USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 586 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 25 ASN : amide:sc= 0.505 K(o=2.2,f=-3.5) USER MOD Set 1.2: A 29 LYS NZ :NH3+ 160:sc= 1.71 (180deg=0.988) USER MOD Set 2.1: A 7 THR OG1 : rot -76:sc= 1.03 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.0315 USER MOD Single : A 1 MET CE :methyl -155:sc= 0 (180deg=-0.531) USER MOD Single : A 1 MET N :NH3+ 170:sc= 0.77 (180deg=0.691) USER MOD Single : A 2 GLN : amide:sc= -1.58 K(o=-1.6,f=-0.011) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc=-0.00671 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0612 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00505 USER MOD Single : A 27 LYS NZ :NH3+ 172:sc= 1.15 (180deg=1.09) USER MOD Single : A 31 GLN : amide:sc= -1.07 K(o=-1.1,f=-0.39) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.494 X(o=-0.49,f=-0.49) USER MOD Single : A 41 GLN : amide:sc= 0.661 K(o=0.66,f=-0.78) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -1.2! K(o=-1.2!,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 100:sc= 1.02 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.192 K(o=-0.19,f=-1.1) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 83:sc= 1.07 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 13.836 30.178 15.859 1.00 0.00 N ATOM 2 CA MET A 1 13.754 30.810 17.189 1.00 0.00 C ATOM 3 C MET A 1 15.127 31.412 17.489 1.00 0.00 C ATOM 4 O MET A 1 16.040 31.461 16.663 1.00 0.00 O ATOM 5 CB MET A 1 13.363 29.790 18.257 1.00 0.00 C ATOM 6 CG MET A 1 13.983 28.402 18.286 1.00 0.00 C ATOM 7 SD MET A 1 13.328 27.334 19.593 1.00 0.00 S ATOM 8 CE MET A 1 14.250 25.800 19.347 1.00 0.00 C ATOM 0 H1 MET A 1 12.979 29.613 15.690 1.00 0.00 H new ATOM 0 H2 MET A 1 13.915 30.914 15.129 1.00 0.00 H new ATOM 0 H3 MET A 1 14.672 29.560 15.819 1.00 0.00 H new ATOM 0 HA MET A 1 12.986 31.583 17.196 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.565 30.249 19.225 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.284 29.655 18.188 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.820 27.921 17.321 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.061 28.499 18.415 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.676 24.963 19.744 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.425 25.648 18.282 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.206 25.863 19.867 1.00 0.00 H new ATOM 20 N GLN A 2 15.162 31.999 18.676 1.00 0.00 N ATOM 21 CA GLN A 2 16.387 32.539 19.230 1.00 0.00 C ATOM 22 C GLN A 2 16.916 31.599 20.323 1.00 0.00 C ATOM 23 O GLN A 2 16.060 30.949 20.923 1.00 0.00 O ATOM 24 CB GLN A 2 15.973 33.831 19.931 1.00 0.00 C ATOM 25 CG GLN A 2 15.439 34.979 19.062 1.00 0.00 C ATOM 26 CD GLN A 2 15.301 36.316 19.775 1.00 0.00 C ATOM 27 OE1 GLN A 2 14.750 37.304 19.292 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.691 36.332 21.049 1.00 0.00 N ATOM 0 H GLN A 2 14.345 32.112 19.277 1.00 0.00 H new ATOM 0 HA GLN A 2 17.144 32.675 18.457 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.207 33.583 20.665 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.836 34.203 20.484 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.104 35.107 18.208 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.464 34.693 18.667 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.148 35.514 21.453 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.532 37.162 21.621 1.00 0.00 H new ATOM 37 N ILE A 3 18.232 31.534 20.520 1.00 0.00 N ATOM 38 CA ILE A 3 18.887 30.858 21.615 1.00 0.00 C ATOM 39 C ILE A 3 20.025 31.720 22.157 1.00 0.00 C ATOM 40 O ILE A 3 20.520 32.599 21.447 1.00 0.00 O ATOM 41 CB ILE A 3 19.251 29.420 21.230 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.006 29.327 19.901 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.070 28.469 21.379 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.933 28.105 19.901 1.00 0.00 C ATOM 0 H ILE A 3 18.894 31.977 19.883 1.00 0.00 H new ATOM 0 HA ILE A 3 18.206 30.737 22.457 1.00 0.00 H new ATOM 0 HB ILE A 3 19.980 29.064 21.958 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.297 29.254 19.076 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.589 30.234 19.741 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.376 27.462 21.095 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.733 28.467 22.416 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.255 28.797 20.733 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.464 28.051 18.950 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.653 28.195 20.714 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.342 27.200 20.039 1.00 0.00 H new ATOM 56 N PHE A 4 20.427 31.532 23.417 1.00 0.00 N ATOM 57 CA PHE A 4 21.594 32.199 23.944 1.00 0.00 C ATOM 58 C PHE A 4 22.714 31.169 24.089 1.00 0.00 C ATOM 59 O PHE A 4 22.428 30.063 24.555 1.00 0.00 O ATOM 60 CB PHE A 4 21.307 32.765 25.340 1.00 0.00 C ATOM 61 CG PHE A 4 20.243 33.830 25.381 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.318 34.942 24.533 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.167 33.691 26.263 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.339 35.928 24.646 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.141 34.640 26.281 1.00 0.00 C ATOM 66 CZ PHE A 4 18.189 35.762 25.434 1.00 0.00 C ATOM 0 H PHE A 4 19.953 30.921 24.082 1.00 0.00 H new ATOM 0 HA PHE A 4 21.871 33.008 23.268 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.008 31.946 25.995 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.230 33.177 25.747 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.115 35.033 23.809 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.128 32.846 26.934 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.470 36.855 24.107 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.304 34.511 26.951 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.373 36.468 25.392 1.00 0.00 H new ATOM 76 N VAL A 5 23.950 31.384 23.654 1.00 0.00 N ATOM 77 CA VAL A 5 25.120 30.541 23.811 1.00 0.00 C ATOM 78 C VAL A 5 26.235 31.211 24.622 1.00 0.00 C ATOM 79 O VAL A 5 26.802 32.202 24.170 1.00 0.00 O ATOM 80 CB VAL A 5 25.615 30.036 22.460 1.00 0.00 C ATOM 81 CG1 VAL A 5 26.823 29.104 22.481 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.475 29.295 21.756 1.00 0.00 C ATOM 0 H VAL A 5 24.175 32.233 23.135 1.00 0.00 H new ATOM 0 HA VAL A 5 24.811 29.675 24.397 1.00 0.00 H new ATOM 0 HB VAL A 5 25.942 30.937 21.941 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.077 28.815 21.461 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.671 29.617 22.935 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.585 28.213 23.062 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.821 28.930 20.789 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.156 28.452 22.369 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.636 29.975 21.609 1.00 0.00 H new ATOM 92 N LYS A 6 26.618 30.692 25.779 1.00 0.00 N ATOM 93 CA LYS A 6 27.654 31.275 26.621 1.00 0.00 C ATOM 94 C LYS A 6 28.998 30.633 26.271 1.00 0.00 C ATOM 95 O LYS A 6 29.130 29.457 25.927 1.00 0.00 O ATOM 96 CB LYS A 6 27.292 31.046 28.086 1.00 0.00 C ATOM 97 CG LYS A 6 26.760 32.375 28.629 1.00 0.00 C ATOM 98 CD LYS A 6 26.260 32.182 30.068 1.00 0.00 C ATOM 99 CE LYS A 6 26.166 33.538 30.757 1.00 0.00 C ATOM 100 NZ LYS A 6 25.582 33.445 32.101 1.00 0.00 N ATOM 0 H LYS A 6 26.212 29.840 26.166 1.00 0.00 H new ATOM 0 HA LYS A 6 27.731 32.349 26.452 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.540 30.263 28.179 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.164 30.720 28.652 1.00 0.00 H new ATOM 0 HG2 LYS A 6 27.546 33.130 28.605 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.949 32.739 27.998 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.285 31.696 30.064 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.939 31.529 30.616 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.161 33.977 30.826 1.00 0.00 H new ATOM 0 HE3 LYS A 6 25.563 34.211 30.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.540 34.393 32.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 24.622 33.051 32.