USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 709 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 38 SER OG : rot -170:sc= 0.205 USER MOD Set 1.2: A 40 SER OG : rot 180:sc= 0.0265 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= 0 (180deg=-0.152) USER MOD Single : A 4 ASN : amide:sc= -0.355 K(o=-0.36,f=-6.3!) USER MOD Single : A 5 LYS NZ :NH3+ 167:sc= -0.0156 (180deg=-0.19) USER MOD Single : A 6 ASN : amide:sc= -0.976 K(o=-0.98,f=-1.7!) USER MOD Single : A 8 TYR OH : rot 180:sc=-0.000367 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl -129:sc= -0.0134 (180deg=-0.999) USER MOD Single : A 15 LYS NZ :NH3+ -177:sc= 0.356 (180deg=0.351) USER MOD Single : A 17 ASN : amide:sc= -0.476 K(o=-0.48,f=-3.9!) USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 19 CYS SG : rot -169:sc= 0.993 USER MOD Single : A 20 THR OG1 : rot -140:sc= -1.86 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.0327 USER MOD Single : A 24 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0456) USER MOD Single : A 25 SER OG : rot 180:sc= -0.753 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot -52:sc= -1.24 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot -42:sc= 0.0886 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 66:sc= 1.07 USER MOD Single : A 36 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.105) USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -67:sc= 0.629 USER MOD Single : A 47 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0127) USER MOD Single : A 48 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0245) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.546 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -0.0139 (180deg=-0.202) USER MOD Single : A 61 GLN : amide:sc= 0.0834 K(o=0.083,f=-1.8!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -143:sc= 1.2 (180deg=-0.462) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.269 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -142:sc= 1.22 USER MOD Single : A 72 ASN : amide:sc= 0.163 K(o=0.16,f=-2!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.279 30.226 23.456 1.00 0.00 N1+ ATOM 2 CA MET A 1 19.928 31.183 24.501 1.00 0.00 C ATOM 3 C MET A 1 19.904 30.538 25.889 1.00 0.00 C ATOM 4 O MET A 1 20.679 30.923 26.765 1.00 0.00 O ATOM 5 CB MET A 1 18.577 31.838 24.198 1.00 0.00 C ATOM 6 CG MET A 1 18.561 32.661 22.920 1.00 0.00 C ATOM 7 SD MET A 1 16.972 33.461 22.628 1.00 0.00 S ATOM 8 CE MET A 1 17.321 34.369 21.125 1.00 0.00 C ATOM 0 H1 MET A 1 20.466 30.734 22.568 1.00 0.00 H new ATOM 0 H2 MET A 1 21.130 29.699 23.739 1.00 0.00 H new ATOM 0 H3 MET A 1 19.492 29.561 23.315 1.00 0.00 H new ATOM 0 HA MET A 1 20.703 31.949 24.509 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.816 31.061 24.127 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.300 32.480 25.035 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.341 33.420 22.972 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.799 32.016 22.074 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.431 34.917 20.816 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.136 35.071 21.305 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.609 33.672 20.338 1.00 0.00 H new ATOM 20 N ALA A 2 19.023 29.560 26.094 1.00 0.00 N ATOM 21 CA ALA A 2 18.924 28.891 27.384 1.00 0.00 C ATOM 22 C ALA A 2 20.219 28.132 27.692 1.00 0.00 C ATOM 23 O ALA A 2 20.825 27.550 26.793 1.00 0.00 O ATOM 24 CB ALA A 2 17.740 27.938 27.393 1.00 0.00 C ATOM 0 H ALA A 2 18.373 29.217 25.387 1.00 0.00 H new ATOM 0 HA ALA A 2 18.771 29.645 28.156 1.00 0.00 H new ATOM 0 HB1 ALA A 2 17.677 27.445 28.363 1.00 0.00 H new ATOM 0 HB2 ALA A 2 16.822 28.497 27.210 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.870 27.189 26.612 1.00 0.00 H new ATOM 30 N VAL A 3 20.643 28.137 28.955 1.00 0.00 N ATOM 31 CA VAL A 3 21.865 27.450 29.354 1.00 0.00 C ATOM 32 C VAL A 3 21.701 25.930 29.283 1.00 0.00 C ATOM 33 O VAL A 3 20.608 25.410 29.507 1.00 0.00 O ATOM 34 CB VAL A 3 22.280 27.837 30.785 1.00 0.00 C ATOM 35 CG1 VAL A 3 22.662 29.308 30.847 1.00 0.00 C ATOM 36 CG2 VAL A 3 21.157 27.528 31.764 1.00 0.00 C ATOM 0 H VAL A 3 20.157 28.610 29.717 1.00 0.00 H new ATOM 0 HA VAL A 3 22.641 27.760 28.654 1.00 0.00 H new ATOM 0 HB VAL A 3 23.151 27.246 31.068 1.00 0.00 H new ATOM 0 HG11 VAL A 3 22.953 29.566 31.865 1.00 0.00 H new ATOM 0 HG12 VAL A 3 23.497 29.496 30.172 1.00 0.00 H new ATOM 0 HG13 VAL A 3 21.810 29.918 30.548 1.00 0.00 H new ATOM 0 HG21 VAL A 3 21.466 27.807 32.771 1.00 0.00 H new ATOM 0 HG22 VAL A 3 20.267 28.093 31.487 1.00 0.00 H new ATOM 0 HG23 VAL A 3 20.933 26.462 31.736 1.00 0.00 H new ATOM 46 N ASN A 4 22.790 25.224 28.975 1.00 0.00 N ATOM 47 CA ASN A 4 22.753 23.765 28.866 1.00 0.00 C ATOM 48 C ASN A 4 23.953 23.064 29.541 1.00 0.00 C ATOM 49 O ASN A 4 25.052 23.616 29.595 1.00 0.00 O ATOM 50 CB ASN A 4 22.684 23.363 27.390 1.00 0.00 C ATOM 51 CG ASN A 4 22.185 21.944 27.192 1.00 0.00 C ATOM 52 OD1 ASN A 4 21.954 21.215 28.156 1.00 0.00 O ATOM 53 ND2 ASN A 4 22.015 21.547 25.936 1.00 0.00 N ATOM 0 H ASN A 4 23.705 25.637 28.797 1.00 0.00 H new ATOM 0 HA ASN A 4 21.861 23.434 29.399 1.00 0.00 H new ATOM 0 HB2 ASN A 4 22.026 24.052 26.860 1.00 0.00 H new ATOM 0 HB3 ASN A 4 23.674 23.461 26.944 1.00 0.00 H new ATOM 0 HD21 ASN A 4 21.680 20.604 25.740 1.00 0.00 H new ATOM 0 HD22 ASN A 4 22.219 22.186 25.167 1.00 0.00 H new ATOM 60 N LYS A 5 23.727 21.849 30.047 1.00 0.00 N ATOM 61 CA LYS A 5 24.752 21.033 30.709 1.00 0.00 C ATOM 62 C LYS A 5 25.866 20.554 29.771 1.00 0.00 C ATOM 63 O LYS A 5 26.998 20.323 30.197 1.00 0.00 O ATOM 64 CB LYS A 5 24.102 19.828 31.391 1.00 0.00 C ATOM 65 CG LYS A 5 23.262 20.190 32.604 1.00 0.00 C ATOM 66 CD LYS A 5 24.073 20.984 33.616 1.00 0.00 C ATOM 67 CE LYS A 5 23.249 21.326 34.846 1.00 0.00 C ATOM 68 NZ LYS A 5 22.826 20.108 35.590 1.00 0.00 N1+ ATOM 0 H LYS A 5 22.814 21.396 30.009 1.00 0.00 H new ATOM 0 HA LYS A 5 25.225 21.683 31.445 1.00 0.00 H new ATOM 0 HB2 LYS A 5 23.474 19.308 30.668 1.00 0.00 H new ATOM 0 HB3 LYS A 5 24.882 19.130 31.696 1.00 0.00 H new ATOM 0 HG2 LYS A 5 22.396 20.773 32.290 1.00 0.00 H new ATOM 0 HG3 LYS A 5 22.882 19.281 33.071 1.00 0.00 H new ATOM 0 HD2 LYS A 5 24.950 20.409 33.913 1.00 0.00 H new ATOM 0 HD3 LYS A 5 24.436 21.902 33.153 1.00 0.00 H new ATOM 0 HE2 LYS A 5 23.832 21.969 35.505 1.00 0.00 H new ATOM 0 HE3 LYS A 5 22.367 21.892 34.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 22.463 20.381 36.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 22.079 19.618 35.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 23.641 19.472 35.707 1.00 0.00 H new ATOM 82 N ASN A 6 25.525 20.410 28.497 1.00 0.00 N ATOM 83 CA ASN A 6 26.434 19.914 27.458 1.00 0.00 C ATOM 84 C ASN A 6 27.444 20.905 26.825 1.00 0.00 C ATOM 85 O ASN A 6 28.619 20.571 26.680 1.00 0.00 O ATOM 86 CB ASN A 6 25.600 19.271 26.348 1.00 0.00 C ATOM 87 CG ASN A 6 26.455 18.682 25.243 1.00 0.00 C ATOM 88 OD1 ASN A 6 27.676 18.593 25.368 1.00 0.00 O ATOM 89 ND2 ASN A 6 25.815 18.276 24.153 1.00 0.00 N ATOM 0 H ASN A 6 24.595 20.637 28.145 1.00 0.00 H new ATOM 0 HA ASN A 6 27.078 19.215 27.992 1.00 0.00 H new ATOM 0 HB2 ASN A 6 24.975 18.487 26.776 1.00 0.00 H new ATOM 0 HB3 ASN A 6 24.929 20.018 25.924 1.00 0.00 H new ATOM 0 HD21 ASN A 6 26.337 17.871 23.376 1.00 0.00 H new ATOM 0 HD22 ASN A 6 24.801 18.369 24.093 1.00 0.00 H new ATOM 96 N GLU A 7 26.997 22.111 26.451 1.00 0.00 N ATOM 97 CA GLU A 7 27.888 23.104 25.839 1.00 0.00 C ATOM 98 C GLU A 7 28.306 24.149 26.861 1.00 0.00 C ATOM 99 O GLU A 7 29.478 24.502 26.987 1.00 0.00 O ATOM 100 CB GLU A 7 27.198 23.782 24.654 1.00 0.00 C ATOM 101 CG GLU A 7 26.865 22.840 23.508 1.00 0.00 C ATOM 102 CD GLU A 7 26.774 23.556 22.175 1.00 0.00 C ATOM 103 OE1 GLU A 7 27.755 23.505 21.403 1.00 0.00 O ATOM 104 OE2 GLU A 7 25.722 24.169 21.897 1.00 0.00 O ATOM 0 H GLU A 7 26.031 22.421 26.560 1.00 0.00 H new ATOM 0 HA GLU A 7 28.779 22.588 25.481 1.00 0.00 H new ATOM 0 HB2 GLU A 7 26.278 24.252 25.003 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.841 24.579 24.280 1.00 0.00 H new ATOM 0 HG2 GLU A 7 27.627 22.063 23.448 1.00 0.00 H new ATOM 0 HG3 GLU A 7 25.918 22.342 23.715 1.00 0.00 H new ATOM 111 N TYR A 8 27.307 24.630 27.585 1.00 0.00 N ATOM 112 CA TYR A 8 27.508 25.616 28.659 1.00 0.00 C ATOM 113 C TYR A 8 28.305 25.033 29.827 1.00 0.00 C ATOM 114 O TYR A 8 28.898 25.802 30.571 1.00 0.00 O ATOM 115 CB TYR A 8 26.177 26.253 29.105 1.00 0.00 C ATOM 116 CG TYR A 8 26.303 27.666 29.621 1.00 0.00 C ATOM 117 CD1 TYR A 8 26.608 27.885 30.976 1.00 0.00 C ATOM 118 CD2 TYR A 8 26.121 28.756 28.747 1.00 0.00 C ATOM 119 CE1 TYR A 8 26.795 29.197 31.451 1.00 0.00 C ATOM 120 CE2 TYR A 8 26.282 30.070 29.225 1.00 0.00 C ATOM 121 CZ TYR A 8 26.643 30.290 30.569 1.00 0.00 C ATOM 122 OH TYR A 8 26.862 31.559 30.998 1.00 0.00 O ATOM 0 H TYR A 8 26.334 24.355 27.453 1.00 0.00 H new ATOM 0 HA TYR A 8 28.115 26.424 28.250 1.00 0.00 H new ATOM 0 HB2 TYR A 8 25.485 26.247 28.263 1.00 0.00 H new ATOM 0 HB3 TYR A 8 25.735 25.633 29.885 1.00 0.00 H new ATOM 0 HD1 TYR A 8 26.699 27.047 31.652 1.00 0.00 H new ATOM 0 HD2 TYR A 8 25.859 28.584 27.714 1.00 0.00 H new ATOM 0 HE1 TYR A 8 27.054 29.367 32.486 1.00 0.00 H new ATOM 0 HE2 TYR A 8 26.129 30.909 28.562 1.00 0.00 H new ATOM 0 HH TYR A 8 26.712 32.185 30.259 1.00 0.00 H new ATOM 132 N LYS A 9 28.479 23.718 29.908 1.00 0.00 N ATOM 133 CA LYS A 9 29.436 23.070 30.824 1.00 0.00 C ATOM 134 C LYS A 9 30.836 23.696 30.712 1.00 0.00 C ATOM 135 O LYS A 9 31.467 23.928 31.737 1.00 0.00 O ATOM 136 CB LYS A 9 29.467 21.548 30.565 1.00 0.00 C ATOM 137 CG LYS A 9 30.839 20.895 30.820 1.00 0.00 C ATOM 138 CD LYS A 9 30.834 19.468 31.390 1.00 0.00 C ATOM 139 CE LYS A 9 32.200 19.055 31.962 1.00 0.00 C ATOM 140 NZ LYS A 9 32.169 17.687 32.539 1.00 0.00 N1+ ATOM 0 H LYS A 9 27.956 23.055 29.335 1.00 0.00 H new ATOM 0 HA LYS A 9 29.101 23.235 31.848 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.724 21.067 31.201 1.00 0.00 H new ATOM 0 HB3 LYS A 9 29.173 21.360 29.532 1.00 0.00 H new ATOM 0 HG2 LYS A 9 31.389 20.883 29.879 1.00 0.00 H new ATOM 0 HG3 LYS A 9 31.396 21.533 31.506 1.00 0.00 H new ATOM 0 HD2 LYS A 9 30.080 19.396 32.173 1.00 0.00 H new ATOM 0 HD3 LYS A 9 30.546 18.768 30.605 1.00 0.00 H new ATOM 0 HE2 LYS A 9 32.952 19.100 31.174 1.00 0.00 H new ATOM 0 HE3 LYS A 9 32.502 19.766 32.