USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 771 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 30 CYS SG : rot 131:sc= 0.427! USER MOD Set 1.2: A 62 CYS SG : rot 120:sc=-0.00579 USER MOD Set 1.3: A 79 CYS SG : rot 18:sc= 0.222 USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0.00684 USER MOD Set 2.2: A 65 GLN : amide:sc= 0.00656 X(o=0.013,f=-0.00024) USER MOD Set 3.1: A 9 SER OG : rot 114:sc= 1.22 USER MOD Set 3.2: A 81 CYS SG : rot -22:sc= -0.0993 USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0475 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 32:sc= 0.992 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= -1.07! C(o=-1.1!,f=-3.6!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 17:sc= 0.435! USER MOD Single : A 34 LYS NZ :NH3+ -168:sc= -0.029 (180deg=-0.269) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HD1:sc= -0.0181 X(o=-0.018,f=-0.22) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HE2:sc= -7.44! C(o=-7.4!,f=-14!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -2.83! C(o=-2.8!,f=-9.5!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -7:sc= -1.22 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc=-0.00261 X(o=-0.0026,f=0.33) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.191 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.192 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.714 39.420 -6.216 1.00 0.00 N ATOM 2 CA GLY A 1 -1.787 38.938 -7.066 1.00 0.00 C ATOM 3 C GLY A 1 -2.822 38.140 -6.298 1.00 0.00 C ATOM 4 O GLY A 1 -2.526 37.580 -5.243 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.757 40.457 -6.157 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.817 39.014 -5.264 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.202 39.134 -6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.272 39.786 -7.549 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.368 38.317 -7.858 1.00 0.00 H new ATOM 8 N SER A 2 -4.040 38.090 -6.827 1.00 0.00 N ATOM 9 CA SER A 2 -5.124 37.360 -6.181 1.00 0.00 C ATOM 10 C SER A 2 -4.901 35.854 -6.282 1.00 0.00 C ATOM 11 O SER A 2 -4.363 35.360 -7.273 1.00 0.00 O ATOM 12 CB SER A 2 -6.467 37.731 -6.814 1.00 0.00 C ATOM 13 OG SER A 2 -6.611 37.133 -8.091 1.00 0.00 O ATOM 0 H SER A 2 -4.301 38.546 -7.701 1.00 0.00 H new ATOM 0 HA SER A 2 -5.138 37.638 -5.127 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.280 37.409 -6.164 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.543 38.815 -6.906 1.00 0.00 H new ATOM 0 HG SER A 2 -7.478 37.384 -8.474 1.00 0.00 H new ATOM 19 N SER A 3 -5.318 35.129 -5.248 1.00 0.00 N ATOM 20 CA SER A 3 -5.161 33.680 -5.218 1.00 0.00 C ATOM 21 C SER A 3 -6.071 33.057 -4.164 1.00 0.00 C ATOM 22 O SER A 3 -6.513 33.729 -3.233 1.00 0.00 O ATOM 23 CB SER A 3 -3.704 33.310 -4.932 1.00 0.00 C ATOM 24 OG SER A 3 -3.259 33.889 -3.718 1.00 0.00 O ATOM 0 H SER A 3 -5.767 35.522 -4.421 1.00 0.00 H new ATOM 0 HA SER A 3 -5.444 33.288 -6.195 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.605 32.226 -4.879 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.072 33.648 -5.753 1.00 0.00 H new ATOM 0 HG SER A 3 -2.326 33.636 -3.558 1.00 0.00 H new ATOM 30 N GLY A 4 -6.348 31.766 -4.319 1.00 0.00 N ATOM 31 CA GLY A 4 -7.204 31.072 -3.375 1.00 0.00 C ATOM 32 C GLY A 4 -6.446 30.576 -2.160 1.00 0.00 C ATOM 33 O GLY A 4 -6.012 31.368 -1.324 1.00 0.00 O ATOM 0 H GLY A 4 -5.995 31.188 -5.082 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.002 31.741 -3.053 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.678 30.227 -3.873 1.00 0.00 H new ATOM 37 N SER A 5 -6.286 29.260 -2.061 1.00 0.00 N ATOM 38 CA SER A 5 -5.579 28.658 -0.936 1.00 0.00 C ATOM 39 C SER A 5 -4.125 29.118 -0.900 1.00 0.00 C ATOM 40 O SER A 5 -3.586 29.589 -1.901 1.00 0.00 O ATOM 41 CB SER A 5 -5.642 27.132 -1.024 1.00 0.00 C ATOM 42 OG SER A 5 -6.807 26.632 -0.392 1.00 0.00 O ATOM 0 H SER A 5 -6.636 28.590 -2.746 1.00 0.00 H new ATOM 0 HA SER A 5 -6.067 28.981 -0.017 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.631 26.824 -2.070 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.757 26.701 -0.556 1.00 0.00 H new ATOM 0 HG SER A 5 -6.824 25.655 -0.464 1.00 0.00 H new ATOM 48 N SER A 6 -3.495 28.977 0.262 1.00 0.00 N ATOM 49 CA SER A 6 -2.104 29.381 0.431 1.00 0.00 C ATOM 50 C SER A 6 -1.243 28.197 0.863 1.00 0.00 C ATOM 51 O SER A 6 -1.335 27.729 1.997 1.00 0.00 O ATOM 52 CB SER A 6 -1.999 30.505 1.464 1.00 0.00 C ATOM 53 OG SER A 6 -2.361 30.047 2.755 1.00 0.00 O ATOM 0 H SER A 6 -3.926 28.586 1.100 1.00 0.00 H new ATOM 0 HA SER A 6 -1.738 29.744 -0.529 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.980 30.890 1.484 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.647 31.332 1.173 1.00 0.00 H new ATOM 0 HG SER A 6 -2.119 29.102 2.846 1.00 0.00 H new ATOM 59 N GLY A 7 -0.407 27.717 -0.052 1.00 0.00 N ATOM 60 CA GLY A 7 0.458 26.592 0.251 1.00 0.00 C ATOM 61 C GLY A 7 -0.320 25.321 0.532 1.00 0.00 C ATOM 62 O GLY A 7 -0.477 24.905 1.680 1.00 0.00 O ATOM 0 H GLY A 7 -0.313 28.087 -0.998 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.135 26.422 -0.586 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.075 26.835 1.116 1.00 0.00 H new ATOM 66 N PRO A 8 -0.823 24.683 -0.535 1.00 0.00 N ATOM 67 CA PRO A 8 -1.598 23.444 -0.423 1.00 0.00 C ATOM 68 C PRO A 8 -0.739 22.259 0.002 1.00 0.00 C ATOM 69 O PRO A 8 0.405 22.429 0.425 1.00 0.00 O ATOM 70 CB PRO A 8 -2.136 23.233 -1.841 1.00 0.00 C ATOM 71 CG PRO A 8 -1.167 23.942 -2.723 1.00 0.00 C ATOM 72 CD PRO A 8 -0.674 25.122 -1.933 1.00 0.00 C ATOM 0 HA PRO A 8 -2.376 23.518 0.337 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.195 22.173 -2.089 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.141 23.641 -1.948 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.342 23.287 -3.002 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.645 24.264 -3.648 1.00 0.00 H new ATOM 0 HD2 PRO A 8 0.363 25.360 -2.171 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -1.262 26.017 -2.138 1.00 0.00 H new ATOM 80 N SER A 9 -1.296 21.058 -0.113 1.00 0.00 N ATOM 81 CA SER A 9 -0.581 19.844 0.263 1.00 0.00 C ATOM 82 C SER A 9 -0.247 19.007 -0.968 1.00 0.00 C ATOM 83 O SER A 9 -1.055 18.883 -1.888 1.00 0.00 O ATOM 84 CB SER A 9 -1.415 19.018 1.244 1.00 0.00 C ATOM 85 OG SER A 9 -2.766 18.940 0.824 1.00 0.00 O ATOM 0 H SER A 9 -2.241 20.899 -0.464 1.00 0.00 H new ATOM 0 HA SER A 9 0.351 20.136 0.746 1.00 0.00 H new ATOM 0 HB2 SER A 9 -0.998 18.014 1.326 1.00 0.00 H new ATOM 0 HB3 SER A 9 -1.365 19.466 2.236 1.00 0.00 H new ATOM 0 HG SER A 9 -2.983 18.013 0.590 1.00 0.00 H new ATOM 91 N LYS A 10 0.951 18.432 -0.978 1.00 0.00 N ATOM 92 CA LYS A 10 1.395 17.605 -2.093 1.00 0.00 C ATOM 93 C LYS A 10 2.253 16.443 -1.602 1.00 0.00 C ATOM 94 O LYS A 10 3.296 16.648 -0.981 1.00 0.00 O ATOM 95 CB LYS A 10 2.185 18.447 -3.097 1.00 0.00 C ATOM 96 CG LYS A 10 1.312 19.149 -4.123 1.00 0.00 C ATOM 97 CD LYS A 10 0.886 20.526 -3.644 1.00 0.00 C ATOM 98 CE LYS A 10 1.999 21.547 -3.819 1.00 0.00 C ATOM 99 NZ LYS A 10 2.013 22.122 -5.193 1.00 0.00 N ATOM 0 H LYS A 10 1.633 18.524 -0.225 1.00 0.00 H new ATOM 0 HA LYS A 10 0.511 17.198 -2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.766 19.193 -2.555 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.897 17.805 -3.616 1.00 0.00 H new ATOM 0 HG2 LYS A 10 1.857 19.242 -5.063 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.428 18.544 -4.325 1.00 0.00 H new ATOM 0 HD2 LYS A 10 0.005 20.849 -4.199 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.600 20.474 -2.593 1.00 0.00 H new ATOM 0 HE2 LYS A 10 1.874 22.349 -3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.960 21.076 -3.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 2.786 22.814 -5.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 2.157 21.361 -5.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 1.106 22.594 -5.381 1.00 0.00 H new ATOM 113 N PHE A 11 1.807 15.224 -1.885 1.00 0.00 N ATOM 114 CA PHE A 11 2.534 14.029 -1.472 1.00 0.00 C ATOM 115 C PHE A 11 4.034 14.203 -1.690 1.00 0.00 C ATOM 116 O PHE A 11 4.488 14.414 -2.815 1.00 0.00 O ATOM 117 CB PHE A 11 2.033 12.808 -2.246 1.00 0.00 C ATOM 118 CG PHE A 11 0.579 12.509 -2.019 1.00 0.00 C ATOM 119 CD1 PHE A 11 0.160 11.888 -0.854 1.00 0.00 C ATOM 120 CD2 PHE A 11 -0.369 12.849 -2.971 1.00 0.00 C ATOM 121 CE1 PHE A 11 -1.178 11.612 -0.641 1.00 0.00 C ATOM 122 CE2 PHE A 11 -1.708 12.576 -2.764 1.00 0.00 C ATOM 123 CZ PHE A 11 -2.113 11.956 -1.598 1.00 0.00 C ATOM 0 H PHE A 11 0.946 15.037 -2.399 1.00 0.00 H new ATOM 0 HA PHE A 11 2.354 13.874 -0.408 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.200 12.969 -3.311 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.624 11.938 -1.958 1.00 0.00 H new ATOM 0 HD1 PHE A 11 0.887 11.616 -0.103 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -0.058 13.333 -3.885 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.492 11.128 0.272 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -2.437 12.847 -3.513 1.00 0.00 H new ATOM 0 HZ PHE A 11 -3.159 11.741 -1.435 1.00 0.00 H new ATOM 133 N ILE A 12 4.798 14.114 -0.607 1.00 0.00 N ATOM 134 CA ILE A 12 6.246 14.261 -0.679 1.00 0.00 C ATOM 135 C ILE A 12 6.908 12.968 -1.144 1.00 0.00 C ATOM 136 O ILE A 12 7.555 12.932 -2.190 1.00 0.00 O ATOM 137 CB ILE A 12 6.840 14.666 0.683 1.00 0.00 C ATOM 138 CG1 ILE A 12 5.862 15.566 1.442 1.00 0.00 C ATOM 139 CG2 ILE A 12 8.175 15.369 0.491 1.00 0.00 C ATOM 140 CD1 ILE A 12 5.389 16.757 0.639 1.00 0.00 C ATOM 0 H ILE A 12 4.438 13.941 0.331 1.00 0.00 H new ATOM 0 HA ILE A 12 6.446 15.051 -1.403 1.00 0.00 H new ATOM 0 HB ILE A 12 7.008 13.765 1.272 1.00 0.00 H new ATOM 0 HG12 ILE A 12 4.997 14.975 1.744 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.341 15.921 2.355 1.00 0.00 H new ATOM 0 HG21 ILE A 12 8.582 15.649 1.463 1.00 0.00 H new ATOM 0 HG22 ILE A 12 8.870 14.698 -0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 12 8.031 16.264 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.699 17.350 1.239 1.00 0.00 H new ATOM 0 HD12 ILE A 12 6.245 17.370 0.359 1.00 0.00 H new ATOM 0 HD13 ILE A 12 4.881 16.410 -0.261 1.00 0.00 H new ATOM 152 N GLU A 13 6.738 11.908 -0.360 1.00 0.00 N ATOM 153 CA GLU A 13 7.318 10.612 -0.693 1.00 0.00 C ATOM 154 C GLU A 13 6.506 9.916 -1.782 1.00 0.00 C ATOM 155 O GLU A 13 7.062 9.265 -2.666 1.00 0.00 O ATOM 156 CB GLU A 13 7.390 9.725 0.551 1.00 0.00 C ATOM 157 CG GLU A 13 8.689 9.867 1.326 1.00 0.00 C ATOM 158 CD GLU A 13 9.887 9.346 0.556 1.00 0.00 C ATOM 159 OE1 GLU A 13 10.481 10.125 -0.217 1.00 0.00 O ATOM 160 OE2 GLU A 13 10.230 8.157 0.728 1.00 0.00 O ATOM 0 H GLU A 13 6.204 11.921 0.509 1.00 0.00 H new ATOM 0 HA GLU A 13 8.327 10.780 -1.068 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.556 9.968 1.209 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.267 8.684 0.252 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.848 10.917 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.606 9.328 2.270 1.00 0.00 H new ATOM 167 N GLY A 14 5.186 10.057 -1.708 1.00 0.00 N ATOM 168 CA GLY A 14 4.318 9.436 -2.692 1.00 0.00 C ATOM 169 C GLY A 14 4.229 7.933 -2.520 1.00 0.00 C ATOM 170 O GLY A 14 5.227 7.274 -2.225 1.00 0.00 O ATOM 0 H GLY A 14 4.702 10.590 -0.985 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.320 9.867 -2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.687 9.663 -3.692 1.00 0.00 H new ATOM 174 N LEU A 15 3.031 7.388 -2.702 1.00 0.00 N ATOM 175 CA LEU A 15 2.815 5.952 -2.564 1.00 0.00 C ATOM 176 C LEU A 15 3.725 5.171 -3.507 1.00 0.00 C ATOM 177 O LEU A 15 3.799 5.467 -4.700 1.00 0.00 O ATOM 178 CB LEU A 15 1.352 5.607 -2.846 1.00 0.00 C ATOM 179 CG LEU A 15 0.335 6.100 -1.816 1.00 0.00 C ATOM 180 CD1 LEU A 15 -1.083 5.842 -2.300 1.00 0.00 C ATOM 181 CD2 