 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.711 45.086 26.075 1.00 0.00 C ATOM 0 H LEU A 67 43.732 49.042 28.938 1.00 0.00 H new ATOM 0 HA LEU A 67 43.991 46.225 29.663 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.248 47.483 26.902 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.720 45.842 27.295 1.00 0.00 H new ATOM 0 HG LEU A 67 42.179 45.750 28.093 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.731 46.836 26.392 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.599 48.028 27.389 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.156 47.675 25.735 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.712 44.737 25.814 1.00 0.00 H new ATOM 0 HD22 LEU A 67 43.185 45.520 25.195 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.308 44.246 26.431 1.00 0.00 H new ATOM 1079 N HIS A 68 46.599 46.413 29.202 1.00 0.00 N ATOM 1080 CA HIS A 68 48.023 46.585 29.005 1.00 0.00 C ATOM 1081 C HIS A 68 48.470 46.050 27.642 1.00 0.00 C ATOM 1082 O HIS A 68 48.023 44.990 27.213 1.00 0.00 O ATOM 1083 CB HIS A 68 48.828 45.910 30.112 1.00 0.00 C ATOM 1084 CG HIS A 68 48.686 46.510 31.483 1.00 0.00 C ATOM 1085 ND1 HIS A 68 47.911 45.991 32.519 1.00 0.00 N ATOM 1086 CD2 HIS A 68 49.402 47.577 31.959 1.00 0.00 C ATOM 1087 CE1 HIS A 68 48.164 46.753 33.585 1.00 0.00 C ATOM 1088 NE2 HIS A 68 49.046 47.720 33.286 1.00 0.00 N ATOM 0 H HIS A 68 46.332 45.443 29.367 1.00 0.00 H new ATOM 0 HA HIS A 68 48.216 47.657 29.039 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.533 44.862 30.162 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.882 45.932 29.834 1.00 0.00 H new ATOM 0 HD2 HIS A 68 50.104 48.184 31.407 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.719 46.611 34.559 1.00 0.00 H new ATOM 0 HE2 HIS A 68 49.392 48.435 33.926 1.00 0.00 H new ATOM 1096 N LEU A 69 49.401 46.751 27.000 1.00 0.00 N ATOM 1097 CA LEU A 69 50.237 46.237 25.933 1.00 0.00 C ATOM 1098 C LEU A 69 51.563 45.766 26.532 1.00 0.00 C ATOM 1099 O LEU A 69 52.173 46.504 27.303 1.00 0.00 O ATOM 1100 CB LEU A 69 50.448 47.331 24.890 1.00 0.00 C ATOM 1101 CG LEU A 69 51.532 47.094 23.844 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.227 45.904 22.939 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.681 48.327 22.956 1.00 0.00 C ATOM 0 H LEU A 69 49.596 47.727 27.221 1.00 0.00 H new ATOM 0 HA LEU A 69 49.761 45.389 25.440 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.504 47.488 24.369 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.681 48.258 25.414 1.00 0.00 H new ATOM 0 HG LEU A 69 52.449 46.887 24.395 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.032 45.782 22.214 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.142 45.000 23.542 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.288 46.078 22.413 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.457 48.148 22.212 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.736 48.529 22.452 1.00 0.00 H new ATOM 0 HD23 LEU A 69 51.956 49.185 23.569 1.00 0.00 H new ATOM 1115 N VAL A 70 52.038 44.582 26.156 1.00 0.00 N ATOM 1116 CA VAL A 70 53.352 44.094 26.523 1.00 0.00 C ATOM 1117 C VAL A 70 54.072 43.574 25.277 1.00 0.00 C ATOM 1118 O VAL A 70 53.540 42.745 24.542 1.00 0.00 O ATOM 1119 CB VAL A 70 53.276 43.041 27.624 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.660 42.540 28.028 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.592 43.573 28.880 1.00 0.00 C ATOM 0 H VAL A 70 51.508 43.929 25.579 1.00 0.00 H new ATOM 0 HA VAL A 70 53.931 44.920 26.935 1.00 0.00 H new ATOM 0 HB VAL A 70 52.691 42.223 27.203 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.561 41.792 28.814 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.153 42.095 27.163 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.256 43.375 28.395 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.560 42.789 29.637 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.150 44.426 29.265 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.576 43.884 28.637 1.00 0.00 H new