USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 706 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 LYS NZ :NH3+ -166:sc= 0.751 (180deg=0.00616) USER MOD Set 1.2: A 88 THR OG1 : rot -97:sc= 1.65 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 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.263 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 35 THR OG1 : rot 149:sc= 1.26 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= -0.0587 X(o=-0.059,f=-0.17) USER MOD Single : A 43 TYR OH : rot 167:sc= 1.4 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -7:sc= 1.24 USER MOD Single : A 60 HIS : no HD1:sc= -0.0915 X(o=-0.092,f=-0.0034) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.0549 X(o=-0.055,f=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.169 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.0066) USER MOD Single : A 79 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.201) USER MOD Single : A 80 GLN : amide:sc= -0.145 K(o=-0.15,f=-0.93) USER MOD Single : A 84 THR OG1 : rot 85:sc= 1.16 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0.28) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 HIS : no HE2:sc= -0.0486 X(o=-0.049,f=-0.51) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 19.638 44.092 20.959 1.00 0.00 N ATOM 2 CA LYS A 9 19.249 42.759 20.616 1.00 0.00 C ATOM 3 C LYS A 9 20.408 41.841 20.801 1.00 0.00 C ATOM 4 O LYS A 9 21.546 42.307 20.776 1.00 0.00 O ATOM 5 CB LYS A 9 18.738 42.652 19.170 1.00 0.00 C ATOM 6 CG LYS A 9 17.510 43.508 18.857 1.00 0.00 C ATOM 7 CD LYS A 9 17.863 44.798 18.113 1.00 0.00 C ATOM 8 CE LYS A 9 16.685 45.736 17.840 1.00 0.00 C ATOM 9 NZ LYS A 9 15.746 45.170 16.845 1.00 0.00 N ATOM 0 HA LYS A 9 18.428 42.477 21.276 1.00 0.00 H new ATOM 0 HB2 LYS A 9 19.544 42.937 18.493 1.00 0.00 H new ATOM 0 HB3 LYS A 9 18.499 41.609 18.960 1.00 0.00 H new ATOM 0 HG2 LYS A 9 16.811 42.927 18.256 1.00 0.00 H new ATOM 0 HG3 LYS A 9 17.000 43.758 19.787 1.00 0.00 H new ATOM 0 HD2 LYS A 9 18.611 45.339 18.692 1.00 0.00 H new ATOM 0 HD3 LYS A 9 18.325 44.535 17.162 1.00 0.00 H new ATOM 0 HE2 LYS A 9 16.153 45.931 18.771 1.00 0.00 H new ATOM 0 HE3 LYS A 9 17.060 46.694 17.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.963 45.836 16.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 16.247 45.008 15.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.368 44.268 17.198 1.00 0.00 H new ATOM 23 N PRO A 10 20.257 40.573 21.041 1.00 0.00 N ATOM 24 CA PRO A 10 21.361 39.657 21.048 1.00 0.00 C ATOM 25 C PRO A 10 21.782 39.262 19.675 1.00 0.00 C ATOM 26 O PRO A 10 21.164 39.686 18.699 1.00 0.00 O ATOM 27 CB PRO A 10 20.803 38.455 21.807 1.00 0.00 C ATOM 28 CG PRO A 10 19.310 38.433 21.442 1.00 0.00 C ATOM 29 CD PRO A 10 18.989 39.934 21.357 1.00 0.00 C ATOM 0 HA PRO A 10 22.254 40.091 21.498 1.00 0.00 H new ATOM 0 HB2 PRO A 10 21.299 37.531 21.509 1.00 0.00 H new ATOM 0 HB3 PRO A 10 20.948 38.562 22.882 1.00 0.00 H new ATOM 0 HG2 PRO A 10 19.127 37.921 20.497 1.00 0.00 H new ATOM 0 HG3 PRO A 10 18.711 37.928 22.200 1.00 0.00 H new ATOM 0 HD2 PRO A 10 18.243 40.135 20.588 1.00 0.00 H new ATOM 0 HD3 PRO A 10 18.584 40.305 22.299 1.00 0.00 H new ATOM 37 N GLY A 11 22.815 38.411 19.545 1.00 0.00 N ATOM 38 CA GLY A 11 23.160 37.785 18.305 1.00 0.00 C ATOM 39 C GLY A 11 24.364 38.315 17.606 1.00 0.00 C ATOM 40 O GLY A 11 24.366 38.455 16.384 1.00 0.00 O ATOM 0 H GLY A 11 23.426 38.151 20.320 1.00 0.00 H new ATOM 0 HA2 GLY A 11 23.313 36.722 18.490 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.308 37.871 17.630 1.00 0.00 H new ATOM 44 N ASP A 12 25.453 38.597 18.343 1.00 0.00 N ATOM 45 CA ASP A 12 26.742 38.910 17.808 1.00 0.00 C ATOM 46 C ASP A 12 27.513 37.647 17.634 1.00 0.00 C ATOM 47 O ASP A 12 27.801 36.950 18.605 1.00 0.00 O ATOM 48 CB ASP A 12 27.429 39.899 18.765 1.00 0.00 C ATOM 49 CG ASP A 12 28.761 40.452 18.280 1.00 0.00 C ATOM 50 OD1 ASP A 12 28.871 40.809 17.078 1.00 0.00 O ATOM 51 OD2 ASP A 12 29.699 40.594 19.109 1.00 0.00 O ATOM 0 H ASP A 12 25.433 38.607 19.363 1.00 0.00 H new ATOM 0 HA ASP A 12 26.672 39.382 16.828 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.752 40.734 18.946 1.00 0.00 H new ATOM 0 HB3 ASP A 12 27.587 39.403 19.723 1.00 0.00 H new ATOM 56 N THR A 13 27.861 37.259 16.394 1.00 0.00 N ATOM 57 CA THR A 13 28.655 36.093 16.155 1.00 0.00 C ATOM 58 C THR A 13 30.097 36.464 16.094 1.00 0.00 C ATOM 59 O THR A 13 30.482 37.531 15.620 1.00 0.00 O ATOM 60 CB THR A 13 28.337 35.267 14.944 1.00 0.00 C ATOM 61 OG1 THR A 13 28.059 36.044 13.788 1.00 0.00 O ATOM 62 CG2 THR A 13 27.116 34.368 15.199 1.00 0.00 C ATOM 0 H THR A 13 27.589 37.759 15.548 1.00 0.00 H new ATOM 0 HA THR A 13 28.405 35.455 17.002 1.00 0.00 H new ATOM 0 HB THR A 13 29.234 34.675 14.760 1.00 0.00 H new ATOM 0 HG1 THR A 13 27.862 35.450 13.034 1.00 0.00 H new ATOM 0 HG21 THR A 13 26.905 33.779 14.306 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.325 33.699 16.034 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.251 34.988 15.437 1.00 0.00 H new ATOM 70 N PHE A 14 30.966 35.552 16.568 1.00 0.00 N ATOM 71 CA PHE A 14 32.379 35.772 16.569 1.00 0.00 C ATOM 72 C PHE A 14 33.077 34.474 16.349 1.00 0.00 C ATOM 73 O PHE A 14 32.712 33.420 16.867 1.00 0.00 O ATOM 74 CB PHE A 14 32.903 36.514 17.810 1.00 0.00 C ATOM 75 CG PHE A 14 32.375 36.028 19.115 1.00 0.00 C ATOM 76 CD1 PHE A 14 31.236 36.566 19.665 1.00 0.00 C ATOM 77 CD2 PHE A 14 33.098 35.104 19.833 1.00 0.00 C ATOM 78 CE1 PHE A 14 30.832 36.206 20.928 1.00 0.00 C ATOM 79 CE2 PHE A 14 32.711 34.759 21.107 1.00 0.00 C ATOM 80 CZ PHE A 14 31.587 35.323 21.663 1.00 0.00 C ATOM 0 H PHE A 14 30.684 34.651 16.955 1.00 0.00 H new ATOM 0 HA PHE A 14 32.603 36.450 15.746 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.990 36.438 17.826 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.659 37.572 17.710 1.00 0.00 H new ATOM 0 HD1 PHE A 14 30.653 37.278 19.099 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.973 34.648 19.395 1.00 0.00 H new ATOM 0 HE1 PHE A 14 29.923 36.616 21.343 1.00 0.00 H new ATOM 0 HE2 PHE A 14 33.291 34.044 21.672 1.00 0.00 H new ATOM 0 HZ PHE A 14 31.298 35.073 22.673 1.00 0.00 H new ATOM 90 N GLU A 15 34.116 34.525 15.496 1.00 0.00 N ATOM 91 CA GLU A 15 34.928 33.415 15.102 1.00 0.00 C ATOM 92 C GLU A 15 36.208 33.451 15.865 1.00 0.00 C ATOM 93 O GLU A 15 36.757 34.509 16.169 1.00 0.00 O ATOM 94 CB GLU A 15 35.137 33.401 13.579 1.00 0.00 C ATOM 95 CG GLU A 15 33.815 33.208 12.833 1.00 0.00 C ATOM 96 CD GLU A 15 33.915 33.313 11.318 1.00 0.00 C ATOM 97 OE1 GLU A 15 34.186 34.427 10.797 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.671 32.289 10.626 1.00 0.00 O ATOM 0 H GLU A 15 34.407 35.397 15.054 1.00 0.00 H new ATOM 0 HA GLU A 15 34.423 32.480 15.343 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.599 34.337 13.266 1.00 0.00 H new ATOM 0 HB3 GLU A 15 35.827 32.600 13.313 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.409 32.229 13.089 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.102 33.952 13.188 1.00 0.00 H new ATOM 105 N VAL A 16 36.698 32.267 16.275 1.00 0.00 N ATOM 106 CA VAL A 16 37.815 32.120 17.155 1.00 0.00 C ATOM 107 C VAL A 16 38.734 31.134 16.523 1.00 0.00 C ATOM 108 O VAL A 16 38.382 29.962 16.391 1.00 0.00 O ATOM 109 CB VAL A 16 37.358 31.686 18.516 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.474 31.048 19.359 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.805 32.908 19.269 1.00 0.00 C ATOM 0 H VAL A 16 36.299 31.376 15.981 1.00 0.00 H new ATOM 0 HA VAL A 16 38.337 33.065 17.303 1.00 0.00 H new ATOM 0 HB VAL A 16 36.593 30.924 18.367 1.00 0.00 H new ATOM 0 HG11 VAL A 16 38.075 30.757 20.331 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.859 30.166 18.846 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.281 31.767 19.499 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.470 32.603 20.260 1.00 0.00 H new ATOM 0 HG22 VAL A 16 37.588 33.660 19.366 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.965 33.327 18.715 1.00 0.00 H new ATOM 121 N GLU A 17 39.938 31.552 16.091 1.00 0.00 N ATOM 122 CA GLU A 17 40.959 30.684 15.593 1.00 0.00 C ATOM 123 C GLU A 17 42.034 30.606 16.622 1.00 0.00 C ATOM 124 O GLU A 17 43.111 31.189 16.508 1.00 0.00 O ATOM 125 CB GLU A 17 41.516 31.115 14.225 1.00 0.00 C ATOM 126 CG GLU A 17 40.573 30.773 13.070 1.00 0.00 C ATOM 127 CD GLU A 17 41.144 31.078 11.692 1.00 0.00 C ATOM 128 OE1 GLU A 17 42.223 30.529 11.347 1.00 0.00 O ATOM 129 OE2 GLU A 17 40.508 31.844 10.921 1.00 0.00 O ATOM 0 H GLU A 17 40.210 32.535 16.089 1.00 0.00 H new ATOM 0 HA GLU A 17 40.524 29.700 15.417 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.699 32.190 14.234 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.478 30.630 14.059 1.00 0.00 H new ATOM 0 HG2 GLU A 17 40.322 29.714 13.121 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.643 31.328 13.197 1.00 0.00 H new ATOM 136 N LEU A 18 41.755 29.852 17.700 1.00 0.00 N ATOM 137 CA LEU A 18 42.524 29.815 18.906 1.00 0.00 C ATOM 138 C LEU A 18 43.512 28.700 18.900 1.00 0.00 C ATOM 139 O LEU A 18 43.206 27.562 18.549 1.00 0.00 O ATOM 140 CB LEU A 18 41.576 29.594 20.097 1.00 0.00 C ATOM 141 CG LEU A 18 42.211 29.406 21.485 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.879 30.697 21.988 1.00 0.00 C ATOM 143 CD2 LEU A 18 41.116 28.937 22.459 1.00 0.00 C ATOM 0 H LEU A 18 40.946 29.232 17.732 1.00 0.00 H new ATOM 0 HA LEU A 18 43.060 30.761 18.985 1.00 0.00 H new ATOM 0 HB2 LEU A 18 40.898 30.446 20.150 1.00 0.00 H new ATOM 0 HB3 LEU A 18 40.967 28.715 19.884 1.00 0.00 H new ATOM 0 HG LEU A 18 42.999 28.656 21.419 1.00 0.00 H new ATOM 0 HD11 LEU A 18 43.315 30.522 22.971 1.00 0.00 H new ATOM 0 HD12 LEU A 18 43.662 30.997 21.292 1.00 0.00 H new ATOM 0 HD13 LEU A 18 42.133 31.489 22.058 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.546 28.798 23.451 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.327 29.687 22.508 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.698 27.993 22.109 1.00 0.00 H new ATOM 155 N ALA A 19 44.763 28.968 19.316 1.00 0.00 N ATOM 156 CA ALA A 19 45.774 27.973 19.493 1.00 0.00 C ATOM 157 C ALA A 19 45.968 27.631 20.930 1.00 0.00 C ATOM 158 O ALA A 19 45.845 28.471 21.820 1.00 0.00 O ATOM 159 CB ALA A 19 47.094 28.429 18.848 1.00 0.00 C ATOM 0 H ALA A 19 45.081 29.911 19.537 1.00 0.00 H new ATOM 0 HA ALA A 19 45.439 27.065 18.991 1.00 0.00 H new ATOM 0 HB1 ALA A 19 47.854 27.661 18.991 1.00 0.00 H new ATOM 0 HB2 ALA A 19 46.940 28.593 17.781 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.425 29.357 19.314 1.00 0.00 H new ATOM 165 N LYS A 20 46.290 26.355 21.208 1.00 0.00 N ATOM 166 CA LYS A 20 46.584 25.861 22.518 1.00 0.00 C ATOM 167 C LYS A 20 47.874 26.330 23.098 1.00 0.00 C ATOM 168 O LYS A 20 48.812 26.722 22.406 1.00 0.00 O ATOM 169 CB LYS A 20 46.609 24.323 22.508 1.00 0.00 C ATOM 170 CG LYS A 20 45.244 23.707 22.195 1.00 0.00 C ATOM 171 CD LYS A 20 45.249 22.181 22.079 1.00 0.00 C ATOM 172 CE LYS A 20 43.844 21.625 21.839 1.00 0.00 C ATOM 173 NZ LYS A 20 43.854 20.179 21.524 1.00 0.00 N ATOM 0 H LYS A 20 46.348 25.635 20.487 1.00 0.00 H new ATOM 0 HA LYS A 20 45.788 26.261 23.146 1.00 0.00 H new ATOM 0 HB2 LYS A 20 47.334 23.981 21.769 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.950 23.964 23.479 1.00 0.00 H new ATOM 0 HG2 LYS A 20 44.541 23.997 22.976 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.875 24.129 21.260 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.903 21.881 21.261 1.00 0.00 H new ATOM 0 HD3 LYS A 20 45.660 21.748 22.991 1.00 0.00 H new ATOM 0 HE2 LYS A 20 43.232 21.797 22.725 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.376 22.169 21.