USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 706 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 20 LYS NZ :NH3+ -140:sc= 1.24 (180deg=0.335) USER MOD Set 1.2: A 88 THR OG1 : rot -83:sc= 1.26 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 40:sc= 0.0345 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 16:sc= 0.0363 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.0934 X(o=-0.093,f=-0.46) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HE2:sc= 0.619 K(o=0.62,f=-2.5!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.0358 K(o=-0.036,f=-1) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0.208 USER MOD Single : A 78 HIS : no HD1:sc= -0.12 K(o=-0.12,f=-0.9) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.0659 X(o=-0.066,f=-0.13) USER MOD Single : A 84 THR OG1 : rot 75:sc= 1.31 USER MOD Single : A 87 ASN : amide:sc= -0.0594 K(o=-0.059,f=-0.69) USER MOD Single : A 90 GLN : amide:sc= -0.0971 X(o=-0.097,f=-0.22) USER MOD Single : A 93 HIS :FLIP no HD1:sc= -0.408 F(o=-1.4,f=-0.41) USER MOD Single : A 98 LYS NZ :NH3+ 157:sc= 2.39 (180deg=2.08) USER MOD Single : A 100 GLN : amide:sc= -0.0275 K(o=-0.027,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 20.638 43.687 21.021 1.00 0.00 N ATOM 2 CA LYS A 9 21.955 43.656 20.465 1.00 0.00 C ATOM 3 C LYS A 9 22.596 42.312 20.475 1.00 0.00 C ATOM 4 O LYS A 9 23.255 42.033 19.474 1.00 0.00 O ATOM 5 CB LYS A 9 22.866 44.756 21.033 1.00 0.00 C ATOM 6 CG LYS A 9 22.861 46.057 20.228 1.00 0.00 C ATOM 7 CD LYS A 9 21.523 46.802 20.210 1.00 0.00 C ATOM 8 CE LYS A 9 21.440 47.928 19.178 1.00 0.00 C ATOM 9 NZ LYS A 9 22.300 49.077 19.537 1.00 0.00 N ATOM 0 HA LYS A 9 21.814 43.884 19.409 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.558 44.974 22.056 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.887 44.377 21.082 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.624 46.721 20.634 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.148 45.832 19.201 1.00 0.00 H new ATOM 0 HD2 LYS A 9 20.725 46.086 20.013 1.00 0.00 H new ATOM 0 HD3 LYS A 9 21.340 47.219 21.200 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.736 47.546 18.201 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.406 48.263 19.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.213 49.816 18.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.002 49.459 20.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 23.290 48.764 19.596 1.00 0.00 H new ATOM 23 N PRO A 10 22.521 41.432 21.428 1.00 0.00 N ATOM 24 CA PRO A 10 23.176 40.160 21.321 1.00 0.00 C ATOM 25 C PRO A 10 22.649 39.219 20.293 1.00 0.00 C ATOM 26 O PRO A 10 21.649 39.498 19.634 1.00 0.00 O ATOM 27 CB PRO A 10 22.997 39.541 22.706 1.00 0.00 C ATOM 28 CG PRO A 10 23.039 40.757 23.644 1.00 0.00 C ATOM 29 CD PRO A 10 22.257 41.788 22.814 1.00 0.00 C ATOM 0 HA PRO A 10 24.204 40.326 20.998 1.00 0.00 H new ATOM 0 HB2 PRO A 10 22.053 39.003 22.787 1.00 0.00 H new ATOM 0 HB3 PRO A 10 23.790 38.829 22.934 1.00 0.00 H new ATOM 0 HG2 PRO A 10 22.565 40.555 24.605 1.00 0.00 H new ATOM 0 HG3 PRO A 10 24.058 41.082 23.854 1.00 0.00 H new ATOM 0 HD2 PRO A 10 21.191 41.747 23.036 1.00 0.00 H new ATOM 0 HD3 PRO A 10 22.589 42.803 23.031 1.00 0.00 H new ATOM 37 N GLY A 11 23.289 38.045 20.150 1.00 0.00 N ATOM 38 CA GLY A 11 23.164 37.215 18.992 1.00 0.00 C ATOM 39 C GLY A 11 24.216 37.543 17.987 1.00 0.00 C ATOM 40 O GLY A 11 24.006 37.479 16.777 1.00 0.00 O ATOM 0 H GLY A 11 23.912 37.662 20.861 1.00 0.00 H new ATOM 0 HA2 GLY A 11 23.245 36.167 19.280 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.177 37.349 18.549 1.00 0.00 H new ATOM 44 N ASP A 12 25.405 37.943 18.470 1.00 0.00 N ATOM 45 CA ASP A 12 26.534 38.367 17.702 1.00 0.00 C ATOM 46 C ASP A 12 27.481 37.229 17.528 1.00 0.00 C ATOM 47 O ASP A 12 27.741 36.489 18.475 1.00 0.00 O ATOM 48 CB ASP A 12 27.150 39.544 18.477 1.00 0.00 C ATOM 49 CG ASP A 12 28.161 40.358 17.681 1.00 0.00 C ATOM 50 OD1 ASP A 12 27.977 40.524 16.447 1.00 0.00 O ATOM 51 OD2 ASP A 12 29.112 40.895 18.309 1.00 0.00 O ATOM 0 H ASP A 12 25.590 37.972 19.473 1.00 0.00 H new ATOM 0 HA ASP A 12 26.266 38.688 16.695 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.349 40.205 18.808 1.00 0.00 H new ATOM 0 HB3 ASP A 12 27.636 39.159 19.373 1.00 0.00 H new ATOM 56 N THR A 13 28.041 37.001 16.326 1.00 0.00 N ATOM 57 CA THR A 13 28.984 35.945 16.126 1.00 0.00 C ATOM 58 C THR A 13 30.390 36.430 16.226 1.00 0.00 C ATOM 59 O THR A 13 30.705 37.582 15.935 1.00 0.00 O ATOM 60 CB THR A 13 28.860 35.176 14.845 1.00 0.00 C ATOM 61 OG1 THR A 13 28.781 36.010 13.699 1.00 0.00 O ATOM 62 CG2 THR A 13 27.581 34.323 14.886 1.00 0.00 C ATOM 0 H THR A 13 27.840 37.550 15.490 1.00 0.00 H new ATOM 0 HA THR A 13 28.733 35.258 16.934 1.00 0.00 H new ATOM 0 HB THR A 13 29.759 34.566 14.763 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.703 35.455 12.895 1.00 0.00 H new ATOM 0 HG21 THR A 13 27.488 33.762 13.956 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.633 33.629 15.725 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.714 34.973 15.007 1.00 0.00 H new ATOM 70 N PHE A 14 31.308 35.521 16.599 1.00 0.00 N ATOM 71 CA PHE A 14 32.713 35.791 16.614 1.00 0.00 C ATOM 72 C PHE A 14 33.421 34.528 16.264 1.00 0.00 C ATOM 73 O PHE A 14 33.052 33.436 16.693 1.00 0.00 O ATOM 74 CB PHE A 14 33.215 36.421 17.923 1.00 0.00 C ATOM 75 CG PHE A 14 32.834 35.649 19.140 1.00 0.00 C ATOM 76 CD1 PHE A 14 31.642 35.865 19.790 1.00 0.00 C ATOM 77 CD2 PHE A 14 33.727 34.739 19.657 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.367 35.211 20.968 1.00 0.00 C ATOM 79 CE2 PHE A 14 33.473 34.103 20.849 1.00 0.00 C ATOM 80 CZ PHE A 14 32.301 34.364 21.518 1.00 0.00 C ATOM 0 H PHE A 14 31.069 34.575 16.897 1.00 0.00 H new ATOM 0 HA PHE A 14 32.933 36.558 15.872 1.00 0.00 H new ATOM 0 HB2 PHE A 14 34.301 36.507 17.882 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.818 37.433 18.005 1.00 0.00 H new ATOM 0 HD1 PHE A 14 30.919 36.551 19.374 1.00 0.00 H new ATOM 0 HD2 PHE A 14 34.638 34.522 19.120 1.00 0.00 H new ATOM 0 HE1 PHE A 14 30.418 35.362 21.461 1.00 0.00 H new ATOM 0 HE2 PHE A 14 34.188 33.404 21.256 1.00 0.00 H new ATOM 0 HZ PHE A 14 32.113 33.904 22.477 1.00 0.00 H new ATOM 90 N GLU A 15 34.460 34.614 15.413 1.00 0.00 N ATOM 91 CA GLU A 15 35.268 33.489 15.062 1.00 0.00 C ATOM 92 C GLU A 15 36.472 33.435 15.938 1.00 0.00 C ATOM 93 O GLU A 15 37.209 34.410 16.077 1.00 0.00 O ATOM 94 CB GLU A 15 35.738 33.443 13.598 1.00 0.00 C ATOM 95 CG GLU A 15 34.659 33.733 12.553 1.00 0.00 C ATOM 96 CD GLU A 15 34.508 35.225 12.296 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.532 35.887 11.979 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.376 35.770 12.392 1.00 0.00 O ATOM 0 H GLU A 15 34.744 35.483 14.960 1.00 0.00 H new ATOM 0 HA GLU A 15 34.614 32.628 15.203 1.00 0.00 H new ATOM 0 HB2 GLU A 15 36.546 34.163 13.471 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.156 32.456 13.399 1.00 0.00 H new ATOM 0 HG2 GLU A 15 34.911 33.227 11.621 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.707 33.324 12.891 1.00 0.00 H new ATOM 105 N VAL A 16 36.706 32.265 16.557 1.00 0.00 N ATOM 106 CA VAL A 16 37.794 32.023 17.454 1.00 0.00 C ATOM 107 C VAL A 16 38.679 31.015 16.805 1.00 0.00 C ATOM 108 O VAL A 16 38.538 29.803 16.957 1.00 0.00 O ATOM 109 CB VAL A 16 37.286 31.715 18.832 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.229 30.862 19.697 1.00 0.00 C ATOM 111 CG2 VAL A 16 37.083 33.061 19.548 1.00 0.00 C ATOM 0 H VAL A 16 36.109 31.449 16.426 1.00 0.00 H new ATOM 0 HA VAL A 16 38.416 32.900 17.632 1.00 0.00 H new ATOM 0 HB VAL A 16 36.374 31.130 18.710 1.00 0.00 H new ATOM 0 HG11 VAL A 16 37.774 30.693 20.673 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.404 29.904 19.208 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.178 31.383 19.824 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.713 32.884 20.558 1.00 0.00 H new ATOM 0 HG22 VAL A 16 38.033 33.593 19.598 1.00 0.00 H new ATOM 0 HG23 VAL A 16 36.359 33.661 18.996 1.00 0.00 H new ATOM 121 N GLU A 17 39.648 31.491 16.003 1.00 0.00 N ATOM 122 CA GLU A 17 40.721 30.705 15.479 1.00 0.00 C ATOM 123 C GLU A 17 41.871 30.859 16.415 1.00 0.00 C ATOM 124 O GLU A 17 42.766 31.674 16.195 1.00 0.00 O ATOM 125 CB GLU A 17 41.224 31.178 14.105 1.00 0.00 C ATOM 126 CG GLU A 17 40.432 30.693 12.889 1.00 0.00 C ATOM 127 CD GLU A 17 41.067 31.199 11.602 1.00 0.00 C ATOM 128 OE1 GLU A 17 42.244 31.650 11.628 1.00 0.00 O ATOM 129 OE2 GLU A 17 40.401 31.133 10.535 1.00 0.00 O ATOM 0 H GLU A 17 39.685 32.466 15.707 1.00 0.00 H new ATOM 0 HA GLU A 17 40.352 29.685 15.372 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.227 32.268 14.099 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.259 30.856 13.990 1.00 0.00 H new ATOM 0 HG2 GLU A 17 40.398 29.604 12.881 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.402 31.043 12.955 1.00 0.00 H new ATOM 136 N LEU A 18 41.882 30.068 17.502 1.00 0.00 N ATOM 137 CA LEU A 18 42.916 30.162 18.486 1.00 0.00 C ATOM 138 C LEU A 18 43.813 28.972 18.442 1.00 0.00 C ATOM 139 O LEU A 18 43.502 27.924 17.877 1.00 0.00 O ATOM 140 CB LEU A 18 42.399 30.589 19.869 1.00 0.00 C ATOM 141 CG LEU A 18 41.424 29.652 20.602 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.093 28.314 20.962 1.00 0.00 C ATOM 143 CD2 LEU A 18 40.962 30.389 21.869 1.00 0.00 C ATOM 0 H LEU A 18 41.173 29.362 17.700 1.00 0.00 H new ATOM 0 HA LEU A 18 43.567 30.996 18.226 1.00 0.00 H new ATOM 0 HB2 LEU A 18 43.264 30.741 20.515 1.00 0.00 H new ATOM 0 HB3 LEU A 18 41.910 31.557 19.757 1.00 0.00 H new ATOM 0 HG LEU A 18 40.577 29.410 19.960 1.00 0.00 H new ATOM 0 HD11 LEU A 18 41.376 27.676 21.479 1.00 0.00 H new ATOM 0 HD12 LEU A 18 42.429 27.818 20.051 1.00 0.00 H new ATOM 0 HD13 LEU A 18 42.949 28.498 21.612 1.00 0.00 H new ATOM 0 HD21 LEU A 18 40.266 29.759 22.423 1.00 0.00 H new ATOM 0 HD22 LEU A 18 41.826 30.613 22.495 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.466 31.318 21.589 1.00 0.00 H new ATOM 155 N ALA A 19 45.005 29.102 19.051 1.00 0.00 N ATOM 156 CA ALA A 19 45.973 28.059 19.176 1.00 0.00 C ATOM 157 C ALA A 19 45.898 27.528 20.566 1.00 0.00 C ATOM 158 O ALA A 19 45.814 28.278 21.538 1.00 0.00 O ATOM 159 CB ALA A 19 47.376 28.591 18.841 1.00 0.00 C ATOM 0 H ALA A 19 45.308 29.978 19.477 1.00 0.00 H new ATOM 0 HA ALA A 19 45.766 27.252 18.473 1.00 0.00 H new ATOM 0 HB1 ALA A 19 48.104 27.786 18.940 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.388 28.967 17.818 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.632 29.398 19.527 1.00 0.00 H new ATOM 165 N LYS A 20 45.878 26.193 20.731 1.00 0.00 N ATOM 166 CA LYS A 20 45.785 25.586 22.022 1.00 0.00 C ATOM 167 C LYS A 20 47.035 25.752 22.817 1.00 0.00 C ATOM 168 O LYS A 20 48.119 25.365 22.382 1.00 0.00 O ATOM 169 CB LYS A 20 45.413 24.102 21.864 1.00 0.00 C ATOM 170 CG LYS A 20 44.821 23.486 23.134 1.00 0.00 C ATOM 171 CD LYS A 20 44.595 21.975 23.047 1.00 0.00 C ATOM 172 CE LYS A 20 43.611 21.514 21.969 1.00 0.00 C ATOM 173 NZ LYS A 20 43.518 20.037 21.991 1.00 0.00 N ATOM 0 H LYS A 20 45.927 25.527 19.960 1.00 0.00 H new ATOM 0 HA LYS A 20 45.000 26.095 22.582 1.00 0.00 H new ATOM 0 HB2 LYS A 20 44.695 24.000 21.050 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.302 23.541 21.577 1.00 0.00 H new ATOM 0 HG2 LYS A 20 45.487 23.696 23.971 1.00 0.00 H new ATOM 0 HG3 LYS A 20 43.871 23.973 23.353 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.555 21.492 22.867 1.00 0.00 H new ATOM 0 HD3 LYS A 20 44.237 21.623 24.015 1.00 0.00 H new ATOM 0 HE2 LYS A 20 42.629 21.954 22.144 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.943 21.854 20.