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 33.109 17.447 32.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.470 17.650 33.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 31.906 17.004 31.800 1.00 0.00 H new ATOM 154 N ILE A 10 31.272 24.063 29.527 1.00 0.00 N ATOM 155 CA ILE A 10 32.525 24.813 29.297 1.00 0.00 C ATOM 156 C ILE A 10 32.517 26.163 30.033 1.00 0.00 C ATOM 157 O ILE A 10 33.439 26.467 30.787 1.00 0.00 O ATOM 158 CB ILE A 10 32.736 25.007 27.782 1.00 0.00 C ATOM 159 CG1 ILE A 10 33.075 23.653 27.125 1.00 0.00 C ATOM 160 CG2 ILE A 10 33.828 26.048 27.467 1.00 0.00 C ATOM 161 CD1 ILE A 10 32.739 23.619 25.636 1.00 0.00 C ATOM 0 H ILE A 10 30.767 23.852 28.666 1.00 0.00 H new ATOM 0 HA ILE A 10 33.357 24.236 29.702 1.00 0.00 H new ATOM 0 HB ILE A 10 31.805 25.393 27.367 1.00 0.00 H new ATOM 0 HG12 ILE A 10 34.137 23.445 27.258 1.00 0.00 H new ATOM 0 HG13 ILE A 10 32.528 22.860 27.635 1.00 0.00 H new ATOM 0 HG21 ILE A 10 33.936 26.146 26.387 1.00 0.00 H new ATOM 0 HG22 ILE A 10 33.546 27.011 27.892 1.00 0.00 H new ATOM 0 HG23 ILE A 10 34.775 25.724 27.899 1.00 0.00 H new ATOM 0 HD11 ILE A 10 32.999 22.643 25.227 1.00 0.00 H new ATOM 0 HD12 ILE A 10 31.672 23.798 25.499 1.00 0.00 H new ATOM 0 HD13 ILE A 10 33.306 24.392 25.117 1.00 0.00 H new ATOM 173 N LEU A 11 31.442 26.941 29.883 1.00 0.00 N ATOM 174 CA LEU A 11 31.209 28.198 30.607 1.00 0.00 C ATOM 175 C LEU A 11 30.911 27.994 32.113 1.00 0.00 C ATOM 176 O LEU A 11 30.778 28.970 32.848 1.00 0.00 O ATOM 177 CB LEU A 11 30.118 29.014 29.875 1.00 0.00 C ATOM 178 CG LEU A 11 30.560 29.615 28.522 1.00 0.00 C ATOM 179 CD1 LEU A 11 29.368 30.213 27.777 1.00 0.00 C ATOM 180 CD2 LEU A 11 31.593 30.729 28.707 1.00 0.00 C ATOM 0 H LEU A 11 30.687 26.709 29.237 1.00 0.00 H new ATOM 0 HA LEU A 11 32.135 28.774 30.599 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.254 28.371 29.707 1.00 0.00 H new ATOM 0 HB3 LEU A 11 29.790 29.824 30.527 1.00 0.00 H new ATOM 0 HG LEU A 11 30.999 28.796 27.952 1.00 0.00 H new ATOM 0 HD11 LEU A 11 29.704 30.630 26.828 1.00 0.00 H new ATOM 0 HD12 LEU A 11 28.628 29.435 27.590 1.00 0.00 H new ATOM 0 HD13 LEU A 11 28.920 31.002 28.381 1.00 0.00 H new ATOM 0 HD21 LEU A 11 31.879 31.126 27.733 1.00 0.00 H new ATOM 0 HD22 LEU A 11 31.163 31.527 29.312 1.00 0.00 H new ATOM 0 HD23 LEU A 11 32.474 30.328 29.208 1.00 0.00 H new ATOM 192 N ILE A 12 30.881 26.748 32.605 1.00 0.00 N ATOM 193 CA ILE A 12 30.884 26.402 34.040 1.00 0.00 C ATOM 194 C ILE A 12 32.288 25.968 34.521 1.00 0.00 C ATOM 195 O ILE A 12 32.671 26.275 35.648 1.00 0.00 O ATOM 196 CB ILE A 12 29.779 25.372 34.372 1.00 0.00 C ATOM 197 CG1 ILE A 12 28.377 25.824 33.898 1.00 0.00 C ATOM 198 CG2 ILE A 12 29.721 25.075 35.881 1.00 0.00 C ATOM 199 CD1 ILE A 12 27.829 27.113 34.524 1.00 0.00 C ATOM 0 H ILE A 12 30.853 25.926 32.001 1.00 0.00 H new ATOM 0 HA ILE A 12 30.642 27.303 34.604 1.00 0.00 H new ATOM 0 HB ILE A 12 30.050 24.467 33.828 1.00 0.00 H new ATOM 0 HG12 ILE A 12 28.408 25.956 32.816 1.00 0.00 H new ATOM 0 HG13 ILE A 12 27.671 25.018 34.101 1.00 0.00 H new ATOM 0 HG21 ILE A 12 28.934 24.348 36.079 1.00 0.00 H new ATOM 0 HG22 ILE A 12 30.679 24.671 36.209 1.00 0.00 H new ATOM 0 HG23 ILE A 12 29.509 25.995 36.425 1.00 0.00 H new ATOM 0 HD11 ILE A 12 26.842 27.326 34.113 1.00 0.00 H new ATOM 0 HD12 ILE A 12 27.754 26.989 35.604 1.00 0.00 H new ATOM 0 HD13 ILE A 12 28.502 27.941 34.300 1.00 0.00 H new ATOM 211 N MET A 13 33.113 25.366 33.654 1.00 0.00 N ATOM 212 CA MET A 13 34.517 24.999 33.935 1.00 0.00 C ATOM 213 C MET A 13 35.456 26.185 34.220 1.00 0.00 C ATOM 214 O MET A 13 36.584 25.980 34.663 1.00 0.00 O ATOM 215 CB MET A 13 35.083 24.139 32.794 1.00 0.00 C ATOM 216 CG MET A 13 34.438 22.755 32.645 1.00 0.00 C ATOM 217 SD MET A 13 34.837 21.538 33.929 1.00 0.00 S ATOM 218 CE MET A 13 33.510 21.781 35.145 1.00 0.00 C ATOM 0 H MET A 13 32.819 25.112 32.711 1.00 0.00 H new ATOM 0 HA MET A 13 34.482 24.429 34.863 1.00 0.00 H new ATOM 0 HB2 MET A 13 34.964 24.682 31.856 1.00 0.00 H new ATOM 0 HB3 MET A 13 36.153 24.009 32.953 1.00 0.00 H new ATOM 0 HG2 MET A 13 33.356 22.883 32.620 1.00 0.00 H new ATOM 0 HG3 MET A 13 34.733 22.343 31.680 1.00 0.00 H new ATOM 0 HE1 MET A 13 33.944 21.909 36.137 1.00 0.00 H new ATOM 0 HE2 MET A 13 32.935 22.669 34.883 1.00 0.00 H new ATOM 0 HE3 MET A 13 32.854 20.911 35.146 1.00 0.00 H new ATOM 228 N LEU A 14 35.004 27.413 34.042 1.00 0.00 N ATOM 229 CA LEU A 14 35.651 28.641 34.530 1.00 0.00 C ATOM 230 C LEU A 14 34.923 29.297 35.718 1.00 0.00 C ATOM 231 O LEU A 14 35.570 29.914 36.562 1.00 0.00 O ATOM 232 CB LEU A 14 35.870 29.637 33.374 1.00 0.00 C ATOM 233 CG LEU A 14 34.679 29.922 32.431 1.00 0.00 C ATOM 234 CD1 LEU A 14 33.665 30.866 33.077 1.00 0.00 C ATOM 235 CD2 LEU A 14 35.152 30.577 31.154 1.00 0.00 C ATOM 0 H LEU A 14 34.140 27.602 33.533 1.00 0.00 H new ATOM 0 HA LEU A 14 36.623 28.341 34.921 1.00 0.00 H new ATOM 0 HB2 LEU A 14 36.190 30.586 33.806 1.00 0.00 H new ATOM 0 HB3 LEU A 14 36.697 29.268 32.767 1.00 0.00 H new ATOM 0 HG LEU A 14 34.212 28.959 32.223 1.00 0.00 H new ATOM 0 HD11 LEU A 14 32.842 31.044 32.385 1.00 0.00 H new ATOM 0 HD12 LEU A 14 33.280 30.415 33.992 1.00 0.00 H new ATOM 0 HD13 LEU A 14 34.150 31.813 33.315 1.00 0.00 H new ATOM 0 HD21 LEU A 14 34.297 30.769 30.505 1.00 0.00 H new ATOM 0 HD22 LEU A 14 35.647 31.519 31.390 1.00 0.00 H new ATOM 0 HD23 LEU A 14 35.854 29.916 30.644 1.00 0.00 H new ATOM 247 N LYS A 15 33.593 29.136 35.791 1.00 0.00 N ATOM 248 CA LYS A 15 32.677 29.738 36.781 1.00 0.00 C ATOM 249 C LYS A 15 33.068 29.453 38.229 1.00 0.00 C ATOM 250 O LYS A 15 32.986 30.349 39.064 1.00 0.00 O ATOM 251 CB LYS A 15 31.255 29.221 36.475 1.00 0.00 C ATOM 252 CG LYS A 15 30.139 29.766 37.378 1.00 0.00 C ATOM 253 CD LYS A 15 29.806 28.784 38.493 1.00 0.00 C ATOM 254 CE LYS A 15 28.833 29.372 39.513 1.00 0.00 C ATOM 255 NZ LYS A 15 28.176 28.316 40.317 1.00 0.00 N1+ ATOM 0 H LYS A 15 33.095 28.548 35.123 1.00 0.00 H new ATOM 0 HA LYS A 15 32.729 30.823 36.688 1.00 0.00 H new ATOM 0 HB2 LYS A 15 31.013 29.468 35.441 1.00 0.00 H new ATOM 0 HB3 LYS A 15 31.260 28.134 36.551 1.00 0.00 H new ATOM 0 HG2 LYS A 15 30.448 30.718 37.809 1.00 0.00 H new ATOM 0 HG3 LYS A 15 29.247 29.960 36.782 1.00 0.00 H new ATOM 0 HD2 LYS A 15 29.374 27.881 38.062 1.00 0.00 H new ATOM 0 HD3 LYS A 15 30.725 28.488 38.999 1.00 0.00 H new ATOM 0 HE2 LYS A 15 29.368 30.053 40.175 1.00 0.00 H new ATOM 0 HE3 LYS A 15 28.075 29.960 38.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 27.486 28.750 40.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 27.687 27.651 39.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 28.893 27.804 40.870 1.00 0.00 H new ATOM 269 N GLU A 16 33.488 28.221 38.509 1.00 0.00 N ATOM 270 CA GLU A 16 33.949 27.770 39.832 1.00 0.00 C ATOM 271 C GLU A 16 35.466 27.939 40.043 1.00 0.00 C ATOM 272 O GLU A 16 35.978 27.603 41.109 1.00 0.00 O ATOM 273 CB GLU A 16 33.574 26.285 40.019 1.00 0.00 C ATOM 274 CG GLU A 16 32.068 25.982 40.047 1.00 0.00 C ATOM 275 CD GLU A 16 31.389 26.545 41.304 1.00 0.00 C ATOM 276 OE1 GLU A 16 31.334 25.827 42.325 1.00 0.00 O ATOM 277 OE2 GLU A 16 30.926 27.712 41.281 1.00 0.00 O ATOM 0 H GLU A 16 33.520 27.483 37.805 1.00 0.00 H new ATOM 0 HA GLU A 16 33.455 28.400 40.571 1.00 0.00 H new ATOM 0 HB2 GLU A 16 34.028 25.709 39.212 1.00 0.00 H new ATOM 0 HB3 GLU A 16 34.016 25.931 40.951 1.00 0.00 H new ATOM 0 HG2 GLU A 16 31.597 26.406 39.160 1.00 0.00 H new ATOM 0 HG3 GLU A 16 31.915 24.904 40.005 1.00 0.00 H new ATOM 284 N ASN A 17 36.183 28.202 38.953 1.00 0.00 N ATOM 285 CA ASN A 17 37.642 28.290 38.998 1.00 0.00 C ATOM 286 C ASN A 17 38.265 29.646 38.693 1.00 0.00 C ATOM 287 O ASN A 17 39.479 29.726 38.521 1.00 0.00 O ATOM 288 CB ASN A 17 38.243 27.249 38.048 1.00 0.00 C ATOM 289 CG ASN A 17 37.826 25.833 38.395 1.00 0.00 C ATOM 290 OD1 ASN A 17 37.095 25.608 39.359 1.00 0.00 O ATOM 291 ND2 ASN A 17 38.288 24.870 37.606 1.00 0.00 N ATOM 0 H ASN A 17 35.779 28.358 38.029 1.00 0.00 H new ATOM 0 HA ASN A 17 37.884 28.105 40.045 1.00 0.00 H new ATOM 0 HB2 ASN A 17 37.936 27.474 37.027 1.00 0.00 H new ATOM 0 HB3 ASN A 17 39.330 27.321 38.077 1.00 0.00 H new ATOM 0 HD21 ASN A 17 38.039 23.898 37.789 1.00 0.00 H new ATOM 0 HD22 ASN A 17 38.892 25.102 36.817 1.00 0.00 H new ATOM 298 N GLN A 18 37.444 30.683 38.567 1.00 0.00 N ATOM 299 CA GLN A 18 37.931 32.038 38.290 1.00 0.00 C ATOM 300 C GLN A 18 38.892 32.104 37.085 1.00 0.00 C ATOM 301 O GLN A 18 39.968 32.697 37.159 1.00 0.00 O ATOM 302 CB GLN A 18 38.481 32.731 39.562 1.00 0.00 C ATOM 303 CG GLN A 18 39.708 32.123 40.229 1.00 0.00 C ATOM 304 CD GLN A 18 40.142 32.894 41.459 1.00 0.00 C ATOM 305 OE1 GLN A 18 39.362 33.647 42.042 1.00 0.00 O ATOM 306 NE2 GLN A 18 41.394 32.710 41.862 1.00 0.00 N ATOM 0 H GLN A 18 36.430 30.614 38.652 1.00 0.00 H new ATOM 0 HA GLN A 18 37.063 32.621 37.983 1.00 0.00 H new ATOM 0 HB2 GLN A 18 38.717 33.764 39.305 1.00 0.00 H new ATOM 0 HB3 GLN A 18 37.679 32.761 40.300 1.00 0.00 H new ATOM 0 HG2 GLN A 18 39.492 31.092 40.508 1.00 0.00 H new ATOM 0 HG3 GLN A 18 40.530 32.094 39.513 1.00 0.00 H new ATOM 0 HE21 GLN A 18 42.007 32.076 41.349 1.00 0.00 H new ATOM 0 HE22 GLN A 18 41.743 33.202 42.684 1.00 0.00 H new ATOM 315 N CYS A 19 38.511 31.462 35.991 1.00 0.00 N ATOM 