USER MOD reduce.3.24.130724 H: found=0, std=0, add=584, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 583 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 Single : A 1 GLY N :NH3+ -154:sc= 0.0275 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0.292 K(o=0.29,f=-0.41) USER MOD Single : A 11 ASN : amide:sc= 0.461 X(o=0.46,f=0) USER MOD Single : A 12 GLN :FLIP amide:sc= -0.133 F(o=-2.5!,f=-0.13) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0.0283 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 149:sc= 1.1 (180deg=-0.382!) USER MOD Single : A 39 ASN : amide:sc= 0.703 K(o=0.7,f=-0.029) USER MOD Single : A 46 GLN : amide:sc= -0.0625 K(o=-0.062,f=-2!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 51 ASN : amide:sc= 0.0172 X(o=0.017,f=-0.083) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0614) USER MOD Single : A 59 SER OG : rot -174:sc= 1.25 USER MOD Single : A 60 HIS : no HD1:sc= -0.0375 X(o=-0.038,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0102 USER MOD Single : A 64 GLN : amide:sc= -0.86 X(o=-0.86,f=-0.53) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 34.079 38.341 19.754 1.00 0.00 N ATOM 2 CA GLY A 1 33.501 38.827 21.017 1.00 0.00 C ATOM 3 C GLY A 1 32.462 37.832 21.471 1.00 0.00 C ATOM 4 O GLY A 1 32.775 36.645 21.490 1.00 0.00 O ATOM 0 H1 GLY A 1 35.042 38.719 19.645 1.00 0.00 H new ATOM 0 H2 GLY A 1 34.115 37.302 19.766 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.490 38.658 18.958 1.00 0.00 H new ATOM 0 HA2 GLY A 1 34.278 38.938 21.773 1.00 0.00 H new ATOM 0 HA3 GLY A 1 33.051 39.810 20.876 1.00 0.00 H new ATOM 10 N ARG A 2 31.246 38.316 21.766 1.00 0.00 N ATOM 11 CA ARG A 2 30.001 37.591 22.097 1.00 0.00 C ATOM 12 C ARG A 2 30.127 36.062 22.116 1.00 0.00 C ATOM 13 O ARG A 2 30.349 35.511 23.189 1.00 0.00 O ATOM 14 CB ARG A 2 28.797 38.040 21.228 1.00 0.00 C ATOM 15 CG ARG A 2 28.339 39.508 21.292 1.00 0.00 C ATOM 16 CD ARG A 2 29.299 40.569 20.734 1.00 0.00 C ATOM 17 NE ARG A 2 29.886 40.202 19.433 1.00 0.00 N ATOM 18 CZ ARG A 2 30.380 41.008 18.512 1.00 0.00 C ATOM 19 NH1 ARG A 2 30.393 42.302 18.635 1.00 0.00 N ATOM 20 NH2 ARG A 2 30.900 40.497 17.439 1.00 0.00 N ATOM 0 H ARG A 2 31.090 39.324 21.781 1.00 0.00 H new ATOM 0 HA ARG A 2 29.803 37.881 23.129 1.00 0.00 H new ATOM 0 HB2 ARG A 2 29.039 37.815 20.189 1.00 0.00 H new ATOM 0 HB3 ARG A 2 27.945 37.417 21.499 1.00 0.00 H new ATOM 0 HG2 ARG A 2 27.395 39.591 20.754 1.00 0.00 H new ATOM 0 HG3 ARG A 2 28.134 39.753 22.334 1.00 0.00 H new ATOM 0 HD2 ARG A 2 28.764 41.513 20.629 1.00 0.00 H new ATOM 0 HD3 ARG A 2 30.102 40.735 21.452 1.00 0.00 H new ATOM 0 HE ARG A 2 29.914 39.205 19.219 1.00 0.00 H new ATOM 0 HH11 ARG A 2 30.009 42.738 19.473 1.00 0.00 H new ATOM 0 HH12 ARG A 2 30.787 42.881 17.893 1.00 0.00 H new ATOM 0 HH21 ARG A 2 30.923 39.485 17.316 1.00 0.00 H new ATOM 0 HH22 ARG A 2 31.286 41.107 16.719 1.00 0.00 H new ATOM 34 N ARG A 3 29.864 35.392 20.987 1.00 0.00 N ATOM 35 CA ARG A 3 29.678 33.939 20.822 1.00 0.00 C ATOM 36 C ARG A 3 29.836 33.547 19.335 1.00 0.00 C ATOM 37 O ARG A 3 28.830 33.411 18.633 1.00 0.00 O ATOM 38 CB ARG A 3 28.284 33.516 21.346 1.00 0.00 C ATOM 39 CG ARG A 3 28.174 33.297 22.868 1.00 0.00 C ATOM 40 CD ARG A 3 27.154 34.197 23.585 1.00 0.00 C ATOM 41 NE ARG A 3 27.711 35.465 24.106 1.00 0.00 N ATOM 42 CZ ARG A 3 27.006 36.411 24.709 1.00 0.00 C ATOM 43 NH1 ARG A 3 25.794 36.173 25.105 1.00 0.00 N ATOM 44 NH2 ARG A 3 27.481 37.608 24.913 1.00 0.00 N ATOM 0 H ARG A 3 29.768 35.884 20.099 1.00 0.00 H new ATOM 0 HA ARG A 3 30.440 33.419 21.402 1.00 0.00 H new ATOM 0 HB2 ARG A 3 27.561 34.278 21.055 1.00 0.00 H new ATOM 0 HB3 ARG A 3 27.993 32.593 20.844 1.00 0.00 H new ATOM 0 HG2 ARG A 3 27.908 32.256 23.051 1.00 0.00 H new ATOM 0 HG3 ARG A 3 29.155 33.459 23.314 1.00 0.00 H new ATOM 0 HD2 ARG A 3 26.344 34.428 22.893 1.00 0.00 H new ATOM 0 HD3 ARG A 3 26.717 33.640 24.414 1.00 0.00 H new ATOM 0 HE ARG A 3 28.712 35.623 23.992 1.00 0.00 H new ATOM 0 HH11 ARG A 3 25.379 35.254 24.953 1.00 0.00 H new ATOM 0 HH12 ARG A 3 25.256 36.905 25.569 1.00 0.00 H new ATOM 0 HH21 ARG A 3 28.425 37.842 24.605 1.00 0.00 H new ATOM 0 HH22 ARG A 3 26.909 38.311 25.381 1.00 0.00 H new ATOM 58 N PRO A 4 31.061 33.327 18.824 1.00 0.00 N ATOM 59 CA PRO A 4 31.291 32.932 17.428 1.00 0.00 C ATOM 60 C PRO A 4 30.874 31.465 17.184 1.00 0.00 C ATOM 61 O PRO A 4 31.688 30.551 17.278 1.00 0.00 O ATOM 62 CB PRO A 4 32.781 33.208 17.183 1.00 0.00 C ATOM 63 CG PRO A 4 33.412 33.016 18.562 1.00 0.00 C ATOM 64 CD PRO A 4 32.330 33.525 19.515 1.00 0.00 C ATOM 0 HA PRO A 4 30.682 33.493 16.719 1.00 0.00 H new ATOM 0 HB2 PRO A 4 33.201 32.519 16.450 1.00 0.00 H new ATOM 0 HB3 PRO A 4 32.945 34.217 16.804 1.00 0.00 H new ATOM 0 HG2 PRO A 4 33.656 31.971 18.751 1.00 0.00 H new ATOM 0 HG3 PRO A 4 34.337 33.583 18.664 1.00 0.00 H new ATOM 0 HD2 PRO A 4 32.351 32.977 20.457 1.00 0.00 H new ATOM 0 HD3 PRO A 4 32.484 34.577 19.754 1.00 0.00 H new ATOM 72 N ARG A 5 29.571 31.221 16.957 1.00 0.00 N ATOM 73 CA ARG A 5 28.850 29.916 16.850 1.00 0.00 C ATOM 74 C ARG A 5 28.958 28.963 18.053 1.00 0.00 C ATOM 75 O ARG A 5 28.260 27.967 18.174 1.00 0.00 O ATOM 76 CB ARG A 5 29.195 29.252 15.490 1.00 0.00 C ATOM 77 CG ARG A 5 28.110 28.426 14.760 1.00 0.00 C ATOM 78 CD ARG A 5 27.752 27.085 15.431 1.00 0.00 C ATOM 79 NE ARG A 5 27.250 26.057 14.488 1.00 0.00 N ATOM 80 CZ ARG A 5 25.992 25.788 14.184 1.00 0.00 C ATOM 81 NH1 ARG A 5 25.005 26.534 14.567 1.00 0.00 N ATOM 82 NH2 ARG A 5 25.675 24.731 13.494 1.00 0.00 N ATOM 0 H ARG A 5 28.924 31.999 16.830 1.00 0.00 H new ATOM 0 HA ARG A 5 27.787 30.155 16.881 1.00 0.00 H new ATOM 0 HB2 ARG A 5 29.519 30.041 14.812 1.00 0.00 H new ATOM 0 HB3 ARG A 5 30.052 28.599 15.651 1.00 0.00 H new ATOM 0 HG2 ARG A 5 27.206 29.030 14.683 1.00 0.00 H new ATOM 0 HG3 ARG A 5 28.448 28.227 13.743 1.00 0.00 H new ATOM 0 HD2 ARG A 5 28.635 26.697 15.940 1.00 0.00 H new ATOM 0 HD3 ARG A 5 26.996 27.263 16.196 1.00 0.00 H new ATOM 0 HE ARG A 5 27.958 25.491 14.019 1.00 0.00 H new ATOM 0 HH11 ARG A 5 25.183 27.368 15.127 1.00 0.00 H new ATOM 0 HH12 ARG A 5 24.049 26.288 14.309 1.00 0.00 H new ATOM 0 HH21 ARG A 5 26.404 24.091 13.177 1.00 0.00 H new ATOM 0 HH22 ARG A 5 24.698 24.542 13.270 1.00 0.00 H new ATOM 96 N THR A 6 29.792 29.342 19.000 1.00 0.00 N ATOM 97 CA THR A 6 30.418 28.570 20.087 1.00 0.00 C ATOM 98 C THR A 6 30.714 27.116 19.706 1.00 0.00 C ATOM 99 O THR A 6 31.825 26.835 19.266 1.00 0.00 O ATOM 100 CB THR A 6 29.652 28.727 21.413 1.00 0.00 C ATOM 101 OG1 THR A 6 29.712 30.083 21.797 1.00 0.00 O ATOM 102 CG2 THR A 6 30.255 27.941 22.581 1.00 0.00 C ATOM 0 H THR A 6 30.092 30.316 19.042 1.00 0.00 H new ATOM 0 HA THR A 6 31.403 29.006 20.256 1.00 0.00 H new ATOM 0 HB THR A 6 28.645 28.354 21.226 1.00 0.00 H new ATOM 0 HG1 THR A 6 29.228 30.206 22.640 1.00 0.00 H new ATOM 0 HG21 THR A 6 29.657 28.105 23.477 1.00 0.00 H new ATOM 0 HG22 THR A 6 30.262 26.878 22.339 1.00 0.00 H new ATOM 0 HG23 THR A 6 31.276 28.279 22.759 1.00 0.00 H new ATOM 110 N ALA A 7 29.730 26.220 19.835 1.00 0.00 N ATOM 111 CA ALA A 7 29.822 24.759 19.760 1.00 0.00 C ATOM 112 C ALA A 7 30.951 24.119 20.607 1.00 0.00 C ATOM 113 O ALA A 7 31.783 24.788 21.224 1.00 0.00 O ATOM 114 CB ALA A 7 29.844 24.341 18.280 1.00 0.00 C ATOM 0 H ALA A 7 28.772 26.523 20.009 1.00 0.00 H new ATOM 0 HA ALA A 7 28.931 24.350 20.237 1.00 0.00 H new ATOM 0 HB1 ALA A 7 29.912 23.255 18.210 1.00 0.00 H new ATOM 0 HB2 ALA A 7 28.930 24.679 17.793 1.00 0.00 H new ATOM 0 HB3 ALA A 7 30.706 24.792 17.787 1.00 0.00 H new ATOM 120 N PHE A 8 30.931 22.788 20.696 1.00 0.00 N ATOM 121 CA PHE A 8 31.832 21.957 21.478 1.00 0.00 C ATOM 122 C PHE A 8 32.257 20.718 20.665 1.00 0.00 C ATOM 123 O PHE A 8 31.857 20.553 19.510 1.00 0.00 O ATOM 124 CB PHE A 8 31.112 21.517 22.758 1.00 0.00 C ATOM 125 CG PHE A 8 30.212 22.529 23.458 1.00 0.00 C ATOM 126 CD1 PHE A 8 30.714 23.790 23.827 1.00 0.00 C ATOM 127 CD2 PHE A 8 28.866 22.211 23.697 1.00 0.00 C ATOM 128 CE1 PHE A 8 29.857 24.753 24.382 1.00 0.00 C ATOM 129 CE2 PHE A 8 28.014 23.171 24.255 1.00 0.00 C ATOM 130 CZ PHE A 8 28.508 24.434 24.602 1.00 0.00 C ATOM 0 H PHE A 8 30.241 22.233 20.191 1.00 0.00 H new ATOM 0 HA PHE A 8 32.726 22.527 21.731 1.00 0.00 