USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 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 7 THR OG1 : rot 111:sc= 0.387 USER MOD Set 1.2: A 9 THR OG1 : rot 180:sc= 0.408 USER MOD Single : A 1 MET CE :methyl -172:sc= 0 (180deg=-0.0625) USER MOD Single : A 1 MET N :NH3+ 167:sc= 2.12! (180deg=1.57!) USER MOD Single : A 2 GLN : amide:sc= 1.4 K(o=1.4,f=-4.9!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -168:sc= 1.25 (180deg=1.12) USER MOD Single : A 12 THR OG1 : rot 170:sc= -0.793 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 162:sc= 0.723 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= 0.332 (180deg=0.236) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.0136 X(o=-0.014,f=-0.062) USER MOD Single : A 41 GLN : amide:sc= 1.26 K(o=1.3,f=-3.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.207! C(o=-0.21!,f=-7.8!) USER MOD Single : A 55 THR OG1 : rot -48:sc= 1.01 USER MOD Single : A 57 SER OG : rot -29:sc= 0.0699 USER MOD Single : A 59 TYR OH : rot 60:sc= 0.331 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.432 X(o=-0.43,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 101:sc= 0.642 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.199 K(o=-0.2,f=-1.8) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.592 30.541 16.438 1.00 0.00 N ATOM 2 CA MET A 1 13.381 30.821 17.859 1.00 0.00 C ATOM 3 C MET A 1 14.778 31.102 18.428 1.00 0.00 C ATOM 4 O MET A 1 15.867 30.623 18.114 1.00 0.00 O ATOM 5 CB MET A 1 12.824 29.625 18.631 1.00 0.00 C ATOM 6 CG MET A 1 13.609 28.315 18.586 1.00 0.00 C ATOM 7 SD MET A 1 13.162 27.023 19.768 1.00 0.00 S ATOM 8 CE MET A 1 14.573 25.983 19.319 1.00 0.00 C ATOM 0 H1 MET A 1 12.727 30.129 16.033 1.00 0.00 H new ATOM 0 H2 MET A 1 13.820 31.425 15.940 1.00 0.00 H new ATOM 0 H3 MET A 1 14.379 29.870 16.330 1.00 0.00 H new ATOM 0 HA MET A 1 12.667 31.639 17.957 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.724 29.919 19.676 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.819 29.425 18.259 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.510 27.900 17.583 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.663 28.551 18.731 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.481 25.014 19.809 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.592 25.843 18.238 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.497 26.465 19.639 1.00 0.00 H new ATOM 20 N GLN A 2 14.733 32.089 19.315 1.00 0.00 N ATOM 21 CA GLN A 2 15.852 32.731 19.979 1.00 0.00 C ATOM 22 C GLN A 2 16.536 31.838 21.018 1.00 0.00 C ATOM 23 O GLN A 2 15.884 31.063 21.721 1.00 0.00 O ATOM 24 CB GLN A 2 15.435 34.056 20.624 1.00 0.00 C ATOM 25 CG GLN A 2 14.544 34.050 21.865 1.00 0.00 C ATOM 26 CD GLN A 2 13.120 33.580 21.604 1.00 0.00 C ATOM 27 OE1 GLN A 2 12.690 33.597 20.457 1.00 0.00 O ATOM 28 NE2 GLN A 2 12.308 33.305 22.621 1.00 0.00 N ATOM 0 H GLN A 2 13.842 32.489 19.609 1.00 0.00 H new ATOM 0 HA GLN A 2 16.582 32.927 19.194 1.00 0.00 H new ATOM 0 HB2 GLN A 2 16.348 34.593 20.882 1.00 0.00 H new ATOM 0 HB3 GLN A 2 14.925 34.643 19.860 1.00 0.00 H new ATOM 0 HG2 GLN A 2 14.995 33.406 22.620 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.513 35.057 22.282 1.00 0.00 H new ATOM 0 HE21 GLN A 2 12.671 33.292 23.574 1.00 0.00 H new ATOM 0 HE22 GLN A 2 11.323 33.107 22.448 1.00 0.00 H new ATOM 37 N ILE A 3 17.851 31.964 21.133 1.00 0.00 N ATOM 38 CA ILE A 3 18.637 31.219 22.101 1.00 0.00 C ATOM 39 C ILE A 3 19.779 32.135 22.537 1.00 0.00 C ATOM 40 O ILE A 3 19.941 33.161 21.877 1.00 0.00 O ATOM 41 CB ILE A 3 19.122 29.847 21.611 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.864 29.964 20.285 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.018 28.798 21.579 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.820 28.801 19.974 1.00 0.00 C ATOM 0 H ILE A 3 18.405 32.592 20.551 1.00 0.00 H new ATOM 0 HA ILE A 3 18.005 30.954 22.948 1.00 0.00 H new ATOM 0 HB ILE A 3 19.837 29.483 22.349 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.132 30.038 19.481 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.433 30.893 20.285 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.426 27.851 21.224 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.613 28.665 22.582 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.224 29.126 20.908 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.301 28.973 19.011 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.580 28.736 20.753 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.258 27.868 19.937 1.00 0.00 H new ATOM 56 N PHE A 4 20.592 31.726 23.501 1.00 0.00 N ATOM 57 CA PHE A 4 21.817 32.349 23.961 1.00 0.00 C ATOM 58 C PHE A 4 22.922 31.288 23.961 1.00 0.00 C ATOM 59 O PHE A 4 22.870 30.337 24.737 1.00 0.00 O ATOM 60 CB PHE A 4 21.689 32.835 25.410 1.00 0.00 C ATOM 61 CG PHE A 4 20.937 34.115 25.665 1.00 0.00 C ATOM 62 CD1 PHE A 4 21.299 35.326 25.065 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.868 34.082 26.567 1.00 0.00 C ATOM 64 CE1 PHE A 4 20.670 36.511 25.470 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.153 35.247 26.885 1.00 0.00 C ATOM 66 CZ PHE A 4 19.605 36.465 26.377 1.00 0.00 C ATOM 0 H PHE A 4 20.390 30.874 24.025 1.00 0.00 H new ATOM 0 HA PHE A 4 22.034 33.192 23.305 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.207 32.045 25.985 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.695 32.954 25.812 1.00 0.00 H new ATOM 0 HD1 PHE A 4 22.057 35.347 24.296 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.589 33.145 27.026 1.00 0.00 H new ATOM 0 HE1 PHE A 4 21.007 37.461 25.082 1.00 0.00 H new ATOM 0 HE2 PHE A 4 18.273 35.202 27.509 1.00 0.00 H new ATOM 0 HZ PHE A 4 19.128 37.383 26.687 1.00 0.00 H new ATOM 76 N VAL A 5 23.986 31.422 23.180 1.00 0.00 N ATOM 77 CA VAL A 5 25.276 30.793 23.348 1.00 0.00 C ATOM 78 C VAL A 5 26.029 31.658 24.366 1.00 0.00 C ATOM 79 O VAL A 5 26.254 32.842 24.140 1.00 0.00 O ATOM 80 CB VAL A 5 26.068 30.668 22.040 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.325 29.801 22.117 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.284 30.216 20.811 1.00 0.00 C ATOM 0 H VAL A 5 23.961 32.019 22.353 1.00 0.00 H new ATOM 0 HA VAL A 5 25.148 29.766 23.689 1.00 0.00 H new ATOM 0 HB VAL A 5 26.346 31.714 21.909 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.811 29.778 21.142 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.010 30.219 22.854 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.051 28.788 22.410 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.952 30.166 19.951 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.855 29.231 20.995 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.484 30.928 20.608 1.00 0.00 H new ATOM 92 N LYS A 6 26.376 31.130 25.539 1.00 0.00 N ATOM 93 CA LYS A 6 27.390 31.621 26.454 1.00 0.00 C ATOM 94 C LYS A 6 28.733 30.918 26.242 1.00 0.00 C ATOM 95 O LYS A 6 28.664 29.729 25.941 1.00 0.00 O ATOM 96 CB LYS A 6 26.995 31.644 27.936 1.00 0.00 C ATOM 97 CG LYS A 6 25.981 32.724 28.318 1.00 0.00 C ATOM 98 CD LYS A 6 26.041 33.050 29.814 1.00 0.00 C ATOM 99 CE LYS A 6 24.810 33.851 30.233 1.00 0.00 C ATOM 100 NZ LYS A 6 24.804 34.345 31.617 1.00 0.00 N ATOM 0 H LYS A 6 25.920 30.289 25.894 1.00 0.00 H new ATOM 0 HA LYS A 6 27.496 32.673 26.189 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.584 30.670 28.202 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.895 31.784 28.534 1.00 0.00 H new ATOM 0 HG2 LYS A 6 26.176 33.627 27.740 1.00 0.00 H new ATOM 0 HG3 LYS A 6 24.977 32.389 28.058 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.097 32.128 30.392 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.945 33.619 30.033 1.00 0.00 H new ATOM 0 HE2 LYS A 6 24.711 34.705 29.563 1.00 0.00 H new ATOM 0 HE3 LYS A 6 23.928 33.227 30.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 23.926 34.873 31.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 24.862 33.540 32.