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 Single : A 1 MET CE :methyl 152:sc= 0 (180deg=-0.0973) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.0239 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 165:sc= 0.717 (180deg=0.241!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -66:sc= 0.38 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0344 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0.509 K(o=0.51,f=-0.81) USER MOD Single : A 27 LYS NZ :NH3+ -153:sc= 1.59 (180deg=1.05) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= 2.23 (180deg=1.98) USER MOD Single : A 31 GLN : amide:sc= -0.0472 K(o=-0.047,f=-0.96) USER MOD Single : A 33 LYS NZ :NH3+ -146:sc= 1.22 (180deg=1.14) USER MOD Single : A 40 GLN : amide:sc=-0.00722 K(o=-0.0072,f=-0.72) USER MOD Single : A 41 GLN : amide:sc= 1.2 K(o=1.2,f=-3.3!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.0468 K(o=-0.047,f=-1.1!) USER MOD Single : A 55 THR OG1 : rot -83:sc= 1.05 USER MOD Single : A 57 SER OG : rot 45:sc= 1.3 USER MOD Single : A 59 TYR OH : rot 90:sc= 0.318 USER MOD Single : A 60 ASN : amide:sc= -0.0193 K(o=-0.019,f=-0.89) USER MOD Single : A 62 GLN : amide:sc= -0.146 K(o=-0.15,f=-4.4!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 75:sc= 1.21 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 32.424 52.757 19.009 1.00 0.00 N ATOM 2 CA MET A 1 32.934 52.403 20.343 1.00 0.00 C ATOM 3 C MET A 1 34.438 52.666 20.437 1.00 0.00 C ATOM 4 O MET A 1 35.152 52.458 19.459 1.00 0.00 O ATOM 5 CB MET A 1 32.567 50.963 20.691 1.00 0.00 C ATOM 6 CG MET A 1 33.301 50.367 21.889 1.00 0.00 C ATOM 7 SD MET A 1 32.689 48.732 22.369 1.00 0.00 S ATOM 8 CE MET A 1 34.119 48.048 23.242 1.00 0.00 C ATOM 0 H1 MET A 1 31.667 52.096 18.740 1.00 0.00 H new ATOM 0 H2 MET A 1 32.047 53.726 19.027 1.00 0.00 H new ATOM 0 H3 MET A 1 33.197 52.699 18.315 1.00 0.00 H new ATOM 0 HA MET A 1 32.457 53.042 21.086 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.495 50.917 20.884 1.00 0.00 H new ATOM 0 HB3 MET A 1 32.761 50.337 19.820 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.363 50.295 21.655 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.207 51.045 22.737 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.780 47.328 23.987 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.776 47.550 22.529 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.663 48.853 23.736 1.00 0.00 H new ATOM 20 N GLN A 2 34.928 53.056 21.610 1.00 0.00 N ATOM 21 CA GLN A 2 36.335 53.236 21.909 1.00 0.00 C ATOM 22 C GLN A 2 36.811 52.451 23.132 1.00 0.00 C ATOM 23 O GLN A 2 36.033 52.160 24.039 1.00 0.00 O ATOM 24 CB GLN A 2 36.682 54.718 22.027 1.00 0.00 C ATOM 25 CG GLN A 2 35.844 55.458 23.067 1.00 0.00 C ATOM 26 CD GLN A 2 36.312 56.880 23.383 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.330 57.383 22.912 1.00 0.00 O ATOM 28 NE2 GLN A 2 35.549 57.584 24.215 1.00 0.00 N ATOM 0 H GLN A 2 34.326 53.262 22.407 1.00 0.00 H new ATOM 0 HA GLN A 2 36.880 52.816 21.063 1.00 0.00 H new ATOM 0 HB2 GLN A 2 37.737 54.817 22.284 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.545 55.194 21.056 1.00 0.00 H new ATOM 0 HG2 GLN A 2 34.813 55.501 22.717 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.843 54.878 23.990 1.00 0.00 H new ATOM 0 HE21 GLN A 2 34.704 57.169 24.607 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.809 58.539 24.461 1.00 0.00 H new ATOM 37 N ILE A 3 38.106 52.149 23.174 1.00 0.00 N ATOM 38 CA ILE A 3 38.832 51.558 24.279 1.00 0.00 C ATOM 39 C ILE A 3 40.218 52.192 24.409 1.00 0.00 C ATOM 40 O ILE A 3 40.652 52.917 23.517 1.00 0.00 O ATOM 41 CB ILE A 3 38.947 50.043 24.134 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.640 49.624 22.841 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.588 49.369 24.301 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.020 48.148 22.785 1.00 0.00 C ATOM 0 H ILE A 3 38.714 52.327 22.374 1.00 0.00 H new ATOM 0 HA ILE A 3 38.267 51.758 25.189 1.00 0.00 H new ATOM 0 HB ILE A 3 39.590 49.696 24.942 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.984 49.851 22.000 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.541 50.225 22.714 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.701 48.290 24.193 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.189 49.594 25.290 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.902 49.740 23.540 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.507 47.934 21.834 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.703 47.917 23.603 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.122 47.537 22.878 1.00 0.00 H new ATOM 56 N PHE A 4 40.942 51.896 25.485 1.00 0.00 N ATOM 57 CA PHE A 4 42.275 52.408 25.730 1.00 0.00 C ATOM 58 C PHE A 4 43.306 51.291 25.904 1.00 0.00 C ATOM 59 O PHE A 4 42.995 50.210 26.399 1.00 0.00 O ATOM 60 CB PHE A 4 42.256 53.335 26.943 1.00 0.00 C ATOM 61 CG PHE A 4 41.234 54.445 26.871 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.416 55.512 25.984 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.095 54.409 27.684 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.453 56.524 25.892 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.138 55.428 27.605 1.00 0.00 C ATOM 66 CZ PHE A 4 39.306 56.477 26.695 1.00 0.00 C ATOM 0 H PHE A 4 40.605 51.279 26.224 1.00 0.00 H new ATOM 0 HA PHE A 4 42.583 52.974 24.851 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.064 52.740 27.836 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.245 53.777 27.061 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.302 55.555 25.368 1.00 0.00 H new ATOM 0 HD2 PHE A 4 39.954 53.591 28.375 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.595 57.342 25.201 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.270 55.404 28.247 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.554 57.248 26.612 1.00 0.00 H new ATOM 76 N VAL A 5 44.556 51.562 25.539 1.00 0.00 N ATOM 77 CA VAL A 5 45.691 50.677 25.711 1.00 0.00 C ATOM 78 C VAL A 5 46.812 51.418 26.443 1.00 0.00 C ATOM 79 O VAL A 5 47.131 52.546 26.071 1.00 0.00 O ATOM 80 CB VAL A 5 46.178 50.130 24.373 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.267 49.079 24.565 1.00 0.00 C ATOM 82 CG2 VAL A 5 45.057 49.485 23.563 1.00 0.00 C ATOM 0 H VAL A 5 44.811 52.445 25.096 1.00 0.00 H new ATOM 0 HA VAL A 5 45.379 49.823 26.312 1.00 0.00 H new ATOM 0 HB VAL A 5 46.567 50.992 23.832 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.592 48.710 23.592 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.115 49.524 25.086 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.874 48.251 25.154 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.457 49.112 22.620 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.630 48.657 24.128 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.282 50.225 23.361 1.00 0.00 H new ATOM 92 N LYS A 6 47.414 50.799 27.454 1.00 0.00 N ATOM 93 CA LYS A 6 48.492 51.341 28.257 1.00 0.00 C ATOM 94 C LYS A 6 49.802 50.582 28.032 1.00 0.00 C ATOM 95 O LYS A 6 49.837 49.361 28.167 1.00 0.00 O ATOM 96 CB LYS A 6 48.064 51.360 29.721 1.00 0.00 C ATOM 97 CG LYS A 6 49.035 52.143 30.602 1.00 0.00 C ATOM 98 CD LYS A 6 48.618 52.131 32.070 1.00 0.00 C ATOM 99 CE LYS A 6 49.660 52.861 32.910 1.00 0.00 C ATOM 100 NZ LYS A 6 49.421 52.718 34.355 1.00 0.00 N ATOM 0 H LYS A 6 47.146 49.859 27.746 1.00 0.00 H new ATOM 0 HA LYS A 6 48.694 52.367 27.948 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.070 51.800 29.800 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.989 50.336 30.088 1.00 0.00 H new ATOM 0 HG2 LYS A 6 50.034 51.718 30.506 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.092 53.173 30.251 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.645 52.609 32.185 1.00 0.00 H new ATOM 0 HD3 LYS A 6 48.511 51.104 32.419 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.651 52.476 32.669 1.00 0.00 H new ATOM 0 HE3 LYS A 6 49.657 53.919 32.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 50.156 53.232 34.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 48.487 53.110 34.