H new ATOM 0 HB2 PHE A 8 30.507 20.643 22.517 1.00 0.00 H new ATOM 0 HB3 PHE A 8 31.869 21.193 23.472 1.00 0.00 H new ATOM 0 HD1 PHE A 8 31.760 24.017 23.683 1.00 0.00 H new ATOM 0 HD2 PHE A 8 28.489 21.229 23.451 1.00 0.00 H new ATOM 0 HE1 PHE A 8 30.233 25.733 24.638 1.00 0.00 H new ATOM 0 HE2 PHE A 8 26.972 22.937 24.418 1.00 0.00 H new ATOM 0 HZ PHE A 8 27.848 25.167 25.041 1.00 0.00 H new ATOM 140 N THR A 9 32.999 19.806 21.292 1.00 0.00 N ATOM 141 CA THR A 9 33.114 18.411 20.828 1.00 0.00 C ATOM 142 C THR A 9 31.772 17.680 20.969 1.00 0.00 C ATOM 143 O THR A 9 31.027 17.954 21.916 1.00 0.00 O ATOM 144 CB THR A 9 34.220 17.662 21.590 1.00 0.00 C ATOM 145 OG1 THR A 9 34.232 16.332 21.144 1.00 0.00 O ATOM 146 CG2 THR A 9 34.063 17.610 23.112 1.00 0.00 C ATOM 0 H THR A 9 33.539 20.006 22.134 1.00 0.00 H new ATOM 0 HA THR A 9 33.387 18.431 19.773 1.00 0.00 H new ATOM 0 HB THR A 9 35.135 18.219 21.387 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.932 15.835 21.616 1.00 0.00 H new ATOM 0 HG21 THR A 9 34.897 17.059 23.545 1.00 0.00 H new ATOM 0 HG22 THR A 9 34.052 18.624 23.511 1.00 0.00 H new ATOM 0 HG23 THR A 9 33.128 17.110 23.364 1.00 0.00 H new ATOM 154 N GLN A 10 31.467 16.710 20.094 1.00 0.00 N ATOM 155 CA GLN A 10 30.227 15.930 20.196 1.00 0.00 C ATOM 156 C GLN A 10 30.100 15.218 21.552 1.00 0.00 C ATOM 157 O GLN A 10 28.998 15.121 22.072 1.00 0.00 O ATOM 158 CB GLN A 10 30.073 14.927 19.035 1.00 0.00 C ATOM 159 CG GLN A 10 28.586 14.615 18.748 1.00 0.00 C ATOM 160 CD GLN A 10 28.305 13.193 18.254 1.00 0.00 C ATOM 161 OE1 GLN A 10 29.180 12.441 17.840 1.00 0.00 O ATOM 162 NE2 GLN A 10 27.073 12.749 18.314 1.00 0.00 N ATOM 0 H GLN A 10 32.063 16.448 19.309 1.00 0.00 H new ATOM 0 HA GLN A 10 29.411 16.649 20.122 1.00 0.00 H new ATOM 0 HB2 GLN A 10 30.540 15.333 18.138 1.00 0.00 H new ATOM 0 HB3 GLN A 10 30.599 14.004 19.278 1.00 0.00 H new ATOM 0 HG2 GLN A 10 28.012 14.787 19.659 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.220 15.321 18.003 1.00 0.00 H new ATOM 0 HE21 GLN A 10 26.328 13.356 18.655 1.00 0.00 H new ATOM 0 HE22 GLN A 10 26.859 11.796 18.020 1.00 0.00 H new ATOM 171 N ASN A 11 31.199 14.803 22.193 1.00 0.00 N ATOM 172 CA ASN A 11 31.125 14.175 23.521 1.00 0.00 C ATOM 173 C ASN A 11 30.622 15.112 24.645 1.00 0.00 C ATOM 174 O ASN A 11 30.274 14.629 25.717 1.00 0.00 O ATOM 175 CB ASN A 11 32.491 13.556 23.875 1.00 0.00 C ATOM 176 CG ASN A 11 32.336 12.191 24.521 1.00 0.00 C ATOM 177 OD1 ASN A 11 32.785 11.191 23.975 1.00 0.00 O ATOM 178 ND2 ASN A 11 31.683 12.091 25.650 1.00 0.00 N ATOM 0 H ASN A 11 32.144 14.889 21.819 1.00 0.00 H new ATOM 0 HA ASN A 11 30.368 13.394 23.455 1.00 0.00 H new ATOM 0 HB2 ASN A 11 33.095 13.465 22.972 1.00 0.00 H new ATOM 0 HB3 ASN A 11 33.028 14.221 24.552 1.00 0.00 H new ATOM 0 HD21 ASN A 11 31.545 11.177 26.080 1.00 0.00 H new ATOM 0 HD22 ASN A 11 31.311 12.928 26.100 1.00 0.00 H new ATOM 185 N GLN A 12 30.581 16.427 24.405 1.00 0.00 N ATOM 186 CA GLN A 12 29.923 17.441 25.240 1.00 0.00 C ATOM 187 C GLN A 12 28.467 17.648 24.798 1.00 0.00 C ATOM 188 O GLN A 12 27.571 17.729 25.639 1.00 0.00 O ATOM 189 CB GLN A 12 30.704 18.760 25.062 1.00 0.00 C ATOM 190 CG GLN A 12 30.597 19.770 26.213 1.00 0.00 C ATOM 191 CD GLN A 12 31.773 19.598 27.181 1.00 0.00 C ATOM 192 OE1 GLN A 12 32.450 20.662 27.547 1.00 0.00 O flip ATOM 193 NE2 GLN A 12 32.119 18.505 27.613 1.00 0.00 N flip ATOM 0 H GLN A 12 31.027 16.834 23.583 1.00 0.00 H new ATOM 0 HA GLN A 12 29.917 17.120 26.282 1.00 0.00 H new ATOM 0 HB2 GLN A 12 31.757 18.518 24.915 1.00 0.00 H new ATOM 0 HB3 GLN A 12 30.357 19.243 24.149 1.00 0.00 H new ATOM 0 HG2 GLN A 12 30.589 20.785 25.816 1.00 0.00 H new ATOM 0 HG3 GLN A 12 29.656 19.628 26.744 1.00 0.00 H new ATOM 0 HE21 GLN A 12 31.608 17.665 27.342 1.00 0.00 H new ATOM 0 HE22 GLN A 12 32.918 18.435 28.243 1.00 0.00 H new ATOM 202 N ILE A 13 28.245 17.726 23.479 1.00 0.00 N ATOM 203 CA ILE A 13 26.924 17.848 22.854 1.00 0.00 C ATOM 204 C ILE A 13 26.010 16.713 23.301 1.00 0.00 C ATOM 205 O ILE A 13 24.946 17.006 23.813 1.00 0.00 O ATOM 206 CB ILE A 13 27.026 17.918 21.313 1.00 0.00 C ATOM 207 CG1 ILE A 13 27.870 19.120 20.834 1.00 0.00 C ATOM 208 CG2 ILE A 13 25.649 17.931 20.627 1.00 0.00 C ATOM 209 CD1 ILE A 13 27.214 20.490 21.027 1.00 0.00 C ATOM 0 H ILE A 13 29.004 17.705 22.798 1.00 0.00 H new ATOM 0 HA ILE A 13 26.483 18.788 23.187 1.00 0.00 H new ATOM 0 HB ILE A 13 27.538 17.003 21.016 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.821 19.111 21.366 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.095 18.988 19.776 1.00 0.00 H new ATOM 0 HG21 ILE A 13 25.781 17.981 19.546 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.106 17.022 20.884 1.00 0.00 H new ATOM 0 HG23 ILE A 13 25.083 18.800 20.964 1.00 0.00 H new ATOM 0 HD11 ILE A 13 27.883 21.269 20.661 1.00 0.00 H new ATOM 0 HD12 ILE A 13 26.277 20.526 20.472 1.00 0.00 H new ATOM 0 HD13 ILE A 13 27.014 20.652 22.086 1.00 0.00 H new ATOM 221 N GLU A 14 26.403 15.446 23.169 1.00 0.00 N ATOM 222 CA GLU A 14 25.557 14.310 23.549 1.00 0.00 C ATOM 223 C GLU A 14 25.118 14.319 25.023 1.00 0.00 C ATOM 224 O GLU A 14 24.009 13.874 25.307 1.00 0.00 O ATOM 225 CB GLU A 14 26.285 12.992 23.249 1.00 0.00 C ATOM 226 CG GLU A 14 26.612 12.747 21.773 1.00 0.00 C ATOM 227 CD GLU A 14 25.376 12.660 20.873 1.00 0.00 C ATOM 228 OE1 GLU A 14 24.777 11.563 20.793 1.00 0.00 O ATOM 229 OE2 GLU A 14 25.111 13.632 20.128 1.00 0.00 O ATOM 0 H GLU A 14 27.314 15.177 22.797 1.00 0.00 H new ATOM 0 HA GLU A 14 24.650 14.402 22.952 1.00 0.00 H new ATOM 0 HB2 GLU A 14 27.214 12.971 23.818 1.00 0.00 H new ATOM 0 HB3 GLU A 14 25.671 12.167 23.610 1.00 0.00 H new ATOM 0 HG2 GLU A 14 27.255 13.551 21.415 1.00 0.00 H new ATOM 0 HG3 GLU A 14 27.180 11.821 21.685 1.00 0.00 H new ATOM 236 N VAL A 15 25.926 14.836 25.963 1.00 0.00 N ATOM 237 CA VAL A 15 25.478 14.990 27.363 1.00 0.00 C ATOM 238 C VAL A 15 24.414 16.086 27.466 1.00 0.00 C ATOM 239 O VAL A 15 23.385 15.895 28.116 1.00 0.00 O ATOM 240 CB VAL A 15 26.670 15.291 28.297 1.00 0.00 C ATOM 241 CG1 VAL A 15 26.236 15.471 29.759 1.00 0.00 C ATOM 242 CG2 VAL A 15 27.696 14.151 28.261 1.00 0.00 C ATOM 0 H VAL A 15 26.880 15.151 25.786 1.00 0.00 H new ATOM 0 HA VAL A 15 25.034 14.048 27.684 1.00 0.00 H new ATOM 0 HB VAL A 15 27.107 16.220 27.931 1.00 0.00 H new ATOM 0 HG11 VAL A 15 27.110 15.681 30.375 1.00 0.00 H new ATOM 0 HG12 VAL A 15 25.534 16.302 29.831 1.00 0.00 H new ATOM 0 HG13 VAL A 15 25.755 14.558 30.111 1.00 0.00 H new ATOM 0 HG21 VAL A 15 28.526 14.387 28.927 1.00 0.00 H new ATOM 0 HG22 VAL A 15 27.222 13.225 28.586 1.00 0.00 H new ATOM 0 HG23 VAL A 15 28.070 14.030 27.244 1.00 0.00 H new ATOM 252 N LEU A 16 24.649 17.224 26.812 1.00 0.00 N ATOM 253 CA LEU A 16 23.736 18.365 26.769 1.00 0.00 C ATOM 254 C LEU A 16 22.410 18.021 26.049 1.00 0.00 C ATOM 255 O LEU A 16 21.341 18.241 26.618 1.00 0.00 O ATOM 256 CB LEU A 16 24.503 19.565 26.172 1.00 0.00 C ATOM 257 CG LEU A 16 25.614 20.112 27.084 1.00 0.00 C ATOM 258 CD1 LEU A 16 26.472 21.103 26.311 1.00 0.00 C ATOM 259 CD2 LEU A 16 25.011 20.861 28.271 1.00 0.00 C ATOM 0 H LEU A 16 25.506 17.381 26.282 1.00 0.00 H new ATOM 0 HA LEU A 16 23.413 18.640 27.773 1.00 0.00 H new ATOM 0 HB2 LEU A 16 24.942 19.265 25.221 1.00 0.00 H new ATOM 0 HB3 LEU A 16 23.795 20.366 25.958 1.00 0.00 H new ATOM 0 HG LEU A 16 26.209 19.267 27.432 1.00 0.00 H new ATOM 0 HD11 LEU A 16 27.258 21.488 26.961 1.00 0.00 H new ATOM 0 HD12 LEU A 16 26.923 20.603 25.454 1.00 0.00 H new ATOM 0 HD13 LEU A 16 25.851 21.929 25.964 1.00 0.00 H new ATOM 0 HD21 LEU A 16 25.811 21.241 28.906 1.00 0.00 H new ATOM 0 HD22 LEU A 16 24.409 21.694 27.908 1.00 0.00 H new ATOM 0 HD23 LEU A 16 24.382 20.183 28.847 1.00 0.00 H new ATOM 271 N GLU A 17 22.449 17.397 24.866 1.00 0.00 N ATOM 272 CA GLU A 17 21.294 16.831 24.148 1.00 0.00 C ATOM 273 C GLU A 17 20.529 15.822 25.014 1.00 0.00 C ATOM 274 O GLU A 17 19.305 15.886 25.103 1.00 0.00 O ATOM 275 CB GLU A 17 21.736 16.137 22.843 1.00 0.00 C ATOM 276 CG GLU A 17 22.353 17.019 21.746 1.00 0.00 C ATOM 277 CD GLU A 17 21.378 17.972 21.030 1.00 0.00 C ATOM 278 OE1 GLU A 17 20.462 18.511 21.684 1.00 0.00 O ATOM 279 OE2 GLU A 17 21.605 18.227 19.819 1.00 0.00 O ATOM 0 H GLU A 