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.620 34.972 31.765 1.00 0.00 H new ATOM 114 N THR A 7 29.848 31.604 26.444 1.00 0.00 N ATOM 115 CA THR A 7 31.210 31.123 26.609 1.00 0.00 C ATOM 116 C THR A 7 31.411 31.039 28.122 1.00 0.00 C ATOM 117 O THR A 7 30.684 31.542 28.972 1.00 0.00 O ATOM 118 CB THR A 7 32.164 32.045 25.841 1.00 0.00 C ATOM 119 OG1 THR A 7 32.329 33.274 26.512 1.00 0.00 O ATOM 120 CG2 THR A 7 31.863 32.173 24.354 1.00 0.00 C ATOM 0 H THR A 7 29.816 32.622 26.502 1.00 0.00 H new ATOM 0 HA THR A 7 31.415 30.139 26.188 1.00 0.00 H new ATOM 0 HB THR A 7 33.137 31.554 25.841 1.00 0.00 H new ATOM 0 HG1 THR A 7 33.240 33.333 26.867 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.588 32.844 23.893 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.927 31.192 23.884 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.859 32.575 24.219 1.00 0.00 H new ATOM 128 N LEU A 8 32.420 30.227 28.437 1.00 0.00 N ATOM 129 CA LEU A 8 32.919 29.967 29.771 1.00 0.00 C ATOM 130 C LEU A 8 33.487 31.242 30.388 1.00 0.00 C ATOM 131 O LEU A 8 33.552 31.246 31.623 1.00 0.00 O ATOM 132 CB LEU A 8 34.048 28.943 29.586 1.00 0.00 C ATOM 133 CG LEU A 8 34.658 28.251 30.801 1.00 0.00 C ATOM 134 CD1 LEU A 8 33.539 27.560 31.582 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.722 27.233 30.383 1.00 0.00 C ATOM 0 H LEU A 8 32.933 29.709 27.724 1.00 0.00 H new ATOM 0 HA LEU A 8 32.130 29.607 30.431 1.00 0.00 H new ATOM 0 HB2 LEU A 8 33.673 28.163 28.924 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.859 29.446 29.059 1.00 0.00 H new ATOM 0 HG LEU A 8 35.148 28.996 31.429 1.00 0.00 H new ATOM 0 HD11 LEU A 8 33.959 27.060 32.455 1.00 0.00 H new ATOM 0 HD12 LEU A 8 32.809 28.302 31.905 1.00 0.00 H new ATOM 0 HD13 LEU A 8 33.050 26.825 30.943 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.138 26.756 31.271 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.269 26.476 29.743 1.00 0.00 H new ATOM 0 HD23 LEU A 8 36.517 27.741 29.837 1.00 0.00 H new ATOM 147 N THR A 9 33.848 32.207 29.555 1.00 0.00 N ATOM 148 CA THR A 9 34.363 33.477 30.036 1.00 0.00 C ATOM 149 C THR A 9 33.282 34.553 30.134 1.00 0.00 C ATOM 150 O THR A 9 33.566 35.618 30.680 1.00 0.00 O ATOM 151 CB THR A 9 35.492 33.860 29.080 1.00 0.00 C ATOM 152 OG1 THR A 9 35.058 33.770 27.729 1.00 0.00 O ATOM 153 CG2 THR A 9 36.554 32.767 29.154 1.00 0.00 C ATOM 0 H THR A 9 33.793 32.132 28.539 1.00 0.00 H new ATOM 0 HA THR A 9 34.733 33.385 31.057 1.00 0.00 H new ATOM 0 HB THR A 9 35.830 34.861 29.348 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.794 34.020 27.132 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.376 33.012 28.481 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.930 32.694 30.174 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.116 31.813 28.860 1.00 0.00 H new ATOM 161 N GLY A 10 32.065 34.296 29.664 1.00 0.00 N ATOM 162 CA GLY A 10 30.905 35.029 30.103 1.00 0.00 C ATOM 163 C GLY A 10 30.134 35.667 28.942 1.00 0.00 C ATOM 164 O GLY A 10 28.941 35.926 29.108 1.00 0.00 O ATOM 0 H GLY A 10 31.866 33.575 28.971 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.242 34.358 30.649 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.215 35.808 30.800 1.00 0.00 H new ATOM 168 N LYS A 11 30.827 35.922 27.838 1.00 0.00 N ATOM 169 CA LYS A 11 30.393 36.555 26.610 1.00 0.00 C ATOM 170 C LYS A 11 29.179 35.795 26.055 1.00 0.00 C ATOM 171 O LYS A 11 29.333 34.602 25.826 1.00 0.00 O ATOM 172 CB LYS A 11 31.489 36.700 25.563 1.00 0.00 C ATOM 173 CG LYS A 11 31.088 37.399 24.257 1.00 0.00 C ATOM 174 CD LYS A 11 32.182 37.716 23.244 1.00 0.00 C ATOM 175 CE LYS A 11 31.669 38.582 22.085 1.00 0.00 C ATOM 176 NZ LYS A 11 32.802 39.147 21.327 1.00 0.00 N ATOM 0 H LYS A 11 31.811 35.660 27.782 1.00 0.00 H new ATOM 0 HA LYS A 11 30.112 37.579 26.856 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.317 37.252 26.007 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.864 35.706 25.319 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.345 36.775 23.760 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.595 38.335 24.518 1.00 0.00 H new ATOM 0 HD2 LYS A 11 33.000 38.232 23.746 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.588 36.785 22.847 1.00 0.00 H new ATOM 0 HE2 LYS A 11 31.043 37.983 21.424 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.044 39.387 22.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.454 39.884 20.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.489 39.562 21.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.262 38.394 20.777 1.00 0.00 H new ATOM 190 N THR A 12 28.051 36.486 25.950 1.00 0.00 N ATOM 191 CA THR A 12 26.859 35.854 25.417 1.00 0.00 C ATOM 192 C THR A 12 26.673 36.256 23.947 1.00 0.00 C ATOM 193 O THR A 12 26.920 37.397 23.573 1.00 0.00 O ATOM 194 CB THR A 12 25.695 36.377 26.265 1.00 0.00 C ATOM 195 OG1 THR A 12 25.859 35.872 27.579 1.00 0.00 O ATOM 196 CG2 THR A 12 24.450 35.569 25.889 1.00 0.00 C ATOM 0 H THR A 12 27.940 37.463 26.221 1.00 0.00 H new ATOM 0 HA THR A 12 26.921 34.766 25.455 1.00 0.00 H new ATOM 0 HB THR A 12 25.640 37.460 26.152 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.226 36.315 28.181 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.600 35.916 26.476 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.237 35.701 24.828 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.626 34.513 26.095 1.00 0.00 H new ATOM 204 N ILE A 13 26.405 35.282 23.087 1.00 0.00 N ATOM 205 CA ILE A 13 26.064 35.436 21.681 1.00 0.00 C ATOM 206 C ILE A 13 24.589 35.085 21.542 1.00 0.00 C ATOM 207 O ILE A 13 24.136 34.072 22.068 1.00 0.00 O ATOM 208 CB ILE A 13 26.842 34.377 20.898 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.294 34.094 21.291 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.793 34.451 19.376 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.139 35.342 21.084 1.00 0.00 C ATOM 0 H ILE A 13 26.421 34.303 23.372 1.00 0.00 H new ATOM 0 HA ILE A 13 26.285 36.442 21.326 1.00 0.00 H new ATOM 0 HB ILE A 13 26.230 33.543 21.242 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.343 33.780 22.334 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.689 33.273 20.692 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.387 33.641 18.953 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.760 34.357 19.040 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.196 35.408 19.045 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.171 35.133 21.366 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.102 35.637 20.035 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.751 36.151 21.703 1.00 0.00 H new ATOM 223 N THR A 14 23.768 35.909 20.889 1.00 0.00 N ATOM 224 CA THR A 14 22.370 35.700 20.562 1.00 0.00 C ATOM 225 C THR A 14 22.379 34.916 19.252 1.00 0.00 C ATOM 226 O THR A 14 23.117 35.229 18.313 1.00 0.00 O ATOM 227 CB THR A 14 21.547 36.973 20.339 1.00 0.00 C ATOM 228 OG1 THR A 14 21.751 37.700 21.524 1.00 0.00 O ATOM 229 CG2 THR A 14 20.067 36.658 20.151 1.00 0.00 C ATOM 0 H THR A 14 24.098 36.813 20.550 1.00 0.00 H new ATOM 0 HA THR A 14 21.900 35.198 21.408 1.00 0.00 H new ATOM 0 HB THR A 14 21.846 37.513 19.441 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.259 38.546 21.478 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.515 37.585 19.995 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.940 36.010 19.284 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.687 36.154 21.039 1.00 0.00 H new ATOM 237 N LEU A 15 21.433 34.000 19.083 1.00 0.00 N ATOM 238 CA LEU A 15 21.247 33.330 17.804 1.00 0.00 C ATOM 239 C LEU A 15 19.745 33.271 17.525 1.00 0.00 C ATOM 240 O LEU A 15 18.933 33.109 18.443 1.00 0.00 O ATOM 241 CB LEU A 15 21.907 31.954 17.817 1.00 0.00 C ATOM 242 CG LEU A 15 23.402 31.984 17.503 1.00 0.00 C ATOM 243 CD1 LEU A 15 23.984 30.570 17.555 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.900 32.569 16.182 1.00 0.00 C ATOM 0 H LEU A 15 20.785 33.706 19.814 1.00 0.00 H new ATOM 0 HA LEU A 15 21.731 33.880 16.997 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.760 31.500 18.797 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.406 31.314 17.091 1.00 0.00 H new ATOM 0 HG LEU A 15 23.738 32.677 18.275 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.050 30.607 17.329 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.838 30.153 18.551 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.479 29.942 16.821 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.987 32.502 16.141 1.00 0.00 H new ATOM 0 HD22 LEU A 15 23.471 32.009 15.351 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.598 33.614 16.110 1.00 0.00 H new ATOM 256 N GLU A 16 19.363 33.253 16.256 1.00 0.00 N ATOM 257 CA GLU A 16 18.127 32.682 15.756 1.00 0.00 C ATOM 258 C GLU A 16 18.574 31.356 15.133 1.00 0.00 C ATOM 259 O GLU A 16 19.483 31.322 14.312 1.00 0.00 O ATOM 260 CB GLU A 16 17.418 33.525 14.703 1.00 0.00 C ATOM 261 CG GLU A 16 16.128 34.223 15.160 1.00 0.00 C ATOM 262 CD GLU A 16 14.937 33.306 15.336 1.00 0.00 C ATOM 263 OE1 GLU A 16 14.974 32.116 14.953 1.00 0.00 O ATOM 264 OE2 GLU A 16 13.880 33.774 15.825 1.00 0.00 O ATOM 0 H GLU A 16 19.936 33.656 15.514 1.00 0.00 H new ATOM 0 HA GLU A 16 17.400 32.595 16.563 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.113 34.285 14.346 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.181 32.886 13.853 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.321 34.730 16.106 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.871 34.993 14.433 1.00 0.00 H new ATOM 271 N VAL A 17 17.905 30.311 15.614 1.00 0.00 N ATOM 272 CA VAL A 17 17.763 28.957 15.126 1.00 0.00 C ATOM 273 C VAL A 17 16.335 28.436 15.245 1.00 0.00 C ATOM 274 O VAL A 17 15.561 28.897 16.074 1.00 0.00 O ATOM 275 CB VAL A 17 18.724 