LEU A 15 0.572 5.431 -0.470 1.00 0.00 C ATOM 0 H LEU A 15 2.195 7.919 -2.945 1.00 0.00 H new ATOM 0 HA LEU A 15 3.057 5.670 -1.539 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.083 6.020 -3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 15 1.264 4.523 -2.924 1.00 0.00 H new ATOM 0 HG LEU A 15 0.464 7.175 -1.692 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.793 6.199 -1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.248 6.369 -3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.226 4.772 -2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.161 5.794 0.251 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.471 4.351 -0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.576 5.668 -0.117 1.00 0.00 H new ATOM 193 N ARG A 16 4.413 4.171 -2.965 1.00 0.00 N ATOM 194 CA ARG A 16 5.316 3.347 -3.758 1.00 0.00 C ATOM 195 C ARG A 16 4.770 1.930 -3.906 1.00 0.00 C ATOM 196 O ARG A 16 3.824 1.544 -3.222 1.00 0.00 O ATOM 197 CB ARG A 16 6.703 3.306 -3.112 1.00 0.00 C ATOM 198 CG ARG A 16 6.752 2.496 -1.827 1.00 0.00 C ATOM 199 CD ARG A 16 8.156 2.464 -1.242 1.00 0.00 C ATOM 200 NE ARG A 16 8.237 1.607 -0.062 1.00 0.00 N ATOM 201 CZ ARG A 16 9.365 1.375 0.601 1.00 0.00 C ATOM 202 NH1 ARG A 16 10.499 1.934 0.202 1.00 0.00 N ATOM 203 NH2 ARG A 16 9.359 0.584 1.666 1.00 0.00 N ATOM 0 H ARG A 16 4.362 3.912 -1.980 1.00 0.00 H new ATOM 0 HA ARG A 16 5.397 3.792 -4.750 1.00 0.00 H new ATOM 0 HB2 ARG A 16 7.414 2.886 -3.824 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.027 4.325 -2.902 1.00 0.00 H new ATOM 0 HG2 ARG A 16 6.063 2.924 -1.099 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.415 1.478 -2.024 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.856 2.107 -1.998 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.462 3.476 -0.977 1.00 0.00 H new ATOM 0 HE ARG A 16 7.381 1.163 0.271 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.507 2.544 -0.616 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.363 1.754 0.713 1.00 0.00 H new ATOM 0 HH21 ARG A 16 8.488 0.153 1.977 1.00 0.00 H new ATOM 0 HH22 ARG A 16 10.225 0.406 2.174 1.00 0.00 H new ATOM 217 N ASN A 17 5.374 1.160 -4.806 1.00 0.00 N ATOM 218 CA ASN A 17 4.948 -0.214 -5.045 1.00 0.00 C ATOM 219 C ASN A 17 5.061 -1.048 -3.773 1.00 0.00 C ATOM 220 O ASN A 17 6.160 -1.399 -3.345 1.00 0.00 O ATOM 221 CB ASN A 17 5.788 -0.844 -6.158 1.00 0.00 C ATOM 222 CG ASN A 17 7.215 -1.116 -5.721 1.00 0.00 C ATOM 223 OD1 ASN A 17 7.819 -0.318 -5.004 1.00 0.00 O ATOM 224 ND2 ASN A 17 7.761 -2.246 -6.154 1.00 0.00 N ATOM 0 H ASN A 17 6.159 1.464 -5.381 1.00 0.00 H new ATOM 0 HA ASN A 17 3.903 -0.195 -5.354 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.324 -1.778 -6.476 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.796 -0.181 -7.023 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.719 -2.482 -5.894 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.223 -2.878 -6.747 1.00 0.00 H new ATOM 231 N GLU A 18 3.916 -1.362 -3.174 1.00 0.00 N ATOM 232 CA GLU A 18 3.887 -2.155 -1.950 1.00 0.00 C ATOM 233 C GLU A 18 3.687 -3.634 -2.265 1.00 0.00 C ATOM 234 O GLU A 18 2.613 -4.045 -2.703 1.00 0.00 O ATOM 235 CB GLU A 18 2.773 -1.663 -1.024 1.00 0.00 C ATOM 236 CG GLU A 18 2.800 -2.303 0.354 1.00 0.00 C ATOM 237 CD GLU A 18 3.670 -1.540 1.334 1.00 0.00 C ATOM 238 OE1 GLU A 18 4.893 -1.788 1.359 1.00 0.00 O ATOM 239 OE2 GLU A 18 3.127 -0.696 2.077 1.00 0.00 O ATOM 0 H GLU A 18 2.997 -1.080 -3.516 1.00 0.00 H new ATOM 0 HA GLU A 18 4.846 -2.036 -1.447 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.854 -0.582 -0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 18 1.809 -1.865 -1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.784 -2.360 0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.167 -3.326 0.268 1.00 0.00 H new ATOM 246 N GLU A 19 4.729 -4.428 -2.038 1.00 0.00 N ATOM 247 CA GLU A 19 4.667 -5.861 -2.299 1.00 0.00 C ATOM 248 C GLU A 19 4.536 -6.646 -0.997 1.00 0.00 C ATOM 249 O GLU A 19 5.415 -6.595 -0.138 1.00 0.00 O ATOM 250 CB GLU A 19 5.914 -6.318 -3.059 1.00 0.00 C ATOM 251 CG GLU A 19 6.134 -7.821 -3.020 1.00 0.00 C ATOM 252 CD GLU A 19 6.634 -8.302 -1.672 1.00 0.00 C ATOM 253 OE1 GLU A 19 7.576 -7.683 -1.133 1.00 0.00 O ATOM 254 OE2 GLU A 19 6.084 -9.297 -1.156 1.00 0.00 O ATOM 0 H GLU A 19 5.625 -4.103 -1.674 1.00 0.00 H new ATOM 0 HA GLU A 19 3.786 -6.055 -2.911 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.834 -5.998 -4.098 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.788 -5.820 -2.639 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.199 -8.328 -3.258 1.00 0.00 H new ATOM 0 HG3 GLU A 19 6.853 -8.099 -3.791 1.00 0.00 H new ATOM 261 N ALA A 20 3.430 -7.371 -0.859 1.00 0.00 N ATOM 262 CA ALA A 20 3.184 -8.168 0.336 1.00 0.00 C ATOM 263 C ALA A 20 2.741 -9.581 -0.028 1.00 0.00 C ATOM 264 O ALA A 20 2.603 -9.917 -1.205 1.00 0.00 O ATOM 265 CB ALA A 20 2.138 -7.495 1.212 1.00 0.00 C ATOM 0 H ALA A 20 2.691 -7.422 -1.560 1.00 0.00 H new ATOM 0 HA ALA A 20 4.118 -8.240 0.893 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.964 -8.101 2.101 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.493 -6.508 1.509 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.207 -7.393 0.654 1.00 0.00 H new ATOM 271 N THR A 21 2.522 -10.408 0.990 1.00 0.00 N ATOM 272 CA THR A 21 2.097 -11.786 0.777 1.00 0.00 C ATOM 273 C THR A 21 0.593 -11.934 0.972 1.00 0.00 C ATOM 274 O THR A 21 0.001 -11.275 1.827 1.00 0.00 O ATOM 275 CB THR A 21 2.825 -12.752 1.731 1.00 0.00 C ATOM 276 OG1 THR A 21 4.217 -12.422 1.795 1.00 0.00 O ATOM 277 CG2 THR A 21 2.661 -14.193 1.272 1.00 0.00 C ATOM 0 H THR A 21 2.632 -10.147 1.970 1.00 0.00 H new ATOM 0 HA THR A 21 2.354 -12.041 -0.251 1.00 0.00 H new ATOM 0 HB THR A 21 2.382 -12.650 2.722 1.00 0.00 H new ATOM 0 HG1 THR A 21 4.672 -13.040 2.405 1.00 0.00 H new ATOM 0 HG21 THR A 21 3.184 -14.856 1.961 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.602 -14.451 1.253 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.080 -14.306 0.272 1.00 0.00 H new ATOM 285 N GLU A 22 -0.020 -12.804 0.175 1.00 0.00 N ATOM 286 CA GLU A 22 -1.457 -13.038 0.262 1.00 0.00 C ATOM 287 C GLU A 22 -1.855 -13.459 1.673 1.00 0.00 C ATOM 288 O GLU A 22 -1.114 -14.167 2.354 1.00 0.00 O ATOM 289 CB GLU A 22 -1.883 -14.111 -0.742 1.00 0.00 C ATOM 290 CG GLU A 22 -3.358 -14.466 -0.665 1.00 0.00 C ATOM 291 CD GLU A 22 -3.672 -15.801 -1.311 1.00 0.00 C ATOM 292 OE1 GLU A 22 -3.452 -16.842 -0.658 1.00 0.00 O ATOM 293 OE2 GLU A 22 -4.136 -15.804 -2.470 1.00 0.00 O ATOM 0 H GLU A 22 0.456 -13.358 -0.537 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.967 -12.105 0.023 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.653 -13.765 -1.750 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.292 -15.011 -0.572 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.668 -14.491 0.380 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.942 -13.685 -1.152 1.00 0.00 H new ATOM 300 N GLY A 23 -3.032 -13.018 2.106 1.00 0.00 N ATOM 301 CA GLY A 23 -3.510 -13.358 3.434 1.00 0.00 C ATOM 302 C GLY A 23 -3.024 -12.386 4.491 1.00 0.00 C ATOM 303 O GLY A 23 -3.709 -12.148 5.486 1.00 0.00 O ATOM 0 H GLY A 23 -3.663 -12.431 1.561 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.600 -13.373 3.432 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.178 -14.364 3.690 1.00 0.00 H new ATOM 307 N ASP A 24 -1.839 -11.825 4.277 1.00 0.00 N ATOM 308 CA ASP A 24 -1.262 -10.874 5.220 1.00 0.00 C ATOM 309 C ASP A 24 -2.024 -9.553 5.194 1.00 0.00 C ATOM 310 O ASP A 24 -2.947 -9.371 4.398 1.00 0.00 O ATOM 311 CB ASP A 24 0.213 -10.634 4.897 1.00 0.00 C ATOM 312 CG ASP A 24 1.073 -11.850 5.177 1.00 0.00 C ATOM 313 OD1 ASP A 24 0.676 -12.964 4.773 1.00 0.00 O ATOM 314 OD2 ASP A 24 2.143 -11.689 5.800 1.00 0.00 O ATOM 0 H ASP A 24 -1.259 -12.012 3.459 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.341 -11.298 6.221 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.311 -10.357 3.847 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.578 -9.792 5.485 1.00 0.00 H new ATOM 319 N THR A 25 -1.632 -8.632 6.069 1.00 0.00 N ATOM 320 CA THR A 25 -2.279 -7.328 6.148 1.00 0.00 C ATOM 321 C THR A 25 -1.351 -6.223 5.655 1.00 0.00 C ATOM 322 O THR A 25 -0.524 -5.712 6.410 1.00 0.00 O ATOM 323 CB THR A 25 -2.722 -7.007 7.587 1.00 0.00 C ATOM 324 OG1 THR A 25 -3.577 -8.044 8.080 1.00 0.00 O ATOM 325 CG2 THR A 25 -3.451 -5.673 7.644 1.00 0.00 C ATOM 0 H THR A 25 -0.869 -8.765 6.733 1.00 0.00 H new ATOM 0 HA THR A 25 -3.159 -7.373 5.507 1.00 0.00 H new ATOM 0 HB THR A 25 -1.831 -6.944 8.212 1.00 0.00 H new ATOM 0 HG1 THR A 25 -3.853 -7.833 8.996 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.754 -5.468 8.671 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.788 -4.881 7.296 1.00 0.00 H new ATOM 0 HG23 THR A 25 -4.334 -5.713 7.006 1.00 0.00 H new ATOM 333 N ALA A 26 -1.493 -5.860 4.385 1.00 0.00 N ATOM 334 CA ALA A 26 -0.669 -4.813 3.793 1.00 0.00 C ATOM 335 C ALA A 26 -0.858 -3.487 4.522 1.00 0.00 C ATOM 336 O ALA A 26 -1.892 -3.252 5.147 1.00 0.00 O ATOM 337 CB ALA A 26 -0.996 -4.657 2.315 1.00 0.00 C ATOM 0 H ALA A 26 -2.171 -6.275 3.746 1.00 0.00 H new ATOM 0 HA ALA A 26 0.376 -5.107 3.894 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -0.374 -3.872 1.886 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -0.802 -5.597 1.798 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.047 -4.390 2.201 1.00 0.00 H new ATOM 343 N THR A 27 0.149 -2.623 4.439 1.00 0.00 N ATOM 344 CA THR A 27 0.094 -1.321 5.092 1.00 0.00 C ATOM 345 C THR A 27 0.918 -0.289 4.330 1.00 0.00 C ATOM 346 O THR A 27 2.148 -0.348 4.316 1.00 0.00 O ATOM 347 CB THR A 27 0.605 -1.399 6.543 1.00 0.00 C ATOM 348 OG1 THR A 27 -0.213 -2.296 7.303 1.00 0.00 O ATOM 349 CG2 THR A 27 0.598 -0.024 7.194 1.00 0.00 C ATOM 0 H THR A 27 1.012 -2.802 3.926 1.00 0.00 H new ATOM 0 HA THR A 27 -0.952 -1.014 5.099 1.00 0.00 H new ATOM 0 HB THR A 27 1.630 -1.770 6.524 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.119 -2.341 8.224 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.963 -0.104 8.218 1.00 0.00 H new ATOM 0 HG22 THR A 27 1.244 0.649 6.630 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.418 0.370 7.201 1.00 0.00 H new ATOM 357 N LEU A 28 0.233 0.658 3.698 1.00 0.00 N ATOM 358 CA LEU A 28 0.901 1.705 2.934 1.00 0.00 C ATOM 359 C LEU A 28 1.002 2.992 3.747 1.00 0.00 C ATOM 360 O LEU A 28 0.527 3.060 4.880 1.00 0.00 O ATOM 361 CB LEU A 28 0.149 1.971 1.629 1.00 0.00 C ATOM 362 CG LEU A 28 0.293 0.904 0.542 1.00 0.00 C ATOM 363 CD1 LEU A 28 -0.754 -0.184 0.720 1.00 0.00 C ATOM 364 CD2 LEU A 28 0.183 1.532 -0.839 1.00 0.00 C ATOM 0 H LEU A 28 -0.785 0.722 3.700 1.00 0.00 H new ATOM 0 HA LEU A 28 1.910 1.363 2.702 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.910 2.085 1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.491 2.923 1.223 1.00 0.00 H new ATOM 0 HG LEU A 28 1.279 0.449 0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.636 -0.934 -0.062 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.628 -0.654 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.750 0.255 0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.288 0.759 -1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.789 2.014 -0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.971 2.274 -0.965 1.00 0.00 H new ATOM 376 N TRP A 29 1.621 4.010 3.159 1.00 0.00 N ATOM 377 CA TRP A 29 1.781 5.296 3.828 1.00 0.00 C ATOM 378 C TRP A 29 2.393 6.327 2.886 1.00 0.00 C ATOM 379 O TRP A 29 3.081 5.974 1.927 1.00 0.00 O ATOM 380 CB TRP A 29 2.657 5.140 5.072 1.00 0.00 C ATOM 381 CG TRP A 29 4.115 4.990 4.758 1.00 0.00 C ATOM 382 CD1 TRP A 29 4.781 3.828 4.492 1.00 0.00 C ATOM 383 CD2 TRP A 29 5.087 6.039 4.679 1.00 0.00 C ATOM 384 NE1 TRP A 29 6.108 4.091 4.253 1.00 0.00 N ATOM 385 CE2 TRP A 29 6.321 5.439 4.360 1.00 0.00 C ATOM 386 CE3 TRP A 29 5.034 7.425 4.843 1.00 0.00 C ATOM 387 CZ2 TRP A 29 7.490 6.180 4.205 1.00 0.00 C ATOM 388 CZ3 TRP A 29 6.195 8.159 4.690 1.00 0.00 C ATOM 389 CH2 TRP A 29 7.409 7.536 4.372 1.00 0.00 C ATOM 0 H TRP A 29 2.020 3.970 2.221 1.00 0.00 H new ATOM 0 HA TRP A 29 0.794 5.647 4.129 1.00 0.00 H new ATOM 0 HB2 TRP A 29 2.519 6.009 5.716 1.00 0.00 H new ATOM 0 HB3 TRP A 29 2.323 4.269 5.636 1.00 0.00 H new ATOM 0 HD1 TRP A 29 4.331 2.847 4.472 1.00 0.00 H new ATOM 0 HE1 TRP A 29 6.820 3.394 4.032 1.00 0.00 H new ATOM 0 HE3 TRP A 29 4.102 7.915 5.