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.171 32.825 32.693 1.00 0.00 H new ATOM 114 N THR A 7 29.929 31.580 26.255 1.00 0.00 N ATOM 115 CA THR A 7 31.330 31.254 26.006 1.00 0.00 C ATOM 116 C THR A 7 32.006 30.928 27.333 1.00 0.00 C ATOM 117 O THR A 7 31.551 31.218 28.439 1.00 0.00 O ATOM 118 CB THR A 7 31.962 32.408 25.226 1.00 0.00 C ATOM 119 OG1 THR A 7 31.864 33.551 26.053 1.00 0.00 O ATOM 120 CG2 THR A 7 31.420 32.689 23.825 1.00 0.00 C ATOM 0 H THR A 7 29.743 32.571 26.410 1.00 0.00 H new ATOM 0 HA THR A 7 31.450 30.364 25.388 1.00 0.00 H new ATOM 0 HB THR A 7 32.989 32.116 25.008 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.944 33.888 26.038 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.958 33.531 23.389 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.557 31.808 23.198 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.359 32.929 23.887 1.00 0.00 H new ATOM 128 N LEU A 8 33.210 30.361 27.255 1.00 0.00 N ATOM 129 CA LEU A 8 34.201 30.313 28.321 1.00 0.00 C ATOM 130 C LEU A 8 34.813 31.685 28.640 1.00 0.00 C ATOM 131 O LEU A 8 35.378 31.789 29.726 1.00 0.00 O ATOM 132 CB LEU A 8 35.237 29.297 27.836 1.00 0.00 C ATOM 133 CG LEU A 8 36.185 29.706 26.718 1.00 0.00 C ATOM 134 CD1 LEU A 8 37.429 28.809 26.694 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.582 29.502 25.330 1.00 0.00 C ATOM 0 H LEU A 8 33.533 29.901 26.404 1.00 0.00 H new ATOM 0 HA LEU A 8 33.755 30.017 29.271 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.842 29.005 28.694 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.700 28.407 27.507 1.00 0.00 H new ATOM 0 HG LEU A 8 36.405 30.754 26.920 1.00 0.00 H new ATOM 0 HD11 LEU A 8 38.089 29.124 25.886 1.00 0.00 H new ATOM 0 HD12 LEU A 8 37.955 28.891 27.645 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.128 27.774 26.534 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.302 29.810 24.572 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.337 28.449 25.191 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.676 30.101 25.235 1.00 0.00 H new ATOM 147 N THR A 9 34.814 32.652 27.737 1.00 0.00 N ATOM 148 CA THR A 9 35.455 33.931 27.931 1.00 0.00 C ATOM 149 C THR A 9 34.545 34.989 28.557 1.00 0.00 C ATOM 150 O THR A 9 35.108 35.975 29.020 1.00 0.00 O ATOM 151 CB THR A 9 36.071 34.356 26.598 1.00 0.00 C ATOM 152 OG1 THR A 9 35.237 34.110 25.487 1.00 0.00 O ATOM 153 CG2 THR A 9 37.465 33.803 26.258 1.00 0.00 C ATOM 0 H THR A 9 34.357 32.562 26.830 1.00 0.00 H new ATOM 0 HA THR A 9 36.246 33.827 28.674 1.00 0.00 H new ATOM 0 HB THR A 9 36.186 35.425 26.778 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.687 34.405 24.668 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.781 34.184 25.287 1.00 0.00 H new ATOM 0 HG22 THR A 9 38.177 34.118 27.020 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.427 32.714 26.226 1.00 0.00 H new ATOM 161 N GLY A 10 33.226 34.815 28.631 1.00 0.00 N ATOM 162 CA GLY A 10 32.325 35.572 29.481 1.00 0.00 C ATOM 163 C GLY A 10 31.188 36.240 28.704 1.00 0.00 C ATOM 164 O GLY A 10 30.417 36.953 29.330 1.00 0.00 O ATOM 0 H GLY A 10 32.741 34.111 28.074 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.901 34.908 30.234 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.892 36.336 30.012 1.00 0.00 H new ATOM 168 N LYS A 11 31.128 36.083 27.384 1.00 0.00 N ATOM 169 CA LYS A 11 30.074 36.619 26.532 1.00 0.00 C ATOM 170 C LYS A 11 28.963 35.592 26.343 1.00 0.00 C ATOM 171 O LYS A 11 29.229 34.401 26.445 1.00 0.00 O ATOM 172 CB LYS A 11 30.776 37.008 25.238 1.00 0.00 C ATOM 173 CG LYS A 11 31.795 38.154 25.342 1.00 0.00 C ATOM 174 CD LYS A 11 32.200 38.624 23.946 1.00 0.00 C ATOM 175 CE LYS A 11 32.862 39.998 24.101 1.00 0.00 C ATOM 176 NZ LYS A 11 33.590 40.527 22.944 1.00 0.00 N ATOM 0 H LYS A 11 31.834 35.563 26.863 1.00 0.00 H new ATOM 0 HA LYS A 11 29.572 37.486 26.961 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.287 36.128 24.847 1.00 0.00 H new ATOM 0 HB3 LYS A 11 30.018 37.288 24.507 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.365 38.984 25.903 1.00 0.00 H new ATOM 0 HG3 LYS A 11 32.675 37.820 25.891 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.889 37.915 23.487 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.328 38.689 23.295 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.088 40.717 24.370 1.00 0.00 H new ATOM 0 HE3 LYS A 11 33.555 39.946 24.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.988 41.458 23.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 34.360 39.876 22.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.939 40.623 22.138 1.00 0.00 H new ATOM 190 N THR A 12 27.723 36.063 26.159 1.00 0.00 N ATOM 191 CA THR A 12 26.522 35.406 25.683 1.00 0.00 C ATOM 192 C THR A 12 26.324 35.949 24.264 1.00 0.00 C ATOM 193 O THR A 12 26.003 37.105 23.996 1.00 0.00 O ATOM 194 CB THR A 12 25.331 35.827 26.546 1.00 0.00 C ATOM 195 OG1 THR A 12 25.472 35.263 27.830 1.00 0.00 O ATOM 196 CG2 THR A 12 23.936 35.413 26.061 1.00 0.00 C ATOM 0 H THR A 12 27.526 37.041 26.371 1.00 0.00 H new ATOM 0 HA THR A 12 26.601 34.319 25.717 1.00 0.00 H new ATOM 0 HB THR A 12 25.367 36.916 26.511 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.713 35.530 28.390 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.185 35.774 26.763 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.750 35.844 25.077 1.00 0.00 H new ATOM 0 HG23 THR A 12 23.881 34.326 25.998 1.00 0.00 H new ATOM 204 N ILE A 13 26.414 35.066 23.275 1.00 0.00 N ATOM 205 CA ILE A 13 26.217 35.358 21.866 1.00 0.00 C ATOM 206 C ILE A 13 24.762 34.906 21.758 1.00 0.00 C ATOM 207 O ILE A 13 24.280 33.950 22.354 1.00 0.00 O ATOM 208 CB ILE A 13 27.134 34.509 20.992 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.513 34.444 21.657 1.00 0.00 C ATOM 210 CG2 ILE A 13 27.196 35.056 19.568 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.569 33.651 20.892 1.00 0.00 C ATOM 0 H ILE A 13 26.636 34.085 23.445 1.00 0.00 H new ATOM 0 HA ILE A 13 26.426 36.380 21.550 1.00 0.00 H new ATOM 0 HB ILE A 13 26.740 33.496 20.906 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.878 35.461 21.799 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.400 34.005 22.648 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.857 34.432 18.967 1.00 0.00 H new ATOM 0 HG22 ILE A 13 26.197 35.051 19.133 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.579 36.076 19.587 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.508 33.666 21.446 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.235 32.620 20.773 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.720 34.099 19.910 1.00 0.00 H new ATOM 223 N THR A 14 24.008 35.700 20.991 1.00 0.00 N ATOM 224 CA THR A 14 22.599 35.469 20.753 1.00 0.00 C ATOM 225 C THR A 14 22.512 34.836 19.362 1.00 0.00 C ATOM 226 O THR A 14 22.669 35.526 18.353 1.00 0.00 O ATOM 227 CB THR A 14 21.771 36.749 20.803 1.00 0.00 C ATOM 228 OG1 THR A 14 22.066 37.238 22.094 1.00 0.00 O ATOM 229 CG2 THR A 14 20.247 36.635 20.833 1.00 0.00 C ATOM 0 H THR A 14 24.372 36.527 20.518 1.00 0.00 H new ATOM 0 HA THR A 14 22.189 34.827 21.533 1.00 0.00 H new ATOM 0 HB THR A 14 22.016 37.315 19.904 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.582 38.077 22.245 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.808 37.632 20.868 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.903 36.118 19.937 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.941 36.073 21.716 1.00 0.00 H new ATOM 237 N LEU A 15 22.391 33.525 19.193 1.00 0.00 N ATOM 238 CA LEU A 15 22.199 32.810 17.945 1.00 0.00 C ATOM 239 C LEU A 15 20.702 32.669 17.664 1.00 0.00 C ATOM 240 O LEU A 15 19.885 32.646 18.584 1.00 0.00 O ATOM 241 CB LEU A 15 22.808 31.425 18.126 1.00 0.00 C ATOM 242 CG LEU A 15 24.327 31.355 17.990 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.897 31.647 16.600 1.00 0.00 C ATOM 244 CD2 LEU A 15 25.168 32.072 19.043 1.00 0.00 C ATOM 0 H LEU A 15 22.428 32.888 19.989 1.00 0.00 H new ATOM 0 HA LEU A 15 22.665 33.341 17.115 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.531 31.051 19.111 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.363 30.752 17.393 1.00 0.00 H new ATOM 0 HG LEU A 15 24.435 30.288 18.185 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.984 31.567 16.628 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.499 30.927 15.885 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.615 32.655 16.296 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.226 31.936 18.818 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.929 33.136 19.037 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.950 31.657 20.027 1.00 0.00 H new ATOM 256 N GLU A 16 20.389 32.501 16.388 1.00 0.00 N ATOM 257 CA GLU A 16 19.119 32.199 15.757 1.00 0.00 C ATOM 258 C GLU A 16 19.259 30.891 14.971 1.00 0.00 C ATOM 259 O GLU A 16 20.095 30.826 14.078 1.00 0.00 O ATOM 260 CB GLU A 16 18.730 33.390 14.887 1.00 0.00 C ATOM 261 CG GLU A 16 18.141 34.644 15.530 1.00 0.00 C ATOM 262 CD GLU A 16 19.149 35.777 15.686 1.00 0.00 C ATOM 263 OE1 GLU A 16 20.325 35.681 15.270 1.00 0.00 O ATOM 264 OE2 GLU A 16 18.671 36.821 16.180 1.00 0.00 O ATOM 0 H GLU A 16 21.119 32.585 15.681 1.00 0.00 H new ATOM 0 HA GLU A 16 18.321 32.047 16.483 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.621 33.695 14.338 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.009 33.033 14.152 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.304 34.994 14.926 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.741 34.386 16.511 1.00 0.00 H new ATOM 271 N VAL A 17 18.470 29.884 15.316 1.00 0.00 N ATOM 272 CA VAL A 17 18.319 28.578 14.706 1.00 0.00 C ATOM 273 C VAL A 17 16.892 28.153 