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 42.928 19.901 21.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 44.593 19.982 20.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 44.048 19.636 22.390 1.00 0.00 H new ATOM 187 N THR A 21 47.980 26.283 24.437 1.00 0.00 N ATOM 188 CA THR A 21 49.213 26.471 25.139 1.00 0.00 C ATOM 189 C THR A 21 49.329 25.417 26.185 1.00 0.00 C ATOM 190 O THR A 21 48.416 25.184 26.976 1.00 0.00 O ATOM 191 CB THR A 21 49.441 27.857 25.665 1.00 0.00 C ATOM 192 OG1 THR A 21 50.736 28.025 26.223 1.00 0.00 O ATOM 193 CG2 THR A 21 48.400 28.314 26.701 1.00 0.00 C ATOM 0 H THR A 21 47.184 26.109 25.051 1.00 0.00 H new ATOM 0 HA THR A 21 50.023 26.362 24.418 1.00 0.00 H new ATOM 0 HB THR A 21 49.338 28.486 24.780 1.00 0.00 H new ATOM 0 HG1 THR A 21 50.835 28.944 26.549 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.635 29.326 27.032 1.00 0.00 H new ATOM 0 HG22 THR A 21 47.408 28.301 26.250 1.00 0.00 H new ATOM 0 HG23 THR A 21 48.418 27.639 27.557 1.00 0.00 H new ATOM 201 N ASP A 22 50.452 24.677 26.160 1.00 0.00 N ATOM 202 CA ASP A 22 50.744 23.495 26.910 1.00 0.00 C ATOM 203 C ASP A 22 49.688 22.447 26.836 1.00 0.00 C ATOM 204 O ASP A 22 49.319 21.807 27.820 1.00 0.00 O ATOM 205 CB ASP A 22 51.152 23.862 28.346 1.00 0.00 C ATOM 206 CG ASP A 22 52.152 22.870 28.924 1.00 0.00 C ATOM 207 OD1 ASP A 22 53.336 22.927 28.499 1.00 0.00 O ATOM 208 OD2 ASP A 22 51.806 22.047 29.813 1.00 0.00 O ATOM 0 H ASP A 22 51.231 24.934 25.554 1.00 0.00 H new ATOM 0 HA ASP A 22 51.600 23.017 26.434 1.00 0.00 H new ATOM 0 HB2 ASP A 22 51.586 24.862 28.356 1.00 0.00 H new ATOM 0 HB3 ASP A 22 50.265 23.893 28.979 1.00 0.00 H new ATOM 213 N GLY A 23 49.113 22.239 25.639 1.00 0.00 N ATOM 214 CA GLY A 23 48.084 21.281 25.374 1.00 0.00 C ATOM 215 C GLY A 23 46.695 21.687 25.733 1.00 0.00 C ATOM 216 O GLY A 23 45.732 21.001 25.396 1.00 0.00 O ATOM 0 H GLY A 23 49.381 22.769 24.810 1.00 0.00 H new ATOM 0 HA2 GLY A 23 48.106 21.040 24.311 1.00 0.00 H new ATOM 0 HA3 GLY A 23 48.323 20.364 25.913 1.00 0.00 H new ATOM 220 N SER A 24 46.520 22.809 26.454 1.00 0.00 N ATOM 221 CA SER A 24 45.275 23.135 27.077 1.00 0.00 C ATOM 222 C SER A 24 44.551 24.243 26.394 1.00 0.00 C ATOM 223 O SER A 24 45.150 25.196 25.896 1.00 0.00 O ATOM 224 CB SER A 24 45.478 23.485 28.561 1.00 0.00 C ATOM 225 OG SER A 24 44.519 22.836 29.383 1.00 0.00 O ATOM 0 H SER A 24 47.254 23.500 26.607 1.00 0.00 H new ATOM 0 HA SER A 24 44.655 22.243 26.992 1.00 0.00 H new ATOM 0 HB2 SER A 24 46.482 23.194 28.871 1.00 0.00 H new ATOM 0 HB3 SER A 24 45.404 24.564 28.695 1.00 0.00 H new ATOM 0 HG SER A 24 44.675 23.077 30.320 1.00 0.00 H new ATOM 231 N LEU A 25 43.208 24.164 26.355 1.00 0.00 N ATOM 232 CA LEU A 25 42.365 25.204 25.852 1.00 0.00 C ATOM 233 C LEU A 25 41.798 26.003 26.974 1.00 0.00 C ATOM 234 O LEU A 25 42.089 27.191 27.101 1.00 0.00 O ATOM 235 CB LEU A 25 41.228 24.652 24.976 1.00 0.00 C ATOM 236 CG LEU A 25 41.714 24.182 23.595 1.00 0.00 C ATOM 237 CD1 LEU A 25 40.665 23.291 22.907 1.00 0.00 C ATOM 238 CD2 LEU A 25 42.077 25.359 22.675 1.00 0.00 C ATOM 0 H LEU A 25 42.692 23.348 26.685 1.00 0.00 H new ATOM 0 HA LEU A 25 42.985 25.846 25.227 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.751 23.818 25.491 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.469 25.423 24.846 1.00 0.00 H new ATOM 0 HG LEU A 25 42.618 23.598 23.770 1.00 0.00 H new ATOM 0 HD11 LEU A 25 41.038 22.975 21.933 1.00 0.00 H new ATOM 0 HD12 LEU A 25 40.472 22.413 23.524 1.00 0.00 H new ATOM 0 HD13 LEU A 25 39.740 23.853 22.776 1.00 0.00 H new ATOM 0 HD21 LEU A 25 42.415 24.977 21.712 1.00 0.00 H new ATOM 0 HD22 LEU A 25 41.200 25.990 22.528 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.874 25.946 23.132 1.00 0.00 H new ATOM 250 N GLY A 26 40.996 25.416 27.879 1.00 0.00 N ATOM 251 CA GLY A 26 40.586 26.025 29.107 1.00 0.00 C ATOM 252 C GLY A 26 39.132 26.349 29.137 1.00 0.00 C ATOM 253 O GLY A 26 38.746 27.446 29.537 1.00 0.00 O ATOM 0 H GLY A 26 40.617 24.478 27.750 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.821 25.356 29.935 1.00 0.00 H new ATOM 0 HA3 GLY A 26 41.160 26.939 29.263 1.00 0.00 H new ATOM 257 N ILE A 27 38.270 25.395 28.744 1.00 0.00 N ATOM 258 CA ILE A 27 36.856 25.607 28.708 1.00 0.00 C ATOM 259 C ILE A 27 36.096 24.360 29.009 1.00 0.00 C ATOM 260 O ILE A 27 36.396 23.268 28.530 1.00 0.00 O ATOM 261 CB ILE A 27 36.405 26.261 27.436 1.00 0.00 C ATOM 262 CG1 ILE A 27 34.884 26.253 27.212 1.00 0.00 C ATOM 263 CG2 ILE A 27 37.180 25.703 26.230 1.00 0.00 C ATOM 264 CD1 ILE A 27 34.415 27.219 26.126 1.00 0.00 C ATOM 0 H ILE A 27 38.558 24.463 28.447 1.00 0.00 H new ATOM 0 HA ILE A 27 36.627 26.312 29.507 1.00 0.00 H new ATOM 0 HB ILE A 27 36.648 27.318 27.543 1.00 0.00 H new ATOM 0 HG12 ILE A 27 34.571 25.243 26.947 1.00 0.00 H new ATOM 0 HG13 ILE A 27 34.387 26.505 28.149 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.836 26.192 25.319 1.00 0.00 H new ATOM 0 HG22 ILE A 27 38.245 25.892 26.363 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.009 24.629 26.153 1.00 0.00 H new ATOM 0 HD11 ILE A 27 33.331 27.156 26.026 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.696 28.236 26.398 1.00 0.00 H new ATOM 0 HD13 ILE A 27 34.882 26.955 25.177 1.00 0.00 H new ATOM 276 N SER A 28 35.039 24.510 29.828 1.00 0.00 N ATOM 277 CA SER A 28 34.036 23.518 30.060 1.00 0.00 C ATOM 278 C SER A 28 32.793 23.913 29.341 1.00 0.00 C ATOM 279 O SER A 28 32.359 25.061 29.422 1.00 0.00 O ATOM 280 CB SER A 28 33.645 23.332 31.536 1.00 0.00 C ATOM 281 OG SER A 28 34.670 22.694 32.284 1.00 0.00 O ATOM 0 H SER A 28 34.877 25.368 30.355 1.00 0.00 H new ATOM 0 HA SER A 28 34.469 22.581 29.709 1.00 0.00 H new ATOM 0 HB2 SER A 28 33.426 24.304 31.978 1.00 0.00 H new ATOM 0 HB3 SER A 28 32.731 22.741 31.597 1.00 0.00 H new ATOM 0 HG SER A 28 34.383 22.597 33.216 1.00 0.00 H new ATOM 287 N VAL A 29 32.152 22.975 28.620 1.00 0.00 N ATOM 288 CA VAL A 29 30.938 23.206 27.901 1.00 0.00 C ATOM 289 C VAL A 29 29.789 22.543 28.578 1.00 0.00 C ATOM 290 O VAL A 29 29.936 21.790 29.541 1.00 0.00 O ATOM 291 CB VAL A 29 31.003 22.817 26.454 1.00 0.00 C ATOM 292 CG1 VAL A 29 32.010 23.734 25.741 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.385 21.338 26.265 1.00 0.00 C ATOM 0 H VAL A 29 32.494 22.018 28.535 1.00 0.00 H new ATOM 0 HA VAL A 29 30.787 24.285 27.910 1.00 0.00 H new ATOM 0 HB VAL A 29 30.011 22.938 26.018 1.00 0.00 H new ATOM 0 HG11 VAL A 29 32.067 23.462 24.687 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.685 24.771 25.831 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.993 23.621 26.199 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.419 21.104 25.201 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.364 21.156 26.708 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.643 20.705 26.752 1.00 0.00 H new ATOM 303 N THR A 30 28.558 22.834 28.122 1.00 0.00 N ATOM 304 CA THR A 30 27.350 22.216 28.575 1.00 0.00 C ATOM 305 C THR A 30 26.369 22.216 27.453 1.00 0.00 C ATOM 306 O THR A 30 26.708 22.564 26.323 1.00 0.00 O ATOM 307 CB THR A 30 26.791 22.847 29.816 1.00 0.00 C ATOM 308 OG1 THR A 30 25.773 22.046 30.399 1.00 0.00 O ATOM 309 CG2 THR A 30 26.245 24.267 29.598 1.00 0.00 C ATOM 0 H THR A 30 28.397 23.536 27.400 1.00 0.00 H new ATOM 0 HA THR A 30 27.574 21.190 28.867 1.00 0.00 H new ATOM 0 HB THR A 30 27.641 22.921 30.495 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.433 22.486 31.206 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.858 24.657 30.540 1.00 0.00 H new ATOM 0 HG22 THR A 30 27.046 24.914 29.239 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.443 24.239 28.860 1.00 0.00 H new ATOM 317 N GLY A 31 25.111 21.818 27.713 1.00 0.00 N ATOM 318 CA GLY A 31 24.052 21.774 26.753 1.00 0.00 C ATOM 319 C GLY A 31 23.599 20.375 26.510 1.00 0.00 C ATOM 320 O GLY A 31 23.579 19.552 27.425 1.00 0.00 O ATOM 0 H GLY A 31 24.818 21.511 28.641 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.213 22.374 27.106 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.389 22.217 25.816 1.00 0.00 H new ATOM 324 N GLY A 32 23.216 20.076 25.257 1.00 0.00 N ATOM 325 CA GLY A 32 22.804 18.774 24.834 1.00 0.00 C ATOM 326 C GLY A 32 21.332 18.687 24.619 1.00 0.00 C ATOM 327 O GLY A 32 20.532 19.306 25.319 1.00 0.00 O ATOM 0 H GLY A 32 23.192 20.768 24.508 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.320 18.515 23.909 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.103 18.040 25.582 1.00 0.00 H new ATOM 331 N VAL A 33 20.906 17.872 23.639 1.00 0.00 N ATOM 332 CA VAL A 33 19.558 17.820 23.164 1.00 0.00 C ATOM 333 C VAL A 33 18.593 17.227 24.133 1.00 0.00 C ATOM 334 O VAL A 33 17.417 17.584 24.190 1.00 0.00 O ATOM 335 CB VAL A 33 19.452 17.091 21.857 1.00 0.00 C ATOM 336 CG1 VAL A 33 18.229 17.615 21.086 1.00 0.00 C ATOM 337 CG2 VAL A 33 20.709 17.309 20.998 1.00 0.00 C ATOM 0 H VAL A 33 21.526 17.222 23.157 1.00 0.00 H new ATOM 0 HA VAL A 33 19.281 18.865 23.027 1.00 0.00 H new ATOM 0 HB VAL A 33 19.350 16.026 22.065 1.00 0.00 H new ATOM 0 HG11 VAL A 