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 49.450 51.711 34.614 1.00 0.00 H new ATOM 168 N LYS A 11 52.372 55.293 29.045 1.00 0.00 N ATOM 169 CA LYS A 11 51.727 56.005 27.961 1.00 0.00 C ATOM 170 C LYS A 11 50.422 55.331 27.534 1.00 0.00 C ATOM 171 O LYS A 11 50.360 54.106 27.467 1.00 0.00 O ATOM 172 CB LYS A 11 52.717 56.120 26.805 1.00 0.00 C ATOM 173 CG LYS A 11 52.295 57.106 25.720 1.00 0.00 C ATOM 174 CD LYS A 11 53.337 57.223 24.611 1.00 0.00 C ATOM 175 CE LYS A 11 53.436 55.938 23.796 1.00 0.00 C ATOM 176 NZ LYS A 11 54.496 56.023 22.779 1.00 0.00 N ATOM 0 HA LYS A 11 51.446 57.003 28.297 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.687 56.424 27.200 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.850 55.136 26.355 1.00 0.00 H new ATOM 0 HG2 LYS A 11 51.345 56.787 25.291 1.00 0.00 H new ATOM 0 HG3 LYS A 11 52.130 58.087 26.167 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.078 58.053 23.953 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.309 57.454 25.047 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.636 55.098 24.462 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.480 55.739 23.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 54.710 55.071 22.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 54.176 56.625 21.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 55.352 56.433 23.203 1.00 0.00 H new ATOM 190 N THR A 12 49.397 56.114 27.210 1.00 0.00 N ATOM 191 CA THR A 12 48.090 55.639 26.804 1.00 0.00 C ATOM 192 C THR A 12 47.845 55.877 25.312 1.00 0.00 C ATOM 193 O THR A 12 48.385 56.814 24.729 1.00 0.00 O ATOM 194 CB THR A 12 46.974 56.228 27.661 1.00 0.00 C ATOM 195 OG1 THR A 12 47.369 56.390 29.005 1.00 0.00 O ATOM 196 CG2 THR A 12 45.742 55.329 27.719 1.00 0.00 C ATOM 0 H THR A 12 49.462 57.132 27.225 1.00 0.00 H new ATOM 0 HA THR A 12 48.077 54.562 26.968 1.00 0.00 H new ATOM 0 HB THR A 12 46.747 57.182 27.185 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.628 56.771 29.520 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.979 55.797 28.342 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.350 55.184 26.712 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.016 54.363 28.144 1.00 0.00 H new ATOM 204 N ILE A 13 47.043 55.018 24.689 1.00 0.00 N ATOM 205 CA ILE A 13 46.656 55.056 23.294 1.00 0.00 C ATOM 206 C ILE A 13 45.153 54.779 23.208 1.00 0.00 C ATOM 207 O ILE A 13 44.688 53.764 23.721 1.00 0.00 O ATOM 208 CB ILE A 13 47.432 54.029 22.473 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.940 54.051 22.701 1.00 0.00 C ATOM 210 CG2 ILE A 13 47.142 54.240 20.990 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.673 52.818 22.178 1.00 0.00 C ATOM 0 H ILE A 13 46.623 54.230 25.182 1.00 0.00 H new ATOM 0 HA ILE A 13 46.886 56.038 22.882 1.00 0.00 H new ATOM 0 HB ILE A 13 47.088 53.051 22.810 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.355 54.937 22.221 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.133 54.148 23.769 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.696 53.507 20.403 1.00 0.00 H new ATOM 0 HG22 ILE A 13 46.074 54.119 20.807 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.449 55.245 20.699 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.740 52.915 22.381 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.289 51.928 22.676 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.515 52.729 21.103 1.00 0.00 H new ATOM 223 N THR A 14 44.390 55.644 22.547 1.00 0.00 N ATOM 224 CA THR A 14 42.974 55.454 22.303 1.00 0.00 C ATOM 225 C THR A 14 42.742 54.696 20.994 1.00 0.00 C ATOM 226 O THR A 14 43.257 55.103 19.955 1.00 0.00 O ATOM 227 CB THR A 14 42.227 56.783 22.249 1.00 0.00 C ATOM 228 OG1 THR A 14 42.514 57.555 23.394 1.00 0.00 O ATOM 229 CG2 THR A 14 40.713 56.594 22.218 1.00 0.00 C ATOM 0 H THR A 14 44.753 56.515 22.159 1.00 0.00 H new ATOM 0 HA THR A 14 42.586 54.869 23.137 1.00 0.00 H new ATOM 0 HB THR A 14 42.557 57.278 21.336 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.153 57.109 24.188 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.225 57.568 22.180 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.437 56.015 21.337 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.394 56.064 23.115 1.00 0.00 H new ATOM 237 N LEU A 15 41.946 53.632 21.038 1.00 0.00 N ATOM 238 CA LEU A 15 41.578 52.816 19.898 1.00 0.00 C ATOM 239 C LEU A 15 40.070 52.832 19.635 1.00 0.00 C ATOM 240 O LEU A 15 39.265 52.773 20.562 1.00 0.00 O ATOM 241 CB LEU A 15 42.080 51.390 20.105 1.00 0.00 C ATOM 242 CG LEU A 15 43.345 51.074 19.315 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.589 51.806 19.809 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.629 49.576 19.397 1.00 0.00 C ATOM 0 H LEU A 15 41.525 53.306 21.908 1.00 0.00 H new ATOM 0 HA LEU A 15 42.052 53.242 19.014 1.00 0.00 H new ATOM 0 HB2 LEU A 15 42.274 51.231 21.166 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.295 50.691 19.816 1.00 0.00 H new ATOM 0 HG LEU A 15 43.150 51.408 18.296 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.444 51.526 19.194 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.429 52.882 19.740 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.783 51.534 20.846 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.533 49.346 18.833 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.768 49.289 20.439 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.789 49.023 18.977 1.00 0.00 H new ATOM 256 N GLU A 16 39.701 52.822 18.358 1.00 0.00 N ATOM 257 CA GLU A 16 38.341 52.704 17.873 1.00 0.00 C ATOM 258 C GLU A 16 38.054 51.253 17.484 1.00 0.00 C ATOM 259 O GLU A 16 38.831 50.629 16.765 1.00 0.00 O ATOM 260 CB GLU A 16 38.155 53.704 16.735 1.00 0.00 C ATOM 261 CG GLU A 16 36.822 53.610 15.999 1.00 0.00 C ATOM 262 CD GLU A 16 36.762 52.537 14.909 1.00 0.00 C ATOM 263 OE1 GLU A 16 37.793 52.228 14.273 1.00 0.00 O ATOM 264 OE2 GLU A 16 35.649 52.051 14.616 1.00 0.00 O ATOM 0 H GLU A 16 40.380 52.900 17.601 1.00 0.00 H new ATOM 0 HA GLU A 16 37.611 52.950 18.644 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.259 54.712 17.137 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.960 53.564 16.014 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.035 53.412 16.727 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.603 54.578 15.548 1.00 0.00 H new ATOM 271 N VAL A 17 36.955 50.692 17.981 1.00 0.00 N ATOM 272 CA VAL A 17 36.604 49.290 17.876 1.00 0.00 C ATOM 273 C VAL A 17 35.092 49.085 17.767 1.00 0.00 C ATOM 274 O VAL A 17 34.307 50.018 17.924 1.00 0.00 O ATOM 275 CB VAL A 17 37.162 48.483 19.045 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.687 48.488 19.115 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.606 48.936 20.391 1.00 0.00 C ATOM 0 H VAL A 17 36.256 51.233 18.491 1.00 0.00 H new ATOM 0 HA VAL A 17 37.060 48.925 16.956 1.00 0.00 H new ATOM 0 HB VAL A 17 36.832 47.464 18.845 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.014 47.895 19.969 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.095 48.060 18.199 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.043 49.512 19.227 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.037 48.328 21.186 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.861 49.983 20.556 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.522 48.822 20.394 1.00 0.00 H new ATOM 287 N GLU A 18 34.667 47.845 17.547 1.00 0.00 N ATOM 288 CA GLU A 18 33.307 47.379 17.733 1.00 0.00 C ATOM 289 C GLU A 18 33.248 46.438 18.938 1.00 0.00 C ATOM 290 O GLU A 18 34.257 45.805 19.239 1.00 0.00 O ATOM 291 CB GLU A 18 32.827 46.657 16.477 1.00 0.00 C ATOM 292 CG GLU A 18 32.791 47.544 15.235 1.00 0.00 C ATOM 293 CD GLU A 18 32.341 46.764 13.998 1.00 0.00 C ATOM 294 OE1 GLU A 18 33.040 45.818 13.578 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.281 47.100 13.426 1.00 0.00 O ATOM 0 H GLU A 18 35.293 47.109 17.220 1.00 0.00 H new ATOM 0 HA GLU A 18 32.655 48.233 17.915 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.480 45.806 16.286 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.829 46.258 16.657 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.113 48.381 15.404 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.781 47.966 15.060 1.00 0.00 H new ATOM 302 N PRO A 19 32.109 46.233 19.593 1.00 0.00 N ATOM 303 CA PRO A 19 31.984 45.271 20.669 1.00 0.00 C ATOM 304 C PRO A 19 32.407 43.846 20.302 1.00 0.00 C ATOM 305 O PRO A 19 32.848 43.088 21.163 1.00 0.00 O ATOM 306 CB PRO A 19 30.514 45.296 21.077 1.00 0.00 C ATOM 307 CG PRO A 19 30.036 46.685 20.663 1.00 0.00 C ATOM 308 CD PRO A 19 30.875 46.973 19.422 1.00 0.00 C ATOM 0 HA PRO A 19 32.661 45.553 21.475 