17 23.324 17.265 24.358 1.00 0.00 H new ATOM 0 HA GLU A 17 20.634 17.665 23.910 1.00 0.00 H new ATOM 0 HB2 GLU A 17 22.460 15.365 23.101 1.00 0.00 H new ATOM 0 HB3 GLU A 17 20.868 15.631 22.420 1.00 0.00 H new ATOM 0 HG2 GLU A 17 23.153 17.612 22.189 1.00 0.00 H new ATOM 0 HG3 GLU A 17 22.813 16.371 21.000 1.00 0.00 H new ATOM 286 N ASN A 18 21.229 14.913 25.703 1.00 0.00 N ATOM 287 CA ASN A 18 20.593 13.965 26.624 1.00 0.00 C ATOM 288 C ASN A 18 19.867 14.645 27.807 1.00 0.00 C ATOM 289 O ASN A 18 18.879 14.095 28.289 1.00 0.00 O ATOM 290 CB ASN A 18 21.659 12.956 27.069 1.00 0.00 C ATOM 291 CG ASN A 18 21.160 11.950 28.083 1.00 0.00 C ATOM 292 OD1 ASN A 18 20.364 11.068 27.799 1.00 0.00 O ATOM 293 ND2 ASN A 18 21.659 12.033 29.295 1.00 0.00 N ATOM 0 H ASN A 18 22.242 14.814 25.639 1.00 0.00 H new ATOM 0 HA ASN A 18 19.790 13.443 26.103 1.00 0.00 H new ATOM 0 HB2 ASN A 18 22.029 12.423 26.194 1.00 0.00 H new ATOM 0 HB3 ASN A 18 22.504 13.498 27.494 1.00 0.00 H new ATOM 0 HD21 ASN A 18 21.382 11.358 30.008 1.00 0.00 H new ATOM 0 HD22 ASN A 18 22.323 12.773 29.524 1.00 0.00 H new ATOM 300 N VAL A 19 20.273 15.847 28.244 1.00 0.00 N ATOM 301 CA VAL A 19 19.463 16.670 29.166 1.00 0.00 C ATOM 302 C VAL A 19 18.300 17.353 28.440 1.00 0.00 C ATOM 303 O VAL A 19 17.167 17.259 28.909 1.00 0.00 O ATOM 304 CB VAL A 19 20.304 17.696 29.953 1.00 0.00 C ATOM 305 CG1 VAL A 19 19.425 18.548 30.889 1.00 0.00 C ATOM 306 CG2 VAL A 19 21.323 16.970 30.841 1.00 0.00 C ATOM 0 H VAL A 19 21.159 16.275 27.975 1.00 0.00 H new ATOM 0 HA VAL A 19 19.046 15.979 29.899 1.00 0.00 H new ATOM 0 HB VAL A 19 20.795 18.333 29.217 1.00 0.00 H new ATOM 0 HG11 VAL A 19 20.051 19.260 31.428 1.00 0.00 H new ATOM 0 HG12 VAL A 19 18.684 19.089 30.300 1.00 0.00 H new ATOM 0 HG13 VAL A 19 18.918 17.899 31.602 1.00 0.00 H new ATOM 0 HG21 VAL A 19 21.912 17.703 31.393 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.798 16.323 31.544 1.00 0.00 H new ATOM 0 HG23 VAL A 19 21.984 16.368 30.218 1.00 0.00 H new ATOM 316 N PHE A 20 18.527 17.997 27.291 1.00 0.00 N ATOM 317 CA PHE A 20 17.470 18.630 26.482 1.00 0.00 C ATOM 318 C PHE A 20 16.329 17.656 26.109 1.00 0.00 C ATOM 319 O PHE A 20 15.164 18.055 26.092 1.00 0.00 O ATOM 320 CB PHE A 20 18.120 19.283 25.247 1.00 0.00 C ATOM 321 CG PHE A 20 17.163 19.995 24.304 1.00 0.00 C ATOM 322 CD1 PHE A 20 16.557 21.206 24.684 1.00 0.00 C ATOM 323 CD2 PHE A 20 16.879 19.442 23.042 1.00 0.00 C ATOM 324 CE1 PHE A 20 15.634 21.837 23.830 1.00 0.00 C ATOM 325 CE2 PHE A 20 15.963 20.074 22.183 1.00 0.00 C ATOM 326 CZ PHE A 20 15.329 21.265 22.582 1.00 0.00 C ATOM 0 H PHE A 20 19.459 18.097 26.888 1.00 0.00 H new ATOM 0 HA PHE A 20 16.984 19.401 27.081 1.00 0.00 H new ATOM 0 HB2 PHE A 20 18.867 20.000 25.587 1.00 0.00 H new ATOM 0 HB3 PHE A 20 18.649 18.512 24.686 1.00 0.00 H new ATOM 0 HD1 PHE A 20 16.801 21.654 25.636 1.00 0.00 H new ATOM 0 HD2 PHE A 20 17.366 18.529 22.732 1.00 0.00 H new ATOM 0 HE1 PHE A 20 15.160 22.759 24.132 1.00 0.00 H new ATOM 0 HE2 PHE A 20 15.746 19.645 21.216 1.00 0.00 H new ATOM 0 HZ PHE A 20 14.609 21.739 21.931 1.00 0.00 H new ATOM 336 N ARG A 21 16.644 16.367 25.914 1.00 0.00 N ATOM 337 CA ARG A 21 15.728 15.225 25.723 1.00 0.00 C ATOM 338 C ARG A 21 14.714 15.006 26.861 1.00 0.00 C ATOM 339 O ARG A 21 13.654 14.451 26.594 1.00 0.00 O ATOM 340 CB ARG A 21 16.598 13.975 25.458 1.00 0.00 C ATOM 341 CG ARG A 21 15.870 12.619 25.466 1.00 0.00 C ATOM 342 CD ARG A 21 16.806 11.485 25.007 1.00 0.00 C ATOM 343 NE ARG A 21 16.470 10.190 25.627 1.00 0.00 N ATOM 344 CZ ARG A 21 15.477 9.355 25.379 1.00 0.00 C ATOM 345 NH1 ARG A 21 14.616 9.516 24.418 1.00 0.00 N ATOM 346 NH2 ARG A 21 15.364 8.312 26.141 1.00 0.00 N ATOM 0 H ARG A 21 17.619 16.070 25.883 1.00 0.00 H new ATOM 0 HA ARG A 21 15.086 15.442 24.870 1.00 0.00 H new ATOM 0 HB2 ARG A 21 17.084 14.096 24.490 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.388 13.943 26.209 1.00 0.00 H new ATOM 0 HG2 ARG A 21 15.501 12.407 26.469 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.001 12.665 24.810 1.00 0.00 H new ATOM 0 HD2 ARG A 21 16.752 11.390 23.923 1.00 0.00 H new ATOM 0 HD3 ARG A 21 17.835 11.746 25.253 1.00 0.00 H new ATOM 0 HE ARG A 21 17.106 9.891 26.366 1.00 0.00 H new ATOM 0 HH11 ARG A 21 14.685 10.326 23.802 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.871 8.832 24.280 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.029 8.160 26.900 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.610 7.643 25.982 1.00 0.00 H new ATOM 360 N VAL A 22 15.000 15.435 28.096 1.00 0.00 N ATOM 361 CA VAL A 22 14.135 15.261 29.277 1.00 0.00 C ATOM 362 C VAL A 22 13.703 16.572 29.939 1.00 0.00 C ATOM 363 O VAL A 22 12.611 16.665 30.488 1.00 0.00 O ATOM 364 CB VAL A 22 14.819 14.369 30.323 1.00 0.00 C ATOM 365 CG1 VAL A 22 14.811 12.899 29.886 1.00 0.00 C ATOM 366 CG2 VAL A 22 16.257 14.763 30.685 1.00 0.00 C ATOM 0 H VAL A 22 15.866 15.929 28.311 1.00 0.00 H new ATOM 0 HA VAL A 22 13.229 14.786 28.900 1.00 0.00 H new ATOM 0 HB VAL A 22 14.220 14.518 31.222 1.00 0.00 H new ATOM 0 HG11 VAL A 22 15.302 12.291 30.646 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.782 12.562 29.761 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.344 12.798 28.940 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.647 14.070 31.431 1.00 0.00 H new ATOM 0 HG22 VAL A 22 16.881 14.724 29.792 1.00 0.00 H new ATOM 0 HG23 VAL A 22 16.266 15.775 31.090 1.00 0.00 H new ATOM 376 N ASN A 23 14.540 17.602 29.873 1.00 0.00 N ATOM 377 CA ASN A 23 14.299 18.953 30.377 1.00 0.00 C ATOM 378 C ASN A 23 14.667 19.977 29.291 1.00 0.00 C ATOM 379 O ASN A 23 15.710 20.627 29.349 1.00 0.00 O ATOM 380 CB ASN A 23 15.079 19.161 31.689 1.00 0.00 C ATOM 381 CG ASN A 23 14.588 18.292 32.831 1.00 0.00 C ATOM 382 OD1 ASN A 23 15.259 17.377 33.282 1.00 0.00 O ATOM 383 ND2 ASN A 23 13.421 18.564 33.364 1.00 0.00 N ATOM 0 H ASN A 23 15.460 17.513 29.441 1.00 0.00 H new ATOM 0 HA ASN A 23 13.243 19.096 30.608 1.00 0.00 H new ATOM 0 HB2 ASN A 23 16.134 18.952 31.512 1.00 0.00 H new ATOM 0 HB3 ASN A 23 15.007 20.208 31.983 1.00 0.00 H new ATOM 0 HD21 ASN A 23 13.079 18.012 34.151 1.00 0.00 H new ATOM 0 HD22 ASN A 23 12.856 19.327 32.992 1.00 0.00 H new ATOM 390 N CYS A 24 13.794 20.122 28.289 1.00 0.00 N ATOM 391 CA CYS A 24 13.997 21.006 27.135 1.00 0.00 C ATOM 392 C CYS A 24 14.174 22.495 27.505 1.00 0.00 C ATOM 393 O CYS A 24 14.886 23.225 26.814 1.00 0.00 O ATOM 394 CB CYS A 24 12.851 20.779 26.141 1.00 0.00 C ATOM 395 SG CYS A 24 11.255 21.179 26.915 1.00 0.00 S ATOM 0 H CYS A 24 12.908 19.618 28.256 1.00 0.00 H new ATOM 0 HA CYS A 24 14.947 20.743 26.670 1.00 0.00 H new ATOM 0 HB2 CYS A 24 12.999 21.399 25.257 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.851 19.742 25.807 1.00 0.00 H new ATOM 0 HG CYS A 24 10.296 20.983 26.059 1.00 0.00 H new ATOM 401 N TYR A 25 13.603 22.911 28.639 1.00 0.00 N ATOM 402 CA TYR A 25 14.002 24.072 29.436 1.00 0.00 C ATOM 403 C TYR A 25 14.178 23.622 30.899 1.00 0.00 C ATOM 404 O TYR A 25 13.172 23.305 31.541 1.00 0.00 O ATOM 405 CB TYR A 25 12.976 25.214 29.338 1.00 0.00 C ATOM 406 CG TYR A 25 13.096 26.114 28.119 1.00 0.00 C ATOM 407 CD1 TYR A 25 14.322 26.728 27.800 1.00 0.00 C ATOM 408 CD2 TYR A 25 11.949 26.406 27.350 1.00 0.00 C ATOM 409 CE1 TYR A 25 14.416 27.597 26.694 1.00 0.00 C ATOM 410 CE2 TYR A 25 12.037 27.294 26.265 1.00 0.00 C ATOM 411 CZ TYR A 25 13.276 27.880 25.922 1.00 0.00 C ATOM 412 OH TYR A 25 13.367 28.721 24.862 1.00 0.00 O ATOM 0 H TYR A 25 12.807 22.420 29.047 1.00 0.00 H new ATOM 0 HA TYR A 25 14.942 24.463 29.047 1.00 0.00 H new ATOM 0 HB2 TYR A 25 11.976 24.780 29.347 1.00 0.00 H new ATOM 0 HB3 TYR A 25 13.063 25.832 30.232 1.00 0.00 H new ATOM 0 HD1 TYR A 25 15.195 26.532 28.405 1.00 0.00 H new ATOM 0 HD2 TYR A 25 11.003 25.946 27.596 1.00 0.00 H new ATOM 0 HE1 TYR A 25 15.365 28.046 26.440 1.00 0.00 H new ATOM 0 HE2 TYR A 25 11.153 27.530 25.690 1.00 0.00 H new ATOM 0 HH TYR A 25 12.488 28.807 24.436 1.00 0.00 H new ATOM 422 N PRO A 26 15.420 23.510 31.410 1.00 0.00 N ATOM 423 CA PRO A 26 15.717 23.114 32.789 1.00 0.00 C ATOM 424 C PRO A 26 15.604 24.295 33.780 1.00 0.00 C ATOM 425 O PRO A 26 15.148 25.382 33.422 1.00 0.00 O ATOM 426 CB PRO A 26 17.142 22.557 