USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=19 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 60 HIS : no HE2:sc= 0.832 K(o=1.7,f=-5.3!) USER MOD Set 1.2: A 98 LYS NZ :NH3+ 155:sc= 0.835 (180deg=1.16) USER MOD Set 2.1: A 20 LYS NZ :NH3+ -163:sc= 2.08 (180deg=1.22) USER MOD Set 2.2: A 88 THR OG1 : rot -88:sc= 1.99 USER MOD Set 3.1: A 77 THR OG1 : rot -109:sc= 0.673 USER MOD Set 3.2: A 80 GLN : amide:sc= 0.718 K(o=1.4,f=0.023) 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 37:sc= 0.106 USER MOD Single : A 24 SER OG : rot -47:sc= 1.21 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00502 USER MOD Single : A 34 ASN : amide:sc= 0.663 K(o=0.66,f=-5.8!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.00388 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) USER MOD Single : A 43 TYR OH : rot 166:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0357) USER MOD Single : A 50 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00162) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00016) USER MOD Single : A 69 ASN : amide:sc= -0.155 X(o=-0.15,f=-0.15) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 90 GLN : amide:sc= -0.0183 X(o=-0.018,f=-0.027) USER MOD Single : A 93 HIS : no HD1:sc= -0.411 X(o=-0.41,f=-0.00018) USER MOD Single : A 100 GLN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 26.644 42.786 21.475 1.00 0.00 N ATOM 2 CA LYS A 9 25.303 42.616 21.008 1.00 0.00 C ATOM 3 C LYS A 9 24.748 41.356 21.581 1.00 0.00 C ATOM 4 O LYS A 9 25.516 40.412 21.754 1.00 0.00 O ATOM 5 CB LYS A 9 25.251 42.543 19.473 1.00 0.00 C ATOM 6 CG LYS A 9 25.745 43.810 18.772 1.00 0.00 C ATOM 7 CD LYS A 9 25.715 43.684 17.247 1.00 0.00 C ATOM 8 CE LYS A 9 26.199 44.935 16.511 1.00 0.00 C ATOM 9 NZ LYS A 9 26.122 44.726 15.048 1.00 0.00 N ATOM 0 HA LYS A 9 24.713 43.475 21.327 1.00 0.00 H new ATOM 0 HB2 LYS A 9 25.853 41.698 19.139 1.00 0.00 H new ATOM 0 HB3 LYS A 9 24.225 42.346 19.164 1.00 0.00 H new ATOM 0 HG2 LYS A 9 25.127 44.655 19.076 1.00 0.00 H new ATOM 0 HG3 LYS A 9 26.763 44.027 19.096 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.334 42.838 16.950 1.00 0.00 H new ATOM 0 HD3 LYS A 9 24.696 43.460 16.931 1.00 0.00 H new ATOM 0 HE2 LYS A 9 25.590 45.793 16.796 1.00 0.00 H new ATOM 0 HE3 LYS A 9 27.225 45.162 16.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.453 45.581 14.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.722 43.919 14.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.137 44.530 14.777 1.00 0.00 H new ATOM 23 N PRO A 10 23.491 41.225 21.888 1.00 0.00 N ATOM 24 CA PRO A 10 22.918 40.035 22.445 1.00 0.00 C ATOM 25 C PRO A 10 22.686 38.962 21.438 1.00 0.00 C ATOM 26 O PRO A 10 21.545 38.561 21.213 1.00 0.00 O ATOM 27 CB PRO A 10 21.620 40.525 23.083 1.00 0.00 C ATOM 28 CG PRO A 10 21.167 41.652 22.141 1.00 0.00 C ATOM 29 CD PRO A 10 22.511 42.292 21.759 1.00 0.00 C ATOM 0 HA PRO A 10 23.588 39.559 23.160 1.00 0.00 H new ATOM 0 HB2 PRO A 10 20.877 39.730 23.145 1.00 0.00 H new ATOM 0 HB3 PRO A 10 21.783 40.889 24.097 1.00 0.00 H new ATOM 0 HG2 PRO A 10 20.633 41.270 21.271 1.00 0.00 H new ATOM 0 HG3 PRO A 10 20.502 42.359 22.637 1.00 0.00 H new ATOM 0 HD2 PRO A 10 22.486 42.683 20.742 1.00 0.00 H new ATOM 0 HD3 PRO A 10 22.750 43.128 22.416 1.00 0.00 H new ATOM 37 N GLY A 11 23.751 38.448 20.798 1.00 0.00 N ATOM 38 CA GLY A 11 23.697 37.385 19.844 1.00 0.00 C ATOM 39 C GLY A 11 24.260 37.734 18.510 1.00 0.00 C ATOM 40 O GLY A 11 23.687 37.430 17.464 1.00 0.00 O ATOM 0 H GLY A 11 24.698 38.792 20.954 1.00 0.00 H new ATOM 0 HA2 GLY A 11 24.239 36.527 20.242 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.659 37.076 19.719 1.00 0.00 H new ATOM 44 N ASP A 12 25.468 38.325 18.500 1.00 0.00 N ATOM 45 CA ASP A 12 26.321 38.365 17.353 1.00 0.00 C ATOM 46 C ASP A 12 27.182 37.150 17.392 1.00 0.00 C ATOM 47 O ASP A 12 27.230 36.438 18.395 1.00 0.00 O ATOM 48 CB ASP A 12 27.133 39.671 17.365 1.00 0.00 C ATOM 49 CG ASP A 12 27.834 40.018 16.060 1.00 0.00 C ATOM 50 OD1 ASP A 12 27.604 39.351 15.016 1.00 0.00 O ATOM 51 OD2 ASP A 12 28.629 40.995 16.070 1.00 0.00 O ATOM 0 H ASP A 12 25.864 38.790 19.317 1.00 0.00 H new ATOM 0 HA ASP A 12 25.754 38.359 16.422 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.465 40.491 17.628 1.00 0.00 H new ATOM 0 HB3 ASP A 12 27.883 39.605 18.154 1.00 0.00 H new ATOM 56 N THR A 13 27.884 36.840 16.288 1.00 0.00 N ATOM 57 CA THR A 13 28.760 35.714 16.198 1.00 0.00 C ATOM 58 C THR A 13 30.184 36.151 16.262 1.00 0.00 C ATOM 59 O THR A 13 30.518 37.303 15.992 1.00 0.00 O ATOM 60 CB THR A 13 28.584 34.864 14.975 1.00 0.00 C ATOM 61 OG1 THR A 13 28.619 35.613 13.768 1.00 0.00 O ATOM 62 CG2 THR A 13 27.220 34.157 15.047 1.00 0.00 C ATOM 0 H THR A 13 27.841 37.391 15.430 1.00 0.00 H new ATOM 0 HA THR A 13 28.489 35.095 17.053 1.00 0.00 H new ATOM 0 HB THR A 13 29.414 34.157 14.961 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.501 35.009 13.005 1.00 0.00 H new ATOM 0 HG21 THR A 13 27.084 33.537 14.161 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.182 33.530 15.938 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.426 34.902 15.093 1.00 0.00 H new ATOM 70 N PHE A 14 31.088 35.210 16.588 1.00 0.00 N ATOM 71 CA PHE A 14 32.496 35.445 16.493 1.00 0.00 C ATOM 72 C PHE A 14 33.147 34.165 16.097 1.00 0.00 C ATOM 73 O PHE A 14 32.803 33.083 16.572 1.00 0.00 O ATOM 74 CB PHE A 14 33.237 35.943 17.745 1.00 0.00 C ATOM 75 CG PHE A 14 32.402 36.569 18.808 1.00 0.00 C ATOM 76 CD1 PHE A 14 31.643 35.754 19.615 1.00 0.00 C ATOM 77 CD2 PHE A 14 32.533 37.898 19.133 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.050 36.244 20.754 1.00 0.00 C ATOM 79 CE2 PHE A 14 31.922 38.405 20.256 1.00 0.00 C ATOM 80 CZ PHE A 14 31.185 37.576 21.069 1.00 0.00 C ATOM 0 H PHE A 14 30.841 34.278 16.920 1.00 0.00 H new ATOM 0 HA PHE A 14 32.572 36.262 15.775 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.771 35.100 18.183 1.00 0.00 H new ATOM 0 HB3 PHE A 14 33.988 36.667 17.431 1.00 0.00 H new ATOM 0 HD1 PHE A 14 31.511 34.715 19.350 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.120 38.549 18.502 1.00 0.00 H new ATOM 0 HE1 PHE A 14 30.482 35.588 21.397 1.00 0.00 H new ATOM 0 HE2 PHE A 14 32.021 39.453 20.499 1.00 0.00 H new ATOM 0 HZ PHE A 14 30.712 37.971 21.956 1.00 0.00 H new ATOM 90 N GLU A 15 34.136 34.271 15.192 1.00 0.00 N ATOM 91 CA GLU A 15 35.077 33.240 14.882 1.00 0.00 C ATOM 92 C GLU A 15 36.289 33.403 15.734 1.00 0.00 C ATOM 93 O GLU A 15 36.839 34.494 15.874 1.00 0.00 O ATOM 94 CB GLU A 15 35.478 33.259 13.398 1.00 0.00 C ATOM 95 CG GLU A 15 34.330 32.835 12.480 1.00 0.00 C ATOM 96 CD GLU A 15 34.772 32.769 11.024 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.585 31.865 10.694 1.00 0.00 O ATOM 98 OE2 GLU A 15 34.302 33.604 10.207 1.00 0.00 O ATOM 0 H GLU A 15 34.287 35.121 14.648 1.00 0.00 H new ATOM 0 HA GLU A 15 34.603 32.279 15.084 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.806 34.262 13.126 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.327 32.593 13.245 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.955 31.860 12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.505 33.540 12.579 1.00 0.00 H new ATOM 105 N VAL A 16 36.731 32.295 16.356 1.00 0.00 N ATOM 106 CA VAL A 16 37.843 32.267 17.254 1.00 0.00 C ATOM 107 C VAL A 16 38.853 31.336 16.677 1.00 0.00 C ATOM 108 O VAL A 16 38.606 30.140 16.534 1.00 0.00 O ATOM 109 CB VAL A 16 37.400 31.886 18.635 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.537 31.340 19.515 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.782 33.122 19.310 1.00 0.00 C ATOM 0 H VAL A 16 36.295 31.382 16.228 1.00 0.00 H new ATOM 0 HA VAL A 16 38.296 33.252 17.362 1.00 0.00 H new ATOM 0 HB VAL A 16 36.674 31.080 18.532 1.00 0.00 H new ATOM 0 HG11 VAL A 16 38.145 31.085 20.499 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.960 30.449 19.051 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.313 32.099 19.619 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.454 32.861 20.316 1.00 0.00 H new ATOM 0 HG22 VAL A 16 37.526 33.917 19.365 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.927 33.465 18.728 1.00 0.00 H new ATOM 121 N GLU A 17 40.029 31.867 16.297 1.00 0.00 N ATOM 122 CA GLU A 17 41.137 31.129 15.775 1.00 0.00 C ATOM 123 C GLU A 17 42.194 31.090 16.825 1.00 0.00 C ATOM 124 O GLU A 17 43.026 31.986 16.961 1.00 0.00 O ATOM 125 CB GLU A 17 41.654 31.732 14.457 1.00 0.00 C ATOM 126 CG GLU A 17 40.813 31.285 13.261 1.00 0.00 C ATOM 127 CD GLU A 17 41.079 32.083 11.993 1.00 0.00 C ATOM 128 OE1 GLU A 17 42.230 32.071 11.479 1.00 0.00 O ATOM 129 OE2 GLU A 17 40.131 32.749 11.497 1.00 0.00 O ATOM 0 H GLU A 17 40.216 32.868 16.358 1.00 0.00 H new ATOM 0 HA GLU A 17 40.826 30.114 15.530 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.641 32.820 14.525 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.691 31.435 14.303 1.00 0.00 H new ATOM 0 HG2 GLU A 17 41.009 30.231 13.064 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.757 31.370 13.518 1.00 0.00 H new ATOM 136 N LEU A 18 42.150 30.039 17.662 1.00 0.00 N ATOM 137 CA LEU A 18 42.819 29.978 18.925 1.00 0.00 C ATOM 138 C LEU A 18 43.739 28.810 19.020 1.00 0.00 C ATOM 139 O LEU A 18 43.387 27.673 18.712 1.00 0.00 O ATOM 140 CB LEU A 18 41.738 29.855 20.011 1.00 0.00 C ATOM 141 CG LEU A 18 42.210 29.670 21.463 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.986 30.886 21.999 1.00 0.00 C ATOM 143 CD2 LEU A 18 40.977 29.393 22.341 1.00 0.00 C ATOM 0 H LEU A 18 41.623 29.192 17.449 1.00 0.00 H new ATOM 0 HA LEU A 18 43.424 30.876 19.048 1.00 0.00 H new ATOM 0 HB2 LEU A 18 41.117 30.750 19.970 1.00 0.00 H new ATOM 0 HB3 LEU A 18 41.098 29.011 19.755 1.00 0.00 H new ATOM 0 HG LEU A 18 42.904 28.830 21.492 1.00 0.00 H new ATOM 0 HD11 LEU A 18 43.293 30.697 23.028 1.00 0.00 H new ATOM 0 HD12 LEU A 18 43.868 31.055 21.382 1.00 0.00 H new ATOM 0 HD13 LEU A 18 42.347 31.768 21.968 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.290 29.259 23.376 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.288 30.235 22.277 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.478 28.489 21.993 1.00 0.00 H new ATOM 155 N ALA A 19 44.981 29.029 19.489 1.00 0.00 N ATOM 156 CA ALA A 19 45.964 28.015 19.718 1.00 0.00 C ATOM 157 C ALA A 19 45.966 27.554 21.134 1.00 0.00 C ATOM 158 O ALA A 19 45.887 28.350 22.069 1.00 0.00 O ATOM 159 CB ALA A 19 47.364 28.525 19.337 1.00 0.00 C ATOM 0 H ALA A 19 45.317 29.964 19.721 1.00 0.00 H new ATOM 0 HA ALA A 19 45.703 27.166 19.087 1.00 0.00 H new ATOM 0 HB1 ALA A 19 48.099 27.740 19.518 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.377 28.798 18.282 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.610 29.398 19.941 1.00 0.00 H new ATOM 165 N LYS A 20 46.085 26.233 21.352 1.00 0.00 N ATOM 166 CA LYS A 20 46.138 25.653 22.659 1.00 0.00 C ATOM 167 C LYS A 20 47.386 25.926 23.424 1.00 0.00 C ATOM 168 O LYS A 20 48.481 26.031 22.873 1.00 0.00 O ATOM 169 CB LYS A 20 46.006 24.122 22.610 1.00 0.00 C ATOM 170 CG LYS A 20 44.731 23.564 21.972 1.00 0.00 C ATOM 171 CD LYS A 20 44.414 22.179 22.540 1.00 0.00 C ATOM 172 CE LYS A 20 43.179 21.484 21.960 1.00 0.00 C ATOM 173 NZ LYS A 20 43.514 20.654 20.781 1.00 0.00 N ATOM 0 H LYS A 20 46.146 25.548 20.599 1.00 0.00 H new ATOM 0 HA LYS A 20 45.299 26.131 23.165 1.00 0.00 H new ATOM 0 HB2 LYS A 20 46.862 23.724 22.065 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.072 23.742 23.629 1.00 0.00 H new ATOM 0 HG2 LYS A 20 43.897 24.240 22.159 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.855 23.501 20.891 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.279 21.535 22.379 1.00 0.00 H new ATOM 0 HD3 LYS A 20 44.282 22.271 23.618 1.00 0.00 H new ATOM 0 HE2 LYS A 20 42.722 20.858 22.726 1.00 0.00 H new ATOM 0 HE3 LYS A 20 42.440 22.234 21.