316 CA CYS A 19 39.341 31.452 34.795 1.00 0.00 C ATOM 317 C CYS A 19 38.870 32.480 33.770 1.00 0.00 C ATOM 318 O CYS A 19 39.339 32.479 32.632 1.00 0.00 O ATOM 319 CB CYS A 19 39.343 30.058 34.165 1.00 0.00 C ATOM 320 SG CYS A 19 40.005 28.762 35.238 1.00 0.00 S ATOM 0 H CYS A 19 37.637 30.943 35.906 1.00 0.00 H new ATOM 0 HA CYS A 19 40.354 31.718 35.097 1.00 0.00 H new ATOM 0 HB2 CYS A 19 38.323 29.796 33.885 1.00 0.00 H new ATOM 0 HB3 CYS A 19 39.928 30.088 33.246 1.00 0.00 H new ATOM 0 HG CYS A 19 40.189 27.677 34.545 1.00 0.00 H new ATOM 326 N THR A 20 37.947 33.355 34.161 1.00 0.00 N ATOM 327 CA THR A 20 37.400 34.317 33.215 1.00 0.00 C ATOM 328 C THR A 20 37.538 35.817 33.499 1.00 0.00 C ATOM 329 O THR A 20 37.353 36.302 34.615 1.00 0.00 O ATOM 330 CB THR A 20 35.898 34.044 32.992 1.00 0.00 C ATOM 331 OG1 THR A 20 35.368 34.997 32.062 1.00 0.00 O ATOM 332 CG2 THR A 20 35.135 34.141 34.305 1.00 0.00 C ATOM 0 H THR A 20 37.570 33.417 35.107 1.00 0.00 H new ATOM 0 HA THR A 20 38.037 34.140 32.349 1.00 0.00 H new ATOM 0 HB THR A 20 35.784 33.036 32.593 1.00 0.00 H new ATOM 0 HG1 THR A 20 34.475 35.277 32.354 1.00 0.00 H new ATOM 0 HG21 THR A 20 34.078 33.945 34.127 1.00 0.00 H new ATOM 0 HG22 THR A 20 35.526 33.406 35.008 1.00 0.00 H new ATOM 0 HG23 THR A 20 35.254 35.141 34.722 1.00 0.00 H new ATOM 340 N THR A 21 38.083 36.502 32.506 1.00 0.00 N ATOM 341 CA THR A 21 38.247 37.949 32.532 1.00 0.00 C ATOM 342 C THR A 21 38.785 38.388 31.172 1.00 0.00 C ATOM 343 O THR A 21 39.198 37.554 30.363 1.00 0.00 O ATOM 344 CB THR A 21 39.143 38.434 33.695 1.00 0.00 C ATOM 345 OG1 THR A 21 39.090 39.863 33.785 1.00 0.00 O ATOM 346 CG2 THR A 21 40.583 37.997 33.510 1.00 0.00 C ATOM 0 H THR A 21 38.428 36.066 31.651 1.00 0.00 H new ATOM 0 HA THR A 21 37.278 38.413 32.717 1.00 0.00 H new ATOM 0 HB THR A 21 38.765 37.986 34.614 1.00 0.00 H new ATOM 0 HG1 THR A 21 39.658 40.165 34.524 1.00 0.00 H new ATOM 0 HG21 THR A 21 41.183 38.356 34.346 1.00 0.00 H new ATOM 0 HG22 THR A 21 40.631 36.909 33.470 1.00 0.00 H new ATOM 0 HG23 THR A 21 40.972 38.412 32.580 1.00 0.00 H new ATOM 354 N GLU A 22 38.791 39.690 30.909 1.00 0.00 N ATOM 355 CA GLU A 22 39.334 40.190 29.651 1.00 0.00 C ATOM 356 C GLU A 22 40.831 39.877 29.575 1.00 0.00 C ATOM 357 O GLU A 22 41.346 39.478 28.531 1.00 0.00 O ATOM 358 CB GLU A 22 39.106 41.698 29.534 1.00 0.00 C ATOM 359 CG GLU A 22 37.645 42.094 29.400 1.00 0.00 C ATOM 360 CD GLU A 22 37.450 43.597 29.359 1.00 0.00 C ATOM 361 OE1 GLU A 22 38.425 44.332 29.624 1.00 0.00 O ATOM 362 OE2 GLU A 22 36.322 44.044 29.063 1.00 0.00 O ATOM 0 H GLU A 22 38.432 40.408 31.538 1.00 0.00 H new ATOM 0 HA GLU A 22 38.822 39.698 28.824 1.00 0.00 H new ATOM 0 HB2 GLU A 22 39.525 42.188 30.413 1.00 0.00 H new ATOM 0 HB3 GLU A 22 39.654 42.072 28.669 1.00 0.00 H new ATOM 0 HG2 GLU A 22 37.235 41.653 28.491 1.00 0.00 H new ATOM 0 HG3 GLU A 22 37.082 41.681 30.237 1.00 0.00 H new ATOM 369 N LEU A 23 41.514 40.067 30.701 1.00 0.00 N ATOM 370 CA LEU A 23 42.947 39.823 30.826 1.00 0.00 C ATOM 371 C LEU A 23 43.389 38.367 30.640 1.00 0.00 C ATOM 372 O LEU A 23 44.431 38.115 30.035 1.00 0.00 O ATOM 373 CB LEU A 23 43.432 40.316 32.192 1.00 0.00 C ATOM 374 CG LEU A 23 43.084 41.765 32.535 1.00 0.00 C ATOM 375 CD1 LEU A 23 43.520 42.096 33.954 1.00 0.00 C ATOM 376 CD2 LEU A 23 43.720 42.721 31.538 1.00 0.00 C ATOM 0 H LEU A 23 41.081 40.399 31.563 1.00 0.00 H new ATOM 0 HA LEU A 23 43.400 40.376 30.003 1.00 0.00 H new ATOM 0 HB2 LEU A 23 43.012 39.669 32.962 1.00 0.00 H new ATOM 0 HB3 LEU A 23 44.515 40.202 32.236 1.00 0.00 H new ATOM 0 HG LEU A 23 42.002 41.883 32.473 1.00 0.00 H new ATOM 0 HD11 LEU A 23 43.265 43.131 34.181 1.00 0.00 H new ATOM 0 HD12 LEU A 23 43.011 41.434 34.655 1.00 0.00 H new ATOM 0 HD13 LEU A 23 44.598 41.960 34.045 1.00 0.00 H new ATOM 0 HD21 LEU A 23 43.460 43.746 31.800 1.00 0.00 H new ATOM 0 HD22 LEU A 23 44.803 42.604 31.562 1.00 0.00 H new ATOM 0 HD23 LEU A 23 43.353 42.499 30.536 1.00 0.00 H new ATOM 388 N LYS A 24 42.617 37.410 31.153 1.00 0.00 N ATOM 389 CA LYS A 24 43.031 36.006 31.067 1.00 0.00 C ATOM 390 C LYS A 24 42.306 35.135 30.037 1.00 0.00 C ATOM 391 O LYS A 24 41.086 34.973 30.045 1.00 0.00 O ATOM 392 CB LYS A 24 42.950 35.339 32.446 1.00 0.00 C ATOM 393 CG LYS A 24 43.920 35.913 33.467 1.00 0.00 C ATOM 394 CD LYS A 24 43.804 35.223 34.817 1.00 0.00 C ATOM 395 CE LYS A 24 44.739 35.828 35.853 1.00 0.00 C ATOM 396 NZ LYS A 24 46.176 35.674 35.492 1.00 0.00 N1+ ATOM 0 H LYS A 24 41.725 37.571 31.621 1.00 0.00 H new ATOM 0 HA LYS A 24 44.058 36.064 30.705 1.00 0.00 H new ATOM 0 HB2 LYS A 24 41.934 35.440 32.828 1.00 0.00 H new ATOM 0 HB3 LYS A 24 43.144 34.272 32.335 1.00 0.00 H new ATOM 0 HG2 LYS A 24 44.939 35.811 33.095 1.00 0.00 H new ATOM 0 HG3 LYS A 24 43.730 36.979 33.588 1.00 0.00 H new ATOM 0 HD2 LYS A 24 42.776 35.294 35.172 1.00 0.00 H new ATOM 0 HD3 LYS A 24 44.029 34.163 34.702 1.00 0.00 H new ATOM 0 HE2 LYS A 24 44.509 36.887 35.969 1.00 0.00 H new ATOM 0 HE3 LYS A 24 44.559 35.356 36.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 46.769 35.995 36.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 46.378 34.674 35.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 46.385 36.245 34.648 1.00 0.00 H new ATOM 410 N SER A 25 43.133 34.589 29.155 1.00 0.00 N ATOM 411 CA SER A 25 42.730 33.688 28.067 1.00 0.00 C ATOM 412 C SER A 25 42.961 32.216 28.447 1.00 0.00 C ATOM 413 O SER A 25 44.096 31.806 28.717 1.00 0.00 O ATOM 414 CB SER A 25 43.461 34.051 26.765 1.00 0.00 C ATOM 415 OG SER A 25 43.111 35.333 26.262 1.00 0.00 O ATOM 0 H SER A 25 44.138 34.763 29.172 1.00 0.00 H new ATOM 0 HA SER A 25 41.660 33.816 27.900 1.00 0.00 H new ATOM 0 HB2 SER A 25 44.536 34.018 26.939 1.00 0.00 H new ATOM 0 HB3 SER A 25 43.237 33.298 26.009 1.00 0.00 H new ATOM 0 HG SER A 25 43.608 35.507 25.436 1.00 0.00 H new ATOM 421 N PHE A 26 41.882 31.429 28.459 1.00 0.00 N ATOM 422 CA PHE A 26 41.955 30.005 28.806 1.00 0.00 C ATOM 423 C PHE A 26 42.382 29.183 27.592 1.00 0.00 C ATOM 424 O PHE A 26 41.776 29.270 26.524 1.00 0.00 O ATOM 425 CB PHE A 26 40.604 29.512 29.325 1.00 0.00 C ATOM 426 CG PHE A 26 40.709 28.610 30.522 1.00 0.00 C ATOM 427 CD1 PHE A 26 41.945 28.290 31.058 1.00 0.00 C ATOM 428 CD2 PHE A 26 39.572 28.080 31.109 1.00 0.00 C ATOM 429 CE1 PHE A 26 42.046 27.460 32.159 1.00 0.00 C ATOM 430 CE2 PHE A 26 39.665 27.250 32.209 1.00 0.00 C ATOM 431 CZ PHE A 26 40.904 26.939 32.735 1.00 0.00 C ATOM 0 H PHE A 26 40.943 31.755 28.231 1.00 0.00 H new ATOM 0 HA PHE A 26 42.699 29.880 29.593 1.00 0.00 H new ATOM 0 HB2 PHE A 26 39.988 30.373 29.583 1.00 0.00 H new ATOM 0 HB3 PHE A 26 40.089 28.980 28.525 1.00 0.00 H new ATOM 0 HD1 PHE A 26 42.841 28.694 30.610 1.00 0.00 H new ATOM 0 HD2 PHE A 26 38.601 28.319 30.702 1.00 0.00 H new ATOM 0 HE1 PHE A 26 43.016 27.219 32.568 1.00 0.00 H new ATOM 0 HE2 PHE A 26 38.770 26.845 32.657 1.00 0.00 H new ATOM 0 HZ PHE A 26 40.979 26.290 33.595 1.00 0.00 H new ATOM 441 N THR A 27 43.432 28.388 27.770 1.00 0.00 N ATOM 442 CA THR A 27 43.990 27.595 26.652 1.00 0.00 C ATOM 443 C THR A 27 43.212 26.303 26.361 1.00 0.00 C ATOM 444 O THR A 27 42.666 25.663 27.261 1.00 0.00 O ATOM 445 CB THR A 27 45.471 27.247 26.877 1.00 0.00 C ATOM 446 OG1 THR A 27 45.669 26.604 28.111 1.00 0.00 O ATOM 447 CG2 THR A 27 46.384 28.468 26.810 1.00 0.00 C ATOM 0 H THR A 27 43.916 28.268 28.660 1.00 0.00 H new ATOM 0 HA THR A 27 43.893 28.244 25.782 1.00 0.00 H new ATOM 0 HB THR A 27 45.736 26.573 26.062 1.00 0.00 H new ATOM 0 HG1 THR A 27 46.620 26.395 28.222 1.00 0.00 H new ATOM 0 HG21 THR A 27 47.416 28.160 26.976 1.00 0.00 H new ATOM 0 HG22 THR A 27 46.298 28.933 25.828 1.00 0.00 H new ATOM 0 HG23 THR A 27 46.091 29.184 27.578 1.00 0.00 H new ATOM 455 N TYR A 28 43.203 25.871 25.105 1.00 0.00 N ATOM 456 CA TYR A 28 42.429 24.685 24.732 1.00 0.00 C ATOM 457 C TYR A 28 42.831 23.368 25.413 1.00 0.00 C ATOM 458 O TYR A 28 41.961 22.611 25.845 1.00 0.00 O ATOM 459 CB TYR A 28 42.483 24.495 23.214 1.00 0.00 C ATOM 460 CG TYR A 28 41.368 25.194 22.471 1.00 0.00 C ATOM 461 CD1 TYR A 28 41.608 25.834 21.263 1.00 0.00 C ATOM 462 CD2 TYR A 28 40.076 25.215 22.977 1.00 0.00 C ATOM 463 CE1 TYR A 28 40.592 26.475 20.579 1.00 0.00 C ATOM 464 CE2 TYR A 28 39.053 25.853 22.301 1.00 0.00 C ATOM 465 CZ TYR A 28 39.317 26.481 21.103 1.00 0.00 C ATOM 466 OH TYR A 28 38.302 27.118 20.426 1.00 0.00 O ATOM 0 H TYR A 28 43.711 26.312 24.338 1.00 0.00 H new ATOM 0 HA TYR A 28 41.421 24.895 25.091 1.00 0.00 H new ATOM 0 HB2 TYR A 28 43.440 24.864 22.845 1.00 0.00 H new ATOM 0 HB3 TYR A 28 42.444 23.429 22.989 1.00 0.00 H new ATOM 0 HD1 TYR A 28 42.606 25.831 20.850 1.00 0.00 H new ATOM 0 HD2 TYR A 28 39.866 24.724 23.916 1.00 0.00 H new ATOM 0 HE1 TYR A 28 40.796 26.968 19.640 1.00 0.00 H new ATOM 0 HE2 TYR A 28 38.053 25.859 22.709 1.00 0.00 H new ATOM 0 HH TYR A 28 38.578 28.033 20.209 1.00 0.00 H new ATOM 476 N THR A 29 44.126 23.088 25.512 1.00 0.00 N ATOM 477 CA THR A 29 44.568 21.828 26.145 1.00 0.00 C ATOM 478 C THR A 29 44.072 21.725 27.589 1.00 0.00 C ATOM 479 O THR A 29 43.553 20.690 28.004 1.00 0.00 O ATOM 480 CB THR A 29 46.105 21.695 26.131 1.00 0.00 C ATOM 481 OG1 THR A 29 46.612 21.959 24.843 1.00 0.00 O ATOM 482 CG2 THR A 29 46.570 20.295 26.533 1.00 0.00 C ATOM 0 H THR A 29 44.878 23.690 25.176 1.00 0.00 H new ATOM 0 HA THR A 29 44.136 21.018 25.558 1.00 0.00 H new ATOM 0 HB THR A 29 46.480 22.419 26.855 1.00 0.00 H new ATOM 0 HG1 THR A 29 47.588 21.872 24.852 1.00 0.00 H new ATOM 0 HG21 THR A 29 47.659 20.252 26.508 1.00 0.00 H new ATOM 0 HG22 THR A 29 46.221 20.071 27.541 1.00 0.00 H new ATOM 0 HG23 THR A 29 46.162 19.562 25.837 1.00 0.00 H new ATOM 490 N LYS A 30 44.160 22.828 28.345 1.00 0.00 N ATOM 491 CA LYS A 30 43.632 22.913 29.708 1.00 0.00 C ATOM 492 C LYS A 30 42.108 22.756 29.723 1.00 0.00 C ATOM 493 O LYS A 30 41.591 21.928 30.474 1.00 0.00 O ATOM 494 CB LYS A 30 44.087 24.249 30.317 1.00 0.00 C ATOM 495 CG LYS A 30 43.692 24.426 31.787 1.00 0.00 C ATOM 496 CD LYS A 30 44.473 23.525 32.751 1.00 0.00 C ATOM 497 CE LYS A 30 44.002 23.804 34.180 1.00 0.00 C ATOM 498 NZ LYS A 30 44.930 23.254 35.188 1.00 0.00 N1+ ATOM 0 H LYS A 30 44.602 23.689 28.024 1.00 0.00 H new ATOM 0 HA LYS A 30 44.022 22.095 30.314 1.00 0.00 H new ATOM 0 HB2 LYS A 30 45.171 24.327 30.230 1.00 0.00 H new ATOM 0 HB3 LYS A 30 43.661 25.066 29.735 1.00 0.00 H new ATOM 0 HG2 LYS A 30 43.846 25.467 32.072 1.00 0.00 H new ATOM 0 HG3 LYS A 30 42.627 24.220 31.895 1.00 0.00 H new ATOM 0 HD2 LYS A 30 44.314 22.476 32.500 1.00 0.00 H new ATOM 0 HD3 LYS A 30 45.543 23.716 32.662 1.00 0.00 H new ATOM 0 HE2 LYS A 30 43.905 24.880 34.326 1.00 0.00 H new ATOM 0 HE3 LYS A 30 43.012 23.372 34.