32.692 1.00 0.00 C ATOM 427 CG PRO A 26 17.798 23.494 31.684 1.00 0.00 C ATOM 428 CD PRO A 26 16.671 23.721 30.680 1.00 0.00 C ATOM 0 HA PRO A 26 15.008 22.386 33.183 1.00 0.00 H new ATOM 0 HB2 PRO A 26 17.651 22.577 33.655 1.00 0.00 H new ATOM 0 HB3 PRO A 26 17.150 21.522 32.349 1.00 0.00 H new ATOM 0 HG2 PRO A 26 18.126 24.425 32.146 1.00 0.00 H new ATOM 0 HG3 PRO A 26 18.674 23.043 31.218 1.00 0.00 H new ATOM 0 HD2 PRO A 26 16.715 24.729 30.268 1.00 0.00 H new ATOM 0 HD3 PRO A 26 16.753 23.030 29.841 1.00 0.00 H new ATOM 436 N GLY A 27 16.006 24.085 35.038 1.00 0.00 N ATOM 437 CA GLY A 27 16.219 25.150 36.030 1.00 0.00 C ATOM 438 C GLY A 27 17.644 25.721 36.001 1.00 0.00 C ATOM 439 O GLY A 27 18.555 25.101 35.449 1.00 0.00 O ATOM 0 H GLY A 27 16.197 23.152 35.405 1.00 0.00 H new ATOM 0 HA2 GLY A 27 15.507 25.955 35.849 1.00 0.00 H new ATOM 0 HA3 GLY A 27 16.011 24.758 37.026 1.00 0.00 H new ATOM 443 N ILE A 28 17.862 26.884 36.628 1.00 0.00 N ATOM 444 CA ILE A 28 19.168 27.568 36.595 1.00 0.00 C ATOM 445 C ILE A 28 20.255 26.741 37.282 1.00 0.00 C ATOM 446 O ILE A 28 21.363 26.667 36.779 1.00 0.00 O ATOM 447 CB ILE A 28 19.104 28.972 37.226 1.00 0.00 C ATOM 448 CG1 ILE A 28 17.915 29.838 36.741 1.00 0.00 C ATOM 449 CG2 ILE A 28 20.417 29.751 37.023 1.00 0.00 C ATOM 450 CD1 ILE A 28 17.825 30.052 35.224 1.00 0.00 C ATOM 0 H ILE A 28 17.149 27.375 37.167 1.00 0.00 H new ATOM 0 HA ILE A 28 19.426 27.680 35.542 1.00 0.00 H new ATOM 0 HB ILE A 28 18.947 28.781 38.288 1.00 0.00 H new ATOM 0 HG12 ILE A 28 16.989 29.374 37.080 1.00 0.00 H new ATOM 0 HG13 ILE A 28 17.978 30.813 37.224 1.00 0.00 H new ATOM 0 HG21 ILE A 28 20.331 30.736 37.483 1.00 0.00 H new ATOM 0 HG22 ILE A 28 21.239 29.205 37.486 1.00 0.00 H new ATOM 0 HG23 ILE A 28 20.612 29.864 35.957 1.00 0.00 H new ATOM 0 HD11 ILE A 28 16.958 30.671 34.995 1.00 0.00 H new ATOM 0 HD12 ILE A 28 18.729 30.549 34.872 1.00 0.00 H new ATOM 0 HD13 ILE A 28 17.724 29.088 34.726 1.00 0.00 H new ATOM 462 N ASP A 29 19.941 26.060 38.385 1.00 0.00 N ATOM 463 CA ASP A 29 20.877 25.181 39.097 1.00 0.00 C ATOM 464 C ASP A 29 21.370 24.016 38.239 1.00 0.00 C ATOM 465 O ASP A 29 22.474 23.536 38.470 1.00 0.00 O ATOM 466 CB ASP A 29 20.193 24.591 40.340 1.00 0.00 C ATOM 467 CG ASP A 29 19.369 25.600 41.129 1.00 0.00 C ATOM 468 OD1 ASP A 29 19.924 26.236 42.053 1.00 0.00 O ATOM 469 OD2 ASP A 29 18.157 25.712 40.847 1.00 0.00 O ATOM 0 H ASP A 29 19.018 26.102 38.817 1.00 0.00 H new ATOM 0 HA ASP A 29 21.734 25.799 39.365 1.00 0.00 H new ATOM 0 HB2 ASP A 29 19.546 23.770 40.031 1.00 0.00 H new ATOM 0 HB3 ASP A 29 20.954 24.167 40.995 1.00 0.00 H new ATOM 474 N ILE A 30 20.570 23.568 37.268 1.00 0.00 N ATOM 475 CA ILE A 30 20.911 22.522 36.300 1.00 0.00 C ATOM 476 C ILE A 30 21.788 23.096 35.178 1.00 0.00 C ATOM 477 O ILE A 30 22.725 22.431 34.747 1.00 0.00 O ATOM 478 CB ILE A 30 19.613 21.912 35.730 1.00 0.00 C ATOM 479 CG1 ILE A 30 18.570 21.549 36.813 1.00 0.00 C ATOM 480 CG2 ILE A 30 19.872 20.704 34.812 1.00 0.00 C ATOM 481 CD1 ILE A 30 19.033 20.513 37.847 1.00 0.00 C ATOM 0 H ILE A 30 19.630 23.939 37.129 1.00 0.00 H new ATOM 0 HA ILE A 30 21.481 21.737 36.798 1.00 0.00 H new ATOM 0 HB ILE A 30 19.184 22.711 35.125 1.00 0.00 H new ATOM 0 HG12 ILE A 30 18.284 22.460 37.339 1.00 0.00 H new ATOM 0 HG13 ILE A 30 17.675 21.171 36.320 1.00 0.00 H new ATOM 0 HG21 ILE A 30 18.922 20.318 34.442 1.00 0.00 H new ATOM 0 HG22 ILE A 30 20.491 21.013 33.970 1.00 0.00 H new ATOM 0 HG23 ILE A 30 20.386 19.924 35.373 1.00 0.00 H new ATOM 0 HD11 ILE A 30 18.231 20.328 38.561 1.00 0.00 H new ATOM 0 HD12 ILE A 30 19.290 19.583 37.340 1.00 0.00 H new ATOM 0 HD13 ILE A 30 19.908 20.892 38.375 1.00 0.00 H new ATOM 493 N LEU A 31 21.526 24.334 34.730 1.00 0.00 N ATOM 494 CA LEU A 31 22.449 25.065 33.851 1.00 0.00 C ATOM 495 C LEU A 31 23.802 25.295 34.538 1.00 0.00 C ATOM 496 O LEU A 31 24.823 24.958 33.952 1.00 0.00 O ATOM 497 CB LEU A 31 21.845 26.405 33.380 1.00 0.00 C ATOM 498 CG LEU A 31 20.642 26.299 32.425 1.00 0.00 C ATOM 499 CD1 LEU A 31 20.001 27.675 32.249 1.00 0.00 C ATOM 500 CD2 LEU A 31 21.046 25.780 31.044 1.00 0.00 C ATOM 0 H LEU A 31 20.678 24.851 34.964 1.00 0.00 H new ATOM 0 HA LEU A 31 22.613 24.445 32.969 1.00 0.00 H new ATOM 0 HB2 LEU A 31 21.538 26.972 34.259 1.00 0.00 H new ATOM 0 HB3 LEU A 31 22.627 26.981 32.886 1.00 0.00 H new ATOM 0 HG LEU A 31 19.941 25.593 32.871 1.00 0.00 H new ATOM 0 HD11 LEU A 31 19.150 27.596 31.572 1.00 0.00 H new ATOM 0 HD12 LEU A 31 19.662 28.045 33.217 1.00 0.00 H new ATOM 0 HD13 LEU A 31 20.733 28.367 31.832 1.00 0.00 H new ATOM 0 HD21 LEU A 31 20.165 25.722 30.405 1.00 0.00 H new ATOM 0 HD22 LEU A 31 21.773 26.459 30.599 1.00 0.00 H new ATOM 0 HD23 LEU A 31 21.488 24.789 31.143 1.00 0.00 H new ATOM 512 N GLU A 32 23.812 25.810 35.769 1.00 0.00 N ATOM 513 CA GLU A 32 24.997 25.939 36.624 1.00 0.00 C ATOM 514 C GLU A 32 25.724 24.611 36.860 1.00 0.00 C ATOM 515 O GLU A 32 26.944 24.559 36.734 1.00 0.00 O ATOM 516 CB GLU A 32 24.549 26.550 37.963 1.00 0.00 C ATOM 517 CG GLU A 32 24.275 28.056 37.881 1.00 0.00 C ATOM 518 CD GLU A 32 25.573 28.855 37.731 1.00 0.00 C ATOM 519 OE1 GLU A 32 26.047 29.067 36.590 1.00 0.00 O ATOM 520 OE2 GLU A 32 26.156 29.258 38.762 1.00 0.00 O ATOM 0 H GLU A 32 22.965 26.162 36.215 1.00 0.00 H new ATOM 0 HA GLU A 32 25.716 26.581 36.116 1.00 0.00 H new ATOM 0 HB2 GLU A 32 23.647 26.042 38.303 1.00 0.00 H new ATOM 0 HB3 GLU A 32 25.319 26.368 38.713 1.00 0.00 H new ATOM 0 HG2 GLU A 32 23.620 28.262 37.035 1.00 0.00 H new ATOM 0 HG3 GLU A 32 23.748 28.381 38.778 1.00 0.00 H new ATOM 527 N ASP A 33 25.011 23.533 37.190 1.00 0.00 N ATOM 528 CA ASP A 33 25.637 22.219 37.396 1.00 0.00 C ATOM 529 C ASP A 33 26.270 21.632 36.121 1.00 0.00 C ATOM 530 O ASP A 33 27.360 21.059 36.183 1.00 0.00 O ATOM 531 CB ASP A 33 24.615 21.249 38.002 1.00 0.00 C ATOM 532 CG ASP A 33 25.287 20.018 38.591 1.00 0.00 C ATOM 533 OD1 ASP A 33 26.105 20.177 39.527 1.00 0.00 O ATOM 534 OD2 ASP A 33 24.984 18.879 38.178 1.00 0.00 O ATOM 0 H ASP A 33 23.999 23.540 37.321 1.00 0.00 H new ATOM 0 HA ASP A 33 26.464 22.364 38.092 1.00 0.00 H new ATOM 0 HB2 ASP A 33 24.045 21.759 38.779 1.00 0.00 H new ATOM 0 HB3 ASP A 33 23.904 20.943 37.234 1.00 0.00 H new ATOM 539 N LEU A 34 25.634 21.809 34.955 1.00 0.00 N ATOM 540 CA LEU A 34 26.231 21.471 33.661 1.00 0.00 C ATOM 541 C LEU A 34 27.434 22.367 33.352 1.00 0.00 C ATOM 542 O LEU A 34 28.488 21.866 32.963 1.00 0.00 O ATOM 543 CB LEU A 34 25.163 21.601 32.558 1.00 0.00 C ATOM 544 CG LEU A 34 24.125 20.466 32.561 1.00 0.00 C ATOM 545 CD1 LEU A 34 22.941 20.854 31.672 1.00 0.00 C ATOM 546 CD2 LEU A 34 24.725 19.158 32.033 1.00 0.00 C ATOM 0 H LEU A 34 24.691 22.191 34.885 1.00 0.00 H new ATOM 0 HA LEU A 34 26.591 20.443 33.700 1.00 0.00 H new ATOM 0 HB2 LEU A 34 24.646 22.553 32.676 1.00 0.00 H new ATOM 0 HB3 LEU A 34 25.658 21.625 31.587 1.00 0.00 H new ATOM 0 HG LEU A 34 23.800 20.313 33.590 1.00 0.00 H new ATOM 0 HD11 LEU A 34 22.205 20.050 31.674 1.00 0.00 H new ATOM 0 HD12 LEU A 34 22.483 21.766 32.054 1.00 0.00 H new ATOM 0 HD13 LEU A 34 23.291 21.023 30.654 1.00 0.00 H new ATOM 0 HD21 LEU A 34 23.965 18.377 32.049 1.00 0.00 H new ATOM 0 HD22 LEU A 34 25.074 19.304 31.011 1.00 0.00 H new ATOM 0 HD23 LEU A 34 25.563 18.861 32.664 1.00 0.00 H new ATOM 558 N ALA A 35 27.289 23.678 33.541 1.00 0.00 N ATOM 559 CA ALA A 35 28.332 24.670 33.316 1.00 0.00 C ATOM 560 C ALA A 35 29.602 24.362 34.125 1.00 0.00 C ATOM 561 O ALA A 35 30.701 24.316 33.564 1.00 0.00 O ATOM 562 CB ALA A 35 27.768 26.064 33.628 1.00 0.00 C ATOM 0 H ALA A 35 26.413 24.089 33.865 1.00 0.00 H new ATOM 0 HA ALA A 35 28.636 24.639 32.270 1.00 0.00 H new ATOM 0 HB1 ALA A 35 28.541 26.815 33.463 1.00 0.00 H new ATOM 0 HB2 ALA A 35 26.919 26.268 32.975 1.00 0.00 H new ATOM 0 HB3 ALA A 35 27.443 26.101 34.668 1.00 0.00 H new ATOM 568 N GLN A 36 29.424 24.070 35.419 1.00 0.00 N ATOM 569 CA GLN A 36 30.445 23.497 36.299 1.00 0.00 C ATOM 570 C GLN A 36 31.066 22.223 35.692 1.00 0.00 C ATOM 571 O GLN A 36 32.235 22.216 35.308 1.00 0.00 O ATOM 572 CB GLN A 36 29.798 23.233 37.674 1.00 0.00 C ATOM 573 CG GLN A 36 30.753 22.674 38.740 1.00 0.00 C ATOM 574 CD GLN A 36 31.550 23.772 39.430 1.00 0.00 C ATOM 575 OE1 GLN