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 42.646 20.437 20.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 44.174 21.173 20.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 43.958 19.768 21.095 1.00 0.00 H new ATOM 187 N THR A 21 47.275 26.010 24.762 1.00 0.00 N ATOM 188 CA THR A 21 48.373 26.132 25.669 1.00 0.00 C ATOM 189 C THR A 21 48.473 24.904 26.507 1.00 0.00 C ATOM 190 O THR A 21 47.552 24.537 27.236 1.00 0.00 O ATOM 191 CB THR A 21 48.337 27.339 26.558 1.00 0.00 C ATOM 192 OG1 THR A 21 47.112 27.463 27.267 1.00 0.00 O ATOM 193 CG2 THR A 21 48.496 28.612 25.711 1.00 0.00 C ATOM 0 H THR A 21 46.371 25.992 25.235 1.00 0.00 H new ATOM 0 HA THR A 21 49.252 26.259 25.037 1.00 0.00 H new ATOM 0 HB THR A 21 49.151 27.217 27.272 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.791 26.573 27.523 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.469 29.487 26.361 1.00 0.00 H new ATOM 0 HG22 THR A 21 49.449 28.581 25.183 1.00 0.00 H new ATOM 0 HG23 THR A 21 47.682 28.672 24.988 1.00 0.00 H new ATOM 201 N ASP A 22 49.605 24.182 26.417 1.00 0.00 N ATOM 202 CA ASP A 22 49.877 22.940 27.072 1.00 0.00 C ATOM 203 C ASP A 22 48.925 21.847 26.727 1.00 0.00 C ATOM 204 O ASP A 22 48.588 20.982 27.534 1.00 0.00 O ATOM 205 CB ASP A 22 50.025 23.144 28.589 1.00 0.00 C ATOM 206 CG ASP A 22 50.849 22.081 29.302 1.00 0.00 C ATOM 207 OD1 ASP A 22 51.622 21.339 28.639 1.00 0.00 O ATOM 208 OD2 ASP A 22 50.797 22.040 30.560 1.00 0.00 O ATOM 0 H ASP A 22 50.389 24.492 25.842 1.00 0.00 H new ATOM 0 HA ASP A 22 50.834 22.591 26.684 1.00 0.00 H new ATOM 0 HB2 ASP A 22 50.482 24.117 28.767 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.031 23.172 29.036 1.00 0.00 H new ATOM 213 N GLY A 23 48.406 21.841 25.486 1.00 0.00 N ATOM 214 CA GLY A 23 47.391 20.931 25.059 1.00 0.00 C ATOM 215 C GLY A 23 46.032 21.208 25.603 1.00 0.00 C ATOM 216 O GLY A 23 45.146 20.357 25.539 1.00 0.00 O ATOM 0 H GLY A 23 48.703 22.490 24.757 1.00 0.00 H new ATOM 0 HA2 GLY A 23 47.341 20.949 23.970 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.683 19.921 25.348 1.00 0.00 H new ATOM 220 N SER A 24 45.797 22.403 26.174 1.00 0.00 N ATOM 221 CA SER A 24 44.530 22.800 26.704 1.00 0.00 C ATOM 222 C SER A 24 44.011 24.035 26.053 1.00 0.00 C ATOM 223 O SER A 24 44.758 24.944 25.696 1.00 0.00 O ATOM 224 CB SER A 24 44.551 22.967 28.233 1.00 0.00 C ATOM 225 OG SER A 24 45.241 24.125 28.683 1.00 0.00 O ATOM 0 H SER A 24 46.517 23.119 26.270 1.00 0.00 H new ATOM 0 HA SER A 24 43.847 21.982 26.473 1.00 0.00 H new ATOM 0 HB2 SER A 24 43.524 23.005 28.597 1.00 0.00 H new ATOM 0 HB3 SER A 24 45.014 22.086 28.677 1.00 0.00 H new ATOM 0 HG SER A 24 46.102 24.193 28.220 1.00 0.00 H new ATOM 231 N LEU A 25 42.681 24.121 25.870 1.00 0.00 N ATOM 232 CA LEU A 25 42.016 25.343 25.541 1.00 0.00 C ATOM 233 C LEU A 25 41.704 26.103 26.785 1.00 0.00 C ATOM 234 O LEU A 25 42.183 27.216 26.993 1.00 0.00 O ATOM 235 CB LEU A 25 40.723 25.077 24.751 1.00 0.00 C ATOM 236 CG LEU A 25 40.958 24.596 23.310 1.00 0.00 C ATOM 237 CD1 LEU A 25 39.656 24.053 22.697 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.524 25.719 22.425 1.00 0.00 C ATOM 0 H LEU A 25 42.053 23.322 25.953 1.00 0.00 H new ATOM 0 HA LEU A 25 42.683 25.934 24.913 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.133 24.329 25.281 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.130 25.991 24.726 1.00 0.00 H new ATOM 0 HG LEU A 25 41.693 23.792 23.353 1.00 0.00 H new ATOM 0 HD11 LEU A 25 39.846 23.718 21.677 1.00 0.00 H new ATOM 0 HD12 LEU A 25 39.295 23.215 23.293 1.00 0.00 H new ATOM 0 HD13 LEU A 25 38.903 24.841 22.686 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.677 25.343 21.414 1.00 0.00 H new ATOM 0 HD22 LEU A 25 40.821 26.552 22.400 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.475 26.060 22.834 1.00 0.00 H new ATOM 250 N GLY A 26 40.906 25.532 27.705 1.00 0.00 N ATOM 251 CA GLY A 26 40.593 26.093 28.983 1.00 0.00 C ATOM 252 C GLY A 26 39.130 26.365 29.069 1.00 0.00 C ATOM 253 O GLY A 26 38.714 27.437 29.502 1.00 0.00 O ATOM 0 H GLY A 26 40.455 24.631 27.548 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.892 25.406 29.775 1.00 0.00 H new ATOM 0 HA3 GLY A 26 41.153 27.016 29.133 1.00 0.00 H new ATOM 257 N ILE A 27 38.299 25.388 28.665 1.00 0.00 N ATOM 258 CA ILE A 27 36.879 25.543 28.602 1.00 0.00 C ATOM 259 C ILE A 27 36.202 24.295 29.056 1.00 0.00 C ATOM 260 O ILE A 27 36.646 23.169 28.841 1.00 0.00 O ATOM 261 CB ILE A 27 36.405 25.981 27.248 1.00 0.00 C ATOM 262 CG1 ILE A 27 34.878 26.032 27.068 1.00 0.00 C ATOM 263 CG2 ILE A 27 37.088 25.157 26.144 1.00 0.00 C ATOM 264 CD1 ILE A 27 34.425 26.780 25.815 1.00 0.00 C ATOM 0 H ILE A 27 38.623 24.466 28.374 1.00 0.00 H new ATOM 0 HA ILE A 27 36.605 26.348 29.284 1.00 0.00 H new ATOM 0 HB ILE A 27 36.710 27.024 27.159 1.00 0.00 H new ATOM 0 HG12 ILE A 27 34.493 25.013 27.030 1.00 0.00 H new ATOM 0 HG13 ILE A 27 34.435 26.508 27.943 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.732 25.489 25.169 1.00 0.00 H new ATOM 0 HG22 ILE A 27 38.168 25.295 26.202 1.00 0.00 H new ATOM 0 HG23 ILE A 27 36.850 24.102 26.277 1.00 0.00 H new ATOM 0 HD11 ILE A 27 33.336 26.772 25.760 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.778 27.810 25.859 1.00 0.00 H new ATOM 0 HD13 ILE A 27 34.837 26.292 24.931 1.00 0.00 H new ATOM 276 N SER A 28 35.055 24.492 29.731 1.00 0.00 N ATOM 277 CA SER A 28 34.106 23.459 30.011 1.00 0.00 C ATOM 278 C SER A 28 32.821 23.832 29.356 1.00 0.00 C ATOM 279 O SER A 28 32.377 24.976 29.441 1.00 0.00 O ATOM 280 CB SER A 28 33.895 23.238 31.518 1.00 0.00 C ATOM 281 OG SER A 28 33.205 22.019 31.758 1.00 0.00 O ATOM 0 H SER A 28 34.778 25.404 30.095 1.00 0.00 H new ATOM 0 HA SER A 28 34.488 22.517 29.619 1.00 0.00 H new ATOM 0 HB2 SER A 28 34.859 23.221 32.026 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.329 24.070 31.936 1.00 0.00 H new ATOM 0 HG SER A 28 33.083 21.897 32.723 1.00 0.00 H new ATOM 287 N VAL A 29 32.186 22.882 28.647 1.00 0.00 N ATOM 288 CA VAL A 29 30.952 23.079 27.953 1.00 0.00 C ATOM 289 C VAL A 29 29.843 22.367 28.650 1.00 0.00 C ATOM 290 O VAL A 29 30.059 21.523 29.518 1.00 0.00 O ATOM 291 CB VAL A 29 31.000 22.683 26.508 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.942 23.644 25.764 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.439 21.221 26.319 1.00 0.00 C ATOM 0 H VAL A 29 32.550 21.934 28.554 1.00 0.00 H new ATOM 0 HA VAL A 29 30.767 24.153 27.966 1.00 0.00 H new ATOM 0 HB VAL A 29 29.995 22.754 26.093 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.986 23.367 24.711 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.568 24.664 25.856 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.940 23.583 26.197 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.458 20.981 25.256 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.435 21.083 26.740 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.735 20.561 26.827 1.00 0.00 H new ATOM 303 N THR A 30 28.590 22.714 28.305 1.00 0.00 N ATOM 304 CA THR A 30 27.407 22.097 28.819 1.00 0.00 C ATOM 305 C THR A 30 26.361 22.124 27.758 1.00 0.00 C ATOM 306 O THR A 30 26.592 22.625 26.658 1.00 0.00 O ATOM 307 CB THR A 30 26.923 22.749 30.080 1.00 0.00 C ATOM 308 OG1 THR A 30 26.001 21.949 30.806 1.00 0.00 O ATOM 309 CG2 THR A 30 26.326 24.147 29.849 1.00 0.00 C ATOM 0 H THR A 30 28.393 23.459 27.637 1.00 0.00 H new ATOM 0 HA THR A 30 27.637 21.066 29.088 1.00 0.00 H new ATOM 0 HB THR A 30 27.823 22.861 30.684 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.723 22.424 31.617 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.995 24.563 30.801 1.00 0.00 H new ATOM 0 HG22 THR A 30 27.083 24.798 29.412 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.476 24.072 29.171 1.00 0.00 H new ATOM 317 N GLY A 31 25.167 21.562 28.015 1.00 0.00 N ATOM 318 CA GLY A 31 24.071 21.586 27.097 1.00 0.00 C ATOM 319 C GLY A 31 24.022 20.399 26.197 1.00 0.00 C ATOM 320 O GLY A 31 24.642 19.369 26.453 1.00 0.00 O ATOM 0 H GLY A 31 24.957 21.076 28.887 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.139 21.645 27.658 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.135 22.489 26.490 1.00 0.00 H new ATOM 324 N GLY A 32 23.264 20.523 25.092 1.00 0.00 N ATOM 325 CA GLY A 32 22.979 19.462 24.175 1.00 0.00 C ATOM 326 C GLY A 32 21.570 18.999 24.326 1.00 0.00 C ATOM 327 O GLY A 32 20.899 19.299 25.312 1.00 0.00 O ATOM 0 H GLY A 32 22.829 21.406 24.825 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.148 19.803 23.153 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.661 18.630 24.350 1.00 0.00 H new ATOM 331 N VAL A 33 21.065 18.219 23.354 1.00 0.00 N ATOM 332 CA VAL A 33 19.712 17.758 23.312 1.00 0.00 C ATOM 333 C VAL A 33 19.357 16.824 24.417 1.00 0.00 C ATOM 334 O VAL A 33 18.197 16.656 24.791 1.00 0.00 O ATOM 335 CB VAL A 33 19.362 17.123 21.999 1.00 0.00 C ATOM 336 CG1 VAL A 33 17.837 17.165 21.801 1.00 0.00 C ATOM 337 CG2 VAL A 33 20.027 17.874 20.833 1.00 