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 43.474 19.677 21.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 44.355 19.644 22.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 42.660 19.751 22.505 1.00 0.00 H new ATOM 187 N THR A 21 46.955 26.368 24.009 1.00 0.00 N ATOM 188 CA THR A 21 48.100 26.692 24.803 1.00 0.00 C ATOM 189 C THR A 21 48.351 25.614 25.801 1.00 0.00 C ATOM 190 O THR A 21 47.498 25.279 26.622 1.00 0.00 O ATOM 191 CB THR A 21 48.030 28.022 25.493 1.00 0.00 C ATOM 192 OG1 THR A 21 46.829 28.204 26.227 1.00 0.00 O ATOM 193 CG2 THR A 21 48.066 29.135 24.431 1.00 0.00 C ATOM 0 H THR A 21 46.071 26.649 24.433 1.00 0.00 H new ATOM 0 HA THR A 21 48.930 26.769 24.100 1.00 0.00 H new ATOM 0 HB THR A 21 48.874 28.060 26.181 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.591 27.367 26.678 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.016 30.107 24.921 1.00 0.00 H new ATOM 0 HG22 THR A 21 48.992 29.064 23.861 1.00 0.00 H new ATOM 0 HG23 THR A 21 47.216 29.023 23.758 1.00 0.00 H new ATOM 201 N ASP A 22 49.537 24.985 25.725 1.00 0.00 N ATOM 202 CA ASP A 22 50.038 23.980 26.611 1.00 0.00 C ATOM 203 C ASP A 22 49.246 22.721 26.701 1.00 0.00 C ATOM 204 O ASP A 22 49.515 21.839 27.515 1.00 0.00 O ATOM 205 CB ASP A 22 50.329 24.639 27.971 1.00 0.00 C ATOM 206 CG ASP A 22 51.470 23.976 28.728 1.00 0.00 C ATOM 207 OD1 ASP A 22 52.607 23.921 28.188 1.00 0.00 O ATOM 208 OD2 ASP A 22 51.254 23.534 29.889 1.00 0.00 O ATOM 0 H ASP A 22 50.200 25.199 24.980 1.00 0.00 H new ATOM 0 HA ASP A 22 50.963 23.598 26.178 1.00 0.00 H new ATOM 0 HB2 ASP A 22 50.569 25.691 27.814 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.428 24.606 28.583 1.00 0.00 H new ATOM 213 N GLY A 23 48.225 22.554 25.842 1.00 0.00 N ATOM 214 CA GLY A 23 47.338 21.433 25.826 1.00 0.00 C ATOM 215 C GLY A 23 45.962 21.716 26.324 1.00 0.00 C ATOM 216 O GLY A 23 45.145 20.797 26.368 1.00 0.00 O ATOM 0 H GLY A 23 48.007 23.239 25.119 1.00 0.00 H new ATOM 0 HA2 GLY A 23 47.269 21.057 24.805 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.771 20.636 26.431 1.00 0.00 H new ATOM 220 N SER A 24 45.628 22.964 26.700 1.00 0.00 N ATOM 221 CA SER A 24 44.308 23.325 27.118 1.00 0.00 C ATOM 222 C SER A 24 43.706 24.412 26.296 1.00 0.00 C ATOM 223 O SER A 24 44.291 25.472 26.076 1.00 0.00 O ATOM 224 CB SER A 24 44.215 23.821 28.571 1.00 0.00 C ATOM 225 OG SER A 24 44.482 22.778 29.496 1.00 0.00 O ATOM 0 H SER A 24 46.290 23.740 26.714 1.00 0.00 H new ATOM 0 HA SER A 24 43.770 22.385 27.000 1.00 0.00 H new ATOM 0 HB2 SER A 24 44.924 24.635 28.725 1.00 0.00 H new ATOM 0 HB3 SER A 24 43.220 24.226 28.755 1.00 0.00 H new ATOM 0 HG SER A 24 44.417 23.126 30.410 1.00 0.00 H new ATOM 231 N LEU A 25 42.452 24.215 25.853 1.00 0.00 N ATOM 232 CA LEU A 25 41.618 25.256 25.336 1.00 0.00 C ATOM 233 C LEU A 25 41.117 26.142 26.423 1.00 0.00 C ATOM 234 O LEU A 25 41.132 27.367 26.304 1.00 0.00 O ATOM 235 CB LEU A 25 40.405 24.688 24.579 1.00 0.00 C ATOM 236 CG LEU A 25 40.744 24.009 23.243 1.00 0.00 C ATOM 237 CD1 LEU A 25 39.512 23.273 22.687 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.259 25.019 22.203 1.00 0.00 C ATOM 0 H LEU A 25 42.002 23.299 25.855 1.00 0.00 H new ATOM 0 HA LEU A 25 42.239 25.831 24.649 1.00 0.00 H new ATOM 0 HB2 LEU A 25 39.899 23.966 25.220 1.00 0.00 H new ATOM 0 HB3 LEU A 25 39.699 25.497 24.391 1.00 0.00 H new ATOM 0 HG LEU A 25 41.540 23.290 23.437 1.00 0.00 H new ATOM 0 HD11 LEU A 25 39.769 22.797 21.740 1.00 0.00 H new ATOM 0 HD12 LEU A 25 39.190 22.513 23.399 1.00 0.00 H new ATOM 0 HD13 LEU A 25 38.704 23.986 22.527 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.487 24.499 21.273 1.00 0.00 H new ATOM 0 HD22 LEU A 25 40.494 25.773 22.019 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.161 25.501 22.580 1.00 0.00 H new ATOM 250 N GLY A 26 40.656 25.587 27.558 1.00 0.00 N ATOM 251 CA GLY A 26 40.153 26.302 28.689 1.00 0.00 C ATOM 252 C GLY A 26 38.688 26.098 28.863 1.00 0.00 C ATOM 253 O GLY A 26 37.997 26.981 29.368 1.00 0.00 O ATOM 0 H GLY A 26 40.634 24.576 27.693 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.675 25.975 29.588 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.361 27.365 28.569 1.00 0.00 H new ATOM 257 N ILE A 27 38.155 24.933 28.450 1.00 0.00 N ATOM 258 CA ILE A 27 36.755 24.754 28.222 1.00 0.00 C ATOM 259 C ILE A 27 36.069 23.926 29.253 1.00 0.00 C ATOM 260 O ILE A 27 36.539 22.872 29.677 1.00 0.00 O ATOM 261 CB ILE A 27 36.528 24.161 26.862 1.00 0.00 C ATOM 262 CG1 ILE A 27 37.340 22.878 26.623 1.00 0.00 C ATOM 263 CG2 ILE A 27 36.857 25.244 25.821 1.00 0.00 C ATOM 264 CD1 ILE A 27 36.934 22.125 25.356 1.00 0.00 C ATOM 0 H ILE A 27 38.711 24.097 28.271 1.00 0.00 H new ATOM 0 HA ILE A 27 36.313 25.748 28.288 1.00 0.00 H new ATOM 0 HB ILE A 27 35.486 23.852 26.776 1.00 0.00 H new ATOM 0 HG12 ILE A 27 38.398 23.134 26.561 1.00 0.00 H new ATOM 0 HG13 ILE A 27 37.222 22.218 27.482 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.702 24.844 24.819 1.00 0.00 H new ATOM 0 HG22 ILE A 27 36.206 26.105 25.973 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.897 25.552 25.932 1.00 0.00 H new ATOM 0 HD11 ILE A 27 37.549 21.231 25.251 1.00 0.00 H new ATOM 0 HD12 ILE A 27 35.885 21.838 25.424 1.00 0.00 H new ATOM 0 HD13 ILE A 27 37.079 22.768 24.488 1.00 0.00 H new ATOM 276 N SER A 28 34.888 24.366 29.721 1.00 0.00 N ATOM 277 CA SER A 28 33.909 23.489 30.284 1.00 0.00 C ATOM 278 C SER A 28 32.584 23.782 29.667 1.00 0.00 C ATOM 279 O SER A 28 31.988 24.826 29.926 1.00 0.00 O ATOM 280 CB SER A 28 33.802 23.602 31.814 1.00 0.00 C ATOM 281 OG SER A 28 34.896 22.938 32.429 1.00 0.00 O ATOM 0 H SER A 28 34.608 25.347 29.708 1.00 0.00 H new ATOM 0 HA SER A 28 34.225 22.469 30.068 1.00 0.00 H new ATOM 0 HB2 SER A 28 33.791 24.651 32.109 1.00 0.00 H new ATOM 0 HB3 SER A 28 32.863 23.165 32.154 1.00 0.00 H new ATOM 0 HG SER A 28 35.598 22.779 31.764 1.00 0.00 H new ATOM 287 N VAL A 29 32.066 22.870 28.826 1.00 0.00 N ATOM 288 CA VAL A 29 30.826 23.043 28.133 1.00 0.00 C ATOM 289 C VAL A 29 29.707 22.315 28.794 1.00 0.00 C ATOM 290 O VAL A 29 29.902 21.447 29.643 1.00 0.00 O ATOM 291 CB VAL A 29 30.898 22.666 26.683 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.929 23.575 25.992 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.225 21.176 26.482 1.00 0.00 C ATOM 0 H VAL A 29 32.525 21.982 28.621 1.00 0.00 H new ATOM 0 HA VAL A 29 30.623 24.113 28.181 1.00 0.00 H new ATOM 0 HB VAL A 29 29.918 22.814 26.229 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.994 23.314 24.936 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.620 24.616 26.090 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.904 23.440 26.460 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.266 20.953 25.416 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.189 20.951 26.937 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.452 20.567 26.950 1.00 0.00 H new ATOM 303 N THR A 30 28.462 22.675 28.432 1.00 0.00 N ATOM 304 CA THR A 30 27.260 22.036 28.871 1.00 0.00 C ATOM 305 C THR A 30 26.272 22.082 27.756 1.00 0.00 C ATOM 306 O THR A 30 26.495 22.733 26.738 1.00 0.00 O ATOM 307 CB THR A 30 26.697 22.665 30.110 1.00 0.00 C ATOM 308 OG1 THR A 30 25.715 21.856 30.741 1.00 0.00 O ATOM 309 CG2 THR A 30 26.085 24.054 29.863 1.00 0.00 C ATOM 0 H THR A 30 28.285 23.455 27.798 1.00 0.00 H new ATOM 0 HA THR A 30 27.488 21.003 29.134 1.00 0.00 H new ATOM 0 HB THR A 30 27.561 22.769 30.767 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.382 22.311 31.543 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.696 24.452 30.800 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.851 24.725 29.474 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.274 23.971 29.140 1.00 0.00 H new ATOM 317 N GLY A 31 25.120 21.403 27.899 1.00 0.00 N ATOM 318 CA GLY A 31 24.071 21.429 26.928 1.00 0.00 C ATOM 319 C GLY A 31 24.110 20.298 25.959 1.00 0.00 C ATOM 320 O GLY A 31 24.922 19.380 26.060 1.00 0.00 O ATOM 0 H GLY A 31 24.913 20.821 28.711 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.112 21.417 27.445 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.124 22.368 26.377 1.00 0.00 H new ATOM 324 N GLY A 32 23.190 20.347 24.978 1.00 0.00 N ATOM 325 CA GLY A 32 22.939 19.293 24.043 1.00 0.00 C ATOM 326 C GLY A 32 21.504 19.340 23.646 1.00 0.00 C ATOM 327 O GLY A 32 20.740 20.171 24.134 1.00 0.00 O ATOM 0 H GLY A 32 22.593 21.160 24.830 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.578 19.405 23.167 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.176 18.327 24.489 1.00 0.00 H new ATOM 331 N VAL A 33 21.075 18.455 22.729 1.00 0.00 N ATOM 332 CA VAL A 33 19.761 18.471 22.166 1.00 0.00 C ATOM 333 C VAL A 33 18.705 17.896 23.048 1.00 0.00 C ATOM 334 O VAL A 33 17.606 18.439 23.150 1.00 0.00 O ATOM 335 CB VAL A 33 19.759 17.881 20.786 1.00 0.00 C ATOM 336 CG1 VAL A 33 19.992 16.361 20.773 1.00 0.00 C ATOM 337 CG2 VAL A 33 18.472 18.273 20.041 1.00 0.00 C ATOM 0 H VAL A 33 21.662 17.703 22.367 1.00 0.00 H new ATOM 0 HA VAL A 33 19.482 19.521 22.079 