A 36 32.565 24.245 38.956 1.00 0.00 O ATOM 576 NE2 GLN A 36 31.128 24.222 40.590 1.00 0.00 N ATOM 0 H GLN A 36 28.537 24.232 35.896 1.00 0.00 H new ATOM 0 HA GLN A 36 31.271 24.198 36.418 1.00 0.00 H new ATOM 0 HB2 GLN A 36 29.370 24.165 38.043 1.00 0.00 H new ATOM 0 HB3 GLN A 36 28.973 22.533 37.543 1.00 0.00 H new ATOM 0 HG2 GLN A 36 30.180 22.121 39.484 1.00 0.00 H new ATOM 0 HG3 GLN A 36 31.440 21.966 38.275 1.00 0.00 H new ATOM 0 HE21 GLN A 36 30.279 23.840 41.007 1.00 0.00 H new ATOM 0 HE22 GLN A 36 31.649 24.953 41.074 1.00 0.00 H new ATOM 585 N LYS A 37 30.305 21.122 35.607 1.00 0.00 N ATOM 586 CA LYS A 37 30.837 19.777 35.318 1.00 0.00 C ATOM 587 C LYS A 37 31.415 19.606 33.910 1.00 0.00 C ATOM 588 O LYS A 37 32.211 18.686 33.702 1.00 0.00 O ATOM 589 CB LYS A 37 29.742 18.742 35.623 1.00 0.00 C ATOM 590 CG LYS A 37 29.624 18.552 37.143 1.00 0.00 C ATOM 591 CD LYS A 37 28.327 17.857 37.564 1.00 0.00 C ATOM 592 CE LYS A 37 28.388 17.657 39.081 1.00 0.00 C ATOM 593 NZ LYS A 37 27.047 17.605 39.701 1.00 0.00 N ATOM 0 H LYS A 37 29.294 21.138 35.738 1.00 0.00 H new ATOM 0 HA LYS A 37 31.698 19.620 35.968 1.00 0.00 H new ATOM 0 HB2 LYS A 37 28.788 19.074 35.212 1.00 0.00 H new ATOM 0 HB3 LYS A 37 29.981 17.792 35.145 1.00 0.00 H new ATOM 0 HG2 LYS A 37 30.473 17.968 37.497 1.00 0.00 H new ATOM 0 HG3 LYS A 37 29.682 19.525 37.630 1.00 0.00 H new ATOM 0 HD2 LYS A 37 27.462 18.461 37.291 1.00 0.00 H new ATOM 0 HD3 LYS A 37 28.221 16.899 37.054 1.00 0.00 H new ATOM 0 HE2 LYS A 37 28.922 16.733 39.301 1.00 0.00 H new ATOM 0 HE3 LYS A 37 28.960 18.470 39.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 27.074 16.986 40.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 26.760 18.562 39.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 26.361 17.230 39.015 1.00 0.00 H new ATOM 607 N LEU A 38 31.068 20.482 32.968 1.00 0.00 N ATOM 608 CA LEU A 38 31.577 20.493 31.591 1.00 0.00 C ATOM 609 C LEU A 38 32.656 21.570 31.343 1.00 0.00 C ATOM 610 O LEU A 38 33.197 21.635 30.237 1.00 0.00 O ATOM 611 CB LEU A 38 30.388 20.658 30.624 1.00 0.00 C ATOM 612 CG LEU A 38 29.282 19.586 30.732 1.00 0.00 C ATOM 613 CD1 LEU A 38 28.118 19.982 29.830 1.00 0.00 C ATOM 614 CD2 LEU A 38 29.747 18.189 30.322 1.00 0.00 C ATOM 0 H LEU A 38 30.400 21.232 33.146 1.00 0.00 H new ATOM 0 HA LEU A 38 32.078 19.542 31.412 1.00 0.00 H new ATOM 0 HB2 LEU A 38 29.938 21.636 30.795 1.00 0.00 H new ATOM 0 HB3 LEU A 38 30.771 20.657 29.603 1.00 0.00 H new ATOM 0 HG LEU A 38 28.992 19.541 31.782 1.00 0.00 H new ATOM 0 HD11 LEU A 38 27.332 19.230 29.900 1.00 0.00 H new ATOM 0 HD12 LEU A 38 27.725 20.948 30.146 1.00 0.00 H new ATOM 0 HD13 LEU A 38 28.464 20.051 28.799 1.00 0.00 H new ATOM 0 HD21 LEU A 38 28.920 17.486 30.422 1.00 0.00 H new ATOM 0 HD22 LEU A 38 30.084 18.207 29.286 1.00 0.00 H new ATOM 0 HD23 LEU A 38 30.569 17.876 30.965 1.00 0.00 H new ATOM 626 N ASN A 39 32.976 22.404 32.344 1.00 0.00 N ATOM 627 CA ASN A 39 33.805 23.617 32.260 1.00 0.00 C ATOM 628 C ASN A 39 33.426 24.506 31.048 1.00 0.00 C ATOM 629 O ASN A 39 34.222 24.762 30.138 1.00 0.00 O ATOM 630 CB ASN A 39 35.298 23.233 32.379 1.00 0.00 C ATOM 631 CG ASN A 39 36.225 24.410 32.656 1.00 0.00 C ATOM 632 OD1 ASN A 39 36.777 24.578 33.732 1.00 0.00 O ATOM 633 ND2 ASN A 39 36.413 25.299 31.709 1.00 0.00 N ATOM 0 H ASN A 39 32.642 22.239 33.294 1.00 0.00 H new ATOM 0 HA ASN A 39 33.599 24.270 33.108 1.00 0.00 H new ATOM 0 HB2 ASN A 39 35.411 22.500 33.178 1.00 0.00 H new ATOM 0 HB3 ASN A 39 35.612 22.748 31.455 1.00 0.00 H new ATOM 0 HD21 ASN A 39 37.010 26.108 31.880 1.00 0.00 H new ATOM 0 HD22 ASN A 39 35.963 25.181 30.802 1.00 0.00 H new ATOM 640 N LEU A 40 32.184 24.994 31.050 1.00 0.00 N ATOM 641 CA LEU A 40 31.587 25.872 30.037 1.00 0.00 C ATOM 642 C LEU A 40 30.647 26.852 30.722 1.00 0.00 C ATOM 643 O LEU A 40 29.637 26.428 31.265 1.00 0.00 O ATOM 644 CB LEU A 40 30.749 25.042 29.054 1.00 0.00 C ATOM 645 CG LEU A 40 31.536 24.178 28.074 1.00 0.00 C ATOM 646 CD1 LEU A 40 30.570 23.286 27.311 1.00 0.00 C ATOM 647 CD2 LEU A 40 32.333 25.018 27.074 1.00 0.00 C ATOM 0 H LEU A 40 31.529 24.776 31.801 1.00 0.00 H new ATOM 0 HA LEU A 40 32.385 26.394 29.509 1.00 0.00 H new ATOM 0 HB2 LEU A 40 30.086 24.395 29.628 1.00 0.00 H new ATOM 0 HB3 LEU A 40 30.116 25.721 28.483 1.00 0.00 H new ATOM 0 HG LEU A 40 32.245 23.584 28.651 1.00 0.00 H new ATOM 0 HD11 LEU A 40 31.126 22.665 26.608 1.00 0.00 H new ATOM 0 HD12 LEU A 40 30.033 22.648 28.012 1.00 0.00 H new ATOM 0 HD13 LEU A 40 29.858 23.904 26.764 1.00 0.00 H new ATOM 0 HD21 LEU A 40 32.877 24.359 26.397 1.00 0.00 H new ATOM 0 HD22 LEU A 40 31.651 25.645 26.500 1.00 0.00 H new ATOM 0 HD23 LEU A 40 33.040 25.650 27.612 1.00 0.00 H new ATOM 659 N GLU A 41 30.938 28.145 30.714 1.00 0.00 N ATOM 660 CA GLU A 41 30.125 29.094 31.471 1.00 0.00 C ATOM 661 C GLU A 41 28.646 29.122 31.024 1.00 0.00 C ATOM 662 O GLU A 41 28.309 28.886 29.855 1.00 0.00 O ATOM 663 CB GLU A 41 30.780 30.482 31.463 1.00 0.00 C ATOM 664 CG GLU A 41 30.974 31.105 30.073 1.00 0.00 C ATOM 665 CD GLU A 41 32.284 30.765 29.350 1.00 0.00 C ATOM 666 OE1 GLU A 41 32.947 29.750 29.656 1.00 0.00 O ATOM 667 OE2 GLU A 41 32.632 31.497 28.392 1.00 0.00 O ATOM 0 H GLU A 41 31.717 28.559 30.202 1.00 0.00 H new ATOM 0 HA GLU A 41 30.092 28.747 32.504 1.00 0.00 H new ATOM 0 HB2 GLU A 41 30.171 31.157 32.064 1.00 0.00 H new ATOM 0 HB3 GLU A 41 31.752 30.410 31.950 1.00 0.00 H new ATOM 0 HG2 GLU A 41 30.143 30.793 29.440 1.00 0.00 H new ATOM 0 HG3 GLU A 41 30.910 32.189 30.172 1.00 0.00 H new ATOM 674 N LEU A 42 27.758 29.446 31.975 1.00 0.00 N ATOM 675 CA LEU A 42 26.303 29.363 31.819 1.00 0.00 C ATOM 676 C LEU A 42 25.776 30.099 30.582 1.00 0.00 C ATOM 677 O LEU A 42 24.850 29.611 29.956 1.00 0.00 O ATOM 678 CB LEU A 42 25.635 29.818 33.133 1.00 0.00 C ATOM 679 CG LEU A 42 24.090 29.817 33.095 1.00 0.00 C ATOM 680 CD1 LEU A 42 23.510 29.426 34.449 1.00 0.00 C ATOM 681 CD2 LEU A 42 23.521 31.198 32.751 1.00 0.00 C ATOM 0 H LEU A 42 28.041 29.781 32.896 1.00 0.00 H new ATOM 0 HA LEU A 42 26.033 28.324 31.630 1.00 0.00 H new ATOM 0 HB2 LEU A 42 25.967 29.166 33.941 1.00 0.00 H new ATOM 0 HB3 LEU A 42 25.980 30.824 33.373 1.00 0.00 H new ATOM 0 HG LEU A 42 23.813 29.096 32.326 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.421 29.433 34.394 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.853 28.427 34.717 1.00 0.00 H new ATOM 0 HD13 LEU A 42 23.840 30.138 35.205 1.00 0.00 H new ATOM 0 HD21 LEU A 42 22.432 31.149 32.736 1.00 0.00 H new ATOM 0 HD22 LEU A 42 23.841 31.921 33.501 1.00 0.00 H new ATOM 0 HD23 LEU A 42 23.884 31.507 31.771 1.00 0.00 H new ATOM 693 N ASP A 43 26.389 31.213 30.176 1.00 0.00 N ATOM 694 CA ASP A 43 26.112 31.940 28.926 1.00 0.00 C ATOM 695 C ASP A 43 26.255 31.035 27.686 1.00 0.00 C ATOM 696 O ASP A 43 25.335 30.941 26.875 1.00 0.00 O ATOM 697 CB ASP A 43 27.089 33.139 28.903 1.00 0.00 C ATOM 698 CG ASP A 43 26.811 34.252 27.884 1.00 0.00 C ATOM 699 OD1 ASP A 43 26.474 33.984 26.717 1.00 0.00 O ATOM 700 OD2 ASP A 43 26.980 35.436 28.263 1.00 0.00 O ATOM 0 H ASP A 43 27.123 31.655 30.729 1.00 0.00 H new ATOM 0 HA ASP A 43 25.079 32.286 28.892 1.00 0.00 H new ATOM 0 HB2 ASP A 43 27.098 33.586 29.897 1.00 0.00 H new ATOM 0 HB3 ASP A 43 28.092 32.754 28.717 1.00 0.00 H new ATOM 705 N ARG A 44 27.356 30.277 27.558 1.00 0.00 N ATOM 706 CA ARG A 44 27.526 29.314 26.456 1.00 0.00 C ATOM 707 C ARG A 44 26.476 28.212 26.504 1.00 0.00 C ATOM 708 O ARG A 44 25.941 27.868 25.452 1.00 0.00 O ATOM 709 CB ARG A 44 28.900 28.624 26.496 1.00 0.00 C ATOM 710 CG ARG A 44 30.119 29.539 26.356 1.00 0.00 C ATOM 711 CD ARG A 44 31.378 28.661 26.375 1.00 0.00 C ATOM 712 NE ARG A 44 32.592 29.465 26.543 1.00 0.00 N ATOM 713 CZ ARG A 44 33.824 29.030 26.709 1.00 0.00 C ATOM 714 NH1 ARG A 44 34.169 27.802 26.456 1.00 0.00 N ATOM 715 NH2 ARG A 44 34.723 29.845 27.157 1.00 0.00 N ATOM 0 H ARG A 44 28.144 30.312 28.205 1.00 0.00 H new ATOM 0 HA ARG A 44 27.426 29.902 25.543 1.00 0.00 H new ATOM 0 HB2 ARG A 44 28.984 28.082 27.438 1.00 0.00 H new ATOM 0 HB3 ARG A 44 28.935 27.882 25.698 1.00 0.00 H new ATOM 0 HG2 ARG A 44 30.064 30.106 25.427 1.00 0.00 H new ATOM 0 HG3 ARG A 44 30.147 30.263 27.170 1.00 0.00 H new ATOM 0 HD2 ARG A 44 31.305 