0.00 C ATOM 0 H VAL A 33 21.623 17.896 22.564 1.00 0.00 H new ATOM 0 HA VAL A 33 19.121 18.665 23.442 1.00 0.00 H new ATOM 0 HB VAL A 33 19.719 16.093 22.011 1.00 0.00 H new ATOM 0 HG11 VAL A 33 17.581 16.704 20.847 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.350 16.620 22.610 1.00 0.00 H new ATOM 0 HG13 VAL A 33 17.498 18.201 21.806 1.00 0.00 H new ATOM 0 HG21 VAL A 33 19.759 17.395 19.891 1.00 0.00 H new ATOM 0 HG22 VAL A 33 19.685 18.909 20.824 1.00 0.00 H new ATOM 0 HG23 VAL A 33 21.110 17.851 20.956 1.00 0.00 H new ATOM 347 N ASN A 34 20.371 16.200 25.043 1.00 0.00 N ATOM 348 CA ASN A 34 20.250 15.284 26.135 1.00 0.00 C ATOM 349 C ASN A 34 19.745 15.909 27.391 1.00 0.00 C ATOM 350 O ASN A 34 19.085 15.250 28.192 1.00 0.00 O ATOM 351 CB ASN A 34 21.596 14.582 26.380 1.00 0.00 C ATOM 352 CG ASN A 34 22.752 15.566 26.486 1.00 0.00 C ATOM 353 OD1 ASN A 34 23.196 16.137 25.490 1.00 0.00 O ATOM 354 ND2 ASN A 34 23.254 15.807 27.727 1.00 0.00 N ATOM 0 H ASN A 34 21.342 16.346 24.766 1.00 0.00 H new ATOM 0 HA ASN A 34 19.496 14.552 25.846 1.00 0.00 H new ATOM 0 HB2 ASN A 34 21.536 13.996 27.297 1.00 0.00 H new ATOM 0 HB3 ASN A 34 21.791 13.882 25.567 1.00 0.00 H new ATOM 0 HD21 ASN A 34 24.016 16.474 27.848 1.00 0.00 H new ATOM 0 HD22 ASN A 34 22.868 15.321 28.536 1.00 0.00 H new ATOM 361 N THR A 35 20.030 17.202 27.627 1.00 0.00 N ATOM 362 CA THR A 35 19.612 17.907 28.800 1.00 0.00 C ATOM 363 C THR A 35 18.652 18.985 28.434 1.00 0.00 C ATOM 364 O THR A 35 18.470 19.323 27.265 1.00 0.00 O ATOM 365 CB THR A 35 20.774 18.399 29.610 1.00 0.00 C ATOM 366 OG1 THR A 35 20.394 18.800 30.919 1.00 0.00 O ATOM 367 CG2 THR A 35 21.513 19.563 28.930 1.00 0.00 C ATOM 0 H THR A 35 20.570 17.777 26.980 1.00 0.00 H new ATOM 0 HA THR A 35 19.086 17.211 29.454 1.00 0.00 H new ATOM 0 HB THR A 35 21.448 17.546 29.683 1.00 0.00 H new ATOM 0 HG1 THR A 35 21.184 19.111 31.408 1.00 0.00 H new ATOM 0 HG21 THR A 35 22.345 19.882 29.558 1.00 0.00 H new ATOM 0 HG22 THR A 35 21.893 19.237 27.962 1.00 0.00 H new ATOM 0 HG23 THR A 35 20.826 20.397 28.788 1.00 0.00 H new ATOM 375 N SER A 36 17.947 19.578 29.414 1.00 0.00 N ATOM 376 CA SER A 36 16.798 20.401 29.197 1.00 0.00 C ATOM 377 C SER A 36 17.072 21.830 28.878 1.00 0.00 C ATOM 378 O SER A 36 16.319 22.714 29.285 1.00 0.00 O ATOM 379 CB SER A 36 15.875 20.386 30.427 1.00 0.00 C ATOM 380 OG SER A 36 15.550 19.051 30.788 1.00 0.00 O ATOM 0 H SER A 36 18.188 19.480 30.400 1.00 0.00 H new ATOM 0 HA SER A 36 16.336 19.955 28.317 1.00 0.00 H new ATOM 0 HB2 SER A 36 16.365 20.886 31.263 1.00 0.00 H new ATOM 0 HB3 SER A 36 14.963 20.943 30.212 1.00 0.00 H new ATOM 0 HG SER A 36 14.964 19.058 31.573 1.00 0.00 H new ATOM 386 N VAL A 37 18.136 22.150 28.121 1.00 0.00 N ATOM 387 CA VAL A 37 18.509 23.487 27.775 1.00 0.00 C ATOM 388 C VAL A 37 17.729 24.011 26.619 1.00 0.00 C ATOM 389 O VAL A 37 16.928 23.304 26.010 1.00 0.00 O ATOM 390 CB VAL A 37 19.981 23.623 27.517 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.737 23.439 28.844 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.447 22.626 26.444 1.00 0.00 C ATOM 0 H VAL A 37 18.764 21.446 27.733 1.00 0.00 H new ATOM 0 HA VAL A 37 18.266 24.095 28.647 1.00 0.00 H new ATOM 0 HB VAL A 37 20.197 24.618 27.127 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.808 23.536 28.669 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.415 24.200 29.555 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.524 22.450 29.250 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.517 22.746 26.276 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.244 21.609 26.780 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.911 22.815 25.514 1.00 0.00 H new ATOM 402 N ARG A 38 17.931 25.288 26.251 1.00 0.00 N ATOM 403 CA ARG A 38 17.168 25.969 25.252 1.00 0.00 C ATOM 404 C ARG A 38 17.455 25.516 23.862 1.00 0.00 C ATOM 405 O ARG A 38 18.475 25.848 23.261 1.00 0.00 O ATOM 406 CB ARG A 38 17.329 27.493 25.382 1.00 0.00 C ATOM 407 CG ARG A 38 16.326 28.341 24.598 1.00 0.00 C ATOM 408 CD ARG A 38 16.756 28.836 23.215 1.00 0.00 C ATOM 409 NE ARG A 38 17.842 29.837 23.412 1.00 0.00 N ATOM 410 CZ ARG A 38 18.261 30.727 22.464 1.00 0.00 C ATOM 411 NH1 ARG A 38 17.770 30.753 21.190 1.00 0.00 N ATOM 412 NH2 ARG A 38 19.250 31.608 22.793 1.00 0.00 N ATOM 0 H ARG A 38 18.657 25.871 26.667 1.00 0.00 H new ATOM 0 HA ARG A 38 16.127 25.705 25.439 1.00 0.00 H new ATOM 0 HB2 ARG A 38 17.253 27.758 26.437 1.00 0.00 H new ATOM 0 HB3 ARG A 38 18.334 27.762 25.057 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.412 27.759 24.479 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.073 29.211 25.204 1.00 0.00 H new ATOM 0 HD2 ARG A 38 17.108 28.005 22.603 1.00 0.00 H new ATOM 0 HD3 ARG A 38 15.913 29.284 22.690 1.00 0.00 H new ATOM 0 HE ARG A 38 18.306 29.859 24.320 1.00 0.00 H new ATOM 0 HH11 ARG A 38 17.053 30.085 20.906 1.00 0.00 H new ATOM 0 HH12 ARG A 38 18.120 31.440 20.523 1.00 0.00 H new ATOM 0 HH21 ARG A 38 19.658 31.591 23.728 1.00 0.00 H new ATOM 0 HH22 ARG A 38 19.582 32.283 22.104 1.00 0.00 H new ATOM 426 N HIS A 39 16.521 24.730 23.297 1.00 0.00 N ATOM 427 CA HIS A 39 16.426 24.312 21.932 1.00 0.00 C ATOM 428 C HIS A 39 17.651 23.764 21.285 1.00 0.00 C ATOM 429 O HIS A 39 18.046 24.177 20.195 1.00 0.00 O ATOM 430 CB HIS A 39 15.772 25.416 21.086 1.00 0.00 C ATOM 431 CG HIS A 39 14.971 24.892 19.931 1.00 0.00 C ATOM 432 ND1 HIS A 39 13.782 24.210 20.084 1.00 0.00 N ATOM 433 CD2 HIS A 39 15.211 24.921 18.592 1.00 0.00 C ATOM 434 CE1 HIS A 39 13.365 23.859 18.837 1.00 0.00 C ATOM 435 NE2 HIS A 39 14.212 24.260 17.908 1.00 0.00 N ATOM 0 H HIS A 39 15.756 24.350 23.855 1.00 0.00 H new ATOM 0 HA HIS A 39 15.789 23.428 21.974 1.00 0.00 H new ATOM 0 HB2 HIS A 39 15.124 26.016 21.725 1.00 0.00 H new ATOM 0 HB3 HIS A 39 16.549 26.080 20.707 1.00 0.00 H new ATOM 0 HD2 HIS A 39 16.064 25.395 18.130 1.00 0.00 H new ATOM 0 HE1 HIS A 39 12.453 23.318 18.633 1.00 0.00 H new ATOM 0 HE2 HIS A 39 14.143 24.113 16.901 1.00 0.00 H new ATOM 443 N GLY A 40 18.302 22.772 21.919 1.00 0.00 N ATOM 444 CA GLY A 40 19.437 22.080 21.390 1.00 0.00 C ATOM 445 C GLY A 40 20.701 22.864 21.326 1.00 0.00 C ATOM 446 O GLY A 40 21.408 22.840 20.320 1.00 0.00 O ATOM 0 H GLY A 40 18.025 22.437 22.842 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.613 21.192 21.997 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.193 21.736 20.385 1.00 0.00 H new ATOM 450 N GLY A 41 21.054 23.589 22.403 1.00 0.00 N ATOM 451 CA GLY A 41 22.222 24.413 22.446 1.00 0.00 C ATOM 452 C GLY A 41 23.331 23.821 23.246 1.00 0.00 C ATOM 453 O GLY A 41 23.111 23.253 24.315 1.00 0.00 O ATOM 0 H GLY A 41 20.512 23.602 23.267 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.571 24.590 21.429 1.00 0.00 H new ATOM 0 HA3 GLY A 41 21.958 25.384 22.866 1.00 0.00 H new ATOM 457 N ILE A 42 24.576 23.968 22.760 1.00 0.00 N ATOM 458 CA ILE A 42 25.788 23.658 23.453 1.00 0.00 C ATOM 459 C ILE A 42 26.280 24.960 23.986 1.00 0.00 C ATOM 460 O ILE A 42 26.355 25.935 23.242 1.00 0.00 O ATOM 461 CB ILE A 42 26.796 23.042 22.529 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.261 21.812 21.777 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.115 22.702 23.245 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.017 20.577 22.644 1.00 0.00 C ATOM 0 H ILE A 42 24.747 24.327 21.821 1.00 0.00 H new ATOM 0 HA ILE A 42 25.622 22.931 24.248 1.00 0.00 H new ATOM 0 HB ILE A 42 27.001 23.810 21.783 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.326 22.083 21.287 1.00 0.00 H new ATOM 0 HG13 ILE A 42 26.969 21.550 20.990 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.811 22.259 22.533 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.549 23.612 23.659 1.00 0.00 H new ATOM 0 HG23 ILE A 42 27.920 21.994 24.051 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.641 19.764 22.022 1.00 0.00 H new ATOM 0 HD12 ILE A 42 26.952 20.272 23.114 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.284 20.813 23.415 1.00 0.00 H new ATOM 476 N TYR A 43 26.585 25.073 25.291 1.00 0.00 N ATOM 477 CA TYR A 43 26.848 26.334 25.913 1.00 0.00 C ATOM 478 C TYR A 43 28.140 26.310 26.656 1.00 0.00 C ATOM 479 O TYR A 43 28.622 25.257 27.068 1.00 0.00 O ATOM 480 CB TYR A 43 25.754 26.699 26.932 1.00 0.00 C ATOM 481 CG TYR A 43 24.481 27.072 26.254 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.272 28.373 25.862 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.489 26.141 26.055 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.078 28.745 25.288 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.299 26.503 25.471 1.00 0.00 C ATOM 486 CZ TYR A 43 22.092 27.808 25.092 1.00 0.00 C ATOM 487 OH TYR A 43 20.860 28.188 24.516 1.00 0.00 O ATOM 0 H TYR A 43 26.650 24.276 25.925 1.00 0.00 H new ATOM 0 HA TYR A 43 26.879 27.067 25.107 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.579 25.854 27.598 1.00 0.00 H new ATOM 0 HB3 TYR A 43 26.094 27.529 27.552 1.00 0.00 H new ATOM 0 HD1 TYR A 43 25.050 29.108 26.006 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.646 25.117 26.360 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.916 29.771 24.992 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.528 25.764 25.310 1.00 0.00 H new ATOM 0 HH TYR A 43 20.368 27.387 24.238 1.00 0.00 H new ATOM 497 N VAL A 44 28.743 27.488 26.894 1.00 0.00 N ATOM 498 CA VAL A 44 29.865 27.631 27.768 1.00 0.00 C ATOM 499 C VAL A 44 29.444 27.559 29.195 1.00 0.00 C ATOM 500 O VAL A 44 28.632 28.355 29.665 1.00 0.00 O ATOM 501 CB VAL A 44 30.661 28.886 27.552 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.927 28.900 28.425 1.00 0.00 C ATOM 503 CG2 VAL A 44 31.072 28.978 26.073 1.00 0.00 C ATOM 0 H VAL A 44 28.442 28.364 26.467 1.00 0.00 H new ATOM 0 HA VAL A 44 30.519 26.795 27.521 1.00 0.00 H new ATOM 0 HB VAL A 44 30.039 29.737 27.830 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.482 29.821 28.246 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.645 28.845 29.476 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.553 28.044 28.172 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.650 29.888 25.912 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.678 28.111 25.809 1.00 0.00 H new ATOM 0 HG23 VAL A 44 30.179 29.000 25.448 1.00 0.00 H new ATOM 513 N LYS A 45 29.995 26.582 29.937 1.00 0.00 N ATOM 514 CA LYS A 45 29.711 26.321 31.314 1.00 0.00 C ATOM 515 C LYS A 45 30.648 27.075 32.193 1.00 0.00 C ATOM 516 O LYS A 45 30.226 27.792 33.098 1.00 0.00 O ATOM 517 CB LYS A 45 29.863 24.809 31.549 1.00 0.00 C ATOM 518 CG LYS A 45 29.641 24.263 32.961 1.00 0.00 C ATOM 519 CD LYS A 45 28.299 24.618 33.605 1.00 0.00 C ATOM 520 CE LYS A 45 27.772 23.561 34.577 1.00 0.00 C ATOM 521 NZ LYS A 45 28.772 23.202 35.607 1.00 0.00 N ATOM 0 H LYS A 45 30.682 25.934 29.551 1.00 0.00 H new ATOM 0 HA LYS A 45 28.698 26.643 31.555 1.00 0.00 H new ATOM 0 HB2 LYS A 45 29.167 24.299 30.883 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.868 24.525 31.238 1.00 0.00 H new ATOM 0 HG2 LYS A 45 29.732 23.177 32.930 1.00 0.00 H new ATOM 0 HG3 LYS A 45 30.441 24.632 33.603 1.00 0.00 H new ATOM 0 HD2 LYS A 45 28.402 25.564 34.136 1.00 0.00 H new ATOM 0 HD3 LYS A 45 27.561 24.773 32.818 1.00 0.00 H new ATOM 0 HE2 LYS A 45 26.870 23.934 35.063 1.00 0.00 H new ATOM 0 HE3 LYS A 45 27.489 22.667 34.