1.00 0.00 H new ATOM 0 HB VAL A 33 20.611 18.305 20.255 1.00 0.00 H new ATOM 0 HG11 VAL A 33 19.978 16.000 19.745 1.00 0.00 H new ATOM 0 HG12 VAL A 33 20.959 16.137 21.224 1.00 0.00 H new ATOM 0 HG13 VAL A 33 19.204 15.867 21.342 1.00 0.00 H new ATOM 0 HG21 VAL A 33 18.484 17.839 19.041 1.00 0.00 H new ATOM 0 HG22 VAL A 33 17.607 17.900 20.589 1.00 0.00 H new ATOM 0 HG23 VAL A 33 18.412 19.359 19.964 1.00 0.00 H new ATOM 347 N ASN A 34 18.968 16.775 23.741 1.00 0.00 N ATOM 348 CA ASN A 34 18.039 16.152 24.633 1.00 0.00 C ATOM 349 C ASN A 34 18.318 16.524 26.048 1.00 0.00 C ATOM 350 O ASN A 34 17.732 15.994 26.992 1.00 0.00 O ATOM 351 CB ASN A 34 18.062 14.631 24.404 1.00 0.00 C ATOM 352 CG ASN A 34 16.838 13.952 25.002 1.00 0.00 C ATOM 353 OD1 ASN A 34 15.702 14.396 24.841 1.00 0.00 O ATOM 354 ND2 ASN A 34 17.062 12.820 25.721 1.00 0.00 N ATOM 0 H ASN A 34 19.860 16.284 23.679 1.00 0.00 H new ATOM 0 HA ASN A 34 17.032 16.511 24.423 1.00 0.00 H new ATOM 0 HB2 ASN A 34 18.106 14.425 23.335 1.00 0.00 H new ATOM 0 HB3 ASN A 34 18.964 14.210 24.847 1.00 0.00 H new ATOM 0 HD21 ASN A 34 16.279 12.319 26.141 1.00 0.00 H new ATOM 0 HD22 ASN A 34 18.013 12.472 25.840 1.00 0.00 H new ATOM 361 N THR A 35 19.246 17.473 26.260 1.00 0.00 N ATOM 362 CA THR A 35 19.692 17.944 27.535 1.00 0.00 C ATOM 363 C THR A 35 18.751 18.992 28.022 1.00 0.00 C ATOM 364 O THR A 35 18.038 19.610 27.233 1.00 0.00 O ATOM 365 CB THR A 35 21.078 18.509 27.434 1.00 0.00 C ATOM 366 OG1 THR A 35 21.915 17.623 26.706 1.00 0.00 O ATOM 367 CG2 THR A 35 21.767 18.726 28.791 1.00 0.00 C ATOM 0 H THR A 35 19.717 17.943 25.487 1.00 0.00 H new ATOM 0 HA THR A 35 19.713 17.110 28.237 1.00 0.00 H new ATOM 0 HB THR A 35 20.950 19.474 26.943 1.00 0.00 H new ATOM 0 HG1 THR A 35 22.817 18.002 26.644 1.00 0.00 H new ATOM 0 HG21 THR A 35 22.764 19.136 28.631 1.00 0.00 H new ATOM 0 HG22 THR A 35 21.180 19.422 29.390 1.00 0.00 H new ATOM 0 HG23 THR A 35 21.846 17.774 29.315 1.00 0.00 H new ATOM 375 N SER A 36 18.695 19.262 29.338 1.00 0.00 N ATOM 376 CA SER A 36 17.837 20.217 29.970 1.00 0.00 C ATOM 377 C SER A 36 18.213 21.648 29.789 1.00 0.00 C ATOM 378 O SER A 36 18.190 22.473 30.701 1.00 0.00 O ATOM 379 CB SER A 36 17.622 19.901 31.460 1.00 0.00 C ATOM 380 OG SER A 36 18.849 19.740 32.159 1.00 0.00 O ATOM 0 H SER A 36 19.292 18.778 30.008 1.00 0.00 H new ATOM 0 HA SER A 36 16.895 20.102 29.434 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.047 20.704 31.920 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.030 18.991 31.554 1.00 0.00 H new ATOM 0 HG SER A 36 18.665 19.542 33.101 1.00 0.00 H new ATOM 386 N VAL A 37 18.500 22.024 28.530 1.00 0.00 N ATOM 387 CA VAL A 37 18.522 23.359 28.020 1.00 0.00 C ATOM 388 C VAL A 37 17.165 23.634 27.468 1.00 0.00 C ATOM 389 O VAL A 37 16.276 22.788 27.550 1.00 0.00 O ATOM 390 CB VAL A 37 19.591 23.551 26.986 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.963 23.404 27.663 1.00 0.00 C ATOM 392 CG2 VAL A 37 19.448 22.551 25.826 1.00 0.00 C ATOM 0 H VAL A 37 18.735 21.338 27.813 1.00 0.00 H new ATOM 0 HA VAL A 37 18.763 24.063 28.816 1.00 0.00 H new ATOM 0 HB VAL A 37 19.492 24.548 26.557 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.751 23.541 26.922 1.00 0.00 H new ATOM 0 HG12 VAL A 37 21.065 24.156 28.445 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.047 22.410 28.102 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.241 22.723 25.098 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.523 21.534 26.211 1.00 0.00 H new ATOM 0 HG23 VAL A 37 18.479 22.687 25.346 1.00 0.00 H new ATOM 402 N ARG A 38 16.908 24.818 26.885 1.00 0.00 N ATOM 403 CA ARG A 38 15.598 25.164 26.426 1.00 0.00 C ATOM 404 C ARG A 38 15.154 24.385 25.236 1.00 0.00 C ATOM 405 O ARG A 38 14.089 23.770 25.253 1.00 0.00 O ATOM 406 CB ARG A 38 15.484 26.671 26.140 1.00 0.00 C ATOM 407 CG ARG A 38 15.697 27.528 27.389 1.00 0.00 C ATOM 408 CD ARG A 38 15.375 29.012 27.204 1.00 0.00 C ATOM 409 NE ARG A 38 16.321 29.563 26.194 1.00 0.00 N ATOM 410 CZ ARG A 38 17.040 30.717 26.324 1.00 0.00 C ATOM 411 NH1 ARG A 38 17.159 31.414 27.490 1.00 0.00 N ATOM 412 NH2 ARG A 38 17.658 31.216 25.214 1.00 0.00 N ATOM 0 H ARG A 38 17.612 25.540 26.731 1.00 0.00 H new ATOM 0 HA ARG A 38 14.928 24.899 27.244 1.00 0.00 H new ATOM 0 HB2 ARG A 38 16.218 26.949 25.384 1.00 0.00 H new ATOM 0 HB3 ARG A 38 14.500 26.884 25.722 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.078 27.133 28.195 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.735 27.432 27.707 1.00 0.00 H new ATOM 0 HD2 ARG A 38 14.345 29.140 26.872 1.00 0.00 H new ATOM 0 HD3 ARG A 38 15.474 29.545 28.150 1.00 0.00 H new ATOM 0 HE ARG A 38 16.442 29.033 25.331 1.00 0.00 H new ATOM 0 HH11 ARG A 38 16.695 31.079 28.334 1.00 0.00 H new ATOM 0 HH12 ARG A 38 17.712 32.270 27.518 1.00 0.00 H new ATOM 0 HH21 ARG A 38 17.575 30.729 24.322 1.00 0.00 H new ATOM 0 HH22 ARG A 38 18.203 32.076 25.277 1.00 0.00 H new ATOM 426 N HIS A 39 15.955 24.372 24.156 1.00 0.00 N ATOM 427 CA HIS A 39 15.600 23.737 22.924 1.00 0.00 C ATOM 428 C HIS A 39 16.649 22.806 22.422 1.00 0.00 C ATOM 429 O HIS A 39 16.357 21.697 21.978 1.00 0.00 O ATOM 430 CB HIS A 39 15.331 24.808 21.853 1.00 0.00 C ATOM 431 CG HIS A 39 14.425 24.318 20.764 1.00 0.00 C ATOM 432 ND1 HIS A 39 13.105 23.979 20.975 1.00 0.00 N ATOM 433 CD2 HIS A 39 14.653 24.102 19.441 1.00 0.00 C ATOM 434 CE1 HIS A 39 12.600 23.574 19.778 1.00 0.00 C ATOM 435 NE2 HIS A 39 13.504 23.655 18.820 1.00 0.00 N ATOM 0 H HIS A 39 16.874 24.814 24.138 1.00 0.00 H new ATOM 0 HA HIS A 39 14.706 23.145 23.122 1.00 0.00 H new ATOM 0 HB2 HIS A 39 14.886 25.684 22.324 1.00 0.00 H new ATOM 0 HB3 HIS A 39 16.278 25.127 21.417 1.00 0.00 H new ATOM 0 HD2 HIS A 39 15.600 24.258 18.946 1.00 0.00 H new ATOM 0 HE1 HIS A 39 11.587 23.230 19.631 1.00 0.00 H new ATOM 0 HE2 HIS A 39 13.380 23.434 17.832 1.00 0.00 H new ATOM 443 N GLY A 40 17.926 23.227 22.441 1.00 0.00 N ATOM 444 CA GLY A 40 19.001 22.427 21.942 1.00 0.00 C ATOM 445 C GLY A 40 20.175 23.262 21.566 1.00 0.00 C ATOM 446 O GLY A 40 20.343 23.644 20.408 1.00 0.00 O ATOM 0 H GLY A 40 18.216 24.134 22.807 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.297 21.701 22.699 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.662 21.862 21.074 1.00 0.00 H new ATOM 450 N GLY A 41 21.048 23.572 22.541 1.00 0.00 N ATOM 451 CA GLY A 41 22.258 24.302 22.318 1.00 0.00 C ATOM 452 C GLY A 41 23.358 23.816 23.198 1.00 0.00 C ATOM 453 O GLY A 41 23.107 23.244 24.257 1.00 0.00 O ATOM 0 H GLY A 41 20.908 23.306 23.516 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.556 24.205 21.274 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.084 25.362 22.503 1.00 0.00 H new ATOM 457 N ILE A 42 24.614 24.036 22.767 1.00 0.00 N ATOM 458 CA ILE A 42 25.812 23.744 23.491 1.00 0.00 C ATOM 459 C ILE A 42 26.323 25.028 24.046 1.00 0.00 C ATOM 460 O ILE A 42 26.548 25.978 23.298 1.00 0.00 O ATOM 461 CB ILE A 42 26.863 23.130 22.614 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.357 21.885 21.866 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.129 22.803 23.423 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.072 20.674 22.751 1.00 0.00 C ATOM 0 H ILE A 42 24.803 24.445 21.852 1.00 0.00 H new ATOM 0 HA ILE A 42 25.586 23.024 24.278 1.00 0.00 H new ATOM 0 HB ILE A 42 27.113 23.873 21.857 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.445 22.147 21.330 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.097 21.603 21.117 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.876 22.359 22.765 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.528 23.718 23.860 1.00 0.00 H new ATOM 0 HG23 ILE A 42 27.881 22.100 24.218 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.720 19.847 22.134 1.00 0.00 H new ATOM 0 HD12 ILE A 42 26.985 20.378 23.268 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.307 20.931 23.484 1.00 0.00 H new ATOM 476 N TYR A 43 26.516 25.132 25.373 1.00 0.00 N ATOM 477 CA TYR A 43 26.803 26.374 26.020 1.00 0.00 C ATOM 478 C TYR A 43 28.065 26.295 26.808 1.00 0.00 C ATOM 479 O TYR A 43 28.485 25.233 27.267 1.00 0.00 O ATOM 480 CB TYR A 43 25.691 26.794 26.996 1.00 0.00 C ATOM 481 CG TYR A 43 24.424 27.067 26.261 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.231 28.277 25.638 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.435 26.113 26.207 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.056 28.541 24.976 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.256 26.369 25.546 1.00 0.00 C ATOM 486 CZ TYR A 43 22.067 27.587 24.937 1.00 0.00 C ATOM 487 OH TYR A 43 20.841 27.848 24.289 1.00 0.00 O ATOM 0 H TYR A 43 26.472 24.336 26.010 1.00 0.00 H new ATOM 0 HA TYR A 43 26.890 27.106 25.217 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.529 26.006 27.732 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.998 27.684 27.545 1.00 0.00 H new ATOM 0 HD1 TYR A 43 25.009 29.026 25.669 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.585 25.157 26.686 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.910 29.494 24.489 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.482 25.617 25.506 1.00 0.00 H new ATOM 0 HH TYR A 43 20.260 27.062 24.359 1.00 0.00 H new ATOM 497 N VAL A 44 28.718 27.450 27.031 1.00 0.00 N ATOM 498 CA VAL A 44 29.818 27.586 27.934 1.00 0.00 C ATOM 499 C VAL A 44 29.344 27.602 29.346 1.00 0.00 C ATOM 500 O VAL A 44 28.578 28.486 29.726 1.00 0.00 O ATOM 501 CB VAL A 44 30.620 28.821 27.650 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.802 28.959 28.625 1.00 0.00 C ATOM 503 CG2 VAL A 44 31.134 28.748 26.203 1.00 0.00 C ATOM 0 H VAL A 44 28.470 28.322 26.564 1.00 0.00 H new ATOM 0 HA VAL A 44 30.465 26.721 27.785 1.00 0.00 H new ATOM 0 HB VAL A 44 29.984 29.696 27.782 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.362 29.864 28.392 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.426 29.018 29.646 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.456 28.092 28.529 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.720 29.640 25.980 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.759 27.863 26.083 1.00 0.00 H new ATOM 0 HG23 VAL A 44 30.288 28.689 25.519 1.00 0.00 H new ATOM 513 N LYS A 45 29.764 26.650 30.199 1.00 0.00 N ATOM 514 CA LYS A 45 29.447 26.691 31.593 1.00 0.00 C ATOM 515 C LYS A 45 30.531 27.313 32.405 1.00 0.00 C ATOM 516 O LYS A 45 30.243 28.026 33.365 1.00 0.00 O ATOM 517 CB LYS A 45 28.968 25.364 32.203 1.00 0.00 C ATOM 518 CG LYS A 45 29.955 24.201 32.329 1.00 0.00 C ATOM 519 CD LYS A 45 29.470 23.192 33.372 1.00 0.00 C ATOM 520 CE LYS A 45 30.372 21.974 33.577 1.00 0.00 C ATOM 521 NZ LYS A 45 30.041 21.330 34.868 1.00 0.00 N ATOM 0 H LYS A 45 30.327 25.846 29.920 1.00 0.00 H new ATOM 0 HA LYS A 45 28.574 27.342 31.638 1.00 0.00 H new ATOM 0 HB2 LYS A 45 28.587 25.580 33.201 1.00 0.00 H new ATOM 0 HB3 LYS A 45 28.124 25.015 31.608 1.00 0.00 H new ATOM 0 HG2 LYS A 45 30.069 23.708 31.364 1.00 0.00 H new ATOM 0 HG3 LYS A 45 30.937 24.580 32.611 1.00 0.00 H new ATOM 0 HD2 LYS A 45 29.361 23.706 34.327 1.00 0.00 H new ATOM 0 HD3 LYS A 45 28.479 22.844 33.082 1.00 0.00 H new ATOM 0 HE2 LYS A 45 30.237 21.266 32.759 1.00 0.00 H new ATOM 0 HE3 LYS A 45 31.419 22.277 33.