27.937 27.186 1.00 0.00 H new ATOM 0 HD3 ARG A 44 31.441 28.094 25.446 1.00 0.00 H new ATOM 0 HE ARG A 44 32.469 30.477 26.530 1.00 0.00 H new ATOM 0 HH11 ARG A 44 33.474 27.137 26.116 1.00 0.00 H new ATOM 0 HH12 ARG A 44 35.134 27.504 26.598 1.00 0.00 H new ATOM 0 HH21 ARG A 44 34.473 30.809 27.376 1.00 0.00 H new ATOM 0 HH22 ARG A 44 35.682 29.523 27.291 1.00 0.00 H new ATOM 729 N ILE A 45 26.202 27.639 27.679 1.00 0.00 N ATOM 730 CA ILE A 45 25.175 26.585 27.807 1.00 0.00 C ATOM 731 C ILE A 45 23.764 27.134 27.551 1.00 0.00 C ATOM 732 O ILE A 45 22.979 26.473 26.879 1.00 0.00 O ATOM 733 CB ILE A 45 25.304 25.828 29.149 1.00 0.00 C ATOM 734 CG1 ILE A 45 26.730 25.316 29.454 1.00 0.00 C ATOM 735 CG2 ILE A 45 24.353 24.622 29.156 1.00 0.00 C ATOM 736 CD1 ILE A 45 27.283 24.329 28.416 1.00 0.00 C ATOM 0 H ILE A 45 26.669 27.880 28.553 1.00 0.00 H new ATOM 0 HA ILE A 45 25.353 25.846 27.026 1.00 0.00 H new ATOM 0 HB ILE A 45 25.049 26.554 29.921 1.00 0.00 H new ATOM 0 HG12 ILE A 45 27.404 26.170 29.520 1.00 0.00 H new ATOM 0 HG13 ILE A 45 26.729 24.834 30.432 1.00 0.00 H new ATOM 0 HG21 ILE A 45 24.446 24.091 30.103 1.00 0.00 H new ATOM 0 HG22 ILE A 45 23.326 24.967 29.033 1.00 0.00 H new ATOM 0 HG23 ILE A 45 24.610 23.951 28.337 1.00 0.00 H new ATOM 0 HD11 ILE A 45 28.287 24.020 28.706 1.00 0.00 H new ATOM 0 HD12 ILE A 45 26.635 23.454 28.364 1.00 0.00 H new ATOM 0 HD13 ILE A 45 27.320 24.811 27.439 1.00 0.00 H new ATOM 748 N GLN A 46 23.467 28.371 27.942 1.00 0.00 N ATOM 749 CA GLN A 46 22.260 29.106 27.569 1.00 0.00 C ATOM 750 C GLN A 46 22.130 29.233 26.046 1.00 0.00 C ATOM 751 O GLN A 46 21.158 28.733 25.482 1.00 0.00 O ATOM 752 CB GLN A 46 22.267 30.475 28.282 1.00 0.00 C ATOM 753 CG GLN A 46 21.620 30.407 29.673 1.00 0.00 C ATOM 754 CD GLN A 46 20.094 30.449 29.613 1.00 0.00 C ATOM 755 OE1 GLN A 46 19.431 29.599 29.036 1.00 0.00 O ATOM 756 NE2 GLN A 46 19.474 31.447 30.201 1.00 0.00 N ATOM 0 H GLN A 46 24.084 28.910 28.550 1.00 0.00 H new ATOM 0 HA GLN A 46 21.378 28.554 27.895 1.00 0.00 H new ATOM 0 HB2 GLN A 46 23.294 30.828 28.378 1.00 0.00 H new ATOM 0 HB3 GLN A 46 21.735 31.204 27.671 1.00 0.00 H new ATOM 0 HG2 GLN A 46 21.935 29.491 30.172 1.00 0.00 H new ATOM 0 HG3 GLN A 46 21.979 31.239 30.278 1.00 0.00 H new ATOM 0 HE21 GLN A 46 20.011 32.165 30.687 1.00 0.00 H new ATOM 0 HE22 GLN A 46 18.456 31.503 30.171 1.00 0.00 H new ATOM 765 N ILE A 47 23.110 29.820 25.349 1.00 0.00 N ATOM 766 CA ILE A 47 23.107 29.914 23.876 1.00 0.00 C ATOM 767 C ILE A 47 23.078 28.525 23.220 1.00 0.00 C ATOM 768 O ILE A 47 22.444 28.361 22.176 1.00 0.00 O ATOM 769 CB ILE A 47 24.266 30.823 23.386 1.00 0.00 C ATOM 770 CG1 ILE A 47 23.878 32.319 23.490 1.00 0.00 C ATOM 771 CG2 ILE A 47 24.659 30.605 21.911 1.00 0.00 C ATOM 772 CD1 ILE A 47 23.898 32.889 24.906 1.00 0.00 C ATOM 0 H ILE A 47 23.929 30.244 25.785 1.00 0.00 H new ATOM 0 HA ILE A 47 22.185 30.397 23.553 1.00 0.00 H new ATOM 0 HB ILE A 47 25.102 30.554 24.032 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.560 32.901 22.870 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.879 32.450 23.075 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.475 31.278 21.649 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.980 29.573 21.769 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.800 30.809 21.272 1.00 0.00 H new ATOM 0 HD11 ILE A 47 23.613 33.941 24.879 1.00 0.00 H new ATOM 0 HD12 ILE A 47 23.194 32.338 25.530 1.00 0.00 H new ATOM 0 HD13 ILE A 47 24.901 32.796 25.322 1.00 0.00 H new ATOM 784 N TRP A 48 23.677 27.495 23.815 1.00 0.00 N ATOM 785 CA TRP A 48 23.522 26.120 23.342 1.00 0.00 C ATOM 786 C TRP A 48 22.062 25.631 23.440 1.00 0.00 C ATOM 787 O TRP A 48 21.481 25.267 22.417 1.00 0.00 O ATOM 788 CB TRP A 48 24.517 25.197 24.055 1.00 0.00 C ATOM 789 CG TRP A 48 24.421 23.790 23.578 1.00 0.00 C ATOM 790 CD1 TRP A 48 25.105 23.259 22.540 1.00 0.00 C ATOM 791 CD2 TRP A 48 23.481 22.771 24.021 1.00 0.00 C ATOM 792 NE1 TRP A 48 24.631 21.981 22.303 1.00 0.00 N ATOM 793 CE2 TRP A 48 23.602 21.651 23.155 1.00 0.00 C ATOM 794 CE3 TRP A 48 22.499 22.706 25.030 1.00 0.00 C ATOM 795 CZ2 TRP A 48 22.748 20.549 23.248 1.00 0.00 C ATOM 796 CZ3 TRP A 48 21.603 21.625 25.104 1.00 0.00 C ATOM 797 CH2 TRP A 48 21.712 20.560 24.196 1.00 0.00 C ATOM 0 H TRP A 48 24.279 27.588 24.633 1.00 0.00 H new ATOM 0 HA TRP A 48 23.761 26.093 22.279 1.00 0.00 H new ATOM 0 HB2 TRP A 48 25.530 25.565 23.894 1.00 0.00 H new ATOM 0 HB3 TRP A 48 24.333 25.228 25.129 1.00 0.00 H new ATOM 0 HD1 TRP A 48 25.891 23.751 21.987 1.00 0.00 H new ATOM 0 HE1 TRP A 48 25.000 21.359 21.584 1.00 0.00 H new ATOM 0 HE3 TRP A 48 22.434 23.500 25.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 22.883 19.698 22.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 20.831 21.614 25.859 1.00 0.00 H new ATOM 0 HH2 TRP A 48 20.999 19.749 24.226 1.00 0.00 H new ATOM 808 N PHE A 49 21.440 25.675 24.628 1.00 0.00 N ATOM 809 CA PHE A 49 20.031 25.270 24.827 1.00 0.00 C ATOM 810 C PHE A 49 19.069 26.088 23.952 1.00 0.00 C ATOM 811 O PHE A 49 18.176 25.531 23.309 1.00 0.00 O ATOM 812 CB PHE A 49 19.624 25.410 26.309 1.00 0.00 C ATOM 813 CG PHE A 49 19.781 24.159 27.157 1.00 0.00 C ATOM 814 CD1 PHE A 49 18.722 23.235 27.256 1.00 0.00 C ATOM 815 CD2 PHE A 49 20.954 23.936 27.897 1.00 0.00 C ATOM 816 CE1 PHE A 49 18.851 22.088 28.064 1.00 0.00 C ATOM 817 CE2 PHE A 49 21.092 22.789 28.698 1.00 0.00 C ATOM 818 CZ PHE A 49 20.041 21.861 28.779 1.00 0.00 C ATOM 0 H PHE A 49 21.897 25.993 25.483 1.00 0.00 H new ATOM 0 HA PHE A 49 19.958 24.224 24.528 1.00 0.00 H new ATOM 0 HB2 PHE A 49 20.219 26.207 26.756 1.00 0.00 H new ATOM 0 HB3 PHE A 49 18.582 25.727 26.352 1.00 0.00 H new ATOM 0 HD1 PHE A 49 17.806 23.407 26.710 1.00 0.00 H new ATOM 0 HD2 PHE A 49 21.759 24.654 27.850 1.00 0.00 H new ATOM 0 HE1 PHE A 49 18.036 21.383 28.134 1.00 0.00 H new ATOM 0 HE2 PHE A 49 22.005 22.622 29.250 1.00 0.00 H new ATOM 0 HZ PHE A 49 20.146 20.976 29.388 1.00 0.00 H new ATOM 828 N GLN A 50 19.278 27.403 23.849 1.00 0.00 N ATOM 829 CA GLN A 50 18.574 28.301 22.930 1.00 0.00 C ATOM 830 C GLN A 50 18.668 27.795 21.485 1.00 0.00 C ATOM 831 O GLN A 50 17.645 27.513 20.865 1.00 0.00 O ATOM 832 CB GLN A 50 19.139 29.724 23.065 1.00 0.00 C ATOM 833 CG GLN A 50 18.733 30.419 24.378 1.00 0.00 C ATOM 834 CD GLN A 50 17.294 30.913 24.350 1.00 0.00 C ATOM 835 OE1 GLN A 50 16.855 31.539 23.399 1.00 0.00 O ATOM 836 NE2 GLN A 50 16.516 30.667 25.377 1.00 0.00 N ATOM 0 H GLN A 50 19.967 27.889 24.424 1.00 0.00 H new ATOM 0 HA GLN A 50 17.517 28.321 23.194 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.227 29.683 23.005 1.00 0.00 H new ATOM 0 HB3 GLN A 50 18.796 30.325 22.223 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.860 29.724 25.208 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.400 31.261 24.562 1.00 0.00 H new ATOM 0 HE21 GLN A 50 16.876 30.144 26.176 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.551 30.998 25.377 1.00 0.00 H new ATOM 845 N ASN A 51 19.873 27.562 20.950 1.00 0.00 N ATOM 846 CA ASN A 51 20.049 27.003 19.602 1.00 0.00 C ATOM 847 C ASN A 51 19.729 25.492 19.479 1.00 0.00 C ATOM 848 O ASN A 51 19.995 24.864 18.449 1.00 0.00 O ATOM 849 CB ASN A 51 21.464 27.343 19.105 1.00 0.00 C ATOM 850 CG ASN A 51 21.645 28.832 18.867 1.00 0.00 C ATOM 851 OD1 ASN A 51 21.055 29.426 17.981 1.00 0.00 O ATOM 852 ND2 ASN A 51 22.449 29.486 19.665 1.00 0.00 N ATOM 0 H ASN A 51 20.749 27.754 21.435 1.00 0.00 H new ATOM 0 HA ASN A 51 19.305 27.471 18.957 1.00 0.00 H new ATOM 0 HB2 ASN A 51 22.196 27.002 19.837 1.00 0.00 H new ATOM 0 HB3 ASN A 51 21.662 26.802 18.180 1.00 0.00 H new ATOM 0 HD21 ASN A 51 22.581 30.490 19.545 1.00 0.00 H new ATOM 0 HD22 ASN A 51 22.944 28.992 20.407 1.00 0.00 H new ATOM 859 N ARG A 52 19.124 24.886 20.505 1.00 0.00 N ATOM 860 CA ARG A 52 18.371 23.622 20.457 1.00 0.00 C ATOM 861 C ARG A 52 16.876 23.905 20.352 1.00 0.00 C ATOM 862 O ARG A 52 16.253 23.580 19.344 1.00 0.00 O ATOM 863 CB ARG A 52 18.722 22.772 21.699 1.00 0.00 C ATOM 864 CG ARG A 52 19.551 21.521 21.400 1.00 0.00 C ATOM 865 CD ARG A 52 20.979 21.794 20.913 1.00 0.00 C ATOM 866 NE ARG A 52 21.044 22.352 19.552 1.00 0.00 N ATOM 867 CZ ARG A 52 21.549 21.807 18.465 1.00 0.00 C ATOM 868 