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.947 44.513 20.573 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.395 45.137 22.149 1.00 0.00 H new ATOM 0 HG2 PRO A 19 28.969 46.697 20.442 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.207 47.422 21.447 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.354 46.659 18.517 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.071 48.041 19.323 1.00 0.00 H new ATOM 316 N SER A 20 32.283 43.499 19.025 1.00 0.00 N ATOM 317 CA SER A 20 32.598 42.233 18.394 1.00 0.00 C ATOM 318 C SER A 20 33.954 42.197 17.686 1.00 0.00 C ATOM 319 O SER A 20 34.258 41.221 17.004 1.00 0.00 O ATOM 320 CB SER A 20 31.465 41.912 17.423 1.00 0.00 C ATOM 321 OG SER A 20 31.274 42.980 16.523 1.00 0.00 O ATOM 0 H SER A 20 31.923 44.167 18.344 1.00 0.00 H new ATOM 0 HA SER A 20 32.685 41.479 19.176 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.697 41.000 16.872 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.545 41.725 17.976 1.00 0.00 H new ATOM 0 HG SER A 20 30.546 42.761 15.905 1.00 0.00 H new ATOM 327 N ASP A 21 34.776 43.236 17.797 1.00 0.00 N ATOM 328 CA ASP A 21 36.055 43.324 17.122 1.00 0.00 C ATOM 329 C ASP A 21 37.071 42.319 17.670 1.00 0.00 C ATOM 330 O ASP A 21 36.960 41.879 18.811 1.00 0.00 O ATOM 331 CB ASP A 21 36.568 44.760 17.179 1.00 0.00 C ATOM 332 CG ASP A 21 37.534 45.148 16.057 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.907 44.288 15.229 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.858 46.350 15.946 1.00 0.00 O ATOM 0 H ASP A 21 34.563 44.052 18.370 1.00 0.00 H new ATOM 0 HA ASP A 21 35.913 43.052 16.076 1.00 0.00 H new ATOM 0 HB2 ASP A 21 35.714 45.436 17.152 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.066 44.914 18.136 1.00 0.00 H new ATOM 339 N THR A 22 38.066 41.938 16.873 1.00 0.00 N ATOM 340 CA THR A 22 39.006 40.878 17.178 1.00 0.00 C ATOM 341 C THR A 22 40.315 41.383 17.786 1.00 0.00 C ATOM 342 O THR A 22 40.778 42.475 17.462 1.00 0.00 O ATOM 343 CB THR A 22 39.293 39.957 15.995 1.00 0.00 C ATOM 344 OG1 THR A 22 39.848 40.639 14.894 1.00 0.00 O ATOM 345 CG2 THR A 22 38.045 39.224 15.510 1.00 0.00 C ATOM 0 H THR A 22 38.241 42.377 15.969 1.00 0.00 H new ATOM 0 HA THR A 22 38.495 40.286 17.937 1.00 0.00 H new ATOM 0 HB THR A 22 40.017 39.238 16.379 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.014 40.004 14.166 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.304 38.583 14.668 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.643 38.615 16.320 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.295 39.950 15.196 1.00 0.00 H new ATOM 353 N ILE A 23 40.948 40.574 18.630 1.00 0.00 N ATOM 354 CA ILE A 23 42.185 40.923 19.302 1.00 0.00 C ATOM 355 C ILE A 23 43.312 41.182 18.299 1.00 0.00 C ATOM 356 O ILE A 23 44.081 42.127 18.463 1.00 0.00 O ATOM 357 CB ILE A 23 42.558 39.845 20.316 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.460 39.498 21.315 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.833 40.203 21.076 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.864 40.653 22.114 1.00 0.00 C ATOM 0 H ILE A 23 40.606 39.643 18.867 1.00 0.00 H new ATOM 0 HA ILE A 23 42.032 41.855 19.846 1.00 0.00 H new ATOM 0 HB ILE A 23 42.720 38.956 19.707 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.651 39.007 20.773 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.860 38.769 22.020 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.066 39.412 21.788 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.658 40.312 20.372 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.686 41.141 21.611 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.096 40.272 22.787 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.649 41.136 22.696 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.421 41.378 21.431 1.00 0.00 H new ATOM 372 N GLU A 24 43.379 40.431 17.203 1.00 0.00 N ATOM 373 CA GLU A 24 44.330 40.673 16.136 1.00 0.00 C ATOM 374 C GLU A 24 44.102 41.980 15.374 1.00 0.00 C ATOM 375 O GLU A 24 45.061 42.561 14.870 1.00 0.00 O ATOM 376 CB GLU A 24 44.369 39.475 15.192 1.00 0.00 C ATOM 377 CG GLU A 24 43.042 39.160 14.507 1.00 0.00 C ATOM 378 CD GLU A 24 43.135 37.971 13.549 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.241 37.598 13.101 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.074 37.431 13.169 1.00 0.00 O ATOM 0 H GLU A 24 42.767 39.632 17.035 1.00 0.00 H new ATOM 0 HA GLU A 24 45.303 40.795 16.611 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.123 39.657 14.427 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.690 38.598 15.753 1.00 0.00 H new ATOM 0 HG2 GLU A 24 42.288 38.951 15.266 1.00 0.00 H new ATOM 0 HG3 GLU A 24 42.705 40.038 13.956 1.00 0.00 H new ATOM 387 N ASN A 25 42.876 42.492 15.320 1.00 0.00 N ATOM 388 CA ASN A 25 42.604 43.797 14.754 1.00 0.00 C ATOM 389 C ASN A 25 42.984 44.914 15.728 1.00 0.00 C ATOM 390 O ASN A 25 43.525 45.931 15.298 1.00 0.00 O ATOM 391 CB ASN A 25 41.142 43.897 14.332 1.00 0.00 C ATOM 392 CG ASN A 25 40.857 45.106 13.437 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.706 45.588 12.690 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.632 45.623 13.457 1.00 0.00 N ATOM 0 H ASN A 25 42.048 42.009 15.669 1.00 0.00 H new ATOM 0 HA ASN A 25 43.223 43.922 13.865 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.859 42.987 13.804 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.516 43.956 15.222 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.402 46.414 12.855 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.922 45.229 14.074 1.00 0.00 H new ATOM 401 N VAL A 26 42.796 44.719 17.030 1.00 0.00 N ATOM 402 CA VAL A 26 43.304 45.617 18.048 1.00 0.00 C ATOM 403 C VAL A 26 44.825 45.742 17.948 1.00 0.00 C ATOM 404 O VAL A 26 45.334 46.860 17.937 1.00 0.00 O ATOM 405 CB VAL A 26 42.849 45.199 19.444 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.422 46.091 20.543 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.331 45.278 19.570 1.00 0.00 C ATOM 0 H VAL A 26 42.281 43.923 17.406 1.00 0.00 H new ATOM 0 HA VAL A 26 42.882 46.606 17.869 1.00 0.00 H new ATOM 0 HB VAL A 26 43.210 44.178 19.570 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.065 45.747 21.514 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.511 46.044 20.519 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.100 47.120 20.382 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.033 44.975 20.574 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.004 46.302 19.388 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.870 44.614 18.839 1.00 0.00 H new ATOM 417 N LYS A 27 45.556 44.648 17.750 1.00 0.00 N ATOM 418 CA LYS A 27 46.988 44.691 17.529 1.00 0.00 C ATOM 419 C LYS A 27 47.386 45.416 16.242 1.00 0.00 C ATOM 420 O LYS A 27 48.338 46.191 16.253 1.00 0.00 O ATOM 421 CB LYS A 27 47.583 43.287 17.570 1.00 0.00 C ATOM 422 CG LYS A 27 47.512 42.657 18.957 1.00 0.00 C ATOM 423 CD LYS A 27 48.127 41.261 18.953 1.00 0.00 C ATOM 424 CE LYS A 27 48.083 40.670 20.360 1.00 0.00 C ATOM 425 NZ LYS A 27 48.611 39.297 20.376 1.00 0.00 N ATOM 0 H LYS A 27 45.165 43.706 17.739 1.00 0.00 H new ATOM 0 HA LYS A 27 47.405 45.279 18.347 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.054 42.652 16.860 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.623 43.328 17.247 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.037 43.288 19.675 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.473 42.600 19.282 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.584 40.617 18.261 1.00 0.00 H new ATOM 0 HD3 LYS A 27 49.158 41.309 18.601 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.665 41.294 21.038 1.00 0.00 H new ATOM 0 HE3 LYS A 27 47.056 40.672 20.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.179 38.768 21.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.385 38.828 19.