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 28.350 22.534 36.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 29.596 22.759 35.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 29.075 24.060 36.111 1.00 0.00 H new ATOM 535 N ALA A 46 31.963 26.937 31.944 1.00 0.00 N ATOM 536 CA ALA A 46 32.964 27.624 32.699 1.00 0.00 C ATOM 537 C ALA A 46 34.166 27.832 31.844 1.00 0.00 C ATOM 538 O ALA A 46 34.404 27.086 30.895 1.00 0.00 O ATOM 539 CB ALA A 46 33.345 26.821 33.955 1.00 0.00 C ATOM 0 H ALA A 46 32.337 26.339 31.207 1.00 0.00 H new ATOM 0 HA ALA A 46 32.568 28.588 33.018 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.108 27.362 34.515 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.463 26.685 34.581 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.734 25.847 33.660 1.00 0.00 H new ATOM 545 N ILE A 47 34.973 28.863 32.153 1.00 0.00 N ATOM 546 CA ILE A 47 36.219 29.114 31.498 1.00 0.00 C ATOM 547 C ILE A 47 37.289 28.966 32.525 1.00 0.00 C ATOM 548 O ILE A 47 37.218 29.521 33.621 1.00 0.00 O ATOM 549 CB ILE A 47 36.192 30.392 30.715 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.858 30.231 29.338 1.00 0.00 C ATOM 551 CG2 ILE A 47 36.781 31.606 31.453 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.990 29.482 28.326 1.00 0.00 C ATOM 0 H ILE A 47 34.752 29.543 32.881 1.00 0.00 H new ATOM 0 HA ILE A 47 36.434 28.389 30.713 1.00 0.00 H new ATOM 0 HB ILE A 47 35.132 30.605 30.579 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.097 31.218 28.941 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.802 29.700 29.459 1.00 0.00 H new ATOM 0 HG21 ILE A 47 36.720 32.486 30.812 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.217 31.784 32.369 1.00 0.00 H new ATOM 0 HG23 ILE A 47 37.824 31.410 31.702 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.521 29.405 27.377 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.773 28.482 28.702 1.00 0.00 H new ATOM 0 HD13 ILE A 47 35.056 30.024 28.176 1.00 0.00 H new ATOM 564 N ILE A 48 38.272 28.086 32.263 1.00 0.00 N ATOM 565 CA ILE A 48 39.245 27.594 33.186 1.00 0.00 C ATOM 566 C ILE A 48 40.340 28.560 33.483 1.00 0.00 C ATOM 567 O ILE A 48 41.026 28.920 32.528 1.00 0.00 O ATOM 568 CB ILE A 48 39.843 26.296 32.727 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.745 25.290 32.340 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.781 25.699 33.790 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.836 24.821 33.476 1.00 0.00 C ATOM 0 H ILE A 48 38.394 27.689 31.331 1.00 0.00 H new ATOM 0 HA ILE A 48 38.690 27.437 34.111 1.00 0.00 H new ATOM 0 HB ILE A 48 40.441 26.507 31.840 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.123 25.741 31.566 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.221 24.415 31.897 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.196 24.760 33.423 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.592 26.398 33.994 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.221 25.515 34.707 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.102 24.116 33.087 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.436 24.333 34.244 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.321 25.679 33.908 1.00 0.00 H new ATOM 583 N PRO A 49 40.625 29.006 34.670 1.00 0.00 N ATOM 584 CA PRO A 49 41.586 30.044 34.904 1.00 0.00 C ATOM 585 C PRO A 49 42.968 29.792 34.407 1.00 0.00 C ATOM 586 O PRO A 49 43.575 28.783 34.762 1.00 0.00 O ATOM 587 CB PRO A 49 41.573 30.229 36.419 1.00 0.00 C ATOM 588 CG PRO A 49 40.110 29.945 36.798 1.00 0.00 C ATOM 589 CD PRO A 49 39.784 28.790 35.838 1.00 0.00 C ATOM 0 HA PRO A 49 41.301 30.929 34.335 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.258 29.540 36.914 1.00 0.00 H new ATOM 0 HB3 PRO A 49 41.874 31.237 36.704 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.002 29.656 37.844 1.00 0.00 H new ATOM 0 HG3 PRO A 49 39.466 30.810 36.638 1.00 0.00 H new ATOM 0 HD2 PRO A 49 39.994 27.825 36.300 1.00 0.00 H new ATOM 0 HD3 PRO A 49 38.728 28.791 35.567 1.00 0.00 H new ATOM 597 N LYS A 50 43.476 30.702 33.557 1.00 0.00 N ATOM 598 CA LYS A 50 44.755 30.696 32.918 1.00 0.00 C ATOM 599 C LYS A 50 44.873 29.764 31.762 1.00 0.00 C ATOM 600 O LYS A 50 45.970 29.342 31.399 1.00 0.00 O ATOM 601 CB LYS A 50 45.954 30.590 33.875 1.00 0.00 C ATOM 602 CG LYS A 50 45.935 31.589 35.034 1.00 0.00 C ATOM 603 CD LYS A 50 47.210 31.541 35.879 1.00 0.00 C ATOM 604 CE LYS A 50 48.186 32.704 35.696 1.00 0.00 C ATOM 605 NZ LYS A 50 48.554 32.891 34.275 1.00 0.00 N ATOM 0 H LYS A 50 42.934 31.524 33.292 1.00 0.00 H new ATOM 0 HA LYS A 50 44.807 31.698 32.492 1.00 0.00 H new ATOM 0 HB2 LYS A 50 45.987 29.580 34.284 1.00 0.00 H new ATOM 0 HB3 LYS A 50 46.871 30.733 33.304 1.00 0.00 H new ATOM 0 HG2 LYS A 50 45.805 32.596 34.638 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.075 31.384 35.671 1.00 0.00 H new ATOM 0 HD2 LYS A 50 46.923 31.497 36.930 1.00 0.00 H new ATOM 0 HD3 LYS A 50 47.736 30.614 35.653 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.736 33.620 36.079 1.00 0.00 H new ATOM 0 HE3 LYS A 50 49.085 32.520 36.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 49.230 33.677 34.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 48.990 32.020 33.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 47.701 33.108 33.721 1.00 0.00 H new ATOM 619 N GLY A 51 43.761 29.431 31.081 1.00 0.00 N ATOM 620 CA GLY A 51 43.802 28.744 29.828 1.00 0.00 C ATOM 621 C GLY A 51 44.018 29.647 28.662 1.00 0.00 C ATOM 622 O GLY A 51 43.925 30.869 28.767 1.00 0.00 O ATOM 0 H GLY A 51 42.818 29.643 31.407 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.600 28.002 29.855 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.867 28.202 29.689 1.00 0.00 H new ATOM 626 N ALA A 52 44.292 29.070 27.478 1.00 0.00 N ATOM 627 CA ALA A 52 44.260 29.689 26.189 1.00 0.00 C ATOM 628 C ALA A 52 43.006 30.437 25.889 1.00 0.00 C ATOM 629 O ALA A 52 43.008 31.642 25.639 1.00 0.00 O ATOM 630 CB ALA A 52 44.502 28.628 25.103 1.00 0.00 C ATOM 0 H ALA A 52 44.558 28.087 27.420 1.00 0.00 H new ATOM 0 HA ALA A 52 45.055 30.435 26.197 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.477 29.100 24.121 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.476 28.164 25.258 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.724 27.866 25.159 1.00 0.00 H new ATOM 636 N ALA A 53 41.873 29.714 25.935 1.00 0.00 N ATOM 637 CA ALA A 53 40.526 30.142 25.717 1.00 0.00 C ATOM 638 C ALA A 53 40.059 31.120 26.740 1.00 0.00 C ATOM 639 O ALA A 53 39.525 32.177 26.408 1.00 0.00 O ATOM 640 CB ALA A 53 39.581 28.928 25.730 1.00 0.00 C ATOM 0 H ALA A 53 41.909 28.717 26.149 1.00 0.00 H new ATOM 0 HA ALA A 53 40.510 30.637 24.746 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.557 29.262 25.563 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.869 28.234 24.940 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.646 28.426 26.696 1.00 0.00 H new ATOM 646 N GLU A 54 40.298 30.801 28.024 1.00 0.00 N ATOM 647 CA GLU A 54 40.057 31.680 29.126 1.00 0.00 C ATOM 648 C GLU A 54 40.531 33.085 28.982 1.00 0.00 C ATOM 649 O GLU A 54 39.772 34.050 29.060 1.00 0.00 O ATOM 650 CB GLU A 54 40.706 31.122 30.404 1.00 0.00 C ATOM 651 CG GLU A 54 40.303 31.890 31.664 1.00 0.00 C ATOM 652 CD GLU A 54 41.329 32.794 32.333 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.515 32.856 31.913 1.00 0.00 O ATOM 654 OE2 GLU A 54 40.951 33.457 33.335 1.00 0.00 O ATOM 0 H GLU A 54 40.674 29.896 28.306 1.00 0.00 H new ATOM 0 HA GLU A 54 38.969 31.721 29.170 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.427 30.075 30.519 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.790 31.153 30.298 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.437 32.503 31.414 1.00 0.00 H new ATOM 0 HG3 GLU A 54 39.974 31.160 32.404 1.00 0.00 H new ATOM 661 N SER A 55 41.852 33.220 28.770 1.00 0.00 N ATOM 662 CA SER A 55 42.544 34.469 28.695 1.00 0.00 C ATOM 663 C SER A 55 42.220 35.257 27.472 1.00 0.00 C ATOM 664 O SER A 55 42.287 36.484 27.486 1.00 0.00 O ATOM 665 CB SER A 55 44.065 34.264 28.784 1.00 0.00 C ATOM 666 OG SER A 55 44.753 35.443 29.174 1.00 0.00 O ATOM 0 H SER A 55 42.468 32.417 28.645 1.00 0.00 H new ATOM 0 HA SER A 55 42.196 35.046 29.552 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.280 33.469 29.499 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.440 33.932 27.816 1.00 0.00 H new ATOM 0 HG SER A 55 45.715 35.261 29.218 1.00 0.00 H new ATOM 672 N ASP A 56 41.844 34.579 26.374 1.00 0.00 N ATOM 673 CA ASP A 56 41.538 35.129 25.089 1.00 0.00 C ATOM 674 C ASP A 56 40.559 36.252 25.146 1.00 0.00 C ATOM 675 O ASP A 56 40.879 37.395 24.823 1.00 0.00 O ATOM 676 CB ASP A 56 41.021 34.010 24.171 1.00 0.00 C ATOM 677 CG ASP A 56 41.164 34.401 22.707 1.00 0.00 C ATOM 678 OD1 ASP A 56 42.329 34.600 22.270 1.00 0.00 O ATOM 679 OD2 ASP A 56 40.133 34.513 21.993 1.00 0.00 O ATOM 0 H ASP A 56 41.746 33.564 26.387 1.00 0.00 H new ATOM 0 HA ASP A 56 42.459 35.553 24.688 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.576 33.091 24.362 1.00 0.00 H new ATOM 0 HB3 ASP A 56 39.975 33.803 24.396 1.00 0.00 H new ATOM 684 N GLY A 57 39.331 35.961 25.613 1.00 0.00 N ATOM 685 CA GLY A 57 38.377 36.974 25.944 1.00 0.00 C ATOM 686 C GLY A 57 37.067 36.789 25.259 1.00 0.00 C ATOM 687 O GLY A 57 36.018 36.906 25.891 1.00 0.00 O ATOM 0 H GLY A 57 38.996 35.009 25.763 1.00 0.00 H new ATOM 0 HA2 GLY A 57 38.219 36.977 27.022 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.785 37.949 