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 8.427 5.702 3.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 6.166 9.231 4.818 1.00 0.00 H new ATOM 0 HH2 TRP A 29 8.298 8.138 4.256 1.00 0.00 H new ATOM 400 N CYS A 30 2.140 7.600 3.165 1.00 0.00 N ATOM 401 CA CYS A 30 2.666 8.683 2.341 1.00 0.00 C ATOM 402 C CYS A 30 2.888 9.941 3.173 1.00 0.00 C ATOM 403 O CYS A 30 2.123 10.231 4.092 1.00 0.00 O ATOM 404 CB CYS A 30 1.710 8.983 1.185 1.00 0.00 C ATOM 405 SG CYS A 30 0.109 9.644 1.704 1.00 0.00 S ATOM 0 H CYS A 30 1.574 7.908 3.955 1.00 0.00 H new ATOM 0 HA CYS A 30 3.626 8.364 1.935 1.00 0.00 H new ATOM 0 HB2 CYS A 30 2.184 9.696 0.511 1.00 0.00 H new ATOM 0 HB3 CYS A 30 1.546 8.068 0.616 1.00 0.00 H new ATOM 0 HG CYS A 30 -0.174 10.700 1.000 1.00 0.00 H new ATOM 411 N GLU A 31 3.941 10.684 2.845 1.00 0.00 N ATOM 412 CA GLU A 31 4.264 11.910 3.565 1.00 0.00 C ATOM 413 C GLU A 31 3.535 13.105 2.959 1.00 0.00 C ATOM 414 O GLU A 31 3.346 13.181 1.744 1.00 0.00 O ATOM 415 CB GLU A 31 5.774 12.156 3.545 1.00 0.00 C ATOM 416 CG GLU A 31 6.198 13.399 4.309 1.00 0.00 C ATOM 417 CD GLU A 31 7.665 13.377 4.692 1.00 0.00 C ATOM 418 OE1 GLU A 31 8.499 13.046 3.823 1.00 0.00 O ATOM 419 OE2 GLU A 31 7.979 13.690 5.859 1.00 0.00 O ATOM 0 H GLU A 31 4.584 10.458 2.086 1.00 0.00 H new ATOM 0 HA GLU A 31 3.936 11.792 4.598 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.281 11.289 3.969 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.106 12.245 2.510 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.999 14.281 3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.592 13.491 5.211 1.00 0.00 H new ATOM 426 N LEU A 32 3.127 14.037 3.813 1.00 0.00 N ATOM 427 CA LEU A 32 2.417 15.230 3.363 1.00 0.00 C ATOM 428 C LEU A 32 3.181 16.494 3.744 1.00 0.00 C ATOM 429 O LEU A 32 3.884 16.526 4.754 1.00 0.00 O ATOM 430 CB LEU A 32 1.012 15.269 3.965 1.00 0.00 C ATOM 431 CG LEU A 32 -0.058 15.971 3.128 1.00 0.00 C ATOM 432 CD1 LEU A 32 -0.282 15.231 1.819 1.00 0.00 C ATOM 433 CD2 LEU A 32 -1.359 16.082 3.910 1.00 0.00 C ATOM 0 H LEU A 32 3.275 13.990 4.821 1.00 0.00 H new ATOM 0 HA LEU A 32 2.339 15.188 2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.688 14.244 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.068 15.763 4.935 1.00 0.00 H new ATOM 0 HG LEU A 32 0.291 16.978 2.897 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.047 15.745 1.237 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.649 15.204 1.252 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.609 14.212 2.028 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.109 16.584 3.299 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.712 15.085 4.172 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.188 16.657 4.820 1.00 0.00 H new ATOM 445 N SER A 33 3.037 17.534 2.930 1.00 0.00 N ATOM 446 CA SER A 33 3.715 18.801 3.180 1.00 0.00 C ATOM 447 C SER A 33 2.854 19.715 4.046 1.00 0.00 C ATOM 448 O SER A 33 3.275 20.808 4.426 1.00 0.00 O ATOM 449 CB SER A 33 4.047 19.496 1.858 1.00 0.00 C ATOM 450 OG SER A 33 4.045 20.905 2.009 1.00 0.00 O ATOM 0 H SER A 33 2.457 17.525 2.091 1.00 0.00 H new ATOM 0 HA SER A 33 4.642 18.590 3.714 1.00 0.00 H new ATOM 0 HB2 SER A 33 5.024 19.166 1.505 1.00 0.00 H new ATOM 0 HB3 SER A 33 3.320 19.207 1.099 1.00 0.00 H new ATOM 0 HG SER A 33 4.096 21.132 2.961 1.00 0.00 H new ATOM 456 N LYS A 34 1.644 19.261 4.355 1.00 0.00 N ATOM 457 CA LYS A 34 0.722 20.035 5.177 1.00 0.00 C ATOM 458 C LYS A 34 -0.361 19.140 5.770 1.00 0.00 C ATOM 459 O LYS A 34 -1.201 18.603 5.047 1.00 0.00 O ATOM 460 CB LYS A 34 0.080 21.150 4.348 1.00 0.00 C ATOM 461 CG LYS A 34 -1.174 21.731 4.978 1.00 0.00 C ATOM 462 CD LYS A 34 -0.853 22.513 6.240 1.00 0.00 C ATOM 463 CE LYS A 34 -2.117 23.027 6.914 1.00 0.00 C ATOM 464 NZ LYS A 34 -2.954 23.832 5.982 1.00 0.00 N ATOM 0 H LYS A 34 1.279 18.359 4.048 1.00 0.00 H new ATOM 0 HA LYS A 34 1.289 20.479 5.995 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.807 21.949 4.204 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.167 20.761 3.360 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.673 22.384 4.262 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.870 20.926 5.215 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -0.303 21.877 6.933 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -0.203 23.353 5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -2.698 22.184 7.288 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.847 23.635 7.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.692 24.330 6.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.356 24.527 5.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -3.399 23.203 5.284 1.00 0.00 H new ATOM 478 N ALA A 35 -0.338 18.985 7.090 1.00 0.00 N ATOM 479 CA ALA A 35 -1.320 18.158 7.780 1.00 0.00 C ATOM 480 C ALA A 35 -2.728 18.431 7.262 1.00 0.00 C ATOM 481 O ALA A 35 -3.297 19.492 7.515 1.00 0.00 O ATOM 482 CB ALA A 35 -1.251 18.398 9.281 1.00 0.00 C ATOM 0 H ALA A 35 0.351 19.422 7.703 1.00 0.00 H new ATOM 0 HA ALA A 35 -1.084 17.113 7.580 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.990 17.774 9.784 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.255 18.145 9.644 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -1.459 19.447 9.492 1.00 0.00 H new ATOM 488 N ALA A 36 -3.284 17.466 6.536 1.00 0.00 N ATOM 489 CA ALA A 36 -4.626 17.603 5.984 1.00 0.00 C ATOM 490 C ALA A 36 -5.275 16.239 5.776 1.00 0.00 C ATOM 491 O ALA A 36 -4.602 15.228 5.578 1.00 0.00 O ATOM 492 CB ALA A 36 -4.582 18.374 4.674 1.00 0.00 C ATOM 0 H ALA A 36 -2.826 16.581 6.317 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.232 18.159 6.699 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.591 18.469 4.273 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.167 19.366 4.850 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.956 17.840 3.959 1.00 0.00 H new ATOM 498 N PRO A 37 -6.616 16.207 5.821 1.00 0.00 N ATOM 499 CA PRO A 37 -7.385 14.973 5.639 1.00 0.00 C ATOM 500 C PRO A 37 -7.324 14.457 4.206 1.00 0.00 C ATOM 501 O PRO A 37 -7.774 15.126 3.275 1.00 0.00 O ATOM 502 CB PRO A 37 -8.814 15.390 5.997 1.00 0.00 C ATOM 503 CG PRO A 37 -8.858 16.855 5.735 1.00 0.00 C ATOM 504 CD PRO A 37 -7.483 17.375 6.053 1.00 0.00 C ATOM 0 HA PRO A 37 -6.998 14.158 6.250 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.546 14.857 5.390 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.042 15.167 7.039 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -9.121 17.058 4.697 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -9.612 17.340 6.356 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -7.211 18.212 5.410 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.415 17.728 7.082 1.00 0.00 H new ATOM 512 N VAL A 38 -6.764 13.264 4.034 1.00 0.00 N ATOM 513 CA VAL A 38 -6.645 12.658 2.713 1.00 0.00 C ATOM 514 C VAL A 38 -7.692 11.568 2.513 1.00 0.00 C ATOM 515 O VAL A 38 -8.484 11.283 3.410 1.00 0.00 O ATOM 516 CB VAL A 38 -5.245 12.055 2.497 1.00 0.00 C ATOM 517 CG1 VAL A 38 -4.173 13.122 2.659 1.00 0.00 C ATOM 518 CG2 VAL A 38 -5.008 10.899 3.457 1.00 0.00 C ATOM 0 H VAL A 38 -6.385 12.698 4.793 1.00 0.00 H new ATOM 0 HA VAL A 38 -6.807 13.452 1.984 1.00 0.00 H new ATOM 0 HB VAL A 38 -5.188 11.669 1.479 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.190 12.677 2.503 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -4.334 13.913 1.927 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.226 13.541 3.664 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -4.014 10.485 3.290 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.084 11.257 4.484 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.756 10.125 3.286 1.00 0.00 H new ATOM 528 N GLU A 39 -7.689 10.963 1.329 1.00 0.00 N ATOM 529 CA GLU A 39 -8.640 9.904 1.011 1.00 0.00 C ATOM 530 C GLU A 39 -7.951 8.757 0.277 1.00 0.00 C ATOM 531 O GLU A 39 -7.091 8.979 -0.575 1.00 0.00 O ATOM 532 CB GLU A 39 -9.785 10.455 0.158 1.00 0.00 C ATOM 533 CG GLU A 39 -11.094 9.705 0.338 1.00 0.00 C ATOM 534 CD GLU A 39 -10.908 8.201 0.347 1.00 0.00 C ATOM 535 OE1 GLU A 39 -10.857 7.603 -0.749 1.00 0.00 O ATOM 536 OE2 GLU A 39 -10.813 7.620 1.449 1.00 0.00 O ATOM 0 H GLU A 39 -7.040 11.188 0.575 1.00 0.00 H new ATOM 0 HA GLU A 39 -9.046 9.522 1.948 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -9.940 11.505 0.408 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.495 10.417 -0.892 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.560 10.015 1.273 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.778 9.978 -0.465 1.00 0.00 H new ATOM 543 N TRP A 40 -8.336 7.531 0.615 1.00 0.00 N ATOM 544 CA TRP A 40 -7.755 6.349 -0.010 1.00 0.00 C ATOM 545 C TRP A 40 -8.770 5.657 -0.914 1.00 0.00 C ATOM 546 O TRP A 40 -9.897 5.381 -0.500 1.00 0.00 O ATOM 547 CB TRP A 40 -7.257 5.374 1.058 1.00 0.00 C ATOM 548 CG TRP A 40 -6.155 5.933 1.905 1.00 0.00 C ATOM 549 CD1 TRP A 40 -6.282 6.824 2.932 1.00 0.00 C ATOM 550 CD2 TRP A 40 -4.757 5.641 1.796 1.00 0.00 C ATOM 551 NE1 TRP A 40 -5.048 7.103 3.469 1.00 0.00 N ATOM 552 CE2 TRP A 40 -4.096 6.390 2.789 1.00 0.00 C ATOM 553 CE3 TRP A 40 -4.001 4.819 0.957 1.00 0.00 C ATOM 554 CZ2 TRP A 40 -2.716 6.339 2.964 1.00 0.00 C ATOM 555 CZ3 TRP A 40 -2.630 4.771 1.131 1.00 0.00 C ATOM 556 CH2 TRP A 40 -2.000 5.526 2.128 1.00 0.00 C ATOM 0 H TRP A 40 -9.047 7.330 1.318 1.00 0.00 H new ATOM 0 HA TRP A 40 -6.911 6.670 -0.621 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -8.092 5.092 1.700 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -6.906 4.463 0.573 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -7.215 7.247 3.272 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -4.870 7.738 4.247 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -4.478 4.232 0.187 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -2.228 6.920 3.