33 18.146 17.089 20.135 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.328 17.445 21.675 1.00 0.00 H new ATOM 0 HG13 VAL A 33 18.345 18.683 20.901 1.00 0.00 H new ATOM 0 HG21 VAL A 33 20.605 16.769 20.057 1.00 0.00 H new ATOM 0 HG22 VAL A 33 20.831 18.373 20.795 1.00 0.00 H new ATOM 0 HG23 VAL A 33 21.584 16.940 21.533 1.00 0.00 H new ATOM 347 N ASN A 34 19.061 16.281 24.965 1.00 0.00 N ATOM 348 CA ASN A 34 18.255 15.599 25.930 1.00 0.00 C ATOM 349 C ASN A 34 18.270 16.275 27.257 1.00 0.00 C ATOM 350 O ASN A 34 17.497 15.927 28.148 1.00 0.00 O ATOM 351 CB ASN A 34 18.698 14.135 26.095 1.00 0.00 C ATOM 352 CG ASN A 34 18.464 13.387 24.790 1.00 0.00 C ATOM 353 OD1 ASN A 34 17.337 13.304 24.307 1.00 0.00 O ATOM 354 ND2 ASN A 34 19.553 12.828 24.196 1.00 0.00 N ATOM 0 H ASN A 34 20.035 15.980 24.967 1.00 0.00 H new ATOM 0 HA ASN A 34 17.235 15.624 25.547 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.752 14.091 26.368 1.00 0.00 H new ATOM 0 HB3 ASN A 34 18.139 13.663 26.903 1.00 0.00 H new ATOM 0 HD21 ASN A 34 19.450 12.318 23.319 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.472 12.919 24.628 1.00 0.00 H new ATOM 361 N THR A 35 19.123 17.296 27.458 1.00 0.00 N ATOM 362 CA THR A 35 19.216 18.043 28.673 1.00 0.00 C ATOM 363 C THR A 35 18.083 19.010 28.724 1.00 0.00 C ATOM 364 O THR A 35 17.661 19.513 27.685 1.00 0.00 O ATOM 365 CB THR A 35 20.500 18.816 28.748 1.00 0.00 C ATOM 366 OG1 THR A 35 21.603 17.960 28.489 1.00 0.00 O ATOM 367 CG2 THR A 35 20.744 19.417 30.143 1.00 0.00 C ATOM 0 H THR A 35 19.776 17.614 26.742 1.00 0.00 H new ATOM 0 HA THR A 35 19.183 17.344 29.508 1.00 0.00 H new ATOM 0 HB THR A 35 20.413 19.613 28.009 1.00 0.00 H new ATOM 0 HG1 THR A 35 22.321 18.472 28.061 1.00 0.00 H new ATOM 0 HG21 THR A 35 21.686 19.966 30.143 1.00 0.00 H new ATOM 0 HG22 THR A 35 19.929 20.095 30.395 1.00 0.00 H new ATOM 0 HG23 THR A 35 20.791 18.616 30.881 1.00 0.00 H new ATOM 375 N SER A 36 17.520 19.352 29.897 1.00 0.00 N ATOM 376 CA SER A 36 16.458 20.305 29.983 1.00 0.00 C ATOM 377 C SER A 36 16.972 21.703 30.002 1.00 0.00 C ATOM 378 O SER A 36 16.740 22.488 30.919 1.00 0.00 O ATOM 379 CB SER A 36 15.511 20.091 31.176 1.00 0.00 C ATOM 380 OG SER A 36 14.917 18.802 31.121 1.00 0.00 O ATOM 0 H SER A 36 17.805 18.963 30.796 1.00 0.00 H new ATOM 0 HA SER A 36 15.872 20.140 29.079 1.00 0.00 H new ATOM 0 HB2 SER A 36 16.063 20.203 32.109 1.00 0.00 H new ATOM 0 HB3 SER A 36 14.734 20.855 31.171 1.00 0.00 H new ATOM 0 HG SER A 36 14.320 18.684 31.889 1.00 0.00 H new ATOM 386 N VAL A 37 17.705 22.060 28.932 1.00 0.00 N ATOM 387 CA VAL A 37 18.304 23.327 28.648 1.00 0.00 C ATOM 388 C VAL A 37 17.427 24.057 27.690 1.00 0.00 C ATOM 389 O VAL A 37 16.754 23.445 26.863 1.00 0.00 O ATOM 390 CB VAL A 37 19.693 23.121 28.122 1.00 0.00 C ATOM 391 CG1 VAL A 37 19.723 22.339 26.797 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.463 24.446 27.986 1.00 0.00 C ATOM 0 H VAL A 37 17.896 21.388 28.189 1.00 0.00 H new ATOM 0 HA VAL A 37 18.396 23.932 29.550 1.00 0.00 H new ATOM 0 HB VAL A 37 20.200 22.509 28.869 1.00 0.00 H new ATOM 0 HG11 VAL A 37 20.755 22.222 26.467 1.00 0.00 H new ATOM 0 HG12 VAL A 37 19.275 21.356 26.944 1.00 0.00 H new ATOM 0 HG13 VAL A 37 19.160 22.884 26.040 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.464 24.248 27.602 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.934 25.105 27.298 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.538 24.925 28.962 1.00 0.00 H new ATOM 402 N ARG A 38 17.367 25.399 27.761 1.00 0.00 N ATOM 403 CA ARG A 38 16.601 26.205 26.863 1.00 0.00 C ATOM 404 C ARG A 38 17.163 26.197 25.483 1.00 0.00 C ATOM 405 O ARG A 38 18.231 26.741 25.210 1.00 0.00 O ATOM 406 CB ARG A 38 16.455 27.653 27.360 1.00 0.00 C ATOM 407 CG ARG A 38 15.603 27.841 28.616 1.00 0.00 C ATOM 408 CD ARG A 38 14.134 27.442 28.459 1.00 0.00 C ATOM 409 NE ARG A 38 13.340 28.150 29.503 1.00 0.00 N ATOM 410 CZ ARG A 38 13.068 27.696 30.760 1.00 0.00 C ATOM 411 NH1 ARG A 38 13.550 26.520 31.260 1.00 0.00 N ATOM 412 NH2 ARG A 38 12.253 28.448 31.556 1.00 0.00 N ATOM 0 H ARG A 38 17.868 25.940 28.466 1.00 0.00 H new ATOM 0 HA ARG A 38 15.609 25.754 26.832 1.00 0.00 H new ATOM 0 HB2 ARG A 38 17.450 28.053 27.555 1.00 0.00 H new ATOM 0 HB3 ARG A 38 16.023 28.251 26.558 1.00 0.00 H new ATOM 0 HG2 ARG A 38 16.040 27.256 29.425 1.00 0.00 H new ATOM 0 HG3 ARG A 38 15.651 28.887 28.917 1.00 0.00 H new ATOM 0 HD2 ARG A 38 13.774 27.706 27.465 1.00 0.00 H new ATOM 0 HD3 ARG A 38 14.021 26.363 28.563 1.00 0.00 H new ATOM 0 HE ARG A 38 12.963 29.064 29.253 1.00 0.00 H new ATOM 0 HH11 ARG A 38 14.149 25.928 30.684 1.00 0.00 H new ATOM 0 HH12 ARG A 38 13.311 26.233 32.209 1.00 0.00 H new ATOM 0 HH21 ARG A 38 11.865 29.324 31.206 1.00 0.00 H new ATOM 0 HH22 ARG A 38 12.032 28.134 32.501 1.00 0.00 H new ATOM 426 N HIS A 39 16.433 25.528 24.572 1.00 0.00 N ATOM 427 CA HIS A 39 16.768 25.169 23.228 1.00 0.00 C ATOM 428 C HIS A 39 18.061 24.454 23.031 1.00 0.00 C ATOM 429 O HIS A 39 19.140 25.040 23.085 1.00 0.00 O ATOM 430 CB HIS A 39 16.549 26.285 22.193 1.00 0.00 C ATOM 431 CG HIS A 39 16.383 25.810 20.779 1.00 0.00 C ATOM 432 ND1 HIS A 39 15.796 24.614 20.419 1.00 0.00 N ATOM 433 CD2 HIS A 39 16.682 26.433 19.607 1.00 0.00 C ATOM 434 CE1 HIS A 39 15.784 24.564 19.060 1.00 0.00 C ATOM 435 NE2 HIS A 39 16.307 25.655 18.532 1.00 0.00 N ATOM 0 H HIS A 39 15.496 25.201 24.810 1.00 0.00 H new ATOM 0 HA HIS A 39 16.016 24.407 23.023 1.00 0.00 H new ATOM 0 HB2 HIS A 39 15.664 26.855 22.476 1.00 0.00 H new ATOM 0 HB3 HIS A 39 17.396 26.970 22.234 1.00 0.00 H new ATOM 0 HD2 HIS A 39 17.149 27.404 19.529 1.00 0.00 H new ATOM 0 HE1 HIS A 39 15.396 23.736 18.485 1.00 0.00 H new ATOM 0 HE2 HIS A 39 16.411 25.875 17.542 1.00 0.00 H new ATOM 443 N GLY A 40 17.990 23.134 22.783 1.00 0.00 N ATOM 444 CA GLY A 40 19.077 22.205 22.776 1.00 0.00 C ATOM 445 C GLY A 40 20.214 22.482 21.854 1.00 0.00 C ATOM 446 O GLY A 40 20.213 22.070 20.695 1.00 0.00 O ATOM 0 H GLY A 40 17.101 22.682 22.571 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.473 22.144 23.790 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.677 21.221 22.530 1.00 0.00 H new ATOM 450 N GLY A 41 21.232 23.188 22.380 1.00 0.00 N ATOM 451 CA GLY A 41 22.481 23.469 21.745 1.00 0.00 C ATOM 452 C GLY A 41 23.568 23.309 22.752 1.00 0.00 C ATOM 453 O GLY A 41 23.309 22.922 23.889 1.00 0.00 O ATOM 0 H GLY A 41 21.176 23.590 23.316 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.640 22.793 20.905 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.483 24.482 21.343 1.00 0.00 H new ATOM 457 N ILE A 42 24.820 23.606 22.361 1.00 0.00 N ATOM 458 CA ILE A 42 25.982 23.496 23.188 1.00 0.00 C ATOM 459 C ILE A 42 26.366 24.851 23.671 1.00 0.00 C ATOM 460 O ILE A 42 26.462 25.798 22.892 1.00 0.00 O ATOM 461 CB ILE A 42 27.100 22.818 22.453 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.669 21.440 21.924 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.374 22.679 23.304 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.304 20.407 22.990 1.00 0.00 C ATOM 0 H ILE A 42 25.033 23.940 21.421 1.00 0.00 H new ATOM 0 HA ILE A 42 25.760 22.873 24.054 1.00 0.00 H new ATOM 0 HB ILE A 42 27.339 23.464 21.608 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.810 21.576 21.266 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.477 21.036 21.314 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.149 22.181 22.721 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.723 23.668 23.601 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.155 22.089 24.194 1.00 0.00 H new ATOM 0 HD11 ILE A 42 26.015 19.473 22.508 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.164 20.231 23.636 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.472 20.779 23.587 1.00 0.00 H new ATOM 476 N TYR A 43 26.568 25.025 24.990 1.00 0.00 N ATOM 477 CA TYR A 43 26.752 26.307 25.594 1.00 0.00 C ATOM 478 C TYR A 43 28.020 26.323 26.377 1.00 0.00 C ATOM 479 O TYR A 43 28.524 25.285 26.803 1.00 0.00 O ATOM 480 CB TYR A 43 25.606 26.654 26.560 1.00 0.00 C ATOM 481 CG TYR A 43 24.306 26.801 25.847 1.00 0.00 C ATOM 482 CD1 TYR A 43 23.967 28.009 25.283 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.423 25.751 25.760 1.00 0.00 C ATOM 484 CE1 TYR A 43 22.765 28.164 24.632 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.223 25.895 25.104 1.00 0.00 C ATOM 486 CZ TYR A 43 21.900 27.101 24.527 1.00 0.00 C ATOM 487 OH TYR A 43 20.700 27.266 23.803 1.00 0.00 O ATOM 0 H TYR A 43 26.604 24.252 25.654 1.00 0.00 H new ATOM 0 HA TYR A 43 26.777 27.038 24.786 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.519 25.874 27.316 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.840 27.581 27.084 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.650 28.843 25.352 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.674 24.803 26.212 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.501 29.120 24.204 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.536 25.064 25.042 1.00 0.00 H new ATOM 0 HH TYR A 43 20.292 26.390 23.641 1.00 0.00 H new ATOM 497 N VAL A 44 28.603 27.511 26.617 1.00 0.00 N ATOM 498 CA VAL A 44 29.739 27.674 27.470 1.00 0.00 C ATOM 499 C VAL A 44 29.371 27.580 28.911 1.00 0.00 C ATOM 500 O VAL A 44 28.560 28.361 29.407 1.00 0.00 O ATOM 501 CB VAL A 44 30.473 28.956 27.208 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.727 29.080 28.089 1.00 0.00 C ATOM 503 CG2 VAL A 44 30.876 29.023 25.724 1.00 0.00 C ATOM 0 H VAL A 44 28.274 28.384 26.205 1.00 0.00 H new ATOM 0 HA VAL A 44 30.411 26.850 27.232 1.00 0.00 H new ATOM 0 HB VAL A 44 29.807 29.783 27.453 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.233 30.021 27.872 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.437 29.058 29.140 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.401 28.249 27.881 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.409 29.954 25.533 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.523 28.179 25.484 1.00 0.00 H new ATOM 0 HG23 VAL A 44 29.982 28.983 25.102 1.00 0.00 H new ATOM 513 N LYS A 45 29.950 26.635 29.673 1.00 0.00 N ATOM 514 CA LYS A 45 29.667 26.486 31.067 1.00 0.00 C ATOM 515 C LYS A 45 30.572 27.342 31.885 1.00 0.00 C ATOM 516 O LYS A 45 30.117 28.197 32.643 1.00 0.00 O ATOM 517 CB LYS A 45 29.785 25.030 31.546 1.00 0.00 C ATOM 518 CG LYS A 45 29.241 24.808 32.958 1.00 0.00 C ATOM 519 CD LYS A 45 29.812 23.588 33.682 1.00 0.00 C ATOM 520 CE LYS A 45 29.288 22.226 33.224 1.00 0.00 C ATOM 521 NZ LYS A 45 29.900 21.167 34.059 1.00 0.00 N ATOM 0 H LYS A 45 30.627 25.962 29.315 1.00 0.00 H new ATOM 0 HA LYS A 45 28.632 26.801 31.201 1.00 0.00 H new ATOM 0 HB2 LYS A 45 29.249 24.383 30.852 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.832 24.730 31.517 1.00 0.00 H new ATOM 0 HG2 LYS A 45 29.447 25.696 33.555 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.157 24.705 32.902 1.00 0.00 H new ATOM 0 HD2 LYS A 45 30.896 23.596 33.564 1.00 0.00 H new ATOM 0 HD3 LYS A 45 29.606 23.694 34.747 1.00 0.00 H new ATOM 0 HE2 LYS A 45 28.202 22.192 33.310 1.00 0.00 H new ATOM 0 HE3 LYS A 45 29.530 22.064 32.