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.643 39.323 20.504 1.00 0.00 H new ATOM 439 N ALA A 28 46.651 45.230 15.150 1.00 0.00 N ATOM 440 CA ALA A 28 46.863 45.975 13.924 1.00 0.00 C ATOM 441 C ALA A 28 46.597 47.472 14.087 1.00 0.00 C ATOM 442 O ALA A 28 47.322 48.297 13.535 1.00 0.00 O ATOM 443 CB ALA A 28 46.003 45.366 12.821 1.00 0.00 C ATOM 0 H ALA A 28 45.889 44.554 15.095 1.00 0.00 H new ATOM 0 HA ALA A 28 47.915 45.896 13.651 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.155 45.919 11.894 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.286 44.324 12.672 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.953 45.419 13.107 1.00 0.00 H new ATOM 449 N LYS A 29 45.618 47.858 14.902 1.00 0.00 N ATOM 450 CA LYS A 29 45.319 49.237 15.226 1.00 0.00 C ATOM 451 C LYS A 29 46.362 49.863 16.154 1.00 0.00 C ATOM 452 O LYS A 29 46.641 51.052 16.027 1.00 0.00 O ATOM 453 CB LYS A 29 43.908 49.311 15.802 1.00 0.00 C ATOM 454 CG LYS A 29 42.836 49.110 14.735 1.00 0.00 C ATOM 455 CD LYS A 29 41.468 48.915 15.383 1.00 0.00 C ATOM 456 CE LYS A 29 40.400 48.791 14.301 1.00 0.00 C ATOM 457 NZ LYS A 29 39.061 48.620 14.886 1.00 0.00 N ATOM 0 H LYS A 29 44.997 47.195 15.365 1.00 0.00 H new ATOM 0 HA LYS A 29 45.363 49.831 14.313 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.794 48.552 16.576 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.764 50.279 16.281 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.810 49.973 14.070 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.082 48.243 14.123 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.474 48.021 16.006 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.241 49.757 16.037 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.413 49.681 13.671 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.629 47.942 13.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.339 48.858 14.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.938 47.633 15.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.958 49.249 15.708 1.00 0.00 H new ATOM 471 N ILE A 30 46.993 49.084 17.028 1.00 0.00 N ATOM 472 CA ILE A 30 48.147 49.502 17.799 1.00 0.00 C ATOM 473 C ILE A 30 49.345 49.747 16.879 1.00 0.00 C ATOM 474 O ILE A 30 50.005 50.774 17.029 1.00 0.00 O ATOM 475 CB ILE A 30 48.461 48.514 18.918 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.377 48.557 19.991 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.816 48.793 19.561 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.388 47.350 20.926 1.00 0.00 C ATOM 0 H ILE A 30 46.705 48.124 17.220 1.00 0.00 H new ATOM 0 HA ILE A 30 47.912 50.448 18.286 1.00 0.00 H new ATOM 0 HB ILE A 30 48.493 47.522 18.466 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.500 49.464 20.582 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.402 48.621 19.507 1.00 0.00 H new ATOM 0 HG21 ILE A 30 50.000 48.066 20.353 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.599 48.714 18.807 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.818 49.798 19.983 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.590 47.452 21.661 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.234 46.440 20.347 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.348 47.296 21.439 1.00 0.00 H new ATOM 490 N GLN A 31 49.601 48.912 15.877 1.00 0.00 N ATOM 491 CA GLN A 31 50.604 49.194 14.869 1.00 0.00 C ATOM 492 C GLN A 31 50.332 50.522 14.160 1.00 0.00 C ATOM 493 O GLN A 31 51.250 51.322 13.991 1.00 0.00 O ATOM 494 CB GLN A 31 50.697 48.030 13.886 1.00 0.00 C ATOM 495 CG GLN A 31 51.775 48.202 12.820 1.00 0.00 C ATOM 496 CD GLN A 31 51.724 47.095 11.766 1.00 0.00 C ATOM 497 OE1 GLN A 31 52.592 46.227 11.692 1.00 0.00 O ATOM 498 NE2 GLN A 31 50.713 47.080 10.903 1.00 0.00 N ATOM 0 H GLN A 31 49.117 48.024 15.745 1.00 0.00 H new ATOM 0 HA GLN A 31 51.571 49.300 15.362 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.893 47.113 14.442 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.732 47.905 13.395 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.653 49.170 12.334 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.756 48.205 13.295 1.00 0.00 H new ATOM 0 HE21 GLN A 31 49.987 47.795 10.955 1.00 0.00 H new ATOM 0 HE22 GLN A 31 50.663 46.353 10.189 1.00 0.00 H new ATOM 507 N ASP A 32 49.078 50.817 13.827 1.00 0.00 N ATOM 508 CA ASP A 32 48.676 52.041 13.164 1.00 0.00 C ATOM 509 C ASP A 32 48.885 53.322 13.974 1.00 0.00 C ATOM 510 O ASP A 32 48.948 54.392 13.374 1.00 0.00 O ATOM 511 CB ASP A 32 47.228 51.902 12.703 1.00 0.00 C ATOM 512 CG ASP A 32 46.783 53.005 11.741 1.00 0.00 C ATOM 513 OD1 ASP A 32 45.748 53.654 12.004 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.443 53.214 10.701 1.00 0.00 O ATOM 0 H ASP A 32 48.297 50.190 14.019 1.00 0.00 H new ATOM 0 HA ASP A 32 49.343 52.164 12.310 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.102 50.935 12.217 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.575 51.908 13.576 1.00 0.00 H new ATOM 519 N LYS A 33 49.031 53.258 15.294 1.00 0.00 N ATOM 520 CA LYS A 33 49.288 54.404 16.142 1.00 0.00 C ATOM 521 C LYS A 33 50.649 54.425 16.842 1.00 0.00 C ATOM 522 O LYS A 33 51.134 55.514 17.140 1.00 0.00 O ATOM 523 CB LYS A 33 48.159 54.587 17.152 1.00 0.00 C ATOM 524 CG LYS A 33 46.955 55.290 16.532 1.00 0.00 C ATOM 525 CD LYS A 33 45.919 55.674 17.584 1.00 0.00 C ATOM 526 CE LYS A 33 44.754 56.403 16.921 1.00 0.00 C ATOM 527 NZ LYS A 33 43.779 56.892 17.908 1.00 0.00 N ATOM 0 H LYS A 33 48.971 52.381 15.812 1.00 0.00 H new ATOM 0 HA LYS A 33 49.324 55.250 15.455 1.00 0.00 H new ATOM 0 HB2 LYS A 33 47.854 53.614 17.537 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.521 55.166 18.001 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.288 56.185 16.006 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.495 54.637 15.790 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.558 54.781 18.095 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.375 56.312 18.341 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.135 57.243 16.340 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.256 55.731 16.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 42.822 56.844 17.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.824 56.301 18.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.001 57.877 18.157 1.00 0.00 H new ATOM 541 N GLU A 34 51.257 53.277 17.125 1.00 0.00 N ATOM 542 CA GLU A 34 52.465 53.149 17.917 1.00 0.00 C ATOM 543 C GLU A 34 53.633 52.530 17.147 1.00 0.00 C ATOM 544 O GLU A 34 54.784 52.734 17.526 1.00 0.00 O ATOM 545 CB GLU A 34 52.109 52.354 19.170 1.00 0.00 C ATOM 546 CG GLU A 34 53.178 52.269 20.256 1.00 0.00 C ATOM 547 CD GLU A 34 53.610 53.623 20.821 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.770 54.526 21.028 1.00 0.00 O ATOM 549 OE2 GLU A 34 54.816 53.805 21.097 1.00 0.00 O ATOM 0 H GLU A 34 50.904 52.379 16.794 1.00 0.00 H new ATOM 0 HA GLU A 34 52.824 54.142 18.188 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.213 52.794 19.608 1.00 0.00 H new ATOM 0 HB3 GLU A 34 51.851 51.339 18.867 1.00 0.00 H new ATOM 0 HG2 GLU A 34 52.802 51.651 21.072 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.053 51.762 19.849 1.00 0.00 H new ATOM 556 N GLY A 35 53.370 51.815 16.058 1.00 0.00 N ATOM 557 CA GLY A 35 54.379 51.284 15.165 1.00 0.00 C ATOM 558 C GLY A 35 54.980 49.925 15.533 1.00 0.00 C ATOM 559 O GLY A 35 55.901 49.479 14.855 1.00 0.00 O ATOM 0 H GLY A 35 52.419 51.585 15.769 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.943 51.204 14.169 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.191 52.008 15.101 1.00 0.00 H new ATOM 563 N ILE A 36 54.485 49.243 16.563 1.00 0.00 N ATOM 564 CA ILE A 36 54.949 47.936 16.982 1.00 0.00 C ATOM 565 C ILE A 36 54.256 46.827 16.189 1.00 0.00 C ATOM 566 O ILE A 36 53.028 46.781 16.209 1.00 0.00 O ATOM 567 CB ILE A 36 54.827 47.806 18.498 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.339 46.475 19.042 1.00 0.00 C ATOM 569 CG2 ILE A 36 53.426 48.065 19.044 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.861 46.364 19.019 1.00 0.00 C ATOM 0 H ILE A 36 53.726 49.602 17.143 1.00 0.00 H new ATOM 0 HA ILE A 36 56.008 47.822 16.752 1.00 0.00 H new ATOM 0 HB ILE A 36 55.477 48.603 18.858 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.987 46.348 20.066 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.913 45.661 18.455 1.00 0.00 H new ATOM 0 HG21 ILE A 36 53.431 47.951 20.128 1.00 0.00 H new ATOM 0 HG22 ILE A 36 53.117 49.078 18.787 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.728 47.351 18.608 1.00 0.00 H new ATOM 0 HD11 ILE A 36 57.161 45.395 19.418 1.00 0.00 H new ATOM 0 HD12 ILE A 36 57.217 46.460 17.993 1.00 0.00 H new ATOM 0 HD13 ILE A 36 57.293 47.157 19.629 1.00 0.00 H new ATOM 582 N PRO A 37 54.950 45.929 15.495 1.00 0.00 N ATOM 583 CA PRO A 37 54.314 44.889 14.712 1.00 0.00 C ATOM 584 C PRO A 37 53.488 