28.056 15.927 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.185 28.489 15.839 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.374 27.961 17.414 1.00 0.00 C ATOM 0 H VAL A 17 17.378 30.421 16.480 1.00 0.00 H new ATOM 0 HA VAL A 17 18.007 28.946 14.064 1.00 0.00 H new ATOM 0 HB VAL A 17 18.597 27.084 15.451 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.802 27.809 16.427 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.509 28.466 14.799 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.288 29.502 16.229 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.091 27.311 17.916 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.410 28.955 17.860 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.371 27.549 17.526 1.00 0.00 H new ATOM 287 N GLU A 18 16.080 27.263 14.652 1.00 0.00 N ATOM 288 CA GLU A 18 14.782 26.619 14.624 1.00 0.00 C ATOM 289 C GLU A 18 15.034 25.178 15.077 1.00 0.00 C ATOM 290 O GLU A 18 16.137 24.698 14.819 1.00 0.00 O ATOM 291 CB GLU A 18 14.013 26.853 13.329 1.00 0.00 C ATOM 292 CG GLU A 18 13.185 28.136 13.440 1.00 0.00 C ATOM 293 CD GLU A 18 11.978 28.131 14.372 1.00 0.00 C ATOM 294 OE1 GLU A 18 10.957 27.606 13.891 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.039 28.606 15.528 1.00 0.00 O ATOM 0 H GLU A 18 16.800 26.728 14.167 1.00 0.00 H new ATOM 0 HA GLU A 18 14.064 27.062 15.314 1.00 0.00 H new ATOM 0 HB2 GLU A 18 14.707 26.929 12.492 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.360 26.005 13.125 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.851 28.937 13.761 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.834 28.395 12.441 1.00 0.00 H new ATOM 302 N PRO A 19 14.135 24.543 15.815 1.00 0.00 N ATOM 303 CA PRO A 19 14.463 23.268 16.433 1.00 0.00 C ATOM 304 C PRO A 19 14.902 22.162 15.462 1.00 0.00 C ATOM 305 O PRO A 19 15.694 21.386 15.983 1.00 0.00 O ATOM 306 CB PRO A 19 13.259 22.812 17.250 1.00 0.00 C ATOM 307 CG PRO A 19 12.296 24.000 17.245 1.00 0.00 C ATOM 308 CD PRO A 19 12.801 24.972 16.187 1.00 0.00 C ATOM 0 HA PRO A 19 15.339 23.439 17.059 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.796 21.929 16.810 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.551 22.546 18.266 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.281 23.674 17.017 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.265 24.477 18.225 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.141 24.974 15.319 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.818 25.990 16.576 1.00 0.00 H new ATOM 316 N SER A 20 14.511 22.065 14.197 1.00 0.00 N ATOM 317 CA SER A 20 15.047 21.119 13.241 1.00 0.00 C ATOM 318 C SER A 20 16.419 21.473 12.661 1.00 0.00 C ATOM 319 O SER A 20 16.970 20.730 11.846 1.00 0.00 O ATOM 320 CB SER A 20 13.943 21.027 12.188 1.00 0.00 C ATOM 321 OG SER A 20 13.563 22.189 11.500 1.00 0.00 O ATOM 0 H SER A 20 13.788 22.665 13.801 1.00 0.00 H new ATOM 0 HA SER A 20 15.275 20.163 13.713 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.256 20.292 11.446 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.054 20.628 12.677 1.00 0.00 H new ATOM 0 HG SER A 20 12.852 21.973 10.862 1.00 0.00 H new ATOM 327 N ASP A 21 17.060 22.562 13.076 1.00 0.00 N ATOM 328 CA ASP A 21 18.350 22.975 12.574 1.00 0.00 C ATOM 329 C ASP A 21 19.406 22.094 13.248 1.00 0.00 C ATOM 330 O ASP A 21 19.262 21.765 14.424 1.00 0.00 O ATOM 331 CB ASP A 21 18.736 24.437 12.808 1.00 0.00 C ATOM 332 CG ASP A 21 17.846 25.429 12.064 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.354 24.978 11.010 1.00 0.00 O ATOM 334 OD2 ASP A 21 17.918 26.662 12.241 1.00 0.00 O ATOM 0 H ASP A 21 16.682 23.189 13.786 1.00 0.00 H new ATOM 0 HA ASP A 21 18.294 22.866 11.491 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.690 24.650 13.876 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.770 24.585 12.498 1.00 0.00 H new ATOM 339 N THR A 22 20.505 21.817 12.565 1.00 0.00 N ATOM 340 CA THR A 22 21.530 20.878 12.971 1.00 0.00 C ATOM 341 C THR A 22 22.468 21.453 14.035 1.00 0.00 C ATOM 342 O THR A 22 22.734 22.648 13.949 1.00 0.00 O ATOM 343 CB THR A 22 22.331 20.391 11.766 1.00 0.00 C ATOM 344 OG1 THR A 22 22.837 21.404 10.921 1.00 0.00 O ATOM 345 CG2 THR A 22 21.562 19.337 10.976 1.00 0.00 C ATOM 0 H THR A 22 20.713 22.263 11.672 1.00 0.00 H new ATOM 0 HA THR A 22 21.013 20.030 13.421 1.00 0.00 H new ATOM 0 HB THR A 22 23.220 19.934 12.199 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.555 21.037 10.364 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.160 19.012 10.125 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.351 18.483 11.619 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.624 19.763 10.619 1.00 0.00 H new ATOM 353 N ILE A 23 23.115 20.640 14.857 1.00 0.00 N ATOM 354 CA ILE A 23 24.288 21.026 15.611 1.00 0.00 C ATOM 355 C ILE A 23 25.531 20.924 14.724 1.00 0.00 C ATOM 356 O ILE A 23 26.471 20.158 14.906 1.00 0.00 O ATOM 357 CB ILE A 23 24.256 20.253 16.934 1.00 0.00 C ATOM 358 CG1 ILE A 23 22.935 20.113 17.683 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.359 20.808 17.836 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.359 21.425 18.201 1.00 0.00 C ATOM 0 H ILE A 23 22.829 19.674 15.018 1.00 0.00 H new ATOM 0 HA ILE A 23 24.312 22.074 15.908 1.00 0.00 H new ATOM 0 HB ILE A 23 24.422 19.216 16.643 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.205 19.647 17.022 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.080 19.437 18.526 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.356 20.273 18.786 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.326 20.679 17.350 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.182 21.868 18.017 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.420 21.231 18.720 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.066 21.886 18.891 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.178 22.099 17.363 1.00 0.00 H new ATOM 372 N GLU A 24 25.449 21.522 13.537 1.00 0.00 N ATOM 373 CA GLU A 24 26.445 21.446 12.477 1.00 0.00 C ATOM 374 C GLU A 24 26.346 22.703 11.606 1.00 0.00 C ATOM 375 O GLU A 24 27.293 23.485 11.670 1.00 0.00 O ATOM 376 CB GLU A 24 26.362 20.107 11.757 1.00 0.00 C ATOM 377 CG GLU A 24 27.090 19.846 10.436 1.00 0.00 C ATOM 378 CD GLU A 24 28.573 20.169 10.345 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.270 19.492 11.125 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.968 21.068 9.567 1.00 0.00 O ATOM 0 H GLU A 24 24.648 22.099 13.279 1.00 0.00 H new ATOM 0 HA GLU A 24 27.460 21.455 12.873 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.709 19.350 12.461 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.305 19.913 11.576 1.00 0.00 H new ATOM 0 HG2 GLU A 24 26.966 18.791 10.193 1.00 0.00 H new ATOM 0 HG3 GLU A 24 26.579 20.415 9.659 1.00 0.00 H new ATOM 387 N ASN A 25 25.190 23.054 11.049 1.00 0.00 N ATOM 388 CA ASN A 25 25.043 24.171 10.139 1.00 0.00 C ATOM 389 C ASN A 25 25.444 25.517 10.753 1.00 0.00 C ATOM 390 O ASN A 25 26.285 26.185 10.136 1.00 0.00 O ATOM 391 CB ASN A 25 23.647 24.221 9.531 1.00 0.00 C ATOM 392 CG ASN A 25 23.577 25.172 8.339 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.933 26.206 8.416 1.00 0.00 O ATOM 394 ND2 ASN A 25 24.047 24.669 7.201 1.00 0.00 N ATOM 0 H ASN A 25 24.317 22.557 11.225 1.00 0.00 H new ATOM 0 HA ASN A 25 25.753 23.992 9.331 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.353 23.220 9.214 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.932 24.538 10.290 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.876 25.154 6.320 1.00 0.00 H new ATOM 0 HD22 ASN A 25 24.579 23.799 7.209 1.00 0.00 H new ATOM 401 N VAL A 26 24.808 25.882 11.856 1.00 0.00 N ATOM 402 CA VAL A 26 24.746 27.203 12.445 1.00 0.00 C ATOM 403 C VAL A 26 26.030 27.528 13.210 1.00 0.00 C ATOM 404 O VAL A 26 26.273 28.686 13.535 1.00 0.00 O ATOM 405 CB VAL A 26 23.538 27.464 13.348 1.00 0.00 C ATOM 406 CG1 VAL A 26 23.376 28.843 14.004 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.301 27.069 12.545 1.00 0.00 C ATOM 0 H VAL A 26 24.280 25.203 12.404 1.00 0.00 H new ATOM 0 HA VAL A 26 24.629 27.867 11.588 1.00 0.00 H new ATOM 0 HB VAL A 26 23.702 26.858 14.239 1.00 0.00 H new ATOM 0 HG11 VAL A 26 22.469 28.854 14.608 1.00 0.00 H new ATOM 0 HG12 VAL A 26 24.238 29.047 14.639 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.306 29.608 13.231 1.00 0.00 H new ATOM 0 HG21 VAL A 26 21.408 27.237 13.147 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.247 27.673 11.639 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.364 26.015 12.275 1.00 0.00 H new ATOM 417 N LYS A 27 26.949 26.583 13.400 1.00 0.00 N ATOM 418 CA LYS A 27 28.345 26.745 13.770 1.00 0.00 C ATOM 419 C LYS A 27 29.149 27.767 12.957 1.00 0.00 C ATOM 420 O LYS A 27 29.982 28.534 13.435 1.00 0.00 O ATOM 421 CB LYS A 27 28.929 25.338 13.633 1.00 0.00 C ATOM 422 CG LYS A 27 28.447 24.382 14.722 1.00 0.00 C ATOM 423 CD LYS A 27 29.345 23.142 14.779 1.00 0.00 C ATOM 424 CE LYS A 27 29.075 22.345 16.050 1.00 0.00 C ATOM 425 NZ LYS A 27 30.046 21.234 16.140 1.00 0.00 N ATOM 0 H LYS A 27 26.709 25.598 13.288 1.00 0.00 H new ATOM 0 HA LYS A 27 28.408 27.164 14.774 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.661 24.933 12.657 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.017 25.398 13.665 1.00 0.00 H new ATOM 0 HG2 LYS A 27 28.453 24.888 15.688 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.417 24.084 14.524 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.166 22.516 13.905 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.392 23.442 14.747 1.00 0.00 H new ATOM 0 HE2 LYS A 27 29.160 22.991 16.924 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.057 21.955 16.