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 29.548 20.237 33.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 30.934 21.197 33.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 29.648 21.322 35.056 1.00 0.00 H new ATOM 535 N ALA A 46 31.896 27.129 31.775 1.00 0.00 N ATOM 536 CA ALA A 46 32.846 27.774 32.628 1.00 0.00 C ATOM 537 C ALA A 46 34.162 27.887 31.939 1.00 0.00 C ATOM 538 O ALA A 46 34.477 27.101 31.046 1.00 0.00 O ATOM 539 CB ALA A 46 33.026 26.968 33.924 1.00 0.00 C ATOM 0 H ALA A 46 32.312 26.502 31.086 1.00 0.00 H new ATOM 0 HA ALA A 46 32.473 28.770 32.867 1.00 0.00 H new ATOM 0 HB1 ALA A 46 33.751 27.468 34.566 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.070 26.896 34.444 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.384 25.967 33.683 1.00 0.00 H new ATOM 545 N ILE A 47 34.979 28.880 32.335 1.00 0.00 N ATOM 546 CA ILE A 47 36.271 29.114 31.768 1.00 0.00 C ATOM 547 C ILE A 47 37.322 28.802 32.777 1.00 0.00 C ATOM 548 O ILE A 47 37.255 29.216 33.933 1.00 0.00 O ATOM 549 CB ILE A 47 36.327 30.463 31.114 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.889 30.371 29.685 1.00 0.00 C ATOM 551 CG2 ILE A 47 37.042 31.557 31.923 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.904 29.782 28.675 1.00 0.00 C ATOM 0 H ILE A 47 34.733 29.540 33.072 1.00 0.00 H new ATOM 0 HA ILE A 47 36.479 28.433 30.943 1.00 0.00 H new ATOM 0 HB ILE A 47 35.287 30.787 31.070 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.183 31.367 29.355 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.792 29.760 29.698 1.00 0.00 H new ATOM 0 HG21 ILE A 47 37.027 32.492 31.363 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.532 31.697 32.876 1.00 0.00 H new ATOM 0 HG23 ILE A 47 38.075 31.259 32.105 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.370 29.748 27.690 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.629 28.773 28.981 1.00 0.00 H new ATOM 0 HD13 ILE A 47 35.010 30.405 28.633 1.00 0.00 H new ATOM 564 N ILE A 48 38.282 27.930 32.418 1.00 0.00 N ATOM 565 CA ILE A 48 39.301 27.398 33.267 1.00 0.00 C ATOM 566 C ILE A 48 40.421 28.349 33.518 1.00 0.00 C ATOM 567 O ILE A 48 41.022 28.760 32.527 1.00 0.00 O ATOM 568 CB ILE A 48 39.872 26.111 32.754 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.762 25.150 32.295 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.781 25.440 33.799 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.824 24.637 33.387 1.00 0.00 C ATOM 0 H ILE A 48 38.349 27.572 31.465 1.00 0.00 H new ATOM 0 HA ILE A 48 38.786 27.212 34.210 1.00 0.00 H new ATOM 0 HB ILE A 48 40.486 26.353 31.887 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.163 25.655 31.537 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.229 24.291 31.813 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.177 24.509 33.393 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.606 26.108 34.046 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.205 25.226 34.699 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.084 23.969 32.947 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.401 24.096 34.137 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.318 25.480 33.857 1.00 0.00 H new ATOM 583 N PRO A 49 40.829 28.707 34.700 1.00 0.00 N ATOM 584 CA PRO A 49 41.847 29.695 34.910 1.00 0.00 C ATOM 585 C PRO A 49 43.162 29.447 34.254 1.00 0.00 C ATOM 586 O PRO A 49 43.716 28.356 34.377 1.00 0.00 O ATOM 587 CB PRO A 49 42.028 29.730 36.425 1.00 0.00 C ATOM 588 CG PRO A 49 40.616 29.443 36.958 1.00 0.00 C ATOM 589 CD PRO A 49 40.097 28.429 35.926 1.00 0.00 C ATOM 0 HA PRO A 49 41.520 30.630 34.454 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.745 28.981 36.762 1.00 0.00 H new ATOM 0 HB3 PRO A 49 42.396 30.698 36.764 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.635 29.029 37.966 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.001 30.342 36.994 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.269 27.406 36.261 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.023 28.539 35.775 1.00 0.00 H new ATOM 597 N LYS A 50 43.685 30.462 33.542 1.00 0.00 N ATOM 598 CA LYS A 50 44.933 30.485 32.841 1.00 0.00 C ATOM 599 C LYS A 50 44.961 29.694 31.579 1.00 0.00 C ATOM 600 O LYS A 50 46.026 29.470 31.007 1.00 0.00 O ATOM 601 CB LYS A 50 46.178 30.223 33.706 1.00 0.00 C ATOM 602 CG LYS A 50 46.317 31.113 34.942 1.00 0.00 C ATOM 603 CD LYS A 50 45.911 30.400 36.233 1.00 0.00 C ATOM 604 CE LYS A 50 46.236 31.156 37.524 1.00 0.00 C ATOM 605 NZ LYS A 50 45.389 32.357 37.698 1.00 0.00 N ATOM 0 H LYS A 50 43.187 31.347 33.450 1.00 0.00 H new ATOM 0 HA LYS A 50 44.997 31.531 32.542 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.163 29.182 34.029 1.00 0.00 H new ATOM 0 HB3 LYS A 50 47.065 30.351 33.085 1.00 0.00 H new ATOM 0 HG2 LYS A 50 47.350 31.450 35.028 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.701 32.003 34.815 1.00 0.00 H new ATOM 0 HD2 LYS A 50 44.838 30.210 36.202 1.00 0.00 H new ATOM 0 HD3 LYS A 50 46.406 29.429 36.265 1.00 0.00 H new ATOM 0 HE2 LYS A 50 46.099 30.491 38.377 1.00 0.00 H new ATOM 0 HE3 LYS A 50 47.285 31.452 37.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 45.645 32.836 38.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 45.538 33.005 36.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 44.389 32.074 37.733 1.00 0.00 H new ATOM 619 N GLY A 51 43.809 29.264 31.032 1.00 0.00 N ATOM 620 CA GLY A 51 43.783 28.594 29.769 1.00 0.00 C ATOM 621 C GLY A 51 43.931 29.508 28.601 1.00 0.00 C ATOM 622 O GLY A 51 43.738 30.720 28.687 1.00 0.00 O ATOM 0 H GLY A 51 42.893 29.381 31.466 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.583 27.855 29.744 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.843 28.050 29.676 1.00 0.00 H new ATOM 626 N ALA A 52 44.242 28.947 27.419 1.00 0.00 N ATOM 627 CA ALA A 52 44.213 29.590 26.143 1.00 0.00 C ATOM 628 C ALA A 52 42.945 30.312 25.837 1.00 0.00 C ATOM 629 O ALA A 52 42.948 31.511 25.566 1.00 0.00 O ATOM 630 CB ALA A 52 44.508 28.565 25.036 1.00 0.00 C ATOM 0 H ALA A 52 44.535 27.972 27.352 1.00 0.00 H new ATOM 0 HA ALA A 52 44.987 30.357 26.182 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.485 29.061 24.066 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.494 28.129 25.197 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.755 27.777 25.059 1.00 0.00 H new ATOM 636 N ALA A 53 41.812 29.588 25.886 1.00 0.00 N ATOM 637 CA ALA A 53 40.467 30.019 25.670 1.00 0.00 C ATOM 638 C ALA A 53 40.016 31.004 26.694 1.00 0.00 C ATOM 639 O ALA A 53 39.449 32.048 26.374 1.00 0.00 O ATOM 640 CB ALA A 53 39.516 28.811 25.690 1.00 0.00 C ATOM 0 H ALA A 53 41.847 28.592 26.101 1.00 0.00 H new ATOM 0 HA ALA A 53 40.444 30.507 24.696 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.493 29.150 25.524 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.799 28.112 24.902 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.581 28.313 26.657 1.00 0.00 H new ATOM 646 N GLU A 54 40.287 30.689 27.973 1.00 0.00 N ATOM 647 CA GLU A 54 40.112 31.577 29.080 1.00 0.00 C ATOM 648 C GLU A 54 40.664 32.951 28.909 1.00 0.00 C ATOM 649 O GLU A 54 39.950 33.952 28.929 1.00 0.00 O ATOM 650 CB GLU A 54 40.735 30.951 30.340 1.00 0.00 C ATOM 651 CG GLU A 54 40.501 31.737 31.631 1.00 0.00 C ATOM 652 CD GLU A 54 41.676 32.504 32.218 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.765 32.627 31.596 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.521 33.022 33.357 1.00 0.00 O ATOM 0 H GLU A 54 40.644 29.774 28.248 1.00 0.00 H new ATOM 0 HA GLU A 54 39.033 31.705 29.164 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.333 29.946 30.466 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.809 30.848 30.184 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.695 32.448 31.449 1.00 0.00 H new ATOM 0 HG3 GLU A 54 40.145 31.039 32.388 1.00 0.00 H new ATOM 661 N SER A 55 41.995 33.022 28.728 1.00 0.00 N ATOM 662 CA SER A 55 42.724 34.248 28.635 1.00 0.00 C ATOM 663 C SER A 55 42.452 35.031 27.396 1.00 0.00 C ATOM 664 O SER A 55 42.573 36.255 27.403 1.00 0.00 O ATOM 665 CB SER A 55 44.240 34.008 28.725 1.00 0.00 C ATOM 666 OG SER A 55 44.621 33.553 30.016 1.00 0.00 O ATOM 0 H SER A 55 42.585 32.194 28.643 1.00 0.00 H new ATOM 0 HA SER A 55 42.372 34.834 29.484 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.538 33.273 27.977 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.770 34.932 28.493 1.00 0.00 H new ATOM 0 HG SER A 55 43.851 33.600 30.620 1.00 0.00 H new ATOM 672 N ASP A 56 42.053 34.369 26.296 1.00 0.00 N ATOM 673 CA ASP A 56 41.641 34.963 25.062 1.00 0.00 C ATOM 674 C ASP A 56 40.527 35.931 25.263 1.00 0.00 C ATOM 675 O ASP A 56 40.693 37.141 25.119 1.00 0.00 O ATOM 676 CB ASP A 56 41.261 33.851 24.069 1.00 0.00 C ATOM 677 CG ASP A 56 40.876 34.342 22.680 1.00 0.00 C ATOM 678 OD1 ASP A 56 39.784 34.952 22.529 1.00 0.00 O ATOM 679 OD2 ASP A 56 41.665 34.121 21.723 1.00 0.00 O ATOM 0 H ASP A 56 42.016 33.350 26.267 1.00 0.00 H new ATOM 0 HA ASP A 56 42.471 35.536 24.648 1.00 0.00 H new ATOM 0 HB2 ASP A 56 42.101 33.163 23.976 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.428 33.283 24.482 1.00 0.00 H new ATOM 684 N GLY A 57 39.334 35.434 25.638 1.00 0.00 N ATOM 685 CA GLY A 57 38.256 36.292 26.022 1.00 0.00 C ATOM 686 C GLY A 57 37.467 36.854 24.890 1.00 0.00 C ATOM 687 O GLY A 57 36.883 37.931 25.007 1.00 0.00 O ATOM 0 H GLY A 57 39.116 34.438 25.675 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.583 35.736 26.674 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.659 37.117 26.610 1.00 0.00 H new ATOM 691 N ARG A 58 37.356 36.131 23.761 1.00 0.00 N ATOM 692 