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 44.572 23.466 36.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 45.003 22.224 35.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 45.869 23.685 35.067 1.00 0.00 H new ATOM 512 N LEU A 31 41.399 23.506 28.872 1.00 0.00 N ATOM 513 CA LEU A 31 39.937 23.476 28.790 1.00 0.00 C ATOM 514 C LEU A 31 39.389 22.107 28.377 1.00 0.00 C ATOM 515 O LEU A 31 38.396 21.672 28.958 1.00 0.00 O ATOM 516 CB LEU A 31 39.432 24.555 27.807 1.00 0.00 C ATOM 517 CG LEU A 31 39.052 25.885 28.481 1.00 0.00 C ATOM 518 CD1 LEU A 31 38.768 26.936 27.407 1.00 0.00 C ATOM 519 CD2 LEU A 31 37.788 25.731 29.336 1.00 0.00 C ATOM 0 H LEU A 31 41.830 24.157 28.215 1.00 0.00 H new ATOM 0 HA LEU A 31 39.567 23.683 29.794 1.00 0.00 H new ATOM 0 HB2 LEU A 31 40.205 24.744 27.062 1.00 0.00 H new ATOM 0 HB3 LEU A 31 38.564 24.168 27.274 1.00 0.00 H new ATOM 0 HG LEU A 31 39.884 26.188 29.117 1.00 0.00 H new ATOM 0 HD11 LEU A 31 38.499 27.879 27.883 1.00 0.00 H new ATOM 0 HD12 LEU A 31 39.658 27.080 26.794 1.00 0.00 H new ATOM 0 HD13 LEU A 31 37.945 26.599 26.777 1.00 0.00 H new ATOM 0 HD21 LEU A 31 37.544 26.687 29.800 1.00 0.00 H new ATOM 0 HD22 LEU A 31 36.959 25.411 28.705 1.00 0.00 H new ATOM 0 HD23 LEU A 31 37.962 24.985 30.112 1.00 0.00 H new ATOM 531 N CYS A 32 39.988 21.421 27.400 1.00 0.00 N ATOM 532 CA CYS A 32 39.486 20.125 26.934 1.00 0.00 C ATOM 533 C CYS A 32 39.668 19.041 28.015 1.00 0.00 C ATOM 534 O CYS A 32 38.715 18.323 28.330 1.00 0.00 O ATOM 535 CB CYS A 32 40.099 19.795 25.556 1.00 0.00 C ATOM 536 SG CYS A 32 41.754 19.051 25.624 1.00 0.00 S ATOM 0 H CYS A 32 40.825 21.743 26.914 1.00 0.00 H new ATOM 0 HA CYS A 32 38.408 20.166 26.775 1.00 0.00 H new ATOM 0 HB2 CYS A 32 39.430 19.114 25.029 1.00 0.00 H new ATOM 0 HB3 CYS A 32 40.151 20.711 24.967 1.00 0.00 H new ATOM 0 HG CYS A 32 42.466 19.659 26.525 1.00 0.00 H new ATOM 542 N ASN A 33 40.834 19.033 28.679 1.00 0.00 N ATOM 543 CA ASN A 33 41.183 18.125 29.770 1.00 0.00 C ATOM 544 C ASN A 33 40.214 18.244 30.958 1.00 0.00 C ATOM 545 O ASN A 33 39.614 17.252 31.355 1.00 0.00 O ATOM 546 CB ASN A 33 42.644 18.416 30.163 1.00 0.00 C ATOM 547 CG ASN A 33 43.229 17.401 31.132 1.00 0.00 C ATOM 548 OD1 ASN A 33 43.346 16.221 30.834 1.00 0.00 O ATOM 549 ND2 ASN A 33 43.662 17.813 32.302 1.00 0.00 N ATOM 0 H ASN A 33 41.585 19.686 28.458 1.00 0.00 H new ATOM 0 HA ASN A 33 41.090 17.090 29.442 1.00 0.00 H new ATOM 0 HB2 ASN A 33 43.256 18.439 29.261 1.00 0.00 H new ATOM 0 HB3 ASN A 33 42.700 19.408 30.612 1.00 0.00 H new ATOM 0 HD21 ASN A 33 44.090 17.151 32.949 1.00 0.00 H new ATOM 0 HD22 ASN A 33 43.570 18.795 32.563 1.00 0.00 H new ATOM 556 N ILE A 34 39.982 19.456 31.485 1.00 0.00 N ATOM 557 CA ILE A 34 39.000 19.653 32.573 1.00 0.00 C ATOM 558 C ILE A 34 37.552 19.423 32.107 1.00 0.00 C ATOM 559 O ILE A 34 36.687 19.077 32.910 1.00 0.00 O ATOM 560 CB ILE A 34 39.159 21.031 33.258 1.00 0.00 C ATOM 561 CG1 ILE A 34 38.682 22.188 32.351 1.00 0.00 C ATOM 562 CG2 ILE A 34 40.599 21.230 33.769 1.00 0.00 C ATOM 563 CD1 ILE A 34 38.948 23.583 32.920 1.00 0.00 C ATOM 0 H ILE A 34 40.453 20.309 31.182 1.00 0.00 H new ATOM 0 HA ILE A 34 39.219 18.890 33.320 1.00 0.00 H new ATOM 0 HB ILE A 34 38.505 21.047 34.130 1.00 0.00 H new ATOM 0 HG12 ILE A 34 39.176 22.103 31.383 1.00 0.00 H new ATOM 0 HG13 ILE A 34 37.612 22.078 32.174 1.00 0.00 H new ATOM 0 HG21 ILE A 34 40.684 22.206 34.246 1.00 0.00 H new ATOM 0 HG22 ILE A 34 40.840 20.450 34.492 1.00 0.00 H new ATOM 0 HG23 ILE A 34 41.294 21.174 32.931 1.00 0.00 H new ATOM 0 HD11 ILE A 34 38.583 24.336 32.222 1.00 0.00 H new ATOM 0 HD12 ILE A 34 38.432 23.692 33.874 1.00 0.00 H new ATOM 0 HD13 ILE A 34 40.019 23.716 33.070 1.00 0.00 H new ATOM 575 N SER A 35 37.335 19.507 30.797 1.00 0.00 N ATOM 576 CA SER A 35 36.019 19.261 30.209 1.00 0.00 C ATOM 577 C SER A 35 35.761 17.774 29.882 1.00 0.00 C ATOM 578 O SER A 35 34.652 17.422 29.471 1.00 0.00 O ATOM 579 CB SER A 35 35.847 20.100 28.940 1.00 0.00 C ATOM 580 OG SER A 35 35.952 21.484 29.226 1.00 0.00 O ATOM 0 H SER A 35 38.058 19.745 30.118 1.00 0.00 H new ATOM 0 HA SER A 35 35.287 19.552 30.962 1.00 0.00 H new ATOM 0 HB2 SER A 35 36.604 19.818 28.208 1.00 0.00 H new ATOM 0 HB3 SER A 35 34.876 19.891 28.491 1.00 0.00 H new ATOM 0 HG SER A 35 36.866 21.690 29.514 1.00 0.00 H new ATOM 586 N LYS A 36 36.792 16.933 30.025 1.00 0.00 N ATOM 587 CA LYS A 36 36.727 15.479 29.765 1.00 0.00 C ATOM 588 C LYS A 36 36.274 15.145 28.338 1.00 0.00 C ATOM 589 O LYS A 36 35.567 14.165 28.102 1.00 0.00 O ATOM 590 CB LYS A 36 35.851 14.757 30.800 1.00 0.00 C ATOM 591 CG LYS A 36 36.353 14.880 32.229 1.00 0.00 C ATOM 592 CD LYS A 36 35.413 14.199 33.211 1.00 0.00 C ATOM 593 CE LYS A 36 35.240 12.724 32.885 1.00 0.00 C ATOM 594 NZ LYS A 36 36.525 11.977 32.968 1.00 0.00 N1+ ATOM 0 H LYS A 36 37.714 17.244 30.330 1.00 0.00 H new ATOM 0 HA LYS A 36 37.748 15.111 29.865 1.00 0.00 H new ATOM 0 HB2 LYS A 36 34.838 15.157 30.746 1.00 0.00 H new ATOM 0 HB3 LYS A 36 35.791 13.701 30.537 1.00 0.00 H new ATOM 0 HG2 LYS A 36 37.345 14.436 32.306 1.00 0.00 H new ATOM 0 HG3 LYS A 36 36.454 15.933 32.491 1.00 0.00 H new ATOM 0 HD2 LYS A 36 35.803 14.306 34.223 1.00 0.00 H new ATOM 0 HD3 LYS A 36 34.442 14.694 33.190 1.00 0.00 H new ATOM 0 HE2 LYS A 36 34.520 12.283 33.574 1.00 0.00 H new ATOM 0 HE3 LYS A 36 34.826 12.621 31.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 36.339 10.957 32.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 37.151 12.276 32.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 36.984 12.176 33.880 1.00 0.00 H new ATOM 608 N LEU A 37 36.700 15.984 27.403 1.00 0.00 N ATOM 609 CA LEU A 37 36.378 15.840 25.982 1.00 0.00 C ATOM 610 C LEU A 37 37.502 16.304 25.040 1.00 0.00 C ATOM 611 O LEU A 37 38.485 16.905 25.472 1.00 0.00 O ATOM 612 CB LEU A 37 35.012 16.512 25.755 1.00 0.00 C ATOM 613 CG LEU A 37 34.879 18.012 26.088 1.00 0.00 C ATOM 614 CD1 LEU A 37 35.706 18.934 25.192 1.00 0.00 C ATOM 615 CD2 LEU A 37 33.420 18.447 25.975 1.00 0.00 C ATOM 0 H LEU A 37 37.285 16.794 27.608 1.00 0.00 H new ATOM 0 HA LEU A 37 36.298 14.786 25.717 1.00 0.00 H new ATOM 0 HB2 LEU A 37 34.744 16.377 24.707 1.00 0.00 H new ATOM 0 HB3 LEU A 37 34.272 15.972 26.345 1.00 0.00 H new ATOM 0 HG LEU A 37 35.260 18.110 27.104 1.00 0.00 H new ATOM 0 HD11 LEU A 37 35.553 19.970 25.496 1.00 0.00 H new ATOM 0 HD12 LEU A 37 36.762 18.681 25.285 1.00 0.00 H new ATOM 0 HD13 LEU A 37 35.393 18.810 24.155 1.00 0.00 H new ATOM 0 HD21 LEU A 37 33.337 19.508 26.212 1.00 0.00 H new ATOM 0 HD22 LEU A 37 33.066 18.274 24.959 1.00 0.00 H new ATOM 0 HD23 LEU A 37 32.813 17.871 26.673 1.00 0.00 H new ATOM 627 N SER A 38 37.383 15.981 23.747 1.00 0.00 N ATOM 628 CA SER A 38 38.441 16.243 22.762 1.00 0.00 C ATOM 629 C SER A 38 38.671 17.741 22.519 1.00 0.00 C ATOM 630 O SER A 38 37.752 18.563 22.615 1.00 0.00 O ATOM 631 CB SER A 38 38.150 15.518 21.437 1.00 0.00 C ATOM 632 OG SER A 38 39.197 15.770 20.517 1.00 0.00 O ATOM 0 H SER A 38 36.555 15.533 23.354 1.00 0.00 H new ATOM 0 HA SER A 38 39.364 15.847 23.186 1.00 0.00 H new ATOM 0 HB2 SER A 38 38.055 14.446 21.611 1.00 0.00 H new ATOM 0 HB3 SER A 38 37.200 15.859 21.025 1.00 0.00 H new ATOM 0 HG SER A 38 38.939 15.443 19.630 1.00 0.00 H new ATOM 638 N MET A 39 39.893 18.095 22.105 1.00 0.00 N ATOM 639 CA MET A 39 40.187 19.413 21.535 1.00 0.00 C ATOM 640 C MET A 39 39.315 19.699 20.295 1.00 0.00 C ATOM 641 O MET A 39 38.896 20.836 20.095 1.00 0.00 O ATOM 642 CB MET A 39 41.693 19.548 21.253 1.00 0.00 C ATOM 643 CG MET A 39 42.207 18.741 20.053 1.00 0.00 C ATOM 644 SD MET A 39 44.014 18.774 19.874 1.00 0.00 S ATOM 645 CE MET A 39 44.471 17.460 21.040 1.00 0.00 C ATOM 0 H MET A 39 40.703 17.477 22.156 1.00 0.00 H new ATOM 0 HA MET A 39 39.926 20.178 22.266 1.00 0.00 H new ATOM 0 HB2 MET A 39 41.923 20.601 21.088 1.00 0.00 H new ATOM 0 HB3 MET A 39 42.242 19.237 22.142 1.00 0.00 H new ATOM 0 HG2 MET A 39 41.879 17.706 20.155 1.00 0.00 H new ATOM 0 HG3 MET A 39 41.753 19.131 19.142 1.00 0.00 H new ATOM 0 HE1 MET A 39 45.555 17.347 21.054 1.00 0.00 H new ATOM 0 HE2 MET A 39 44.120 17.721 22.038 1.00 0.00 H new ATOM 0 HE3 MET A 39 44.012 16.521 20.728 1.00 0.00 H new ATOM 655 N SER A 40 38.945 18.661 19.530 1.00 0.00 N ATOM 656 CA SER A 40 37.962 18.723 18.435 1.00 0.00 C ATOM 657 C SER A 40 36.595 19.215 18.924 1.00 0.00 C ATOM 658 O SER A 40 35.968 20.066 18.296 1.00 0.00 O ATOM 659 CB SER A 40 37.759 17.321 17.833 1.00 0.00 C ATOM 660 OG SER A 40 38.990 16.651 17.638 1.00 0.00 O ATOM 0 H SER A 40 39.333 17.726 19.659 1.00 0.00 H new ATOM 0 HA SER A 40 38.355 19.420 17.695 1.00 0.00 H new ATOM 0 HB2 SER A 40 37.124 16.730 18.493 1.00 0.00 H new ATOM 0 HB3 SER A 40 37.236 17.406 16.880 1.00 0.00 H new ATOM 0 HG SER A 40 38.823 15.764 17.256 1.00 0.00 H new ATOM 666 N THR A 41 36.141 18.699 20.070 1.00 0.00 N ATOM 667 CA THR A 41 34.824 18.995 20.643 1.00 0.00 C ATOM 668 C THR A 41 34.776 20.422 21.193 1.00 0.00 