15.038 1.00 0.00 C ATOM 274 O VAL A 17 16.264 28.513 16.036 1.00 0.00 O ATOM 275 CB VAL A 17 19.319 27.551 15.249 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.713 27.693 14.631 1.00 0.00 C ATOM 277 CG2 VAL A 17 19.538 27.505 16.758 1.00 0.00 C ATOM 0 H VAL A 17 17.852 29.977 16.122 1.00 0.00 H new ATOM 0 HA VAL A 17 18.512 28.629 13.634 1.00 0.00 H new ATOM 0 HB VAL A 17 18.814 26.630 14.958 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.377 26.939 15.054 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.648 27.555 13.552 1.00 0.00 H new ATOM 0 HG13 VAL A 17 21.107 28.686 14.847 1.00 0.00 H new ATOM 0 HG21 VAL A 17 20.270 26.733 16.996 1.00 0.00 H new ATOM 0 HG22 VAL A 17 19.906 28.472 17.102 1.00 0.00 H new ATOM 0 HG23 VAL A 17 18.595 27.277 17.256 1.00 0.00 H new ATOM 287 N GLU A 18 16.427 27.283 14.148 1.00 0.00 N ATOM 288 CA GLU A 18 15.133 26.645 14.329 1.00 0.00 C ATOM 289 C GLU A 18 15.257 25.221 14.880 1.00 0.00 C ATOM 290 O GLU A 18 16.337 24.640 14.950 1.00 0.00 O ATOM 291 CB GLU A 18 14.680 26.537 12.875 1.00 0.00 C ATOM 292 CG GLU A 18 14.315 27.871 12.233 1.00 0.00 C ATOM 293 CD GLU A 18 13.200 28.675 12.890 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.283 28.064 13.491 1.00 0.00 O ATOM 295 OE2 GLU A 18 13.209 29.924 12.839 1.00 0.00 O ATOM 0 H GLU A 18 16.924 27.007 13.301 1.00 0.00 H new ATOM 0 HA GLU A 18 14.485 27.185 15.019 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.475 26.072 12.292 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.817 25.874 12.824 1.00 0.00 H new ATOM 0 HG2 GLU A 18 15.211 28.491 12.209 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.031 27.682 11.198 1.00 0.00 H new ATOM 302 N PRO A 19 14.160 24.642 15.336 1.00 0.00 N ATOM 303 CA PRO A 19 14.123 23.312 15.908 1.00 0.00 C ATOM 304 C PRO A 19 14.771 22.154 15.164 1.00 0.00 C ATOM 305 O PRO A 19 15.176 21.104 15.680 1.00 0.00 O ATOM 306 CB PRO A 19 12.681 22.925 16.257 1.00 0.00 C ATOM 307 CG PRO A 19 11.904 24.218 15.963 1.00 0.00 C ATOM 308 CD PRO A 19 12.821 25.206 15.241 1.00 0.00 C ATOM 0 HA PRO A 19 14.770 23.438 16.776 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.327 22.093 15.649 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.584 22.622 17.300 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.031 23.999 15.349 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.539 24.656 16.892 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.521 25.330 14.200 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.777 26.191 15.705 1.00 0.00 H new ATOM 316 N SER A 20 14.693 22.241 13.845 1.00 0.00 N ATOM 317 CA SER A 20 15.104 21.187 12.924 1.00 0.00 C ATOM 318 C SER A 20 16.593 21.245 12.589 1.00 0.00 C ATOM 319 O SER A 20 17.008 20.388 11.813 1.00 0.00 O ATOM 320 CB SER A 20 14.127 21.334 11.758 1.00 0.00 C ATOM 321 OG SER A 20 13.931 22.630 11.242 1.00 0.00 O ATOM 0 H SER A 20 14.332 23.069 13.370 1.00 0.00 H new ATOM 0 HA SER A 20 15.041 20.180 13.336 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.473 20.695 10.945 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.159 20.948 12.077 1.00 0.00 H new ATOM 0 HG SER A 20 13.289 22.594 10.503 1.00 0.00 H new ATOM 327 N ASP A 21 17.305 22.265 13.051 1.00 0.00 N ATOM 328 CA ASP A 21 18.639 22.519 12.548 1.00 0.00 C ATOM 329 C ASP A 21 19.641 21.660 13.328 1.00 0.00 C ATOM 330 O ASP A 21 19.344 21.209 14.425 1.00 0.00 O ATOM 331 CB ASP A 21 19.023 23.922 13.047 1.00 0.00 C ATOM 332 CG ASP A 21 18.430 24.963 12.110 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.004 24.633 10.974 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.301 26.125 12.545 1.00 0.00 O ATOM 0 H ASP A 21 16.982 22.919 13.764 1.00 0.00 H new ATOM 0 HA ASP A 21 18.655 22.358 11.470 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.653 24.075 14.061 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.108 24.024 13.084 1.00 0.00 H new ATOM 339 N THR A 22 20.643 21.174 12.601 1.00 0.00 N ATOM 340 CA THR A 22 21.738 20.410 13.168 1.00 0.00 C ATOM 341 C THR A 22 22.743 21.351 13.822 1.00 0.00 C ATOM 342 O THR A 22 22.725 22.513 13.417 1.00 0.00 O ATOM 343 CB THR A 22 22.444 19.534 12.126 1.00 0.00 C ATOM 344 OG1 THR A 22 22.749 20.337 11.000 1.00 0.00 O ATOM 345 CG2 THR A 22 21.533 18.347 11.808 1.00 0.00 C ATOM 0 H THR A 22 20.714 21.304 11.592 1.00 0.00 H new ATOM 0 HA THR A 22 21.312 19.742 13.916 1.00 0.00 H new ATOM 0 HB THR A 22 23.388 19.127 12.489 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.203 19.793 10.323 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.014 17.708 11.068 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.350 17.775 12.718 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.585 18.712 11.412 1.00 0.00 H new ATOM 353 N ILE A 23 23.604 20.863 14.710 1.00 0.00 N ATOM 354 CA ILE A 23 24.813 21.439 15.262 1.00 0.00 C ATOM 355 C ILE A 23 25.639 22.136 14.177 1.00 0.00 C ATOM 356 O ILE A 23 26.206 23.182 14.494 1.00 0.00 O ATOM 357 CB ILE A 23 25.573 20.388 16.070 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.734 19.454 16.944 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.645 21.042 16.935 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.678 19.985 17.911 1.00 0.00 C ATOM 0 H ILE A 23 23.444 19.936 15.105 1.00 0.00 H new ATOM 0 HA ILE A 23 24.559 22.231 15.967 1.00 0.00 H new ATOM 0 HB ILE A 23 26.006 19.749 15.300 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.225 18.765 16.270 1.00 0.00 H new ATOM 0 HG13 ILE A 23 25.434 18.863 17.535 1.00 0.00 H new ATOM 0 HG21 ILE A 23 27.173 20.275 17.501 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.352 21.574 16.298 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.177 21.745 17.625 1.00 0.00 H new ATOM 0 HD11 ILE A 23 23.205 19.150 18.428 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.151 20.642 18.641 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.924 20.542 17.356 1.00 0.00 H new ATOM 372 N GLU A 24 25.718 21.726 12.920 1.00 0.00 N ATOM 373 CA GLU A 24 26.577 22.310 11.903 1.00 0.00 C ATOM 374 C GLU A 24 26.154 23.734 11.549 1.00 0.00 C ATOM 375 O GLU A 24 27.067 24.543 11.384 1.00 0.00 O ATOM 376 CB GLU A 24 26.572 21.352 10.705 1.00 0.00 C ATOM 377 CG GLU A 24 27.652 21.648 9.659 1.00 0.00 C ATOM 378 CD GLU A 24 27.611 20.613 8.539 1.00 0.00 C ATOM 379 OE1 GLU A 24 26.634 19.848 8.442 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.540 20.549 7.712 1.00 0.00 O ATOM 0 H GLU A 24 25.163 20.946 12.567 1.00 0.00 H new ATOM 0 HA GLU A 24 27.597 22.420 12.270 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.704 20.333 11.069 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.595 21.395 10.224 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.502 22.645 9.246 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.635 21.643 10.131 1.00 0.00 H new ATOM 387 N ASN A 25 24.920 24.198 11.777 1.00 0.00 N ATOM 388 CA ASN A 25 24.368 25.527 11.719 1.00 0.00 C ATOM 389 C ASN A 25 24.808 26.455 12.856 1.00 0.00 C ATOM 390 O ASN A 25 25.343 27.529 12.580 1.00 0.00 O ATOM 391 CB ASN A 25 22.848 25.452 11.615 1.00 0.00 C ATOM 392 CG ASN A 25 22.404 26.582 10.693 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.264 27.669 11.255 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.248 26.351 9.394 1.00 0.00 N ATOM 0 H ASN A 25 24.191 23.537 12.045 1.00 0.00 H new ATOM 0 HA ASN A 25 24.778 25.988 10.820 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.537 24.486 11.218 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.389 25.555 12.598 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.989 27.113 8.768 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.387 25.411 9.023 1.00 0.00 H new ATOM 401 N VAL A 26 24.668 26.028 14.114 1.00 0.00 N ATOM 402 CA VAL A 26 25.124 26.702 15.301 1.00 0.00 C ATOM 403 C VAL A 26 26.608 27.047 15.215 1.00 0.00 C ATOM 404 O VAL A 26 26.928 28.232 15.282 1.00 0.00 O ATOM 405 CB VAL A 26 24.774 25.989 16.613 1.00 0.00 C ATOM 406 CG1 VAL A 26 25.357 26.615 17.878 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.271 25.692 16.717 1.00 0.00 C ATOM 0 H VAL A 26 24.202 25.146 14.328 1.00 0.00 H new ATOM 0 HA VAL A 26 24.560 27.634 15.335 1.00 0.00 H new ATOM 0 HB VAL A 26 25.292 25.032 16.556 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.049 26.034 18.747 1.00 0.00 H new ATOM 0 HG12 VAL A 26 26.445 26.621 17.813 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.994 27.638 17.978 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.064 25.187 17.660 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.712 26.627 16.676 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.968 25.052 15.889 1.00 0.00 H new ATOM 417 N LYS A 27 27.411 26.001 15.046 1.00 0.00 N ATOM 418 CA LYS A 27 28.858 26.153 14.947 1.00 0.00 C ATOM 419 C LYS A 27 29.153 27.126 13.807 1.00 0.00 C ATOM 420 O LYS A 27 30.085 27.910 13.986 1.00 0.00 O ATOM 421 CB LYS A 27 29.464 24.811 14.561 1.00 0.00 C ATOM 422 CG LYS A 27 29.375 23.728 15.638 1.00 0.00 C ATOM 423 CD LYS A 27 29.967 22.369 15.255 1.00 0.00 C ATOM 424 CE LYS A 27 30.646 21.710 16.458 1.00 0.00 C ATOM 425 NZ LYS A 27 31.331 20.495 15.977 1.00 0.00 N ATOM 0 H LYS A 27 27.083 25.038 14.975 1.00 0.00 H new ATOM 0 HA LYS A 27 29.265 26.507 15.894 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.966 24.450 13.661 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.513 24.963 14.305 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.883 24.087 16.533 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.327 23.587 15.902 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.179 21.718 14.876 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.690 22.497 14.449 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.359 22.395 16.917 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.910 21.457 17.