25.678 1.00 0.00 H new ATOM 691 N ARG A 58 37.098 36.493 23.947 1.00 0.00 N ATOM 692 CA ARG A 58 35.959 36.426 23.085 1.00 0.00 C ATOM 693 C ARG A 58 35.003 35.323 23.386 1.00 0.00 C ATOM 694 O ARG A 58 33.843 35.368 22.977 1.00 0.00 O ATOM 695 CB ARG A 58 36.419 36.403 21.618 1.00 0.00 C ATOM 696 CG ARG A 58 35.698 37.459 20.779 1.00 0.00 C ATOM 697 CD ARG A 58 36.072 37.513 19.296 1.00 0.00 C ATOM 698 NE ARG A 58 37.514 37.872 19.193 1.00 0.00 N ATOM 699 CZ ARG A 58 38.064 38.670 18.231 1.00 0.00 C ATOM 700 NH1 ARG A 58 37.325 39.353 17.309 1.00 0.00 N ATOM 701 NH2 ARG A 58 39.421 38.809 18.184 1.00 0.00 N ATOM 0 H ARG A 58 37.971 36.288 23.460 1.00 0.00 H new ATOM 0 HA ARG A 58 35.380 37.329 23.275 1.00 0.00 H new ATOM 0 HB2 ARG A 58 37.494 36.574 21.572 1.00 0.00 H new ATOM 0 HB3 ARG A 58 36.235 35.415 21.195 1.00 0.00 H new ATOM 0 HG2 ARG A 58 34.625 37.284 20.856 1.00 0.00 H new ATOM 0 HG3 ARG A 58 35.893 38.437 21.218 1.00 0.00 H new ATOM 0 HD2 ARG A 58 35.885 36.550 18.821 1.00 0.00 H new ATOM 0 HD3 ARG A 58 35.459 38.249 18.776 1.00 0.00 H new ATOM 0 HE ARG A 58 38.143 37.490 19.900 1.00 0.00 H new ATOM 0 HH11 ARG A 58 36.308 39.281 17.316 1.00 0.00 H new ATOM 0 HH12 ARG A 58 37.790 39.935 16.612 1.00 0.00 H new ATOM 0 HH21 ARG A 58 40.007 38.321 18.861 1.00 0.00 H new ATOM 0 HH22 ARG A 58 39.849 39.401 17.472 1.00 0.00 H new ATOM 715 N ILE A 59 35.441 34.290 24.128 1.00 0.00 N ATOM 716 CA ILE A 59 34.619 33.233 24.626 1.00 0.00 C ATOM 717 C ILE A 59 34.223 33.544 26.028 1.00 0.00 C ATOM 718 O ILE A 59 35.069 33.645 26.915 1.00 0.00 O ATOM 719 CB ILE A 59 35.311 31.903 24.594 1.00 0.00 C ATOM 720 CG1 ILE A 59 36.038 31.683 23.257 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.276 30.800 24.878 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.665 30.297 23.112 1.00 0.00 C ATOM 0 H ILE A 59 36.420 34.188 24.394 1.00 0.00 H new ATOM 0 HA ILE A 59 33.745 33.163 23.978 1.00 0.00 H new ATOM 0 HB ILE A 59 36.080 31.871 25.366 1.00 0.00 H new ATOM 0 HG12 ILE A 59 35.332 31.838 22.441 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.818 32.437 23.151 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.767 29.827 24.858 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.832 30.962 25.860 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.496 30.829 24.118 1.00 0.00 H new ATOM 0 HD11 ILE A 59 37.158 30.220 22.143 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.397 30.144 23.905 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.887 29.537 23.184 1.00 0.00 H new ATOM 734 N HIS A 60 32.917 33.715 26.300 1.00 0.00 N ATOM 735 CA HIS A 60 32.427 34.055 27.600 1.00 0.00 C ATOM 736 C HIS A 60 31.523 32.991 28.122 1.00 0.00 C ATOM 737 O HIS A 60 30.941 32.202 27.381 1.00 0.00 O ATOM 738 CB HIS A 60 31.653 35.383 27.613 1.00 0.00 C ATOM 739 CG HIS A 60 32.179 36.463 26.716 1.00 0.00 C ATOM 740 ND1 HIS A 60 32.004 36.444 25.347 1.00 0.00 N ATOM 741 CD2 HIS A 60 32.834 37.626 26.978 1.00 0.00 C ATOM 742 CE1 HIS A 60 32.570 37.576 24.848 1.00 0.00 C ATOM 743 NE2 HIS A 60 33.060 38.330 25.813 1.00 0.00 N ATOM 0 H HIS A 60 32.183 33.614 25.599 1.00 0.00 H new ATOM 0 HA HIS A 60 33.309 34.156 28.232 1.00 0.00 H new ATOM 0 HB2 HIS A 60 30.619 35.180 27.335 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.640 35.762 28.635 1.00 0.00 H new ATOM 0 HD1 HIS A 60 31.536 35.715 24.808 1.00 0.00 H new ATOM 0 HD2 HIS A 60 33.136 37.953 27.962 1.00 0.00 H new ATOM 0 HE1 HIS A 60 32.613 37.825 23.798 1.00 0.00 H new ATOM 751 N LYS A 61 31.321 32.940 29.451 1.00 0.00 N ATOM 752 CA LYS A 61 30.379 32.060 30.070 1.00 0.00 C ATOM 753 C LYS A 61 28.973 32.322 29.653 1.00 0.00 C ATOM 754 O LYS A 61 28.507 33.459 29.677 1.00 0.00 O ATOM 755 CB LYS A 61 30.481 32.168 31.600 1.00 0.00 C ATOM 756 CG LYS A 61 29.656 31.129 32.361 1.00 0.00 C ATOM 757 CD LYS A 61 29.802 31.256 33.879 1.00 0.00 C ATOM 758 CE LYS A 61 29.084 32.450 34.511 1.00 0.00 C ATOM 759 NZ LYS A 61 27.614 32.281 34.493 1.00 0.00 N ATOM 0 H LYS A 61 31.827 33.527 30.114 1.00 0.00 H new ATOM 0 HA LYS A 61 30.635 31.053 29.740 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.527 32.068 31.891 1.00 0.00 H new ATOM 0 HB3 LYS A 61 30.159 33.164 31.904 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.605 31.236 32.091 1.00 0.00 H new ATOM 0 HG3 LYS A 61 29.964 30.130 32.053 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.427 30.343 34.340 1.00 0.00 H new ATOM 0 HD3 LYS A 61 30.863 31.323 34.120 1.00 0.00 H new ATOM 0 HE2 LYS A 61 29.423 32.575 35.539 1.00 0.00 H new ATOM 0 HE3 LYS A 61 29.352 33.360 33.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 27.165 33.103 34.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 27.285 32.204 33.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 27.358 31.417 35.012 1.00 0.00 H new ATOM 773 N GLY A 62 28.236 31.283 29.223 1.00 0.00 N ATOM 774 CA GLY A 62 26.895 31.417 28.743 1.00 0.00 C ATOM 775 C GLY A 62 26.774 31.613 27.271 1.00 0.00 C ATOM 776 O GLY A 62 25.666 31.731 26.751 1.00 0.00 O ATOM 0 H GLY A 62 28.581 30.323 29.208 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.333 30.526 29.024 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.426 32.262 29.247 1.00 0.00 H new ATOM 780 N ASP A 63 27.892 31.655 26.525 1.00 0.00 N ATOM 781 CA ASP A 63 27.842 31.811 25.104 1.00 0.00 C ATOM 782 C ASP A 63 27.526 30.521 24.429 1.00 0.00 C ATOM 783 O ASP A 63 27.820 29.438 24.933 1.00 0.00 O ATOM 784 CB ASP A 63 29.150 32.410 24.561 1.00 0.00 C ATOM 785 CG ASP A 63 29.385 33.859 24.961 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.508 34.534 25.564 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.488 34.366 24.624 1.00 0.00 O ATOM 0 H ASP A 63 28.835 31.581 26.908 1.00 0.00 H new ATOM 0 HA ASP A 63 27.037 32.511 24.880 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.987 31.807 24.914 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.144 32.341 23.473 1.00 0.00 H new ATOM 792 N ARG A 64 26.899 30.562 23.239 1.00 0.00 N ATOM 793 CA ARG A 64 26.324 29.434 22.575 1.00 0.00 C ATOM 794 C ARG A 64 27.166 28.996 21.427 1.00 0.00 C ATOM 795 O ARG A 64 27.609 29.806 20.616 1.00 0.00 O ATOM 796 CB ARG A 64 24.910 29.827 22.116 1.00 0.00 C ATOM 797 CG ARG A 64 24.103 28.775 21.351 1.00 0.00 C ATOM 798 CD ARG A 64 22.630 29.173 21.234 1.00 0.00 C ATOM 799 NE ARG A 64 21.991 28.326 20.188 1.00 0.00 N ATOM 800 CZ ARG A 64 21.925 28.655 18.864 1.00 0.00 C ATOM 801 NH1 ARG A 64 22.387 29.836 18.361 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.344 27.780 17.993 1.00 0.00 N ATOM 0 H ARG A 64 26.788 31.429 22.713 1.00 0.00 H new ATOM 0 HA ARG A 64 26.270 28.586 23.258 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.337 30.116 22.997 1.00 0.00 H new ATOM 0 HB3 ARG A 64 24.994 30.712 21.486 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.526 28.644 20.355 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.182 27.814 21.859 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.125 29.039 22.190 1.00 0.00 H new ATOM 0 HD3 ARG A 64 22.543 30.228 20.973 1.00 0.00 H new ATOM 0 HE ARG A 64 21.575 27.442 20.480 1.00 0.00 H new ATOM 0 HH11 ARG A 64 22.808 30.526 18.984 1.00 0.00 H new ATOM 0 HH12 ARG A 64 22.312 30.029 17.362 1.00 0.00 H new ATOM 0 HH21 ARG A 64 20.967 26.896 18.334 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.287 28.010 17.001 1.00 0.00 H new ATOM 816 N VAL A 65 27.476 27.692 21.312 1.00 0.00 N ATOM 817 CA VAL A 65 28.361 27.171 20.317 1.00 0.00 C ATOM 818 C VAL A 65 27.633 26.902 19.045 1.00 0.00 C ATOM 819 O VAL A 65 26.526 26.367 19.039 1.00 0.00 O ATOM 820 CB VAL A 65 29.025 25.904 20.767 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.074 25.421 19.752 1.00 0.00 C ATOM 822 CG2 VAL A 65 29.691 26.110 22.138 1.00 0.00 C ATOM 0 H VAL A 65 27.098 26.976 21.933 1.00 0.00 H new ATOM 0 HA VAL A 65 29.125 27.931 20.153 1.00 0.00 H new ATOM 0 HB VAL A 65 28.252 25.140 20.846 1.00 0.00 H new ATOM 0 HG11 VAL A 65 30.533 24.501 20.113 1.00 0.00 H new ATOM 0 HG12 VAL A 65 29.592 25.234 18.792 1.00 0.00 H new ATOM 0 HG13 VAL A 65 30.841 26.186 19.630 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.169 25.183 22.453 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.441 26.898 22.064 1.00 0.00 H new ATOM 0 HG23 VAL A 65 28.936 26.396 22.870 1.00 0.00 H new ATOM 832 N LEU A 66 28.230 27.268 17.896 1.00 0.00 N ATOM 833 CA LEU A 66 27.655 27.025 16.610 1.00 0.00 C ATOM 834 C LEU A 66 28.389 25.913 15.942 1.00 0.00 C ATOM 835 O LEU A 66 27.805 24.900 15.561 1.00 0.00 O ATOM 836 CB LEU A 66 27.681 28.290 15.736 1.00 0.00 C ATOM 837 CG LEU A 66 26.403 29.145 15.800 1.00 0.00 C ATOM 838 CD1 LEU A 66 25.909 29.431 17.227 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.620 30.466 15.043 1.00 0.00 C ATOM 0 H LEU A 66 29.132 27.743 17.860 1.00 0.00 H new ATOM 0 HA LEU A 66 26.611 26.743 16.744 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.529 28.906 16.037 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.853 27.996 14.701 1.00 0.00 H new ATOM 0 HG LEU A 66 25.619 28.555 15.324 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.005 30.039 17.184 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.690 28.490 17.732 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.681 29.968 17.779 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.712 31.067 15.092 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.444 31.016 15.499 1.00 0.00 H new ATOM 0 HD23 LEU A 66 26.859 30.253 14.001 1.00 0.00 H new ATOM 851 N ALA A 67 29.717 26.054 15.780 1.00 0.00 N ATOM 852 CA ALA A 67 30.470 25.101 15.026 1.00 0.00 C ATOM 853 C ALA A 67 31.876 24.998 15.506 1.00 0.00 C ATOM 854 O ALA A 67 32.546 25.994 15.775 1.00 0.00 O ATOM 855 CB ALA A 67 30.479 25.496 13.540 1.00 0.00 C ATOM 0 H ALA A 67 30.266 26.822 16.168 1.00 0.00 H new ATOM 0 HA ALA A 67 29.990 24.132 15.158 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.055 24.765 12.973 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.456 25.523 13.164 1.00 0.00 H new ATOM 0 HB3 ALA A 67 30.933 26.481 13.428 1.00 0.00 H new ATOM 861 N VAL A 68 32.390 23.758 15.606 1.00 0.00 N ATOM 862 CA VAL A 68 33.741 23.498 15.997 1.00 0.00 C ATOM 863 C VAL A 68 34.447 22.912 14.824 1.00 0.00 C ATOM 864 O VAL A 68 33.980 21.920 14.264 1.00 0.00 O ATOM 865 CB VAL A 68 33.799 22.508 17.123 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.245 22.315 17.607 