C ATOM 669 O THR A 41 33.885 21.189 20.833 1.00 0.00 O ATOM 670 CB THR A 41 34.473 17.995 21.759 1.00 0.00 C ATOM 671 OG1 THR A 41 34.415 16.669 21.289 1.00 0.00 O ATOM 672 CG2 THR A 41 33.137 18.315 22.422 1.00 0.00 C ATOM 0 H THR A 41 36.689 18.051 20.636 1.00 0.00 H new ATOM 0 HA THR A 41 34.089 18.902 19.844 1.00 0.00 H new ATOM 0 HB THR A 41 35.278 18.091 22.488 1.00 0.00 H new ATOM 0 HG1 THR A 41 34.191 16.069 22.030 1.00 0.00 H new ATOM 0 HG21 THR A 41 32.933 17.582 23.202 1.00 0.00 H new ATOM 0 HG22 THR A 41 33.179 19.311 22.862 1.00 0.00 H new ATOM 0 HG23 THR A 41 32.343 18.281 21.676 1.00 0.00 H new ATOM 680 N VAL A 42 35.753 20.815 22.025 1.00 0.00 N ATOM 681 CA VAL A 42 35.736 22.123 22.711 1.00 0.00 C ATOM 682 C VAL A 42 35.832 23.307 21.738 1.00 0.00 C ATOM 683 O VAL A 42 35.181 24.331 21.950 1.00 0.00 O ATOM 684 CB VAL A 42 36.817 22.186 23.809 1.00 0.00 C ATOM 685 CG1 VAL A 42 38.244 22.305 23.269 1.00 0.00 C ATOM 686 CG2 VAL A 42 36.580 23.358 24.766 1.00 0.00 C ATOM 0 H VAL A 42 36.570 20.244 22.242 1.00 0.00 H new ATOM 0 HA VAL A 42 34.764 22.215 23.195 1.00 0.00 H new ATOM 0 HB VAL A 42 36.726 21.234 24.331 1.00 0.00 H new ATOM 0 HG11 VAL A 42 38.946 22.344 24.102 1.00 0.00 H new ATOM 0 HG12 VAL A 42 38.470 21.441 22.644 1.00 0.00 H new ATOM 0 HG13 VAL A 42 38.334 23.215 22.676 1.00 0.00 H new ATOM 0 HG21 VAL A 42 37.361 23.371 25.526 1.00 0.00 H new ATOM 0 HG22 VAL A 42 36.602 24.294 24.208 1.00 0.00 H new ATOM 0 HG23 VAL A 42 35.608 23.245 25.246 1.00 0.00 H new ATOM 696 N ARG A 43 36.581 23.150 20.635 1.00 0.00 N ATOM 697 CA ARG A 43 36.744 24.112 19.542 1.00 0.00 C ATOM 698 C ARG A 43 35.404 24.588 18.973 1.00 0.00 C ATOM 699 O ARG A 43 35.229 25.781 18.729 1.00 0.00 O ATOM 700 CB ARG A 43 37.591 23.377 18.489 1.00 0.00 C ATOM 701 CG ARG A 43 38.054 24.243 17.325 1.00 0.00 C ATOM 702 CD ARG A 43 38.775 23.366 16.291 1.00 0.00 C ATOM 703 NE ARG A 43 39.411 24.167 15.231 1.00 0.00 N ATOM 704 CZ ARG A 43 40.695 24.485 15.136 1.00 0.00 C ATOM 705 NH1 ARG A 43 41.544 24.059 16.027 1.00 0.00 N ATOM 706 NH2 ARG A 43 41.116 25.222 14.154 1.00 0.00 N ATOM 0 H ARG A 43 37.119 22.298 20.476 1.00 0.00 H new ATOM 0 HA ARG A 43 37.227 25.026 19.886 1.00 0.00 H new ATOM 0 HB2 ARG A 43 38.467 22.953 18.979 1.00 0.00 H new ATOM 0 HB3 ARG A 43 37.011 22.542 18.095 1.00 0.00 H new ATOM 0 HG2 ARG A 43 37.200 24.739 16.865 1.00 0.00 H new ATOM 0 HG3 ARG A 43 38.722 25.026 17.683 1.00 0.00 H new ATOM 0 HD2 ARG A 43 39.532 22.763 16.793 1.00 0.00 H new ATOM 0 HD3 ARG A 43 38.062 22.674 15.843 1.00 0.00 H new ATOM 0 HE ARG A 43 38.799 24.514 14.492 1.00 0.00 H new ATOM 0 HH11 ARG A 43 41.222 23.478 16.802 1.00 0.00 H new ATOM 0 HH12 ARG A 43 42.531 24.306 15.950 1.00 0.00 H new ATOM 0 HH21 ARG A 43 40.458 25.559 13.451 1.00 0.00 H new ATOM 0 HH22 ARG A 43 42.105 25.464 14.085 1.00 0.00 H new ATOM 720 N ARG A 44 34.454 23.661 18.807 1.00 0.00 N ATOM 721 CA ARG A 44 33.123 23.901 18.229 1.00 0.00 C ATOM 722 C ARG A 44 32.303 24.844 19.111 1.00 0.00 C ATOM 723 O ARG A 44 31.953 25.942 18.679 1.00 0.00 O ATOM 724 CB ARG A 44 32.411 22.550 18.023 1.00 0.00 C ATOM 725 CG ARG A 44 33.138 21.625 17.026 1.00 0.00 C ATOM 726 CD ARG A 44 32.700 20.157 17.161 1.00 0.00 C ATOM 727 NE ARG A 44 31.235 19.992 17.100 1.00 0.00 N ATOM 728 CZ ARG A 44 30.448 20.183 16.062 1.00 0.00 C ATOM 729 NH1 ARG A 44 30.947 20.562 14.923 1.00 0.00 N ATOM 730 NH2 ARG A 44 29.168 20.022 16.174 1.00 0.00 N ATOM 0 H ARG A 44 34.594 22.688 19.080 1.00 0.00 H new ATOM 0 HA ARG A 44 33.231 24.391 17.261 1.00 0.00 H new ATOM 0 HB2 ARG A 44 32.325 22.042 18.984 1.00 0.00 H new ATOM 0 HB3 ARG A 44 31.397 22.732 17.667 1.00 0.00 H new ATOM 0 HG2 ARG A 44 32.944 21.967 16.009 1.00 0.00 H new ATOM 0 HG3 ARG A 44 34.214 21.696 17.186 1.00 0.00 H new ATOM 0 HD2 ARG A 44 33.161 19.570 16.367 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.067 19.758 18.106 1.00 0.00 H new ATOM 0 HE ARG A 44 30.779 19.695 17.963 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.952 20.712 14.831 1.00 0.00 H new ATOM 0 HH12 ARG A 44 30.334 20.709 14.121 1.00 0.00 H new ATOM 0 HH21 ARG A 44 28.765 19.746 17.069 1.00 0.00 H new ATOM 0 HH22 ARG A 44 28.563 20.171 15.367 1.00 0.00 H new ATOM 744 N SER A 45 32.075 24.458 20.366 1.00 0.00 N ATOM 745 CA SER A 45 31.324 25.258 21.341 1.00 0.00 C ATOM 746 C SER A 45 32.009 26.606 21.618 1.00 0.00 C ATOM 747 O SER A 45 31.334 27.630 21.648 1.00 0.00 O ATOM 748 CB SER A 45 31.139 24.464 22.633 1.00 0.00 C ATOM 749 OG SER A 45 30.529 23.225 22.343 1.00 0.00 O ATOM 0 H SER A 45 32.409 23.571 20.742 1.00 0.00 H new ATOM 0 HA SER A 45 30.344 25.478 20.917 1.00 0.00 H new ATOM 0 HB2 SER A 45 32.104 24.302 23.114 1.00 0.00 H new ATOM 0 HB3 SER A 45 30.524 25.028 23.334 1.00 0.00 H new ATOM 0 HG SER A 45 29.610 23.376 22.037 1.00 0.00 H new ATOM 755 N ILE A 46 33.333 26.658 21.719 1.00 0.00 N ATOM 756 CA ILE A 46 34.083 27.922 21.876 1.00 0.00 C ATOM 757 C ILE A 46 33.858 28.889 20.706 1.00 0.00 C ATOM 758 O ILE A 46 33.626 30.073 20.957 1.00 0.00 O ATOM 759 CB ILE A 46 35.588 27.642 22.128 1.00 0.00 C ATOM 760 CG1 ILE A 46 35.812 27.185 23.589 1.00 0.00 C ATOM 761 CG2 ILE A 46 36.525 28.811 21.780 1.00 0.00 C ATOM 762 CD1 ILE A 46 35.661 28.256 24.670 1.00 0.00 C ATOM 0 H ILE A 46 33.927 25.829 21.695 1.00 0.00 H new ATOM 0 HA ILE A 46 33.689 28.428 22.757 1.00 0.00 H new ATOM 0 HB ILE A 46 35.856 26.841 21.439 1.00 0.00 H new ATOM 0 HG12 ILE A 46 35.110 26.380 23.806 1.00 0.00 H new ATOM 0 HG13 ILE A 46 36.814 26.763 23.665 1.00 0.00 H new ATOM 0 HG21 ILE A 46 37.556 28.525 21.988 1.00 0.00 H new ATOM 0 HG22 ILE A 46 36.423 29.057 20.723 1.00 0.00 H new ATOM 0 HG23 ILE A 46 36.261 29.680 22.382 1.00 0.00 H new ATOM 0 HD11 ILE A 46 35.842 27.813 25.649 1.00 0.00 H new ATOM 0 HD12 ILE A 46 36.382 29.054 24.494 1.00 0.00 H new ATOM 0 HD13 ILE A 46 34.651 28.665 24.638 1.00 0.00 H new ATOM 774 N LYS A 47 33.897 28.425 19.449 1.00 0.00 N ATOM 775 CA LYS A 47 33.683 29.323 18.299 1.00 0.00 C ATOM 776 C LYS A 47 32.234 29.813 18.241 1.00 0.00 C ATOM 777 O LYS A 47 32.009 30.995 18.001 1.00 0.00 O ATOM 778 CB LYS A 47 34.172 28.679 16.991 1.00 0.00 C ATOM 779 CG LYS A 47 34.128 29.704 15.839 1.00 0.00 C ATOM 780 CD LYS A 47 35.027 29.303 14.661 1.00 0.00 C ATOM 781 CE LYS A 47 34.967 30.309 13.498 1.00 0.00 C ATOM 782 NZ LYS A 47 33.640 30.335 12.834 1.00 0.00 N1+ ATOM 0 H LYS A 47 34.071 27.451 19.202 1.00 0.00 H new ATOM 0 HA LYS A 47 34.293 30.216 18.436 1.00 0.00 H new ATOM 0 HB2 LYS A 47 35.189 28.309 17.118 1.00 0.00 H new ATOM 0 HB3 LYS A 47 33.548 27.819 16.746 1.00 0.00 H new ATOM 0 HG2 LYS A 47 33.101 29.809 15.489 1.00 0.00 H new ATOM 0 HG3 LYS A 47 34.438 30.680 16.213 1.00 0.00 H new ATOM 0 HD2 LYS A 47 36.057 29.216 15.008 1.00 0.00 H new ATOM 0 HD3 LYS A 47 34.728 28.319 14.300 1.00 0.00 H new ATOM 0 HE2 LYS A 47 35.202 31.306 13.872 1.00 0.00 H new ATOM 0 HE3 LYS A 47 35.732 30.056 12.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 33.668 30.991 12.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 33.402 29.381 12.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 32.918 30.652 13.513 1.00 0.00 H new ATOM 796 N LYS A 48 31.267 28.956 18.583 1.00 0.00 N ATOM 797 CA LYS A 48 29.863 29.344 18.793 1.00 0.00 C ATOM 798 C LYS A 48 29.720 30.392 19.906 1.00 0.00 C ATOM 799 O LYS A 48 28.998 31.370 19.733 1.00 0.00 O ATOM 800 CB LYS A 48 29.043 28.076 19.078 1.00 0.00 C ATOM 801 CG LYS A 48 28.896 27.193 17.826 1.00 0.00 C ATOM 802 CD LYS A 48 28.256 25.828 18.130 1.00 0.00 C ATOM 803 CE LYS A 48 26.742 25.875 18.387 1.00 0.00 C ATOM 804 NZ LYS A 48 25.983 26.196 17.149 1.00 0.00 N1+ ATOM 0 H LYS A 48 31.436 27.960 18.724 1.00 0.00 H new ATOM 0 HA LYS A 48 29.479 29.821 17.891 1.00 0.00 H new ATOM 0 HB2 LYS A 48 29.524 27.504 19.871 1.00 0.00 H new ATOM 0 HB3 LYS A 48 28.055 28.357 19.442 1.00 0.00 H new ATOM 0 HG2 LYS A 48 28.290 27.717 17.087 1.00 0.00 H new ATOM 0 HG3 LYS A 48 29.878 27.037 17.380 1.00 0.00 H new ATOM 0 HD2 LYS A 48 28.449 25.157 17.293 1.00 0.00 H new ATOM 0 HD3 LYS A 48 28.746 25.398 19.003 1.00 0.00 H new ATOM 0 HE2 LYS A 48 26.409 24.914 18.779 1.00 0.00 H new ATOM 0 HE3 LYS A 48 26.526 26.622 19.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 24.963 26.119 17.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 26.207 27.165 16.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 26.247 25.528 16.397 1.00 0.00 H new ATOM 818 N PHE A 49 30.446 30.265 21.020 1.00 0.00 N ATOM 819 CA PHE A 49 30.417 31.242 22.120 1.00 0.00 C ATOM 820 C PHE A 49 31.011 32.625 21.793 1.00 0.00 C ATOM 821 O PHE A 49 30.724 33.572 22.531 1.00 0.00 O ATOM 822 CB PHE A 49 31.071 30.670 23.387 1.00 0.00 C ATOM 823 CG PHE A 49 30.407 29.462 24.027 1.00 0.00 C ATOM 824 CD1 PHE A 49 29.003 29.376 24.102 1.00 0.00 C ATOM 825 CD2 PHE A 49 31.196 28.447 24.606 1.00 0.00 C ATOM 826 CE1 PHE A 49 28.391 28.271 24.710 1.00 0.00 C ATOM 827 CE2 PHE A 49 30.584 27.330 25.201 1.00 0.00 C ATOM 828 CZ PHE A 49 29.181 27.244 25.245 1.00 0.00 C ATOM 0 H PHE A 49 31.074 29.479 21.188 1.00 0.00 H new ATOM 0 HA PHE A 49 29.355 31.419 22.293 1.00 0.00 H new ATOM 0 HB2 PHE A 49 32.099 30.401 23.144 1.00 0.00 H new ATOM 0 HB3 PHE A 49 31.116 31.465 24.132 1.00 0.00 H new ATOM 0 HD1 PHE A 49 28.394 30.166 23.688 1.00 0.00 H new ATOM 0 HD2 PHE A 49 32.273 28.528 24.592 1.00 0.00 H new ATOM 0 HE1 PHE A 49 27.314 28.211 24.766 1.00 0.00 H new ATOM 0 HE2 PHE A 49 31.189 26.541 25.623 1.00 0.00 H new ATOM 0 HZ PHE A 49 28.710 26.382 25.693 1.00 0.00 H new ATOM 838 N LEU A 50 31.749 32.777 20.684 1.00 0.00 N ATOM 839 CA LEU A 50 32.077 34.097 20.123 1.00 0.00 C ATOM 840 C LEU A 50 30.805 34.838 19.673 1.00 0.00 C ATOM 841 O LEU A 50 30.649 36.032 19.921 1.00 0.00 O ATOM 842 CB LEU A 50 33.040 33.966 18.932 1.00 0.00 C ATOM 843 CG LEU A 50 34.353 33.199 19.189 1.00 0.00 