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.913 20.099 16.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.624 19.792 15.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.939 20.736 15.169 1.00 0.00 H new ATOM 439 N ALA A 28 28.422 27.222 12.703 1.00 0.00 N ATOM 440 CA ALA A 28 28.786 28.097 11.608 1.00 0.00 C ATOM 441 C ALA A 28 28.549 29.599 11.760 1.00 0.00 C ATOM 442 O ALA A 28 29.436 30.425 11.515 1.00 0.00 O ATOM 443 CB ALA A 28 28.024 27.612 10.372 1.00 0.00 C ATOM 0 H ALA A 28 27.563 26.695 12.547 1.00 0.00 H new ATOM 0 HA ALA A 28 29.872 28.023 11.550 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.270 28.246 9.521 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.306 26.583 10.151 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.952 27.661 10.563 1.00 0.00 H new ATOM 449 N LYS A 29 27.422 29.947 12.374 1.00 0.00 N ATOM 450 CA LYS A 29 27.119 31.237 12.959 1.00 0.00 C ATOM 451 C LYS A 29 28.013 31.634 14.135 1.00 0.00 C ATOM 452 O LYS A 29 28.492 32.763 14.109 1.00 0.00 O ATOM 453 CB LYS A 29 25.646 31.234 13.379 1.00 0.00 C ATOM 454 CG LYS A 29 24.686 31.038 12.200 1.00 0.00 C ATOM 455 CD LYS A 29 23.195 30.857 12.515 1.00 0.00 C ATOM 456 CE LYS A 29 22.329 30.828 11.247 1.00 0.00 C ATOM 457 NZ LYS A 29 21.015 30.267 11.573 1.00 0.00 N ATOM 0 H LYS A 29 26.650 29.289 12.480 1.00 0.00 H new ATOM 0 HA LYS A 29 27.319 31.991 12.198 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.484 30.440 14.108 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.414 32.176 13.876 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.787 31.899 11.539 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.018 30.165 11.639 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.053 29.930 13.070 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.862 31.669 13.161 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.218 31.835 10.845 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.812 30.228 10.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.328 30.546 10.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.080 29.230 11.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.704 30.627 12.498 1.00 0.00 H new ATOM 471 N ILE A 30 28.369 30.726 15.044 1.00 0.00 N ATOM 472 CA ILE A 30 29.303 31.058 16.103 1.00 0.00 C ATOM 473 C ILE A 30 30.628 31.509 15.484 1.00 0.00 C ATOM 474 O ILE A 30 31.165 32.487 15.989 1.00 0.00 O ATOM 475 CB ILE A 30 29.554 29.935 17.115 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.296 29.702 17.954 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.700 30.170 18.100 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.216 28.658 19.068 1.00 0.00 C ATOM 0 H ILE A 30 28.025 29.766 15.063 1.00 0.00 H new ATOM 0 HA ILE A 30 28.838 31.862 16.674 1.00 0.00 H new ATOM 0 HB ILE A 30 29.829 29.081 16.496 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.048 30.660 18.410 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.496 29.466 17.252 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.787 29.313 18.768 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.632 30.297 17.550 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.499 31.067 18.685 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.223 28.681 19.517 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.404 27.668 18.653 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.964 28.880 19.829 1.00 0.00 H new ATOM 490 N GLN A 31 31.037 30.765 14.457 1.00 0.00 N ATOM 491 CA GLN A 31 32.157 31.057 13.590 1.00 0.00 C ATOM 492 C GLN A 31 32.043 32.398 12.855 1.00 0.00 C ATOM 493 O GLN A 31 33.036 33.127 12.944 1.00 0.00 O ATOM 494 CB GLN A 31 32.399 29.924 12.584 1.00 0.00 C ATOM 495 CG GLN A 31 33.633 30.001 11.689 1.00 0.00 C ATOM 496 CD GLN A 31 33.585 30.917 10.472 1.00 0.00 C ATOM 497 OE1 GLN A 31 34.664 31.384 10.125 1.00 0.00 O ATOM 498 NE2 GLN A 31 32.402 31.127 9.895 1.00 0.00 N ATOM 0 H GLN A 31 30.565 29.898 14.201 1.00 0.00 H new ATOM 0 HA GLN A 31 33.016 31.139 14.256 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.451 28.989 13.142 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.523 29.861 11.938 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.474 30.314 12.308 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.853 28.993 11.338 1.00 0.00 H new ATOM 0 HE21 GLN A 31 31.565 30.683 10.272 1.00 0.00 H new ATOM 0 HE22 GLN A 31 32.334 31.731 9.076 1.00 0.00 H new ATOM 507 N ASP A 32 30.909 32.772 12.272 1.00 0.00 N ATOM 508 CA ASP A 32 30.813 33.988 11.495 1.00 0.00 C ATOM 509 C ASP A 32 30.791 35.244 12.369 1.00 0.00 C ATOM 510 O ASP A 32 30.980 36.338 11.858 1.00 0.00 O ATOM 511 CB ASP A 32 29.639 33.797 10.528 1.00 0.00 C ATOM 512 CG ASP A 32 29.526 34.903 9.500 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.453 34.990 8.660 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.519 35.651 9.493 1.00 0.00 O ATOM 0 H ASP A 32 30.040 32.241 12.328 1.00 0.00 H new ATOM 0 HA ASP A 32 31.706 34.169 10.897 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.752 32.842 10.014 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.712 33.744 11.099 1.00 0.00 H new ATOM 519 N LYS A 33 30.470 35.110 13.653 1.00 0.00 N ATOM 520 CA LYS A 33 30.136 36.187 14.568 1.00 0.00 C ATOM 521 C LYS A 33 31.336 36.570 15.428 1.00 0.00 C ATOM 522 O LYS A 33 31.783 37.711 15.472 1.00 0.00 O ATOM 523 CB LYS A 33 29.081 35.668 15.550 1.00 0.00 C ATOM 524 CG LYS A 33 27.648 35.950 15.101 1.00 0.00 C ATOM 525 CD LYS A 33 26.615 35.811 16.222 1.00 0.00 C ATOM 526 CE LYS A 33 25.163 35.658 15.769 1.00 0.00 C ATOM 527 NZ LYS A 33 24.673 36.905 15.141 1.00 0.00 N ATOM 0 H LYS A 33 30.435 34.195 14.103 1.00 0.00 H new ATOM 0 HA LYS A 33 29.799 37.039 13.978 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.210 34.593 15.677 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.246 36.126 16.525 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.596 36.960 14.694 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.388 35.267 14.293 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.880 34.946 16.830 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.685 36.687 16.867 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.084 34.833 15.061 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.536 35.405 16.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.685 36.778 14.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.729 37.685 15.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.260 37.130 14.312 1.00 0.00 H new ATOM 541 N GLU A 34 31.903 35.554 16.073 1.00 0.00 N ATOM 542 CA GLU A 34 32.976 35.701 17.049 1.00 0.00 C ATOM 543 C GLU A 34 34.308 35.114 16.594 1.00 0.00 C ATOM 544 O GLU A 34 35.307 35.300 17.289 1.00 0.00 O ATOM 545 CB GLU A 34 32.344 35.010 18.253 1.00 0.00 C ATOM 546 CG GLU A 34 33.035 35.326 19.588 1.00 0.00 C ATOM 547 CD GLU A 34 32.952 36.781 20.007 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.137 37.598 19.531 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.827 37.149 20.824 1.00 0.00 O ATOM 0 H GLU A 34 31.622 34.584 15.927 1.00 0.00 H new ATOM 0 HA GLU A 34 33.279 36.730 17.245 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.296 35.304 18.319 1.00 0.00 H new ATOM 0 HB3 GLU A 34 32.363 33.932 18.092 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.589 34.710 20.369 1.00 0.00 H new ATOM 0 HG3 GLU A 34 34.084 35.040 19.517 1.00 0.00 H new ATOM 556 N GLY A 35 34.362 34.479 15.426 1.00 0.00 N ATOM 557 CA GLY A 35 35.636 34.218 14.797 1.00 0.00 C ATOM 558 C GLY A 35 36.300 32.903 15.200 1.00 0.00 C ATOM 559 O GLY A 35 37.488 32.671 15.357 1.00 0.00 O ATOM 0 H GLY A 35 33.549 34.144 14.910 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.497 34.221 13.716 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.315 35.037 15.033 1.00 0.00 H new ATOM 563 N ILE A 36 35.373 32.009 15.533 1.00 0.00 N ATOM 564 CA ILE A 36 35.698 30.782 16.248 1.00 0.00 C ATOM 565 C ILE A 36 35.657 29.561 15.324 1.00 0.00 C ATOM 566 O ILE A 36 34.567 29.144 