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.898 22.900 18.305 1.00 0.00 C ATOM 0 H VAL A 68 31.852 22.914 15.410 1.00 0.00 H new ATOM 0 HA VAL A 68 34.202 24.428 16.329 1.00 0.00 H new ATOM 0 HB VAL A 68 33.422 21.566 16.725 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.262 21.593 18.423 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.858 21.947 16.784 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.642 23.268 17.957 1.00 0.00 H new ATOM 0 HG21 VAL A 68 32.980 22.148 19.090 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.211 23.868 18.696 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.863 22.962 17.969 1.00 0.00 H new ATOM 877 N ASN A 69 35.588 23.466 14.374 1.00 0.00 N ATOM 878 CA ASN A 69 36.450 22.874 13.400 1.00 0.00 C ATOM 879 C ASN A 69 35.885 22.779 12.025 1.00 0.00 C ATOM 880 O ASN A 69 36.412 22.093 11.151 1.00 0.00 O ATOM 881 CB ASN A 69 36.996 21.553 13.966 1.00 0.00 C ATOM 882 CG ASN A 69 38.151 20.901 13.221 1.00 0.00 C ATOM 883 OD1 ASN A 69 38.052 19.757 12.782 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.300 21.615 13.082 1.00 0.00 N ATOM 0 H ASN A 69 35.924 24.370 14.706 1.00 0.00 H new ATOM 0 HA ASN A 69 37.286 23.552 13.231 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.315 21.732 14.993 1.00 0.00 H new ATOM 0 HB3 ASN A 69 36.174 20.838 14.007 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.102 21.203 12.606 1.00 0.00 H new ATOM 0 HD22 ASN A 69 39.360 22.563 13.454 1.00 0.00 H new ATOM 891 N GLY A 70 34.787 23.500 11.736 1.00 0.00 N ATOM 892 CA GLY A 70 34.057 23.461 10.506 1.00 0.00 C ATOM 893 C GLY A 70 32.781 22.701 10.613 1.00 0.00 C ATOM 894 O GLY A 70 31.923 22.761 9.734 1.00 0.00 O ATOM 0 H GLY A 70 34.383 24.154 12.407 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.841 24.480 10.185 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.680 23.009 9.734 1.00 0.00 H new ATOM 898 N VAL A 71 32.613 21.941 11.711 1.00 0.00 N ATOM 899 CA VAL A 71 31.487 21.090 11.939 1.00 0.00 C ATOM 900 C VAL A 71 30.453 21.836 12.709 1.00 0.00 C ATOM 901 O VAL A 71 30.586 22.061 13.911 1.00 0.00 O ATOM 902 CB VAL A 71 31.860 19.823 12.651 1.00 0.00 C ATOM 903 CG1 VAL A 71 30.663 18.857 12.700 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.060 19.156 11.958 1.00 0.00 C ATOM 0 H VAL A 71 33.292 21.919 12.472 1.00 0.00 H new ATOM 0 HA VAL A 71 31.088 20.796 10.968 1.00 0.00 H new ATOM 0 HB VAL A 71 32.142 20.072 13.674 1.00 0.00 H new ATOM 0 HG11 VAL A 71 30.953 17.944 13.220 1.00 0.00 H new ATOM 0 HG12 VAL A 71 29.836 19.329 13.230 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.351 18.612 11.685 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.320 18.238 12.485 1.00 0.00 H new ATOM 0 HG22 VAL A 71 32.800 18.921 10.926 1.00 0.00 H new ATOM 0 HG23 VAL A 71 33.912 19.836 11.971 1.00 0.00 H new ATOM 914 N SER A 72 29.364 22.266 12.047 1.00 0.00 N ATOM 915 CA SER A 72 28.242 22.873 12.694 1.00 0.00 C ATOM 916 C SER A 72 27.452 21.830 13.407 1.00 0.00 C ATOM 917 O SER A 72 27.106 20.798 12.835 1.00 0.00 O ATOM 918 CB SER A 72 27.333 23.670 11.743 1.00 0.00 C ATOM 919 OG SER A 72 26.396 24.459 12.462 1.00 0.00 O ATOM 0 H SER A 72 29.261 22.190 11.035 1.00 0.00 H new ATOM 0 HA SER A 72 28.645 23.598 13.402 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.943 24.314 11.109 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.803 22.983 11.083 1.00 0.00 H new ATOM 0 HG SER A 72 25.834 24.955 11.831 1.00 0.00 H new ATOM 925 N LEU A 73 27.201 22.049 14.710 1.00 0.00 N ATOM 926 CA LEU A 73 26.871 21.010 15.636 1.00 0.00 C ATOM 927 C LEU A 73 25.430 20.632 15.635 1.00 0.00 C ATOM 928 O LEU A 73 24.765 20.648 16.669 1.00 0.00 O ATOM 929 CB LEU A 73 27.274 21.439 17.057 1.00 0.00 C ATOM 930 CG LEU A 73 28.769 21.716 17.286 1.00 0.00 C ATOM 931 CD1 LEU A 73 28.987 22.104 18.758 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.672 20.524 16.927 1.00 0.00 C ATOM 0 H LEU A 73 27.228 22.977 15.132 1.00 0.00 H new ATOM 0 HA LEU A 73 27.427 20.130 15.313 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.716 22.339 17.314 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.960 20.660 17.752 1.00 0.00 H new ATOM 0 HG LEU A 73 29.051 22.531 16.619 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.045 22.302 18.929 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.408 22.999 18.988 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.662 21.286 19.402 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.713 20.788 17.112 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.401 19.664 17.540 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.543 20.274 15.874 1.00 0.00 H new ATOM 944 N GLU A 74 24.850 20.262 14.479 1.00 0.00 N ATOM 945 CA GLU A 74 23.447 20.025 14.333 1.00 0.00 C ATOM 946 C GLU A 74 22.962 18.781 14.995 1.00 0.00 C ATOM 947 O GLU A 74 23.438 17.672 14.758 1.00 0.00 O ATOM 948 CB GLU A 74 22.974 20.096 12.872 1.00 0.00 C ATOM 949 CG GLU A 74 23.641 19.128 11.893 1.00 0.00 C ATOM 950 CD GLU A 74 22.882 19.024 10.578 1.00 0.00 C ATOM 951 OE1 GLU A 74 21.695 18.603 10.607 1.00 0.00 O ATOM 952 OE2 GLU A 74 23.464 19.310 9.497 1.00 0.00 O ATOM 0 H GLU A 74 25.376 20.123 13.616 1.00 0.00 H new ATOM 0 HA GLU A 74 22.985 20.853 14.870 1.00 0.00 H new ATOM 0 HB2 GLU A 74 21.899 19.916 12.852 1.00 0.00 H new ATOM 0 HB3 GLU A 74 23.134 21.112 12.510 1.00 0.00 H new ATOM 0 HG2 GLU A 74 24.661 19.459 11.696 1.00 0.00 H new ATOM 0 HG3 GLU A 74 23.708 18.141 12.350 1.00 0.00 H new ATOM 959 N GLY A 75 21.994 18.918 15.918 1.00 0.00 N ATOM 960 CA GLY A 75 21.416 17.833 16.649 1.00 0.00 C ATOM 961 C GLY A 75 22.270 17.261 17.727 1.00 0.00 C ATOM 962 O GLY A 75 21.930 16.241 18.325 1.00 0.00 O ATOM 0 H GLY A 75 21.597 19.824 16.166 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.480 18.174 17.093 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.165 17.038 15.947 1.00 0.00 H new ATOM 966 N ALA A 76 23.440 17.871 17.983 1.00 0.00 N ATOM 967 CA ALA A 76 24.447 17.357 18.859 1.00 0.00 C ATOM 968 C ALA A 76 24.137 17.398 20.315 1.00 0.00 C ATOM 969 O ALA A 76 23.558 18.339 20.856 1.00 0.00 O ATOM 970 CB ALA A 76 25.804 18.028 18.590 1.00 0.00 C ATOM 0 H ALA A 76 23.696 18.763 17.560 1.00 0.00 H new ATOM 0 HA ALA A 76 24.485 16.296 18.614 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.553 17.620 19.269 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.106 17.838 17.560 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.717 19.103 18.750 1.00 0.00 H new ATOM 976 N THR A 77 24.540 16.316 21.005 1.00 0.00 N ATOM 977 CA THR A 77 24.514 16.128 22.423 1.00 0.00 C ATOM 978 C THR A 77 25.806 16.516 23.055 1.00 0.00 C ATOM 979 O THR A 77 26.765 16.909 22.393 1.00 0.00 O ATOM 980 CB THR A 77 24.183 14.704 22.759 1.00 0.00 C ATOM 981 OG1 THR A 77 25.015 13.806 22.039 1.00 0.00 O ATOM 982 CG2 THR A 77 22.734 14.428 22.326 1.00 0.00 C ATOM 0 H THR A 77 24.918 15.499 20.525 1.00 0.00 H new ATOM 0 HA THR A 77 23.737 16.779 22.824 1.00 0.00 H new ATOM 0 HB THR A 77 24.327 14.559 23.830 1.00 0.00 H new ATOM 0 HG1 THR A 77 24.485 13.347 21.354 1.00 0.00 H new ATOM 0 HG21 THR A 77 22.474 13.396 22.562 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.061 15.102 22.856 1.00 0.00 H new ATOM 0 HG23 THR A 77 22.638 14.590 21.252 1.00 0.00 H new ATOM 990 N HIS A 78 25.883 16.401 24.393 1.00 0.00 N ATOM 991 CA HIS A 78 27.018 16.695 25.211 1.00 0.00 C ATOM 992 C HIS A 78 28.248 15.932 24.857 1.00 0.00 C ATOM 993 O HIS A 78 29.320 16.510 24.676 1.00 0.00 O ATOM 994 CB HIS A 78 26.620 16.461 26.677 1.00 0.00 C ATOM 995 CG HIS A 78 27.539 16.934 27.765 1.00 0.00 C ATOM 996 ND1 HIS A 78 27.392 16.485 29.061 1.00 0.00 N ATOM 997 CD2 HIS A 78 28.503 17.892 27.818 1.00 0.00 C ATOM 998 CE1 HIS A 78 28.283 17.172 29.826 1.00 0.00 C ATOM 999 NE2 HIS A 78 28.970 18.040 29.108 1.00 0.00 N ATOM 0 H HIS A 78 25.088 16.077 24.944 1.00 0.00 H new ATOM 0 HA HIS A 78 27.290 17.736 25.039 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.652 16.936 26.835 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.475 15.389 26.812 1.00 0.00 H new ATOM 0 HD2 HIS A 78 28.854 18.458 26.968 1.00 0.00 H new ATOM 0 HE1 HIS A 78 28.412 17.025 30.888 1.00 0.00 H new ATOM 0 HE2 HIS A 78 29.691 18.682 29.436 1.00 0.00 H new ATOM 1007 N LYS A 79 28.146 14.603 24.682 1.00 0.00 N ATOM 1008 CA LYS A 79 29.205 13.757 24.229 1.00 0.00 C ATOM 1009 C LYS A 79 29.790 14.147 22.915 1.00 0.00 C ATOM 1010 O LYS A 79 31.009 14.162 22.759 1.00 0.00 O ATOM 1011 CB LYS A 79 28.740 12.291 24.170 1.00 0.00 C ATOM 1012 CG LYS A 79 29.833 11.246 23.944 1.00 0.00 C ATOM 1013 CD LYS A 79 30.568 10.824 25.219 1.00 0.00 C ATOM 1014 CE LYS A 79 31.710 9.847 24.937 1.00 0.00 C ATOM 1015 NZ LYS A 79 32.218 9.212 26.174 1.00 0.00 N ATOM 0 H LYS A 79 27.282 14.093 24.866 1.00 0.00 H new ATOM 0 HA LYS A 79 29.999 13.878 24.965 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.228 12.056 25.103 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.005 12.196 23.371 1.00 0.00 H new ATOM 0 HG2 LYS A 79 29.387 10.363 23.485 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.558 11.643 23.234 1.00 0.00 H new ATOM 0 HD2 LYS A 79 30.965 11.709 25.716 1.00 0.00 H new ATOM 0 HD3 LYS A 79 29.860 10.362 25.907 1.00 0.00 H new ATOM 0 HE2 LYS A 79 31.365 9.075 24.249 1.00 0.00 H new ATOM 0 HE3 LYS A 79 32.524 10.375 24.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 32.991 8.558 25.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 32.572 9.946 26.