NH1 ARG A 52 21.953 20.573 18.367 1.00 0.00 N ATOM 869 NH2 ARG A 52 21.677 22.546 17.404 1.00 0.00 N ATOM 0 H ARG A 52 19.146 25.283 21.444 1.00 0.00 H new ATOM 0 HA ARG A 52 18.650 23.052 19.571 1.00 0.00 H new ATOM 0 HB2 ARG A 52 19.270 23.395 22.406 1.00 0.00 H new ATOM 0 HB3 ARG A 52 17.797 22.470 22.190 1.00 0.00 H new ATOM 0 HG2 ARG A 52 19.601 20.912 22.302 1.00 0.00 H new ATOM 0 HG3 ARG A 52 19.032 20.931 20.645 1.00 0.00 H new ATOM 0 HD2 ARG A 52 21.463 22.485 21.603 1.00 0.00 H new ATOM 0 HD3 ARG A 52 21.547 20.864 20.942 1.00 0.00 H new ATOM 0 HE ARG A 52 20.645 23.284 19.436 1.00 0.00 H new ATOM 0 HH11 ARG A 52 21.889 19.950 19.172 1.00 0.00 H new ATOM 0 HH12 ARG A 52 22.333 20.229 17.485 1.00 0.00 H new ATOM 0 HH21 ARG A 52 21.389 23.524 17.426 1.00 0.00 H new ATOM 0 HH22 ARG A 52 22.065 22.148 16.549 1.00 0.00 H new ATOM 883 N ARG A 53 16.302 24.584 21.342 1.00 0.00 N ATOM 884 CA ARG A 53 14.872 24.918 21.416 1.00 0.00 C ATOM 885 C ARG A 53 14.392 25.744 20.213 1.00 0.00 C ATOM 886 O ARG A 53 13.395 25.374 19.589 1.00 0.00 O ATOM 887 CB ARG A 53 14.620 25.577 22.788 1.00 0.00 C ATOM 888 CG ARG A 53 13.250 25.280 23.415 1.00 0.00 C ATOM 889 CD ARG A 53 12.117 26.163 22.876 1.00 0.00 C ATOM 890 NE ARG A 53 11.474 25.597 21.678 1.00 0.00 N ATOM 891 CZ ARG A 53 10.307 24.986 21.616 1.00 0.00 C ATOM 892 NH1 ARG A 53 9.466 24.962 22.609 1.00 0.00 N ATOM 893 NH2 ARG A 53 9.977 24.361 20.526 1.00 0.00 N ATOM 0 H ARG A 53 16.831 24.930 22.142 1.00 0.00 H new ATOM 0 HA ARG A 53 14.264 24.016 21.348 1.00 0.00 H new ATOM 0 HB2 ARG A 53 15.397 25.249 23.479 1.00 0.00 H new ATOM 0 HB3 ARG A 53 14.726 26.656 22.679 1.00 0.00 H new ATOM 0 HG2 ARG A 53 12.999 24.234 23.237 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.319 25.412 24.495 1.00 0.00 H new ATOM 0 HD2 ARG A 53 11.367 26.300 23.655 1.00 0.00 H new ATOM 0 HD3 ARG A 53 12.513 27.150 22.638 1.00 0.00 H new ATOM 0 HE ARG A 53 11.987 25.687 20.801 1.00 0.00 H new ATOM 0 HH11 ARG A 53 9.698 25.430 23.485 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.575 24.475 22.511 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.617 24.347 19.732 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.078 23.884 20.464 1.00 0.00 H new ATOM 907 N ALA A 54 15.141 26.773 19.807 1.00 0.00 N ATOM 908 CA ALA A 54 14.843 27.563 18.610 1.00 0.00 C ATOM 909 C ALA A 54 15.073 26.772 17.306 1.00 0.00 C ATOM 910 O ALA A 54 14.399 27.020 16.305 1.00 0.00 O ATOM 911 CB ALA A 54 15.695 28.838 18.634 1.00 0.00 C ATOM 0 H ALA A 54 15.977 27.083 20.303 1.00 0.00 H new ATOM 0 HA ALA A 54 13.784 27.821 18.625 1.00 0.00 H new ATOM 0 HB1 ALA A 54 15.482 29.435 17.747 1.00 0.00 H new ATOM 0 HB2 ALA A 54 15.458 29.417 19.527 1.00 0.00 H new ATOM 0 HB3 ALA A 54 16.751 28.570 18.645 1.00 0.00 H new ATOM 917 N LYS A 55 15.982 25.780 17.306 1.00 0.00 N ATOM 918 CA LYS A 55 16.155 24.873 16.165 1.00 0.00 C ATOM 919 C LYS A 55 14.911 24.011 15.960 1.00 0.00 C ATOM 920 O LYS A 55 14.351 24.039 14.870 1.00 0.00 O ATOM 921 CB LYS A 55 17.450 24.052 16.285 1.00 0.00 C ATOM 922 CG LYS A 55 17.703 23.256 14.996 1.00 0.00 C ATOM 923 CD LYS A 55 19.117 22.669 14.944 1.00 0.00 C ATOM 924 CE LYS A 55 19.332 22.081 13.548 1.00 0.00 C ATOM 925 NZ LYS A 55 20.760 21.880 13.220 1.00 0.00 N ATOM 0 H LYS A 55 16.608 25.589 18.088 1.00 0.00 H new ATOM 0 HA LYS A 55 16.268 25.474 15.263 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.292 24.716 16.481 1.00 0.00 H new ATOM 0 HB3 LYS A 55 17.378 23.370 17.132 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.974 22.449 14.921 1.00 0.00 H new ATOM 0 HG3 LYS A 55 17.550 23.906 14.134 1.00 0.00 H new ATOM 0 HD2 LYS A 55 19.858 23.441 15.151 1.00 0.00 H new ATOM 0 HD3 LYS A 55 19.238 21.898 15.705 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.811 21.126 13.478 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.884 22.744 12.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.844 21.480 12.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 21.257 22.793 13.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 21.185 21.225 13.907 1.00 0.00 H new ATOM 939 N LEU A 56 14.418 23.327 16.998 1.00 0.00 N ATOM 940 CA LEU A 56 13.203 22.501 16.899 1.00 0.00 C ATOM 941 C LEU A 56 11.951 23.302 16.482 1.00 0.00 C ATOM 942 O LEU A 56 11.061 22.743 15.845 1.00 0.00 O ATOM 943 CB LEU A 56 12.965 21.736 18.217 1.00 0.00 C ATOM 944 CG LEU A 56 13.648 20.355 18.256 1.00 0.00 C ATOM 945 CD1 LEU A 56 15.175 20.442 18.303 1.00 0.00 C ATOM 946 CD2 LEU A 56 13.173 19.590 19.493 1.00 0.00 C ATOM 0 H LEU A 56 14.844 23.328 17.925 1.00 0.00 H new ATOM 0 HA LEU A 56 13.375 21.783 16.097 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.331 22.338 19.049 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.893 21.607 18.365 1.00 0.00 H new ATOM 0 HG LEU A 56 13.371 19.842 17.335 1.00 0.00 H new ATOM 0 HD11 LEU A 56 15.596 19.437 18.329 1.00 0.00 H new ATOM 0 HD12 LEU A 56 15.537 20.964 17.417 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.481 20.987 19.196 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.654 18.613 19.523 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.434 20.151 20.390 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.092 19.461 19.448 1.00 0.00 H new ATOM 958 N LYS A 57 11.900 24.612 16.777 1.00 0.00 N ATOM 959 CA LYS A 57 10.893 25.540 16.231 1.00 0.00 C ATOM 960 C LYS A 57 10.967 25.616 14.698 1.00 0.00 C ATOM 961 O LYS A 57 10.003 25.278 14.020 1.00 0.00 O ATOM 962 CB LYS A 57 11.062 26.932 16.871 1.00 0.00 C ATOM 963 CG LYS A 57 9.858 27.864 16.642 1.00 0.00 C ATOM 964 CD LYS A 57 10.309 29.336 16.593 1.00 0.00 C ATOM 965 CE LYS A 57 9.219 30.327 17.013 1.00 0.00 C ATOM 966 NZ LYS A 57 8.973 30.261 18.475 1.00 0.00 N ATOM 0 H LYS A 57 12.563 25.062 17.408 1.00 0.00 H new ATOM 0 HA LYS A 57 9.903 25.159 16.481 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.221 26.813 17.943 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.958 27.403 16.466 1.00 0.00 H new ATOM 0 HG2 LYS A 57 9.360 27.600 15.709 1.00 0.00 H new ATOM 0 HG3 LYS A 57 9.130 27.728 17.442 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.174 29.464 17.243 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.634 29.574 15.580 1.00 0.00 H new ATOM 0 HE2 LYS A 57 9.516 31.338 16.736 1.00 0.00 H new ATOM 0 HE3 LYS A 57 8.297 30.108 16.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 8.387 31.070 18.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.478 29.375 18.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 9.881 30.291 18.982 1.00 0.00 H new ATOM 980 N ARG A 58 12.105 26.061 14.141 1.00 0.00 N ATOM 981 CA ARG A 58 12.287 26.301 12.690 1.00 0.00 C ATOM 982 C ARG A 58 12.541 25.036 11.846 1.00 0.00 C ATOM 983 O ARG A 58 12.469 25.102 10.622 1.00 0.00 O ATOM 984 CB ARG A 58 13.409 27.335 12.468 1.00 0.00 C ATOM 985 CG ARG A 58 13.088 28.241 11.267 1.00 0.00 C ATOM 986 CD ARG A 58 14.286 29.078 10.795 1.00 0.00 C ATOM 987 NE ARG A 58 15.243 28.277 10.005 1.00 0.00 N ATOM 988 CZ ARG A 58 15.185 28.003 8.711 1.00 0.00 C ATOM 989 NH1 ARG A 58 14.206 28.400 7.946 1.00 0.00 N ATOM 990 NH2 ARG A 58 16.125 27.304 8.151 1.00 0.00 N ATOM 0 H ARG A 58 12.940 26.269 14.689 1.00 0.00 H new ATOM 0 HA ARG A 58 11.332 26.688 12.333 1.00 0.00 H new ATOM 0 HB2 ARG A 58 13.532 27.942 13.365 1.00 0.00 H new ATOM 0 HB3 ARG A 58 14.355 26.821 12.299 1.00 0.00 H new ATOM 0 HG2 ARG A 58 12.737 27.624 10.440 1.00 0.00 H new ATOM 0 HG3 ARG A 58 12.270 28.910 11.535 1.00 0.00 H new ATOM 0 HD2 ARG A 58 13.930 29.914 10.193 1.00 0.00 H new ATOM 0 HD3 ARG A 58 14.796 29.502 11.660 1.00 0.00 H new ATOM 0 HE ARG A 58 16.038 27.891 10.514 1.00 0.00 H new ATOM 0 HH11 ARG A 58 13.440 28.947 8.340 1.00 0.00 H new ATOM 0 HH12 ARG A 58 14.206 28.164 6.954 1.00 0.00 H new ATOM 0 HH21 ARG A 58 16.909 26.965 8.708 1.00 0.00 H new ATOM 0 HH22 ARG A 58 16.079 27.094 7.154 1.00 0.00 H new ATOM 1004 N SER A 59 12.846 23.903 12.477 1.00 0.00 N ATOM 1005 CA SER A 59 13.046 22.599 11.829 1.00 0.00 C ATOM 1006 C SER A 59 11.745 22.048 11.214 1.00 0.00 C ATOM 1007 O SER A 59 10.651 22.566 11.456 1.00 0.00 O ATOM 1008 CB SER A 59 13.638 21.624 12.851 1.00 0.00 C ATOM 1009 OG SER A 59 14.102 20.446 12.226 1.00 0.00 O ATOM 0 H SER A 59 12.966 