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.041 20.846 17.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.783 20.488 15.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.998 21.586 15.914 1.00 0.00 H new ATOM 439 N ALA A 28 28.909 27.786 11.648 1.00 0.00 N ATOM 440 CA ALA A 28 29.488 28.830 10.818 1.00 0.00 C ATOM 441 C ALA A 28 29.268 30.263 11.311 1.00 0.00 C ATOM 442 O ALA A 28 30.046 31.170 11.027 1.00 0.00 O ATOM 443 CB ALA A 28 28.791 28.741 9.463 1.00 0.00 C ATOM 0 H ALA A 28 28.332 27.107 11.152 1.00 0.00 H new ATOM 0 HA ALA A 28 30.564 28.658 10.813 1.00 0.00 H new ATOM 0 HB1 ALA A 28 29.190 29.507 8.798 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.965 27.757 9.029 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.720 28.896 9.594 1.00 0.00 H new ATOM 449 N LYS A 29 28.167 30.455 12.039 1.00 0.00 N ATOM 450 CA LYS A 29 27.799 31.812 12.394 1.00 0.00 C ATOM 451 C LYS A 29 28.443 32.240 13.704 1.00 0.00 C ATOM 452 O LYS A 29 28.465 33.420 14.057 1.00 0.00 O ATOM 453 CB LYS A 29 26.278 31.767 12.542 1.00 0.00 C ATOM 454 CG LYS A 29 25.555 33.115 12.515 1.00 0.00 C ATOM 455 CD LYS A 29 24.074 32.942 12.175 1.00 0.00 C ATOM 456 CE LYS A 29 23.878 32.719 10.681 1.00 0.00 C ATOM 457 NZ LYS A 29 22.459 32.937 10.343 1.00 0.00 N ATOM 0 H LYS A 29 27.545 29.721 12.378 1.00 0.00 H new ATOM 0 HA LYS A 29 28.133 32.530 11.645 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.874 31.146 11.742 1.00 0.00 H new ATOM 0 HB3 LYS A 29 26.040 31.270 13.482 1.00 0.00 H new ATOM 0 HG2 LYS A 29 25.654 33.603 13.485 1.00 0.00 H new ATOM 0 HG3 LYS A 29 26.026 33.768 11.780 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.667 32.096 12.729 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.519 33.826 12.490 1.00 0.00 H new ATOM 0 HE2 LYS A 29 24.509 33.402 10.113 1.00 0.00 H new ATOM 0 HE3 LYS A 29 24.178 31.707 10.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 22.318 32.786 9.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.868 32.268 10.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 22.189 33.911 10.590 1.00 0.00 H new ATOM 471 N ILE A 30 29.188 31.351 14.358 1.00 0.00 N ATOM 472 CA ILE A 30 30.115 31.600 15.442 1.00 0.00 C ATOM 473 C ILE A 30 31.499 31.883 14.846 1.00 0.00 C ATOM 474 O ILE A 30 32.284 32.716 15.303 1.00 0.00 O ATOM 475 CB ILE A 30 30.150 30.388 16.384 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.765 30.049 16.950 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.233 30.436 17.459 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.982 31.172 17.631 1.00 0.00 C ATOM 0 H ILE A 30 29.150 30.360 14.118 1.00 0.00 H new ATOM 0 HA ILE A 30 29.798 32.464 16.025 1.00 0.00 H new ATOM 0 HB ILE A 30 30.450 29.556 15.747 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.155 29.661 16.134 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.886 29.240 17.670 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.176 29.537 18.073 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.213 30.491 16.986 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.084 31.314 18.087 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.024 30.787 17.981 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.553 31.551 18.479 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.810 31.979 16.919 1.00 0.00 H new ATOM 490 N GLN A 31 31.798 31.147 13.781 1.00 0.00 N ATOM 491 CA GLN A 31 33.021 31.304 13.020 1.00 0.00 C ATOM 492 C GLN A 31 33.169 32.666 12.346 1.00 0.00 C ATOM 493 O GLN A 31 34.190 33.310 12.561 1.00 0.00 O ATOM 494 CB GLN A 31 33.059 30.209 11.952 1.00 0.00 C ATOM 495 CG GLN A 31 34.247 30.111 10.999 1.00 0.00 C ATOM 496 CD GLN A 31 34.221 28.845 10.159 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.226 28.296 9.699 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.419 28.324 9.911 1.00 0.00 N ATOM 0 H GLN A 31 31.185 30.415 13.421 1.00 0.00 H new ATOM 0 HA GLN A 31 33.849 31.226 13.724 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.977 29.252 12.467 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.163 30.321 11.342 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.252 30.979 10.340 1.00 0.00 H new ATOM 0 HG3 GLN A 31 35.173 30.142 11.574 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.256 28.769 10.287 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.501 27.479 9.345 1.00 0.00 H new ATOM 507 N ASP A 32 32.091 33.166 11.742 1.00 0.00 N ATOM 508 CA ASP A 32 31.916 34.496 11.195 1.00 0.00 C ATOM 509 C ASP A 32 32.126 35.647 12.174 1.00 0.00 C ATOM 510 O ASP A 32 32.433 36.773 11.779 1.00 0.00 O ATOM 511 CB ASP A 32 30.511 34.511 10.579 1.00 0.00 C ATOM 512 CG ASP A 32 30.139 35.760 9.802 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.476 35.806 8.595 1.00 0.00 O ATOM 514 OD2 ASP A 32 29.395 36.583 10.380 1.00 0.00 O ATOM 0 H ASP A 32 31.253 32.598 11.616 1.00 0.00 H new ATOM 0 HA ASP A 32 32.699 34.679 10.459 1.00 0.00 H new ATOM 0 HB2 ASP A 32 30.418 33.652 9.914 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.784 34.375 11.379 1.00 0.00 H new ATOM 519 N LYS A 33 32.114 35.351 13.467 1.00 0.00 N ATOM 520 CA LYS A 33 32.156 36.311 14.552 1.00 0.00 C ATOM 521 C LYS A 33 33.504 36.269 15.267 1.00 0.00 C ATOM 522 O LYS A 33 34.229 37.264 15.337 1.00 0.00 O ATOM 523 CB LYS A 33 30.992 35.978 15.501 1.00 0.00 C ATOM 524 CG LYS A 33 29.668 36.428 14.888 1.00 0.00 C ATOM 525 CD LYS A 33 28.432 36.396 15.783 1.00 0.00 C ATOM 526 CE LYS A 33 27.112 36.815 15.120 1.00 0.00 C ATOM 527 NZ LYS A 33 27.135 38.149 14.502 1.00 0.00 N ATOM 0 H LYS A 33 32.073 34.387 13.799 1.00 0.00 H new ATOM 0 HA LYS A 33 32.047 37.328 14.174 1.00 0.00 H new ATOM 0 HB2 LYS A 33 30.966 34.906 15.694 1.00 0.00 H new ATOM 0 HB3 LYS A 33 31.143 36.471 16.461 1.00 0.00 H new ATOM 0 HG2 LYS A 33 29.794 37.448 14.525 1.00 0.00 H new ATOM 0 HG3 LYS A 33 29.470 35.802 14.018 1.00 0.00 H new ATOM 0 HD2 LYS A 33 28.315 35.385 16.172 1.00 0.00 H new ATOM 0 HD3 LYS A 33 28.610 37.048 16.638 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.854 36.080 14.358 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.320 36.789 15.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 26.207 38.352 14.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 27.349 38.864 15.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 27.866 38.177 13.763 1.00 0.00 H new ATOM 541 N GLU A 34 33.970 35.107 15.704 1.00 0.00 N ATOM 542 CA GLU A 34 35.183 35.126 16.501 1.00 0.00 C ATOM 543 C GLU A 34 36.350 34.417 15.803 1.00 0.00 C ATOM 544 O GLU A 34 37.526 34.574 16.096 1.00 0.00 O ATOM 545 CB GLU A 34 34.857 34.456 17.829 1.00 0.00 C ATOM 546 CG GLU A 34 33.874 35.186 18.749 1.00 0.00 C ATOM 547 CD GLU A 34 34.411 36.533 19.213 1.00 0.00 C ATOM 548 OE1 GLU A 34 35.630 36.718 19.440 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.525 37.376 19.477 1.00 0.00 O ATOM 0 H GLU A 34 33.555 34.191 15.533 1.00 0.00 H new ATOM 0 HA GLU A 34 35.508 36.156 16.650 1.00 0.00 H new ATOM 0 HB2 GLU A 34 34.454 33.465 17.619 1.00 0.00 H new ATOM 0 HB3 GLU A 34 35.790 34.312 18.375 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.930 35.334 18.224 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.661 34.563 19.618 1.00 0.00 H new ATOM 556 N GLY A 35 35.946 33.595 14.833 1.00 0.00 N ATOM 557 CA GLY A 35 36.947 32.884 14.047 1.00 0.00 C ATOM 558 C GLY A 35 37.059 31.411 14.441 1.00 0.00 C ATOM 559 O GLY A 35 38.078 30.846 14.061 1.00 0.00 O ATOM 0 H GLY A 35 34.975 33.411 14.582 1.00 0.00 H new ATOM 0 HA2 GLY A 35 36.693 32.956 12.989 1.00 0.00 H new ATOM 0 HA3 GLY A 35 37.916 33.366 14.176 1.00 0.00 H new ATOM 563 N ILE A 36 36.122 30.807 15.162 1.00 0.00 N ATOM 564 CA ILE A 36 36.232 29.426 15.605 1.00 0.00 C ATOM 565 C ILE A 36 35.625 28.451 14.604 1.00 0.00 C ATOM 566 O ILE A 36 34.436 28.569 14.344 1.00 0.00 O ATOM 567 CB ILE A 36 35.687 29.171 17.011 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.157 30.142 18.103 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.836 