14.924 1.00 0.00 O ATOM 567 CB ILE A 36 34.868 30.608 17.512 1.00 0.00 C ATOM 568 CG1 ILE A 36 34.674 31.853 18.376 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.436 29.415 18.292 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.658 31.755 19.512 1.00 0.00 C ATOM 0 H ILE A 36 34.382 32.115 15.316 1.00 0.00 H new ATOM 0 HA ILE A 36 36.729 30.872 16.590 1.00 0.00 H new ATOM 0 HB ILE A 36 33.844 30.411 17.196 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.639 32.121 18.806 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.376 32.675 17.725 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.858 29.268 19.204 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.377 28.517 17.677 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.477 29.611 18.550 1.00 0.00 H new ATOM 0 HD11 ILE A 36 33.617 32.704 20.046 1.00 0.00 H new ATOM 0 HD12 ILE A 36 32.674 31.527 19.102 1.00 0.00 H new ATOM 0 HD13 ILE A 36 33.957 30.964 20.200 1.00 0.00 H new ATOM 582 N PRO A 37 36.712 28.797 15.069 1.00 0.00 N ATOM 583 CA PRO A 37 36.694 27.695 14.125 1.00 0.00 C ATOM 584 C PRO A 37 35.912 26.482 14.646 1.00 0.00 C ATOM 585 O PRO A 37 36.273 26.159 15.768 1.00 0.00 O ATOM 586 CB PRO A 37 38.168 27.504 13.760 1.00 0.00 C ATOM 587 CG PRO A 37 38.977 27.931 14.979 1.00 0.00 C ATOM 588 CD PRO A 37 38.044 28.968 15.618 1.00 0.00 C ATOM 0 HA PRO A 37 36.128 27.884 13.213 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.372 26.464 13.504 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.433 28.104 12.890 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.182 27.096 15.649 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.940 28.361 14.702 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.025 28.843 16.701 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.408 29.976 15.420 1.00 0.00 H new ATOM 596 N PRO A 38 35.031 25.903 13.826 1.00 0.00 N ATOM 597 CA PRO A 38 33.998 25.003 14.295 1.00 0.00 C ATOM 598 C PRO A 38 34.555 23.628 14.668 1.00 0.00 C ATOM 599 O PRO A 38 33.883 23.030 15.506 1.00 0.00 O ATOM 600 CB PRO A 38 33.002 24.771 13.151 1.00 0.00 C ATOM 601 CG PRO A 38 33.800 25.094 11.887 1.00 0.00 C ATOM 602 CD PRO A 38 34.901 26.037 12.395 1.00 0.00 C ATOM 0 HA PRO A 38 33.542 25.459 15.174 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.639 23.743 13.141 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.129 25.416 13.246 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.218 24.195 11.434 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.178 25.572 11.130 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.848 25.801 11.910 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.659 27.068 12.137 1.00 0.00 H new ATOM 610 N ASP A 39 35.730 23.202 14.218 1.00 0.00 N ATOM 611 CA ASP A 39 36.306 21.935 14.602 1.00 0.00 C ATOM 612 C ASP A 39 37.005 22.114 15.957 1.00 0.00 C ATOM 613 O ASP A 39 37.277 21.087 16.568 1.00 0.00 O ATOM 614 CB ASP A 39 37.227 21.478 13.475 1.00 0.00 C ATOM 615 CG ASP A 39 38.611 22.101 13.502 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.703 23.341 13.607 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.646 21.404 13.594 1.00 0.00 O ATOM 0 H ASP A 39 36.309 23.737 13.571 1.00 0.00 H new ATOM 0 HA ASP A 39 35.561 21.151 14.740 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.329 20.394 13.523 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.756 21.711 12.520 1.00 0.00 H new ATOM 622 N GLN A 40 37.257 23.336 16.427 1.00 0.00 N ATOM 623 CA GLN A 40 37.875 23.682 17.693 1.00 0.00 C ATOM 624 C GLN A 40 36.795 23.793 18.776 1.00 0.00 C ATOM 625 O GLN A 40 37.154 23.734 19.947 1.00 0.00 O ATOM 626 CB GLN A 40 38.520 25.051 17.507 1.00 0.00 C ATOM 627 CG GLN A 40 39.973 25.108 17.998 1.00 0.00 C ATOM 628 CD GLN A 40 40.956 26.050 17.307 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.134 27.201 17.697 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.533 25.584 16.209 1.00 0.00 N ATOM 0 H GLN A 40 37.014 24.167 15.887 1.00 0.00 H new ATOM 0 HA GLN A 40 38.604 22.928 17.990 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.490 25.319 16.451 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.933 25.797 18.042 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.952 25.373 19.055 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.382 24.100 17.931 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.364 24.623 15.913 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.146 26.187 15.660 1.00 0.00 H new ATOM 639 N GLN A 41 35.510 23.885 18.445 1.00 0.00 N ATOM 640 CA GLN A 41 34.421 24.038 19.384 1.00 0.00 C ATOM 641 C GLN A 41 33.911 22.669 19.864 1.00 0.00 C ATOM 642 O GLN A 41 33.995 21.680 19.146 1.00 0.00 O ATOM 643 CB GLN A 41 33.297 24.722 18.595 1.00 0.00 C ATOM 644 CG GLN A 41 33.650 26.120 18.101 1.00 0.00 C ATOM 645 CD GLN A 41 32.489 26.838 17.431 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.343 26.661 17.828 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.644 27.772 16.493 1.00 0.00 N ATOM 0 H GLN A 41 35.195 23.853 17.476 1.00 0.00 H new ATOM 0 HA GLN A 41 34.741 24.604 20.259 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.037 24.100 17.739 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.410 24.783 19.225 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.998 26.717 18.944 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.478 26.049 17.396 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.572 27.970 16.119 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.835 28.289 16.150 1.00 0.00 H new ATOM 656 N ARG A 42 33.312 22.626 21.044 1.00 0.00 N ATOM 657 CA ARG A 42 32.797 21.537 21.853 1.00 0.00 C ATOM 658 C ARG A 42 31.610 22.149 22.590 1.00 0.00 C ATOM 659 O ARG A 42 31.790 23.155 23.272 1.00 0.00 O ATOM 660 CB ARG A 42 33.838 20.866 22.757 1.00 0.00 C ATOM 661 CG ARG A 42 33.240 19.755 23.632 1.00 0.00 C ATOM 662 CD ARG A 42 34.260 18.672 24.007 1.00 0.00 C ATOM 663 NE ARG A 42 34.103 17.543 23.092 1.00 0.00 N ATOM 664 CZ ARG A 42 34.617 16.307 23.165 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.387 15.986 24.225 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.499 15.421 22.168 1.00 0.00 N ATOM 0 H ARG A 42 33.152 23.507 21.533 1.00 0.00 H new ATOM 0 HA ARG A 42 32.493 20.688 21.241 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.633 20.447 22.139 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.296 21.620 23.398 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.835 20.196 24.543 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.406 19.293 23.103 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.273 19.070 23.946 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.106 18.348 25.036 1.00 0.00 H new ATOM 0 HE ARG A 42 33.516 17.722 22.278 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.568 16.678 24.952 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.788 15.051 24.300 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.004 15.677 21.314 1.00 0.00 H new ATOM 0 HH22 ARG A 42 34.905 14.490 22.263 1.00 0.00 H new ATOM 680 N LEU A 43 30.378 21.644 22.505 1.00 0.00 N ATOM 681 CA LEU A 43 29.082 22.176 22.862 1.00 0.00 C ATOM 682 C LEU A 43 28.316 21.326 23.866 1.00 0.00 C ATOM 683 O LEU A 43 28.256 20.116 23.646 1.00 0.00 O ATOM 684 CB LEU A 43 28.214 22.488 21.637 1.00 0.00 C ATOM 685 CG LEU A 43 28.746 23.497 20.623 1.00 0.00 C ATOM 686 CD1 LEU A 43 29.954 22.999 19.826 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.684 23.810 19.569 1.00 0.00 C ATOM 0 H LEU A 43 30.263 20.705 22.123 1.00 0.00 H new ATOM 0 HA LEU A 43 29.307 23.117 23.365 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.029 21.551 21.111 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.250 22.849 21.994 1.00 0.00 H new ATOM 0 HG LEU A 43 29.027 24.361 21.226 1.00 0.00 H new ATOM 0 HD11 LEU A 43 30.273 23.772 19.127 1.00 0.00 H new ATOM 0 HD12 LEU A 43 30.771 22.769 20.510 1.00 0.00 H new ATOM 0 HD13 LEU A 43 29.680 22.101 19.273 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.082 24.531 18.855 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.410 22.894 19.045 1.00 0.00 H new ATOM 0 HD23 LEU A 43 26.802 24.228 20.054 1.00 0.00 H new ATOM 699 N ILE A 44 27.790 21.964 24.907 1.00 0.00 N ATOM 700 CA ILE A 44 27.170 21.306 26.038 1.00 0.00 C ATOM 701 C ILE A 44 25.843 21.969 26.427 1.00 0.00 C ATOM 702 O ILE A 44 25.764 23.195 26.271 1.00 0.00 O ATOM 703 CB ILE A 44 28.198 20.924 27.100 1.00 0.00 C ATOM 704 CG1 ILE A 44 27.654 20.241 28.350 1.00 0.00 C ATOM 705 CG2 ILE A 44 29.175 22.045 27.470 1.00 0.00 C ATOM 706 CD1 ILE A 44 28.517 19.097 28.869 1.00 0.00 C ATOM 0 H ILE A 44 27.786 22.981 24.983 1.00 0.00 H new ATOM 0 HA ILE A 44 26.802 20.314 25.776 1.00 0.00 H new ATOM 0 HB ILE A 44 28.763 20.155 26.573 1.00 0.00 H new ATOM 0 HG12 ILE A 44 27.547 20.986 29.139 1.00 0.00 H new ATOM 0 HG13 ILE A 44 26.656 19.859 28.135 1.00 0.00 H new ATOM 