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -2.035 4.140 0.487 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -0.927 5.465 2.239 1.00 0.00 H new ATOM 567 N ARG A 41 -8.365 5.379 -2.148 1.00 0.00 N ATOM 568 CA ARG A 41 -9.240 4.720 -3.110 1.00 0.00 C ATOM 569 C ARG A 41 -8.633 3.403 -3.584 1.00 0.00 C ATOM 570 O ARG A 41 -7.413 3.264 -3.671 1.00 0.00 O ATOM 571 CB ARG A 41 -9.498 5.636 -4.308 1.00 0.00 C ATOM 572 CG ARG A 41 -10.503 6.741 -4.025 1.00 0.00 C ATOM 573 CD ARG A 41 -10.485 7.802 -5.113 1.00 0.00 C ATOM 574 NE ARG A 41 -11.315 7.429 -6.255 1.00 0.00 N ATOM 575 CZ ARG A 41 -11.498 8.208 -7.316 1.00 0.00 C ATOM 576 NH1 ARG A 41 -10.912 9.395 -7.380 1.00 0.00 N ATOM 577 NH2 ARG A 41 -12.269 7.798 -8.316 1.00 0.00 N ATOM 0 H ARG A 41 -7.436 5.600 -2.506 1.00 0.00 H new ATOM 0 HA ARG A 41 -10.187 4.506 -2.615 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -8.555 6.085 -4.621 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -9.857 5.035 -5.143 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -11.503 6.314 -3.948 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -10.278 7.201 -3.063 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -10.837 8.748 -4.702 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -9.460 7.962 -5.447 1.00 0.00 H new ATOM 0 HE ARG A 41 -11.780 6.521 -6.237 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -10.319 9.713 -6.614 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -11.054 9.991 -8.196 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -12.721 6.885 -8.270 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -12.409 8.396 -9.130 1.00 0.00 H new ATOM 591 N LYS A 42 -9.493 2.437 -3.890 1.00 0.00 N ATOM 592 CA LYS A 42 -9.044 1.131 -4.357 1.00 0.00 C ATOM 593 C LYS A 42 -9.690 0.778 -5.692 1.00 0.00 C ATOM 594 O LYS A 42 -10.701 0.078 -5.738 1.00 0.00 O ATOM 595 CB LYS A 42 -9.372 0.055 -3.319 1.00 0.00 C ATOM 596 CG LYS A 42 -9.067 -1.356 -3.789 1.00 0.00 C ATOM 597 CD LYS A 42 -9.587 -2.395 -2.809 1.00 0.00 C ATOM 598 CE LYS A 42 -9.010 -3.772 -3.098 1.00 0.00 C ATOM 599 NZ LYS A 42 -9.828 -4.519 -4.093 1.00 0.00 N ATOM 0 H LYS A 42 -10.506 2.535 -3.823 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.964 1.175 -4.497 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.807 0.256 -2.409 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.429 0.122 -3.060 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -9.518 -1.520 -4.768 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -7.990 -1.475 -3.910 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.330 -2.098 -1.792 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.675 -2.436 -2.864 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.991 -3.668 -3.471 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.954 -4.344 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.401 -5.452 -4.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.794 -4.641 -3.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -9.861 -3.986 -4.986 1.00 0.00 H new ATOM 613 N GLY A 43 -9.099 1.266 -6.779 1.00 0.00 N ATOM 614 CA GLY A 43 -9.631 0.990 -8.100 1.00 0.00 C ATOM 615 C GLY A 43 -10.608 2.052 -8.566 1.00 0.00 C ATOM 616 O GLY A 43 -10.205 3.074 -9.123 1.00 0.00 O ATOM 0 H GLY A 43 -8.261 1.848 -6.768 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.809 0.920 -8.812 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -10.129 0.021 -8.092 1.00 0.00 H new ATOM 620 N HIS A 44 -11.895 1.811 -8.339 1.00 0.00 N ATOM 621 CA HIS A 44 -12.932 2.755 -8.740 1.00 0.00 C ATOM 622 C HIS A 44 -13.928 2.981 -7.607 1.00 0.00 C ATOM 623 O HIS A 44 -15.129 3.114 -7.842 1.00 0.00 O ATOM 624 CB HIS A 44 -13.662 2.244 -9.982 1.00 0.00 C ATOM 625 CG HIS A 44 -12.818 2.252 -11.219 1.00 0.00 C ATOM 626 ND1 HIS A 44 -11.972 3.291 -11.546 1.00 0.00 N ATOM 627 CD2 HIS A 44 -12.690 1.339 -12.210 1.00 0.00 C ATOM 628 CE1 HIS A 44 -11.363 3.018 -12.686 1.00 0.00 C ATOM 629 NE2 HIS A 44 -11.781 1.839 -13.110 1.00 0.00 N ATOM 0 H HIS A 44 -12.245 0.970 -7.880 1.00 0.00 H new ATOM 0 HA HIS A 44 -12.453 3.706 -8.974 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -14.010 1.228 -9.796 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -14.547 2.858 -10.152 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -13.207 0.393 -12.280 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -10.645 3.651 -13.186 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -11.478 1.375 -13.966 1.00 0.00 H new ATOM 638 N GLU A 45 -13.421 3.024 -6.379 1.00 0.00 N ATOM 639 CA GLU A 45 -14.268 3.233 -5.210 1.00 0.00 C ATOM 640 C GLU A 45 -13.466 3.829 -4.057 1.00 0.00 C ATOM 641 O GLU A 45 -12.266 3.582 -3.926 1.00 0.00 O ATOM 642 CB GLU A 45 -14.906 1.913 -4.773 1.00 0.00 C ATOM 643 CG GLU A 45 -16.242 2.087 -4.069 1.00 0.00 C ATOM 644 CD GLU A 45 -17.376 2.379 -5.032 1.00 0.00 C ATOM 645 OE1 GLU A 45 -17.562 1.595 -5.986 1.00 0.00 O ATOM 646 OE2 GLU A 45 -18.077 3.392 -4.831 1.00 0.00 O ATOM 0 H GLU A 45 -12.429 2.917 -6.168 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.055 3.936 -5.484 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.046 1.279 -5.649 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -14.219 1.390 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.472 1.182 -3.506 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.165 2.900 -3.347 1.00 0.00 H new ATOM 653 N THR A 46 -14.137 4.616 -3.222 1.00 0.00 N ATOM 654 CA THR A 46 -13.488 5.249 -2.080 1.00 0.00 C ATOM 655 C THR A 46 -13.481 4.324 -0.869 1.00 0.00 C ATOM 656 O THR A 46 -14.515 4.106 -0.236 1.00 0.00 O ATOM 657 CB THR A 46 -14.184 6.569 -1.700 1.00 0.00 C ATOM 658 OG1 THR A 46 -14.065 7.513 -2.771 1.00 0.00 O ATOM 659 CG2 THR A 46 -13.579 7.154 -0.432 1.00 0.00 C ATOM 0 H THR A 46 -15.130 4.830 -3.315 1.00 0.00 H new ATOM 0 HA THR A 46 -12.461 5.461 -2.377 1.00 0.00 H new ATOM 0 HB THR A 46 -15.238 6.359 -1.518 1.00 0.00 H new ATOM 0 HG1 THR A 46 -14.512 8.349 -2.522 1.00 0.00 H new ATOM 0 HG21 THR A 46 -14.087 8.086 -0.183 1.00 0.00 H new ATOM 0 HG22 THR A 46 -13.698 6.446 0.388 1.00 0.00 H new ATOM 0 HG23 THR A 46 -12.519 7.350 -0.592 1.00 0.00 H new ATOM 667 N LEU A 47 -12.310 3.783 -0.551 1.00 0.00 N ATOM 668 CA LEU A 47 -12.168 2.881 0.587 1.00 0.00 C ATOM 669 C LEU A 47 -12.942 3.401 1.794 1.00 0.00 C ATOM 670 O LEU A 47 -13.329 4.569 1.840 1.00 0.00 O ATOM 671 CB LEU A 47 -10.691 2.712 0.948 1.00 0.00 C ATOM 672 CG LEU A 47 -9.853 1.883 -0.026 1.00 0.00 C ATOM 673 CD1 LEU A 47 -8.370 2.118 0.213 1.00 0.00 C ATOM 674 CD2 LEU A 47 -10.189 0.405 0.105 1.00 0.00 C ATOM 0 H LEU A 47 -11.445 3.953 -1.065 1.00 0.00 H new ATOM 0 HA LEU A 47 -12.580 1.912 0.305 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -10.242 3.702 1.031 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -10.629 2.250 1.933 1.00 0.00 H new ATOM 0 HG LEU A 47 -10.091 2.200 -1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -7.789 1.520 -0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -8.141 3.174 0.067 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -8.116 1.829 1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -9.583 -0.169 -0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -9.980 0.073 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -11.245 0.251 -0.117 1.00 0.00 H new ATOM 686 N ARG A 48 -13.162 2.527 2.771 1.00 0.00 N ATOM 687 CA ARG A 48 -13.889 2.898 3.979 1.00 0.00 C ATOM 688 C ARG A 48 -13.368 2.123 5.186 1.00 0.00 C ATOM 689 O ARG A 48 -12.940 0.976 5.062 1.00 0.00 O ATOM 690 CB ARG A 48 -15.386 2.638 3.800 1.00 0.00 C ATOM 691 CG ARG A 48 -16.002 3.404 2.641 1.00 0.00 C ATOM 692 CD ARG A 48 -17.487 3.647 2.861 1.00 0.00 C ATOM 693 NE ARG A 48 -17.732 4.592 3.948 1.00 0.00 N ATOM 694 CZ ARG A 48 -18.932 4.816 4.470 1.00 0.00 C ATOM 695 NH1 ARG A 48 -19.992 4.167 4.007 1.00 0.00 N ATOM 696 NH2 ARG A 48 -19.075 5.691 5.458 1.00 0.00 N ATOM 0 H ARG A 48 -12.847 1.557 2.749 1.00 0.00 H new ATOM 0 HA ARG A 48 -13.731 3.962 4.156 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -15.545 1.571 3.645 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -15.906 2.907 4.720 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -15.490 4.359 2.521 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -15.857 2.846 1.716 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -17.932 4.028 1.942 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -17.980 2.701 3.085 1.00 0.00 H new ATOM 0 HE ARG A 48 -16.938 5.108 4.327 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -19.886 3.494 3.248 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -20.913 4.341 4.410 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -18.262 6.192 5.817 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -19.997 5.862 5.858 1.00 0.00 H new ATOM 710 N ASP A 49 -13.407 2.759 6.352 1.00 0.00 N ATOM 711 CA ASP A 49 -12.940 2.130 7.582 1.00 0.00 C ATOM 712 C ASP A 49 -14.028 1.250 8.189 1.00 0.00 C ATOM 713 O ASP A 49 -15.166 1.684 8.365 1.00 0.00 O ATOM 714 CB ASP A 49 -12.505 3.194 8.591 1.00 0.00 C ATOM 715 CG ASP A 49 -12.238 2.613 9.965 1.00 0.00 C ATOM 716 OD1 ASP A 49 -13.173 2.034 10.557 1.00 0.00 O ATOM 717 OD2 ASP A 49 -11.093 2.738 10.450 1.00 0.00 O ATOM 0 H ASP A 49 -13.757 3.710 6.471 1.00 0.00 H new ATOM 0 HA ASP A 49 -12.084 1.501 7.337 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -11.604 3.689 8.228 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -13.279 3.957 8.667 1.00 0.00 H new ATOM 722 N GLY A 50 -13.671 0.009 8.507 1.00 0.00 N ATOM 723 CA GLY A 50 -14.628 -0.913 9.090 1.00 0.00 C ATOM 724 C GLY A 50 -14.704 -2.224 8.334 1.00 0.00 C ATOM 725 O GLY A 50 -14.816 -3.291 8.938 1.00 0.00 O ATOM 0 H GLY A 50 -12.736 -0.374 8.371 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -14.353 -1.110 10.126 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -15.614 -0.448 9.105 1.00 0.00 H new ATOM 729 N ASP A 51 -14.646 -2.146 7.009 1.00 0.00 N ATOM 730 CA ASP A 51 -14.709 -3.336 6.169 1.00 0.00 C ATOM 731 C ASP A 51 -13.309 -3.844 5.839 1.00 0.00 C ATOM 732 O ASP A 51 -12.790 -3.600 4.750 1.00 0.00 O ATOM 733 CB ASP A 51 -15.473 -3.035 4.878 1.00 0.00 C ATOM 734 CG ASP A 51 -15.126 -1.677 4.303 1.00 0.00 C ATOM 735 OD1 ASP A 51 -14.007 -1.528 3.767 1.00 0.00 O ATOM 736 OD2 ASP A 51 -15.972 -0.763 4.388 1.00 0.00 O ATOM 0 H ASP A 51 -14.555 -1.271 6.493 1.00 0.00 H new ATOM 0 HA ASP A 51 -15.237 -4.113 6.722 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -15.251 -3.806 4.140 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -16.544 -3.080 5.074 1.00 0.00 H new ATOM 741 N ARG A 52 -12.703 -4.551 6.787 1.00 0.00 N ATOM 742 CA ARG A 52 -11.362 -5.092 6.598 1.00 0.00 C ATOM 743 C ARG A 52 -10.422 -4.028 6.039 1.00 0.00 C ATOM 744 O ARG A 52 -9.565 -4.319 5.204 1.00 0.00 O ATOM 745 CB ARG A 52 -11.403 -6.297 5.657 1.00 0.00 C ATOM 746 CG ARG A 52 -11.701 -7.610 6.362 1.00 0.00 C ATOM 747 CD ARG A 52 -11.414 -8.803 5.463 1.00 0.00 C ATOM 748 NE ARG A 52 -12.506 -9.058 4.528 1.00 0.00 N ATOM 749 CZ ARG A 52 -13.701 -9.505 4.898 1.00 0.00 C ATOM 750 NH1 ARG A 52 -13.956 -9.744 6.177 1.00 0.00 N ATOM 751 NH2 ARG A 52 -14.644 -9.713 3.988 1.00 0.00 N ATOM 0 H ARG A 52 -13.119 -4.763 7.694 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.985 -5.412 7.570 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -12.161 -6.125 4.892 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -10.445 -6.379 5.144 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -11.099 -7.683 7.268 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -12.746 -7.629 6.671 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -10.494 -8.624 4.906 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.248 -9.688 6.077 1.00 0.00 H new ATOM 0 HE ARG A 52 -12.342 -8.883 3.536 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.234 -9.585 6.879 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.874 -10.087 6.458 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -14.452 -9.530 3.003 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -15.561 -10.056 4.273 1.00 0.00 H new ATOM 765 N HIS A 53 -10.588 -2.794 6.505 1.00 0.00 N ATOM 766 CA HIS A 53 -9.754 -1.687 6.051 1.00 0.00 C ATOM 767 C HIS A 53 -9.676 -0.595 7.114 1.00 0.00 C ATOM 768 O HIS A 53 -10.570 -0.464 7.950 1.00 0.00 O ATOM 769 CB HIS A 53 -10.302 -1.108 4.747 1.00 0.00 C ATOM 770 CG HIS A 53 -9.911 -1.893 3.532 1.00 0.00 C ATOM 771 ND1 HIS A 53 -10.538 -3.063 3.158 1.00 0.00 N ATOM 772 CD2 HIS A 53 -8.952 -1.669 2.604 1.00 0.00 C ATOM 773 CE1 HIS A 53 -9.980 -3.525 2.053 1.00 0.00 C ATOM 774 NE2 HIS A 53 -9.015 -2.697 1.696 1.00 0.00 N ATOM 0 H HIS A 53 -11.292 -2.536 7.196 1.00 0.00 H new ATOM 0 HA HIS A 53 -8.749 -2.070 5.874 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -11.389 -1.065 4.807 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -9.948 -0.083 4.637 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -11.312 -3.503 3.656 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -8.265 -0.836 2.582 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -10.265 -4.426 1.531 