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 30.653 20.501 35.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 30.191 22.008 35.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 29.046 21.028 34.860 1.00 0.00 H new ATOM 535 N ALA A 46 31.814 27.093 32.068 1.00 0.00 N ATOM 536 CA ALA A 46 32.895 27.711 32.771 1.00 0.00 C ATOM 537 C ALA A 46 34.104 27.792 31.904 1.00 0.00 C ATOM 538 O ALA A 46 34.221 27.083 30.906 1.00 0.00 O ATOM 539 CB ALA A 46 33.234 26.949 34.065 1.00 0.00 C ATOM 0 H ALA A 46 32.104 26.483 31.304 1.00 0.00 H new ATOM 0 HA ALA A 46 32.577 28.718 33.040 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.060 27.446 34.574 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.361 26.934 34.718 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.521 25.926 33.820 1.00 0.00 H new ATOM 545 N ILE A 47 35.051 28.677 32.265 1.00 0.00 N ATOM 546 CA ILE A 47 36.291 28.858 31.578 1.00 0.00 C ATOM 547 C ILE A 47 37.416 28.580 32.515 1.00 0.00 C ATOM 548 O ILE A 47 37.454 29.070 33.642 1.00 0.00 O ATOM 549 CB ILE A 47 36.328 30.176 30.865 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.833 30.039 29.418 1.00 0.00 C ATOM 551 CG2 ILE A 47 37.107 31.280 31.600 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.840 29.371 28.468 1.00 0.00 C ATOM 0 H ILE A 47 34.947 29.293 33.071 1.00 0.00 H new ATOM 0 HA ILE A 47 36.403 28.136 30.769 1.00 0.00 H new ATOM 0 HB ILE A 47 35.287 30.498 30.848 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.075 31.030 29.034 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.759 29.464 29.421 1.00 0.00 H new ATOM 0 HG21 ILE A 47 37.081 32.197 31.012 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.651 31.460 32.574 1.00 0.00 H new ATOM 0 HG23 ILE A 47 38.142 30.966 31.737 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.274 29.314 27.470 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.616 28.366 28.824 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.921 29.956 28.431 1.00 0.00 H new ATOM 564 N ILE A 48 38.340 27.675 32.144 1.00 0.00 N ATOM 565 CA ILE A 48 39.454 27.226 32.920 1.00 0.00 C ATOM 566 C ILE A 48 40.595 28.183 32.964 1.00 0.00 C ATOM 567 O ILE A 48 41.090 28.493 31.881 1.00 0.00 O ATOM 568 CB ILE A 48 39.994 25.904 32.463 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.857 24.904 32.191 1.00 0.00 C ATOM 570 CG2 ILE A 48 41.008 25.328 33.466 1.00 0.00 C ATOM 571 CD1 ILE A 48 38.076 24.454 33.425 1.00 0.00 C ATOM 0 H ILE A 48 38.304 27.223 31.230 1.00 0.00 H new ATOM 0 HA ILE A 48 39.030 27.135 33.920 1.00 0.00 H new ATOM 0 HB ILE A 48 40.523 26.076 31.525 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.160 25.354 31.484 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.278 24.023 31.706 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.377 24.370 33.100 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.843 26.020 33.577 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.524 25.186 34.432 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.298 23.751 33.127 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.754 23.969 34.127 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.618 25.321 33.902 1.00 0.00 H new ATOM 583 N PRO A 49 41.120 28.640 34.063 1.00 0.00 N ATOM 584 CA PRO A 49 42.262 29.508 34.081 1.00 0.00 C ATOM 585 C PRO A 49 43.486 29.000 33.401 1.00 0.00 C ATOM 586 O PRO A 49 43.861 27.846 33.598 1.00 0.00 O ATOM 587 CB PRO A 49 42.529 29.756 35.563 1.00 0.00 C ATOM 588 CG PRO A 49 41.120 29.714 36.175 1.00 0.00 C ATOM 589 CD PRO A 49 40.470 28.583 35.363 1.00 0.00 C ATOM 0 HA PRO A 49 42.032 30.405 33.506 1.00 0.00 H new ATOM 0 HB2 PRO A 49 43.178 28.992 35.990 1.00 0.00 H new ATOM 0 HB3 PRO A 49 43.014 30.717 35.731 1.00 0.00 H new ATOM 0 HG2 PRO A 49 41.142 29.493 37.242 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.592 30.660 36.056 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.623 27.615 35.840 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.393 28.728 35.274 1.00 0.00 H new ATOM 597 N LYS A 50 44.110 29.869 32.585 1.00 0.00 N ATOM 598 CA LYS A 50 45.267 29.666 31.769 1.00 0.00 C ATOM 599 C LYS A 50 44.993 29.042 30.444 1.00 0.00 C ATOM 600 O LYS A 50 45.912 28.866 29.645 1.00 0.00 O ATOM 601 CB LYS A 50 46.450 28.972 32.465 1.00 0.00 C ATOM 602 CG LYS A 50 46.917 29.722 33.715 1.00 0.00 C ATOM 603 CD LYS A 50 48.190 29.143 34.333 1.00 0.00 C ATOM 604 CE LYS A 50 47.983 27.807 35.051 1.00 0.00 C ATOM 605 NZ LYS A 50 49.236 27.416 35.735 1.00 0.00 N ATOM 0 H LYS A 50 43.760 30.822 32.489 1.00 0.00 H new ATOM 0 HA LYS A 50 45.582 30.692 31.580 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.161 27.958 32.741 1.00 0.00 H new ATOM 0 HB3 LYS A 50 47.281 28.887 31.764 1.00 0.00 H new ATOM 0 HG2 LYS A 50 47.090 30.767 33.459 1.00 0.00 H new ATOM 0 HG3 LYS A 50 46.121 29.704 34.459 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.934 29.010 33.548 1.00 0.00 H new ATOM 0 HD3 LYS A 50 48.598 29.864 35.041 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.172 27.892 35.775 1.00 0.00 H new ATOM 0 HE3 LYS A 50 47.692 27.038 34.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 49.096 26.508 36.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 49.998 27.319 35.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 49.495 28.146 36.429 1.00 0.00 H new ATOM 619 N GLY A 51 43.731 28.734 30.099 1.00 0.00 N ATOM 620 CA GLY A 51 43.421 28.211 28.804 1.00 0.00 C ATOM 621 C GLY A 51 43.437 29.249 27.735 1.00 0.00 C ATOM 622 O GLY A 51 43.231 30.436 27.982 1.00 0.00 O ATOM 0 H GLY A 51 42.926 28.846 30.715 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.138 27.429 28.553 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.437 27.744 28.834 1.00 0.00 H new ATOM 626 N ALA A 52 43.651 28.841 26.471 1.00 0.00 N ATOM 627 CA ALA A 52 43.551 29.663 25.305 1.00 0.00 C ATOM 628 C ALA A 52 42.310 30.480 25.179 1.00 0.00 C ATOM 629 O ALA A 52 42.348 31.697 25.011 1.00 0.00 O ATOM 630 CB ALA A 52 43.719 28.765 24.067 1.00 0.00 C ATOM 0 H ALA A 52 43.909 27.879 26.251 1.00 0.00 H new ATOM 0 HA ALA A 52 44.345 30.405 25.395 1.00 0.00 H new ATOM 0 HB1 ALA A 52 43.646 29.372 23.165 1.00 0.00 H new ATOM 0 HB2 ALA A 52 44.694 28.279 24.100 1.00 0.00 H new ATOM 0 HB3 ALA A 52 42.936 28.007 24.058 1.00 0.00 H new ATOM 636 N ALA A 53 41.143 29.819 25.282 1.00 0.00 N ATOM 637 CA ALA A 53 39.811 30.337 25.251 1.00 0.00 C ATOM 638 C ALA A 53 39.521 31.242 26.399 1.00 0.00 C ATOM 639 O ALA A 53 38.990 32.336 26.215 1.00 0.00 O ATOM 640 CB ALA A 53 38.804 29.174 25.259 1.00 0.00 C ATOM 0 H ALA A 53 41.137 28.806 25.400 1.00 0.00 H new ATOM 0 HA ALA A 53 39.716 30.923 24.337 1.00 0.00 H new ATOM 0 HB1 ALA A 53 37.789 29.571 25.235 1.00 0.00 H new ATOM 0 HB2 ALA A 53 38.968 28.545 24.384 1.00 0.00 H new ATOM 0 HB3 ALA A 53 38.940 28.581 26.163 1.00 0.00 H new ATOM 646 N GLU A 54 39.910 30.817 27.615 1.00 0.00 N ATOM 647 CA GLU A 54 39.879 31.625 28.794 1.00 0.00 C ATOM 648 C GLU A 54 40.519 32.962 28.648 1.00 0.00 C ATOM 649 O GLU A 54 39.919 34.019 28.841 1.00 0.00 O ATOM 650 CB GLU A 54 40.601 30.901 29.943 1.00 0.00 C ATOM 651 CG GLU A 54 40.542 31.611 31.297 1.00 0.00 C ATOM 652 CD GLU A 54 41.662 32.560 31.698 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.861 32.175 31.703 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.336 33.704 32.113 1.00 0.00 O ATOM 0 H GLU A 54 40.260 29.874 27.783 1.00 0.00 H new ATOM 0 HA GLU A 54 38.820 31.784 28.996 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.169 29.906 30.053 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.647 30.766 29.666 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.610 32.175 31.329 1.00 0.00 H new ATOM 0 HG3 GLU A 54 40.476 30.841 32.066 1.00 0.00 H new ATOM 661 N SER A 55 41.810 32.916 28.275 1.00 0.00 N ATOM 662 CA SER A 55 42.698 34.036 28.240 1.00 0.00 C ATOM 663 C SER A 55 42.356 35.040 27.192 1.00 0.00 C ATOM 664 O SER A 55 42.647 36.227 27.325 1.00 0.00 O ATOM 665 CB SER A 55 44.135 33.533 28.024 1.00 0.00 C ATOM 666 OG SER A 55 45.122 34.468 28.432 1.00 0.00 O ATOM 0 H SER A 55 42.259 32.048 27.981 1.00 0.00 H new ATOM 0 HA SER A 55 42.600 34.547 29.198 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.274 32.603 28.576 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.277 33.302 26.968 1.00 0.00 H new ATOM 0 HG SER A 55 46.013 34.093 28.272 1.00 0.00 H new ATOM 672 N ASP A 56 41.672 34.608 26.117 1.00 0.00 N ATOM 673 CA ASP A 56 41.145 35.434 25.077 1.00 0.00 C ATOM 674 C ASP A 56 40.134 36.408 25.579 1.00 0.00 C ATOM 675 O ASP A 56 40.408 37.604 25.666 1.00 0.00 O ATOM 676 CB ASP A 56 40.595 34.530 23.960 1.00 0.00 C ATOM 677 CG ASP A 56 40.284 35.299 22.683 1.00 0.00 C ATOM 678 OD1 ASP A 56 39.255 36.024 22.634 1.00 0.00 O ATOM 679 OD2 ASP A 56 41.092 35.204 21.720 1.00 0.00 O ATOM 0 H ASP A 56 41.475 33.619 25.966 1.00 0.00 H new ATOM 0 HA ASP A 56 41.947 36.050 24.670 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.321 33.747 23.741 1.00 0.00 H new ATOM 0 HB3 ASP A 56 39.690 34.035 24.311 1.00 0.00 H new ATOM 684 N GLY A 57 38.929 35.943 25.950 1.00 0.00 N ATOM 685 CA GLY A 57 37.907 36.778 26.500 1.00 0.00 C ATOM 686 C GLY A 57 36.764 37.069 25.589 1.00 0.00 C ATOM 687 O GLY A 57 35.755 37.639 26.000 1.00 0.00 O ATOM 0 H GLY A 57 38.658 34.963 25.866 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.520 36.304 27.402 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.357 37.723 26.804 1.00 0.00 H new ATOM 691 N ARG A 58 36.827 36.658 24.310 1.00 0.00 N ATOM 692 CA