CA ARG A 58 36.184 36.192 22.946 1.00 0.00 C ATOM 693 C ARG A 58 35.125 35.355 23.578 1.00 0.00 C ATOM 694 O ARG A 58 33.989 35.789 23.765 1.00 0.00 O ATOM 695 CB ARG A 58 36.444 35.764 21.492 1.00 0.00 C ATOM 696 CG ARG A 58 36.538 36.974 20.559 1.00 0.00 C ATOM 697 CD ARG A 58 36.734 36.637 19.080 1.00 0.00 C ATOM 698 NE ARG A 58 36.372 37.886 18.354 1.00 0.00 N ATOM 699 CZ ARG A 58 36.617 38.141 17.035 1.00 0.00 C ATOM 700 NH1 ARG A 58 37.203 37.234 16.200 1.00 0.00 N ATOM 701 NH2 ARG A 58 36.213 39.349 16.546 1.00 0.00 N ATOM 0 H ARG A 58 38.080 35.503 23.413 1.00 0.00 H new ATOM 0 HA ARG A 58 35.856 37.230 22.888 1.00 0.00 H new ATOM 0 HB2 ARG A 58 37.370 35.191 21.440 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.642 35.106 21.156 1.00 0.00 H new ATOM 0 HG2 ARG A 58 35.629 37.566 20.664 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.367 37.602 20.886 1.00 0.00 H new ATOM 0 HD2 ARG A 58 37.764 36.344 18.874 1.00 0.00 H new ATOM 0 HD3 ARG A 58 36.099 35.805 18.776 1.00 0.00 H new ATOM 0 HE ARG A 58 35.900 38.615 18.889 1.00 0.00 H new ATOM 0 HH11 ARG A 58 37.479 36.318 16.555 1.00 0.00 H new ATOM 0 HH12 ARG A 58 37.365 37.472 15.221 1.00 0.00 H new ATOM 0 HH21 ARG A 58 35.749 40.018 17.160 1.00 0.00 H new ATOM 0 HH22 ARG A 58 36.375 39.583 15.566 1.00 0.00 H new ATOM 715 N ILE A 59 35.483 34.121 23.975 1.00 0.00 N ATOM 716 CA ILE A 59 34.608 33.124 24.510 1.00 0.00 C ATOM 717 C ILE A 59 34.157 33.440 25.893 1.00 0.00 C ATOM 718 O ILE A 59 34.937 33.439 26.843 1.00 0.00 O ATOM 719 CB ILE A 59 35.259 31.772 24.490 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.969 31.516 23.150 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.198 30.701 24.793 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.559 30.111 23.033 1.00 0.00 C ATOM 0 H ILE A 59 36.449 33.799 23.918 1.00 0.00 H new ATOM 0 HA ILE A 59 33.727 33.114 23.868 1.00 0.00 H new ATOM 0 HB ILE A 59 36.030 31.728 25.259 1.00 0.00 H new ATOM 0 HG12 ILE A 59 35.261 31.673 22.336 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.767 32.248 23.024 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.662 29.715 24.780 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.765 30.886 25.776 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.413 30.742 24.037 1.00 0.00 H new ATOM 0 HD11 ILE A 59 37.044 30.000 22.063 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.291 29.957 23.825 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.762 29.373 23.127 1.00 0.00 H new ATOM 734 N HIS A 60 32.858 33.743 26.068 1.00 0.00 N ATOM 735 CA HIS A 60 32.289 34.097 27.331 1.00 0.00 C ATOM 736 C HIS A 60 31.251 33.135 27.796 1.00 0.00 C ATOM 737 O HIS A 60 30.667 32.344 27.056 1.00 0.00 O ATOM 738 CB HIS A 60 31.690 35.514 27.322 1.00 0.00 C ATOM 739 CG HIS A 60 32.669 36.650 27.288 1.00 0.00 C ATOM 740 ND1 HIS A 60 32.291 37.930 27.639 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.977 36.738 26.925 1.00 0.00 C ATOM 742 CE1 HIS A 60 33.383 38.724 27.478 1.00 0.00 C ATOM 743 NE2 HIS A 60 34.424 38.039 27.041 1.00 0.00 N ATOM 0 H HIS A 60 32.181 33.741 25.305 1.00 0.00 H new ATOM 0 HA HIS A 60 33.124 34.063 28.031 1.00 0.00 H new ATOM 0 HB2 HIS A 60 31.034 35.602 26.456 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.066 35.627 28.208 1.00 0.00 H new ATOM 0 HD2 HIS A 60 34.581 35.907 26.593 1.00 0.00 H new ATOM 0 HE1 HIS A 60 33.397 39.784 27.682 1.00 0.00 H new ATOM 0 HE2 HIS A 60 35.357 38.395 26.834 1.00 0.00 H new ATOM 751 N LYS A 61 30.990 33.176 29.114 1.00 0.00 N ATOM 752 CA LYS A 61 30.122 32.279 29.812 1.00 0.00 C ATOM 753 C LYS A 61 28.711 32.311 29.337 1.00 0.00 C ATOM 754 O LYS A 61 28.098 33.370 29.207 1.00 0.00 O ATOM 755 CB LYS A 61 30.125 32.582 31.320 1.00 0.00 C ATOM 756 CG LYS A 61 29.541 31.459 32.180 1.00 0.00 C ATOM 757 CD LYS A 61 29.158 31.946 33.579 1.00 0.00 C ATOM 758 CE LYS A 61 28.706 30.789 34.472 1.00 0.00 C ATOM 759 NZ LYS A 61 28.040 31.312 35.685 1.00 0.00 N ATOM 0 H LYS A 61 31.409 33.875 29.727 1.00 0.00 H new ATOM 0 HA LYS A 61 30.520 31.285 29.608 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.149 32.776 31.640 1.00 0.00 H new ATOM 0 HB3 LYS A 61 29.557 33.495 31.498 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.661 31.045 31.687 1.00 0.00 H new ATOM 0 HG3 LYS A 61 30.268 30.652 32.264 1.00 0.00 H new ATOM 0 HD2 LYS A 61 30.010 32.448 34.036 1.00 0.00 H new ATOM 0 HD3 LYS A 61 28.358 32.682 33.503 1.00 0.00 H new ATOM 0 HE2 LYS A 61 28.022 30.142 33.923 1.00 0.00 H new ATOM 0 HE3 LYS A 61 29.565 30.180 34.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 27.737 30.518 36.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 28.704 31.912 36.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 27.210 31.875 35.410 1.00 0.00 H new ATOM 773 N GLY A 62 28.137 31.131 29.042 1.00 0.00 N ATOM 774 CA GLY A 62 26.769 30.979 28.651 1.00 0.00 C ATOM 775 C GLY A 62 26.536 31.125 27.187 1.00 0.00 C ATOM 776 O GLY A 62 25.399 30.964 26.747 1.00 0.00 O ATOM 0 H GLY A 62 28.646 30.248 29.077 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.419 29.997 28.968 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.167 31.718 29.180 1.00 0.00 H new ATOM 780 N ASP A 63 27.558 31.474 26.385 1.00 0.00 N ATOM 781 CA ASP A 63 27.352 31.751 24.998 1.00 0.00 C ATOM 782 C ASP A 63 27.276 30.508 24.178 1.00 0.00 C ATOM 783 O ASP A 63 27.595 29.415 24.642 1.00 0.00 O ATOM 784 CB ASP A 63 28.365 32.800 24.509 1.00 0.00 C ATOM 785 CG ASP A 63 28.042 34.139 25.158 1.00 0.00 C ATOM 786 OD1 ASP A 63 26.840 34.476 25.329 1.00 0.00 O ATOM 787 OD2 ASP A 63 29.003 34.875 25.504 1.00 0.00 O ATOM 0 H ASP A 63 28.525 31.564 26.697 1.00 0.00 H new ATOM 0 HA ASP A 63 26.369 32.203 24.864 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.379 32.492 24.764 1.00 0.00 H new ATOM 0 HB3 ASP A 63 28.322 32.887 23.423 1.00 0.00 H new ATOM 792 N ARG A 64 26.741 30.598 22.948 1.00 0.00 N ATOM 793 CA ARG A 64 26.233 29.460 22.245 1.00 0.00 C ATOM 794 C ARG A 64 27.139 29.041 21.139 1.00 0.00 C ATOM 795 O ARG A 64 27.471 29.832 20.257 1.00 0.00 O ATOM 796 CB ARG A 64 24.836 29.778 21.688 1.00 0.00 C ATOM 797 CG ARG A 64 23.988 28.547 21.360 1.00 0.00 C ATOM 798 CD ARG A 64 22.583 28.935 20.896 1.00 0.00 C ATOM 799 NE ARG A 64 21.669 27.779 21.106 1.00 0.00 N ATOM 800 CZ ARG A 64 20.856 27.239 20.153 1.00 0.00 C ATOM 801 NH1 ARG A 64 20.751 27.778 18.903 1.00 0.00 N ATOM 802 NH2 ARG A 64 20.088 26.154 20.465 1.00 0.00 N ATOM 0 H ARG A 64 26.659 31.474 22.432 1.00 0.00 H new ATOM 0 HA ARG A 64 26.171 28.631 22.950 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.300 30.390 22.414 1.00 0.00 H new ATOM 0 HB3 ARG A 64 24.947 30.378 20.785 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.480 27.963 20.582 1.00 0.00 H new ATOM 0 HG3 ARG A 64 23.917 27.909 22.241 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.228 29.802 21.453 1.00 0.00 H new ATOM 0 HD3 ARG A 64 22.598 29.217 19.843 1.00 0.00 H new ATOM 0 HE ARG A 64 21.649 27.358 22.035 1.00 0.00 H new ATOM 0 HH11 ARG A 64 21.290 28.609 18.659 1.00 0.00 H new ATOM 0 HH12 ARG A 64 20.134 27.350 18.213 1.00 0.00 H new ATOM 0 HH21 ARG A 64 20.126 25.755 21.403 1.00 0.00 H new ATOM 0 HH22 ARG A 64 19.477 25.742 19.760 1.00 0.00 H new ATOM 816 N VAL A 65 27.587 27.773 21.136 1.00 0.00 N ATOM 817 CA VAL A 65 28.537 27.273 20.191 1.00 0.00 C ATOM 818 C VAL A 65 27.834 26.747 18.988 1.00 0.00 C ATOM 819 O VAL A 65 26.975 25.871 19.083 1.00 0.00 O ATOM 820 CB VAL A 65 29.433 26.228 20.787 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.551 25.853 19.800 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.049 26.759 22.091 1.00 0.00 C ATOM 0 H VAL A 65 27.279 27.074 21.812 1.00 0.00 H new ATOM 0 HA VAL A 65 29.177 28.104 19.894 1.00 0.00 H new ATOM 0 HB VAL A 65 28.841 25.338 21.000 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.192 25.094 20.248 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.111 25.461 18.883 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.144 26.738 19.568 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.700 25.998 22.522 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.631 27.656 21.880 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.254 27.000 22.797 1.00 0.00 H new ATOM 832 N LEU A 66 28.163 27.264 17.791 1.00 0.00 N ATOM 833 CA LEU A 66 27.522 26.876 16.573 1.00 0.00 C ATOM 834 C LEU A 66 28.293 25.796 15.895 1.00 0.00 C ATOM 835 O LEU A 66 27.711 24.832 15.399 1.00 0.00 O ATOM 836 CB LEU A 66 27.352 28.040 15.581 1.00 0.00 C ATOM 837 CG LEU A 66 26.160 28.981 15.816 1.00 0.00 C ATOM 838 CD1 LEU A 66 24.810 28.245 15.850 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.311 29.882 17.054 1.00 0.00 C ATOM 0 H LEU A 66 28.891 27.968 17.667 1.00 0.00 H new ATOM 0 HA LEU A 66 26.531 26.525 16.860 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.264 28.636 15.597 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.262 27.622 14.578 1.00 0.00 H new ATOM 0 HG LEU A 66 26.165 29.635 14.944 1.00 0.00 H new ATOM 0 HD11 LEU A 66 24.008 28.964 16.019 1.00 0.00 H new ATOM 0 HD12 LEU A 66 24.648 27.738 14.899 1.00 0.00 H new ATOM 0 HD13 LEU A 66 24.816 27.511 16.656 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.430 30.516 17.152 1.00 0.00 H new ATOM 0 HD22 LEU A 66 26.413 29.262 17.945 1.00 0.00 H new ATOM 0 HD23 LEU A 66 27.197 30.507 16.944 1.00 0.00 H new ATOM 851 N ALA A 67 29.630 25.922 15.828 1.00 0.00 N ATOM 852 CA ALA A 67 30.422 25.005 15.068 1.00 0.00 C ATOM 853 C ALA A 67 31.795 24.850 15.626 1.00 0.00 C ATOM 854 O ALA A 67 32.442 25.819 16.019 1.00 0.00 O ATOM 855 CB ALA A 67 30.516 25.474 13.606 1.00 0.00 C ATOM 0 H ALA A 67 30.161 26.655 16.298 1.00 0.00 H new ATOM 0 HA ALA A 67 29.928 24.035 15.119 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.121 24.769 13.036 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.516 25.525 13.175 1.00 0.00 H new ATOM 0 HB3 ALA A 67 30.978 26.461 13.569 1.00 0.00 H new ATOM 861 N VAL A 68 32.290 23.599 15.666 1.00 0.00 N ATOM 862 CA VAL A 68 33.626 23.276 16.060 1.00 0.00 C ATOM 863 C VAL A 68 34.339 22.790 14.846 1.00 0.00 C ATOM 864 O VAL A 68 33.848 21.906 14.145 1.00 0.00 O ATOM 865 CB VAL A 68 33.714 22.193 17.094 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.168 22.003 17.558 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.810 22.500 18.299 1.00 0.00 C ATOM 0 H VAL A 68 