43.908 15.548 1.00 0.00 C ATOM 585 O PRO A 37 53.905 43.591 16.659 1.00 0.00 O ATOM 586 CB PRO A 37 55.425 44.164 13.960 1.00 0.00 C ATOM 587 CG PRO A 37 56.519 45.223 13.861 1.00 0.00 C ATOM 588 CD PRO A 37 56.367 45.951 15.193 1.00 0.00 C ATOM 0 HA PRO A 37 53.595 45.345 14.032 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.767 43.280 14.498 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.096 43.831 12.976 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.508 44.780 13.747 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.368 45.889 13.011 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.942 45.457 15.977 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.736 46.974 15.124 1.00 0.00 H new ATOM 596 N PRO A 38 52.370 43.375 15.063 1.00 0.00 N ATOM 597 CA PRO A 38 51.482 42.553 15.859 1.00 0.00 C ATOM 598 C PRO A 38 52.101 41.304 16.492 1.00 0.00 C ATOM 599 O PRO A 38 51.758 40.984 17.628 1.00 0.00 O ATOM 600 CB PRO A 38 50.306 42.192 14.957 1.00 0.00 C ATOM 601 CG PRO A 38 50.248 43.367 13.987 1.00 0.00 C ATOM 602 CD PRO A 38 51.723 43.716 13.812 1.00 0.00 C ATOM 0 HA PRO A 38 51.186 43.135 16.732 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.470 41.247 14.438 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.380 42.089 15.522 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.780 43.092 13.042 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.678 44.202 14.393 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.159 43.158 12.983 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.848 44.775 13.585 1.00 0.00 H new ATOM 610 N ASP A 39 53.038 40.624 15.839 1.00 0.00 N ATOM 611 CA ASP A 39 53.715 39.476 16.410 1.00 0.00 C ATOM 612 C ASP A 39 54.540 39.829 17.650 1.00 0.00 C ATOM 613 O ASP A 39 54.796 38.967 18.487 1.00 0.00 O ATOM 614 CB ASP A 39 54.574 38.746 15.382 1.00 0.00 C ATOM 615 CG ASP A 39 55.937 39.393 15.121 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.974 40.475 14.497 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.966 38.809 15.520 1.00 0.00 O ATOM 0 H ASP A 39 53.347 40.858 14.896 1.00 0.00 H new ATOM 0 HA ASP A 39 52.924 38.798 16.731 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.731 37.722 15.720 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.026 38.691 14.442 1.00 0.00 H new ATOM 622 N GLN A 40 54.931 41.091 17.802 1.00 0.00 N ATOM 623 CA GLN A 40 55.688 41.599 18.928 1.00 0.00 C ATOM 624 C GLN A 40 54.805 42.099 20.072 1.00 0.00 C ATOM 625 O GLN A 40 55.333 42.600 21.062 1.00 0.00 O ATOM 626 CB GLN A 40 56.681 42.656 18.451 1.00 0.00 C ATOM 627 CG GLN A 40 57.621 42.158 17.357 1.00 0.00 C ATOM 628 CD GLN A 40 58.793 43.106 17.097 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.292 43.789 17.988 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.281 43.200 15.864 1.00 0.00 N ATOM 0 H GLN A 40 54.717 41.812 17.113 1.00 0.00 H new ATOM 0 HA GLN A 40 56.248 40.766 19.353 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.130 43.520 18.080 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.273 42.997 19.300 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.009 41.179 17.637 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.057 42.025 16.434 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.879 42.640 15.112 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.058 43.832 15.670 1.00 0.00 H new ATOM 639 N GLN A 41 53.486 41.954 19.982 1.00 0.00 N ATOM 640 CA GLN A 41 52.527 42.421 20.963 1.00 0.00 C ATOM 641 C GLN A 41 51.842 41.286 21.729 1.00 0.00 C ATOM 642 O GLN A 41 51.298 40.363 21.126 1.00 0.00 O ATOM 643 CB GLN A 41 51.443 43.262 20.298 1.00 0.00 C ATOM 644 CG GLN A 41 51.910 44.498 19.533 1.00 0.00 C ATOM 645 CD GLN A 41 50.716 45.206 18.889 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.630 45.285 19.459 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.830 45.726 17.670 1.00 0.00 N ATOM 0 H GLN A 41 53.044 41.488 19.189 1.00 0.00 H new ATOM 0 HA GLN A 41 53.103 43.014 21.673 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.891 42.623 19.609 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.741 43.583 21.067 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.424 45.180 20.210 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.628 44.209 18.765 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.720 45.674 17.175 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.027 46.177 17.231 1.00 0.00 H new ATOM 656 N ARG A 42 51.750 41.418 23.050 1.00 0.00 N ATOM 657 CA ARG A 42 50.863 40.690 23.933 1.00 0.00 C ATOM 658 C ARG A 42 49.889 41.671 24.589 1.00 0.00 C ATOM 659 O ARG A 42 50.326 42.695 25.109 1.00 0.00 O ATOM 660 CB ARG A 42 51.655 39.968 25.020 1.00 0.00 C ATOM 661 CG ARG A 42 52.596 38.890 24.490 1.00 0.00 C ATOM 662 CD ARG A 42 53.376 38.268 25.645 1.00 0.00 C ATOM 663 NE ARG A 42 54.064 37.049 25.218 1.00 0.00 N ATOM 664 CZ ARG A 42 55.382 36.828 25.120 1.00 0.00 C ATOM 665 NH1 ARG A 42 56.310 37.753 25.402 1.00 0.00 N ATOM 666 NH2 ARG A 42 55.831 35.644 24.684 1.00 0.00 N ATOM 0 H ARG A 42 52.334 42.082 23.558 1.00 0.00 H new ATOM 0 HA ARG A 42 50.317 39.950 23.347 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.237 40.701 25.579 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.957 39.513 25.722 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.026 38.121 23.969 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.286 39.322 23.765 1.00 0.00 H new ATOM 0 HD2 ARG A 42 54.103 38.986 26.026 1.00 0.00 H new ATOM 0 HD3 ARG A 42 52.696 38.038 26.465 1.00 0.00 H new ATOM 0 HE ARG A 42 53.462 36.266 24.962 1.00 0.00 H new ATOM 0 HH11 ARG A 42 56.026 38.683 25.710 1.00 0.00 H new ATOM 0 HH12 ARG A 42 57.300 37.527 25.309 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.170 34.911 24.427 1.00 0.00 H new ATOM 0 HH22 ARG A 42 56.834 35.475 24.609 1.00 0.00 H new ATOM 680 N LEU A 43 48.594 41.368 24.586 1.00 0.00 N ATOM 681 CA LEU A 43 47.576 42.182 25.219 1.00 0.00 C ATOM 682 C LEU A 43 47.004 41.465 26.444 1.00 0.00 C ATOM 683 O LEU A 43 46.661 40.288 26.363 1.00 0.00 O ATOM 684 CB LEU A 43 46.499 42.574 24.212 1.00 0.00 C ATOM 685 CG LEU A 43 47.007 43.370 23.015 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.852 43.708 22.078 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.685 44.682 23.401 1.00 0.00 C ATOM 0 H LEU A 43 48.222 40.533 24.134 1.00 0.00 H new ATOM 0 HA LEU A 43 48.028 43.108 25.574 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.013 41.668 23.849 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.737 43.161 24.725 1.00 0.00 H new ATOM 0 HG LEU A 43 47.746 42.731 22.531 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.228 44.276 21.227 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.390 42.787 21.723 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.112 44.303 22.613 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.022 45.196 22.501 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.976 45.314 23.936 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.542 44.474 24.042 1.00 0.00 H new ATOM 699 N ILE A 44 46.926 42.165 27.572 1.00 0.00 N ATOM 700 CA ILE A 44 46.554 41.621 28.864 1.00 0.00 C ATOM 701 C ILE A 44 45.396 42.416 29.469 1.00 0.00 C ATOM 702 O ILE A 44 45.436 43.642 29.523 1.00 0.00 O ATOM 703 CB ILE A 44 47.745 41.534 29.813 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.956 40.900 29.134 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.348 40.761 31.068 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.156 40.612 30.031 1.00 0.00 C ATOM 0 H ILE A 44 47.129 43.164 27.607 1.00 0.00 H new ATOM 0 HA ILE A 44 46.212 40.598 28.709 1.00 0.00 H new ATOM 0 HB ILE A 44 48.034 42.545 30.099 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.640 39.964 28.674 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.281 41.558 28.328 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.201 40.701 31.743 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.526 41.274 31.567 1.00 0.00 H new ATOM 0 HG23 ILE A 44 47.033 39.755 30.791 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.953 40.163 29.439 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.512 41.543 30.473 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.861 39.924 30.823 1.00 0.00 H new ATOM 718 N PHE A 45 44.373 41.713 29.948 1.00 0.00 N ATOM 719 CA PHE A 45 43.254 42.288 30.668 1.00 