0 HG21 ILE A 44 29.869 21.687 28.230 1.00 0.00 H new ATOM 0 HG22 ILE A 44 29.733 22.349 26.584 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.619 22.898 27.859 1.00 0.00 H new ATOM 0 HD11 ILE A 44 28.056 18.669 29.759 1.00 0.00 H new ATOM 0 HD12 ILE A 44 28.604 18.329 28.100 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.509 19.474 29.119 1.00 0.00 H new ATOM 718 N PHE A 45 24.889 21.157 26.865 1.00 0.00 N ATOM 719 CA PHE A 45 23.696 21.600 27.565 1.00 0.00 C ATOM 720 C PHE A 45 23.254 20.367 28.362 1.00 0.00 C ATOM 721 O PHE A 45 23.206 19.217 27.955 1.00 0.00 O ATOM 722 CB PHE A 45 22.637 22.150 26.602 1.00 0.00 C ATOM 723 CG PHE A 45 21.279 22.512 27.147 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.022 23.597 27.987 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.199 21.735 26.695 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.713 23.895 28.394 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.890 22.097 27.047 1.00 0.00 C ATOM 728 CZ PHE A 45 18.634 23.141 27.940 1.00 0.00 C ATOM 0 H PHE A 45 24.927 20.146 26.738 1.00 0.00 H new ATOM 0 HA PHE A 45 23.873 22.445 28.230 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.051 23.041 26.129 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.490 21.410 25.815 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.840 24.214 28.327 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.375 20.865 26.080 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.540 24.720 29.069 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.060 21.556 26.617 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.628 23.357 28.269 1.00 0.00 H new ATOM 738 N ALA A 46 22.785 20.754 29.551 1.00 0.00 N ATOM 739 CA ALA A 46 22.188 19.891 30.547 1.00 0.00 C ATOM 740 C ALA A 46 22.934 18.612 30.932 1.00 0.00 C ATOM 741 O ALA A 46 22.268 17.595 31.130 1.00 0.00 O ATOM 742 CB ALA A 46 20.741 19.591 30.155 1.00 0.00 C ATOM 0 H ALA A 46 22.818 21.729 29.850 1.00 0.00 H new ATOM 0 HA ALA A 46 22.249 20.470 31.468 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.289 18.941 30.904 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.179 20.523 30.097 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.722 19.095 29.185 1.00 0.00 H new ATOM 748 N GLY A 47 24.255 18.696 30.815 1.00 0.00 N ATOM 749 CA GLY A 47 25.066 17.579 31.244 1.00 0.00 C ATOM 750 C GLY A 47 25.681 16.788 30.090 1.00 0.00 C ATOM 751 O GLY A 47 26.548 15.930 30.214 1.00 0.00 O ATOM 0 H GLY A 47 24.765 19.496 30.441 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.865 17.947 31.887 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.455 16.908 31.848 1.00 0.00 H new ATOM 755 N LYS A 48 25.084 17.015 28.918 1.00 0.00 N ATOM 756 CA LYS A 48 25.202 16.337 27.651 1.00 0.00 C ATOM 757 C LYS A 48 26.066 17.144 26.675 1.00 0.00 C ATOM 758 O LYS A 48 25.741 18.258 26.271 1.00 0.00 O ATOM 759 CB LYS A 48 23.811 16.212 27.021 1.00 0.00 C ATOM 760 CG LYS A 48 22.965 15.357 27.969 1.00 0.00 C ATOM 761 CD LYS A 48 21.657 14.738 27.456 1.00 0.00 C ATOM 762 CE LYS A 48 20.773 14.238 28.598 1.00 0.00 C ATOM 763 NZ LYS A 48 19.595 13.504 28.118 1.00 0.00 N ATOM 0 H LYS A 48 24.420 17.785 28.840 1.00 0.00 H new ATOM 0 HA LYS A 48 25.656 15.362 27.831 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.361 17.195 26.883 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.874 15.749 26.036 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.595 14.542 28.326 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.719 15.973 28.834 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.110 15.478 26.872 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.886 13.910 26.786 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.359 13.591 29.250 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.448 15.087 29.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.029 13.187 28.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.019 14.127 27.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.902 12.678 27.566 1.00 0.00 H new ATOM 777 N GLN A 49 27.165 16.542 26.224 1.00 0.00 N ATOM 778 CA GLN A 49 27.948 16.975 25.082 1.00 0.00 C ATOM 779 C GLN A 49 27.139 16.644 23.826 1.00 0.00 C ATOM 780 O GLN A 49 26.616 15.550 23.661 1.00 0.00 O ATOM 781 CB GLN A 49 29.269 16.220 25.023 1.00 0.00 C ATOM 782 CG GLN A 49 30.164 16.423 26.245 1.00 0.00 C ATOM 783 CD GLN A 49 31.578 15.916 25.990 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.513 16.250 26.707 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.745 15.118 24.931 1.00 0.00 N ATOM 0 H GLN A 49 27.545 15.705 26.667 1.00 0.00 H new ATOM 0 HA GLN A 49 28.160 18.041 25.158 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.061 15.156 24.912 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.814 16.533 24.132 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.196 17.482 26.502 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.737 15.900 27.101 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.943 14.860 24.355 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.674 14.767 24.698 1.00 0.00 H new ATOM 794 N LEU A 50 27.104 17.616 22.915 1.00 0.00 N ATOM 795 CA LEU A 50 26.135 17.662 21.837 1.00 0.00 C ATOM 796 C LEU A 50 26.639 17.001 20.558 1.00 0.00 C ATOM 797 O LEU A 50 27.711 17.381 20.069 1.00 0.00 O ATOM 798 CB LEU A 50 25.799 19.114 21.486 1.00 0.00 C ATOM 799 CG LEU A 50 24.874 19.761 22.518 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.649 21.258 22.298 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.535 19.098 22.803 1.00 0.00 C ATOM 0 H LEU A 50 27.758 18.399 22.911 1.00 0.00 H new ATOM 0 HA LEU A 50 25.262 17.120 22.201 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.721 19.691 21.415 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.325 19.148 20.505 1.00 0.00 H new ATOM 0 HG LEU A 50 25.473 19.591 23.413 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.983 21.643 23.070 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.604 21.781 22.349 1.00 0.00 H new ATOM 0 HD13 LEU A 50 24.200 21.418 21.318 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.996 19.675 23.555 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.947 19.058 21.886 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.701 18.086 23.172 1.00 0.00 H new ATOM 813 N GLU A 51 25.901 15.993 20.116 1.00 0.00 N ATOM 814 CA GLU A 51 26.259 15.061 19.058 1.00 0.00 C ATOM 815 C GLU A 51 25.958 15.726 17.714 1.00 0.00 C ATOM 816 O GLU A 51 24.826 16.037 17.337 1.00 0.00 O ATOM 817 CB GLU A 51 25.427 13.796 19.255 1.00 0.00 C ATOM 818 CG GLU A 51 25.994 12.631 18.435 1.00 0.00 C ATOM 819 CD GLU A 51 25.192 11.361 18.691 1.00 0.00 C ATOM 820 OE1 GLU A 51 24.082 11.232 18.127 1.00 0.00 O ATOM 821 OE2 GLU A 51 25.699 10.535 19.474 1.00 0.00 O ATOM 0 H GLU A 51 24.982 15.793 20.510 1.00 0.00 H new ATOM 0 HA GLU A 51 27.316 14.797 19.082 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.411 13.528 20.311 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.395 13.985 18.959 1.00 0.00 H new ATOM 0 HG2 GLU A 51 25.967 12.878 17.374 1.00 0.00 H new ATOM 0 HG3 GLU A 51 27.039 12.468 18.698 1.00 0.00 H new ATOM 828 N ASP A 52 27.005 15.769 16.891 1.00 0.00 N ATOM 829 CA ASP A 52 27.068 16.199 15.507 1.00 0.00 C ATOM 830 C ASP A 52 26.284 15.253 14.600 1.00 0.00 C ATOM 831 O ASP A 52 26.673 14.102 14.432 1.00 0.00 O ATOM 832 CB ASP A 52 28.503 16.189 14.979 1.00 0.00 C ATOM 833 CG ASP A 52 29.298 17.312 15.640 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.745 17.149 16.795 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.565 18.430 15.143 1.00 0.00 O ATOM 0 H ASP A 52 27.924 15.470 17.219 1.00 0.00 H new ATOM 0 HA ASP A 52 26.651 17.206 15.491 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.971 15.227 15.187 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.504 16.317 13.897 1.00 0.00 H new ATOM 840 N GLY A 53 25.150 15.776 14.136 1.00 0.00 N ATOM 841 CA GLY A 53 24.275 15.085 13.213 1.00 0.00 C ATOM 842 C GLY A 53 22.864 14.809 13.723 1.00 0.00 C ATOM 843 O GLY A 53 22.054 14.109 13.109 1.00 0.00 O ATOM 0 H GLY A 53 24.816 16.703 14.399 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.203 15.674 12.299 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.737 14.135 12.944 1.00 0.00 H new ATOM 847 N ARG A 54 22.471 15.272 14.901 1.00 0.00 N ATOM 848 CA ARG A 54 21.149 15.335 15.489 1.00 0.00 C ATOM 849 C ARG A 54 20.636 16.782 15.469 1.00 0.00 C ATOM 850 O ARG A 54 21.409 17.728 15.512 1.00 0.00 O ATOM 851 CB ARG A 54 21.262 14.999 16.967 1.00 0.00 C ATOM 852 CG ARG A 54 21.425 13.499 17.231 1.00 0.00 C ATOM 853 CD ARG A 54 21.454 13.160 18.723 1.00 0.00 C ATOM 854 NE ARG A 54 21.604 11.711 18.833 1.00 0.00 N ATOM 855 CZ ARG A 54 20.635 10.799 18.978 1.00 0.00 C ATOM 856 NH1 ARG A 54 19.353 11.193 18.934 1.00 0.00 N ATOM 857 NH2 ARG A 54 20.927 9.561 19.385 1.00 0.00 N ATOM 0 H ARG A 54 23.162 15.660 