27.723 17.473 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.095 30.563 19.121 1.00 0.00 C ATOM 0 H ILE A 36 35.260 31.266 15.457 1.00 0.00 H new ATOM 0 HA ILE A 36 37.305 29.242 15.660 1.00 0.00 H new ATOM 0 HB ILE A 36 34.625 29.379 16.879 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.986 29.681 18.640 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.548 31.039 17.622 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.428 27.618 18.478 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.296 27.066 16.791 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.891 27.450 17.480 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.536 31.248 19.845 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.273 31.060 18.605 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.718 29.681 19.639 1.00 0.00 H new ATOM 582 N PRO A 37 36.332 27.462 14.040 1.00 0.00 N ATOM 583 CA PRO A 37 35.748 26.522 13.103 1.00 0.00 C ATOM 584 C PRO A 37 34.735 25.578 13.736 1.00 0.00 C ATOM 585 O PRO A 37 34.755 25.452 14.959 1.00 0.00 O ATOM 586 CB PRO A 37 36.918 25.667 12.633 1.00 0.00 C ATOM 587 CG PRO A 37 37.933 25.736 13.777 1.00 0.00 C ATOM 588 CD PRO A 37 37.694 27.110 14.388 1.00 0.00 C ATOM 0 HA PRO A 37 35.224 27.074 12.323 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.606 24.640 12.441 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.341 26.050 11.704 1.00 0.00 H new ATOM 0 HG2 PRO A 37 37.771 24.941 14.504 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.955 25.632 13.413 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.828 27.086 15.469 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.400 27.842 13.995 1.00 0.00 H new ATOM 596 N PRO A 38 33.825 24.987 12.968 1.00 0.00 N ATOM 597 CA PRO A 38 32.742 24.182 13.495 1.00 0.00 C ATOM 598 C PRO A 38 33.169 22.949 14.303 1.00 0.00 C ATOM 599 O PRO A 38 32.649 22.751 15.399 1.00 0.00 O ATOM 600 CB PRO A 38 31.950 23.583 12.336 1.00 0.00 C ATOM 601 CG PRO A 38 32.211 24.641 11.261 1.00 0.00 C ATOM 602 CD PRO A 38 33.613 25.174 11.544 1.00 0.00 C ATOM 0 HA PRO A 38 32.196 24.872 14.138 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.315 22.597 12.048 1.00 0.00 H new ATOM 0 HB3 PRO A 38 30.890 23.476 12.567 1.00 0.00 H new ATOM 0 HG2 PRO A 38 32.150 24.209 10.262 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.471 25.440 11.309 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.361 24.635 10.963 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.694 26.226 11.271 1.00 0.00 H new ATOM 610 N ASP A 39 34.206 22.250 13.851 1.00 0.00 N ATOM 611 CA ASP A 39 35.014 21.230 14.480 1.00 0.00 C ATOM 612 C ASP A 39 35.370 21.529 15.944 1.00 0.00 C ATOM 613 O ASP A 39 35.222 20.679 16.821 1.00 0.00 O ATOM 614 CB ASP A 39 36.162 20.872 13.539 1.00 0.00 C ATOM 615 CG ASP A 39 37.002 19.686 13.988 1.00 0.00 C ATOM 616 OD1 ASP A 39 36.365 18.864 14.677 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.180 19.510 13.595 1.00 0.00 O ATOM 0 H ASP A 39 34.538 22.417 12.901 1.00 0.00 H new ATOM 0 HA ASP A 39 34.433 20.318 14.615 1.00 0.00 H new ATOM 0 HB2 ASP A 39 35.752 20.657 12.552 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.811 21.741 13.432 1.00 0.00 H new ATOM 622 N GLN A 40 35.967 22.680 16.234 1.00 0.00 N ATOM 623 CA GLN A 40 36.553 23.077 17.495 1.00 0.00 C ATOM 624 C GLN A 40 35.532 23.566 18.526 1.00 0.00 C ATOM 625 O GLN A 40 35.840 23.624 19.715 1.00 0.00 O ATOM 626 CB GLN A 40 37.514 24.240 17.240 1.00 0.00 C ATOM 627 CG GLN A 40 38.445 24.620 18.393 1.00 0.00 C ATOM 628 CD GLN A 40 39.764 25.356 18.220 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.215 25.992 19.169 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.500 25.217 17.121 1.00 0.00 N ATOM 0 H GLN A 40 36.057 23.414 15.531 1.00 0.00 H new ATOM 0 HA GLN A 40 37.042 22.190 17.898 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.127 23.992 16.373 1.00 0.00 H new ATOM 0 HB3 GLN A 40 36.925 25.118 16.973 1.00 0.00 H new ATOM 0 HG2 GLN A 40 37.849 25.223 19.078 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.682 23.690 18.910 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.136 24.691 16.327 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.429 25.636 17.073 1.00 0.00 H new ATOM 639 N GLN A 41 34.298 23.836 18.109 1.00 0.00 N ATOM 640 CA GLN A 41 33.158 24.324 18.859 1.00 0.00 C ATOM 641 C GLN A 41 32.500 23.100 19.505 1.00 0.00 C ATOM 642 O GLN A 41 31.842 22.349 18.783 1.00 0.00 O ATOM 643 CB GLN A 41 32.099 24.986 17.990 1.00 0.00 C ATOM 644 CG GLN A 41 32.430 26.365 17.411 1.00 0.00 C ATOM 645 CD GLN A 41 31.430 26.715 16.319 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.228 26.504 16.417 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.905 27.366 15.260 1.00 0.00 N ATOM 0 H GLN A 41 34.052 23.701 17.128 1.00 0.00 H new ATOM 0 HA GLN A 41 33.518 25.069 19.569 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.876 24.316 17.160 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.187 25.077 18.580 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.401 27.118 18.199 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.442 26.367 17.005 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.906 27.543 15.177 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.268 27.688 14.532 1.00 0.00 H new ATOM 656 N ARG A 42 32.637 22.900 20.811 1.00 0.00 N ATOM 657 CA ARG A 42 31.992 21.833 21.551 1.00 0.00 C ATOM 658 C ARG A 42 30.986 22.490 22.501 1.00 0.00 C ATOM 659 O ARG A 42 31.330 23.512 23.080 1.00 0.00 O ATOM 660 CB ARG A 42 33.000 21.016 22.362 1.00 0.00 C ATOM 661 CG ARG A 42 34.140 20.233 21.716 1.00 0.00 C ATOM 662 CD ARG A 42 34.253 19.766 20.266 1.00 0.00 C ATOM 663 NE ARG A 42 33.185 18.795 20.025 1.00 0.00 N ATOM 664 CZ ARG A 42 32.718 18.433 18.825 1.00 0.00 C ATOM 665 NH1 ARG A 42 33.035 19.024 17.659 1.00 0.00 N ATOM 666 NH2 ARG A 42 31.900 17.368 18.733 1.00 0.00 N ATOM 0 H ARG A 42 33.219 23.497 21.398 1.00 0.00 H new ATOM 0 HA ARG A 42 31.507 21.148 20.856 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.459 21.705 23.071 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.421 20.299 22.944 1.00 0.00 H new ATOM 0 HG2 ARG A 42 35.033 20.832 21.893 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.240 19.328 22.315 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.162 20.611 19.584 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.228 19.314 20.085 1.00 0.00 H new ATOM 0 HE ARG A 42 32.760 18.357 20.842 1.00 0.00 H new ATOM 0 HH11 ARG A 42 33.680 19.814 17.647 1.00 0.00 H new ATOM 0 HH12 ARG A 42 32.631 18.682 16.787 1.00 0.00 H new ATOM 0 HH21 ARG A 42 31.643 16.848 19.572 1.00 0.00 H new ATOM 0 HH22 ARG A 42 31.537 17.081 17.824 1.00 0.00 H new ATOM 680 N LEU A 43 29.770 21.976 22.664 1.00 0.00 N ATOM 681 CA LEU A 43 28.747 22.667 23.429 1.00 0.00 C ATOM 682 C LEU A 43 28.019 21.740 24.404 1.00 0.00 C ATOM 683 O LEU A 43 27.731 20.588 24.083 1.00 0.00 O ATOM 684 CB LEU A 43 27.858 23.562 22.577 1.00 0.00 C ATOM 685 CG LEU A 43 26.953 22.852 21.566 1.00 0.00 C ATOM 686 CD1 LEU A 43 25.745 23.749 21.289 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.634 22.503 20.243 1.00 0.00 C ATOM 0 H LEU A 43 29.473 21.082 22.274 1.00 0.00 H new ATOM 0 HA LEU A 43 29.259 23.379 24.076 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.230 24.154 23.243 1.00 0.00 H new ATOM 0 HB3 LEU A 43 28.495 24.261 22.035 1.00 0.00 H new ATOM 0 HG LEU A 43 26.667 21.900 22.014 1.00 0.00 H new ATOM 0 HD11 LEU A 43 25.087 23.261 20.570 1.00 0.00 H new ATOM 0 HD12 LEU A 43 25.202 23.925 22.217 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.085 24.701 20.882 1.00 0.00 H new ATOM 0 HD21 LEU A 43 26.921 22.003 19.587 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.989 23.416 19.765 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.479 21.841 20.432 1.00 0.00 H new ATOM 699 N ILE A 44 27.927 22.234 25.641 1.00 0.00 N ATOM 700 CA ILE A 44 27.404 21.582 26.825 1.00 0.00 C ATOM 701 C ILE A 44 26.095 22.327 27.093 1.00 0.00 C ATOM 702 O ILE A 44 26.071 23.552 27.064 1.00 0.00 O ATOM 703 CB ILE A 44 28.422 21.535 27.965 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.604 20.636 27.585 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.874 21.042 29.301 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.845 21.159 28.308 1.00 0.00 C ATOM 0 H ILE A 44 28.246 23.181 25.848 1.00 0.00 H new ATOM 0 HA ILE A 44 27.203 20.518 26.703 1.00 0.00 H new ATOM 0 HB ILE A 44 28.722 22.574 28.104 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.404 19.603 27.869 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.759 20.645 26.506 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.671 21.045 30.045 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.069 21.700 29.629 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.490 20.029 