0.00 C ATOM 720 C PHE A 45 42.681 41.287 31.671 1.00 0.00 C ATOM 721 O PHE A 45 42.492 40.121 31.329 1.00 0.00 O ATOM 722 CB PHE A 45 42.182 42.721 29.672 1.00 0.00 C ATOM 723 CG PHE A 45 41.015 43.455 30.287 1.00 0.00 C ATOM 724 CD1 PHE A 45 41.202 44.736 30.820 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.741 42.876 30.305 1.00 0.00 C ATOM 726 CE1 PHE A 45 40.116 45.445 31.348 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.653 43.581 30.834 1.00 0.00 C ATOM 728 CZ PHE A 45 38.840 44.868 31.351 1.00 0.00 C ATOM 0 H PHE A 45 44.303 40.701 29.840 1.00 0.00 H new ATOM 0 HA PHE A 45 43.600 43.158 31.227 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.641 43.361 28.919 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.807 41.838 29.154 1.00 0.00 H new ATOM 0 HD1 PHE A 45 42.187 45.179 30.824 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.596 41.882 29.909 1.00 0.00 H new ATOM 0 HE1 PHE A 45 40.262 46.436 31.752 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.671 43.132 30.843 1.00 0.00 H new ATOM 0 HZ PHE A 45 38.000 45.416 31.752 1.00 0.00 H new ATOM 738 N ALA A 46 42.424 41.724 32.900 1.00 0.00 N ATOM 739 CA ALA A 46 42.044 40.875 34.011 1.00 0.00 C ATOM 740 C ALA A 46 42.972 39.671 34.188 1.00 0.00 C ATOM 741 O ALA A 46 42.532 38.537 34.363 1.00 0.00 O ATOM 742 CB ALA A 46 40.559 40.543 33.917 1.00 0.00 C ATOM 0 H ALA A 46 42.478 42.711 33.152 1.00 0.00 H new ATOM 0 HA ALA A 46 42.182 41.423 34.943 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.275 39.904 34.754 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.977 41.464 33.950 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.361 40.023 32.980 1.00 0.00 H new ATOM 748 N GLY A 47 44.277 39.886 34.045 1.00 0.00 N ATOM 749 CA GLY A 47 45.315 38.876 34.093 1.00 0.00 C ATOM 750 C GLY A 47 45.396 37.907 32.911 1.00 0.00 C ATOM 751 O GLY A 47 46.417 37.241 32.753 1.00 0.00 O ATOM 0 H GLY A 47 44.652 40.821 33.884 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.276 39.382 34.183 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.177 38.291 35.002 1.00 0.00 H new ATOM 755 N LYS A 48 44.382 37.844 32.055 1.00 0.00 N ATOM 756 CA LYS A 48 44.342 36.966 30.902 1.00 0.00 C ATOM 757 C LYS A 48 45.162 37.553 29.752 1.00 0.00 C ATOM 758 O LYS A 48 44.944 38.703 29.380 1.00 0.00 O ATOM 759 CB LYS A 48 42.906 36.719 30.449 1.00 0.00 C ATOM 760 CG LYS A 48 42.034 36.048 31.506 1.00 0.00 C ATOM 761 CD LYS A 48 40.668 35.667 30.942 1.00 0.00 C ATOM 762 CE LYS A 48 39.829 34.984 32.018 1.00 0.00 C ATOM 763 NZ LYS A 48 38.592 34.404 31.472 1.00 0.00 N ATOM 0 H LYS A 48 43.545 38.419 32.151 1.00 0.00 H new ATOM 0 HA LYS A 48 44.778 36.011 31.195 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.454 37.671 30.169 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.919 36.097 29.554 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.536 35.156 31.881 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.904 36.721 32.354 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.154 36.557 30.580 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.791 35.001 30.088 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.418 34.199 32.492 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.578 35.707 32.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.054 33.951 32.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.016 35.156 31.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.830 33.695 30.750 1.00 0.00 H new ATOM 777 N GLN A 49 46.027 36.749 29.139 1.00 0.00 N ATOM 778 CA GLN A 49 46.602 37.062 27.847 1.00 0.00 C ATOM 779 C GLN A 49 45.557 36.804 26.761 1.00 0.00 C ATOM 780 O GLN A 49 45.106 35.674 26.581 1.00 0.00 O ATOM 781 CB GLN A 49 47.876 36.265 27.582 1.00 0.00 C ATOM 782 CG GLN A 49 49.083 36.731 28.391 1.00 0.00 C ATOM 783 CD GLN A 49 50.433 36.334 27.789 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.575 36.025 26.608 1.00 0.00 O ATOM 785 NE2 GLN A 49 51.514 36.392 28.561 1.00 0.00 N ATOM 0 H GLN A 49 46.345 35.862 29.530 1.00 0.00 H new ATOM 0 HA GLN A 49 46.887 38.114 27.838 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.687 35.215 27.804 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.117 36.328 26.521 1.00 0.00 H new ATOM 0 HG2 GLN A 49 49.045 37.816 28.486 1.00 0.00 H new ATOM 0 HG3 GLN A 49 49.012 36.320 29.398 1.00 0.00 H new ATOM 0 HE21 GLN A 49 51.425 36.646 29.545 1.00 0.00 H new ATOM 0 HE22 GLN A 49 52.432 36.183 28.169 1.00 0.00 H new ATOM 794 N LEU A 50 45.155 37.845 26.037 1.00 0.00 N ATOM 795 CA LEU A 50 44.049 37.791 25.103 1.00 0.00 C ATOM 796 C LEU A 50 44.461 37.093 23.805 1.00 0.00 C ATOM 797 O LEU A 50 45.426 37.507 23.165 1.00 0.00 O ATOM 798 CB LEU A 50 43.513 39.200 24.867 1.00 0.00 C ATOM 799 CG LEU A 50 43.197 40.017 26.117 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.643 41.381 25.720 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.189 39.340 27.041 1.00 0.00 C ATOM 0 H LEU A 50 45.600 38.762 26.088 1.00 0.00 H new ATOM 0 HA LEU A 50 43.242 37.193 25.527 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.243 39.750 24.273 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.606 39.126 24.267 1.00 0.00 H new ATOM 0 HG LEU A 50 44.136 40.114 26.662 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.420 41.958 26.617 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.382 41.913 25.120 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.731 41.248 25.138 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.009 39.973 27.910 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.252 39.184 26.506 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.584 38.379 27.369 1.00 0.00 H new ATOM 813 N GLU A 51 43.745 36.042 23.415 1.00 0.00 N ATOM 814 CA GLU A 51 44.067 35.260 22.239 1.00 0.00 C ATOM 815 C GLU A 51 43.656 35.956 20.940 1.00 0.00 C ATOM 816 O GLU A 51 42.547 36.473 20.816 1.00 0.00 O ATOM 817 CB GLU A 51 43.483 33.853 22.322 1.00 0.00 C ATOM 818 CG GLU A 51 44.124 33.020 23.429 1.00 0.00 C ATOM 819 CD GLU A 51 43.794 31.530 23.318 1.00 0.00 C ATOM 820 OE1 GLU A 51 42.599 31.163 23.289 1.00 0.00 O ATOM 821 OE2 GLU A 51 44.731 30.704 23.294 1.00 0.00 O ATOM 0 H GLU A 51 42.919 35.712 23.915 1.00 0.00 H new ATOM 0 HA GLU A 51 45.153 35.170 22.218 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.409 33.918 22.496 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.621 33.349 21.366 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.206 33.151 23.396 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.787 33.391 24.397 1.00 0.00 H new ATOM 828 N ASP A 52 44.528 35.911 19.937 1.00 0.00 N ATOM 829 CA ASP A 52 44.396 36.590 18.664 1.00 0.00 C ATOM 830 C ASP A 52 43.161 36.156 17.872 1.00 0.00 C ATOM 831 O ASP A 52 42.557 36.966 17.172 1.00 0.00 O ATOM 832 CB ASP A 52 45.659 36.346 17.843 1.00 0.00 C ATOM 833 CG ASP A 52 46.929 36.904 18.490 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.242 38.099 18.298 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.649 36.148 19.176 1.00 0.00 O ATOM 0 H ASP A 52 45.390 35.369 20.000 1.00 0.00 H new ATOM 0 HA ASP A 52 44.266 37.652 18.870 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.781 35.274 17.689 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.535 36.797 16.858 1.00 0.00 H new ATOM 840 N GLY A 53 42.743 34.902 18.019 1.00 0.00 N ATOM 841 CA GLY A 53 41.574 34.327 17.384 1.00 0.00 C ATOM 842 C GLY A 53 40.215 34.685 17.989 1.00 0.00 C ATOM 843 O GLY A 53 39.214 34.168 17.499 1.00 0.00 O ATOM 0 H GLY A 53 43.236 34.234 18.612 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.571 34.632 16.338 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.678 33.242 17.400 1.00 0.00 H new ATOM 847 N ARG A 54 40.147 35.498 19.039 1.00 0.00 N ATOM 848 CA ARG A 54 38.944 35.837 19.773 1.00 0.00 C ATOM 849 C ARG A 54 38.501 37.291 19.600 1.00 0.00 C ATOM 850 O ARG A 54 39.213 38.108 19.019 1.00 0.00 O ATOM 851 CB ARG A 54 39.113 35.439 21.237 1.00 0.00 C ATOM 852 CG ARG A 54 38.447 34.097 21.531 1.00 0.00 C ATOM 853 CD ARG A 54 38.641 33.681 22.987 1.00 0.00 C ATOM 854 NE ARG A 54 37.722 32.607 23.365 1.00 0.00 N ATOM 855 CZ ARG A 54 38.013 31.350 23.727 1.00 0.00 C ATOM 856 NH1 ARG A 54 39.220 30.785 23.585 1.00 0.00 N ATOM 857 NH2 ARG A 54 37.066 30.569 24.266 1.00 0.00 N ATOM 0 H ARG A 54 40.975 35.959 19.416 1.00 0.00 H new ATOM 0 HA ARG A 54 38.123 