ARG A 58 35.677 36.626 23.461 1.00 0.00 C ATOM 693 C ARG A 58 34.666 35.638 23.932 1.00 0.00 C ATOM 694 O ARG A 58 33.465 35.890 23.867 1.00 0.00 O ATOM 695 CB ARG A 58 36.063 36.410 21.987 1.00 0.00 C ATOM 696 CG ARG A 58 36.434 37.734 21.316 1.00 0.00 C ATOM 697 CD ARG A 58 37.071 37.611 19.931 1.00 0.00 C ATOM 698 NE ARG A 58 38.443 37.073 20.147 1.00 0.00 N ATOM 699 CZ ARG A 58 39.537 37.467 19.433 1.00 0.00 C ATOM 700 NH1 ARG A 58 39.460 38.302 18.355 1.00 0.00 N ATOM 701 NH2 ARG A 58 40.780 37.026 19.787 1.00 0.00 N ATOM 0 H ARG A 58 37.686 36.344 23.859 1.00 0.00 H new ATOM 0 HA ARG A 58 35.204 37.606 23.521 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.904 35.719 21.925 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.232 35.949 21.454 1.00 0.00 H new ATOM 0 HG2 ARG A 58 35.534 38.343 21.231 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.123 38.272 21.968 1.00 0.00 H new ATOM 0 HD2 ARG A 58 36.489 36.946 19.293 1.00 0.00 H new ATOM 0 HD3 ARG A 58 37.107 38.580 19.433 1.00 0.00 H new ATOM 0 HE ARG A 58 38.573 36.368 20.872 1.00 0.00 H new ATOM 0 HH11 ARG A 58 38.555 38.660 18.051 1.00 0.00 H new ATOM 0 HH12 ARG A 58 40.308 38.567 17.854 1.00 0.00 H new ATOM 0 HH21 ARG A 58 40.891 36.401 20.586 1.00 0.00 H new ATOM 0 HH22 ARG A 58 41.597 37.321 19.253 1.00 0.00 H new ATOM 715 N ILE A 59 35.107 34.496 24.489 1.00 0.00 N ATOM 716 CA ILE A 59 34.268 33.482 25.050 1.00 0.00 C ATOM 717 C ILE A 59 33.949 33.821 26.466 1.00 0.00 C ATOM 718 O ILE A 59 34.818 34.229 27.233 1.00 0.00 O ATOM 719 CB ILE A 59 34.934 32.144 24.928 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.223 31.859 23.444 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.043 31.044 25.529 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.004 30.576 23.164 1.00 0.00 C ATOM 0 H ILE A 59 36.099 34.268 24.551 1.00 0.00 H new ATOM 0 HA ILE A 59 33.328 33.431 24.501 1.00 0.00 H new ATOM 0 HB ILE A 59 35.873 32.153 25.481 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.274 31.811 22.909 1.00 0.00 H new ATOM 0 HG13 ILE A 59 35.779 32.701 23.031 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.541 30.079 25.432 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.864 31.256 26.583 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.091 31.016 24.998 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.155 30.469 22.090 1.00 0.00 H new ATOM 0 HD12 ILE A 59 36.972 30.623 23.663 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.443 29.720 23.539 1.00 0.00 H new ATOM 734 N HIS A 60 32.673 33.702 26.872 1.00 0.00 N ATOM 735 CA HIS A 60 32.233 33.940 28.212 1.00 0.00 C ATOM 736 C HIS A 60 31.232 32.900 28.584 1.00 0.00 C ATOM 737 O HIS A 60 30.642 32.234 27.734 1.00 0.00 O ATOM 738 CB HIS A 60 31.620 35.349 28.300 1.00 0.00 C ATOM 739 CG HIS A 60 31.156 35.862 29.629 1.00 0.00 C ATOM 740 ND1 HIS A 60 29.924 35.581 30.186 1.00 0.00 N ATOM 741 CD2 HIS A 60 31.746 36.744 30.480 1.00 0.00 C ATOM 742 CE1 HIS A 60 29.833 36.296 31.338 1.00 0.00 C ATOM 743 NE2 HIS A 60 30.918 37.017 31.550 1.00 0.00 N ATOM 0 H HIS A 60 31.918 33.429 26.243 1.00 0.00 H new ATOM 0 HA HIS A 60 33.072 33.883 28.906 1.00 0.00 H new ATOM 0 HB2 HIS A 60 32.359 36.053 27.916 1.00 0.00 H new ATOM 0 HB3 HIS A 60 30.768 35.379 27.621 1.00 0.00 H new ATOM 0 HD1 HIS A 60 29.215 34.954 29.804 1.00 0.00 H new ATOM 0 HD2 HIS A 60 32.727 37.172 30.338 1.00 0.00 H new ATOM 0 HE1 HIS A 60 28.979 36.277 31.998 1.00 0.00 H new ATOM 751 N LYS A 61 30.991 32.715 29.893 1.00 0.00 N ATOM 752 CA LYS A 61 29.965 31.889 30.450 1.00 0.00 C ATOM 753 C LYS A 61 28.596 32.208 29.954 1.00 0.00 C ATOM 754 O LYS A 61 28.134 33.348 29.998 1.00 0.00 O ATOM 755 CB LYS A 61 30.027 32.008 31.983 1.00 0.00 C ATOM 756 CG LYS A 61 28.959 31.267 32.789 1.00 0.00 C ATOM 757 CD LYS A 61 29.229 31.302 34.295 1.00 0.00 C ATOM 758 CE LYS A 61 29.224 32.707 34.897 1.00 0.00 C ATOM 759 NZ LYS A 61 29.662 32.692 36.311 1.00 0.00 N ATOM 0 H LYS A 61 31.551 33.174 30.611 1.00 0.00 H new ATOM 0 HA LYS A 61 30.154 30.865 30.127 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.004 31.651 32.310 1.00 0.00 H new ATOM 0 HB3 LYS A 61 29.971 33.065 32.242 1.00 0.00 H new ATOM 0 HG2 LYS A 61 27.984 31.711 32.588 1.00 0.00 H new ATOM 0 HG3 LYS A 61 28.912 30.230 32.456 1.00 0.00 H new ATOM 0 HD2 LYS A 61 28.477 30.698 34.802 1.00 0.00 H new ATOM 0 HD3 LYS A 61 30.196 30.838 34.491 1.00 0.00 H new ATOM 0 HE2 LYS A 61 29.882 33.355 34.318 1.00 0.00 H new ATOM 0 HE3 LYS A 61 28.221 33.129 34.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 29.647 33.661 36.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 29.019 32.093 36.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 30.628 32.312 36.371 1.00 0.00 H new ATOM 773 N GLY A 62 27.899 31.193 29.413 1.00 0.00 N ATOM 774 CA GLY A 62 26.589 31.323 28.854 1.00 0.00 C ATOM 775 C GLY A 62 26.557 31.539 27.380 1.00 0.00 C ATOM 776 O GLY A 62 25.476 31.605 26.797 1.00 0.00 O ATOM 0 H GLY A 62 28.264 30.242 29.363 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.019 30.424 29.088 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.083 32.157 29.340 1.00 0.00 H new ATOM 780 N ASP A 63 27.712 31.642 26.698 1.00 0.00 N ATOM 781 CA ASP A 63 27.741 31.824 25.281 1.00 0.00 C ATOM 782 C ASP A 63 27.579 30.518 24.583 1.00 0.00 C ATOM 783 O ASP A 63 27.758 29.458 25.181 1.00 0.00 O ATOM 784 CB ASP A 63 28.998 32.588 24.831 1.00 0.00 C ATOM 785 CG ASP A 63 28.999 34.035 25.300 1.00 0.00 C ATOM 786 OD1 ASP A 63 27.928 34.605 25.638 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.094 34.658 25.259 1.00 0.00 O ATOM 0 H ASP A 63 28.633 31.599 27.134 1.00 0.00 H new ATOM 0 HA ASP A 63 26.894 32.449 24.997 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.884 32.084 25.217 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.065 32.562 23.743 1.00 0.00 H new ATOM 792 N ARG A 64 27.181 30.521 23.298 1.00 0.00 N ATOM 793 CA ARG A 64 26.760 29.346 22.601 1.00 0.00 C ATOM 794 C ARG A 64 27.713 28.961 21.522 1.00 0.00 C ATOM 795 O ARG A 64 28.119 29.774 20.694 1.00 0.00 O ATOM 796 CB ARG A 64 25.369 29.551 21.979 1.00 0.00 C ATOM 797 CG ARG A 64 24.785 28.300 21.318 1.00 0.00 C ATOM 798 CD ARG A 64 23.443 28.539 20.624 1.00 0.00 C ATOM 799 NE ARG A 64 23.078 27.266 19.942 1.00 0.00 N ATOM 800 CZ ARG A 64 21.985 27.125 19.137 1.00 0.00 C ATOM 801 NH1 ARG A 64 21.126 28.166 18.928 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.756 25.938 18.504 1.00 0.00 N ATOM 0 H ARG A 64 27.151 31.366 22.727 1.00 0.00 H new ATOM 0 HA ARG A 64 26.726 28.544 23.339 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.683 29.892 22.755 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.430 30.346 21.236 1.00 0.00 H new ATOM 0 HG2 ARG A 64 25.499 27.919 20.587 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.660 27.525 22.075 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.679 28.823 21.348 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.520 29.355 19.905 1.00 0.00 H new ATOM 0 HE ARG A 64 23.679 26.454 20.085 1.00 0.00 H new ATOM 0 HH11 ARG A 64 21.297 29.066 19.377 1.00 0.00 H new ATOM 0 HH12 ARG A 64 20.314 28.043 18.323 1.00 0.00 H new ATOM 0 HH21 ARG A 64 22.401 25.158 18.633 1.00 0.00 H new ATOM 0 HH22 ARG A 64 20.940 25.830 17.902 1.00 0.00 H new ATOM 816 N VAL A 65 28.094 27.672 21.452 1.00 0.00 N ATOM 817 CA VAL A 65 28.979 27.169 20.448 1.00 0.00 C ATOM 818 C VAL A 65 28.219 26.770 19.229 1.00 0.00 C ATOM 819 O VAL A 65 27.248 26.019 19.312 1.00 0.00 O ATOM 820 CB VAL A 65 29.805 26.021 20.950 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.892 25.669 19.920 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.466 26.405 22.285 1.00 0.00 C ATOM 0 H VAL A 65 27.778 26.961 22.112 1.00 0.00 H new ATOM 0 HA VAL A 65 29.664 27.976 20.188 1.00 0.00 H new ATOM 0 HB VAL A 65 29.160 25.156 21.100 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.488 24.835 20.291 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.423 25.389 18.977 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.537 26.533 19.762 1.00 0.00 H new ATOM 0 HG21 VAL A 65 31.065 25.570 22.648 1.00 0.00 H new ATOM 0 HG22 VAL A 65 31.107 27.274 22.137 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.695 26.643 23.018 1.00 0.00 H new ATOM 832 N LEU A 66 28.614 27.267 18.044 1.00 0.00 N ATOM 833 CA LEU A 66 27.947 26.972 16.815 1.00 0.00 C ATOM 834 C LEU A 66 28.643 25.885 16.070 1.00 0.00 C ATOM 835 O LEU A 66 28.029 24.918 15.620 1.00 0.00 O ATOM 836 CB LEU A 66 27.838 28.201 15.896 1.00 0.00 C ATOM 837 CG LEU A 66 26.999 29.366 16.449 1.00 0.00 C ATOM 838 CD1 LEU A 66 26.980 30.512 15.424 1.00 0.00 C ATOM 839 CD2 LEU A 66 25.557 28.957 16.791 1.00 0.00 C ATOM 0 H LEU A 66 29.416 27.888 17.938 1.00 0.00 H new ATOM 0 HA LEU A 66 26.943 26.651 17.091 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.843 28.567 15.686 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.409 27.886 14.945 1.00 0.00 H new ATOM 0 HG LEU A 66 27.468 29.688 17.379 1.00 0.00 H new ATOM 0 HD11 LEU A 66 26.386 31.339 15.814 1.00 0.00 H new ATOM 0 HD12 LEU A 66 27.999 30.852 15.240 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.541 30.158 14.491 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.015 29.821 17.176 1.00 0.00 H new ATOM 0 HD22 LEU A 66 25.061 28.588 15.893 1.00 0.00 H new ATOM 0 HD23 LEU A 66 25.571 28.171 17.546 1.00 0.00 H new ATOM 851 N ALA A 67 29.976 25.988 15.924 1.00 0.00 N ATOM 852 CA ALA A 67 30.720 25.033 15.162 1.00 0.00 C ATOM 853 C ALA A 67 32.096 24.904 15.720 1.00 0.00 C ATOM 854 O ALA A 67 32.759 25.889 16.040 1.00 0.00 O ATOM 855 CB ALA A 67 30.812 25.440 13.681 1.00 0.00 C ATOM 0 H ALA A 67 30.539 26.733 16.334 1.00 0.00 H new ATOM 0 HA ALA A 67 30.197 24.078 15.225 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.384 24.691 13.133 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.809 25.510 13.260 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.308 26.407 13.600 1.00 0.00 H new ATOM 861 N VAL A 68 32.565 23.652 15.872 1.00 0.00 N ATOM 862 CA VAL A 68 33.864 23.354 16.389 1.00 0.00 C ATOM 863 C VAL A 68 34.640 22.728 15.282 1.00 0.00 C ATOM 864 O VAL A 68 34.197 21.754 14.675 1.00 0.00 O ATOM 865 CB VAL A 68 33.838 22.385 17.534 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.263 22.141 18.058 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.947 22.917 18.669 