C ATOM 844 CD1 LEU A 50 35.181 33.248 17.909 1.00 0.00 C ATOM 845 CD2 LEU A 50 35.190 33.815 20.301 1.00 0.00 C ATOM 0 H LEU A 50 32.133 31.995 20.153 1.00 0.00 H new ATOM 0 HA LEU A 50 32.563 34.673 20.911 1.00 0.00 H new ATOM 0 HB2 LEU A 50 32.510 33.472 18.118 1.00 0.00 H new ATOM 0 HB3 LEU A 50 33.293 34.968 18.586 1.00 0.00 H new ATOM 0 HG LEU A 50 34.091 32.184 19.488 1.00 0.00 H new ATOM 0 HD11 LEU A 50 36.118 32.712 18.061 1.00 0.00 H new ATOM 0 HD12 LEU A 50 34.624 32.781 17.097 1.00 0.00 H new ATOM 0 HD13 LEU A 50 35.394 34.286 17.653 1.00 0.00 H new ATOM 0 HD21 LEU A 50 36.101 33.232 20.436 1.00 0.00 H new ATOM 0 HD22 LEU A 50 35.451 34.840 20.035 1.00 0.00 H new ATOM 0 HD23 LEU A 50 34.618 33.815 21.229 1.00 0.00 H new ATOM 857 N GLU A 51 29.871 34.120 19.043 1.00 0.00 N ATOM 858 CA GLU A 51 28.598 34.672 18.562 1.00 0.00 C ATOM 859 C GLU A 51 27.604 34.911 19.716 1.00 0.00 C ATOM 860 O GLU A 51 26.795 35.836 19.649 1.00 0.00 O ATOM 861 CB GLU A 51 27.992 33.770 17.466 1.00 0.00 C ATOM 862 CG GLU A 51 29.000 33.456 16.341 1.00 0.00 C ATOM 863 CD GLU A 51 28.359 32.966 15.033 1.00 0.00 C ATOM 864 OE1 GLU A 51 27.344 33.545 14.581 1.00 0.00 O ATOM 865 OE2 GLU A 51 28.933 32.061 14.381 1.00 0.00 O ATOM 0 H GLU A 51 29.978 33.124 18.849 1.00 0.00 H new ATOM 0 HA GLU A 51 28.804 35.646 18.119 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.650 32.837 17.915 1.00 0.00 H new ATOM 0 HB3 GLU A 51 27.116 34.259 17.040 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.583 34.353 16.132 1.00 0.00 H new ATOM 0 HG3 GLU A 51 29.698 32.697 16.696 1.00 0.00 H new ATOM 872 N LEU A 52 27.704 34.149 20.816 1.00 0.00 N ATOM 873 CA LEU A 52 26.995 34.433 22.078 1.00 0.00 C ATOM 874 C LEU A 52 27.603 35.613 22.872 1.00 0.00 C ATOM 875 O LEU A 52 27.053 35.988 23.903 1.00 0.00 O ATOM 876 CB LEU A 52 26.896 33.176 22.973 1.00 0.00 C ATOM 877 CG LEU A 52 25.847 32.133 22.541 1.00 0.00 C ATOM 878 CD1 LEU A 52 26.285 31.241 21.381 1.00 0.00 C ATOM 879 CD2 LEU A 52 25.451 31.225 23.705 1.00 0.00 C ATOM 0 H LEU A 52 28.284 33.311 20.857 1.00 0.00 H new ATOM 0 HA LEU A 52 25.990 34.734 21.784 1.00 0.00 H new ATOM 0 HB2 LEU A 52 27.873 32.693 23.000 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.669 33.493 23.991 1.00 0.00 H new ATOM 0 HG LEU A 52 25.001 32.732 22.204 1.00 0.00 H new ATOM 0 HD11 LEU A 52 25.488 30.537 21.142 1.00 0.00 H new ATOM 0 HD12 LEU A 52 26.498 31.858 20.508 1.00 0.00 H new ATOM 0 HD13 LEU A 52 27.182 30.691 21.664 1.00 0.00 H new ATOM 0 HD21 LEU A 52 24.710 30.501 23.366 1.00 0.00 H new ATOM 0 HD22 LEU A 52 26.332 30.698 24.071 1.00 0.00 H new ATOM 0 HD23 LEU A 52 25.028 31.828 24.509 1.00 0.00 H new ATOM 891 N GLN A 53 28.717 36.210 22.425 1.00 0.00 N ATOM 892 CA GLN A 53 29.450 37.300 23.107 1.00 0.00 C ATOM 893 C GLN A 53 30.058 36.934 24.478 1.00 0.00 C ATOM 894 O GLN A 53 30.601 37.795 25.176 1.00 0.00 O ATOM 895 CB GLN A 53 28.597 38.582 23.206 1.00 0.00 C ATOM 896 CG GLN A 53 27.754 38.888 21.960 1.00 0.00 C ATOM 897 CD GLN A 53 27.233 40.318 21.989 1.00 0.00 C ATOM 898 OE1 GLN A 53 27.872 41.243 21.502 1.00 0.00 O ATOM 899 NE2 GLN A 53 26.070 40.564 22.540 1.00 0.00 N ATOM 0 H GLN A 53 29.154 35.940 21.544 1.00 0.00 H new ATOM 0 HA GLN A 53 30.309 37.487 22.462 1.00 0.00 H new ATOM 0 HB2 GLN A 53 27.932 38.495 24.065 1.00 0.00 H new ATOM 0 HB3 GLN A 53 29.257 39.428 23.398 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.355 38.735 21.064 1.00 0.00 H new ATOM 0 HG3 GLN A 53 26.916 38.193 21.904 1.00 0.00 H new ATOM 0 HE21 GLN A 53 25.528 39.803 22.949 1.00 0.00 H new ATOM 0 HE22 GLN A 53 25.706 41.517 22.560 1.00 0.00 H new ATOM 908 N TYR A 54 29.970 35.666 24.888 1.00 0.00 N ATOM 909 CA TYR A 54 30.493 35.183 26.169 1.00 0.00 C ATOM 910 C TYR A 54 31.987 34.855 26.108 1.00 0.00 C ATOM 911 O TYR A 54 32.687 35.023 27.102 1.00 0.00 O ATOM 912 CB TYR A 54 29.655 33.982 26.633 1.00 0.00 C ATOM 913 CG TYR A 54 28.162 34.255 26.789 1.00 0.00 C ATOM 914 CD1 TYR A 54 27.708 35.526 27.209 1.00 0.00 C ATOM 915 CD2 TYR A 54 27.221 33.243 26.501 1.00 0.00 C ATOM 916 CE1 TYR A 54 26.334 35.802 27.300 1.00 0.00 C ATOM 917 CE2 TYR A 54 25.843 33.505 26.643 1.00 0.00 C ATOM 918 CZ TYR A 54 25.397 34.793 27.004 1.00 0.00 C ATOM 919 OH TYR A 54 24.069 35.074 27.039 1.00 0.00 O ATOM 0 H TYR A 54 29.527 34.935 24.331 1.00 0.00 H new ATOM 0 HA TYR A 54 30.405 35.983 26.904 1.00 0.00 H new ATOM 0 HB2 TYR A 54 29.787 33.169 25.919 1.00 0.00 H new ATOM 0 HB3 TYR A 54 30.046 33.633 27.589 1.00 0.00 H new ATOM 0 HD1 TYR A 54 28.425 36.293 27.463 1.00 0.00 H new ATOM 0 HD2 TYR A 54 27.556 32.270 26.173 1.00 0.00 H new ATOM 0 HE1 TYR A 54 25.997 36.785 27.596 1.00 0.00 H new ATOM 0 HE2 TYR A 54 25.126 32.715 26.474 1.00 0.00 H new ATOM 0 HH TYR A 54 23.558 34.270 26.809 1.00 0.00 H new ATOM 929 N VAL A 55 32.488 34.434 24.945 1.00 0.00 N ATOM 930 CA VAL A 55 33.911 34.143 24.704 1.00 0.00 C ATOM 931 C VAL A 55 34.435 35.077 23.610 1.00 0.00 C ATOM 932 O VAL A 55 33.677 35.671 22.843 1.00 0.00 O ATOM 933 CB VAL A 55 34.132 32.647 24.379 1.00 0.00 C ATOM 934 CG1 VAL A 55 35.587 32.222 24.205 1.00 0.00 C ATOM 935 CG2 VAL A 55 33.536 31.739 25.467 1.00 0.00 C ATOM 0 H VAL A 55 31.905 34.281 24.122 1.00 0.00 H new ATOM 0 HA VAL A 55 34.485 34.333 25.611 1.00 0.00 H new ATOM 0 HB VAL A 55 33.627 32.530 23.420 1.00 0.00 H new ATOM 0 HG11 VAL A 55 35.630 31.156 23.980 1.00 0.00 H new ATOM 0 HG12 VAL A 55 36.035 32.784 23.386 1.00 0.00 H new ATOM 0 HG13 VAL A 55 36.137 32.421 25.125 1.00 0.00 H new ATOM 0 HG21 VAL A 55 33.710 30.695 25.205 1.00 0.00 H new ATOM 0 HG22 VAL A 55 34.011 31.957 26.423 1.00 0.00 H new ATOM 0 HG23 VAL A 55 32.464 31.920 25.545 1.00 0.00 H new ATOM 945 N LYS A 56 35.753 35.203 23.549 1.00 0.00 N ATOM 946 CA LYS A 56 36.509 36.076 22.644 1.00 0.00 C ATOM 947 C LYS A 56 37.884 35.461 22.343 1.00 0.00 C ATOM 948 O LYS A 56 38.509 34.855 23.209 1.00 0.00 O ATOM 949 CB LYS A 56 36.619 37.470 23.283 1.00 0.00 C ATOM 950 CG LYS A 56 36.627 38.642 22.287 1.00 0.00 C ATOM 951 CD LYS A 56 35.523 38.556 21.220 1.00 0.00 C ATOM 952 CE LYS A 56 35.139 39.921 20.641 1.00 0.00 C ATOM 953 NZ LYS A 56 34.234 39.834 19.470 1.00 0.00 N1+ ATOM 0 H LYS A 56 36.366 34.669 24.165 1.00 0.00 H new ATOM 0 HA LYS A 56 35.994 36.177 21.689 1.00 0.00 H new ATOM 0 HB2 LYS A 56 35.785 37.604 23.972 1.00 0.00 H new ATOM 0 HB3 LYS A 56 37.533 37.510 23.876 1.00 0.00 H new ATOM 0 HG2 LYS A 56 36.515 39.576 22.838 1.00 0.00 H new ATOM 0 HG3 LYS A 56 37.597 38.679 21.791 1.00 0.00 H new ATOM 0 HD2 LYS A 56 35.857 37.906 20.411 1.00 0.00 H new ATOM 0 HD3 LYS A 56 34.639 38.092 21.657 1.00 0.00 H new ATOM 0 HE2 LYS A 56 34.658 40.514 21.419 1.00 0.00 H new ATOM 0 HE3 LYS A 56 36.046 40.452 20.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 34.015 40.792 19.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 34.698 39.294 18.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 33.353 39.355 19.747 1.00 0.00 H new ATOM 967 N GLU A 57 38.341 35.574 21.101 1.00 0.00 N ATOM 968 CA GLU A 57 39.587 34.969 20.614 1.00 0.00 C ATOM 969 C GLU A 57 40.825 35.871 20.827 1.00 0.00 C ATOM 970 O GLU A 57 40.716 37.097 20.768 1.00 0.00 O ATOM 971 CB GLU A 57 39.371 34.618 19.132 1.00 0.00 C ATOM 972 CG GLU A 57 40.457 33.681 18.611 1.00 0.00 C ATOM 973 CD GLU A 57 40.159 33.145 17.206 1.00 0.00 C ATOM 974 OE1 GLU A 57 40.037 33.954 16.262 1.00 0.00 O ATOM 975 OE2 GLU A 57 40.191 31.906 17.024 1.00 0.00 O ATOM 0 H GLU A 57 37.846 36.102 20.382 1.00 0.00 H new ATOM 0 HA GLU A 57 39.808 34.072 21.192 1.00 0.00 H new ATOM 0 HB2 GLU A 57 38.395 34.149 19.007 1.00 0.00 H new ATOM 0 HB3 GLU A 57 39.363 35.532 18.539 1.00 0.00 H new ATOM 0 HG2 GLU A 57 41.410 34.209 18.598 1.00 0.00 H new ATOM 0 HG3 GLU A 57 40.567 32.842 19.299 1.00 0.00 H new ATOM 982 N GLY A 58 42.012 35.283 21.031 1.00 0.00 N ATOM 983 CA GLY A 58 43.291 36.006 21.042 1.00 0.00 C ATOM 984 C GLY A 58 44.512 35.121 20.743 1.00 0.00 C ATOM 985 O GLY A 58 44.712 34.071 21.353 1.00 0.00 O ATOM 0 H GLY A 58 42.112 34.281 21.195 1.00 0.00 H new ATOM 0 HA2 GLY A 58 43.249 36.810 20.307 1.00 0.00 H new ATOM 0 HA3 GLY A 58 43.424 36.473 22.018 1.00 0.00 H new ATOM 989 N CYS A 59 45.359 35.552 19.810 1.00 0.00 N ATOM 990 CA CYS A 59 46.637 34.922 19.483 1.00 0.00 C ATOM 991 C CYS A 59 47.777 35.599 20.263 1.00 0.00 C ATOM 992 O CYS A 59 48.307 36.631 19.845 1.00 0.00 O ATOM 993 CB CYS A 59 46.832 34.983 17.962 1.00 0.00 C ATOM 994 SG CYS A 59 48.156 33.829 17.516 1.00 0.00 S ATOM 0 H CYS A 59 45.168 36.377 19.242 1.00 0.00 H new ATOM 0 HA CYS A 59 46.644 33.874 19.783 1.00 0.00 H new ATOM 0 HB2 CYS A 59 45.908 34.718 17.449 1.00 0.00 H new ATOM 0 HB3 CYS A 59 47.090 35.996 17.652 1.00 0.00 H new ATOM 0 HG CYS A 59 48.342 33.858 16.230 1.00 0.00 H new ATOM 1000 N LYS A 60 48.116 35.065 21.443 1.00 0.00 N ATOM 1001 CA LYS A 60 49.161 35.628 22.314 1.00 0.00 C ATOM 1002 C LYS A 60 50.546 35.493 21.665 1.00 0.00 C ATOM 1003 O LYS A 60 50.924 34.416 21.214 1.00 0.00 O ATOM 1004 CB LYS A 60 49.142 34.918 23.675 1.00 0.00 C ATOM 1005 CG LYS A 60 47.908 35.188 24.551 1.00 0.00 C ATOM 1006 CD LYS A 60 47.784 36.650 25.011 1.00 0.00 C ATOM 1007 CE LYS A 60 46.921 36.779 26.277 1.00 0.00 C ATOM 1008 NZ LYS A 60 47.608 36.220 27.467 1.00 0.00 N1+ ATOM 0 H LYS A 60 47.674 34.228 21.824 1.00 0.00 H new ATOM 0 HA LYS A 60 48.956 36.689 22.459 1.00 0.00 H new ATOM 0 HB2 LYS A 60 49.216 33.844 23.505 1.00 0.00 H new ATOM 0 HB3 LYS A 60 50.031 35.214 24.231 1.00 0.00 H new ATOM 0 HG2 LYS A 60 47.012 34.914 23.995 1.00 0.00 H new ATOM 0 HG3 LYS A 60 47.948 34.543 25.428 1.00 0.00 H new ATOM 0 HD2 LYS A 60 48.777 37.055 25.205 1.00 0.00 H new ATOM 0 HD3 LYS A 60 47.347 37.247 24.211 1.00 0.00 H new ATOM 0 HE2 LYS A 60 46.686 37.829 26.452 1.00 0.00 H new ATOM 0 HE3 LYS A 60 45.974 36.261 26.