35.262 19.345 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.174 35.381 21.479 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.681 36.209 21.877 1.00 0.00 H new ATOM 0 HG2 ARG A 54 37.382 34.162 21.309 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.863 33.332 20.875 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.669 33.352 23.139 1.00 0.00 H new ATOM 0 HD3 ARG A 54 38.483 34.542 23.637 1.00 0.00 H new ATOM 0 HE ARG A 54 36.731 32.846 23.351 1.00 0.00 H new ATOM 0 HH11 ARG A 54 39.988 31.319 23.179 1.00 0.00 H new ATOM 0 HH12 ARG A 54 39.370 29.821 23.883 1.00 0.00 H new ATOM 0 HH21 ARG A 54 36.122 30.931 24.401 1.00 0.00 H new ATOM 0 HH22 ARG A 54 37.289 29.612 24.541 1.00 0.00 H new ATOM 871 N THR A 55 37.316 37.617 20.109 1.00 0.00 N ATOM 872 CA THR A 55 36.744 38.948 20.116 1.00 0.00 C ATOM 873 C THR A 55 36.809 39.638 21.481 1.00 0.00 C ATOM 874 O THR A 55 36.967 38.995 22.516 1.00 0.00 O ATOM 875 CB THR A 55 35.299 38.984 19.630 1.00 0.00 C ATOM 876 OG1 THR A 55 34.435 38.397 20.577 1.00 0.00 O ATOM 877 CG2 THR A 55 35.062 38.300 18.287 1.00 0.00 C ATOM 0 H THR A 55 36.706 36.926 20.546 1.00 0.00 H new ATOM 0 HA THR A 55 37.374 39.496 19.415 1.00 0.00 H new ATOM 0 HB THR A 55 35.085 40.045 19.499 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.442 37.423 20.467 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.007 38.375 18.022 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.665 38.786 17.520 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.344 37.250 18.359 1.00 0.00 H new ATOM 885 N LEU A 56 36.603 40.952 21.501 1.00 0.00 N ATOM 886 CA LEU A 56 36.376 41.715 22.712 1.00 0.00 C ATOM 887 C LEU A 56 35.159 41.218 23.495 1.00 0.00 C ATOM 888 O LEU A 56 35.204 41.193 24.723 1.00 0.00 O ATOM 889 CB LEU A 56 36.237 43.192 22.357 1.00 0.00 C ATOM 890 CG LEU A 56 37.476 43.857 21.765 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.168 45.316 21.436 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.675 43.843 22.709 1.00 0.00 C ATOM 0 H LEU A 56 36.590 41.522 20.655 1.00 0.00 H new ATOM 0 HA LEU A 56 37.236 41.577 23.368 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.417 43.299 21.647 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.952 43.736 23.257 1.00 0.00 H new ATOM 0 HG LEU A 56 37.733 43.283 20.875 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.055 45.789 21.013 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.353 45.362 20.714 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.876 45.840 22.346 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.523 44.331 22.228 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.422 44.375 23.626 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.938 42.813 22.948 1.00 0.00 H new ATOM 904 N SER A 57 34.102 40.772 22.823 1.00 0.00 N ATOM 905 CA SER A 57 32.932 40.184 23.444 1.00 0.00 C ATOM 906 C SER A 57 33.211 38.849 24.137 1.00 0.00 C ATOM 907 O SER A 57 32.637 38.599 25.194 1.00 0.00 O ATOM 908 CB SER A 57 31.814 39.978 22.426 1.00 0.00 C ATOM 909 OG SER A 57 31.194 41.207 22.121 1.00 0.00 O ATOM 0 H SER A 57 34.039 40.813 21.806 1.00 0.00 H new ATOM 0 HA SER A 57 32.627 40.899 24.208 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.219 39.532 21.517 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.077 39.280 22.822 1.00 0.00 H new ATOM 0 HG SER A 57 31.879 41.893 21.981 1.00 0.00 H new ATOM 915 N ASP A 58 34.119 38.028 23.616 1.00 0.00 N ATOM 916 CA ASP A 58 34.520 36.783 24.242 1.00 0.00 C ATOM 917 C ASP A 58 35.261 36.993 25.564 1.00 0.00 C ATOM 918 O ASP A 58 35.284 36.090 26.397 1.00 0.00 O ATOM 919 CB ASP A 58 35.366 35.939 23.293 1.00 0.00 C ATOM 920 CG ASP A 58 34.622 35.590 22.003 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.496 35.049 22.069 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.166 35.876 20.915 1.00 0.00 O ATOM 0 H ASP A 58 34.600 38.216 22.736 1.00 0.00 H new ATOM 0 HA ASP A 58 33.599 36.248 24.471 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.280 36.480 23.047 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.665 35.020 23.797 1.00 0.00 H new ATOM 927 N TYR A 59 35.812 38.182 25.783 1.00 0.00 N ATOM 928 CA TYR A 59 36.450 38.610 27.013 1.00 0.00 C ATOM 929 C TYR A 59 35.647 39.642 27.806 1.00 0.00 C ATOM 930 O TYR A 59 36.129 40.116 28.833 1.00 0.00 O ATOM 931 CB TYR A 59 37.857 39.102 26.691 1.00 0.00 C ATOM 932 CG TYR A 59 38.799 38.006 26.250 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.209 37.047 27.185 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.263 37.943 24.932 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.086 36.025 26.805 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.159 36.939 24.545 1.00 0.00 C ATOM 937 CZ TYR A 59 40.560 35.964 25.480 1.00 0.00 C ATOM 938 OH TYR A 59 41.391 34.949 25.106 1.00 0.00 O ATOM 0 H TYR A 59 35.824 38.908 25.067 1.00 0.00 H new ATOM 0 HA TYR A 59 36.502 37.747 27.677 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.798 39.855 25.906 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.271 39.592 27.572 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.847 37.096 28.201 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.928 38.672 24.209 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.399 35.284 27.526 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.541 36.912 23.535 1.00 0.00 H new ATOM 0 HH TYR A 59 40.859 34.194 24.779 1.00 0.00 H new ATOM 948 N ASN A 60 34.436 39.985 27.376 1.00 0.00 N ATOM 949 CA ASN A 60 33.573 40.978 27.983 1.00 0.00 C ATOM 950 C ASN A 60 34.220 42.350 28.182 1.00 0.00 C ATOM 951 O ASN A 60 34.020 43.011 29.199 1.00 0.00 O ATOM 952 CB ASN A 60 32.906 40.384 29.220 1.00 0.00 C ATOM 953 CG ASN A 60 31.654 41.142 29.666 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.196 42.106 29.056 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.035 40.706 30.760 1.00 0.00 N ATOM 0 H ASN A 60 34.015 39.553 26.554 1.00 0.00 H new ATOM 0 HA ASN A 60 32.782 41.220 27.273 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.639 39.347 29.016 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.625 40.373 30.040 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.188 41.171 31.086 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.408 39.907 31.273 1.00 0.00 H new ATOM 962 N ILE A 61 35.015 42.801 27.216 1.00 0.00 N ATOM 963 CA ILE A 61 35.659 44.098 27.234 1.00 0.00 C ATOM 964 C ILE A 61 34.667 45.148 26.727 1.00 0.00 C ATOM 965 O ILE A 61 34.335 45.167 25.544 1.00 0.00 O ATOM 966 CB ILE A 61 36.960 44.058 26.438 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.973 43.125 27.095 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.553 45.458 26.305 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.131 42.716 26.189 1.00 0.00 C ATOM 0 H ILE A 61 35.231 42.256 26.381 1.00 0.00 H new ATOM 0 HA ILE A 61 35.941 44.375 28.250 1.00 0.00 H new ATOM 0 HB ILE A 61 36.730 43.676 25.443 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.376 43.613 27.982 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.456 42.227 27.432 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.480 45.408 25.734 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.844 46.106 25.789 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.759 45.862 27.296 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.803 42.054 26.734 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.742 42.197 25.313 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.676 43.605 25.872 1.00 0.00 H new ATOM 981 N GLN A 62 34.190 46.006 27.625 1.00 0.00 N ATOM 982 CA GLN A 62 33.264 47.079 27.324 1.00 0.00 C ATOM 983 C GLN A 62 33.939 48.421 27.032 1.00 0.00 C ATOM 984 O GLN A 62 35.126 48.606 27.289 1.00 0.00 O ATOM 985 CB GLN A 62 32.227 47.192 28.437 1.00 0.00 C ATOM 986 CG GLN A 62 31.002 46.332 28.142 1.00 0.00 C ATOM 987 CD GLN A 62 30.197 46.802 26.929 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.468 47.825 26.302 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.172 46.049 26.542 1.00 0.00 N ATOM 0 H GLN A 62 34.449 45.967 28.611 1.00 0.00 H new ATOM 0 HA GLN A 62 32.764 46.816 26.392 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.671 46.884 29.384 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.924 48.233 28.551 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.323 45.303 27.977 1.00 0.00 H