31.737 22.780 15.414 1.00 0.00 H new ATOM 0 HA VAL A 68 34.060 24.175 16.498 1.00 0.00 H new ATOM 0 HB VAL A 68 33.368 21.267 16.635 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.210 21.213 18.308 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.789 21.728 16.706 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.537 22.933 17.990 1.00 0.00 H new ATOM 0 HG21 VAL A 68 32.895 21.697 19.032 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.118 23.441 18.755 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.775 22.580 17.966 1.00 0.00 H new ATOM 877 N ASN A 69 35.505 23.371 14.509 1.00 0.00 N ATOM 878 CA ASN A 69 36.319 23.042 13.380 1.00 0.00 C ATOM 879 C ASN A 69 35.684 23.480 12.105 1.00 0.00 C ATOM 880 O ASN A 69 36.054 23.068 11.007 1.00 0.00 O ATOM 881 CB ASN A 69 36.728 21.559 13.380 1.00 0.00 C ATOM 882 CG ASN A 69 38.085 21.297 12.744 1.00 0.00 C ATOM 883 OD1 ASN A 69 38.221 20.596 11.742 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.160 21.830 13.383 1.00 0.00 N ATOM 0 H ASN A 69 35.906 24.125 15.067 1.00 0.00 H new ATOM 0 HA ASN A 69 37.249 23.603 13.464 1.00 0.00 H new ATOM 0 HB2 ASN A 69 36.742 21.196 14.408 1.00 0.00 H new ATOM 0 HB3 ASN A 69 35.971 20.983 12.849 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.101 21.651 13.033 1.00 0.00 H new ATOM 0 HD22 ASN A 69 39.025 22.408 14.212 1.00 0.00 H new ATOM 891 N GLY A 70 34.665 24.350 12.218 1.00 0.00 N ATOM 892 CA GLY A 70 33.787 24.756 11.165 1.00 0.00 C ATOM 893 C GLY A 70 32.668 23.807 10.904 1.00 0.00 C ATOM 894 O GLY A 70 31.848 24.050 10.020 1.00 0.00 O ATOM 0 H GLY A 70 34.440 24.800 13.105 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.370 25.733 11.410 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.367 24.877 10.250 1.00 0.00 H new ATOM 898 N VAL A 71 32.574 22.693 11.651 1.00 0.00 N ATOM 899 CA VAL A 71 31.559 21.695 11.511 1.00 0.00 C ATOM 900 C VAL A 71 30.420 22.011 12.418 1.00 0.00 C ATOM 901 O VAL A 71 30.590 22.193 13.623 1.00 0.00 O ATOM 902 CB VAL A 71 32.076 20.313 11.783 1.00 0.00 C ATOM 903 CG1 VAL A 71 30.984 19.252 11.563 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.280 20.025 10.870 1.00 0.00 C ATOM 0 H VAL A 71 33.241 22.477 12.392 1.00 0.00 H new ATOM 0 HA VAL A 71 31.221 21.708 10.475 1.00 0.00 H new ATOM 0 HB VAL A 71 32.385 20.263 12.827 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.392 18.262 11.769 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.147 19.446 12.234 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.638 19.295 10.530 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.655 19.021 11.068 1.00 0.00 H new ATOM 0 HG22 VAL A 71 32.971 20.098 9.827 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.068 20.752 11.067 1.00 0.00 H new ATOM 914 N SER A 72 29.196 22.119 11.872 1.00 0.00 N ATOM 915 CA SER A 72 28.047 22.575 12.591 1.00 0.00 C ATOM 916 C SER A 72 27.541 21.571 13.568 1.00 0.00 C ATOM 917 O SER A 72 27.414 20.387 13.255 1.00 0.00 O ATOM 918 CB SER A 72 26.865 22.935 11.675 1.00 0.00 C ATOM 919 OG SER A 72 27.223 23.895 10.692 1.00 0.00 O ATOM 0 H SER A 72 28.999 21.882 10.900 1.00 0.00 H new ATOM 0 HA SER A 72 28.404 23.465 13.110 1.00 0.00 H new ATOM 0 HB2 SER A 72 26.500 22.033 11.184 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.045 23.324 12.279 1.00 0.00 H new ATOM 0 HG SER A 72 26.445 24.094 10.131 1.00 0.00 H new ATOM 925 N LEU A 73 27.212 21.994 14.802 1.00 0.00 N ATOM 926 CA LEU A 73 26.832 21.111 15.861 1.00 0.00 C ATOM 927 C LEU A 73 25.379 20.784 15.897 1.00 0.00 C ATOM 928 O LEU A 73 24.789 20.623 16.965 1.00 0.00 O ATOM 929 CB LEU A 73 27.208 21.724 17.221 1.00 0.00 C ATOM 930 CG LEU A 73 28.711 21.961 17.450 1.00 0.00 C ATOM 931 CD1 LEU A 73 28.898 22.664 18.806 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.518 20.653 17.400 1.00 0.00 C ATOM 0 H LEU A 73 27.210 22.978 15.071 1.00 0.00 H new ATOM 0 HA LEU A 73 27.373 20.185 15.666 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.688 22.676 17.327 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.837 21.069 18.010 1.00 0.00 H new ATOM 0 HG LEU A 73 29.091 22.591 16.645 1.00 0.00 H new ATOM 0 HD11 LEU A 73 29.959 22.839 18.982 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.370 23.618 18.797 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.497 22.035 19.601 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.573 20.870 17.567 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.160 19.975 18.175 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.394 20.186 16.423 1.00 0.00 H new ATOM 944 N GLU A 74 24.700 20.638 14.745 1.00 0.00 N ATOM 945 CA GLU A 74 23.278 20.511 14.677 1.00 0.00 C ATOM 946 C GLU A 74 22.774 19.191 15.152 1.00 0.00 C ATOM 947 O GLU A 74 23.098 18.137 14.608 1.00 0.00 O ATOM 948 CB GLU A 74 22.770 20.754 13.247 1.00 0.00 C ATOM 949 CG GLU A 74 23.080 22.166 12.745 1.00 0.00 C ATOM 950 CD GLU A 74 22.846 22.285 11.245 1.00 0.00 C ATOM 951 OE1 GLU A 74 21.686 22.503 10.804 1.00 0.00 O ATOM 952 OE2 GLU A 74 23.843 22.168 10.484 1.00 0.00 O ATOM 0 H GLU A 74 25.155 20.607 13.833 1.00 0.00 H new ATOM 0 HA GLU A 74 22.888 21.274 15.351 1.00 0.00 H new ATOM 0 HB2 GLU A 74 23.224 20.026 12.575 1.00 0.00 H new ATOM 0 HB3 GLU A 74 21.693 20.589 13.215 1.00 0.00 H new ATOM 0 HG2 GLU A 74 22.454 22.887 13.271 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.116 22.416 12.974 1.00 0.00 H new ATOM 959 N GLY A 75 21.977 19.198 16.235 1.00 0.00 N ATOM 960 CA GLY A 75 21.450 18.018 16.846 1.00 0.00 C ATOM 961 C GLY A 75 22.453 17.224 17.610 1.00 0.00 C ATOM 962 O GLY A 75 22.206 16.069 17.955 1.00 0.00 O ATOM 0 H GLY A 75 21.689 20.058 16.703 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.640 18.301 17.518 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.016 17.385 16.072 1.00 0.00 H new ATOM 966 N ALA A 76 23.639 17.797 17.881 1.00 0.00 N ATOM 967 CA ALA A 76 24.703 17.134 18.568 1.00 0.00 C ATOM 968 C ALA A 76 24.438 16.897 20.015 1.00 0.00 C ATOM 969 O ALA A 76 23.822 17.710 20.703 1.00 0.00 O ATOM 970 CB ALA A 76 26.025 17.902 18.402 1.00 0.00 C ATOM 0 H ALA A 76 23.865 18.755 17.613 1.00 0.00 H new ATOM 0 HA ALA A 76 24.779 16.152 18.101 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.819 17.378 18.934 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.278 17.967 17.344 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.916 18.906 18.811 1.00 0.00 H new ATOM 976 N THR A 77 24.906 15.761 20.564 1.00 0.00 N ATOM 977 CA THR A 77 24.776 15.487 21.960 1.00 0.00 C ATOM 978 C THR A 77 25.850 16.176 22.729 1.00 0.00 C ATOM 979 O THR A 77 26.780 16.746 22.162 1.00 0.00 O ATOM 980 CB THR A 77 24.751 14.028 22.313 1.00 0.00 C ATOM 981 OG1 THR A 77 25.957 13.359 21.976 1.00 0.00 O ATOM 982 CG2 THR A 77 23.609 13.344 21.542 1.00 0.00 C ATOM 0 H THR A 77 25.378 15.028 20.035 1.00 0.00 H new ATOM 0 HA THR A 77 23.797 15.878 22.238 1.00 0.00 H new ATOM 0 HB THR A 77 24.614 13.966 23.393 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.888 12.414 22.228 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.584 12.284 21.793 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.659 13.804 21.815 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.773 13.459 20.471 1.00 0.00 H new ATOM 990 N HIS A 78 25.785 16.129 24.072 1.00 0.00 N ATOM 991 CA HIS A 78 26.825 16.603 24.931 1.00 0.00 C ATOM 992 C HIS A 78 28.110 15.887 24.686 1.00 0.00 C ATOM 993 O HIS A 78 29.147 16.506 24.460 1.00 0.00 O ATOM 994 CB HIS A 78 26.419 16.464 26.407 1.00 0.00 C ATOM 995 CG HIS A 78 27.472 16.821 27.415 1.00 0.00 C ATOM 996 ND1 HIS A 78 27.833 15.982 28.450 1.00 0.00 N ATOM 997 CD2 HIS A 78 28.214 17.949 27.579 1.00 0.00 C ATOM 998 CE1 HIS A 78 28.765 16.643 29.187 1.00 0.00 C ATOM 999 NE2 HIS A 78 29.024 17.839 28.691 1.00 0.00 N ATOM 0 H HIS A 78 24.983 15.749 24.576 1.00 0.00 H new ATOM 0 HA HIS A 78 26.977 17.658 24.703 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.547 17.093 26.584 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.110 15.434 26.583 1.00 0.00 H new ATOM 0 HD2 HIS A 78 28.175 18.811 26.929 1.00 0.00 H new ATOM 0 HE1 HIS A 78 29.236 16.239 30.071 1.00 0.00 H new ATOM 0 HE2 HIS A 78 29.680 18.531 29.052 1.00 0.00 H new ATOM 1007 N LYS A 79 28.067 14.544 24.625 1.00 0.00 N ATOM 1008 CA LYS A 79 29.170 13.700 24.282 1.00 0.00 C ATOM 1009 C LYS A 79 29.788 14.008 22.963 1.00 0.00 C ATOM 1010 O LYS A 79 31.004 14.152 22.840 1.00 0.00 O ATOM 1011 CB LYS A 79 28.685 12.241 24.322 1.00 0.00 C ATOM 1012 CG LYS A 79 29.768 11.178 24.516 1.00 0.00 C ATOM 1013 CD LYS A 79 30.516 10.717 23.262 1.00 0.00 C ATOM 1014 CE LYS A 79 29.899 9.550 22.489 1.00 0.00 C ATOM 1015 NZ LYS A 79 28.780 9.980 21.621 1.00 0.00 N ATOM 0 H LYS A 79 27.216 14.019 24.826 1.00 0.00 H new ATOM 0 HA LYS A 79 29.960 13.879 25.012 1.00 0.00 H new ATOM 0 HB2 LYS A 79 27.959 12.143 25.129 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.158 12.029 23.392 1.00 0.00 H new ATOM 0 HG2 LYS A 79 30.500 11.564 25.225 1.00 0.00 H new ATOM 0 HG3 LYS A 79 29.308 10.304 24.977 1.00 0.00 H new ATOM 0 HD2 LYS A 79 30.603 11.567 22.585 1.00 0.00 H new ATOM 0 HD3 LYS A 79 31.528 10.436 23.553 1.00 0.00 H new ATOM 0 HE2 LYS A 79 30.667 9.075 21.879 1.00 0.00 H new ATOM 0 HE3 LYS A 79 29.542 8.799 23.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 28.528 9.208 20.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 27.957 10.220 22.