15.543 1.00 0.00 H new ATOM 0 HA ARG A 54 20.497 14.658 14.937 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.114 15.531 17.390 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.372 15.358 17.484 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.605 12.960 16.756 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.347 13.151 16.766 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.280 13.671 19.218 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.537 13.490 19.211 1.00 0.00 H new ATOM 0 HE ARG A 54 22.558 11.353 18.795 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.127 12.177 18.791 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.605 10.508 19.043 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.893 9.305 19.588 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.184 8.871 19.493 1.00 0.00 H new ATOM 871 N THR A 55 19.328 16.827 15.264 1.00 0.00 N ATOM 872 CA THR A 55 18.581 18.064 15.283 1.00 0.00 C ATOM 873 C THR A 55 18.169 18.467 16.699 1.00 0.00 C ATOM 874 O THR A 55 17.941 17.698 17.628 1.00 0.00 O ATOM 875 CB THR A 55 17.300 17.824 14.467 1.00 0.00 C ATOM 876 OG1 THR A 55 16.224 17.189 15.128 1.00 0.00 O ATOM 877 CG2 THR A 55 17.498 17.239 13.067 1.00 0.00 C ATOM 0 H THR A 55 18.758 16.001 15.080 1.00 0.00 H new ATOM 0 HA THR A 55 19.204 18.860 14.876 1.00 0.00 H new ATOM 0 HB THR A 55 16.991 18.861 14.339 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.470 17.094 14.509 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.529 17.113 12.585 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.113 17.916 12.474 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.994 16.271 13.144 1.00 0.00 H new ATOM 885 N LEU A 56 18.187 19.787 16.853 1.00 0.00 N ATOM 886 CA LEU A 56 17.874 20.633 17.986 1.00 0.00 C ATOM 887 C LEU A 56 16.625 20.100 18.678 1.00 0.00 C ATOM 888 O LEU A 56 16.623 19.873 19.892 1.00 0.00 O ATOM 889 CB LEU A 56 17.773 22.138 17.709 1.00 0.00 C ATOM 890 CG LEU A 56 18.509 23.076 18.659 1.00 0.00 C ATOM 891 CD1 LEU A 56 20.024 22.959 18.497 1.00 0.00 C ATOM 892 CD2 LEU A 56 17.997 24.500 18.410 1.00 0.00 C ATOM 0 H LEU A 56 18.465 20.367 16.061 1.00 0.00 H new ATOM 0 HA LEU A 56 18.740 20.572 18.645 1.00 0.00 H new ATOM 0 HB2 LEU A 56 18.144 22.321 16.700 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.718 22.412 17.715 1.00 0.00 H new ATOM 0 HG LEU A 56 18.306 22.801 19.694 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.518 23.641 19.189 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.335 21.937 18.712 1.00 0.00 H new ATOM 0 HD13 LEU A 56 20.301 23.216 17.475 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.509 25.193 19.078 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.194 24.782 17.376 1.00 0.00 H new ATOM 0 HD23 LEU A 56 16.924 24.539 18.599 1.00 0.00 H new ATOM 904 N SER A 57 15.534 19.797 17.977 1.00 0.00 N ATOM 905 CA SER A 57 14.269 19.218 18.392 1.00 0.00 C ATOM 906 C SER A 57 14.430 17.898 19.144 1.00 0.00 C ATOM 907 O SER A 57 13.741 17.673 20.143 1.00 0.00 O ATOM 908 CB SER A 57 13.355 19.159 17.170 1.00 0.00 C ATOM 909 OG SER A 57 12.083 18.649 17.480 1.00 0.00 O ATOM 0 H SER A 57 15.522 19.978 16.973 1.00 0.00 H new ATOM 0 HA SER A 57 13.793 19.852 19.140 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.250 20.159 16.749 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.817 18.537 16.403 1.00 0.00 H new ATOM 0 HG SER A 57 11.532 18.631 16.670 1.00 0.00 H new ATOM 915 N ASP A 58 15.472 17.144 18.778 1.00 0.00 N ATOM 916 CA ASP A 58 15.823 15.891 19.414 1.00 0.00 C ATOM 917 C ASP A 58 16.311 16.069 20.860 1.00 0.00 C ATOM 918 O ASP A 58 15.997 15.258 21.726 1.00 0.00 O ATOM 919 CB ASP A 58 16.798 15.027 18.618 1.00 0.00 C ATOM 920 CG ASP A 58 17.146 13.671 19.202 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.461 12.652 18.929 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.254 13.581 19.773 1.00 0.00 O ATOM 0 H ASP A 58 16.100 17.401 18.017 1.00 0.00 H new ATOM 0 HA ASP A 58 14.881 15.343 19.440 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.380 14.871 17.624 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.723 15.589 18.490 1.00 0.00 H new ATOM 927 N TYR A 59 16.965 17.184 21.137 1.00 0.00 N ATOM 928 CA TYR A 59 17.427 17.595 22.446 1.00 0.00 C ATOM 929 C TYR A 59 16.324 18.385 23.153 1.00 0.00 C ATOM 930 O TYR A 59 16.510 18.602 24.352 1.00 0.00 O ATOM 931 CB TYR A 59 18.668 18.469 22.218 1.00 0.00 C ATOM 932 CG TYR A 59 19.874 17.607 21.953 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.409 16.784 22.946 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.632 17.766 20.785 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.583 16.072 22.670 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.810 17.064 20.488 1.00 0.00 C ATOM 937 CZ TYR A 59 22.283 16.180 21.469 1.00 0.00 C ATOM 938 OH TYR A 59 23.484 15.552 21.305 1.00 0.00 O ATOM 0 H TYR A 59 17.199 17.862 20.412 1.00 0.00 H new ATOM 0 HA TYR A 59 17.674 16.740 23.076 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.499 19.139 21.375 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.845 19.095 23.092 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.927 16.698 23.909 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.283 18.484 20.058 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.966 15.404 23.427 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.327 17.198 19.550 1.00 0.00 H new ATOM 0 HH TYR A 59 23.353 14.722 20.801 1.00 0.00 H new ATOM 948 N ASN A 60 15.174 18.777 22.610 1.00 0.00 N ATOM 949 CA ASN A 60 14.110 19.557 23.216 1.00 0.00 C ATOM 950 C ASN A 60 14.612 20.845 23.869 1.00 0.00 C ATOM 951 O ASN A 60 14.119 21.374 24.857 1.00 0.00 O ATOM 952 CB ASN A 60 13.437 18.708 24.285 1.00 0.00 C ATOM 953 CG ASN A 60 12.907 17.382 23.758 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.920 17.441 23.042 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.525 16.278 24.186 1.00 0.00 N ATOM 0 H ASN A 60 14.948 18.532 21.646 1.00 0.00 H new ATOM 0 HA ASN A 60 13.419 19.839 22.421 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.150 18.513 25.086 1.00 0.00 H new ATOM 0 HB3 ASN A 60 12.613 19.273 24.722 1.00 0.00 H new ATOM 0 HD21 ASN A 60 13.175 15.359 23.914 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.347 16.353 24.785 1.00 0.00 H new ATOM 962 N ILE A 61 15.554 21.450 23.147 1.00 0.00 N ATOM 963 CA ILE A 61 15.970 22.810 23.426 1.00 0.00 C ATOM 964 C ILE A 61 14.901 23.702 22.788 1.00 0.00 C ATOM 965 O ILE A 61 14.434 23.444 21.688 1.00 0.00 O ATOM 966 CB ILE A 61 17.348 23.010 22.784 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.454 22.153 23.388 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.784 24.478 22.703 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.749 22.207 22.571 1.00 0.00 C ATOM 0 H ILE A 61 16.040 21.013 22.364 1.00 0.00 H new ATOM 0 HA ILE A 61 16.059 23.043 24.487 1.00 0.00 H new ATOM 0 HB ILE A 61 17.199 22.656 21.764 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.655 22.489 24.405 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.113 21.120 23.455 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.768 24.540 22.238 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.064 25.039 22.107 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.830 24.900 23.707 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.504 21.580 23.044 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.557 21.845 21.561 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.108 23.235 22.526 1.00 0.00 H new ATOM 981 N GLN A 62 14.461 24.712 23.543 1.00 0.00 N ATOM 982 CA GLN A 62 13.374 25.603 23.207 1.00 0.00 C ATOM 983 C GLN A 62 14.023 26.993 23.170 1.00 0.00 C ATOM 984 O GLN A 62 15.061 27.224 23.790 1.00 0.00 O ATOM 985 CB GLN A 62 12.259 25.509 24.248 1.00 0.00 C ATOM 986 CG GLN A 62 11.572 24.198 24.612 1.00 0.00 C ATOM 987 CD GLN A 62 11.340 23.261 23.434 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.108 23.718 22.315 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.427 21.971 23.735 1.00 0.00 N ATOM 0 H GLN A 62 14.881 24.932 24.446 1.00 0.00 H new ATOM 0 HA GLN A 62 12.898 25.360 22.257 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.666 25.913 25.175 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.473 26.190 23.922 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.175 23.681 25.359 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.612 24.422 25.077 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.624 21.683 24.694 1.00 0.00 H new ATOM 0 HE22 GLN A 62 11.297 21.268 23.008 1.00 0.00 H new ATOM 998 N LYS A 63 13.321 28.001 22.684 1.00 0.00 N ATOM 999 CA LYS A 63 13.633 29.411 22.533 1.00 0.00 C ATOM 1000 C LYS A 63 14.200 30.052 23.807 1.00 0.00 C ATOM 1001 O LYS A 63 13.645 29.914 24.893 1.00 0.00 O ATOM 1002 CB LYS A 63 12.495 30.243 21.943 1.00 0.00 C ATOM 1003 CG LYS A 63 11.146 29.902 22.575 1.00 0.00 C ATOM 1004 CD LYS A 63 9.892 30.625 22.121 1.00 0.00 C ATOM 1005 CE LYS A 63 8.654 29.878 22.629 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.373 30.521 22.333 1.00 0.00 N ATOM 0 H LYS A 63 12.380 27.820 22.335 1.00 0.00 H new ATOM 0 HA LYS A 63 14.432 29.423 21.791 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.707 31.302 22.091 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.444 30.075 20.867 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.978 28.836 22.425 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.241 30.062 23.649 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.893 31.647 22.499 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.870 30.688 21.033 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.649 28.878 22.195 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.740 29.756 23.