new ATOM 0 HG3 GLN A 62 30.353 46.327 29.018 1.00 0.00 H new ATOM 0 HE21 GLN A 62 28.941 45.199 27.056 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.617 46.321 25.731 1.00 0.00 H new ATOM 998 N LYS A 63 33.173 49.367 26.493 1.00 0.00 N ATOM 999 CA LYS A 63 33.650 50.680 26.109 1.00 0.00 C ATOM 1000 C LYS A 63 34.360 51.433 27.235 1.00 0.00 C ATOM 1001 O LYS A 63 34.000 51.322 28.405 1.00 0.00 O ATOM 1002 CB LYS A 63 32.523 51.499 25.486 1.00 0.00 C ATOM 1003 CG LYS A 63 31.419 51.943 26.441 1.00 0.00 C ATOM 1004 CD LYS A 63 30.364 52.742 25.681 1.00 0.00 C ATOM 1005 CE LYS A 63 29.213 53.142 26.599 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.182 53.900 25.874 1.00 0.00 N ATOM 0 H LYS A 63 32.179 49.231 26.309 1.00 0.00 H new ATOM 0 HA LYS A 63 34.419 50.524 25.353 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.956 52.386 25.024 1.00 0.00 H new ATOM 0 HB3 LYS A 63 32.071 50.912 24.687 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.960 51.073 26.910 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.841 52.551 27.241 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.819 53.635 25.252 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.982 52.148 24.851 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.768 52.248 27.037 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.596 53.744 27.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 27.415 54.156 26.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 28.602 54.765 25.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 27.799 53.316 25.103 1.00 0.00 H new ATOM 1020 N GLU A 64 35.392 52.184 26.863 1.00 0.00 N ATOM 1021 CA GLU A 64 36.291 52.917 27.731 1.00 0.00 C ATOM 1022 C GLU A 64 37.142 52.088 28.695 1.00 0.00 C ATOM 1023 O GLU A 64 37.863 52.659 29.509 1.00 0.00 O ATOM 1024 CB GLU A 64 35.579 54.077 28.421 1.00 0.00 C ATOM 1025 CG GLU A 64 35.072 55.123 27.434 1.00 0.00 C ATOM 1026 CD GLU A 64 34.519 56.353 28.158 1.00 0.00 C ATOM 1027 OE1 GLU A 64 35.303 57.066 28.818 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.299 56.614 28.073 1.00 0.00 O ATOM 0 H GLU A 64 35.634 52.301 25.879 1.00 0.00 H new ATOM 0 HA GLU A 64 37.039 53.322 27.050 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.739 53.691 28.999 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.262 54.550 29.127 1.00 0.00 H new ATOM 0 HG2 GLU A 64 35.884 55.423 26.771 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.294 54.687 26.808 1.00 0.00 H new ATOM 1035 N SER A 65 37.122 50.761 28.596 1.00 0.00 N ATOM 1036 CA SER A 65 38.034 49.906 29.330 1.00 0.00 C ATOM 1037 C SER A 65 39.485 50.116 28.893 1.00 0.00 C ATOM 1038 O SER A 65 39.749 50.464 27.744 1.00 0.00 O ATOM 1039 CB SER A 65 37.687 48.429 29.168 1.00 0.00 C ATOM 1040 OG SER A 65 36.371 48.181 29.609 1.00 0.00 O ATOM 0 H SER A 65 36.468 50.253 28.001 1.00 0.00 H new ATOM 0 HA SER A 65 37.927 50.187 30.378 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.788 48.138 28.122 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.389 47.820 29.737 1.00 0.00 H new ATOM 0 HG SER A 65 35.734 48.521 28.946 1.00 0.00 H new ATOM 1046 N THR A 66 40.424 49.857 29.799 1.00 0.00 N ATOM 1047 CA THR A 66 41.846 50.012 29.571 1.00 0.00 C ATOM 1048 C THR A 66 42.541 48.649 29.582 1.00 0.00 C ATOM 1049 O THR A 66 42.412 47.905 30.552 1.00 0.00 O ATOM 1050 CB THR A 66 42.487 50.938 30.602 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.789 52.160 30.691 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.931 51.285 30.253 1.00 0.00 C ATOM 0 H THR A 66 40.203 49.524 30.738 1.00 0.00 H new ATOM 0 HA THR A 66 41.972 50.469 28.590 1.00 0.00 H new ATOM 0 HB THR A 66 42.451 50.392 31.544 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.218 52.734 31.359 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.341 51.945 31.017 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.524 50.371 30.207 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.961 51.786 29.286 1.00 0.00 H new ATOM 1060 N LEU A 67 43.285 48.330 28.527 1.00 0.00 N ATOM 1061 CA LEU A 67 44.028 47.098 28.349 1.00 0.00 C ATOM 1062 C LEU A 67 45.529 47.362 28.475 1.00 0.00 C ATOM 1063 O LEU A 67 45.980 48.473 28.204 1.00 0.00 O ATOM 1064 CB LEU A 67 43.700 46.469 26.997 1.00 0.00 C ATOM 1065 CG LEU A 67 42.243 46.481 26.549 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.116 45.721 25.232 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.278 45.831 27.538 1.00 0.00 C ATOM 0 H LEU A 67 43.388 48.962 27.733 1.00 0.00 H new ATOM 0 HA LEU A 67 43.736 46.397 29.131 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.290 46.981 26.236 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.037 45.433 27.018 1.00 0.00 H new ATOM 0 HG LEU A 67 41.971 47.533 26.460 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.075 45.727 24.907 1.00 0.00 H new ATOM 0 HD12 LEU A 67 42.735 46.201 24.474 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.446 44.692 25.372 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.263 45.882 27.143 1.00 0.00 H new ATOM 0 HD22 LEU A 67 41.558 44.788 27.687 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.323 46.359 28.491 1.00 0.00 H new ATOM 1079 N HIS A 68 46.323 46.359 28.836 1.00 0.00 N ATOM 1080 CA HIS A 68 47.751 46.501 29.039 1.00 0.00 C ATOM 1081 C HIS A 68 48.542 45.842 27.906 1.00 0.00 C ATOM 1082 O HIS A 68 48.290 44.690 27.563 1.00 0.00 O ATOM 1083 CB HIS A 68 48.149 45.955 30.407 1.00 0.00 C ATOM 1084 CG HIS A 68 47.407 46.621 31.532 1.00 0.00 C ATOM 1085 ND1 HIS A 68 47.731 47.850 32.103 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.225 46.182 32.072 1.00 0.00 C ATOM 1087 CE1 HIS A 68 46.750 48.132 32.964 1.00 0.00 C ATOM 1088 NE2 HIS A 68 45.830 47.154 32.969 1.00 0.00 N ATOM 0 H HIS A 68 45.982 45.411 28.997 1.00 0.00 H new ATOM 0 HA HIS A 68 48.000 47.562 29.019 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.959 44.882 30.436 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.221 46.092 30.552 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.708 45.262 31.842 1.00 0.00 H new ATOM 0 HE1 HIS A 68 46.703 49.023 33.572 1.00 0.00 H new ATOM 0 HE2 HIS A 68 44.984 47.133 33.538 1.00 0.00 H new ATOM 1096 N LEU A 69 49.505 46.565 27.340 1.00 0.00 N ATOM 1097 CA LEU A 69 50.457 46.061 26.370 1.00 0.00 C ATOM 1098 C LEU A 69 51.716 45.546 27.072 1.00 0.00 C ATOM 1099 O LEU A 69 52.287 46.239 27.911 1.00 0.00 O ATOM 1100 CB LEU A 69 50.762 47.164 25.360 1.00 0.00 C ATOM 1101 CG LEU A 69 51.809 46.829 24.302 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.375 45.716 23.352 1.00 0.00 C ATOM 1103 CD2 LEU A 69 52.110 48.060 23.452 1.00 0.00 C ATOM 0 H LEU A 69 49.644 47.552 27.556 1.00 0.00 H new ATOM 0 HA LEU A 69 50.035 45.213 25.831 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.835 47.432 24.853 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.095 48.047 25.905 1.00 0.00 H new ATOM 0 HG LEU A 69 52.687 46.492 24.854 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.166 45.529 22.626 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.182 44.807 23.921 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.467 46.017 22.830 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.858 47.809 22.700 1.00 0.00 H new ATOM 0 HD22 LEU A 69 51.197 48.393 22.958 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.490 48.858 24.090 1.00 0.00 H new ATOM 1115 N VAL A 70 52.171 44.362 26.672 1.00 0.00 N ATOM 1116 CA VAL A 70 53.467 43.786 26.968 1.00 0.00 C ATOM 1117 C VAL A 70 54.087 43.322 25.649 1.00 0.00 C ATOM 1118 O VAL A 70 53.360 42.974 24.719 1.00 0.00 O ATOM 1119 CB VAL A 70 53.330 42.649 27.975 1.00 0.00 C ATOM 1120 CG1 VAL A 70 54.655 41.963 28.298 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.746 43.137 29.298 1.00 0.00 C ATOM 0 H VAL A 70 51.602 43.743 26.095 1.00 0.00 H new ATOM 0 HA VAL A 70 54.123 44.524 27.429 1.00 0.00 H new ATOM 0 HB VAL A 70 52.664 41.935 27.491 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.485 41.165 29.020 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.079 41.543 27.386 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.349 42.691 28.719 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.663 42.299 29.990 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.399 43.898 29.725 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.758 43.563 29.124 1.00 0.00 H new