1.00 0.00 C ATOM 0 H VAL A 68 32.024 22.823 15.628 1.00 0.00 H new ATOM 0 HA VAL A 68 34.302 24.281 16.758 1.00 0.00 H new ATOM 0 HB VAL A 68 33.425 21.442 17.177 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.229 21.436 18.889 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.879 21.730 17.258 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.692 23.083 18.399 1.00 0.00 H new ATOM 0 HG21 VAL A 68 32.940 22.202 19.491 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.338 23.871 19.022 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.931 23.056 18.299 1.00 0.00 H new ATOM 877 N ASN A 69 35.828 23.269 14.958 1.00 0.00 N ATOM 878 CA ASN A 69 36.740 22.740 13.992 1.00 0.00 C ATOM 879 C ASN A 69 36.190 22.825 12.610 1.00 0.00 C ATOM 880 O ASN A 69 36.461 21.994 11.745 1.00 0.00 O ATOM 881 CB ASN A 69 37.199 21.332 14.410 1.00 0.00 C ATOM 882 CG ASN A 69 38.590 20.987 13.898 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.205 21.712 13.117 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.134 19.832 14.364 1.00 0.00 N ATOM 0 H ASN A 69 36.171 24.124 15.395 1.00 0.00 H new ATOM 0 HA ASN A 69 37.637 23.358 13.967 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.189 21.260 15.498 1.00 0.00 H new ATOM 0 HB3 ASN A 69 36.487 20.597 14.036 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.069 19.552 14.067 1.00 0.00 H new ATOM 0 HD22 ASN A 69 38.608 19.245 15.011 1.00 0.00 H new ATOM 891 N GLY A 70 35.347 23.840 12.351 1.00 0.00 N ATOM 892 CA GLY A 70 34.622 24.015 11.130 1.00 0.00 C ATOM 893 C GLY A 70 33.331 23.277 11.059 1.00 0.00 C ATOM 894 O GLY A 70 32.466 23.584 10.240 1.00 0.00 O ATOM 0 H GLY A 70 35.161 24.578 13.030 1.00 0.00 H new ATOM 0 HA2 GLY A 70 34.425 25.078 10.990 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.253 23.696 10.300 1.00 0.00 H new ATOM 898 N VAL A 71 33.141 22.253 11.909 1.00 0.00 N ATOM 899 CA VAL A 71 32.040 21.341 11.844 1.00 0.00 C ATOM 900 C VAL A 71 30.905 21.832 12.676 1.00 0.00 C ATOM 901 O VAL A 71 31.040 22.086 13.872 1.00 0.00 O ATOM 902 CB VAL A 71 32.431 19.950 12.246 1.00 0.00 C ATOM 903 CG1 VAL A 71 31.274 18.966 12.002 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.671 19.505 11.453 1.00 0.00 C ATOM 0 H VAL A 71 33.783 22.051 12.676 1.00 0.00 H new ATOM 0 HA VAL A 71 31.719 21.294 10.803 1.00 0.00 H new ATOM 0 HB VAL A 71 32.664 19.952 13.311 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.580 17.963 12.301 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.407 19.271 12.589 1.00 0.00 H new ATOM 0 HG13 VAL A 71 31.014 18.966 10.944 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.949 18.494 11.750 1.00 0.00 H new ATOM 0 HG22 VAL A 71 33.446 19.521 10.387 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.498 20.184 11.659 1.00 0.00 H new ATOM 914 N SER A 72 29.720 22.004 12.066 1.00 0.00 N ATOM 915 CA SER A 72 28.539 22.472 12.723 1.00 0.00 C ATOM 916 C SER A 72 28.036 21.558 13.787 1.00 0.00 C ATOM 917 O SER A 72 27.918 20.351 13.580 1.00 0.00 O ATOM 918 CB SER A 72 27.353 22.613 11.756 1.00 0.00 C ATOM 919 OG SER A 72 27.669 23.448 10.651 1.00 0.00 O ATOM 0 H SER A 72 29.578 21.809 11.075 1.00 0.00 H new ATOM 0 HA SER A 72 28.858 23.426 13.144 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.060 21.627 11.395 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.496 23.025 12.289 1.00 0.00 H new ATOM 0 HG SER A 72 26.892 23.513 10.057 1.00 0.00 H new ATOM 925 N LEU A 73 27.657 22.095 14.961 1.00 0.00 N ATOM 926 CA LEU A 73 27.117 21.311 16.028 1.00 0.00 C ATOM 927 C LEU A 73 25.645 21.129 15.886 1.00 0.00 C ATOM 928 O LEU A 73 24.854 21.458 16.769 1.00 0.00 O ATOM 929 CB LEU A 73 27.441 21.916 17.404 1.00 0.00 C ATOM 930 CG LEU A 73 28.938 22.067 17.720 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.100 22.621 19.145 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.727 20.753 17.582 1.00 0.00 C ATOM 0 H LEU A 73 27.727 23.090 15.173 1.00 0.00 H new ATOM 0 HA LEU A 73 27.594 20.333 15.964 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.972 22.898 17.470 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.985 21.292 18.173 1.00 0.00 H new ATOM 0 HG LEU A 73 29.352 22.756 16.984 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.160 22.730 19.375 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.612 23.593 19.215 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.644 21.933 19.857 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.776 20.932 17.819 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.321 20.011 18.269 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.644 20.384 16.560 1.00 0.00 H new ATOM 944 N GLU A 74 25.202 20.581 14.740 1.00 0.00 N ATOM 945 CA GLU A 74 23.826 20.422 14.385 1.00 0.00 C ATOM 946 C GLU A 74 23.194 19.253 15.060 1.00 0.00 C ATOM 947 O GLU A 74 23.674 18.123 14.986 1.00 0.00 O ATOM 948 CB GLU A 74 23.652 20.300 12.862 1.00 0.00 C ATOM 949 CG GLU A 74 24.596 19.304 12.184 1.00 0.00 C ATOM 950 CD GLU A 74 24.168 18.908 10.778 1.00 0.00 C ATOM 951 OE1 GLU A 74 23.028 19.234 10.350 1.00 0.00 O ATOM 952 OE2 GLU A 74 24.965 18.225 10.081 1.00 0.00 O ATOM 0 H GLU A 74 25.838 20.231 14.024 1.00 0.00 H new ATOM 0 HA GLU A 74 23.318 21.322 14.731 1.00 0.00 H new ATOM 0 HB2 GLU A 74 22.624 20.006 12.651 1.00 0.00 H new ATOM 0 HB3 GLU A 74 23.801 21.282 12.414 1.00 0.00 H new ATOM 0 HG2 GLU A 74 25.595 19.737 12.141 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.664 18.407 12.799 1.00 0.00 H new ATOM 959 N GLY A 75 22.102 19.499 15.806 1.00 0.00 N ATOM 960 CA GLY A 75 21.360 18.518 16.535 1.00 0.00 C ATOM 961 C GLY A 75 22.141 17.762 17.554 1.00 0.00 C ATOM 962 O GLY A 75 21.795 16.642 17.926 1.00 0.00 O ATOM 0 H GLY A 75 21.715 20.438 15.906 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.526 19.012 17.033 1.00 0.00 H new ATOM 0 HA3 GLY A 75 20.933 17.808 15.827 1.00 0.00 H new ATOM 966 N ALA A 76 23.278 18.336 17.988 1.00 0.00 N ATOM 967 CA ALA A 76 24.294 17.629 18.705 1.00 0.00 C ATOM 968 C ALA A 76 23.936 17.236 20.097 1.00 0.00 C ATOM 969 O ALA A 76 23.262 17.957 20.830 1.00 0.00 O ATOM 970 CB ALA A 76 25.602 18.438 18.706 1.00 0.00 C ATOM 0 H ALA A 76 23.497 19.321 17.836 1.00 0.00 H new ATOM 0 HA ALA A 76 24.418 16.689 18.167 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.368 17.890 19.255 1.00 0.00 H new ATOM 0 HB2 ALA A 76 25.933 18.595 17.680 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.433 19.403 19.185 1.00 0.00 H new ATOM 976 N THR A 77 24.426 16.058 20.523 1.00 0.00 N ATOM 977 CA THR A 77 24.388 15.605 21.879 1.00 0.00 C ATOM 978 C THR A 77 25.429 16.297 22.690 1.00 0.00 C ATOM 979 O THR A 77 26.224 17.086 22.181 1.00 0.00 O ATOM 980 CB THR A 77 24.571 14.121 21.994 1.00 0.00 C ATOM 981 OG1 THR A 77 25.851 13.708 21.537 1.00 0.00 O ATOM 982 CG2 THR A 77 23.524 13.392 21.136 1.00 0.00 C ATOM 0 H THR A 77 24.869 15.390 19.892 1.00 0.00 H new ATOM 0 HA THR A 77 23.397 15.849 22.262 1.00 0.00 H new ATOM 0 HB THR A 77 24.463 13.873 23.050 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.933 12.736 21.629 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.665 12.315 21.226 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.524 13.657 21.479 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.639 13.687 20.093 1.00 0.00 H new ATOM 990 N HIS A 78 25.504 16.005 24.000 1.00 0.00 N ATOM 991 CA HIS A 78 26.555 16.496 24.837 1.00 0.00 C ATOM 992 C HIS A 78 27.870 15.888 24.486 1.00 0.00 C ATOM 993 O HIS A 78 28.869 16.577 24.289 1.00 0.00 O ATOM 994 CB HIS A 78 26.223 16.229 26.315 1.00 0.00 C ATOM 995 CG HIS A 78 27.069 16.969 27.307 1.00 0.00 C ATOM 996 ND1 HIS A 78 28.442 16.868 27.409 1.00 0.00 N ATOM 997 CD2 HIS A 78 26.696 17.852 28.272 1.00 0.00 C ATOM 998 CE1 HIS A 78 28.831 17.686 28.423 1.00 0.00 C ATOM 999 NE2 HIS A 78 27.798 18.294 28.976 1.00 0.00 N ATOM 0 H HIS A 78 24.825 15.419 24.486 1.00 0.00 H new ATOM 0 HA HIS A 78 26.635 17.571 24.674 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.179 16.489 26.488 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.321 15.160 26.505 1.00 0.00 H new ATOM 0 HD2 HIS A 78 25.679 18.164 28.461 1.00 0.00 H new ATOM 0 HE1 HIS A 78 29.856 17.821 28.736 1.00 0.00 H new ATOM 0 HE2 HIS A 78 27.811 18.950 29.757 1.00 0.00 H new ATOM 1007 N LYS A 79 27.934 14.551 24.351 1.00 0.00 N ATOM 1008 CA LYS A 79 29.104 13.859 23.911 1.00 0.00 C ATOM 1009 C LYS A 79 29.626 14.245 22.569 1.00 0.00 C ATOM 1010 O LYS A 79 30.844 14.266 22.390 1.00 0.00 O ATOM 1011 CB LYS A 79 28.977 12.332 24.037 1.00 0.00 C ATOM 1012 CG LYS A 79 29.134 11.804 25.464 1.00 0.00 C ATOM 1013 CD LYS A 79 30.538 12.019 26.034 1.00 0.00 C ATOM 1014 CE LYS A 79 30.875 11.234 27.303 1.00 0.00 C ATOM 1015 NZ LYS A 79 29.976 11.610 28.417 1.00 0.00 N ATOM 0 H LYS A 79 27.148 13.934 24.554 1.00 0.00 H new ATOM 0 HA LYS A 79 29.863 14.203 24.614 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.003 12.027 23.654 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.730 11.863 23.403 1.00 0.00 H new ATOM 0 HG2 LYS A 79 28.407 12.297 26.109 1.00 0.00 H new ATOM 0 HG3 LYS A 79 28.902 10.739 25.478 1.00 0.00 H new ATOM 0 HD2 LYS A 79 31.265 11.757 25.265 1.00 0.00 H new ATOM 0 HD3 LYS A 79 30.665 13.081 26.243 1.00 0.00 H new ATOM 0 HE2 LYS A 79 30.789 10.165 27.107 1.00 0.00 H new ATOM 0 HE3 LYS A 79 31.910 11.423 27.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 30.227 11.063 29.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 30.078 12.625 28.