29.185 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.703 20.536 28.055 1.00 0.00 H new ATOM 0 HD12 ILE A 44 31.039 22.187 28.001 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.679 21.128 29.385 1.00 0.00 H new ATOM 718 N PHE A 45 25.008 21.594 27.330 1.00 0.00 N ATOM 719 CA PHE A 45 23.702 21.979 27.825 1.00 0.00 C ATOM 720 C PHE A 45 23.179 21.103 28.958 1.00 0.00 C ATOM 721 O PHE A 45 23.578 21.455 30.064 1.00 0.00 O ATOM 722 CB PHE A 45 22.777 22.063 26.612 1.00 0.00 C ATOM 723 CG PHE A 45 21.384 22.573 26.927 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.158 23.741 27.665 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.278 21.774 26.586 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.858 24.200 27.871 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.969 22.193 26.794 1.00 0.00 C ATOM 728 CZ PHE A 45 18.770 23.407 27.465 1.00 0.00 C ATOM 0 H PHE A 45 25.035 20.590 27.154 1.00 0.00 H new ATOM 0 HA PHE A 45 23.760 22.953 28.312 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.231 22.717 25.867 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.696 21.074 26.161 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.994 24.288 28.076 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.452 20.802 26.148 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.688 25.158 28.339 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.133 21.602 26.450 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.764 23.739 27.674 1.00 0.00 H new ATOM 738 N ALA A 46 22.519 19.955 28.818 1.00 0.00 N ATOM 739 CA ALA A 46 21.832 19.162 29.817 1.00 0.00 C ATOM 740 C ALA A 46 22.567 17.884 30.232 1.00 0.00 C ATOM 741 O ALA A 46 22.017 16.777 30.201 1.00 0.00 O ATOM 742 CB ALA A 46 20.423 18.749 29.394 1.00 0.00 C ATOM 0 H ALA A 46 22.449 19.517 27.900 1.00 0.00 H new ATOM 0 HA ALA A 46 21.793 19.843 30.667 1.00 0.00 H new ATOM 0 HB1 ALA A 46 19.964 18.158 30.186 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.822 19.640 29.211 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.477 18.154 28.482 1.00 0.00 H new ATOM 748 N GLY A 47 23.813 18.066 30.661 1.00 0.00 N ATOM 749 CA GLY A 47 24.520 17.071 31.441 1.00 0.00 C ATOM 750 C GLY A 47 25.553 16.360 30.565 1.00 0.00 C ATOM 751 O GLY A 47 26.412 15.669 31.106 1.00 0.00 O ATOM 0 H GLY A 47 24.355 18.909 30.474 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.014 17.545 32.289 1.00 0.00 H new ATOM 0 HA3 GLY A 47 23.815 16.346 31.847 1.00 0.00 H new ATOM 755 N LYS A 48 25.496 16.611 29.261 1.00 0.00 N ATOM 756 CA LYS A 48 26.399 16.120 28.244 1.00 0.00 C ATOM 757 C LYS A 48 26.852 17.050 27.118 1.00 0.00 C ATOM 758 O LYS A 48 26.159 18.021 26.835 1.00 0.00 O ATOM 759 CB LYS A 48 25.846 14.774 27.746 1.00 0.00 C ATOM 760 CG LYS A 48 26.290 14.251 26.383 1.00 0.00 C ATOM 761 CD LYS A 48 26.070 12.745 26.190 1.00 0.00 C ATOM 762 CE LYS A 48 25.337 12.439 24.879 1.00 0.00 C ATOM 763 NZ LYS A 48 24.806 11.072 24.812 1.00 0.00 N ATOM 0 H LYS A 48 24.765 17.204 28.868 1.00 0.00 H new ATOM 0 HA LYS A 48 27.362 16.018 28.744 1.00 0.00 H new ATOM 0 HB2 LYS A 48 26.103 14.018 28.488 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.759 14.850 27.731 1.00 0.00 H new ATOM 0 HG2 LYS A 48 25.749 14.789 25.605 1.00 0.00 H new ATOM 0 HG3 LYS A 48 27.348 14.473 26.247 1.00 0.00 H new ATOM 0 HD2 LYS A 48 27.033 12.234 26.196 1.00 0.00 H new ATOM 0 HD3 LYS A 48 25.495 12.352 27.028 1.00 0.00 H new ATOM 0 HE2 LYS A 48 24.516 13.146 24.757 1.00 0.00 H new ATOM 0 HE3 LYS A 48 26.020 12.597 24.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 24.323 10.931 23.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 25.588 10.391 24.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.130 10.924 25.589 1.00 0.00 H new ATOM 777 N GLN A 49 27.994 16.771 26.513 1.00 0.00 N ATOM 778 CA GLN A 49 28.512 17.547 25.406 1.00 0.00 C ATOM 779 C GLN A 49 27.749 17.143 24.146 1.00 0.00 C ATOM 780 O GLN A 49 27.738 15.972 23.763 1.00 0.00 O ATOM 781 CB GLN A 49 29.959 17.123 25.125 1.00 0.00 C ATOM 782 CG GLN A 49 30.732 17.822 24.005 1.00 0.00 C ATOM 783 CD GLN A 49 30.972 17.121 22.677 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.458 17.690 21.710 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.591 15.851 22.533 1.00 0.00 N ATOM 0 H GLN A 49 28.592 15.990 26.782 1.00 0.00 H new ATOM 0 HA GLN A 49 28.427 18.607 25.646 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.525 17.254 26.047 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.952 16.056 24.904 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.210 18.754 23.787 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.709 18.091 24.408 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.182 15.349 23.321 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.709 15.382 21.635 1.00 0.00 H new ATOM 794 N LEU A 50 26.991 18.029 23.513 1.00 0.00 N ATOM 795 CA LEU A 50 26.136 17.779 22.370 1.00 0.00 C ATOM 796 C LEU A 50 26.874 17.226 21.154 1.00 0.00 C ATOM 797 O LEU A 50 27.923 17.758 20.777 1.00 0.00 O ATOM 798 CB LEU A 50 25.258 18.949 21.925 1.00 0.00 C ATOM 799 CG LEU A 50 24.367 19.630 22.975 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.433 20.677 22.364 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.443 18.615 23.648 1.00 0.00 C ATOM 0 H LEU A 50 26.958 19.005 23.808 1.00 0.00 H new ATOM 0 HA LEU A 50 25.471 17.013 22.768 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.910 19.711 21.498 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.613 18.594 21.121 1.00 0.00 H new ATOM 0 HG LEU A 50 25.061 20.092 23.677 1.00 0.00 H new ATOM 0 HD11 LEU A 50 22.827 21.127 23.150 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.024 21.451 21.875 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.782 20.200 21.631 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.823 19.122 24.387 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.805 18.149 22.897 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.042 17.849 24.141 1.00 0.00 H new ATOM 813 N GLU A 51 26.341 16.209 20.480 1.00 0.00 N ATOM 814 CA GLU A 51 26.973 15.592 19.334 1.00 0.00 C ATOM 815 C GLU A 51 26.618 16.420 18.106 1.00 0.00 C ATOM 816 O GLU A 51 25.469 16.784 17.862 1.00 0.00 O ATOM 817 CB GLU A 51 26.403 14.171 19.206 1.00 0.00 C ATOM 818 CG GLU A 51 27.149 13.222 18.266 1.00 0.00 C ATOM 819 CD GLU A 51 26.538 11.820 18.318 1.00 0.00 C ATOM 820 OE1 GLU A 51 25.420 11.645 17.788 1.00 0.00 O ATOM 821 OE2 GLU A 51 27.116 10.928 18.975 1.00 0.00 O ATOM 0 H GLU A 51 25.444 15.790 20.725 1.00 0.00 H new ATOM 0 HA GLU A 51 28.057 15.545 19.436 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.380 13.721 20.199 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.370 14.246 18.866 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.107 13.605 17.246 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.201 13.176 18.547 1.00 0.00 H new ATOM 828 N ASP A 52 27.594 16.515 17.205 1.00 0.00 N ATOM 829 CA ASP A 52 27.452 17.063 15.869 1.00 0.00 C ATOM 830 C ASP A 52 26.626 16.152 14.952 1.00 0.00 C ATOM 831 O ASP A 52 26.979 14.984 14.834 1.00 0.00 O ATOM 832 CB ASP A 52 28.798 17.419 15.245 1.00 0.00 C ATOM 833 CG ASP A 52 30.008 16.528 15.491 1.00 0.00 C ATOM 834 OD1 ASP A 52 30.439 16.529 16.670 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.502 15.736 14.662 1.00 0.00 O ATOM 0 H ASP A 52 28.543 16.197 17.400 1.00 0.00 H new ATOM 0 HA ASP A 52 26.895 17.994 15.977 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.651 17.476 14.166 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.058 18.421 15.585 1.00 0.00 H new ATOM 840 N GLY A 53 25.672 16.746 14.237 1.00 0.00 N ATOM 841 CA GLY A 53 24.912 16.094 13.196 1.00 0.00 C ATOM 842 C GLY A 53 23.436 15.982 13.545 1.00 0.00 C ATOM 843 O GLY A 53 22.547 15.728 12.741 1.00 0.00 O ATOM 0 H GLY A 53 25.407 17.721 14.377 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.022 16.651 12.265 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.319 15.098 13.021 1.00 0.00 H new ATOM 847 N ARG A 54 23.231 16.007 14.865 1.00 0.00 N ATOM 848 CA ARG A 54 21.939 15.918 15.517 1.00 0.00 C ATOM 849 C ARG A 54 21.271 17.280 15.281 1.00 0.00 C ATOM 850 O ARG A 54 21.881 18.273 14.876 1.00 0.00 O ATOM 851 CB ARG A 54 22.146 15.710 17.020 1.00 0.00 C ATOM 852 CG ARG A 54 22.840 14.384 17.297 1.00 0.00 C ATOM 853 CD ARG A 54 21.933 13.167 17.115 1.00 0.00 C ATOM 854 NE ARG A 54 21.977 12.772 15.705 1.00 0.00 N ATOM 855 CZ ARG A 54 22.928 12.359 14.863 1.00 0.00 C ATOM 856 NH1 ARG A 54 24.187 12.097 15.238 1.00 0.00 N ATOM 857 NH2 ARG A 54 22.579 12.047 13.607 1.00 0.00 N ATOM 0 H ARG A 54 24.000 16.094 15.529 1.00 0.00 H new ATOM 0 HA ARG A 54 21.339 15.093 15.133 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.742 16.528 17.425 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.183 15.734 