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 31.449 8.686 26.635 1.00 0.00 H new ATOM 1029 N GLN A 80 28.958 14.514 21.924 1.00 0.00 N ATOM 1030 CA GLN A 80 29.349 14.936 20.615 1.00 0.00 C ATOM 1031 C GLN A 80 30.228 16.139 20.590 1.00 0.00 C ATOM 1032 O GLN A 80 31.297 16.126 19.981 1.00 0.00 O ATOM 1033 CB GLN A 80 28.084 15.174 19.774 1.00 0.00 C ATOM 1034 CG GLN A 80 27.716 14.059 18.793 1.00 0.00 C ATOM 1035 CD GLN A 80 27.718 12.645 19.356 1.00 0.00 C ATOM 1036 OE1 GLN A 80 28.450 11.765 18.905 1.00 0.00 O ATOM 1037 NE2 GLN A 80 26.846 12.367 20.363 1.00 0.00 N ATOM 0 H GLN A 80 27.945 14.516 22.046 1.00 0.00 H new ATOM 0 HA GLN A 80 29.957 14.136 20.193 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.244 15.328 20.451 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.213 16.099 19.212 1.00 0.00 H new ATOM 0 HG2 GLN A 80 26.724 14.268 18.393 1.00 0.00 H new ATOM 0 HG3 GLN A 80 28.412 14.096 17.955 1.00 0.00 H new ATOM 0 HE21 GLN A 80 26.242 13.102 20.732 1.00 0.00 H new ATOM 0 HE22 GLN A 80 26.796 11.424 20.749 1.00 0.00 H new ATOM 1046 N ALA A 81 29.840 17.222 21.286 1.00 0.00 N ATOM 1047 CA ALA A 81 30.612 18.415 21.446 1.00 0.00 C ATOM 1048 C ALA A 81 31.924 18.189 22.116 1.00 0.00 C ATOM 1049 O ALA A 81 32.937 18.755 21.709 1.00 0.00 O ATOM 1050 CB ALA A 81 29.782 19.426 22.257 1.00 0.00 C ATOM 0 H ALA A 81 28.939 17.268 21.763 1.00 0.00 H new ATOM 0 HA ALA A 81 30.841 18.794 20.450 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.355 20.344 22.390 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.858 19.649 21.724 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.545 19.002 23.233 1.00 0.00 H new ATOM 1056 N VAL A 82 31.989 17.303 23.125 1.00 0.00 N ATOM 1057 CA VAL A 82 33.202 16.890 23.761 1.00 0.00 C ATOM 1058 C VAL A 82 34.078 16.118 22.836 1.00 0.00 C ATOM 1059 O VAL A 82 35.269 16.405 22.728 1.00 0.00 O ATOM 1060 CB VAL A 82 32.967 16.104 25.017 1.00 0.00 C ATOM 1061 CG1 VAL A 82 34.276 15.535 25.589 1.00 0.00 C ATOM 1062 CG2 VAL A 82 32.319 17.028 26.061 1.00 0.00 C ATOM 0 H VAL A 82 31.160 16.854 23.515 1.00 0.00 H new ATOM 0 HA VAL A 82 33.712 17.812 24.040 1.00 0.00 H new ATOM 0 HB VAL A 82 32.314 15.264 24.779 1.00 0.00 H new ATOM 0 HG11 VAL A 82 34.062 14.973 26.498 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.738 14.875 24.854 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.958 16.353 25.821 1.00 0.00 H new ATOM 0 HG21 VAL A 82 32.142 16.470 26.981 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.984 17.866 26.268 1.00 0.00 H new ATOM 0 HG23 VAL A 82 31.371 17.403 25.676 1.00 0.00 H new ATOM 1072 N GLU A 83 33.530 15.135 22.099 1.00 0.00 N ATOM 1073 CA GLU A 83 34.219 14.328 21.140 1.00 0.00 C ATOM 1074 C GLU A 83 34.918 15.146 20.108 1.00 0.00 C ATOM 1075 O GLU A 83 36.104 14.985 19.826 1.00 0.00 O ATOM 1076 CB GLU A 83 33.247 13.362 20.443 1.00 0.00 C ATOM 1077 CG GLU A 83 33.364 11.900 20.876 1.00 0.00 C ATOM 1078 CD GLU A 83 34.472 11.163 20.137 1.00 0.00 C ATOM 1079 OE1 GLU A 83 34.362 10.978 18.896 1.00 0.00 O ATOM 1080 OE2 GLU A 83 35.470 10.750 20.787 1.00 0.00 O ATOM 0 H GLU A 83 32.543 14.889 22.179 1.00 0.00 H new ATOM 0 HA GLU A 83 34.970 13.764 21.693 1.00 0.00 H new ATOM 0 HB2 GLU A 83 32.227 13.700 20.629 1.00 0.00 H new ATOM 0 HB3 GLU A 83 33.410 13.420 19.367 1.00 0.00 H new ATOM 0 HG2 GLU A 83 33.554 11.856 21.948 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.415 11.394 20.700 1.00 0.00 H new ATOM 1087 N THR A 84 34.166 16.112 19.552 1.00 0.00 N ATOM 1088 CA THR A 84 34.574 17.111 18.613 1.00 0.00 C ATOM 1089 C THR A 84 35.570 18.079 19.151 1.00 0.00 C ATOM 1090 O THR A 84 36.582 18.336 18.499 1.00 0.00 O ATOM 1091 CB THR A 84 33.342 17.771 18.066 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.670 16.892 17.177 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.616 19.061 17.275 1.00 0.00 C ATOM 0 H THR A 84 33.177 16.200 19.784 1.00 0.00 H new ATOM 0 HA THR A 84 35.117 16.625 17.802 1.00 0.00 H new ATOM 0 HB THR A 84 32.747 18.020 18.945 1.00 0.00 H new ATOM 0 HG1 THR A 84 31.867 17.332 16.827 1.00 0.00 H new ATOM 0 HG21 THR A 84 32.674 19.474 16.915 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.107 19.788 17.923 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.262 18.837 16.426 1.00 0.00 H new ATOM 1101 N LEU A 85 35.407 18.641 20.361 1.00 0.00 N ATOM 1102 CA LEU A 85 36.379 19.487 20.983 1.00 0.00 C ATOM 1103 C LEU A 85 37.671 18.818 21.305 1.00 0.00 C ATOM 1104 O LEU A 85 38.736 19.429 21.228 1.00 0.00 O ATOM 1105 CB LEU A 85 35.855 20.110 22.287 1.00 0.00 C ATOM 1106 CG LEU A 85 34.903 21.305 22.106 1.00 0.00 C ATOM 1107 CD1 LEU A 85 34.267 21.655 23.460 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.620 22.542 21.539 1.00 0.00 C ATOM 0 H LEU A 85 34.570 18.502 20.927 1.00 0.00 H new ATOM 0 HA LEU A 85 36.563 20.250 20.226 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.339 19.338 22.858 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.707 20.432 22.885 1.00 0.00 H new ATOM 0 HG LEU A 85 34.137 21.014 21.387 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.591 22.501 23.337 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.709 20.796 23.832 1.00 0.00 H new ATOM 0 HD13 LEU A 85 35.049 21.916 24.173 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.906 23.358 21.430 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.416 22.845 22.219 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.047 22.301 20.566 1.00 0.00 H new ATOM 1120 N ARG A 86 37.653 17.524 21.669 1.00 0.00 N ATOM 1121 CA ARG A 86 38.824 16.723 21.848 1.00 0.00 C ATOM 1122 C ARG A 86 39.581 16.513 20.581 1.00 0.00 C ATOM 1123 O ARG A 86 40.812 16.514 20.580 1.00 0.00 O ATOM 1124 CB ARG A 86 38.472 15.355 22.453 1.00 0.00 C ATOM 1125 CG ARG A 86 38.192 15.350 23.957 1.00 0.00 C ATOM 1126 CD ARG A 86 37.939 13.948 24.515 1.00 0.00 C ATOM 1127 NE ARG A 86 39.250 13.313 24.834 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.924 12.422 24.049 1.00 0.00 C ATOM 1129 NH1 ARG A 86 39.454 11.963 22.853 1.00 0.00 N ATOM 1130 NH2 ARG A 86 41.140 11.966 24.468 1.00 0.00 N ATOM 0 H ARG A 86 36.787 17.015 21.846 1.00 0.00 H new ATOM 0 HA ARG A 86 39.462 17.279 22.535 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.595 14.964 21.937 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.293 14.667 22.252 1.00 0.00 H new ATOM 0 HG2 ARG A 86 39.038 15.795 24.480 1.00 0.00 H new ATOM 0 HG3 ARG A 86 37.325 15.978 24.161 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.319 14.004 25.410 1.00 0.00 H new ATOM 0 HD3 ARG A 86 37.395 13.345 23.788 1.00 0.00 H new ATOM 0 HE ARG A 86 39.684 13.568 25.721 1.00 0.00 H new ATOM 0 HH11 ARG A 86 38.553 12.286 22.501 1.00 0.00 H new ATOM 0 HH12 ARG A 86 40.004 11.297 22.311 1.00 0.00 H new ATOM 0 HH21 ARG A 86 41.529 12.291 25.353 1.00 0.00 H new ATOM 0 HH22 ARG A 86 41.660 11.300 23.896 1.00 0.00 H new ATOM 1144 N ASN A 87 38.886 16.363 19.440 1.00 0.00 N ATOM 1145 CA ASN A 87 39.450 16.171 18.141 1.00 0.00 C ATOM 1146 C ASN A 87 39.775 17.456 17.459 1.00 0.00 C ATOM 1147 O ASN A 87 39.499 17.671 16.281 1.00 0.00 O ATOM 1148 CB ASN A 87 38.475 15.310 17.320 1.00 0.00 C ATOM 1149 CG ASN A 87 39.146 14.616 16.144 1.00 0.00 C ATOM 1150 OD1 ASN A 87 40.339 14.751 15.875 1.00 0.00 O ATOM 1151 ND2 ASN A 87 38.353 13.812 15.386 1.00 0.00 N ATOM 0 H ASN A 87 37.866 16.377 19.425 1.00 0.00 H new ATOM 0 HA ASN A 87 40.406 15.656 18.238 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.025 14.560 17.970 1.00 0.00 H new ATOM 0 HB3 ASN A 87 37.665 15.939 16.951 1.00 0.00 H new ATOM 0 HD21 ASN A 87 38.746 13.315 14.587 1.00 0.00 H new ATOM 0 HD22 ASN A 87 37.365 13.706 15.617 1.00 0.00 H new ATOM 1158 N THR A 88 40.422 18.386 18.185 1.00 0.00 N ATOM 1159 CA THR A 88 40.937 19.623 17.686 1.00 0.00 C ATOM 1160 C THR A 88 42.423 19.554 17.613 1.00 0.00 C ATOM 1161 O THR A 88 43.062 18.794 18.340 1.00 0.00 O ATOM 1162 CB THR A 88 40.540 20.814 18.508 1.00 0.00 C ATOM 1163 OG1 THR A 88 40.799 20.624 19.891 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.032 21.077 18.351 1.00 0.00 C ATOM 0 H THR A 88 40.596 18.265 19.183 1.00 0.00 H new ATOM 0 HA THR A 88 40.502 19.761 16.696 1.00 0.00 H new ATOM 0 HB THR A 88 41.132 21.655 18.148 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.025 20.195 20.313 1.00 0.00 H new ATOM 0 HG21 THR A 88 38.749 21.943 18.950 1.00 0.00 H new ATOM 0 HG22 THR A 88 38.804 21.271 17.303 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.473 20.204 18.689 1.00 0.00 H new ATOM 1172 N GLY A 89 43.055 20.369 16.748 1.00 0.00 N ATOM 1173 CA GLY A 89 44.476 20.421 16.601 1.00 0.00 C ATOM 1174 C GLY A 89 45.107 21.424 17.504 1.00 0.00 C ATOM 1175 O GLY A 89 44.558 21.796 18.541 1.00 0.00 O ATOM 0 H GLY A 89 42.560 21.013 16.131 1.00 0.00 H new ATOM 0 HA2 GLY A 89 44.896 19.436 16.807 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.722 20.662 15.567 1.00 0.00 H new ATOM 1179 N GLN A 90 46.307 21.909 17.139 1.00 0.00 N ATOM 1180 CA GLN A 90 47.005 22.932 17.854 1.00 0.00 C ATOM 1181 C GLN A 90 46.320 24.250 17.742 1.00 0.00 C ATOM 1182 O GLN A 90 45.985 24.854 18.760 1.00 0.00 O ATOM 1183 CB GLN A 90 48.462 23.053 17.374 1.00 0.00 C ATOM 1184 CG GLN A 90 49.342 21.877 17.803 1.00 0.00 C ATOM 1185 CD GLN A 90 49.703 21.941 19.280 1.00 0.00 C ATOM 1186 OE1 GLN A 90 49.036 21.382 20.149 1.00 0.00 O ATOM 1187 NE2 GLN A 90 50.827 22.640 19.592 1.00 0.00 N ATOM 0 H GLN A 90 46.810 21.577 16.316 1.00 0.00 H new ATOM 0 HA GLN A 90 47.006 22.638 18.904 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.474 23.128 16.287 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.889 23.978 17.762 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.822 20.942 17.598 1.00 0.00 H new ATOM 0 HG3 GLN A 90 50.255 21.871 17.207 1.00 0.00 H new ATOM 0 HE21 GLN A 90 51.365 23.096 18.855 1.00 0.00 H new ATOM 0 HE22 GLN A 90 51.132 22.708 20.563 1.00 0.00 H new ATOM 1196 N VAL A 91 46.065 24.727 16.511 1.00 0.00 N ATOM 1197 CA VAL A 91 45.243 25.871 16.257 1.00 0.00 C ATOM 1198 C VAL A 91 43.855 25.400 15.989 1.00 0.00 C ATOM 1199 O VAL A 91 43.610 24.463 15.231 1.00 0.00 O ATOM 1200 CB VAL A 91 45.731 26.725 15.124 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.865 27.982 14.947 1.00 0.00 C ATOM 1202 CG2 VAL A 91 47.187 27.139 15.395 1.00 0.00 C ATOM 0 H VAL A 91 46.443 24.303 15.664 1.00 0.00 H new ATOM 0 HA VAL A 91 45.280 26.508 17.141 1.00 0.00 H new ATOM 0 HB VAL A 91 45.666 26.142 14.205 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.250 28.575 14.117 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.836 27.689 14.737 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.894 28.575 15.861 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.547 27.760 14.575 1.00 0.00 H new ATOM 0 HG22 VAL A 91 47.238 27.703 16.326 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.810 26.248 15.476 1.00 0.00 H new ATOM 1212 N VAL A 92 42.878 26.020 16.674 1.00 0.00 N ATOM 1213 CA VAL A 92 41.509 25.619 16.775 1.00 0.00 C ATOM 1214 C VAL A 92 40.630 26.680 16.205 1.00 0.00 C ATOM 1215 O VAL A 92 40.640 27.822 16.661 1.00 0.00 O ATOM 1216 CB VAL A 92 41.167 25.424 18.222 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.700 24.993 18.385 1.00 0.00 C ATOM 1218 CG2 VAL A 92 42.088 24.324 18.778 1.00 0.00 C ATOM 0 H VAL A 92 43.063 26.873 