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 29.068 10.815 21.071 1.00 0.00 H new ATOM 1029 N GLN A 80 28.968 14.162 21.907 1.00 0.00 N ATOM 1030 CA GLN A 80 29.363 14.421 20.557 1.00 0.00 C ATOM 1031 C GLN A 80 30.160 15.659 20.330 1.00 0.00 C ATOM 1032 O GLN A 80 31.202 15.655 19.676 1.00 0.00 O ATOM 1033 CB GLN A 80 28.034 14.477 19.786 1.00 0.00 C ATOM 1034 CG GLN A 80 28.202 14.379 18.269 1.00 0.00 C ATOM 1035 CD GLN A 80 26.855 14.424 17.564 1.00 0.00 C ATOM 1036 OE1 GLN A 80 25.851 13.865 18.003 1.00 0.00 O ATOM 1037 NE2 GLN A 80 26.829 15.164 16.423 1.00 0.00 N ATOM 0 H GLN A 80 27.955 14.101 22.006 1.00 0.00 H new ATOM 0 HA GLN A 80 30.050 13.642 20.228 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.392 13.664 20.125 1.00 0.00 H new ATOM 0 HB3 GLN A 80 27.523 15.409 20.027 1.00 0.00 H new ATOM 0 HG2 GLN A 80 28.828 15.198 17.916 1.00 0.00 H new ATOM 0 HG3 GLN A 80 28.717 13.452 18.016 1.00 0.00 H new ATOM 0 HE21 GLN A 80 27.681 15.614 16.088 1.00 0.00 H new ATOM 0 HE22 GLN A 80 25.958 15.269 15.903 1.00 0.00 H new ATOM 1046 N ALA A 81 29.712 16.791 20.902 1.00 0.00 N ATOM 1047 CA ALA A 81 30.418 18.035 20.908 1.00 0.00 C ATOM 1048 C ALA A 81 31.672 17.967 21.709 1.00 0.00 C ATOM 1049 O ALA A 81 32.687 18.544 21.319 1.00 0.00 O ATOM 1050 CB ALA A 81 29.489 19.110 21.496 1.00 0.00 C ATOM 0 H ALA A 81 28.814 16.841 21.383 1.00 0.00 H new ATOM 0 HA ALA A 81 30.704 18.277 19.884 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.006 20.069 21.511 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.592 19.191 20.882 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.209 18.833 22.512 1.00 0.00 H new ATOM 1056 N VAL A 82 31.689 17.210 22.821 1.00 0.00 N ATOM 1057 CA VAL A 82 32.833 17.044 23.663 1.00 0.00 C ATOM 1058 C VAL A 82 33.907 16.284 22.964 1.00 0.00 C ATOM 1059 O VAL A 82 35.064 16.702 22.980 1.00 0.00 O ATOM 1060 CB VAL A 82 32.515 16.454 25.006 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.769 15.982 25.762 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.817 17.538 25.846 1.00 0.00 C ATOM 0 H VAL A 82 30.872 16.693 23.146 1.00 0.00 H new ATOM 0 HA VAL A 82 33.204 18.048 23.871 1.00 0.00 H new ATOM 0 HB VAL A 82 31.882 15.581 24.849 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.477 15.565 26.726 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.281 15.219 25.176 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.438 16.828 25.920 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.574 17.136 26.829 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.481 18.395 25.958 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.901 17.852 25.346 1.00 0.00 H new ATOM 1072 N GLU A 83 33.588 15.177 22.270 1.00 0.00 N ATOM 1073 CA GLU A 83 34.529 14.465 21.462 1.00 0.00 C ATOM 1074 C GLU A 83 35.132 15.302 20.386 1.00 0.00 C ATOM 1075 O GLU A 83 36.331 15.264 20.118 1.00 0.00 O ATOM 1076 CB GLU A 83 33.921 13.235 20.768 1.00 0.00 C ATOM 1077 CG GLU A 83 33.547 12.097 21.719 1.00 0.00 C ATOM 1078 CD GLU A 83 33.064 10.883 20.939 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.157 11.021 20.075 1.00 0.00 O ATOM 1080 OE2 GLU A 83 33.591 9.767 21.195 1.00 0.00 O ATOM 0 H GLU A 83 32.654 14.767 22.270 1.00 0.00 H new ATOM 0 HA GLU A 83 35.292 14.160 22.178 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.030 13.544 20.222 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.632 12.859 20.032 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.410 11.825 22.327 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.767 12.430 22.404 1.00 0.00 H new ATOM 1087 N THR A 84 34.290 16.137 19.751 1.00 0.00 N ATOM 1088 CA THR A 84 34.647 17.049 18.710 1.00 0.00 C ATOM 1089 C THR A 84 35.548 18.142 19.176 1.00 0.00 C ATOM 1090 O THR A 84 36.491 18.521 18.484 1.00 0.00 O ATOM 1091 CB THR A 84 33.404 17.596 18.074 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.645 16.547 17.492 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.706 18.585 16.936 1.00 0.00 C ATOM 0 H THR A 84 33.297 16.177 19.980 1.00 0.00 H new ATOM 0 HA THR A 84 35.219 16.495 17.966 1.00 0.00 H new ATOM 0 HB THR A 84 32.864 18.103 18.873 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.077 16.135 18.177 1.00 0.00 H new ATOM 0 HG21 THR A 84 32.770 18.949 16.512 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.279 19.426 17.327 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.284 18.082 16.161 1.00 0.00 H new ATOM 1101 N LEU A 85 35.336 18.681 20.390 1.00 0.00 N ATOM 1102 CA LEU A 85 36.211 19.622 21.017 1.00 0.00 C ATOM 1103 C LEU A 85 37.486 19.028 21.508 1.00 0.00 C ATOM 1104 O LEU A 85 38.530 19.676 21.508 1.00 0.00 O ATOM 1105 CB LEU A 85 35.489 20.296 22.197 1.00 0.00 C ATOM 1106 CG LEU A 85 34.327 21.214 21.783 1.00 0.00 C ATOM 1107 CD1 LEU A 85 33.383 21.451 22.974 1.00 0.00 C ATOM 1108 CD2 LEU A 85 34.819 22.557 21.218 1.00 0.00 C ATOM 0 H LEU A 85 34.521 18.451 20.958 1.00 0.00 H new ATOM 0 HA LEU A 85 36.475 20.347 20.247 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.107 19.523 22.864 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.213 20.879 22.766 1.00 0.00 H new ATOM 0 HG LEU A 85 33.783 20.707 20.986 1.00 0.00 H new ATOM 0 HD11 LEU A 85 32.565 22.103 22.666 1.00 0.00 H new ATOM 0 HD12 LEU A 85 32.979 20.497 23.313 1.00 0.00 H new ATOM 0 HD13 LEU A 85 33.935 21.921 23.788 1.00 0.00 H new ATOM 0 HD21 LEU A 85 33.962 23.171 20.940 1.00 0.00 H new ATOM 0 HD22 LEU A 85 35.407 23.077 21.975 1.00 0.00 H new ATOM 0 HD23 LEU A 85 35.437 22.377 20.338 1.00 0.00 H new ATOM 1120 N ARG A 86 37.475 17.751 21.933 1.00 0.00 N ATOM 1121 CA ARG A 86 38.634 17.003 22.310 1.00 0.00 C ATOM 1122 C ARG A 86 39.519 16.684 21.154 1.00 0.00 C ATOM 1123 O ARG A 86 40.738 16.824 21.236 1.00 0.00 O ATOM 1124 CB ARG A 86 38.248 15.726 23.075 1.00 0.00 C ATOM 1125 CG ARG A 86 38.667 15.677 24.546 1.00 0.00 C ATOM 1126 CD ARG A 86 38.001 16.644 25.526 1.00 0.00 C ATOM 1127 NE ARG A 86 38.548 18.025 25.410 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.788 18.426 25.817 1.00 0.00 C ATOM 1129 NH1 ARG A 86 40.685 17.576 26.398 1.00 0.00 N ATOM 1130 NH2 ARG A 86 40.167 19.729 25.675 1.00 0.00 N ATOM 0 H ARG A 86 36.612 17.213 22.018 1.00 0.00 H new ATOM 0 HA ARG A 86 39.210 17.645 22.977 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.166 15.606 23.021 1.00 0.00 H new ATOM 0 HB3 ARG A 86 38.689 14.871 22.563 1.00 0.00 H new ATOM 0 HG2 ARG A 86 38.490 14.664 24.908 1.00 0.00 H new ATOM 0 HG3 ARG A 86 39.743 15.848 24.590 1.00 0.00 H new ATOM 0 HD2 ARG A 86 36.927 16.663 25.342 1.00 0.00 H new ATOM 0 HD3 ARG A 86 38.143 16.283 26.544 1.00 0.00 H new ATOM 0 HE ARG A 86 37.944 18.732 24.990 1.00 0.00 H new ATOM 0 HH11 ARG A 86 40.439 16.597 26.543 1.00 0.00 H new ATOM 0 HH12 ARG A 86 41.601 17.920 26.686 1.00 0.00 H new ATOM 0 HH21 ARG A 86 39.524 20.405 25.264 1.00 0.00 H new ATOM 0 HH22 ARG A 86 41.094 20.027 25.980 1.00 0.00 H new ATOM 1144 N ASN A 87 38.948 16.289 20.002 1.00 0.00 N ATOM 1145 CA ASN A 87 39.641 16.059 18.773 1.00 0.00 C ATOM 1146 C ASN A 87 39.941 17.338 18.070 1.00 0.00 C ATOM 1147 O ASN A 87 39.565 17.602 16.931 1.00 0.00 O ATOM 1148 CB ASN A 87 38.855 15.063 17.903 1.00 0.00 C ATOM 1149 CG ASN A 87 39.747 14.331 16.911 1.00 0.00 C ATOM 1150 OD1 ASN A 87 40.325 14.910 15.993 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.881 12.988 17.074 1.00 0.00 N ATOM 0 H ASN A 87 37.945 16.121 19.925 1.00 0.00 H new ATOM 0 HA ASN A 87 40.609 15.606 18.989 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.358 14.336 18.546 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.074 15.596 17.361 1.00 0.00 H new ATOM 0 HD21 ASN A 87 40.465 12.452 16.432 1.00 0.00 H new ATOM 0 HD22 ASN A 87 39.398 12.516 17.838 1.00 0.00 H new ATOM 1158 N THR A 88 40.677 18.220 18.771 1.00 0.00 N ATOM 1159 CA THR A 88 41.266 19.437 18.307 1.00 0.00 C ATOM 1160 C THR A 88 42.741 19.252 18.209 1.00 0.00 C ATOM 1161 O THR A 88 43.351 18.581 19.041 1.00 0.00 O ATOM 1162 CB THR A 88 40.980 20.606 19.202 1.00 0.00 C ATOM 1163 OG1 THR A 88 41.132 20.294 20.580 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.534 21.088 19.001 1.00 0.00 C ATOM 0 H THR A 88 40.877 18.062 19.759 1.00 0.00 H new ATOM 0 HA THR A 88 40.826 19.660 17.335 1.00 0.00 H new ATOM 0 HB THR A 88 41.702 21.376 18.930 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.256 20.086 20.967 1.00 0.00 H new ATOM 0 HG21 THR A 88 39.339 21.937 19.656 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.392 21.391 17.963 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.844 20.279 19.240 1.00 0.00 H new ATOM 1172 N GLY A 89 43.386 19.861 17.198 1.00 0.00 N ATOM 1173 CA GLY A 89 44.811 19.883 17.077 1.00 0.00 C ATOM 1174 C GLY A 89 45.415 21.045 17.787 1.00 0.00 C ATOM 1175 O GLY A 89 44.971 21.436 18.866 1.00 0.00 O ATOM 0 H GLY A 89 42.904 20.351 16.445 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.223 18.958 17.480 1.00 0.00 H new ATOM 0 HA3 GLY A 89 45.084 19.921 16.023 1.00 0.00 H new ATOM 1179 N GLN A 90 46.462 21.647 17.196 1.00 0.00 N ATOM 1180 CA GLN A 90 47.104 22.840 17.655 1.00 0.00 C ATOM 1181 C GLN A 90 46.201 24.025 17.661 1.00 0.00 C ATOM 1182 O GLN A 90 46.006 24.660 18.696 1.00 0.00 O ATOM 1183 CB GLN A 90 48.324 23.140 16.766 1.00 0.00 C ATOM 1184 CG GLN A 90 49.127 24.385 17.145 1.00 0.00 C ATOM 1185 CD GLN A 90 50.279 24.607 16.175 1.00 0.00 C ATOM 1186 OE1 GLN A 90 51.163 23.765 16.016 1.00 0.00 O ATOM 1187 NE2 GLN A 90 50.295 25.777 15.483 1.00 0.00 N ATOM 0 H GLN A 90 46.886 21.278 16.345 1.00 0.00 H new ATOM 0 HA GLN A 90 47.406 22.660 18.687 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.991 22.278 16.792 1.00 0.00 H new ATOM 0 HB3 GLN A 90 47.983 23.249 15.736 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.474 25.257 17.145 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.515 24.277 18.158 1.00 0.00 H new ATOM 0 HE21 GLN A 90 49.555 26.464 15.626 1.00 0.00 H new ATOM 0 HE22 GLN A 90 51.047 25.967 14.821 1.00 0.00 H new ATOM 1196 N VAL A 91 45.628 24.362 16.493 1.00 0.00 N ATOM 1197 CA VAL A 91 44.709 25.445 16.325 1.00 0.00 C ATOM 1198 C VAL A 91 43.311 24.935 16.244 1.00 0.00 C ATOM 1199 O VAL A 91 43.027 23.852 15.733 1.00 0.00 O ATOM 1200 CB VAL A 91 45.082 26.323 15.168 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.972 25.592 13.819 1.00 0.00 C ATOM 1202 CG2 VAL A 91 44.276 27.633 15.157 1.00 0.00 C ATOM 0 H VAL A 91 45.813 23.857 15.626 1.00 0.00 H new ATOM 0 HA VAL A 91 44.767 26.084 17.206 1.00 0.00 H new ATOM 0 HB VAL A 91 46.131 26.583 15.308 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.253 26.271 13.013 1.00 0.00 H new ATOM 0 HG12 VAL A 91 45.640 24.730 13.817 1.00 0.00 H new ATOM 0 HG13 VAL A 91 43.946 25.256 13.670 1.00 0.00 H new ATOM 0 HG21 VAL A 91 44.578 28.239 14.303 1.00 0.00 H new ATOM 0 HG22 VAL A 91 43.213 27.405 15.083 1.00 0.00 H new ATOM 0 HG23 VAL A 91 44.465 28.185 16.078 1.00 0.00 H new ATOM 1212 N VAL A 92 42.379 25.697 16.844 1.00 0.00 N ATOM 1213 CA VAL A 92 41.004 25.387 17.088 1.00 0.00 C ATOM 1214 C VAL A 92 40.149 26.448 16.485 1.00 0.00 C ATOM 1215 O VAL A 92 40.144 27.587 16.947 1.00 0.00 O ATOM 1216 CB VAL A 92 40.782 25.364 18.572 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.316 25.040 18.909 1.00 0.00 C ATOM 1218 CG2 VAL A 92 41.694 24.266 19.144 1.00 0.00 C ATOM 0 H VAL A 92 42.616 26.626 17.193 