1.00 0.00 H new ATOM 783 N SER A 54 -8.602 0.187 7.075 1.00 0.00 N ATOM 784 CA SER A 54 -8.406 1.265 8.037 1.00 0.00 C ATOM 785 C SER A 54 -7.789 2.488 7.364 1.00 0.00 C ATOM 786 O SER A 54 -6.757 2.391 6.699 1.00 0.00 O ATOM 787 CB SER A 54 -7.511 0.795 9.186 1.00 0.00 C ATOM 788 OG SER A 54 -7.150 1.878 10.026 1.00 0.00 O ATOM 0 H SER A 54 -7.854 0.094 6.388 1.00 0.00 H new ATOM 0 HA SER A 54 -9.381 1.545 8.436 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.031 0.036 9.770 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.612 0.327 8.784 1.00 0.00 H new ATOM 0 HG SER A 54 -6.580 1.552 10.753 1.00 0.00 H new ATOM 794 N LEU A 55 -8.429 3.638 7.542 1.00 0.00 N ATOM 795 CA LEU A 55 -7.946 4.882 6.953 1.00 0.00 C ATOM 796 C LEU A 55 -7.654 5.919 8.033 1.00 0.00 C ATOM 797 O LEU A 55 -8.570 6.535 8.579 1.00 0.00 O ATOM 798 CB LEU A 55 -8.973 5.434 5.964 1.00 0.00 C ATOM 799 CG LEU A 55 -9.370 4.503 4.818 1.00 0.00 C ATOM 800 CD1 LEU A 55 -10.563 3.647 5.214 1.00 0.00 C ATOM 801 CD2 LEU A 55 -9.680 5.304 3.562 1.00 0.00 C ATOM 0 H LEU A 55 -9.284 3.735 8.090 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.019 4.667 6.422 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.873 5.701 6.517 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.577 6.355 5.536 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.529 3.843 4.605 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.831 2.991 4.386 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.306 3.045 6.085 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -11.409 4.291 5.455 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.961 4.625 2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -10.503 5.990 3.762 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.798 5.872 3.266 1.00 0.00 H new ATOM 813 N ARG A 56 -6.374 6.107 8.335 1.00 0.00 N ATOM 814 CA ARG A 56 -5.962 7.070 9.349 1.00 0.00 C ATOM 815 C ARG A 56 -4.691 7.799 8.922 1.00 0.00 C ATOM 816 O ARG A 56 -3.917 7.292 8.111 1.00 0.00 O ATOM 817 CB ARG A 56 -5.733 6.367 10.688 1.00 0.00 C ATOM 818 CG ARG A 56 -5.086 4.998 10.555 1.00 0.00 C ATOM 819 CD ARG A 56 -4.703 4.428 11.912 1.00 0.00 C ATOM 820 NE ARG A 56 -5.862 3.911 12.635 1.00 0.00 N ATOM 821 CZ ARG A 56 -5.808 3.461 13.883 1.00 0.00 C ATOM 822 NH1 ARG A 56 -4.659 3.465 14.544 1.00 0.00 N ATOM 823 NH2 ARG A 56 -6.906 3.006 14.474 1.00 0.00 N ATOM 0 H ARG A 56 -5.604 5.605 7.892 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.761 7.803 9.463 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.104 6.997 11.317 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.689 6.259 11.200 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.774 4.317 10.054 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.198 5.074 9.927 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -3.974 3.629 11.777 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.220 5.203 12.508 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.762 3.895 12.155 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.813 3.814 14.094 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.621 3.119 15.503 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.792 3.002 13.969 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -6.863 2.661 15.433 1.00 0.00 H new ATOM 837 N GLN A 57 -4.484 8.990 9.474 1.00 0.00 N ATOM 838 CA GLN A 57 -3.308 9.789 9.149 1.00 0.00 C ATOM 839 C GLN A 57 -2.922 10.690 10.317 1.00 0.00 C ATOM 840 O GLN A 57 -3.782 11.298 10.955 1.00 0.00 O ATOM 841 CB GLN A 57 -3.569 10.635 7.902 1.00 0.00 C ATOM 842 CG GLN A 57 -4.153 12.005 8.207 1.00 0.00 C ATOM 843 CD GLN A 57 -4.231 12.892 6.980 1.00 0.00 C ATOM 844 OE1 GLN A 57 -5.254 12.937 6.296 1.00 0.00 O ATOM 845 NE2 GLN A 57 -3.148 13.605 6.695 1.00 0.00 N ATOM 0 H GLN A 57 -5.115 9.423 10.148 1.00 0.00 H new ATOM 0 HA GLN A 57 -2.481 9.108 8.951 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -2.634 10.761 7.357 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -4.251 10.097 7.244 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -5.151 11.885 8.628 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -3.544 12.495 8.967 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -2.322 13.537 7.289 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -3.142 14.221 5.882 1.00 0.00 H new ATOM 854 N ASP A 58 -1.625 10.771 10.592 1.00 0.00 N ATOM 855 CA ASP A 58 -1.125 11.599 11.683 1.00 0.00 C ATOM 856 C ASP A 58 -0.403 12.830 11.145 1.00 0.00 C ATOM 857 O ASP A 58 -0.383 13.072 9.939 1.00 0.00 O ATOM 858 CB ASP A 58 -0.183 10.789 12.575 1.00 0.00 C ATOM 859 CG ASP A 58 -0.907 10.121 13.728 1.00 0.00 C ATOM 860 OD1 ASP A 58 -1.463 10.847 14.578 1.00 0.00 O ATOM 861 OD2 ASP A 58 -0.918 8.873 13.779 1.00 0.00 O ATOM 0 H ASP A 58 -0.901 10.273 10.074 1.00 0.00 H new ATOM 0 HA ASP A 58 -1.978 11.931 12.275 1.00 0.00 H new ATOM 0 HB2 ASP A 58 0.317 10.029 11.975 1.00 0.00 H new ATOM 0 HB3 ASP A 58 0.593 11.445 12.969 1.00 0.00 H new ATOM 866 N GLY A 59 0.189 13.605 12.048 1.00 0.00 N ATOM 867 CA GLY A 59 0.903 14.803 11.645 1.00 0.00 C ATOM 868 C GLY A 59 1.583 14.646 10.299 1.00 0.00 C ATOM 869 O GLY A 59 2.597 13.959 10.185 1.00 0.00 O ATOM 0 H GLY A 59 0.187 13.425 13.052 1.00 0.00 H new ATOM 0 HA2 GLY A 59 0.207 15.640 11.602 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.650 15.049 12.400 1.00 0.00 H new ATOM 873 N SER A 60 1.022 15.285 9.277 1.00 0.00 N ATOM 874 CA SER A 60 1.577 15.209 7.931 1.00 0.00 C ATOM 875 C SER A 60 2.057 13.794 7.620 1.00 0.00 C ATOM 876 O SER A 60 3.172 13.597 7.136 1.00 0.00 O ATOM 877 CB SER A 60 2.735 16.197 7.778 1.00 0.00 C ATOM 878 OG SER A 60 2.430 17.439 8.388 1.00 0.00 O ATOM 0 H SER A 60 0.184 15.861 9.356 1.00 0.00 H new ATOM 0 HA SER A 60 0.789 15.470 7.225 1.00 0.00 H new ATOM 0 HB2 SER A 60 3.636 15.779 8.228 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.949 16.351 6.720 1.00 0.00 H new ATOM 0 HG SER A 60 3.187 18.052 8.278 1.00 0.00 H new ATOM 884 N ARG A 61 1.206 12.813 7.902 1.00 0.00 N ATOM 885 CA ARG A 61 1.542 11.416 7.654 1.00 0.00 C ATOM 886 C ARG A 61 0.280 10.574 7.492 1.00 0.00 C ATOM 887 O ARG A 61 -0.637 10.648 8.311 1.00 0.00 O ATOM 888 CB ARG A 61 2.394 10.863 8.798 1.00 0.00 C ATOM 889 CG ARG A 61 3.172 9.611 8.429 1.00 0.00 C ATOM 890 CD ARG A 61 3.382 8.709 9.636 1.00 0.00 C ATOM 891 NE ARG A 61 2.288 7.755 9.803 1.00 0.00 N ATOM 892 CZ ARG A 61 2.128 7.004 10.887 1.00 0.00 C ATOM 893 NH1 ARG A 61 2.985 7.096 11.894 1.00 0.00 N ATOM 894 NH2 ARG A 61 1.108 6.159 10.965 1.00 0.00 N ATOM 0 H ARG A 61 0.279 12.960 8.302 1.00 0.00 H new ATOM 0 HA ARG A 61 2.114 11.365 6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 61 3.094 11.633 9.123 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.747 10.641 9.647 1.00 0.00 H new ATOM 0 HG2 ARG A 61 2.636 9.064 7.653 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.139 9.892 8.011 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.321 8.168 9.525 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.471 9.320 10.534 1.00 0.00 H new ATOM 0 HE ARG A 61 1.611 7.661 9.046 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.770 7.745 11.838 1.00 0.00 H new ATOM 0 HH12 ARG A 61 2.859 6.518 12.725 1.00 0.00 H new ATOM 0 HH21 ARG A 61 0.446 6.086 10.192 1.00 0.00 H new ATOM 0 HH22 ARG A 61 0.986 5.583 11.798 1.00 0.00 H new ATOM 908 N CYS A 62 0.241 9.774 6.432 1.00 0.00 N ATOM 909 CA CYS A 62 -0.909 8.918 6.162 1.00 0.00 C ATOM 910 C CYS A 62 -0.510 7.447 6.192 1.00 0.00 C ATOM 911 O CYS A 62 0.643 7.101 5.937 1.00 0.00 O ATOM 912 CB CYS A 62 -1.521 9.266 4.805 1.00 0.00 C ATOM 913 SG CYS A 62 -1.508 11.032 4.419 1.00 0.00 S ATOM 0 H CYS A 62 0.992 9.700 5.746 1.00 0.00 H new ATOM 0 HA CYS A 62 -1.651 9.090 6.942 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -0.978 8.731 4.026 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.550 8.907 4.780 1.00 0.00 H new ATOM 0 HG CYS A 62 -0.821 11.234 3.334 1.00 0.00 H new ATOM 919 N GLU A 63 -1.472 6.585 6.508 1.00 0.00 N ATOM 920 CA GLU A 63 -1.220 5.150 6.573 1.00 0.00 C ATOM 921 C GLU A 63 -2.518 4.362 6.420 1.00 0.00 C ATOM 922 O GLU A 63 -3.395 4.414 7.284 1.00 0.00 O ATOM 923 CB GLU A 63 -0.544 4.789 7.898 1.00 0.00 C ATOM 924 CG GLU A 63 0.333 3.551 7.816 1.00 0.00 C ATOM 925 CD GLU A 63 0.882 3.135 9.167 1.00 0.00 C ATOM 926 OE1 GLU A 63 0.074 2.800 10.058 1.00 0.00 O ATOM 927 OE2 GLU A 63 2.120 3.144 9.333 1.00 0.00 O ATOM 0 H GLU A 63 -2.432 6.855 6.723 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.556 4.885 5.750 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.062 5.632 8.228 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.311 4.631 8.656 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.244 2.729 7.394 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.162 3.742 7.134 1.00 0.00 H new ATOM 934 N LEU A 64 -2.633 3.632 5.316 1.00 0.00 N ATOM 935 CA LEU A 64 -3.823 2.833 5.048 1.00 0.00 C ATOM 936 C LEU A 64 -3.553 1.353 5.299 1.00 0.00 C ATOM 937 O LEU A 64 -2.414 0.896 5.204 1.00 0.00 O ATOM 938 CB LEU A 64 -4.288 3.041 3.606 1.00 0.00 C ATOM 939 CG LEU A 64 -5.213 1.965 3.036 1.00 0.00 C ATOM 940 CD1 LEU A 64 -6.632 2.157 3.548 1.00 0.00 C ATOM 941 CD2 LEU A 64 -5.184 1.988 1.515 1.00 0.00 C ATOM 0 H LEU A 64 -1.916 3.577 4.592 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.610 3.160 5.727 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -4.801 4.001 3.546 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.407 3.109 2.968 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.857 0.991 3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.277 1.383 3.132 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -6.639 2.089 4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.999 3.137 3.243 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.848 1.216 1.127 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.515 2.964 1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.168 1.801 1.168 1.00 0.00 H new ATOM 953 N GLN A 65 -4.607 0.609 5.616 1.00 0.00 N ATOM 954 CA GLN A 65 -4.483 -0.820 5.878 1.00 0.00 C ATOM 955 C GLN A 65 -5.543 -1.608 5.115 1.00 0.00 C ATOM 956 O GLN A 65 -6.674 -1.149 4.952 1.00 0.00 O ATOM 957 CB GLN A 65 -4.606 -1.098 7.377 1.00 0.00 C ATOM 958 CG GLN A 65 -4.064 -2.457 7.791 1.00 0.00 C ATOM 959 CD GLN A 65 -3.837 -2.565 9.286 1.00 0.00 C ATOM 960 OE1 GLN A 65 -4.787 -2.653 10.065 1.00 0.00 O ATOM 961 NE2 GLN A 65 -2.574 -2.559 9.695 1.00 0.00 N ATOM 0 H GLN A 65 -5.557 0.972 5.698 1.00 0.00 H new ATOM 0 HA GLN A 65 -3.500 -1.142 5.535 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -4.074 -0.321 7.927 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -5.655 -1.031 7.665 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -4.762 -3.233 7.476 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -3.125 -2.643 7.271 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -1.818 -2.484 9.014 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -2.360 -2.629 10.690 1.00 0.00 H new ATOM 970 N ILE A 66 -5.169 -2.795 4.649 1.00 0.00 N ATOM 971 CA ILE A 66 -6.089 -3.646 3.904 1.00 0.00 C ATOM 972 C ILE A 66 -6.141 -5.050 4.497 1.00 0.00 C ATOM 973 O ILE A 66 -5.613 -5.999 3.918 1.00 0.00 O ATOM 974 CB ILE A 66 -5.688 -3.743 2.420 1.00 0.00 C ATOM 975 CG1 ILE A 66 -5.672 -2.352 1.782 1.00 0.00 C ATOM 976 CG2 ILE A 66 -6.642 -4.663 1.673 1.00 0.00 C ATOM 977 CD1 ILE A 66 -4.844 -2.276 0.519 1.00 0.00 C ATOM 0 H ILE A 66 -4.236 -3.189 4.774 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.075 -3.186 3.977 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.684 -4.163 2.356 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -6.695 -2.054 1.554 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.284 -1.634 2.505 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -6.346 -4.721 0.626 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -6.609 -5.659 2.116 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -7.656 -4.269 1.742 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.878 -1.261 0.122 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.811 -2.543 0.744 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -5.245 -2.969 -0.221 1.00 0.00 H new ATOM 989 N ARG A 67 -6.784 -5.174 5.654 1.00 0.00 N ATOM 990 CA ARG A 67 -6.907 -6.462 6.325 1.00 0.00 C ATOM 991 C ARG A 67 -7.362 -7.543 5.349 1.00 0.00 C ATOM 992 O ARG A 67 -8.207 -7.300 4.488 1.00 0.00 O ATOM 993 CB ARG A 67 -7.894 -6.362 7.489 1.00 0.00 C ATOM 994 CG ARG A 67 -7.561 -7.283 8.651 1.00 0.00 C ATOM 995 CD ARG A 67 -8.185 -8.658 8.468 1.00 0.00 C ATOM 996 NE ARG A 67 -7.942 -9.527 9.617 1.00 0.00 N ATOM 997 CZ ARG A 67 -8.647 -9.472 10.742 1.00 0.00 C ATOM 998 NH1 ARG A 67 -9.634 -8.595 10.867 1.00 0.00 N ATOM 999 NH2 ARG A 67 -8.366 -10.295 11.743 1.00 0.00 N ATOM 0 H ARG A 67 -7.227 -4.398 6.146 1.00 0.00 H new ATOM 0 HA ARG A 67 -5.926 -6.737 6.712 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -7.917 -5.333 7.847 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -8.895 -6.596 7.127 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.479 -7.382 8.740 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -7.918 -6.841 9.581 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -9.259 -8.551 8.315 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -7.780 -9.123 7.569 1.00 0.00 H new ATOM 0 HE ARG A 67 -7.190 -10.213 9.552 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -9.853 -7.961 10.099 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -10.174 -8.555 11.731 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -7.608 -10.971 11.650 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -8.908 -10.252 12.606 1.00 0.00 H new ATOM 1013 N GLY A 68 -6.795 -8.737 5.490 1.00 0.00 N ATOM 1014 CA GLY A 68 -7.154 -9.837 4.614 1.00 0.00 C ATOM 1015 C GLY A 68 -6.766 -9.579 3.171 1.00 0.00 C ATOM 1016 O GLY A 68 -7.630 -9.418 2.307 1.00 0.00 O ATOM 0 H GLY A 68 -6.093 -8.962 6.195 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.666 -10.748 4.961 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.229 -10.009 4.673 1.00 0.00 H new ATOM 1020 N LEU A 69 -5.465 -9.539 2.909 1.00 0.00 N ATOM 1021 CA LEU A 69 -4.963 -9.298 1.560 1.00 0.00 C ATOM 1022 C LEU A 69 -5.500 -10.341 0.585 1.00 0.00 C ATOM 1023 O LEU A 69 -6.034 -11.371 0.994 1.00 0.00 O ATOM 1024 CB LEU A 69 -3.434 -9.315 1.553 1.00 0.00 C ATOM 1025 CG LEU A 69 -2.746 -7.978 1.835 1.00 0.00 C ATOM 1026 CD1 LEU A 69 -1.248 -8.174 2.003 1.00 0.00 C ATOM 1027 CD2 LEU A 69 -3.034 -6.985 0.719 1.00 0.00 C ATOM 0 H LEU A 69 -4.738 -9.670 3.612 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.310 -8.316 1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.095 -10.039 2.295 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.099 -9.675 0.580 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.145 -7.574 2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.775 -7.212 2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.061 -8.851 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.832 -8.600 1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.537 -6.040 0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.663 -7.382 -0.226 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.109 -6.821 0.646 1.00 0.00 H new ATOM 1039 N ALA A 70 -5.351 -10.067 -0.707 1.00 0.00 N ATOM 1040 CA ALA A 70 -5.817 -10.983 -1.741 1.00 0.00 C ATOM 1041 C ALA A 70 -5.291 -10.576 -3.113 1.00 0.00 C ATOM 1042 O ALA A 70 -5.098 -9.391 -3.388 1.00 0.00 O ATOM 1043 CB ALA A 70 -7.337 -11.039 -1.751 1.00 0.00 C ATOM 0 H ALA A 70 -4.911 -9.218 -1.063 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.430 -11.976 -1.513 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.671 -11.727 -2.528 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -7.695 -11.386 -0.781 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -7.736 -10.045 -1.951 1.00 0.00 H new ATOM 1049 N VAL A 71 -5.061 -11.565 -3.971 1.00 0.00 N ATOM 1050 CA VAL A 71 -4.558 -11.309 -5.315 1.00 0.00 C ATOM 1051 C VAL A 71 -5.310 -10.157 -5.973 1.00 0.00 C ATOM 1052 O VAL A 71 -4.740 -9.393 -6.752 1.00 0.00 O ATOM 1053 CB VAL A 71 -4.676 -12.560 -6.206 1.00 0.00 C ATOM 1054 CG1 VAL A 71 -4.137 -12.275 -7.600 1.00 0.00 C ATOM 1055 CG2 VAL A 71 -3.945 -13.734 -5.573 1.00 0.00 C ATOM 0 H VAL A 71 -5.215 -12.551 -3.759 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.506 -11.042 -5.214 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.730 -12.823 -6.297 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.228 -13.170 -8.215 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.708 -11.464 -8.052 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.088 -11.987 -7.533 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.038 -14.610 -6.215 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -2.891 -13.484 -5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -4.381 -13.951 -4.598 1.00 0.00 H new ATOM 1065 N VAL A 72 -6.595 -10.038 -5.655 1.00 0.00 N ATOM 1066 CA VAL A 72 -7.426 -8.978 -6.214 1.00 0.00 C ATOM 1067 C VAL A 72 -6.964 -7.607 -5.735 1.00 0.00 C ATOM 1068 O VAL A 72 -6.960 -6.641 -6.498 1.00 0.00 O ATOM 1069 CB VAL A 72 -8.907 -9.169 -5.837 1.00 0.00 C ATOM 1070 CG1 VAL A 72 -9.460 -10.440 -6.464 1.00 0.00 C ATOM 1071 CG2 VAL A 72 -9.072 -9.196 -4.325 1.00 0.00 C ATOM 0 H VAL A 72 -7.083 -10.663 -5.013 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.324 -9.034 -7.298 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.474 -8.324 -6.227 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -10.507 -10.557 -6.186 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.378 -10.376 -7.549 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.892 -11.299 -6.107 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.125 -9.332 -4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -8.492 -10.020 -3.910 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.718 -8.255 -3.903 1.00 0.00 H new ATOM 1081 N ASP A 73 -6.573 -7.529 -4.468 1.00 0.00 N ATOM 1082 CA ASP A 73 -6.106 -6.276 -3.887 1.00 0.00 C ATOM 1083 C ASP A 73 -4.938 -5.708 -4.687 1.00 0.00 C ATOM 1084 O ASP A 73 -4.872 -4.505 -4.938 1.00 0.00 O ATOM 1085 CB ASP A 73 -5.688 -6.488 -2.431 1.00 0.00 C ATOM 1086 CG ASP A 73 -6.861 -6.839 -1.537 1.00 0.00 C ATOM 1087 OD1 ASP A 73 -8.000 -6.455 -1.874 1.00 0.00 O ATOM 1088 OD2 ASP A 73 -6.639 -7.499 -0.501 1.00 0.00 O ATOM 0 H ASP A 73 -6.570 -8.319 -3.823 1.00 0.00 H new ATOM 0 HA ASP A 73 -6.928 -5.561 -3.920 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -4.946 -7.285 -2.381 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -5.209 -5.583 -2.058 1.00 0.00 H new ATOM 1093 N ALA A 74 -4.019 -6.582 -5.085 1.00 0.00 N ATOM 1094 CA ALA A 74 -2.855 -6.167 -5.857 1.00 0.00 C ATOM 1095 C ALA A 74 -3.271 -5.530 -7.178 1.00 0.00 C ATOM 1096 O ALA A 74 -3.481 -6.223 -8.173 1.00 0.00 O ATOM 1097 CB ALA A 74 -1.937 -7.355 -6.107 1.00 0.00 C ATOM 0 H ALA A 74 -4.059 -7.581 -4.885 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.314 -5.419 -5.278 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -1.071 -7.031 -6.685 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -1.604 -7.764 -5.153 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.477 -8.122 -6.662 1.00 0.00 H new ATOM 1103 N GLY A 75 -3.388 -4.206 -7.181 1.00 0.00 N ATOM 1104 CA GLY A 75 -3.780 -3.498 -8.386 1.00 0.00 C ATOM 1105 C GLY A 75 -3.218 -2.091 -8.440 1.00 0.00 C ATOM 1106 O GLY A 75 -2.055 -1.894 -8.791 1.00 0.00 O ATOM 0 H GLY A 75 -3.218 -3.611 -6.370 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -3.440 -4.056 -9.258 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.868 -3.454 -8.440 1.00 0.00 H new ATOM 1110 N GLU A 76 -4.046 -1.111 -8.093 1.00 0.00 N ATOM 1111 CA GLU A 76 -3.625 0.285 -8.107 1.00 0.00 C ATOM 1112 C GLU A 76 -4.398 1.097 -7.071 1.00 0.00 C ATOM 1113 O GLU A 76 -5.612 1.268 -7.180 1.00 0.00 O ATOM 1114 CB GLU A 76 -3.828 0.889 -9.498 1.00 0.00 C ATOM 1115 CG GLU A 76 -3.520 2.375 -9.568 1.00 0.00 C ATOM 1116 CD GLU A 76 -3.085 2.816 -10.952 1.00 0.00 C ATOM 1117 OE1 GLU A 76 -2.318 2.072 -11.598 1.00 0.00 O ATOM 1118 OE2 GLU A 76 -3.513 3.905 -11.390 1.00 0.00 O ATOM 0 H GLU A 76 -5.012 -1.258 -7.799 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.565 0.320 -7.855 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -3.193 0.361 -10.210 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -4.860 0.726 -9.809 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.404 2.940 -9.272 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -2.734 2.614 -8.851 1.00 0.00 H new ATOM 1125 N TYR A 77 -3.685 1.594 -6.066 1.00 0.00 N ATOM 1126 CA TYR A 77 -4.303 2.384 -5.009 1.00 0.00 C ATOM 1127 C TYR A 77 -3.954 3.862 -5.159 1.00 0.00 C ATOM 1128 O TYR A 77 -2.783 4.230 -5.245 1.00 0.00 O ATOM 1129 CB TYR A 77 -3.852 1.880 -3.637 1.00 0.00 C ATOM 1130 CG TYR A 77 -4.334 0.483 -3.317 1.00 0.00 C ATOM 1131 CD1 TYR A 77 -5.579 0.272 -2.737 1.00 0.00 C ATOM 1132 CD2 TYR A 77 -3.543 -0.626 -3.594 1.00 0.00 C ATOM 1133 CE1 TYR A 77 -6.023 -1.003 -2.443 1.00 0.00 C ATOM 1134 CE2 TYR A 77 -3.980 -1.904 -3.304 1.00 0.00 C ATOM 1135 CZ TYR A 77 -5.220 -2.088 -2.729 1.00 0.00 C ATOM 1136 OH TYR A 77 -5.657 -3.359 -2.438 1.00 0.00 O ATOM 0 H TYR A 77 -2.679 1.463 -5.962 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.384 2.273 -5.093 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -2.763 1.899 -3.592 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.214 2.565 -2.870 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.210 1.119 -2.512 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -2.571 -0.486 -4.043 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.993 -1.150 -1.992 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.354 -2.755 -3.527 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.497 -3.309 -1.935 1.00 0.00 H new ATOM 1146 N SER A 78 -4.982 4.705 -5.190 1.00 0.00 N ATOM 1147 CA SER A 78 -4.786 6.143 -5.334 1.00 0.00 C ATOM 1148 C SER A 78 -5.186 6.876 -4.056 1.00 0.00 C ATOM 1149 O SER A 78 -6.157 6.507 -3.395 1.00 0.00 O ATOM 1150 CB SER A 78 -5.600 6.674 -6.515 1.00 0.00 C ATOM 1151 OG SER A 78 -5.350 5.918 -7.687 1.00 0.00 O ATOM 0 H SER A 78 -5.958 4.417 -5.117 1.00 0.00 H new ATOM 0 HA SER A 78 -3.727 6.324 -5.521 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.662 6.637 -6.274 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.349 7.720 -6.693 1.00 0.00 H new ATOM 0 HG SER A 78 -5.883 6.276 -8.427 1.00 0.00 H new ATOM 1157 N CYS A 79 -4.430 7.914 -3.717 1.00 0.00 N ATOM 1158 CA CYS A 79 -4.704 8.699 -2.518 1.00 0.00 C ATOM 1159 C CYS A 79 -5.003 10.151 -2.876 1.00 0.00 C ATOM 1160 O CYS A 79 -4.131 10.875 -3.358 1.00 0.00 O ATOM 1161 CB CYS A 79 -3.517 8.632 -1.557 1.00 0.00 C ATOM 1162 SG CYS A 79 -3.868 9.275 0.096 1.00 0.00 S ATOM 0 H CYS A 79 -3.623 8.232 -4.254 1.00 0.00 H new ATOM 0 HA CYS A 79 -5.582 8.276 -2.029 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -3.192 7.595 -1.470 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -2.685 9.192 -1.984 1.00 0.00 H new ATOM 0 HG CYS A 79 -5.154 9.333 0.275 1.00 0.00 H new ATOM 1168 N VAL A 80 -6.241 10.571 -2.639 1.00 0.00 N ATOM 1169 CA VAL A 80 -6.656 11.937 -2.936 1.00 0.00 C ATOM 1170 C VAL A 80 -6.618 12.808 -1.685 1.00 0.00 C ATOM 1171 O VAL A 80 -7.378 12.590 -0.741 1.00 0.00 O ATOM 1172 CB VAL A 80 -8.076 11.976 -3.532 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -8.367 13.343 -4.130 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -8.245 10.881 -4.575 1.00 