17.201 1.00 0.00 H new ATOM 0 HA VAL A 92 41.359 24.691 16.224 1.00 0.00 H new ATOM 0 HB VAL A 92 41.305 26.361 18.761 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.476 24.858 19.443 1.00 0.00 H new ATOM 0 HG12 VAL A 92 39.047 25.761 17.971 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.536 24.054 17.857 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.863 24.159 19.832 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.927 23.400 18.223 1.00 0.00 H new ATOM 0 HG23 VAL A 92 43.128 24.633 18.674 1.00 0.00 H new ATOM 1228 N HIS A 93 39.825 26.343 15.182 1.00 0.00 N ATOM 1229 CA HIS A 93 38.844 27.232 14.639 1.00 0.00 C ATOM 1230 C HIS A 93 37.495 26.961 15.210 1.00 0.00 C ATOM 1231 O HIS A 93 36.909 25.902 14.993 1.00 0.00 O ATOM 1232 CB HIS A 93 38.747 27.138 13.108 1.00 0.00 C ATOM 1233 CG HIS A 93 39.989 27.530 12.365 1.00 0.00 C ATOM 1234 ND1 HIS A 93 39.971 27.952 11.051 1.00 0.00 N ATOM 1235 CD2 HIS A 93 41.298 27.548 12.734 1.00 0.00 C ATOM 1236 CE1 HIS A 93 41.258 28.213 10.695 1.00 0.00 C ATOM 1237 NE2 HIS A 93 42.093 27.969 11.688 1.00 0.00 N ATOM 0 H HIS A 93 39.856 25.433 14.722 1.00 0.00 H new ATOM 0 HA HIS A 93 39.173 28.235 14.910 1.00 0.00 H new ATOM 0 HB2 HIS A 93 38.489 26.114 12.838 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.926 27.772 12.772 1.00 0.00 H new ATOM 0 HD2 HIS A 93 41.665 27.271 13.711 1.00 0.00 H new ATOM 0 HE1 HIS A 93 41.559 28.574 9.723 1.00 0.00 H new ATOM 0 HE2 HIS A 93 43.108 28.070 11.683 1.00 0.00 H new ATOM 1245 N LEU A 94 36.953 27.916 15.986 1.00 0.00 N ATOM 1246 CA LEU A 94 35.596 27.921 16.439 1.00 0.00 C ATOM 1247 C LEU A 94 34.757 28.927 15.727 1.00 0.00 C ATOM 1248 O LEU A 94 35.239 29.954 15.252 1.00 0.00 O ATOM 1249 CB LEU A 94 35.457 28.245 17.936 1.00 0.00 C ATOM 1250 CG LEU A 94 36.416 27.465 18.852 1.00 0.00 C ATOM 1251 CD1 LEU A 94 36.337 27.971 20.303 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.127 25.955 18.795 1.00 0.00 C ATOM 0 H LEU A 94 37.485 28.722 16.313 1.00 0.00 H new ATOM 0 HA LEU A 94 35.256 26.906 16.233 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.625 29.312 18.080 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.432 28.039 18.245 1.00 0.00 H new ATOM 0 HG LEU A 94 37.429 27.636 18.487 1.00 0.00 H new ATOM 0 HD11 LEU A 94 37.026 27.400 20.925 1.00 0.00 H new ATOM 0 HD12 LEU A 94 36.608 29.026 20.336 1.00 0.00 H new ATOM 0 HD13 LEU A 94 35.321 27.845 20.677 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.819 25.427 19.451 1.00 0.00 H new ATOM 0 HD22 LEU A 94 35.104 25.768 19.120 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.253 25.599 17.773 1.00 0.00 H new ATOM 1264 N LEU A 95 33.435 28.681 15.699 1.00 0.00 N ATOM 1265 CA LEU A 95 32.433 29.675 15.470 1.00 0.00 C ATOM 1266 C LEU A 95 31.453 29.578 16.589 1.00 0.00 C ATOM 1267 O LEU A 95 30.939 28.503 16.894 1.00 0.00 O ATOM 1268 CB LEU A 95 31.687 29.473 14.139 1.00 0.00 C ATOM 1269 CG LEU A 95 30.574 30.490 13.840 1.00 0.00 C ATOM 1270 CD1 LEU A 95 31.122 31.891 13.522 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.687 30.016 12.677 1.00 0.00 C ATOM 0 H LEU A 95 33.048 27.748 15.842 1.00 0.00 H new ATOM 0 HA LEU A 95 32.916 30.651 15.420 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.414 29.507 13.327 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.252 28.474 14.135 1.00 0.00 H new ATOM 0 HG LEU A 95 29.978 30.560 14.750 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.293 32.569 13.319 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.692 32.261 14.374 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.770 31.838 12.647 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.909 30.755 12.488 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.296 29.894 11.781 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.227 29.063 12.936 1.00 0.00 H new ATOM 1283 N LEU A 96 31.137 30.702 17.254 1.00 0.00 N ATOM 1284 CA LEU A 96 30.140 30.704 18.279 1.00 0.00 C ATOM 1285 C LEU A 96 29.332 31.956 18.243 1.00 0.00 C ATOM 1286 O LEU A 96 29.646 32.909 17.532 1.00 0.00 O ATOM 1287 CB LEU A 96 30.740 30.443 19.672 1.00 0.00 C ATOM 1288 CG LEU A 96 31.699 31.516 20.215 1.00 0.00 C ATOM 1289 CD1 LEU A 96 30.970 32.554 21.084 1.00 0.00 C ATOM 1290 CD2 LEU A 96 32.824 30.859 21.032 1.00 0.00 C ATOM 0 H LEU A 96 31.571 31.609 17.083 1.00 0.00 H new ATOM 0 HA LEU A 96 29.464 29.874 18.075 1.00 0.00 H new ATOM 0 HB2 LEU A 96 29.920 30.327 20.381 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.272 29.492 19.642 1.00 0.00 H new ATOM 0 HG LEU A 96 32.122 32.036 19.356 1.00 0.00 H new ATOM 0 HD11 LEU A 96 31.685 33.292 21.446 1.00 0.00 H new ATOM 0 HD12 LEU A 96 30.204 33.052 20.490 1.00 0.00 H new ATOM 0 HD13 LEU A 96 30.503 32.054 21.933 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.496 31.629 21.411 1.00 0.00 H new ATOM 0 HD22 LEU A 96 32.393 30.310 21.869 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.382 30.172 20.396 1.00 0.00 H new ATOM 1302 N GLU A 97 28.239 31.974 19.026 1.00 0.00 N ATOM 1303 CA GLU A 97 27.331 33.067 19.186 1.00 0.00 C ATOM 1304 C GLU A 97 27.405 33.563 20.589 1.00 0.00 C ATOM 1305 O GLU A 97 27.564 32.803 21.544 1.00 0.00 O ATOM 1306 CB GLU A 97 25.906 32.581 18.876 1.00 0.00 C ATOM 1307 CG GLU A 97 24.795 33.631 18.944 1.00 0.00 C ATOM 1308 CD GLU A 97 23.441 32.957 18.782 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.058 32.156 19.676 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.748 33.210 17.760 1.00 0.00 O ATOM 0 H GLU A 97 27.971 31.166 19.587 1.00 0.00 H new ATOM 0 HA GLU A 97 27.594 33.877 18.506 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.904 32.147 17.876 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.660 31.779 19.572 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.838 34.158 19.897 1.00 0.00 H new ATOM 0 HG3 GLU A 97 24.937 34.376 18.161 1.00 0.00 H new ATOM 1317 N LYS A 98 27.240 34.884 20.780 1.00 0.00 N ATOM 1318 CA LYS A 98 27.280 35.536 22.052 1.00 0.00 C ATOM 1319 C LYS A 98 26.026 35.300 22.821 1.00 0.00 C ATOM 1320 O LYS A 98 24.921 35.283 22.281 1.00 0.00 O ATOM 1321 CB LYS A 98 27.462 37.041 21.787 1.00 0.00 C ATOM 1322 CG LYS A 98 27.463 37.971 23.002 1.00 0.00 C ATOM 1323 CD LYS A 98 28.588 37.685 23.998 1.00 0.00 C ATOM 1324 CE LYS A 98 28.109 37.801 25.447 1.00 0.00 C ATOM 1325 NZ LYS A 98 29.081 37.132 26.340 1.00 0.00 N ATOM 0 H LYS A 98 27.070 35.529 20.009 1.00 0.00 H new ATOM 0 HA LYS A 98 28.101 35.139 22.648 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.404 37.179 21.256 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.667 37.364 21.115 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.548 39.002 22.659 1.00 0.00 H new ATOM 0 HG3 LYS A 98 26.505 37.884 23.515 1.00 0.00 H new ATOM 0 HD2 LYS A 98 28.981 36.683 23.824 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.408 38.383 23.830 1.00 0.00 H new ATOM 0 HE2 LYS A 98 28.005 38.850 25.725 1.00 0.00 H new ATOM 0 HE3 LYS A 98 27.125 37.344 25.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 29.017 37.544 27.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 28.867 36.115 26.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 30.043 37.266 25.969 1.00 0.00 H new ATOM 1339 N GLY A 99 26.154 35.051 24.136 1.00 0.00 N ATOM 1340 CA GLY A 99 25.063 34.795 25.025 1.00 0.00 C ATOM 1341 C GLY A 99 24.128 35.944 25.189 1.00 0.00 C ATOM 1342 O GLY A 99 24.536 37.078 25.431 1.00 0.00 O ATOM 0 H GLY A 99 27.061 35.027 24.602 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.503 33.935 24.658 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.461 34.522 26.002 1.00 0.00 H new ATOM 1346 N GLN A 100 22.818 35.682 25.043 1.00 0.00 N ATOM 1347 CA GLN A 100 21.819 36.704 24.994 1.00 0.00 C ATOM 1348 C GLN A 100 21.394 37.137 26.355 1.00 0.00 C ATOM 1349 O GLN A 100 21.554 38.297 26.732 1.00 0.00 O ATOM 1350 CB GLN A 100 20.608 36.281 24.145 1.00 0.00 C ATOM 1351 CG GLN A 100 21.029 35.525 22.883 1.00 0.00 C ATOM 1352 CD GLN A 100 20.014 35.490 21.750 1.00 0.00 C ATOM 1353 OE1 GLN A 100 20.392 35.309 20.593 1.00 0.00 O ATOM 1354 NE2 GLN A 100 18.693 35.636 22.037 1.00 0.00 N ATOM 0 H GLN A 100 22.443 34.737 24.957 1.00 0.00 H new ATOM 0 HA GLN A 100 22.279 37.564 24.507 1.00 0.00 H new ATOM 0 HB2 GLN A 100 19.949 35.651 24.742 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.036 37.165 23.864 1.00 0.00 H new ATOM 0 HG2 GLN A 100 21.948 35.973 22.506 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.266 34.498 23.162 1.00 0.00 H new ATOM 0 HE21 GLN A 100 18.394 35.785 23.001 1.00 0.00 H new ATOM 0 HE22 GLN A 100 18.001 35.596 21.289 1.00 0.00 H new ATOM 1363 N VAL A 101 20.832 36.209 27.149 1.00 0.00 N ATOM 1364 CA VAL A 101 20.320 36.472 28.458 1.00 0.00 C ATOM 1365 C VAL A 101 21.282 36.100 29.534 1.00 0.00 C ATOM 1366 O VAL A 101 21.997 35.112 29.384 1.00 0.00 O ATOM 1367 CB VAL A 101 18.995 35.806 28.686 1.00 0.00 C ATOM 1368 CG1 VAL A 101 17.944 36.463 27.775 1.00 0.00 C ATOM 1369 CG2 VAL A 101 19.051 34.292 28.415 1.00 0.00 C ATOM 0 H VAL A 101 20.730 35.234 26.867 1.00 0.00 H new ATOM 0 HA VAL A 101 20.172 37.551 28.509 1.00 0.00 H new ATOM 0 HB VAL A 101 18.726 35.934 29.734 1.00 0.00 H new ATOM 0 HG11 VAL A 101 16.977 35.986 27.933 1.00 0.00 H new ATOM 0 HG12 VAL A 101 17.869 37.524 28.013 1.00 0.00 H new ATOM 0 HG13 VAL A 101 18.241 36.345 26.733 1.00 0.00 H new ATOM 0 HG21 VAL A 101 18.069 33.854 28.593 1.00 0.00 H new ATOM 0 HG22 VAL A 101 19.343 34.118 27.379 1.00 0.00 H new ATOM 0 HG23 VAL A 101 19.781 33.830 29.080 1.00 0.00 H new ATOM 1379 N PRO A 102 21.383 36.802 30.624 1.00 0.00 N ATOM 1380 CA PRO A 102 22.084 36.340 31.786 1.00 0.00 C ATOM 1381 C PRO A 102 21.430 35.189 32.471 1.00 0.00 C ATOM 1382 O PRO A 102 20.173 35.123 32.505 1.00 0.00 O ATOM 1383 CB PRO A 102 22.114 37.537 32.733 1.00 0.00 C ATOM 1384 CG PRO A 102 22.040 38.752 31.795 1.00 0.00 C ATOM 1385 CD PRO A 102 21.098 38.227 30.700 1.00 0.00 C ATOM 1386 OXT PRO A 102 22.150 34.330 33.046 1.00 0.00 O ATOM 0 HA PRO A 102 23.069 35.977 31.494 1.00 0.00 H new ATOM 0 HB2 PRO A 102 21.275 37.517 33.428 1.00 0.00 H new ATOM 0 HB3 PRO A 102 23.024 37.550 33.332 1.00 0.00 H new ATOM 0 HG2 PRO A 102 21.639 39.634 32.295 1.00 0.00 H new ATOM 0 HG3 PRO A 102 23.018 39.027 31.400 1.00 0.00 H new ATOM 0 HD2 PRO A 102 20.054 38.410 30.954 1.00 0.00 H new ATOM 0 HD3 PRO A 102 21.285 38.720 29.746 1.00 0.00 H new TER 1394 PRO A 102