17.530 1.00 0.00 H new ATOM 0 HG2 ARG A 54 23.700 14.288 16.634 1.00 0.00 H new ATOM 0 HG3 ARG A 54 23.224 14.391 18.317 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.266 12.346 17.751 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.912 13.406 17.411 1.00 0.00 H new ATOM 0 HE ARG A 54 21.061 12.825 15.259 1.00 0.00 H new ATOM 0 HH11 ARG A 54 24.463 12.210 16.213 1.00 0.00 H new ATOM 0 HH12 ARG A 54 24.870 11.784 14.548 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.606 12.127 13.313 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.287 11.729 12.945 1.00 0.00 H new ATOM 871 N THR A 55 19.975 17.460 15.520 1.00 0.00 N ATOM 872 CA THR A 55 19.213 18.693 15.569 1.00 0.00 C ATOM 873 C THR A 55 19.009 19.071 17.032 1.00 0.00 C ATOM 874 O THR A 55 19.244 18.293 17.949 1.00 0.00 O ATOM 875 CB THR A 55 17.900 18.456 14.819 1.00 0.00 C ATOM 876 OG1 THR A 55 16.960 17.550 15.368 1.00 0.00 O ATOM 877 CG2 THR A 55 18.088 18.064 13.349 1.00 0.00 C ATOM 0 H THR A 55 19.374 16.656 15.703 1.00 0.00 H new ATOM 0 HA THR A 55 19.726 19.526 15.089 1.00 0.00 H new ATOM 0 HB THR A 55 17.473 19.453 14.928 1.00 0.00 H new ATOM 0 HG1 THR A 55 17.416 16.721 15.624 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.113 17.913 12.885 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.620 18.859 12.826 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.665 17.141 13.289 1.00 0.00 H new ATOM 885 N LEU A 56 18.634 20.320 17.295 1.00 0.00 N ATOM 886 CA LEU A 56 18.217 20.861 18.577 1.00 0.00 C ATOM 887 C LEU A 56 17.118 20.041 19.255 1.00 0.00 C ATOM 888 O LEU A 56 17.101 19.866 20.476 1.00 0.00 O ATOM 889 CB LEU A 56 17.876 22.347 18.445 1.00 0.00 C ATOM 890 CG LEU A 56 19.087 23.152 17.982 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.619 24.220 16.986 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.851 23.724 19.173 1.00 0.00 C ATOM 0 H LEU A 56 18.614 21.029 16.562 1.00 0.00 H new ATOM 0 HA LEU A 56 19.064 20.780 19.258 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.059 22.474 17.735 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.527 22.729 19.404 1.00 0.00 H new ATOM 0 HG LEU A 56 19.798 22.506 17.466 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.476 24.802 16.648 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.147 23.737 16.130 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.901 24.880 17.472 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.709 24.293 18.815 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.194 24.379 19.746 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.196 22.909 19.809 1.00 0.00 H new ATOM 904 N SER A 57 16.213 19.526 18.437 1.00 0.00 N ATOM 905 CA SER A 57 15.132 18.671 18.904 1.00 0.00 C ATOM 906 C SER A 57 15.469 17.201 19.181 1.00 0.00 C ATOM 907 O SER A 57 14.703 16.606 19.936 1.00 0.00 O ATOM 908 CB SER A 57 14.043 18.742 17.847 1.00 0.00 C ATOM 909 OG SER A 57 12.801 18.380 18.420 1.00 0.00 O ATOM 0 H SER A 57 16.207 19.689 17.430 1.00 0.00 H new ATOM 0 HA SER A 57 14.844 19.051 19.884 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.986 19.750 17.437 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.282 18.074 17.019 1.00 0.00 H new ATOM 0 HG SER A 57 12.951 17.751 19.156 1.00 0.00 H new ATOM 915 N ASP A 58 16.565 16.641 18.688 1.00 0.00 N ATOM 916 CA ASP A 58 17.086 15.378 19.172 1.00 0.00 C ATOM 917 C ASP A 58 17.487 15.523 20.643 1.00 0.00 C ATOM 918 O ASP A 58 17.629 14.499 21.308 1.00 0.00 O ATOM 919 CB ASP A 58 18.298 14.865 18.407 1.00 0.00 C ATOM 920 CG ASP A 58 17.974 14.567 16.943 1.00 0.00 C ATOM 921 OD1 ASP A 58 17.045 13.764 16.709 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.438 15.236 15.997 1.00 0.00 O ATOM 0 H ASP A 58 17.118 17.055 17.937 1.00 0.00 H new ATOM 0 HA ASP A 58 16.283 14.655 19.029 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.097 15.605 18.457 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.671 13.960 18.886 1.00 0.00 H new ATOM 927 N TYR A 59 17.676 16.708 21.233 1.00 0.00 N ATOM 928 CA TYR A 59 18.084 17.028 22.582 1.00 0.00 C ATOM 929 C TYR A 59 17.022 17.815 23.341 1.00 0.00 C ATOM 930 O TYR A 59 17.355 18.386 24.372 1.00 0.00 O ATOM 931 CB TYR A 59 19.406 17.788 22.410 1.00 0.00 C ATOM 932 CG TYR A 59 20.631 17.076 21.913 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.113 16.000 22.667 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.271 17.409 20.716 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.130 15.188 22.144 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.417 16.700 20.335 1.00 0.00 C ATOM 937 CZ TYR A 59 22.911 15.599 21.053 1.00 0.00 C ATOM 938 OH TYR A 59 24.007 14.875 20.689 1.00 0.00 O ATOM 0 H TYR A 59 17.524 17.563 20.698 1.00 0.00 H new ATOM 0 HA TYR A 59 18.216 16.139 23.198 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.215 18.616 21.728 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.656 18.223 23.378 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.704 15.796 23.646 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.887 18.203 20.093 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.317 14.223 22.592 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.946 17.015 19.447 1.00 0.00 H new ATOM 0 HH TYR A 59 23.734 13.963 20.456 1.00 0.00 H new ATOM 948 N ASN A 60 15.826 17.990 22.772 1.00 0.00 N ATOM 949 CA ASN A 60 14.604 18.582 23.273 1.00 0.00 C ATOM 950 C ASN A 60 14.780 20.069 23.605 1.00 0.00 C ATOM 951 O ASN A 60 14.150 20.559 24.547 1.00 0.00 O ATOM 952 CB ASN A 60 14.076 17.774 24.454 1.00 0.00 C ATOM 953 CG ASN A 60 13.317 16.553 23.960 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.217 16.570 23.417 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.868 15.349 24.089 1.00 0.00 N ATOM 0 H ASN A 60 15.685 17.670 21.814 1.00 0.00 H new ATOM 0 HA ASN A 60 13.853 18.544 22.484 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.905 17.463 25.090 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.421 18.395 25.065 1.00 0.00 H new ATOM 0 HD21 ASN A 60 13.376 14.524 23.747 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.782 15.251 24.530 1.00 0.00 H new ATOM 962 N ILE A 61 15.634 20.751 22.859 1.00 0.00 N ATOM 963 CA ILE A 61 16.083 22.111 23.083 1.00 0.00 C ATOM 964 C ILE A 61 14.913 23.011 22.671 1.00 0.00 C ATOM 965 O ILE A 61 14.318 22.838 21.608 1.00 0.00 O ATOM 966 CB ILE A 61 17.424 22.429 22.416 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.508 21.612 23.123 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.757 23.915 22.437 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.859 21.649 22.386 1.00 0.00 C ATOM 0 H ILE A 61 16.058 20.340 22.027 1.00 0.00 H new ATOM 0 HA ILE A 61 16.324 22.286 24.132 1.00 0.00 H new ATOM 0 HB ILE A 61 17.365 22.158 21.362 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.641 21.993 24.136 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.176 20.578 23.213 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.718 24.079 21.950 1.00 0.00 H new ATOM 0 HG22 ILE A 61 16.982 24.469 21.907 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.809 24.262 23.469 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.589 21.052 22.934 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.737 21.242 21.382 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.209 22.679 22.320 1.00 0.00 H new ATOM 981 N GLN A 62 14.564 23.977 23.520 1.00 0.00 N ATOM 982 CA GLN A 62 13.497 24.948 23.358 1.00 0.00 C ATOM 983 C GLN A 62 14.002 26.381 23.551 1.00 0.00 C ATOM 984 O GLN A 62 15.140 26.563 23.994 1.00 0.00 O ATOM 985 CB GLN A 62 12.446 24.676 24.427 1.00 0.00 C ATOM 986 CG GLN A 62 12.144 23.202 24.694 1.00 0.00 C ATOM 987 CD GLN A 62 10.973 22.993 25.653 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.906 21.963 26.320 1.00 0.00 O ATOM 989 NE2 GLN A 62 9.989 23.874 25.781 1.00 0.00 N ATOM 0 H GLN A 62 15.060 24.106 24.402 1.00 0.00 H new ATOM 0 HA GLN A 62 13.094 24.853 22.349 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.774 25.136 25.359 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.520 25.171 24.135 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.925 22.706 23.749 1.00 0.00 H new ATOM 0 HG3 GLN A 62 13.033 22.724 25.106 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.008 24.741 25.245 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.214 23.684 26.416 1.00 0.00 H new ATOM 998 N LYS A 63 13.167 27.326 23.132 1.00 0.00 N ATOM 999 CA LYS A 63 13.273 28.767 23.147 1.00 0.00 C ATOM 1000 C LYS A 63 13.718 29.308 24.510 1.00 0.00 C ATOM 1001 O LYS A 63 13.214 28.845 25.533 1.00 0.00 O ATOM 1002 CB LYS A 63 12.018 29.401 22.550 1.00 0.00 C ATOM 1003 CG LYS A 63 10.690 29.123 23.261 1.00 0.00 C ATOM 1004 CD LYS A 63 9.644 30.177 22.916 1.00 0.00 C ATOM 1005 CE LYS A 63 8.188 29.865 23.249 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.249 30.932 22.864 1.00 0.00 N ATOM 0 H LYS A 63 12.277 27.050 22.717 1.00 0.00 H new ATOM 0 HA LYS A 63 14.086 29.075 22.490 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.166 30.480 22.520 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.926 29.063 21.518 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.323 28.137 22.977 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.849 29.105 24.339 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.915 31.100 23.429 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.708 30.376 21.846 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.900 28.942 22.747 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.100 29.686 24.