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 47.157 36.584 28.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 47.540 35.182 27.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 48.609 36.501 27.454 1.00 0.00 H new ATOM 1022 N GLN A 61 51.319 36.578 21.658 1.00 0.00 N ATOM 1023 CA GLN A 61 52.632 36.649 21.007 1.00 0.00 C ATOM 1024 C GLN A 61 53.573 35.499 21.428 1.00 0.00 C ATOM 1025 O GLN A 61 53.823 35.273 22.614 1.00 0.00 O ATOM 1026 CB GLN A 61 53.280 38.014 21.302 1.00 0.00 C ATOM 1027 CG GLN A 61 52.794 39.164 20.402 1.00 0.00 C ATOM 1028 CD GLN A 61 51.290 39.429 20.419 1.00 0.00 C ATOM 1029 OE1 GLN A 61 50.629 39.402 21.449 1.00 0.00 O ATOM 1030 NE2 GLN A 61 50.694 39.718 19.285 1.00 0.00 N ATOM 0 H GLN A 61 51.048 37.450 22.112 1.00 0.00 H new ATOM 0 HA GLN A 61 52.472 36.538 19.934 1.00 0.00 H new ATOM 0 HB2 GLN A 61 53.084 38.277 22.342 1.00 0.00 H new ATOM 0 HB3 GLN A 61 54.361 37.919 21.195 1.00 0.00 H new ATOM 0 HG2 GLN A 61 53.308 40.077 20.701 1.00 0.00 H new ATOM 0 HG3 GLN A 61 53.095 38.950 19.376 1.00 0.00 H new ATOM 0 HE21 GLN A 61 51.232 39.744 18.419 1.00 0.00 H new ATOM 0 HE22 GLN A 61 49.694 39.916 19.271 1.00 0.00 H new ATOM 1039 N GLY A 62 54.114 34.787 20.436 1.00 0.00 N ATOM 1040 CA GLY A 62 55.095 33.712 20.618 1.00 0.00 C ATOM 1041 C GLY A 62 54.556 32.379 21.161 1.00 0.00 C ATOM 1042 O GLY A 62 55.360 31.476 21.387 1.00 0.00 O ATOM 0 H GLY A 62 53.876 34.946 19.457 1.00 0.00 H new ATOM 0 HA2 GLY A 62 55.574 33.521 19.658 1.00 0.00 H new ATOM 0 HA3 GLY A 62 55.870 34.068 21.296 1.00 0.00 H new ATOM 1046 N ILE A 63 53.243 32.218 21.372 1.00 0.00 N ATOM 1047 CA ILE A 63 52.622 30.991 21.915 1.00 0.00 C ATOM 1048 C ILE A 63 51.308 30.643 21.186 1.00 0.00 C ATOM 1049 O ILE A 63 50.836 31.387 20.330 1.00 0.00 O ATOM 1050 CB ILE A 63 52.436 31.085 23.453 1.00 0.00 C ATOM 1051 CG1 ILE A 63 51.429 32.179 23.863 1.00 0.00 C ATOM 1052 CG2 ILE A 63 53.785 31.244 24.178 1.00 0.00 C ATOM 1053 CD1 ILE A 63 51.066 32.156 25.355 1.00 0.00 C ATOM 0 H ILE A 63 52.563 32.950 21.167 1.00 0.00 H new ATOM 0 HA ILE A 63 53.308 30.165 21.727 1.00 0.00 H new ATOM 0 HB ILE A 63 52.004 30.137 23.773 1.00 0.00 H new ATOM 0 HG12 ILE A 63 51.845 33.155 23.614 1.00 0.00 H new ATOM 0 HG13 ILE A 63 50.519 32.062 23.275 1.00 0.00 H new ATOM 0 HG21 ILE A 63 53.615 31.307 25.253 1.00 0.00 H new ATOM 0 HG22 ILE A 63 54.419 30.384 23.960 1.00 0.00 H new ATOM 0 HG23 ILE A 63 54.277 32.154 23.835 1.00 0.00 H new ATOM 0 HD11 ILE A 63 50.354 32.953 25.569 1.00 0.00 H new ATOM 0 HD12 ILE A 63 50.620 31.194 25.606 1.00 0.00 H new ATOM 0 HD13 ILE A 63 51.967 32.305 25.951 1.00 0.00 H new ATOM 1065 N SER A 64 50.720 29.486 21.505 1.00 0.00 N ATOM 1066 CA SER A 64 49.478 28.997 20.884 1.00 0.00 C ATOM 1067 C SER A 64 48.273 29.929 21.101 1.00 0.00 C ATOM 1068 O SER A 64 48.135 30.567 22.149 1.00 0.00 O ATOM 1069 CB SER A 64 49.129 27.606 21.424 1.00 0.00 C ATOM 1070 OG SER A 64 50.224 26.722 21.279 1.00 0.00 O ATOM 0 H SER A 64 51.095 28.852 22.210 1.00 0.00 H new ATOM 0 HA SER A 64 49.674 28.962 19.812 1.00 0.00 H new ATOM 0 HB2 SER A 64 48.851 27.678 22.475 1.00 0.00 H new ATOM 0 HB3 SER A 64 48.264 27.211 20.892 1.00 0.00 H new ATOM 0 HG SER A 64 49.981 25.840 21.631 1.00 0.00 H new ATOM 1076 N LYS A 65 47.348 29.959 20.129 1.00 0.00 N ATOM 1077 CA LYS A 65 46.093 30.712 20.205 1.00 0.00 C ATOM 1078 C LYS A 65 45.214 30.260 21.383 1.00 0.00 C ATOM 1079 O LYS A 65 45.226 29.096 21.782 1.00 0.00 O ATOM 1080 CB LYS A 65 45.342 30.569 18.874 1.00 0.00 C ATOM 1081 CG LYS A 65 44.500 31.822 18.635 1.00 0.00 C ATOM 1082 CD LYS A 65 43.270 31.577 17.770 1.00 0.00 C ATOM 1083 CE LYS A 65 43.515 30.953 16.395 1.00 0.00 C ATOM 1084 NZ LYS A 65 42.274 31.029 15.588 1.00 0.00 N1+ ATOM 0 H LYS A 65 47.457 29.449 19.252 1.00 0.00 H new ATOM 0 HA LYS A 65 46.331 31.761 20.383 1.00 0.00 H new ATOM 0 HB2 LYS A 65 46.050 30.430 18.057 1.00 0.00 H new ATOM 0 HB3 LYS A 65 44.703 29.686 18.896 1.00 0.00 H new ATOM 0 HG2 LYS A 65 44.183 32.225 19.597 1.00 0.00 H new ATOM 0 HG3 LYS A 65 45.121 32.582 18.161 1.00 0.00 H new ATOM 0 HD2 LYS A 65 42.589 30.930 18.322 1.00 0.00 H new ATOM 0 HD3 LYS A 65 42.759 32.529 17.626 1.00 0.00 H new ATOM 0 HE2 LYS A 65 44.325 31.476 15.886 1.00 0.00 H new ATOM 0 HE3 LYS A 65 43.826 29.914 16.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 42.181 30.168 15.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 41.453 31.113 16.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 42.316 31.860 14.964 1.00 0.00 H new ATOM 1098 N THR A 66 44.429 31.184 21.928 1.00 0.00 N ATOM 1099 CA THR A 66 43.702 31.016 23.191 1.00 0.00 C ATOM 1100 C THR A 66 42.436 31.882 23.235 1.00 0.00 C ATOM 1101 O THR A 66 42.230 32.733 22.368 1.00 0.00 O ATOM 1102 CB THR A 66 44.691 31.290 24.333 1.00 0.00 C ATOM 1103 OG1 THR A 66 44.085 31.095 25.587 1.00 0.00 O ATOM 1104 CG2 THR A 66 45.316 32.684 24.309 1.00 0.00 C ATOM 0 H THR A 66 44.274 32.095 21.496 1.00 0.00 H new ATOM 0 HA THR A 66 43.328 29.998 23.296 1.00 0.00 H new ATOM 0 HB THR A 66 45.495 30.571 24.173 1.00 0.00 H new ATOM 0 HG1 THR A 66 44.737 31.274 26.297 1.00 0.00 H new ATOM 0 HG21 THR A 66 46.001 32.790 25.150 1.00 0.00 H new ATOM 0 HG22 THR A 66 45.863 32.821 23.376 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.531 33.436 24.383 1.00 0.00 H new ATOM 1112 N PHE A 67 41.546 31.640 24.204 1.00 0.00 N ATOM 1113 CA PHE A 67 40.215 32.256 24.259 1.00 0.00 C ATOM 1114 C PHE A 67 39.936 32.840 25.643 1.00 0.00 C ATOM 1115 O PHE A 67 39.952 32.122 26.639 1.00 0.00 O ATOM 1116 CB PHE A 67 39.147 31.238 23.827 1.00 0.00 C ATOM 1117 CG PHE A 67 39.227 30.874 22.358 1.00 0.00 C ATOM 1118 CD1 PHE A 67 40.216 29.982 21.899 1.00 0.00 C ATOM 1119 CD2 PHE A 67 38.336 31.457 21.439 1.00 0.00 C ATOM 1120 CE1 PHE A 67 40.331 29.706 20.528 1.00 0.00 C ATOM 1121 CE2 PHE A 67 38.412 31.129 20.075 1.00 0.00 C ATOM 1122 CZ PHE A 67 39.415 30.260 19.619 1.00 0.00 C ATOM 0 H PHE A 67 41.731 31.005 24.980 1.00 0.00 H new ATOM 0 HA PHE A 67 40.180 33.090 23.559 1.00 0.00 H new ATOM 0 HB2 PHE A 67 39.254 30.333 24.425 1.00 0.00 H new ATOM 0 HB3 PHE A 67 38.159 31.646 24.040 1.00 0.00 H new ATOM 0 HD1 PHE A 67 40.886 29.510 22.603 1.00 0.00 H new ATOM 0 HD2 PHE A 67 37.591 32.159 21.783 1.00 0.00 H new ATOM 0 HE1 PHE A 67 41.125 29.067 20.171 1.00 0.00 H new ATOM 0 HE2 PHE A 67 37.699 31.545 19.378 1.00 0.00 H new ATOM 0 HZ PHE A 67 39.483 30.017 18.569 1.00 0.00 H new ATOM 1132 N TYR A 68 39.704 34.150 25.722 1.00 0.00 N ATOM 1133 CA TYR A 68 39.266 34.809 26.954 1.00 0.00 C ATOM 1134 C TYR A 68 37.738 34.926 27.005 1.00 0.00 C ATOM 1135 O TYR A 68 37.041 34.661 26.024 1.00 0.00 O ATOM 1136 CB TYR A 68 39.997 36.139 27.152 1.00 0.00 C ATOM 1137 CG TYR A 68 39.617 37.252 26.207 1.00 0.00 C ATOM 1138 CD1 TYR A 68 38.475 38.030 26.480 1.00 0.00 C ATOM 1139 CD2 TYR A 68 40.440 37.550 25.104 1.00 0.00 C ATOM 1140 CE1 TYR A 68 38.179 39.139 25.670 1.00 0.00 C ATOM 1141 CE2 TYR A 68 40.152 38.674 24.304 1.00 0.00 C ATOM 1142 CZ TYR A 68 39.037 39.484 24.604 1.00 0.00 C ATOM 1143 OH TYR A 68 38.767 40.589 23.869 1.00 0.00 O ATOM 0 H TYR A 68 39.814 34.786 24.932 1.00 0.00 H new ATOM 0 HA TYR A 68 39.542 34.187 27.806 1.00 0.00 H new ATOM 0 HB2 TYR A 68 39.820 36.479 28.172 1.00 0.00 H new ATOM 0 HB3 TYR A 68 41.068 35.959 27.058 1.00 0.00 H new ATOM 0 HD1 TYR A 68 37.830 37.775 27.308 1.00 0.00 H new ATOM 0 HD2 TYR A 68 41.287 36.921 24.872 1.00 0.00 H new ATOM 0 HE1 TYR A 68 37.294 39.728 25.863 1.00 0.00 H new ATOM 0 HE2 TYR A 68 40.784 38.915 23.462 1.00 0.00 H new ATOM 0 HH TYR A 68 39.449 40.694 23.173 1.00 0.00 H new ATOM 1153 N ILE A 69 37.209 35.266 28.178 1.00 0.00 N ATOM 1154 CA ILE A 69 35.778 35.186 28.489 1.00 0.00 C ATOM 1155 C ILE A 69 35.326 36.512 29.111 1.00 0.00 C ATOM 1156 O ILE A 69 36.030 37.092 29.936 1.00 0.00 O ATOM 1157 CB ILE A 69 35.508 33.920 29.338 1.00 0.00 C ATOM 1158 CG1 ILE A 69 35.902 32.639 28.553 1.00 0.00 C ATOM 1159 CG2 ILE A 69 34.033 33.791 29.764 1.00 0.00 C ATOM 1160 CD1 ILE A 69 37.295 32.079 28.883 1.00 0.00 C ATOM 0 H ILE A 69 37.771 35.612 28.956 1.00 0.00 H new ATOM 0 HA ILE A 69 35.168 35.063 27.594 1.00 0.00 H new ATOM 0 HB ILE A 69 36.119 34.025 30.235 1.00 0.00 H new ATOM 0 HG12 ILE A 69 35.160 31.866 28.752 1.00 0.00 H new ATOM 0 HG13 ILE A 69 35.858 32.857 27.486 1.00 0.00 H new ATOM 0 HG21 ILE A 69 33.903 32.885 30.356 1.00 0.00 H new ATOM 0 HG22 ILE A 69 33.749 34.658 30.360 1.00 0.00 H new ATOM 0 HG23 ILE A 69 33.401 33.738 28.877 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.479 31.186 28.286 1.00 0.00 H new ATOM 0 HD12 ILE A 69 38.052 32.830 28.656 1.00 0.00 H new ATOM 0 HD13 ILE A 69 37.343 31.824 29.942 1.00 0.00 H new ATOM 1172 N THR A 70 34.208 37.051 28.628 1.00 0.00 N ATOM 1173 CA THR A 70 33.766 38.427 28.875 1.00 0.00 C ATOM 1174 C THR A 70 33.022 38.560 30.218 1.00 0.00 C ATOM 1175 O THR A 70 32.437 37.584 30.707 1.00 0.00 O ATOM 1176 CB THR A 70 32.851 38.873 27.716 1.00 0.00 C ATOM 1177 OG1 THR A 70 31.655 38.130 27.695 1.00 0.00 O ATOM 1178 CG2 THR A 70 33.521 38.742 26.346 1.00 0.00 C ATOM 0 H THR A 70 33.563 36.528 28.035 1.00 0.00 H new ATOM 0 HA THR A 70 34.647 39.067 28.930 1.00 0.00 H new ATOM 0 HB THR A 70 32.639 39.926 27.901 1.00 0.00 H new ATOM 0 HG1 THR A 70 31.395 37.955 26.767 1.00 0.00 H new ATOM 0 HG21 THR A 70 32.830 39.070 25.570 1.00 0.00 H new ATOM 0 HG22 THR A 70 34.418 39.361 26.319 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.794 37.701 26.172 1.00 0.00 H new ATOM 1186 N PRO A 71 32.950 39.769 30.817 1.00 0.00 N ATOM 1187 CA PRO A 71 32.104 40.001 31.993 1.00 0.00 C ATOM 1188 C PRO A 71 30.618 39.743 31.688 1.00 0.00 C ATOM 1189 O PRO A 71 29.898 39.246 32.549 1.00 0.00 O ATOM 1190 CB PRO A 71 32.358 41.456 32.400 1.00 0.00 C ATOM 1191 CG PRO A 71 32.730 42.120 31.077 1.00 0.00 C ATOM 1192 CD PRO A 71 33.546 41.028 30.383 