0.00 C ATOM 0 H VAL A 80 -6.975 9.985 -2.242 1.00 0.00 H new ATOM 0 HA VAL A 80 -5.951 12.329 -3.669 1.00 0.00 H new ATOM 0 HB VAL A 80 -8.793 11.797 -2.731 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.374 13.351 -4.546 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -8.289 14.104 -3.353 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.647 13.555 -4.920 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.254 10.923 -4.986 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -7.520 11.027 -5.376 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.082 9.908 -4.111 1.00 0.00 H new ATOM 1184 N CYS A 81 -5.728 13.795 -1.685 1.00 0.00 N ATOM 1185 CA CYS A 81 -5.590 14.700 -0.550 1.00 0.00 C ATOM 1186 C CYS A 81 -6.439 15.952 -0.746 1.00 0.00 C ATOM 1187 O CYS A 81 -6.847 16.595 0.220 1.00 0.00 O ATOM 1188 CB CYS A 81 -4.124 15.088 -0.356 1.00 0.00 C ATOM 1189 SG CYS A 81 -3.845 16.277 0.978 1.00 0.00 S ATOM 0 H CYS A 81 -5.092 13.988 -2.458 1.00 0.00 H new ATOM 0 HA CYS A 81 -5.942 14.181 0.342 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -3.545 14.187 -0.152 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -3.744 15.508 -1.288 1.00 0.00 H new ATOM 0 HG CYS A 81 -4.946 16.926 1.218 1.00 0.00 H new ATOM 1195 N GLY A 82 -6.700 16.293 -2.004 1.00 0.00 N ATOM 1196 CA GLY A 82 -7.497 17.468 -2.304 1.00 0.00 C ATOM 1197 C GLY A 82 -7.401 17.877 -3.761 1.00 0.00 C ATOM 1198 O GLY A 82 -8.236 17.489 -4.577 1.00 0.00 O ATOM 0 H GLY A 82 -6.374 15.777 -2.821 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -8.539 17.270 -2.053 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -7.169 18.296 -1.675 1.00 0.00 H new ATOM 1202 N GLN A 83 -6.380 18.663 -4.087 1.00 0.00 N ATOM 1203 CA GLN A 83 -6.180 19.127 -5.455 1.00 0.00 C ATOM 1204 C GLN A 83 -5.326 18.140 -6.244 1.00 0.00 C ATOM 1205 O GLN A 83 -5.471 18.014 -7.460 1.00 0.00 O ATOM 1206 CB GLN A 83 -5.520 20.507 -5.457 1.00 0.00 C ATOM 1207 CG GLN A 83 -5.228 21.039 -6.850 1.00 0.00 C ATOM 1208 CD GLN A 83 -6.488 21.295 -7.653 1.00 0.00 C ATOM 1209 OE1 GLN A 83 -7.066 20.375 -8.233 1.00 0.00 O ATOM 1210 NE2 GLN A 83 -6.921 22.550 -7.692 1.00 0.00 N ATOM 0 H GLN A 83 -5.679 18.992 -3.423 1.00 0.00 H new ATOM 0 HA GLN A 83 -7.156 19.199 -5.934 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -6.169 21.212 -4.937 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -4.588 20.456 -4.894 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -4.659 21.965 -6.769 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -4.601 20.325 -7.383 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -6.411 23.281 -7.196 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -7.764 22.783 -8.217 1.00 0.00 H new ATOM 1219 N GLU A 84 -4.435 17.444 -5.545 1.00 0.00 N ATOM 1220 CA GLU A 84 -3.557 16.470 -6.182 1.00 0.00 C ATOM 1221 C GLU A 84 -3.940 15.048 -5.782 1.00 0.00 C ATOM 1222 O GLU A 84 -4.735 14.843 -4.865 1.00 0.00 O ATOM 1223 CB GLU A 84 -2.099 16.742 -5.806 1.00 0.00 C ATOM 1224 CG GLU A 84 -1.523 17.986 -6.459 1.00 0.00 C ATOM 1225 CD GLU A 84 -1.313 17.818 -7.951 1.00 0.00 C ATOM 1226 OE1 GLU A 84 -0.565 16.898 -8.345 1.00 0.00 O ATOM 1227 OE2 GLU A 84 -1.896 18.605 -8.726 1.00 0.00 O ATOM 0 H GLU A 84 -4.302 17.537 -4.538 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.671 16.568 -7.262 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -2.025 16.843 -4.723 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -1.493 15.881 -6.088 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.193 18.828 -6.283 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.572 18.232 -5.987 1.00 0.00 H new ATOM 1234 N ARG A 85 -3.370 14.070 -6.479 1.00 0.00 N ATOM 1235 CA ARG A 85 -3.654 12.668 -6.198 1.00 0.00 C ATOM 1236 C ARG A 85 -2.514 11.776 -6.682 1.00 0.00 C ATOM 1237 O ARG A 85 -2.023 11.928 -7.801 1.00 0.00 O ATOM 1238 CB ARG A 85 -4.964 12.246 -6.866 1.00 0.00 C ATOM 1239 CG ARG A 85 -5.131 10.740 -6.983 1.00 0.00 C ATOM 1240 CD ARG A 85 -6.340 10.378 -7.831 1.00 0.00 C ATOM 1241 NE ARG A 85 -6.000 10.262 -9.247 1.00 0.00 N ATOM 1242 CZ ARG A 85 -6.897 10.040 -10.202 1.00 0.00 C ATOM 1243 NH1 ARG A 85 -8.180 9.911 -9.894 1.00 0.00 N ATOM 1244 NH2 ARG A 85 -6.510 9.947 -11.468 1.00 0.00 N ATOM 0 H ARG A 85 -2.710 14.223 -7.241 1.00 0.00 H new ATOM 0 HA ARG A 85 -3.751 12.552 -5.119 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -5.800 12.652 -6.296 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -5.013 12.687 -7.862 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -4.233 10.306 -7.424 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -5.240 10.307 -5.989 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -6.760 9.435 -7.480 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -7.112 11.137 -7.704 1.00 0.00 H new ATOM 0 HE ARG A 85 -5.021 10.357 -9.517 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -8.481 9.982 -8.922 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -8.866 9.741 -10.629 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -5.524 10.046 -11.708 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -7.199 9.777 -12.201 1.00 0.00 H new ATOM 1258 N THR A 86 -2.096 10.844 -5.831 1.00 0.00 N ATOM 1259 CA THR A 86 -1.014 9.929 -6.170 1.00 0.00 C ATOM 1260 C THR A 86 -1.546 8.529 -6.456 1.00 0.00 C ATOM 1261 O THR A 86 -2.710 8.230 -6.187 1.00 0.00 O ATOM 1262 CB THR A 86 0.028 9.847 -5.039 1.00 0.00 C ATOM 1263 OG1 THR A 86 1.157 9.078 -5.467 1.00 0.00 O ATOM 1264 CG2 THR A 86 -0.575 9.221 -3.791 1.00 0.00 C ATOM 0 H THR A 86 -2.491 10.703 -4.901 1.00 0.00 H new ATOM 0 HA THR A 86 -0.537 10.324 -7.067 1.00 0.00 H new ATOM 0 HB THR A 86 0.350 10.860 -4.798 1.00 0.00 H new ATOM 0 HG1 THR A 86 1.815 9.032 -4.743 1.00 0.00 H new ATOM 0 HG21 THR A 86 0.180 9.174 -3.006 1.00 0.00 H new ATOM 0 HG22 THR A 86 -1.415 9.826 -3.450 1.00 0.00 H new ATOM 0 HG23 THR A 86 -0.923 8.214 -4.021 1.00 0.00 H new ATOM 1272 N SER A 87 -0.688 7.675 -7.003 1.00 0.00 N ATOM 1273 CA SER A 87 -1.073 6.307 -7.329 1.00 0.00 C ATOM 1274 C SER A 87 0.110 5.357 -7.172 1.00 0.00 C ATOM 1275 O SER A 87 1.265 5.757 -7.316 1.00 0.00 O ATOM 1276 CB SER A 87 -1.615 6.233 -8.758 1.00 0.00 C ATOM 1277 OG SER A 87 -0.667 6.726 -9.689 1.00 0.00 O ATOM 0 H SER A 87 0.279 7.906 -7.230 1.00 0.00 H new ATOM 0 HA SER A 87 -1.856 6.002 -6.635 1.00 0.00 H new ATOM 0 HB2 SER A 87 -1.866 5.201 -9.002 1.00 0.00 H new ATOM 0 HB3 SER A 87 -2.536 6.811 -8.831 1.00 0.00 H new ATOM 0 HG SER A 87 -1.036 6.666 -10.595 1.00 0.00 H new ATOM 1283 N ALA A 88 -0.186 4.095 -6.877 1.00 0.00 N ATOM 1284 CA ALA A 88 0.852 3.087 -6.703 1.00 0.00 C ATOM 1285 C ALA A 88 0.297 1.684 -6.924 1.00 0.00 C ATOM 1286 O ALA A 88 -0.878 1.421 -6.664 1.00 0.00 O ATOM 1287 CB ALA A 88 1.470 3.200 -5.317 1.00 0.00 C ATOM 0 H ALA A 88 -1.137 3.747 -6.754 1.00 0.00 H new ATOM 0 HA ALA A 88 1.626 3.265 -7.450 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.244 2.441 -5.201 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.911 4.189 -5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 88 0.699 3.051 -4.561 1.00 0.00 H new ATOM 1293 N THR A 89 1.149 0.785 -7.405 1.00 0.00 N ATOM 1294 CA THR A 89 0.744 -0.591 -7.663 1.00 0.00 C ATOM 1295 C THR A 89 1.098 -1.498 -6.490 1.00 0.00 C ATOM 1296 O THR A 89 2.208 -1.439 -5.960 1.00 0.00 O ATOM 1297 CB THR A 89 1.405 -1.142 -8.941 1.00 0.00 C ATOM 1298 OG1 THR A 89 1.165 -0.254 -10.038 1.00 0.00 O ATOM 1299 CG2 THR A 89 0.868 -2.526 -9.275 1.00 0.00 C ATOM 0 H THR A 89 2.125 0.985 -7.624 1.00 0.00 H new ATOM 0 HA THR A 89 -0.338 -0.581 -7.798 1.00 0.00 H new ATOM 0 HB THR A 89 2.478 -1.219 -8.764 1.00 0.00 H new ATOM 0 HG1 THR A 89 1.590 -0.610 -10.846 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.349 -2.894 -10.181 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.078 -3.207 -8.450 1.00 0.00 H new ATOM 0 HG23 THR A 89 -0.209 -2.470 -9.434 1.00 0.00 H new ATOM 1307 N LEU A 90 0.148 -2.336 -6.089 1.00 0.00 N ATOM 1308 CA LEU A 90 0.361 -3.257 -4.978 1.00 0.00 C ATOM 1309 C LEU A 90 0.460 -4.696 -5.474 1.00 0.00 C ATOM 1310 O LEU A 90 -0.339 -5.136 -6.302 1.00 0.00 O ATOM 1311 CB LEU A 90 -0.777 -3.133 -3.962 1.00 0.00 C ATOM 1312 CG LEU A 90 -0.638 -3.975 -2.693 1.00 0.00 C ATOM 1313 CD1 LEU A 90 -1.315 -3.285 -1.519 1.00 0.00 C ATOM 1314 CD2 LEU A 90 -1.223 -5.363 -2.907 1.00 0.00 C ATOM 0 H LEU A 90 -0.776 -2.397 -6.516 1.00 0.00 H new ATOM 0 HA LEU A 90 1.302 -2.993 -4.495 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.866 -2.086 -3.672 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.709 -3.407 -4.456 1.00 0.00 H new ATOM 0 HG LEU A 90 0.422 -4.081 -2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.206 -3.898 -0.624 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.851 -2.313 -1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.374 -3.148 -1.739 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.115 -5.948 -1.994 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.280 -5.277 -3.161 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -0.694 -5.859 -3.720 1.00 0.00 H new ATOM 1326 N THR A 91 1.445 -5.427 -4.961 1.00 0.00 N ATOM 1327 CA THR A 91 1.648 -6.817 -5.351 1.00 0.00 C ATOM 1328 C THR A 91 1.341 -7.762 -4.196 1.00 0.00 C ATOM 1329 O THR A 91 1.710 -7.500 -3.051 1.00 0.00 O ATOM 1330 CB THR A 91 3.092 -7.060 -5.830 1.00 0.00 C ATOM 1331 OG1 THR A 91 3.373 -6.244 -6.973 1.00 0.00 O ATOM 1332 CG2 THR A 91 3.305 -8.525 -6.181 1.00 0.00 C ATOM 0 H THR A 91 2.115 -5.079 -4.275 1.00 0.00 H new ATOM 0 HA THR A 91 0.962 -7.019 -6.173 1.00 0.00 H new ATOM 0 HB THR A 91 3.771 -6.794 -5.020 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.293 -6.403 -7.270 1.00 0.00 H new ATOM 0 HG21 THR A 91 4.331 -8.673 -6.517 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.118 -9.141 -5.301 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.618 -8.812 -6.977 1.00 0.00 H new ATOM 1340 N VAL A 92 0.664 -8.864 -4.503 1.00 0.00 N ATOM 1341 CA VAL A 92 0.309 -9.851 -3.490 1.00 0.00 C ATOM 1342 C VAL A 92 0.709 -11.255 -3.927 1.00 0.00 C ATOM 1343 O VAL A 92 0.029 -11.880 -4.741 1.00 0.00 O ATOM 1344 CB VAL A 92 -1.202 -9.829 -3.190 1.00 0.00 C ATOM 1345 CG1 VAL A 92 -1.530 -10.759 -2.032 1.00 0.00 C ATOM 1346 CG2 VAL A 92 -1.665 -8.410 -2.893 1.00 0.00 C ATOM 0 H VAL A 92 0.350 -9.096 -5.445 1.00 0.00 H new ATOM 0 HA VAL A 92 0.855 -9.586 -2.585 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.735 -10.184 -4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.602 -10.730 -1.835 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.235 -11.777 -2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.988 -10.437 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.735 -8.413 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.126 -8.025 -2.027 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.466 -7.774 -3.756 1.00 0.00 H new ATOM 1356 N ARG A 93 1.816 -11.747 -3.380 1.00 0.00 N ATOM 1357 CA ARG A 93 2.307 -13.078 -3.713 1.00 0.00 C ATOM 1358 C ARG A 93 1.426 -14.155 -3.087 1.00 0.00 C ATOM 1359 O ARG A 93 1.502 -14.413 -1.886 1.00 0.00 O ATOM 1360 CB ARG A 93 3.751 -13.246 -3.239 1.00 0.00 C ATOM 1361 CG ARG A 93 4.710 -12.227 -3.832 1.00 0.00 C ATOM 1362 CD ARG A 93 6.117 -12.790 -3.954 1.00 0.00 C ATOM 1363 NE ARG A 93 7.135 -11.748 -3.850 1.00 0.00 N ATOM 1364 CZ ARG A 93 8.415 -11.939 -4.147 1.00 0.00 C ATOM 1365 NH1 ARG A 93 8.833 -13.126 -4.564 1.00 0.00 N ATOM 1366 NH2 ARG A 93 9.282 -10.941 -4.027 1.00 0.00 N ATOM 0 H ARG A 93 2.390 -11.243 -2.704 1.00 0.00 H new ATOM 0 HA ARG A 93 2.273 -13.190 -4.797 1.00 0.00 H new ATOM 0 HB2 ARG A 93 3.779 -13.169 -2.152 1.00 0.00 H new ATOM 0 HB3 ARG A 93 4.094 -14.248 -3.496 1.00 0.00 H new ATOM 0 HG2 ARG A 93 4.354 -11.920 -4.815 1.00 0.00 H new ATOM 0 HG3 ARG A 93 4.727 -11.335 -3.206 1.00 0.00 H new ATOM 0 HD2 ARG A 93 6.279 -13.534 -3.174 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.220 -13.303 -4.910 1.00 0.00 H new ATOM 0 HE ARG A 93 6.847 -10.823 -3.532 1.00 0.00 H new ATOM 0 HH11 ARG A 93 8.171 -13.896 -4.658 1.00 0.00 H new ATOM 0 HH12 ARG A 93 9.817 -13.269 -4.791 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.965 -10.026 -3.706 1.00 0.00 H new ATOM 0 HH22 ARG A 93 10.265 -11.089 -4.255 1.00 0.00 H new ATOM 1380 N ALA A 94 0.590 -14.781 -3.910 1.00 0.00 N ATOM 1381 CA ALA A 94 -0.304 -15.831 -3.437 1.00 0.00 C ATOM 1382 C ALA A 94 0.445 -16.843 -2.576 1.00 0.00 C ATOM 1383 O ALA A 94 1.523 -17.310 -2.945 1.00 0.00 O ATOM 1384 CB ALA A 94 -0.970 -16.527 -4.615 1.00 0.00 C ATOM 0 H ALA A 94 0.514 -14.579 -4.907 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.074 -15.368 -2.820 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.635 -17.309 -4.247 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.546 -15.801 -5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.207 -16.971 -5.254 1.00 0.00 H new ATOM 1390 N LEU A 95 -0.133 -17.177 -1.427 1.00 0.00 N ATOM 1391 CA LEU A 95 0.480 -18.134 -0.513 1.00 0.00 C ATOM 1392 C LEU A 95 0.709 -19.475 -1.201 1.00 0.00 C ATOM 1393 O LEU A 95 -0.062 -19.899 -2.063 1.00 0.00 O ATOM 1394 CB LEU A 95 -0.402 -18.326 0.722 1.00 0.00 C ATOM 1395 CG LEU A 95 -0.388 -17.185 1.740 1.00 0.00 C ATOM 1396 CD1 LEU A 95 -1.680 -17.171 2.543 1.00 0.00 C ATOM 1397 CD2 LEU A 95 0.815 -17.309 2.664 1.00 0.00 C ATOM 0 H LEU A 95 -1.025 -16.799 -1.107 1.00 0.00 H new ATOM 0 HA LEU A 95 1.446 -17.736 -0.204 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.429 -18.478 0.390 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -0.092 -19.241 1.227 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.310 -16.242 1.199 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.652 -16.353 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.526 -17.033 1.869 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.789 -18.117 3.074 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.809 -16.489 3.382 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.768 -18.258 3.198 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.732 -17.269 2.075 1.00 0.00 H new ATOM 1409 N PRO A 96 1.793 -20.163 -0.813 1.00 0.00 N ATOM 1410 CA PRO A 96 2.148 -21.468 -1.378 1.00 0.00 C ATOM 1411 C PRO A 96 1.178 -22.566 -0.953 1.00 0.00 C ATOM 1412 O PRO A 96 0.763 -22.627 0.203 1.00 0.00 O ATOM 1413 CB PRO A 96 3.542 -21.736 -0.806 1.00 0.00 C ATOM 1414 CG PRO A 96 3.592 -20.945 0.455 1.00 0.00 C ATOM 1415 CD PRO A 96 2.756 -19.719 0.209 1.00 0.00 C ATOM 0 HA PRO A 96 2.114 -21.463 -2.467 1.00 0.00 H new ATOM 0 HB2 PRO A 96 3.693 -22.798 -0.613 1.00 0.00 H new ATOM 0 HB3 PRO A 96 4.322 -21.424 -1.501 1.00 0.00 H new ATOM 0 HG2 PRO A 96 3.201 -21.522 1.293 1.00 0.00 H new ATOM 0 HG3 PRO A 96 4.618 -20.674 0.705 1.00 0.00 H new ATOM 0 HD2 PRO A 96 2.253 -19.386 1.117 1.00 0.00 H new ATOM 0 HD3 PRO A 96 3.361 -18.884 -0.145 1.00 0.00 H new ATOM 1423 N ALA A 97 0.823 -23.432 -1.897 1.00 0.00 N ATOM 1424 CA ALA A 97 -0.096 -24.530 -1.619 1.00 0.00 C ATOM 1425 C ALA A 97 0.559 -25.878 -1.898 1.00 0.00 C ATOM 1426 O ALA A 97 0.402 -26.443 -2.980 1.00 0.00 O ATOM 1427 CB ALA A 97 -1.365 -24.377 -2.444 1.00 0.00 C ATOM 0 H ALA A 97 1.157 -23.395 -2.860 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.357 -24.494 -0.561 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.042 -25.203 -2.227 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.851 -23.434 -2.193 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.113 -24.384 -3.504 1.00 0.00 H new ATOM 1433 N ARG A 98 1.295 -26.387 -0.916 1.00 0.00 N ATOM 1434 CA ARG A 98 1.976 -27.669 -1.057 1.00 0.00 C ATOM 1435 C ARG A 98 1.499 -28.658 0.002 1.00 0.00 C ATOM 1436 O ARG A 98 0.907 -28.268 1.009 1.00 0.00 O ATOM 1437 CB ARG A 98 3.491 -27.481 -0.948 1.00 0.00 C ATOM 1438 CG ARG A 98 3.946 -26.980 0.413 1.00 0.00 C ATOM 1439 CD ARG A 98 4.024 -28.112 1.425 1.00 0.00 C ATOM 1440 NE ARG A 98 5.050 -27.872 2.436 1.00 0.00 N ATOM 1441 CZ ARG A 98 6.346 -27.773 2.159 1.00 0.00 C ATOM 1442 NH1 ARG A 98 6.771 -27.894 0.909 1.00 0.00 N ATOM 1443 NH2 ARG A 98 7.219 -27.554 3.134 1.00 0.00 N ATOM 0 H ARG A 98 1.435 -25.932 -0.014 1.00 0.00 H new ATOM 0 HA ARG A 98 1.736 -28.072 -2.041 1.00 0.00 H new ATOM 0 HB2 ARG A 98 3.983 -28.431 -1.159 1.00 0.00 H new ATOM 0 HB3 ARG A 98 3.817 -26.776 -1.713 1.00 0.00 H new ATOM 0 HG2 ARG A 98 4.923 -26.506 0.320 1.00 0.00 H new ATOM 0 HG3 ARG A 98 3.255 -26.217 0.771 1.00 0.00 H new ATOM 0 HD2 ARG A 98 3.056 -28.230 1.912 1.00 0.00 H new ATOM 0 HD3 ARG A 98 4.237 -29.047 0.907 1.00 0.00 H new ATOM 0 HE ARG A 98 4.756 -27.775 3.408 1.00 0.00 H new ATOM 0 HH11 ARG A 98 6.103 -28.063 0.157 1.00 0.00 H new ATOM 0 HH12 ARG A 98 7.766 -27.818 0.699 1.00 0.00 H new ATOM 0 HH21 ARG A 98 6.896 -27.462 4.097 1.00 0.00 H new ATOM 0 HH22 ARG A 98 8.214 -27.478 2.921 1.00 0.00 H new ATOM 1457 N PHE A 99 1.759 -29.940 -0.233 1.00 0.00 N ATOM 1458 CA PHE A 99 1.355 -30.985 0.700 1.00 0.00 C ATOM 1459 C PHE A 99 2.313 -32.171 0.636 1.00 0.00 C ATOM 1460 O PHE A 99 3.085 -32.309 -0.313 1.00 0.00 O ATOM 1461 CB PHE A 99 -0.070 -31.449 0.392 1.00 0.00 C ATOM 1462 CG PHE A 99 -0.194 -32.179 -0.915 1.00 0.00 C ATOM 1463 CD1 PHE A 99 -0.395 -31.482 -2.096 1.00 0.00 C ATOM 1464 CD2 PHE A 99 -0.110 -33.561 -0.963 1.00 0.00 C ATOM 1465 CE1 PHE A 99 -0.509 -32.150 -3.301 1.00 0.00 C ATOM 1466 CE2 PHE A 99 -0.223 -34.234 -2.165 1.00 0.00 C ATOM 1467 CZ PHE A 99 -0.424 -33.528 -3.335 1.00 0.00 C ATOM 0 H PHE A 99 2.248 -30.280 -1.061 1.00 0.00 H new ATOM 0 HA PHE A 99 1.385 -30.570 1.707 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.413 -32.100 1.196 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.731 -30.582 0.379 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.463 -30.404 -2.075 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.045 -34.119 -0.051 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -0.664 -31.595 -4.214 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.154 -35.312 -2.189 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.515 -34.053 -4.275 1.00 0.00 H new ATOM 1477 N ILE A 100 2.257 -33.025 1.653 1.00 0.00 N ATOM 1478 CA ILE A 100 3.118 -34.199 1.713 1.00 0.00 C ATOM 1479 C ILE A 100 2.297 -35.484 1.703 1.00 0.00 C ATOM 1480 O ILE A 100 1.495 -35.726 2.604 1.00 0.00 O ATOM 1481 CB ILE A 100 4.008 -34.181 2.970 1.00 0.00 C ATOM 1482 CG1 ILE A 100 5.034 -35.315 2.911 1.00 0.00 C ATOM 1483 CG2 ILE A 100 3.155 -34.295 4.224 1.00 0.00 C ATOM 1484 CD1 ILE A 100 6.248 -35.076 3.781 1.00 0.00 C ATOM 0 H ILE A 100 1.624 -32.925 2.447 1.00 0.00 H new ATOM 0 HA ILE A 100 3.753 -34.170 0.828 1.00 0.00 H new ATOM 0 HB ILE A 100 4.544 -33.233 3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.554 -36.245 3.218 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.357 -35.449 1.879 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.798 -34.281 5.104 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.460 -33.456 4.269 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.595 -35.230 4.199 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.933 -35.919 3.690 1.00 0.00 H new ATOM 0 HD12 ILE A 100 6.751 -34.164 3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.936 -34.972 4.820 1.00 0.00 H new ATOM 1496 N GLU A 101 2.506 -36.305 0.678 1.00 0.00 N ATOM 1497 CA GLU A 101 1.785 -37.567 0.553 1.00 0.00 C ATOM 1498 C GLU A 101 2.509 -38.683 1.300 1.00 0.00 C ATOM 1499 O GLU A 101 2.744 -39.760 0.752 1.00 0.00 O ATOM 1500 CB GLU A 101 1.626 -37.944 -0.922 1.00 0.00 C ATOM 1501 CG GLU A 101 0.428 -38.837 -1.196 1.00 0.00 C ATOM 1502 CD GLU A 101 0.075 -38.903 -2.669 1.00 0.00 C ATOM 1503 OE1 GLU A 101 0.309 -37.905 -3.382 1.00 0.00 O ATOM 1504 OE2 GLU A 101 -0.436 -39.955 -3.109 1.00 0.00 O ATOM 0 H GLU A 101 3.167 -36.119 -0.076 1.00 0.00 H new ATOM 0 HA GLU A 101 0.798 -37.438 0.996 1.00 0.00 H new ATOM 0 HB2 GLU A 101 1.532 -37.033 -1.513 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.531 -38.451 -1.258 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.638 -39.842 -0.831 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -0.431 -38.468 -0.636 1.00 0.00 H new ATOM 1511 N SER A 102 2.859 -38.418 2.554 1.00 0.00 N ATOM 1512 CA SER A 102 3.560 -39.398 3.375 1.00 0.00 C ATOM 1513 C SER A 102 2.705 -40.644 3.583 1.00 0.00 C ATOM 1514 O SER A 102 1.743 -40.629 4.350 1.00 0.00 O ATOM 1515 CB SER A 102 3.931 -38.788 4.729 1.00 0.00 C ATOM 1516 OG SER A 102 4.855 -39.609 5.422 1.00 0.00 O ATOM 0 H SER A 102 2.669 -37.533 3.024 1.00 0.00 H new ATOM 0 HA SER A 102 4.472 -39.688 2.853 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.361 -37.797 4.580 1.00 0.00 H new ATOM 0 HB3 SER A 102 3.032 -38.658 5.331 1.00 0.00 H new ATOM 0 HG SER A 102 5.077 -39.197 6.283 1.00 0.00 H new ATOM 1522 N GLY A 103 3.063 -41.722 2.892 1.00 0.00 N ATOM 1523 CA GLY A 103 2.318 -42.962 3.014 1.00 0.00 C ATOM 1524 C GLY A 103 2.123 -43.654 1.680 1.00 0.00 C ATOM 1525 O GLY A 103 1.017 -43.714 1.143 1.00 0.00 O ATOM 0 H GLY A 103 3.855 -41.759 2.250 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.843 -43.632 3.694 1.00 0.00 H new ATOM 0 HA3 GLY A 103 1.344 -42.755 3.458 1.00 0.00 H new ATOM 1529 N PRO A 104 3.218 -44.191 1.121 1.00 0.00 N ATOM 1530 CA PRO A 104 3.188 -44.891 -0.166 1.00 0.00 C ATOM 1531 C PRO A 104 2.456 -46.226 -0.084 1.00 0.00 C ATOM 1532 O PRO A 104 2.241 -46.890 -1.097 1.00 0.00 O ATOM 1533 CB PRO A 104 4.669 -45.111 -0.485 1.00 0.00 C ATOM 1534 CG PRO A 104 5.346 -45.114 0.842 1.00 0.00 C ATOM 1535 CD PRO A 104 4.570 -44.156 1.704 1.00 0.00 C ATOM 0 HA PRO A 104 2.654 -44.322 -0.927 1.00 0.00 H new ATOM 0 HB2 PRO A 104 4.825 -46.053 -1.011 1.00 0.00 H new ATOM 0 HB3 PRO A 104 5.058 -44.320 -1.126 1.00 0.00 H new ATOM 0 HG2 PRO A 104 5.350 -46.114 1.276 1.00 0.00 H new ATOM 0 HG3 PRO A 104 6.386 -44.802 0.750 1.00 0.00 H new ATOM 0 HD2 PRO A 104 4.566 -44.468 2.748 1.00 0.00 H new ATOM 0 HD3 PRO A 104 4.995 -43.153 1.673 1.00 0.00 H new ATOM 1543 N SER A 105 2.076 -46.613 1.130 1.00 0.00 N ATOM 1544 CA SER A 105 1.371 -47.871 1.345 1.00 0.00 C ATOM 1545 C SER A 105 2.304 -49.059 1.136 1.00 0.00 C ATOM 1546 O SER A 105 2.015 -49.959 0.347 1.00 0.00 O ATOM 1547 CB SER A 105 0.172 -47.976 0.400 1.00 0.00 C ATOM 1548 OG SER A 105 -0.395 -46.702 0.152 1.00 0.00 O ATOM 0 H SER A 105 2.245 -46.073 1.979 1.00 0.00 H new ATOM 0 HA SER A 105 1.015 -47.888 2.375 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.485 -48.427 -0.541 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.581 -48.634 0.834 1.00 0.00 H new ATOM 0 HG SER A 105 -1.158 -46.796 -0.456 1.00 0.00 H new ATOM 1554 N SER A 106 3.426 -49.055 1.849 1.00 0.00 N ATOM 1555 CA SER A 106 4.405 -50.131 1.740 1.00 0.00 C ATOM 1556 C SER A 106 4.371 -51.024 2.976 1.00 0.00 C ATOM 1557 O SER A 106 3.809 -50.655 4.007 1.00 0.00 O ATOM 1558 CB SER A 106 5.809 -49.553 1.552 1.00 0.00 C ATOM 1559 OG SER A 106 6.196 -48.779 2.674 1.00 0.00 O ATOM 0 H SER A 106 3.680 -48.319 2.508 1.00 0.00 H new ATOM 0 HA SER A 106 4.149 -50.736 0.870 1.00 0.00 H new ATOM 0 HB2 SER A 106 6.522 -50.363 1.402 1.00 0.00 H new ATOM 0 HB3 SER A 106 5.834 -48.936 0.654 1.00 0.00 H new ATOM 0 HG SER A 106 7.097 -48.422 2.530 1.00 0.00 H new ATOM 1565 N GLY A 107 4.977 -52.202 2.864 1.00 0.00 N ATOM 1566 CA GLY A 107 5.005 -53.131 3.979 1.00 0.00 C ATOM 1567 C GLY A 107 3.675 -53.208 4.703 1.00 0.00 C ATOM 1568 O GLY A 107 2.786 -53.958 4.302 1.00 0.00 O ATOM 0 H GLY A 107 5.449 -52.530 2.021 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.275 -54.122 3.615 1.00 0.00 H new ATOM 0 HA3 GLY A 107 5.781 -52.827 4.682 1.00 0.00 H new TER 1572 GLY A 107