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.281 30.651 23.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.498 31.810 23.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.304 31.089 21.837 1.00 0.00 H new ATOM 1020 N GLU A 64 14.623 30.278 24.550 1.00 0.00 N ATOM 1021 CA GLU A 64 14.948 31.107 25.695 1.00 0.00 C ATOM 1022 C GLU A 64 15.969 30.364 26.556 1.00 0.00 C ATOM 1023 O GLU A 64 16.267 30.812 27.658 1.00 0.00 O ATOM 1024 CB GLU A 64 13.682 31.525 26.445 1.00 0.00 C ATOM 1025 CG GLU A 64 13.781 32.888 27.154 1.00 0.00 C ATOM 1026 CD GLU A 64 12.965 33.966 26.454 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.203 34.137 25.237 1.00 0.00 O ATOM 1028 OE2 GLU A 64 11.968 34.382 27.083 1.00 0.00 O ATOM 0 H GLU A 64 15.182 30.518 23.731 1.00 0.00 H new ATOM 0 HA GLU A 64 15.406 32.044 25.379 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.851 31.556 25.740 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.444 30.761 27.185 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.436 32.785 28.183 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.825 33.197 27.197 1.00 0.00 H new ATOM 1035 N SER A 65 16.455 29.201 26.143 1.00 0.00 N ATOM 1036 CA SER A 65 17.498 28.461 26.835 1.00 0.00 C ATOM 1037 C SER A 65 18.925 28.895 26.522 1.00 0.00 C ATOM 1038 O SER A 65 19.206 29.334 25.413 1.00 0.00 O ATOM 1039 CB SER A 65 17.441 26.982 26.460 1.00 0.00 C ATOM 1040 OG SER A 65 16.152 26.496 26.720 1.00 0.00 O ATOM 0 H SER A 65 16.126 28.736 25.297 1.00 0.00 H new ATOM 0 HA SER A 65 17.292 28.660 27.887 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.688 26.851 25.406 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.178 26.419 27.033 1.00 0.00 H new ATOM 0 HG SER A 65 15.645 26.450 25.883 1.00 0.00 H new ATOM 1046 N THR A 66 19.835 28.897 27.498 1.00 0.00 N ATOM 1047 CA THR A 66 21.245 29.238 27.521 1.00 0.00 C ATOM 1048 C THR A 66 22.152 28.012 27.404 1.00 0.00 C ATOM 1049 O THR A 66 22.004 27.042 28.150 1.00 0.00 O ATOM 1050 CB THR A 66 21.545 30.017 28.810 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.712 31.144 28.918 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.965 30.582 28.736 1.00 0.00 C ATOM 0 H THR A 66 19.543 28.613 28.433 1.00 0.00 H new ATOM 0 HA THR A 66 21.459 29.856 26.649 1.00 0.00 H new ATOM 0 HB THR A 66 21.401 29.333 29.646 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.918 31.625 29.747 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.184 31.136 29.649 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.677 29.764 28.629 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.047 31.249 27.878 1.00 0.00 H new ATOM 1060 N LEU A 67 23.122 28.025 26.494 1.00 0.00 N ATOM 1061 CA LEU A 67 23.903 26.866 26.144 1.00 0.00 C ATOM 1062 C LEU A 67 25.371 27.304 26.228 1.00 0.00 C ATOM 1063 O LEU A 67 25.665 28.468 26.000 1.00 0.00 O ATOM 1064 CB LEU A 67 23.567 26.405 24.730 1.00 0.00 C ATOM 1065 CG LEU A 67 22.161 25.998 24.276 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.357 27.227 23.860 1.00 0.00 C ATOM 1067 CD2 LEU A 67 21.937 24.786 23.378 1.00 0.00 C ATOM 0 H LEU A 67 23.384 28.863 25.975 1.00 0.00 H new ATOM 0 HA LEU A 67 23.697 26.030 26.812 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.882 27.209 24.064 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.213 25.551 24.526 1.00 0.00 H new ATOM 0 HG LEU A 67 21.767 25.552 25.189 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.361 26.919 23.541 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.272 27.910 24.706 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.863 27.731 23.036 1.00 0.00 H new ATOM 0 HD21 LEU A 67 20.872 24.675 23.176 1.00 0.00 H new ATOM 0 HD22 LEU A 67 22.472 24.925 22.439 1.00 0.00 H new ATOM 0 HD23 LEU A 67 22.307 23.890 23.877 1.00 0.00 H new ATOM 1079 N HIS A 68 26.273 26.435 26.686 1.00 0.00 N ATOM 1080 CA HIS A 68 27.586 26.777 27.198 1.00 0.00 C ATOM 1081 C HIS A 68 28.499 26.116 26.169 1.00 0.00 C ATOM 1082 O HIS A 68 28.903 24.952 26.211 1.00 0.00 O ATOM 1083 CB HIS A 68 27.776 26.149 28.581 1.00 0.00 C ATOM 1084 CG HIS A 68 28.939 26.554 29.448 1.00 0.00 C ATOM 1085 ND1 HIS A 68 29.464 25.602 30.312 1.00 0.00 N ATOM 1086 CD2 HIS A 68 29.465 27.787 29.693 1.00 0.00 C ATOM 1087 CE1 HIS A 68 30.359 26.306 31.015 1.00 0.00 C ATOM 1088 NE2 HIS A 68 30.392 27.612 30.699 1.00 0.00 N ATOM 0 H HIS A 68 26.093 25.431 26.708 1.00 0.00 H new ATOM 0 HA HIS A 68 27.767 27.845 27.320 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.867 26.342 29.150 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.840 25.070 28.439 1.00 0.00 H new ATOM 0 HD1 HIS A 68 29.227 24.613 30.391 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.208 28.713 29.200 1.00 0.00 H new ATOM 0 HE1 HIS A 68 30.996 25.865 31.767 1.00 0.00 H new ATOM 1096 N LEU A 69 29.024 26.971 25.297 1.00 0.00 N ATOM 1097 CA LEU A 69 30.125 26.767 24.370 1.00 0.00 C ATOM 1098 C LEU A 69 31.430 26.688 25.169 1.00 0.00 C ATOM 1099 O LEU A 69 31.598 27.359 26.189 1.00 0.00 O ATOM 1100 CB LEU A 69 30.208 28.013 23.489 1.00 0.00 C ATOM 1101 CG LEU A 69 31.144 28.033 22.277 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.911 26.894 21.283 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.156 29.318 21.453 1.00 0.00 C ATOM 0 H LEU A 69 28.650 27.916 25.216 1.00 0.00 H new ATOM 0 HA LEU A 69 29.976 25.859 23.785 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.202 28.220 23.125 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.492 28.846 24.132 1.00 0.00 H new ATOM 0 HG LEU A 69 32.104 27.926 22.783 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.615 26.983 20.456 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.059 25.938 21.784 1.00 0.00 H new ATOM 0 HD13 LEU A 69 29.892 26.948 20.900 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.855 29.212 20.624 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.156 29.509 21.063 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.465 30.152 22.084 1.00 0.00 H new ATOM 1115 N VAL A 70 32.320 25.829 24.670 1.00 0.00 N ATOM 1116 CA VAL A 70 33.705 25.614 25.021 1.00 0.00 C ATOM 1117 C VAL A 70 34.431 25.240 23.730 1.00 0.00 C ATOM 1118 O VAL A 70 33.867 24.786 22.744 1.00 0.00 O ATOM 1119 CB VAL A 70 33.865 24.574 26.130 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.508 25.117 27.514 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.205 23.216 25.912 1.00 0.00 C ATOM 0 H VAL A 70 32.042 25.196 23.920 1.00 0.00 H new ATOM 0 HA VAL A 70 34.146 26.517 25.443 1.00 0.00 H new ATOM 0 HB VAL A 70 34.935 24.372 26.079 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.642 24.332 28.258 1.00 0.00 H new ATOM 0 HG12 VAL A 70 34.158 25.959 27.753 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.469 25.448 27.518 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.397 22.576 26.773 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.130 23.349 25.791 1.00 0.00 H new ATOM 0 HG23 VAL A 70 33.616 22.751 25.016 1.00 0.00 H new ATOM 1131 N LEU A 71 35.739 25.477 23.723 1.00 0.00 N ATOM 1132 CA LEU A 71 36.537 25.198 22.549 1.00 0.00 C ATOM 1133 C LEU A 71 37.415 23.965 22.825 1.00 0.00 C ATOM 1134 O LEU A 71 38.117 23.773 23.816 1.00 0.00 O ATOM 1135 CB LEU A 71 37.588 26.285 22.341 1.00 0.00 C ATOM 1136 CG LEU A 71 37.120 27.737 22.296 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.267 28.747 22.250 1.00 0.00 C ATOM 1138 CD2 LEU A 71 36.037 28.029 21.254 1.00 0.00 C ATOM 0 H LEU A 71 36.259 25.858 24.513 1.00 0.00 H new ATOM 0 HA LEU A 71 35.845 25.097 21.713 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.323 26.196 23.141 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.107 26.073 21.406 1.00 0.00 H new ATOM 0 HG LEU A 71 36.627 27.878 23.258 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.861 29.758 22.219 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.889 28.632 23.138 1.00 0.00 H new ATOM 0 HD13 LEU A 71 38.871 28.572 21.360 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.768 29.084 21.295 1.00 0.00 H new ATOM 0 HD22 LEU A 71 36.414 27.789 20.260 1.00 0.00 H new ATOM 0 HD23 LEU A 71 35.157 27.421 21.464 1.00 0.00 H new