23.862 13.489 1.00 0.00 H new ATOM 0 HA SER A 59 13.741 22.724 10.999 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.460 22.105 13.382 1.00 0.00 H new ATOM 0 HB3 SER A 59 12.883 21.370 13.595 1.00 0.00 H new ATOM 0 HG SER A 59 14.391 19.805 12.909 1.00 0.00 H new ATOM 1015 N HIS A 60 11.847 20.982 10.421 1.00 0.00 N ATOM 1016 CA HIS A 60 10.725 20.346 9.727 1.00 0.00 C ATOM 1017 C HIS A 60 10.860 18.818 9.799 1.00 0.00 C ATOM 1018 O HIS A 60 11.949 18.286 9.586 1.00 0.00 O ATOM 1019 CB HIS A 60 10.667 20.872 8.282 1.00 0.00 C ATOM 1020 CG HIS A 60 9.335 20.666 7.603 1.00 0.00 C ATOM 1021 ND1 HIS A 60 9.127 20.060 6.383 1.00 0.00 N ATOM 1022 CD2 HIS A 60 8.125 21.138 8.038 1.00 0.00 C ATOM 1023 CE1 HIS A 60 7.816 20.133 6.103 1.00 0.00 C ATOM 1024 NE2 HIS A 60 7.166 20.805 7.071 1.00 0.00 N ATOM 0 H HIS A 60 12.739 20.522 10.237 1.00 0.00 H new ATOM 0 HA HIS A 60 9.781 20.599 10.210 1.00 0.00 H new ATOM 0 HB2 HIS A 60 10.900 21.937 8.285 1.00 0.00 H new ATOM 0 HB3 HIS A 60 11.442 20.378 7.696 1.00 0.00 H new ATOM 0 HD2 HIS A 60 7.943 21.671 8.960 1.00 0.00 H new ATOM 0 HE1 HIS A 60 7.349 19.712 5.225 1.00 0.00 H new ATOM 0 HE2 HIS A 60 6.171 21.028 7.096 1.00 0.00 H new ATOM 1032 N ARG A 61 9.756 18.131 10.133 1.00 0.00 N ATOM 1033 CA ARG A 61 9.703 16.741 10.626 1.00 0.00 C ATOM 1034 C ARG A 61 10.601 16.533 11.855 1.00 0.00 C ATOM 1035 O ARG A 61 11.785 16.234 11.751 1.00 0.00 O ATOM 1036 CB ARG A 61 9.930 15.734 9.474 1.00 0.00 C ATOM 1037 CG ARG A 61 9.900 14.264 9.937 1.00 0.00 C ATOM 1038 CD ARG A 61 11.307 13.651 10.028 1.00 0.00 C ATOM 1039 NE ARG A 61 11.419 12.672 11.126 1.00 0.00 N ATOM 1040 CZ ARG A 61 12.225 12.701 12.172 1.00 0.00 C ATOM 1041 NH1 ARG A 61 12.947 13.733 12.491 1.00 0.00 N ATOM 1042 NH2 ARG A 61 12.303 11.650 12.925 1.00 0.00 N ATOM 0 H ARG A 61 8.828 18.549 10.064 1.00 0.00 H new ATOM 0 HA ARG A 61 8.697 16.537 10.992 1.00 0.00 H new ATOM 0 HB2 ARG A 61 9.164 15.884 8.713 1.00 0.00 H new ATOM 0 HB3 ARG A 61 10.891 15.940 9.004 1.00 0.00 H new ATOM 0 HG2 ARG A 61 9.416 14.202 10.912 1.00 0.00 H new ATOM 0 HG3 ARG A 61 9.296 13.679 9.243 1.00 0.00 H new ATOM 0 HD2 ARG A 61 11.551 13.165 9.084 1.00 0.00 H new ATOM 0 HD3 ARG A 61 12.039 14.445 10.176 1.00 0.00 H new ATOM 0 HE ARG A 61 10.793 11.869 11.070 1.00 0.00 H new ATOM 0 HH11 ARG A 61 12.909 14.578 11.921 1.00 0.00 H new ATOM 0 HH12 ARG A 61 13.552 13.698 13.311 1.00 0.00 H new ATOM 0 HH21 ARG A 61 11.749 10.823 12.705 1.00 0.00 H new ATOM 0 HH22 ARG A 61 12.919 11.650 13.738 1.00 0.00 H new ATOM 1056 N GLU A 62 10.010 16.672 13.039 1.00 0.00 N ATOM 1057 CA GLU A 62 10.641 16.446 14.352 1.00 0.00 C ATOM 1058 C GLU A 62 9.651 15.668 15.243 1.00 0.00 C ATOM 1059 O GLU A 62 9.045 16.220 16.162 1.00 0.00 O ATOM 1060 CB GLU A 62 11.050 17.787 15.004 1.00 0.00 C ATOM 1061 CG GLU A 62 12.159 18.588 14.295 1.00 0.00 C ATOM 1062 CD GLU A 62 13.589 18.053 14.492 1.00 0.00 C ATOM 1063 OE1 GLU A 62 13.769 16.871 14.859 1.00 0.00 O ATOM 1064 OE2 GLU A 62 14.539 18.849 14.271 1.00 0.00 O ATOM 0 H GLU A 62 9.034 16.958 13.121 1.00 0.00 H new ATOM 0 HA GLU A 62 11.553 15.862 14.229 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.164 18.418 15.071 1.00 0.00 H new ATOM 0 HB3 GLU A 62 11.375 17.585 16.025 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.942 18.610 13.227 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.123 19.618 14.649 1.00 0.00 H new ATOM 1071 N SER A 63 9.391 14.393 14.936 1.00 0.00 N ATOM 1072 CA SER A 63 8.410 13.543 15.642 1.00 0.00 C ATOM 1073 C SER A 63 8.958 12.937 16.947 1.00 0.00 C ATOM 1074 O SER A 63 8.955 11.718 17.175 1.00 0.00 O ATOM 1075 CB SER A 63 7.835 12.496 14.683 1.00 0.00 C ATOM 1076 OG SER A 63 8.841 11.853 13.923 1.00 0.00 O ATOM 0 H SER A 63 9.864 13.907 14.174 1.00 0.00 H new ATOM 0 HA SER A 63 7.589 14.182 15.968 1.00 0.00 H new ATOM 0 HB2 SER A 63 7.281 11.750 15.253 1.00 0.00 H new ATOM 0 HB3 SER A 63 7.124 12.975 14.009 1.00 0.00 H new ATOM 0 HG SER A 63 8.429 11.193 13.327 1.00 0.00 H new ATOM 1082 N GLN A 64 9.440 13.816 17.827 1.00 0.00 N ATOM 1083 CA GLN A 64 9.803 13.525 19.219 1.00 0.00 C ATOM 1084 C GLN A 64 8.564 13.273 20.112 1.00 0.00 C ATOM 1085 O GLN A 64 7.426 13.350 19.647 1.00 0.00 O ATOM 1086 CB GLN A 64 10.742 14.640 19.724 1.00 0.00 C ATOM 1087 CG GLN A 64 10.131 16.053 19.842 1.00 0.00 C ATOM 1088 CD GLN A 64 9.349 16.264 21.133 1.00 0.00 C ATOM 1089 OE1 GLN A 64 8.153 16.494 21.142 1.00 0.00 O ATOM 1090 NE2 GLN A 64 9.995 16.182 22.274 1.00 0.00 N ATOM 0 H GLN A 64 9.596 14.793 17.580 1.00 0.00 H new ATOM 0 HA GLN A 64 10.349 12.583 19.274 1.00 0.00 H new ATOM 0 HB2 GLN A 64 11.121 14.349 20.704 1.00 0.00 H new ATOM 0 HB3 GLN A 64 11.600 14.694 19.053 1.00 0.00 H new ATOM 0 HG2 GLN A 64 10.929 16.793 19.784 1.00 0.00 H new ATOM 0 HG3 GLN A 64 9.471 16.228 18.992 1.00 0.00 H new ATOM 0 HE21 GLN A 64 10.997 15.990 22.280 1.00 0.00 H new ATOM 0 HE22 GLN A 64 9.495 16.310 23.154 1.00 0.00 H new ATOM 1099 N PHE A 65 8.778 12.952 21.393 1.00 0.00 N ATOM 1100 CA PHE A 65 7.722 12.686 22.382 1.00 0.00 C ATOM 1101 C PHE A 65 8.019 13.396 23.721 1.00 0.00 C ATOM 1102 O PHE A 65 9.112 13.937 23.890 1.00 0.00 O ATOM 1103 CB PHE A 65 7.564 11.161 22.517 1.00 0.00 C ATOM 1104 CG PHE A 65 6.322 10.726 23.269 1.00 0.00 C ATOM 1105 CD1 PHE A 65 5.050 10.903 22.695 1.00 0.00 C ATOM 1106 CD2 PHE A 65 6.431 10.164 24.552 1.00 0.00 C ATOM 1107 CE1 PHE A 65 3.894 10.554 23.416 1.00 0.00 C ATOM 1108 CE2 PHE A 65 5.278 9.817 25.277 1.00 0.00 C ATOM 1109 CZ PHE A 65 4.007 10.025 24.713 1.00 0.00 C ATOM 0 H PHE A 65 9.717 12.867 21.783 1.00 0.00 H new ATOM 0 HA PHE A 65 6.770 13.099 22.049 1.00 0.00 H new ATOM 0 HB2 PHE A 65 7.544 10.720 21.520 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.441 10.760 23.025 1.00 0.00 H new ATOM 0 HD1 PHE A 65 4.961 11.308 21.698 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.407 9.998 24.984 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.919 10.693 22.973 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.368 9.391 26.265 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.119 9.779 25.276 1.00 0.00 H new ATOM 1119 N LEU A 66 7.054 13.445 24.651 1.00 0.00 N ATOM 1120 CA LEU A 66 7.060 14.379 25.798 1.00 0.00 C ATOM 1121 C LEU A 66 6.816 13.745 27.185 1.00 0.00 C ATOM 1122 O LEU A 66 6.714 14.481 28.165 1.00 0.00 O ATOM 1123 CB LEU A 66 6.056 15.524 25.524 1.00 0.00 C ATOM 1124 CG LEU A 66 6.416 16.444 24.341 1.00 0.00 C ATOM 1125 CD1 LEU A 66 5.258 17.405 24.068 1.00 0.00 C ATOM 1126 CD2 LEU A 66 7.668 17.280 24.611 1.00 0.00 C ATOM 0 H LEU A 66 6.238 12.834 24.632 1.00 0.00 H new ATOM 0 HA LEU A 66 8.079 14.759 25.866 1.00 0.00 H new ATOM 0 HB2 LEU A 66 5.074 15.088 25.339 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.970 16.133 26.424 1.00 0.00 H new ATOM 0 HG LEU A 66 6.609 15.798 23.485 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.514 18.055 23.231 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.362 16.835 23.824 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.072 18.011 24.954 1.00 0.00 H new ATOM 0 HD21 LEU A 66 7.878 17.910 23.747 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.504 17.908 25.487 1.00 0.00 H new ATOM 0 HD23 LEU A 66 8.515 16.618 24.792 1.00 0.00 H new ATOM 1138 N MET A 67 6.726 12.413 27.283 1.00 0.00 N ATOM 1139 CA MET A 67 6.631 11.644 28.539 1.00 0.00 C ATOM 1140 C MET A 67 7.478 10.378 28.481 1.00 0.00 C ATOM 1141 O MET A 67 7.891 9.896 29.554 1.00 0.00 O ATOM 1142 CB MET A 67 5.164 11.307 28.867 1.00 0.00 C ATOM 1143 CG MET A 67 4.376 12.501 29.415 1.00 0.00 C ATOM 1144 SD MET A 67 4.899 13.054 31.062 1.00 0.00 S ATOM 1145 CE MET A 67 3.872 14.538 31.215 1.00 0.00 C ATOM 1146 OXT MET A 67 7.742 9.863 27.377 1.00 0.00 O ATOM 0 H MET A 67 6.717 11.813 26.458 1.00 0.00 H new ATOM 0 HA MET A 67 7.025 12.270 29.340 1.00 0.00 H new ATOM 0 HB2 MET A 67 4.673 10.939 27.966 1.00 0.00 H new ATOM 0 HB3 MET A 67 5.139 10.498 29.597 1.00 0.00 H new ATOM 0 HG2 MET A 67 4.471 13.334 28.718 1.00 0.00 H new ATOM 0 HG3 MET A 67 3.319 12.237 29.453 1.00 0.00 H new ATOM 0 HE1 MET A 67 4.062 15.014 32.177 1.00 0.00 H new ATOM 0 HE2 MET A 67 4.115 15.233 30.411 1.00 0.00 H new ATOM 0 HE3 MET A 67 2.820 14.261 31.149 1.00 0.00 H new TER 1156 MET A 67