1.00 0.00 C ATOM 0 HA PRO A 71 32.350 39.313 32.802 1.00 0.00 H new ATOM 0 HB2 PRO A 71 31.474 41.911 32.846 1.00 0.00 H new ATOM 0 HB3 PRO A 71 33.161 41.536 33.132 1.00 0.00 H new ATOM 0 HG2 PRO A 71 31.848 42.398 30.499 1.00 0.00 H new ATOM 0 HG3 PRO A 71 33.312 43.029 31.228 1.00 0.00 H new ATOM 0 HD2 PRO A 71 33.501 41.132 29.299 1.00 0.00 H new ATOM 0 HD3 PRO A 71 34.597 41.083 30.665 1.00 0.00 H new ATOM 1200 N ASN A 72 30.180 39.976 30.444 1.00 0.00 N ATOM 1201 CA ASN A 72 28.824 39.679 29.982 1.00 0.00 C ATOM 1202 C ASN A 72 28.470 38.185 30.118 1.00 0.00 C ATOM 1203 O ASN A 72 27.311 37.848 30.344 1.00 0.00 O ATOM 1204 CB ASN A 72 28.666 40.133 28.518 1.00 0.00 C ATOM 1205 CG ASN A 72 29.055 41.580 28.275 1.00 0.00 C ATOM 1206 OD1 ASN A 72 30.223 41.946 28.318 1.00 0.00 O ATOM 1207 ND2 ASN A 72 28.108 42.446 28.002 1.00 0.00 N ATOM 0 H ASN A 72 30.771 40.384 29.720 1.00 0.00 H new ATOM 0 HA ASN A 72 28.131 40.229 30.619 1.00 0.00 H new ATOM 0 HB2 ASN A 72 29.276 39.492 27.882 1.00 0.00 H new ATOM 0 HB3 ASN A 72 27.629 39.990 28.214 1.00 0.00 H new ATOM 0 HD21 ASN A 72 28.345 43.422 27.826 1.00 0.00 H new ATOM 0 HD22 ASN A 72 27.135 42.143 27.966 1.00 0.00 H new ATOM 1214 N GLY A 73 29.458 37.283 30.019 1.00 0.00 N ATOM 1215 CA GLY A 73 29.289 35.862 30.332 1.00 0.00 C ATOM 1216 C GLY A 73 29.161 35.594 31.837 1.00 0.00 C ATOM 1217 O GLY A 73 28.283 34.837 32.248 1.00 0.00 O ATOM 0 H GLY A 73 30.402 37.524 29.717 1.00 0.00 H new ATOM 0 HA2 GLY A 73 28.401 35.486 29.824 1.00 0.00 H new ATOM 0 HA3 GLY A 73 30.140 35.305 29.940 1.00 0.00 H new ATOM 1221 N ILE A 74 29.984 36.249 32.668 1.00 0.00 N ATOM 1222 CA ILE A 74 29.942 36.148 34.140 1.00 0.00 C ATOM 1223 C ILE A 74 28.571 36.536 34.700 1.00 0.00 C ATOM 1224 O ILE A 74 28.066 35.852 35.591 1.00 0.00 O ATOM 1225 CB ILE A 74 31.070 36.976 34.799 1.00 0.00 C ATOM 1226 CG1 ILE A 74 32.414 36.286 34.497 1.00 0.00 C ATOM 1227 CG2 ILE A 74 30.889 37.124 36.326 1.00 0.00 C ATOM 1228 CD1 ILE A 74 33.624 37.135 34.890 1.00 0.00 C ATOM 0 H ILE A 74 30.714 36.878 32.332 1.00 0.00 H new ATOM 0 HA ILE A 74 30.110 35.101 34.391 1.00 0.00 H new ATOM 0 HB ILE A 74 31.041 37.983 34.383 1.00 0.00 H new ATOM 0 HG12 ILE A 74 32.456 35.336 35.029 1.00 0.00 H new ATOM 0 HG13 ILE A 74 32.468 36.058 33.433 1.00 0.00 H new ATOM 0 HG21 ILE A 74 31.710 37.714 36.734 1.00 0.00 H new ATOM 0 HG22 ILE A 74 29.943 37.625 36.533 1.00 0.00 H new ATOM 0 HG23 ILE A 74 30.886 36.137 36.789 1.00 0.00 H new ATOM 0 HD11 ILE A 74 34.540 36.595 34.652 1.00 0.00 H new ATOM 0 HD12 ILE A 74 33.604 38.075 34.338 1.00 0.00 H new ATOM 0 HD13 ILE A 74 33.592 37.342 35.960 1.00 0.00 H new ATOM 1240 N GLU A 75 27.940 37.583 34.164 1.00 0.00 N ATOM 1241 CA GLU A 75 26.603 38.032 34.585 1.00 0.00 C ATOM 1242 C GLU A 75 25.554 36.916 34.522 1.00 0.00 C ATOM 1243 O GLU A 75 24.734 36.782 35.430 1.00 0.00 O ATOM 1244 CB GLU A 75 26.143 39.189 33.694 1.00 0.00 C ATOM 1245 CG GLU A 75 26.912 40.476 34.002 1.00 0.00 C ATOM 1246 CD GLU A 75 26.401 41.631 33.142 1.00 0.00 C ATOM 1247 OE1 GLU A 75 25.947 42.644 33.724 1.00 0.00 O ATOM 1248 OE2 GLU A 75 26.435 41.532 31.897 1.00 0.00 O ATOM 0 H GLU A 75 28.343 38.151 33.419 1.00 0.00 H new ATOM 0 HA GLU A 75 26.690 38.349 35.624 1.00 0.00 H new ATOM 0 HB2 GLU A 75 26.285 38.921 32.647 1.00 0.00 H new ATOM 0 HB3 GLU A 75 25.076 39.358 33.838 1.00 0.00 H new ATOM 0 HG2 GLU A 75 26.803 40.726 35.057 1.00 0.00 H new ATOM 0 HG3 GLU A 75 27.975 40.323 33.819 1.00 0.00 H new ATOM 1255 N LYS A 76 25.612 36.070 33.487 1.00 0.00 N ATOM 1256 CA LYS A 76 24.683 34.946 33.298 1.00 0.00 C ATOM 1257 C LYS A 76 24.872 33.860 34.364 1.00 0.00 C ATOM 1258 O LYS A 76 23.911 33.187 34.725 1.00 0.00 O ATOM 1259 CB LYS A 76 24.868 34.336 31.896 1.00 0.00 C ATOM 1260 CG LYS A 76 25.090 35.332 30.744 1.00 0.00 C ATOM 1261 CD LYS A 76 24.038 36.436 30.534 1.00 0.00 C ATOM 1262 CE LYS A 76 22.747 35.924 29.885 1.00 0.00 C ATOM 1263 NZ LYS A 76 21.916 37.010 29.317 1.00 0.00 N1+ ATOM 0 H LYS A 76 26.312 36.146 32.749 1.00 0.00 H new ATOM 0 HA LYS A 76 23.671 35.339 33.398 1.00 0.00 H new ATOM 0 HB2 LYS A 76 25.719 33.655 31.928 1.00 0.00 H new ATOM 0 HB3 LYS A 76 23.988 33.736 31.665 1.00 0.00 H new ATOM 0 HG2 LYS A 76 26.055 35.815 30.900 1.00 0.00 H new ATOM 0 HG3 LYS A 76 25.165 34.761 29.818 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.799 36.889 31.496 1.00 0.00 H new ATOM 0 HD3 LYS A 76 24.464 37.221 29.910 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.999 35.216 29.096 1.00 0.00 H new ATOM 0 HE3 LYS A 76 22.165 35.379 30.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 21.058 36.604 28.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 21.649 37.674 30.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 22.457 37.516 28.587 1.00 0.00 H new ATOM 1277 N LEU A 77 26.093 33.708 34.887 1.00 0.00 N ATOM 1278 CA LEU A 77 26.446 32.712 35.907 1.00 0.00 C ATOM 1279 C LEU A 77 25.763 32.988 37.257 1.00 0.00 C ATOM 1280 O LEU A 77 25.505 32.062 38.022 1.00 0.00 O ATOM 1281 CB LEU A 77 27.976 32.661 36.109 1.00 0.00 C ATOM 1282 CG LEU A 77 28.840 32.621 34.838 1.00 0.00 C ATOM 1283 CD1 LEU A 77 30.326 32.636 35.193 1.00 0.00 C ATOM 1284 CD2 LEU A 77 28.556 31.420 33.943 1.00 0.00 C ATOM 0 H LEU A 77 26.884 34.288 34.607 1.00 0.00 H new ATOM 0 HA LEU A 77 26.088 31.750 35.540 1.00 0.00 H new ATOM 0 HB2 LEU A 77 28.271 33.532 36.694 1.00 0.00 H new ATOM 0 HB3 LEU A 77 28.211 31.781 36.708 1.00 0.00 H new ATOM 0 HG LEU A 77 28.573 33.516 34.276 1.00 0.00 H new ATOM 0 HD11 LEU A 77 30.919 32.607 34.279 1.00 0.00 H new ATOM 0 HD12 LEU A 77 30.558 33.545 35.748 1.00 0.00 H new ATOM 0 HD13 LEU A 77 30.562 31.766 35.806 1.00 0.00 H new ATOM 0 HD21 LEU A 77 29.202 31.459 33.066 1.00 0.00 H new ATOM 0 HD22 LEU A 77 28.749 30.501 34.496 1.00 0.00 H new ATOM 0 HD23 LEU A 77 27.513 31.441 33.626 1.00 0.00 H new ATOM 1296 N LYS A 78 25.478 34.261 37.552 1.00 0.00 N ATOM 1297 CA LYS A 78 24.895 34.735 38.812 1.00 0.00 C ATOM 1298 C LYS A 78 23.464 34.238 39.059 1.00 0.00 C ATOM 1299 O LYS A 78 23.051 34.160 40.214 1.00 0.00 O ATOM 1300 CB LYS A 78 24.933 36.276 38.827 1.00 0.00 C ATOM 1301 CG LYS A 78 26.311 36.901 38.531 1.00 0.00 C ATOM 1302 CD LYS A 78 27.449 36.377 39.421 1.00 0.00 C ATOM 1303 CE LYS A 78 28.381 35.373 38.723 1.00 0.00 C ATOM 1304 NZ LYS A 78 29.512 34.990 39.598 1.00 0.00 N1+ ATOM 0 H LYS A 78 25.654 35.020 36.893 1.00 0.00 H new ATOM 0 HA LYS A 78 25.495 34.320 39.622 1.00 0.00 H new ATOM 0 HB2 LYS A 78 24.218 36.648 38.094 1.00 0.00 H new ATOM 0 HB3 LYS A 78 24.597 36.622 39.804 1.00 0.00 H new ATOM 0 HG2 LYS A 78 26.566 36.713 37.488 1.00 0.00 H new ATOM 0 HG3 LYS A 78 26.240 37.982 38.652 1.00 0.00 H new ATOM 0 HD2 LYS A 78 28.041 37.223 39.771 1.00 0.00 H new ATOM 0 HD3 LYS A 78 27.017 35.903 40.303 1.00 0.00 H new ATOM 0 HE2 LYS A 78 27.817 34.483 38.444 1.00 0.00 H new ATOM 0 HE3 LYS A 78 28.764 35.810 37.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 30.123 34.312 39.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 30.063 35.837 39.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 29.146 34.552 40.467 1.00 0.00 H new ATOM 1318 N SER A 79 22.732 33.965 37.984 1.00 0.00 N ATOM 1319 CA SER A 79 21.367 33.443 38.049 1.00 0.00 C ATOM 1320 C SER A 79 21.242 32.015 38.608 1.00 0.00 C ATOM 1321 O SER A 79 20.298 31.706 39.335 1.00 0.00 O ATOM 1322 CB SER A 79 20.726 33.498 36.660 1.00 0.00 C ATOM 1323 OG SER A 79 20.637 34.833 36.192 1.00 0.00 O ATOM 0 H SER A 79 23.071 34.101 37.032 1.00 0.00 H new ATOM 0 HA SER A 79 20.846 34.087 38.757 1.00 0.00 H new ATOM 0 HB2 SER A 79 21.314 32.903 35.961 1.00 0.00 H new ATOM 0 HB3 SER A 79 19.731 33.055 36.698 1.00 0.00 H new ATOM 0 HG SER A 79 20.226 34.841 35.302 1.00 0.00 H new ATOM 1329 N ILE A 80 22.198 31.156 38.259 1.00 0.00 N ATOM 1330 CA ILE A 80 22.170 29.735 38.630 1.00 0.00 C ATOM 1331 C ILE A 80 22.189 29.381 40.121 1.00 0.00 C ATOM 1332 O ILE A 80 22.886 30.001 40.924 1.00 0.00 O ATOM 1333 CB ILE A 80 23.349 28.988 37.974 1.00 0.00 C ATOM 1334 CG1 ILE A 80 23.369 29.246 36.467 1.00 0.00 C ATOM 1335 CG2 ILE A 80 23.258 27.497 38.260 1.00 0.00 C ATOM 1336 CD1 ILE A 80 24.505 28.554 35.747 1.00 0.00 C ATOM 0 H ILE A 80 23.016 31.422 37.711 1.00 0.00 H new ATOM 0 HA ILE A 80 21.190 29.425 38.267 1.00 0.00 H new ATOM 0 HB ILE A 80 24.279 29.363 38.401 1.00 0.00 H new ATOM 0 HG12 ILE A 80 22.423 28.915 36.038 1.00 0.00 H new ATOM 0 HG13 ILE A 80 23.440 30.320 36.292 1.00 0.00 H new ATOM 0 HG21 ILE A 80 24.097 26.984 37.790 1.00 0.00 H new ATOM 0 HG22 ILE A 80 23.288 27.331 39.337 1.00 0.00 H new ATOM 0 HG23 ILE A 80 22.323 27.106 37.858 1.00 0.00 H new ATOM 0 HD11 ILE A 80 24.454 28.783 34.683 1.00 0.00 H new ATOM 0 HD12 ILE A 80 25.456 28.903 36.148 1.00 0.00 H new ATOM 0 HD13 ILE A 80 24.424 27.477 35.890 1.00 0.00 H new ATOM 1348 N MET A 81 21.399 28.361 40.458 1.00 0.00 N ATOM 1349 CA MET A 81 21.266 27.840 41.813 1.00 0.00 C ATOM 1350 C MET A 81 21.206 26.317 41.797 1.00 0.00 C ATOM 1351 O MET A 81 20.854 25.707 40.787 1.00 0.00 O ATOM 1352 CB MET A 81 20.008 28.402 42.478 1.00 0.00 C ATOM 1353 CG MET A 81 20.021 29.913 42.652 1.00 0.00 C ATOM 1354 SD MET A 81 18.545 30.537 43.478 1.00 0.00 S ATOM 1355 CE MET A 81 18.925 32.284 43.576 1.00 0.00 C ATOM 1356 OXT MET A 81 21.509 25.659 42.792 1.00 0.00 O ATOM 0 H MET A 81 20.822 27.865 39.779 1.00 0.00 H new ATOM 0 HA MET A 81 22.140 28.151 42.386 1.00 0.00 H new ATOM 0 HB2 MET A 81 19.139 28.123 41.882 1.00 0.00 H new ATOM 0 HB3 MET A 81 19.887 27.935 43.456 1.00 0.00 H new ATOM 0 HG2 MET A 81 20.902 30.200 43.227 1.00 0.00 H new ATOM 0 HG3 MET A 81 20.111 30.386 41.674 1.00 0.00 H new ATOM 0 HE1 MET A 81 18.104 32.808 44.064 1.00 0.00 H new ATOM 0 HE2 MET A 81 19.839 32.426 44.152 1.00 0.00 H new ATOM 0 HE3 MET A 81 19.064 32.683 42.571 1.00 0.00 H new TER 1366 MET A 81