1.00 0.00 H new ATOM 0 HA VAL A 92 40.751 24.421 16.651 1.00 0.00 H new ATOM 0 HB VAL A 92 41.009 26.341 18.999 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.185 25.030 19.991 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.666 25.798 18.472 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.057 24.062 18.503 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.566 24.213 20.225 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.431 23.306 18.700 1.00 0.00 H new ATOM 0 HG23 VAL A 92 42.733 24.500 18.913 1.00 0.00 H new ATOM 1228 N HIS A 93 39.373 26.128 15.433 1.00 0.00 N ATOM 1229 CA HIS A 93 38.475 27.071 14.843 1.00 0.00 C ATOM 1230 C HIS A 93 37.086 26.900 15.353 1.00 0.00 C ATOM 1231 O HIS A 93 36.403 25.931 15.024 1.00 0.00 O ATOM 1232 CB HIS A 93 38.475 27.001 13.307 1.00 0.00 C ATOM 1233 CG HIS A 93 37.832 28.179 12.636 1.00 0.00 C ATOM 1234 ND1 HIS A 93 37.694 28.292 11.268 1.00 0.00 N ATOM 1235 CD2 HIS A 93 37.342 29.341 13.149 1.00 0.00 C ATOM 1236 CE1 HIS A 93 37.124 29.502 11.024 1.00 0.00 C ATOM 1237 NE2 HIS A 93 36.891 30.166 12.140 1.00 0.00 N ATOM 0 H HIS A 93 39.369 25.210 14.989 1.00 0.00 H new ATOM 0 HA HIS A 93 38.840 28.055 15.136 1.00 0.00 H new ATOM 0 HB2 HIS A 93 39.504 26.916 12.959 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.958 26.093 12.996 1.00 0.00 H new ATOM 0 HD1 HIS A 93 37.968 27.599 10.571 1.00 0.00 H new ATOM 0 HD2 HIS A 93 37.311 29.583 14.201 1.00 0.00 H new ATOM 0 HE1 HIS A 93 36.891 29.874 10.037 1.00 0.00 H new ATOM 1245 N LEU A 94 36.601 27.835 16.190 1.00 0.00 N ATOM 1246 CA LEU A 94 35.246 27.882 16.643 1.00 0.00 C ATOM 1247 C LEU A 94 34.445 28.957 15.992 1.00 0.00 C ATOM 1248 O LEU A 94 34.931 30.059 15.741 1.00 0.00 O ATOM 1249 CB LEU A 94 35.122 28.157 18.152 1.00 0.00 C ATOM 1250 CG LEU A 94 35.989 27.264 19.057 1.00 0.00 C ATOM 1251 CD1 LEU A 94 35.801 27.698 20.519 1.00 0.00 C ATOM 1252 CD2 LEU A 94 35.648 25.775 18.874 1.00 0.00 C ATOM 0 H LEU A 94 37.177 28.588 16.566 1.00 0.00 H new ATOM 0 HA LEU A 94 34.870 26.892 16.384 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.385 29.198 18.338 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.078 28.035 18.442 1.00 0.00 H new ATOM 0 HG LEU A 94 37.035 27.385 18.775 1.00 0.00 H new ATOM 0 HD11 LEU A 94 36.412 27.070 21.167 1.00 0.00 H new ATOM 0 HD12 LEU A 94 36.105 28.739 20.631 1.00 0.00 H new ATOM 0 HD13 LEU A 94 34.752 27.594 20.797 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.279 25.174 19.528 1.00 0.00 H new ATOM 0 HD22 LEU A 94 34.601 25.608 19.126 1.00 0.00 H new ATOM 0 HD23 LEU A 94 35.822 25.487 17.837 1.00 0.00 H new ATOM 1264 N LEU A 95 33.142 28.697 15.781 1.00 0.00 N ATOM 1265 CA LEU A 95 32.163 29.702 15.505 1.00 0.00 C ATOM 1266 C LEU A 95 31.180 29.701 16.625 1.00 0.00 C ATOM 1267 O LEU A 95 30.613 28.660 16.955 1.00 0.00 O ATOM 1268 CB LEU A 95 31.426 29.433 14.183 1.00 0.00 C ATOM 1269 CG LEU A 95 30.261 30.377 13.840 1.00 0.00 C ATOM 1270 CD1 LEU A 95 30.699 31.841 13.664 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.549 29.892 12.566 1.00 0.00 C ATOM 0 H LEU A 95 32.757 27.753 15.803 1.00 0.00 H new ATOM 0 HA LEU A 95 32.662 30.667 15.412 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.153 29.480 13.372 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.042 28.413 14.208 1.00 0.00 H new ATOM 0 HG LEU A 95 29.578 30.350 14.689 1.00 0.00 H new ATOM 0 HD11 LEU A 95 29.831 32.454 13.423 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.151 32.199 14.589 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.426 31.908 12.855 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.725 30.566 12.330 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.256 29.879 11.737 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.160 28.887 12.727 1.00 0.00 H new ATOM 1283 N LEU A 96 30.928 30.863 17.255 1.00 0.00 N ATOM 1284 CA LEU A 96 29.987 30.925 18.331 1.00 0.00 C ATOM 1285 C LEU A 96 29.282 32.237 18.347 1.00 0.00 C ATOM 1286 O LEU A 96 29.682 33.187 17.676 1.00 0.00 O ATOM 1287 CB LEU A 96 30.627 30.522 19.669 1.00 0.00 C ATOM 1288 CG LEU A 96 31.390 31.589 20.473 1.00 0.00 C ATOM 1289 CD1 LEU A 96 30.466 32.261 21.502 1.00 0.00 C ATOM 1290 CD2 LEU A 96 32.601 30.952 21.177 1.00 0.00 C ATOM 0 H LEU A 96 31.371 31.752 17.022 1.00 0.00 H new ATOM 0 HA LEU A 96 29.209 30.180 18.164 1.00 0.00 H new ATOM 0 HB2 LEU A 96 29.837 30.128 20.308 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.316 29.701 19.472 1.00 0.00 H new ATOM 0 HG LEU A 96 31.744 32.355 19.783 1.00 0.00 H new ATOM 0 HD11 LEU A 96 31.027 33.012 22.059 1.00 0.00 H new ATOM 0 HD12 LEU A 96 29.633 32.739 20.986 1.00 0.00 H new ATOM 0 HD13 LEU A 96 30.082 31.509 22.192 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.135 31.715 21.744 1.00 0.00 H new ATOM 0 HD22 LEU A 96 32.258 30.170 21.855 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.269 30.519 20.432 1.00 0.00 H new ATOM 1302 N GLU A 97 28.155 32.315 19.079 1.00 0.00 N ATOM 1303 CA GLU A 97 27.322 33.475 19.153 1.00 0.00 C ATOM 1304 C GLU A 97 27.139 33.947 20.555 1.00 0.00 C ATOM 1305 O GLU A 97 26.982 33.158 21.483 1.00 0.00 O ATOM 1306 CB GLU A 97 25.937 33.176 18.556 1.00 0.00 C ATOM 1307 CG GLU A 97 25.062 34.412 18.338 1.00 0.00 C ATOM 1308 CD GLU A 97 23.830 34.118 17.494 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.980 33.738 16.302 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.688 34.281 18.002 1.00 0.00 O ATOM 0 H GLU A 97 27.811 31.537 19.642 1.00 0.00 H new ATOM 0 HA GLU A 97 27.823 34.258 18.584 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.069 32.666 17.602 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.412 32.486 19.216 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.749 34.806 19.305 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.653 35.189 17.853 1.00 0.00 H new ATOM 1317 N LYS A 98 27.092 35.280 20.731 1.00 0.00 N ATOM 1318 CA LYS A 98 26.808 35.949 21.963 1.00 0.00 C ATOM 1319 C LYS A 98 25.349 35.843 22.253 1.00 0.00 C ATOM 1320 O LYS A 98 24.501 36.379 21.543 1.00 0.00 O ATOM 1321 CB LYS A 98 27.164 37.442 21.878 1.00 0.00 C ATOM 1322 CG LYS A 98 27.317 38.137 23.234 1.00 0.00 C ATOM 1323 CD LYS A 98 28.695 37.892 23.851 1.00 0.00 C ATOM 1324 CE LYS A 98 28.765 38.018 25.374 1.00 0.00 C ATOM 1325 NZ LYS A 98 28.402 39.361 25.876 1.00 0.00 N ATOM 0 H LYS A 98 27.263 35.931 19.964 1.00 0.00 H new ATOM 0 HA LYS A 98 27.403 35.480 22.747 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.095 37.549 21.322 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.391 37.955 21.306 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.160 39.209 23.112 1.00 0.00 H new ATOM 0 HG3 LYS A 98 26.546 37.777 23.915 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.027 36.892 23.571 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.401 38.597 23.412 1.00 0.00 H new ATOM 0 HE2 LYS A 98 28.099 37.280 25.822 1.00 0.00 H new ATOM 0 HE3 LYS A 98 29.776 37.777 25.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 28.471 39.374 26.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 29.052 40.068 25.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 27.427 39.586 25.591 1.00 0.00 H new ATOM 1339 N GLY A 99 25.043 35.087 23.323 1.00 0.00 N ATOM 1340 CA GLY A 99 23.811 34.422 23.618 1.00 0.00 C ATOM 1341 C GLY A 99 22.515 35.122 23.393 1.00 0.00 C ATOM 1342 O GLY A 99 22.345 36.292 23.729 1.00 0.00 O ATOM 0 H GLY A 99 25.733 34.927 24.057 1.00 0.00 H new ATOM 0 HA2 GLY A 99 23.790 33.504 23.031 1.00 0.00 H new ATOM 0 HA3 GLY A 99 23.844 34.129 24.667 1.00 0.00 H new ATOM 1346 N GLN A 100 21.549 34.371 22.834 1.00 0.00 N ATOM 1347 CA GLN A 100 20.192 34.712 22.534 1.00 0.00 C ATOM 1348 C GLN A 100 19.342 35.089 23.698 1.00 0.00 C ATOM 1349 O GLN A 100 19.809 35.379 24.799 1.00 0.00 O ATOM 1350 CB GLN A 100 19.603 33.508 21.781 1.00 0.00 C ATOM 1351 CG GLN A 100 18.661 33.844 20.623 1.00 0.00 C ATOM 1352 CD GLN A 100 18.544 32.680 19.650 1.00 0.00 C ATOM 1353 OE1 GLN A 100 19.336 32.529 18.722 1.00 0.00 O ATOM 1354 NE2 GLN A 100 17.532 31.795 19.853 1.00 0.00 N ATOM 0 H GLN A 100 21.747 33.409 22.561 1.00 0.00 H new ATOM 0 HA GLN A 100 20.198 35.625 21.939 1.00 0.00 H new ATOM 0 HB2 GLN A 100 20.426 32.908 21.393 1.00 0.00 H new ATOM 0 HB3 GLN A 100 19.064 32.885 22.495 1.00 0.00 H new ATOM 0 HG2 GLN A 100 17.675 34.094 21.014 1.00 0.00 H new ATOM 0 HG3 GLN A 100 19.028 34.725 20.097 1.00 0.00 H new ATOM 0 HE21 GLN A 100 16.882 31.932 20.627 1.00 0.00 H new ATOM 0 HE22 GLN A 100 17.423 30.994 19.231 1.00 0.00 H new ATOM 1363 N VAL A 101 18.009 35.125 23.526 1.00 0.00 N ATOM 1364 CA VAL A 101 17.061 35.264 24.587 1.00 0.00 C ATOM 1365 C VAL A 101 16.066 34.177 24.366 1.00 0.00 C ATOM 1366 O VAL A 101 15.718 33.976 23.204 1.00 0.00 O ATOM 1367 CB VAL A 101 16.467 36.640 24.640 1.00 0.00 C ATOM 1368 CG1 VAL A 101 15.669 37.006 23.377 1.00 0.00 C ATOM 1369 CG2 VAL A 101 15.624 36.813 25.916 1.00 0.00 C ATOM 0 H VAL A 101 17.573 35.054 22.607 1.00 0.00 H new ATOM 0 HA VAL A 101 17.521 35.160 25.569 1.00 0.00 H new ATOM 0 HB VAL A 101 17.299 37.344 24.674 1.00 0.00 H new ATOM 0 HG11 VAL A 101 15.266 38.014 23.480 1.00 0.00 H new ATOM 0 HG12 VAL A 101 16.325 36.965 22.507 1.00 0.00 H new ATOM 0 HG13 VAL A 101 14.849 36.299 23.247 1.00 0.00 H new ATOM 0 HG21 VAL A 101 15.200 37.817 25.939 1.00 0.00 H new ATOM 0 HG22 VAL A 101 14.818 36.079 25.922 1.00 0.00 H new ATOM 0 HG23 VAL A 101 16.256 36.666 26.792 1.00 0.00 H new ATOM 1379 N PRO A 102 15.593 33.409 25.303 1.00 0.00 N ATOM 1380 CA PRO A 102 14.678 32.343 25.014 1.00 0.00 C ATOM 1381 C PRO A 102 13.303 32.822 24.703 1.00 0.00 C ATOM 1382 O PRO A 102 12.685 33.579 25.497 1.00 0.00 O ATOM 1383 CB PRO A 102 14.708 31.441 26.246 1.00 0.00 C ATOM 1384 CG PRO A 102 15.244 32.330 27.379 1.00 0.00 C ATOM 1385 CD PRO A 102 16.185 33.286 26.626 1.00 0.00 C ATOM 1386 OXT PRO A 102 12.755 32.432 23.636 1.00 0.00 O ATOM 0 HA PRO A 102 14.978 31.808 24.113 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.714 31.060 26.480 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.351 30.576 26.086 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.443 32.865 27.890 1.00 0.00 H new ATOM 0 HG3 PRO A 102 15.773 31.750 28.136 1.00 0.00 H new ATOM 0 HD2 PRO A 102 16.250 34.254 27.124 1.00 0.00 H new ATOM 0 HD3 PRO A 102 17.198 32.886 26.573 1.00 0.00 H new TER 1394 PRO A 102