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.598 29.943 22.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.349 31.465 22.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.261 30.613 21.303 1.00 0.00 H new ATOM 1020 N GLU A 64 15.355 30.700 23.724 1.00 0.00 N ATOM 1021 CA GLU A 64 16.029 31.335 24.832 1.00 0.00 C ATOM 1022 C GLU A 64 16.659 30.404 25.879 1.00 0.00 C ATOM 1023 O GLU A 64 17.061 30.968 26.887 1.00 0.00 O ATOM 1024 CB GLU A 64 15.161 32.442 25.431 1.00 0.00 C ATOM 1025 CG GLU A 64 14.937 33.520 24.381 1.00 0.00 C ATOM 1026 CD GLU A 64 13.988 34.625 24.804 1.00 0.00 C ATOM 1027 OE1 GLU A 64 14.052 34.996 25.996 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.155 35.120 24.015 1.00 0.00 O ATOM 0 H GLU A 64 15.862 30.797 22.844 1.00 0.00 H new ATOM 0 HA GLU A 64 16.917 31.793 24.397 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.206 32.034 25.761 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.647 32.867 26.309 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.899 33.964 24.124 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.549 33.052 23.476 1.00 0.00 H new ATOM 1035 N SER A 65 16.686 29.083 25.723 1.00 0.00 N ATOM 1036 CA SER A 65 17.548 28.251 26.529 1.00 0.00 C ATOM 1037 C SER A 65 19.060 28.510 26.467 1.00 0.00 C ATOM 1038 O SER A 65 19.565 28.658 25.354 1.00 0.00 O ATOM 1039 CB SER A 65 17.331 26.806 26.105 1.00 0.00 C ATOM 1040 OG SER A 65 16.023 26.289 26.216 1.00 0.00 O ATOM 0 H SER A 65 16.119 28.575 25.045 1.00 0.00 H new ATOM 0 HA SER A 65 17.262 28.490 27.553 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.645 26.708 25.066 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.994 26.177 26.699 1.00 0.00 H new ATOM 0 HG SER A 65 15.503 26.543 25.425 1.00 0.00 H new ATOM 1046 N THR A 66 19.729 28.663 27.605 1.00 0.00 N ATOM 1047 CA THR A 66 21.142 28.953 27.687 1.00 0.00 C ATOM 1048 C THR A 66 21.957 27.664 27.568 1.00 0.00 C ATOM 1049 O THR A 66 21.812 26.760 28.392 1.00 0.00 O ATOM 1050 CB THR A 66 21.457 29.607 29.034 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.672 30.778 29.152 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.910 30.072 29.191 1.00 0.00 C ATOM 0 H THR A 66 19.283 28.585 28.519 1.00 0.00 H new ATOM 0 HA THR A 66 21.404 29.627 26.871 1.00 0.00 H new ATOM 0 HB THR A 66 21.255 28.845 29.786 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.858 31.212 30.011 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.043 30.523 30.174 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.579 29.217 29.090 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.142 30.807 28.420 1.00 0.00 H new ATOM 1060 N LEU A 67 22.895 27.510 26.636 1.00 0.00 N ATOM 1061 CA LEU A 67 23.775 26.420 26.256 1.00 0.00 C ATOM 1062 C LEU A 67 25.211 26.927 26.310 1.00 0.00 C ATOM 1063 O LEU A 67 25.445 28.131 26.230 1.00 0.00 O ATOM 1064 CB LEU A 67 23.382 25.980 24.846 1.00 0.00 C ATOM 1065 CG LEU A 67 21.932 26.178 24.404 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.903 25.893 22.912 1.00 0.00 C ATOM 1067 CD2 LEU A 67 20.934 25.276 25.133 1.00 0.00 C ATOM 0 H LEU A 67 23.081 28.302 26.021 1.00 0.00 H new ATOM 0 HA LEU A 67 23.690 25.566 26.927 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.020 26.513 24.141 1.00 0.00 H new ATOM 0 HB3 LEU A 67 23.617 24.920 24.751 1.00 0.00 H new ATOM 0 HG LEU A 67 21.621 27.194 24.647 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.887 26.019 22.537 1.00 0.00 H new ATOM 0 HD12 LEU A 67 22.569 26.585 22.396 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.232 24.870 22.731 1.00 0.00 H new ATOM 0 HD21 LEU A 67 19.927 25.475 24.765 1.00 0.00 H new ATOM 0 HD22 LEU A 67 21.187 24.232 24.951 1.00 0.00 H new ATOM 0 HD23 LEU A 67 20.975 25.478 26.203 1.00 0.00 H new ATOM 1079 N HIS A 68 26.200 26.048 26.469 1.00 0.00 N ATOM 1080 CA HIS A 68 27.563 26.448 26.766 1.00 0.00 C ATOM 1081 C HIS A 68 28.560 25.888 25.744 1.00 0.00 C ATOM 1082 O HIS A 68 28.374 24.801 25.209 1.00 0.00 O ATOM 1083 CB HIS A 68 27.888 26.018 28.200 1.00 0.00 C ATOM 1084 CG HIS A 68 26.994 26.625 29.254 1.00 0.00 C ATOM 1085 ND1 HIS A 68 25.798 26.066 29.684 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.134 27.779 29.976 1.00 0.00 C ATOM 1087 CE1 HIS A 68 25.224 26.903 30.551 1.00 0.00 C ATOM 1088 NE2 HIS A 68 26.044 27.936 30.805 1.00 0.00 N ATOM 0 H HIS A 68 26.072 25.039 26.394 1.00 0.00 H new ATOM 0 HA HIS A 68 27.654 27.532 26.690 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.819 24.932 28.265 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.921 26.285 28.420 1.00 0.00 H new ATOM 0 HD2 HIS A 68 27.969 28.461 29.907 1.00 0.00 H new ATOM 0 HE1 HIS A 68 24.244 26.769 30.985 1.00 0.00 H new ATOM 0 HE2 HIS A 68 25.891 28.687 31.478 1.00 0.00 H new ATOM 1096 N LEU A 69 29.615 26.658 25.515 1.00 0.00 N ATOM 1097 CA LEU A 69 30.659 26.449 24.522 1.00 0.00 C ATOM 1098 C LEU A 69 31.994 26.270 25.240 1.00 0.00 C ATOM 1099 O LEU A 69 32.281 27.114 26.090 1.00 0.00 O ATOM 1100 CB LEU A 69 30.614 27.539 23.452 1.00 0.00 C ATOM 1101 CG LEU A 69 31.792 27.402 22.486 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.454 26.442 21.346 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.168 28.747 21.865 1.00 0.00 C ATOM 0 H LEU A 69 29.775 27.507 26.058 1.00 0.00 H new ATOM 0 HA LEU A 69 30.500 25.529 23.960 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.676 27.474 22.900 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.638 28.521 23.925 1.00 0.00 H new ATOM 0 HG LEU A 69 32.629 27.019 23.070 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.308 26.362 20.673 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.221 25.459 21.755 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.592 26.820 20.796 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.008 28.611 21.184 1.00 0.00 H new ATOM 0 HD22 LEU A 69 31.316 29.144 21.314 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.449 29.446 22.653 1.00 0.00 H new ATOM 1115 N VAL A 70 32.760 25.214 24.973 1.00 0.00 N ATOM 1116 CA VAL A 70 34.128 24.944 25.374 1.00 0.00 C ATOM 1117 C VAL A 70 35.061 24.772 24.183 1.00 0.00 C ATOM 1118 O VAL A 70 34.627 24.657 23.040 1.00 0.00 O ATOM 1119 CB VAL A 70 34.179 24.110 26.665 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.557 24.781 27.889 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.625 22.697 26.538 1.00 0.00 C ATOM 0 H VAL A 70 32.392 24.448 24.409 1.00 0.00 H new ATOM 0 HA VAL A 70 34.670 25.801 25.774 1.00 0.00 H new ATOM 0 HB VAL A 70 35.254 24.038 26.828 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.640 24.117 28.750 1.00 0.00 H new ATOM 0 HG12 VAL A 70 34.081 25.714 28.098 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.505 24.991 27.694 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.704 22.188 27.498 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.579 22.742 26.236 1.00 0.00 H new ATOM 0 HG23 VAL A 70 34.196 22.148 25.789 1.00 0.00 H new ATOM 1131 N LEU A 71 36.383 24.821 24.391 1.00 0.00 N ATOM 1132 CA LEU A 71 37.346 24.584 23.344 1.00 0.00 C ATOM 1133 C LEU A 71 37.826 23.141 23.506 1.00 0.00 C ATOM 1134 O LEU A 71 37.976 22.648 24.623 1.00 0.00 O ATOM 1135 CB LEU A 71 38.582 25.466 23.478 1.00 0.00 C ATOM 1136 CG LEU A 71 38.434 26.903 22.958 1.00 0.00 C ATOM 1137 CD1 LEU A 71 39.523 27.880 23.383 1.00 0.00 C ATOM 1138 CD2 LEU A 71 38.243 26.711 21.456 1.00 0.00 C ATOM 0 H LEU A 71 36.801 25.028 25.298 1.00 0.00 H new ATOM 0 HA LEU A 71 36.870 24.793 22.386 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.864 25.507 24.530 1.00 0.00 H new ATOM 0 HB3 LEU A 71 39.405 24.990 22.946 1.00 0.00 H new ATOM 0 HG LEU A 71 37.588 27.421 23.410 1.00 0.00 H new ATOM 0 HD11 LEU A 71 39.316 28.862 22.958 1.00 0.00 H new ATOM 0 HD12 LEU A 71 39.543 27.952 24.470 1.00 0.00 H new ATOM 0 HD13 LEU A 71 40.490 27.526 23.025 1.00 0.00 H new ATOM 0 HD21 LEU A 71 38.126 27.683 20.977 1.00 0.00 H new ATOM 0 HD22 LEU A 71 39.114 26.204 21.040 1.00 0.00 H new ATOM 0 HD23 LEU A 71 37.353 26.108 21.277 1.00 0.00 H new