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 28.991 11.406 28.152 1.00 0.00 H new ATOM 1029 N GLN A 80 28.783 14.651 21.604 1.00 0.00 N ATOM 1030 CA GLN A 80 29.208 15.119 20.322 1.00 0.00 C ATOM 1031 C GLN A 80 30.157 16.267 20.375 1.00 0.00 C ATOM 1032 O GLN A 80 31.266 16.201 19.847 1.00 0.00 O ATOM 1033 CB GLN A 80 28.011 15.572 19.468 1.00 0.00 C ATOM 1034 CG GLN A 80 27.349 14.471 18.637 1.00 0.00 C ATOM 1035 CD GLN A 80 28.299 13.973 17.557 1.00 0.00 C ATOM 1036 OE1 GLN A 80 28.984 12.964 17.720 1.00 0.00 O ATOM 1037 NE2 GLN A 80 28.373 14.729 16.430 1.00 0.00 N ATOM 0 H GLN A 80 27.770 14.654 21.720 1.00 0.00 H new ATOM 0 HA GLN A 80 29.718 14.262 19.883 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.260 16.009 20.126 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.344 16.362 18.795 1.00 0.00 H new ATOM 0 HG2 GLN A 80 27.059 13.643 19.284 1.00 0.00 H new ATOM 0 HG3 GLN A 80 26.436 14.852 18.179 1.00 0.00 H new ATOM 0 HE21 GLN A 80 27.788 15.559 16.333 1.00 0.00 H new ATOM 0 HE22 GLN A 80 29.014 14.467 15.681 1.00 0.00 H new ATOM 1046 N ALA A 81 29.769 17.366 21.045 1.00 0.00 N ATOM 1047 CA ALA A 81 30.570 18.541 21.194 1.00 0.00 C ATOM 1048 C ALA A 81 31.815 18.307 21.979 1.00 0.00 C ATOM 1049 O ALA A 81 32.875 18.827 21.636 1.00 0.00 O ATOM 1050 CB ALA A 81 29.720 19.626 21.878 1.00 0.00 C ATOM 0 H ALA A 81 28.860 17.439 21.502 1.00 0.00 H new ATOM 0 HA ALA A 81 30.888 18.855 20.200 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.315 20.531 22.000 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.847 19.846 21.263 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.395 19.271 22.856 1.00 0.00 H new ATOM 1056 N VAL A 82 31.763 17.468 23.029 1.00 0.00 N ATOM 1057 CA VAL A 82 32.868 17.146 23.878 1.00 0.00 C ATOM 1058 C VAL A 82 33.893 16.347 23.149 1.00 0.00 C ATOM 1059 O VAL A 82 35.075 16.685 23.156 1.00 0.00 O ATOM 1060 CB VAL A 82 32.425 16.454 25.133 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.615 15.961 25.973 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.604 17.450 25.967 1.00 0.00 C ATOM 0 H VAL A 82 30.904 16.989 23.300 1.00 0.00 H new ATOM 0 HA VAL A 82 33.331 18.086 24.178 1.00 0.00 H new ATOM 0 HB VAL A 82 31.834 15.582 24.854 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.246 15.467 26.872 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.206 15.257 25.388 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.237 16.810 26.256 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.271 16.967 26.886 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.221 18.314 26.214 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.736 17.776 25.394 1.00 0.00 H new ATOM 1072 N GLU A 83 33.492 15.283 22.431 1.00 0.00 N ATOM 1073 CA GLU A 83 34.384 14.482 21.651 1.00 0.00 C ATOM 1074 C GLU A 83 35.029 15.246 20.545 1.00 0.00 C ATOM 1075 O GLU A 83 36.210 15.092 20.240 1.00 0.00 O ATOM 1076 CB GLU A 83 33.692 13.226 21.094 1.00 0.00 C ATOM 1077 CG GLU A 83 33.364 12.194 22.175 1.00 0.00 C ATOM 1078 CD GLU A 83 32.670 10.936 21.671 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.275 10.847 20.478 1.00 0.00 O ATOM 1080 OE2 GLU A 83 32.524 9.998 22.500 1.00 0.00 O ATOM 0 H GLU A 83 32.522 14.971 22.392 1.00 0.00 H new ATOM 0 HA GLU A 83 35.171 14.168 22.337 1.00 0.00 H new ATOM 0 HB2 GLU A 83 32.772 13.519 20.588 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.335 12.766 20.344 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.289 11.906 22.674 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.730 12.665 22.926 1.00 0.00 H new ATOM 1087 N THR A 84 34.266 16.168 19.932 1.00 0.00 N ATOM 1088 CA THR A 84 34.704 17.065 18.907 1.00 0.00 C ATOM 1089 C THR A 84 35.689 18.073 19.391 1.00 0.00 C ATOM 1090 O THR A 84 36.720 18.283 18.755 1.00 0.00 O ATOM 1091 CB THR A 84 33.527 17.749 18.276 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.670 16.790 17.674 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.906 18.730 17.154 1.00 0.00 C ATOM 0 H THR A 84 33.282 16.295 20.167 1.00 0.00 H new ATOM 0 HA THR A 84 35.219 16.459 18.162 1.00 0.00 H new ATOM 0 HB THR A 84 33.052 18.297 19.090 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.173 16.313 18.371 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.003 19.184 16.747 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.555 19.509 17.555 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.430 18.193 16.363 1.00 0.00 H new ATOM 1101 N LEU A 85 35.456 18.725 20.545 1.00 0.00 N ATOM 1102 CA LEU A 85 36.370 19.635 21.160 1.00 0.00 C ATOM 1103 C LEU A 85 37.625 18.997 21.649 1.00 0.00 C ATOM 1104 O LEU A 85 38.700 19.593 21.601 1.00 0.00 O ATOM 1105 CB LEU A 85 35.701 20.358 22.342 1.00 0.00 C ATOM 1106 CG LEU A 85 34.741 21.487 21.931 1.00 0.00 C ATOM 1107 CD1 LEU A 85 33.729 21.797 23.048 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.502 22.769 21.555 1.00 0.00 C ATOM 0 H LEU A 85 34.590 18.612 21.072 1.00 0.00 H new ATOM 0 HA LEU A 85 36.644 20.338 20.373 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.151 19.628 22.936 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.477 20.773 22.985 1.00 0.00 H new ATOM 0 HG LEU A 85 34.200 21.134 21.053 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.065 22.599 22.725 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.141 20.905 23.264 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.263 22.107 23.947 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.791 23.544 21.270 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.086 23.109 22.410 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.169 22.564 20.718 1.00 0.00 H new ATOM 1120 N ARG A 86 37.563 17.747 22.142 1.00 0.00 N ATOM 1121 CA ARG A 86 38.713 17.048 22.624 1.00 0.00 C ATOM 1122 C ARG A 86 39.637 16.599 21.544 1.00 0.00 C ATOM 1123 O ARG A 86 40.853 16.579 21.725 1.00 0.00 O ATOM 1124 CB ARG A 86 38.322 15.961 23.639 1.00 0.00 C ATOM 1125 CG ARG A 86 38.089 14.523 23.169 1.00 0.00 C ATOM 1126 CD ARG A 86 39.374 13.697 23.108 1.00 0.00 C ATOM 1127 NE ARG A 86 39.011 12.255 22.997 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.945 11.262 23.059 1.00 0.00 C ATOM 1129 NH1 ARG A 86 41.285 11.526 23.061 1.00 0.00 N ATOM 1130 NH2 ARG A 86 39.506 9.975 23.178 1.00 0.00 N ATOM 0 H ARG A 86 36.697 17.212 22.207 1.00 0.00 H new ATOM 0 HA ARG A 86 39.319 17.765 23.179 1.00 0.00 H new ATOM 0 HB2 ARG A 86 39.103 15.931 24.399 1.00 0.00 H new ATOM 0 HB3 ARG A 86 37.409 16.292 24.133 1.00 0.00 H new ATOM 0 HG2 ARG A 86 37.383 14.037 23.842 1.00 0.00 H new ATOM 0 HG3 ARG A 86 37.628 14.540 22.182 1.00 0.00 H new ATOM 0 HD2 ARG A 86 39.978 14.001 22.254 1.00 0.00 H new ATOM 0 HD3 ARG A 86 39.976 13.868 24.001 1.00 0.00 H new ATOM 0 HE ARG A 86 38.031 12.002 22.870 1.00 0.00 H new ATOM 0 HH11 ARG A 86 41.615 12.490 23.015 1.00 0.00 H new ATOM 0 HH12 ARG A 86 41.956 10.759 23.108 1.00 0.00 H new ATOM 0 HH21 ARG A 86 38.506 9.779 23.218 1.00 0.00 H new ATOM 0 HH22 ARG A 86 40.178 9.209 23.227 1.00 0.00 H new ATOM 1144 N ASN A 87 39.106 16.276 20.351 1.00 0.00 N ATOM 1145 CA ASN A 87 39.876 15.963 19.187 1.00 0.00 C ATOM 1146 C ASN A 87 40.202 17.178 18.388 1.00 0.00 C ATOM 1147 O ASN A 87 40.034 17.226 17.170 1.00 0.00 O ATOM 1148 CB ASN A 87 39.121 14.914 18.353 1.00 0.00 C ATOM 1149 CG ASN A 87 39.977 14.243 17.288 1.00 0.00 C ATOM 1150 OD1 ASN A 87 41.201 14.349 17.229 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.295 13.502 16.374 1.00 0.00 N ATOM 0 H ASN A 87 38.100 16.231 20.191 1.00 0.00 H new ATOM 0 HA ASN A 87 40.834 15.547 19.500 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.724 14.150 19.021 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.268 15.392 17.872 1.00 0.00 H new ATOM 0 HD21 ASN A 87 39.799 13.025 15.626 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.280 13.424 16.436 1.00 0.00 H new ATOM 1158 N THR A 88 40.710 18.238 19.041 1.00 0.00 N ATOM 1159 CA THR A 88 41.253 19.405 18.417 1.00 0.00 C ATOM 1160 C THR A 88 42.735 19.392 18.563 1.00 0.00 C ATOM 1161 O THR A 88 43.271 18.784 19.488 1.00 0.00 O ATOM 1162 CB THR A 88 40.715 20.706 18.934 1.00 0.00 C ATOM 1163 OG1 THR A 88 40.804 20.801 20.348 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.232 20.847 18.548 1.00 0.00 C ATOM 0 H THR A 88 40.744 18.283 20.059 1.00 0.00 H new ATOM 0 HA THR A 88 40.948 19.354 17.372 1.00 0.00 H new ATOM 0 HB THR A 88 41.319 21.496 18.488 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.039 20.343 20.755 1.00 0.00 H new ATOM 0 HG21 THR A 88 38.846 21.794 18.926 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.135 20.823 17.463 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.663 20.024 18.982 1.00 0.00 H new ATOM 1172 N GLY A 89 43.458 20.060 17.646 1.00 0.00 N ATOM 1173 CA GLY A 89 44.885 20.007 17.566 1.00 0.00 C ATOM 1174 C GLY A 89 45.559 21.268 17.988 1.00 0.00 C ATOM 1175 O GLY A 89 45.303 21.816 19.058 1.00 0.00 O ATOM 0 H GLY A 89 43.035 20.657 16.936 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.244 19.188 18.189 1.00 0.00 H new ATOM 0 HA3 GLY A 89 45.174 19.777 16.540 1.00 0.00 H new ATOM 1179 N GLN A 90 46.520 21.740 17.173 1.00 0.00 N ATOM 1180 CA GLN A 90 47.266 22.934 17.417 1.00 0.00 C ATOM 1181 C GLN A 90 46.465 24.180 17.254 1.00 0.00 C ATOM 1182 O GLN A 90 46.179 24.859 18.238 1.00 0.00 O ATOM 1183 CB GLN A 90 48.554 22.896 16.577 1.00 0.00 C ATOM 1184 CG GLN A 90 49.627 23.936 16.904 1.00 0.00 C ATOM 1185 CD GLN A 90 49.404 25.254 16.176 1.00 0.00 C ATOM 1186 OE1 GLN A 90 49.254 25.291 14.956 1.00 0.00 O ATOM 1187 NE2 GLN A 90 49.407 26.373 16.949 1.00 0.00 N ATOM 0 H GLN A 90 46.787 21.269 16.308 1.00 0.00 H new ATOM 0 HA GLN A 90 47.549 22.965 18.469 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.998 21.906 16.683 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.278 23.012 15.529 1.00 0.00 H new ATOM 0 HG2 GLN A 90 49.638 24.116 17.979 1.00 0.00 H new ATOM 0 HG3 GLN A 90 50.606 23.539 16.637 1.00 0.00 H new ATOM 0 HE21 GLN A 90 49.535 26.295 17.958 1.00 0.00 H new ATOM 0 HE22 GLN A 90 49.281 27.290 16.520 1.00 0.00 H new ATOM 1196 N VAL A 91 46.058 24.526 16.019 1.00 0.00 N ATOM 1197 CA VAL A 91 45.185 25.629 15.760 1.00 0.00 C ATOM 1198 C VAL A 91 43.787 25.141 15.596 1.00 0.00 C ATOM 1199 O VAL A 91 43.503 24.132 14.951 1.00 0.00 O ATOM 1200 CB VAL A 91 45.651 26.541 14.664 1.00 0.00 C ATOM 1201 CG1 VAL A 91 45.502 25.922 13.265 1.00 0.00 C ATOM 1202 CG2 VAL A 91 44.937 27.900 14.753 1.00 0.00 C ATOM 0 H VAL A 91 46.344 24.025 15.178 1.00 0.00 H new ATOM 0 HA VAL A 91 45.208 26.279 16.634 1.00 0.00 H new ATOM 0 HB VAL A 91 46.719 26.697 14.813 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.856 26.629 12.515 1.00 0.00 H new ATOM 0 HG12 VAL A 91 46.091 25.007 13.207 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.453 25.690 13.079 1.00 0.00 H new ATOM 0 HG21 VAL A 91 45.288 28.548 13.950 1.00 0.00 H new ATOM 0 HG22 VAL A 91 43.861 27.753 14.657 1.00 0.00 H new ATOM 0 HG23 VAL A 91 45.155 28.363 15.715 1.00 0.00 H new ATOM 1212 N VAL A 92 42.859 25.816 16.297 1.00 0.00 N ATOM 1213 CA VAL A 92 41.534 25.367 16.593 1.00 0.00 C ATOM 1214 C VAL A 92 40.535 26.373 16.134 1.00 0.00 C ATOM 1215 O VAL A 92 40.444 27.473 16.676 1.00 0.00 O ATOM 1216 CB VAL A 92 41.426 25.159 18.074 1.00 0.00 C ATOM 1217 CG1 VAL A 92 40.017 24.651 18.426 1.00 0.00 C ATOM 1218 CG2 VAL A 92 42.468 24.111 18.498 1.00 0.00 C ATOM 0 H VAL A 92 43.049 26.741 16.684 1.00 0.00 H new ATOM 0 HA VAL A 92 41.331 24.431 16.073 1.00 0.00 H new ATOM 0 HB VAL A 92 41.605 26.100 18.595 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.943 24.501 19.503 1.00 0.00 H new ATOM 0 HG12 VAL A 92 39.276 25.385 18.110 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.833 23.706 17.915 1.00 0.00 H new ATOM 0 HG21 VAL A 92 42.403 23.948 19.574 1.00 0.00 H new ATOM 0 HG22 VAL A 92 42.274 23.174 17.976 1.00 0.00 H new ATOM 0 HG23 VAL A 92 43.466 24.468 18.245 1.00 0.00 H new ATOM 1228 N HIS A 93 39.730 26.047 15.107 1.00 0.00 N ATOM 1229 CA HIS A 93 38.757 26.933 14.549 1.00 0.00 C ATOM 1230 C HIS A 93 37.390 26.801 15.129 1.00 0.00 C ATOM 1231 O HIS A 93 36.627 25.909 14.761 1.00 0.00 O ATOM 1232 CB HIS A 93 38.616 26.681 13.039 1.00 0.00 C ATOM 1233 CG HIS A 93 39.862 26.923 12.240 1.00 0.00 C ATOM 1234 ND1 HIS A 93 41.140 27.220 12.595 1.00 0.00 N flip ATOM 1235 CD2 HIS A 93 39.865 26.853 10.860 1.00 0.00 C flip ATOM 1236 CE1 HIS A 93 41.937 27.350 11.474 1.00 0.00 C flip ATOM 1237 NE2 HIS A 93 41.134 27.122 10.451 1.00 0.00 N flip ATOM 0 H HIS A 93 39.758 25.136 14.650 1.00 0.00 H new ATOM 0 HA HIS A 93 39.132 27.930 14.781 1.00 0.00 H new ATOM 0 HB2 HIS A 93 38.298 25.650 12.886 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.823 27.320 12.651 1.00 0.00 H new ATOM 0 HD2 HIS A 93 39.020 26.627 10.226 1.00 0.00 H new ATOM 0 HE1 HIS A 93 42.990 27.587 11.441 1.00 0.00 H new ATOM 0 HE2 HIS A 93 41.429 27.145 9.475 1.00 0.00 H new ATOM 1245 N LEU A 94 36.985 27.701 16.042 1.00 0.00 N ATOM 1246 CA LEU A 94 35.635 27.842 16.495 1.00 0.00 C ATOM 1247 C LEU A 94 34.872 28.855 15.714 1.00 0.00 C ATOM 1248 O LEU A 94 35.384 29.908 15.335 1.00 0.00 O ATOM 1249 CB LEU A 94 35.547 28.322 17.953 1.00 0.00 C ATOM 1250 CG LEU A 94 35.730 27.275 19.065 1.00 0.00 C ATOM 1251 CD1 LEU A 94 34.455 26.434 19.249 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.963 26.371 18.906 1.00 0.00 C ATOM 0 H LEU A 94 37.626 28.360 16.484 1.00 0.00 H new ATOM 0 HA LEU A 94 35.217 26.843 16.375 1.00 0.00 H new ATOM 0 HB2 LEU A 94 36.299 29.098 18.096 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.574 28.792 18.093 1.00 0.00 H new ATOM 0 HG LEU A 94 35.916 27.856 19.969 1.00 0.00 H new ATOM 0 HD11 LEU A 94 34.613 25.702 20.041 1.00 0.00 H new ATOM 0 HD12 LEU A 94 33.624 27.087 19.518 1.00 0.00 H new ATOM 0 HD13 LEU A 94 34.223 25.917 18.318 1.00 0.00 H new ATOM 0 HD21 LEU A 94 37.007 25.666 19.737 1.00 0.00 H new ATOM 0 HD22 LEU A 94 36.893 25.821 17.967 1.00 0.00 H new ATOM 0 HD23 LEU A 94 37.865 26.983 18.901 1.00 0.00 H new ATOM 1264 N LEU A 95 33.562 28.608 15.533 1.00 0.00 N ATOM 1265 CA LEU A 95 32.588 29.622 15.272 1.00 0.00 C ATOM 1266 C LEU A 95 31.677 29.664 16.449 1.00 0.00 C ATOM 1267 O LEU A 95 31.159 28.636 16.884 1.00 0.00 O ATOM 1268 CB LEU A 95 31.769 29.336 14.001 1.00 0.00 C ATOM 1269 CG LEU A 95 30.699 30.385 13.656 1.00 0.00 C ATOM 1270 CD1 LEU A 95 31.298 31.761 13.324 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.821 29.879 12.498 1.00 0.00 C ATOM 0 H LEU A 95 33.167 27.668 15.570 1.00 0.00 H new ATOM 0 HA LEU A 95 33.096 30.573 15.111 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.455 29.251 13.158 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.281 28.368 14.114 1.00 0.00 H new ATOM 0 HG LEU A 95 30.084 30.523 14.545 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.495 32.460 13.089 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.860 32.130 14.182 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.964 31.671 12.466 1.00 0.00 H new ATOM 0 HD21 LEU A 95 29.066 30.628 12.260 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.443 29.700 11.621 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.331 28.950 12.792 1.00 0.00 H new ATOM 1283 N LEU A 96 31.468 30.852 17.043 1.00 0.00 N ATOM 1284 CA LEU A 96 30.763 30.961 18.282 1.00 0.00 C ATOM 1285 C LEU A 96 29.792 32.090 18.256 1.00 0.00 C ATOM 1286 O LEU A 96 29.974 33.069 17.534 1.00 0.00 O ATOM 1287 CB LEU A 96 31.800 31.118 19.406 1.00 0.00 C ATOM 1288 CG LEU A 96 31.377 30.524 20.761 1.00 0.00 C ATOM 1289 CD1 LEU A 96 32.601 29.881 21.435 1.00 0.00 C ATOM 1290 CD2 LEU A 96 30.686 31.537 21.689 1.00 0.00 C ATOM 0 H LEU A 96 31.789 31.742 16.663 1.00 0.00 H new ATOM 0 HA LEU A 96 30.172 30.062 18.457 1.00 0.00 H new ATOM 0 HB2 LEU A 96 32.730 30.644 19.092 1.00 0.00 H new ATOM 0 HB3 LEU A 96 32.012 32.179 19.540 1.00 0.00 H new ATOM 0 HG LEU A 96 30.622 29.763 20.565 1.00 0.00 H new ATOM 0 HD11 LEU A 96 32.307 29.458 22.396 1.00 0.00 H new ATOM 0 HD12 LEU A 96 32.995 29.091 20.796 1.00 0.00 H new ATOM 0 HD13 LEU A 96 33.370 30.638 21.591 1.00 0.00 H new ATOM 0 HD21 LEU A 96 30.416 31.048 22.625 1.00 0.00 H new ATOM 0 HD22 LEU A 96 31.365 32.364 21.895 1.00 0.00 H new ATOM 0 HD23 LEU A 96 29.786 31.918 21.206 1.00 0.00 H new ATOM 1302 N GLU A 97 28.700 31.982 19.035 1.00 0.00 N ATOM 1303 CA GLU A 97 27.716 33.010 19.176 1.00 0.00 C ATOM 1304 C GLU A 97 27.639 33.508 20.579 1.00 0.00 C ATOM 1305 O GLU A 97 27.529 32.768 21.555 1.00 0.00 O ATOM 1306 CB GLU A 97 26.323 32.538 18.724 1.00 0.00 C ATOM 1307 CG GLU A 97 25.319 33.678 18.541 1.00 0.00 C ATOM 1308 CD GLU A 97 23.958 33.173 18.084 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.821 32.719 16.916 1.00 0.00 O ATOM 1310 OE2 GLU A 97 23.001 33.231 18.902 1.00 0.00 O ATOM 0 H GLU A 97 28.495 31.149 19.586 1.00 0.00 H new ATOM 0 HA GLU A 97 28.034 33.827 18.528 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.420 31.996 17.783 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.931 31.834 19.458 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.208 34.218 19.482 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.706 34.388 17.810 1.00 0.00 H new ATOM 1317 N LYS A 98 27.657 34.845 20.717 1.00 0.00 N ATOM 1318 CA LYS A 98 27.543 35.589 21.933 1.00 0.00 C ATOM 1319 C LYS A 98 26.132 35.607 22.412 1.00 0.00 C ATOM 1320 O LYS A 98 25.194 35.916 21.680 1.00 0.00 O ATOM 1321 CB LYS A 98 27.993 37.031 21.639 1.00 0.00 C ATOM 1322 CG LYS A 98 28.005 38.029 22.798 1.00 0.00 C ATOM 1323 CD LYS A 98 28.925 37.653 23.962 1.00 0.00 C ATOM 1324 CE LYS A 98 30.420 37.673 23.639 1.00 0.00 C ATOM 1325 NZ LYS A 98 31.172 37.009 24.727 1.00 0.00 N ATOM 0 H LYS A 98 27.760 35.457 19.907 1.00 0.00 H new ATOM 0 HA LYS A 98 28.160 35.129 22.705 1.00 0.00 H new ATOM 0 HB2 LYS A 98 29.000 36.989 21.224 1.00 0.00 H new ATOM 0 HB3 LYS A 98 27.344 37.431 20.860 1.00 0.00 H new ATOM 0 HG2 LYS A 98 28.307 39.004 22.416 1.00 0.00 H new ATOM 0 HG3 LYS A 98 26.989 38.136 23.177 1.00 0.00 H new ATOM 0 HD2 LYS A 98 28.738 38.339 24.789 1.00 0.00 H new ATOM 0 HD3 LYS A 98 28.657 36.655 24.309 1.00 0.00 H new ATOM 0 HE2 LYS A 98 30.605 37.165 22.693 1.00 0.00 H new ATOM 0 HE3 LYS A 98 30.763 38.701 23.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 32.087 36.674 24.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 31.334 37.685 25.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 30.624 36.200 25.084 1.00 0.00 H new ATOM 1339 N GLY A 99 25.931 35.243 23.691 1.00 0.00 N ATOM 1340 CA GLY A 99 24.649 35.253 24.327 1.00 0.00 C ATOM 1341 C GLY A 99 24.368 36.576 24.954 1.00 0.00 C ATOM 1342 O GLY A 99 24.985 37.592 24.636 1.00 0.00 O ATOM 0 H GLY A 99 26.685 34.931 24.303 1.00 0.00 H new ATOM 0 HA2 GLY A 99 23.875 35.023 23.595 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.611 34.472 25.087 1.00 0.00 H new ATOM 1346 N GLN A 100 23.414 36.620 25.901 1.00 0.00 N ATOM 1347 CA GLN A 100 22.992 37.840 26.514 1.00 0.00 C ATOM 1348 C GLN A 100 23.969 38.410 27.485 1.00 0.00 C ATOM 1349 O GLN A 100 25.030 37.845 27.746 1.00 0.00 O ATOM 1350 CB GLN A 100 21.610 37.592 27.141 1.00 0.00 C ATOM 1351 CG GLN A 100 21.587 36.538 28.250 1.00 0.00 C ATOM 1352 CD GLN A 100 20.190 35.979 28.482 1.00 0.00 C ATOM 1353 OE1 GLN A 100 19.209 36.293 27.809 1.00 0.00 O ATOM 1354 NE2 GLN A 100 20.093 35.057 29.476 1.00 0.00 N ATOM 0 H GLN A 100 22.927 35.793 26.247 1.00 0.00 H new ATOM 0 HA GLN A 100 22.929 38.611 25.746 1.00 0.00 H new ATOM 0 HB2 GLN A 100 21.236 38.533 27.546 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.920 37.287 26.355 1.00 0.00 H new ATOM 0 HG2 GLN A 100 22.264 35.724 27.990 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.959 36.978 29.175 1.00 0.00 H new ATOM 0 HE21 GLN A 100 20.917 34.809 30.024 1.00 0.00 H new ATOM 0 HE22 GLN A 100 19.196 34.613 29.674 1.00 0.00 H new ATOM 1363 N VAL A 101 23.658 39.587 28.059 1.00 0.00 N ATOM 1364 CA VAL A 101 24.514 40.298 28.958 1.00 0.00 C ATOM 1365 C VAL A 101 24.082 40.017 30.355 1.00 0.00 C ATOM 1366 O VAL A 101 22.878 40.071 30.598 1.00 0.00 O ATOM 1367 CB VAL A 101 24.481 41.770 28.676 1.00 0.00 C ATOM 1368 CG1 VAL A 101 25.405 42.570 29.611 1.00 0.00 C ATOM 1369 CG2 VAL A 101 24.927 42.032 27.227 1.00 0.00 C ATOM 0 H VAL A 101 22.772 40.063 27.889 1.00 0.00 H new ATOM 0 HA VAL A 101 25.542 39.964 28.821 1.00 0.00 H new ATOM 0 HB VAL A 101 23.455 42.098 28.840 1.00 0.00 H new ATOM 0 HG11 VAL A 101 25.343 43.630 29.364 1.00 0.00 H new ATOM 0 HG12 VAL A 101 25.095 42.420 30.645 1.00 0.00 H new ATOM 0 HG13 VAL A 101 26.432 42.228 29.487 1.00 0.00 H new ATOM 0 HG21 VAL A 101 24.901 43.103 27.026 1.00 0.00 H new ATOM 0 HG22 VAL A 101 25.942 41.661 27.086 1.00 0.00 H new ATOM 0 HG23 VAL A 101 24.254 41.518 26.541 1.00 0.00 H new ATOM 1379 N PRO A 102 24.912 39.707 31.308 1.00 0.00 N ATOM 1380 CA PRO A 102 24.490 39.492 32.660 1.00 0.00 C ATOM 1381 C PRO A 102 24.130 40.749 33.375 1.00 0.00 C ATOM 1382 O PRO A 102 23.307 40.672 34.326 1.00 0.00 O ATOM 1383 CB PRO A 102 25.674 38.795 33.327 1.00 0.00 C ATOM 1384 CG PRO A 102 26.898 39.296 32.542 1.00 0.00 C ATOM 1385 CD PRO A 102 26.326 39.417 31.121 1.00 0.00 C ATOM 1386 OXT PRO A 102 24.635 41.852 33.034 1.00 0.00 O ATOM 0 HA PRO A 102 23.576 38.899 32.690 1.00 0.00 H new ATOM 0 HB2 PRO A 102 25.745 39.054 34.383 1.00 0.00 H new ATOM 0 HB3 PRO A 102 25.581 37.710 33.270 1.00 0.00 H new ATOM 0 HG2 PRO A 102 27.264 40.251 32.919 1.00 0.00 H new ATOM 0 HG3 PRO A 102 27.731 38.594 32.590 1.00 0.00 H new ATOM 0 HD2 PRO A 102 26.821 40.211 30.562 1.00 0.00 H new ATOM 0 HD3 PRO A 102 26.469 38.495 30.558 1.00 0.00 H new TER 1394 PRO A 102