USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 887 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 SER N :NH3+ 154:sc= 0.00276 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00106 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.258 K(o=-0.26,f=-1.7!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0285 X(o=-0.028,f=-0.06) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 80:sc= 1.26 USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 44 GLN : amide:sc= -0.189 K(o=-0.19,f=-0.88) USER MOD Single : A 45 LYS NZ :NH3+ 148:sc= 1.28 (180deg=0.135) USER MOD Single : A 46 HIS : no HD1:sc= -0.505 X(o=-0.5,f=-0.031) USER MOD Single : A 48 GLN : amide:sc= -1.15 K(o=-1.1,f=-0.58) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -168:sc= 1.26 (180deg=0.974) USER MOD Single : A 64 GLN : amide:sc= -0.692 K(o=-0.69,f=-1.7) USER MOD Single : A 67 GLN : amide:sc= -0.696 K(o=-0.7,f=0) USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 73 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.33) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0127) USER MOD Single : A 86 SER OG : rot 56:sc= 1.17 USER MOD Single : A 89 GLN : amide:sc= 0.703 K(o=0.7,f=-0.6) USER MOD Single : A 96 GLN : amide:sc= -0.357 K(o=-0.36,f=-2.2) USER MOD Single : A 99 GLN : amide:sc= 0.576 K(o=0.58,f=-7.2!) USER MOD Single : A 100 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0292) USER MOD Single : A 107 LYS NZ :NH3+ 176:sc= 1.84 (180deg=1.77) USER MOD Single : A 108 LYS NZ :NH3+ -179:sc= 0.0328 (180deg=0.0035) USER MOD Single : A 109 ASN : amide:sc= -0.698 K(o=-0.7,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.912 12.420 18.676 1.00 0.00 N ATOM 2 CA SER A 1 4.101 12.305 17.831 1.00 0.00 C ATOM 3 C SER A 1 4.154 10.941 17.165 1.00 0.00 C ATOM 4 O SER A 1 4.032 9.909 17.831 1.00 0.00 O ATOM 5 CB SER A 1 5.361 12.538 18.665 1.00 0.00 C ATOM 6 OG SER A 1 5.342 13.827 19.261 1.00 0.00 O ATOM 0 H1 SER A 1 3.089 13.112 19.432 1.00 0.00 H new ATOM 0 H2 SER A 1 2.106 12.735 18.100 1.00 0.00 H new ATOM 0 H3 SER A 1 2.695 11.495 19.098 1.00 0.00 H new ATOM 0 HA SER A 1 4.048 13.065 17.051 1.00 0.00 H new ATOM 0 HB2 SER A 1 5.435 11.775 19.440 1.00 0.00 H new ATOM 0 HB3 SER A 1 6.244 12.438 18.034 1.00 0.00 H new ATOM 0 HG SER A 1 6.156 13.954 19.791 1.00 0.00 H new ATOM 14 N GLU A 2 4.315 10.938 15.854 1.00 0.00 N ATOM 15 CA GLU A 2 4.420 9.706 15.097 1.00 0.00 C ATOM 16 C GLU A 2 5.836 9.171 15.183 1.00 0.00 C ATOM 17 O GLU A 2 6.799 9.944 15.149 1.00 0.00 O ATOM 18 CB GLU A 2 4.067 9.948 13.623 1.00 0.00 C ATOM 19 CG GLU A 2 2.638 10.399 13.373 1.00 0.00 C ATOM 20 CD GLU A 2 2.418 10.831 11.936 1.00 0.00 C ATOM 21 OE1 GLU A 2 1.965 10.010 11.114 1.00 0.00 O ATOM 22 OE2 GLU A 2 2.706 12.006 11.617 1.00 0.00 O1- ATOM 0 H GLU A 2 4.376 11.784 15.288 1.00 0.00 H new ATOM 0 HA GLU A 2 3.722 8.983 15.519 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.746 10.700 13.221 1.00 0.00 H new ATOM 0 HB3 GLU A 2 4.245 9.028 13.066 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.954 9.585 13.615 1.00 0.00 H new ATOM 0 HG3 GLU A 2 2.398 11.227 14.040 1.00 0.00 H new ATOM 29 N PHE A 3 5.970 7.869 15.311 1.00 0.00 N ATOM 30 CA PHE A 3 7.283 7.253 15.316 1.00 0.00 C ATOM 31 C PHE A 3 7.823 7.255 13.895 1.00 0.00 C ATOM 32 O PHE A 3 7.494 6.391 13.092 1.00 0.00 O ATOM 33 CB PHE A 3 7.221 5.839 15.899 1.00 0.00 C ATOM 34 CG PHE A 3 6.919 5.825 17.373 1.00 0.00 C ATOM 35 CD1 PHE A 3 5.612 5.849 17.830 1.00 0.00 C ATOM 36 CD2 PHE A 3 7.947 5.797 18.302 1.00 0.00 C ATOM 37 CE1 PHE A 3 5.334 5.845 19.183 1.00 0.00 C ATOM 38 CE2 PHE A 3 7.676 5.792 19.657 1.00 0.00 C ATOM 39 CZ PHE A 3 6.368 5.817 20.097 1.00 0.00 C ATOM 0 H PHE A 3 5.192 7.218 15.413 1.00 0.00 H new ATOM 0 HA PHE A 3 7.959 7.823 15.954 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.457 5.267 15.372 1.00 0.00 H new ATOM 0 HB3 PHE A 3 8.173 5.337 15.724 1.00 0.00 H new ATOM 0 HD1 PHE A 3 4.799 5.871 17.119 1.00 0.00 H new ATOM 0 HD2 PHE A 3 8.972 5.779 17.963 1.00 0.00 H new ATOM 0 HE1 PHE A 3 4.310 5.864 19.525 1.00 0.00 H new ATOM 0 HE2 PHE A 3 8.486 5.769 20.371 1.00 0.00 H new ATOM 0 HZ PHE A 3 6.154 5.815 21.156 1.00 0.00 H new ATOM 49 N GLU A 4 8.651 8.250 13.600 1.00 0.00 N ATOM 50 CA GLU A 4 9.110 8.525 12.240 1.00 0.00 C ATOM 51 C GLU A 4 9.859 7.378 11.565 1.00 0.00 C ATOM 52 O GLU A 4 9.810 7.262 10.349 1.00 0.00 O ATOM 53 CB GLU A 4 9.929 9.810 12.197 1.00 0.00 C ATOM 54 CG GLU A 4 9.140 11.036 12.626 1.00 0.00 C ATOM 55 CD GLU A 4 9.877 12.324 12.367 1.00 0.00 C ATOM 56 OE1 GLU A 4 10.804 12.650 13.135 1.00 0.00 O ATOM 57 OE2 GLU A 4 9.529 13.028 11.394 1.00 0.00 O1- ATOM 0 H GLU A 4 9.025 8.892 14.298 1.00 0.00 H new ATOM 0 HA GLU A 4 8.200 8.648 11.653 1.00 0.00 H new ATOM 0 HB2 GLU A 4 10.799 9.701 12.844 1.00 0.00 H new ATOM 0 HB3 GLU A 4 10.302 9.962 11.184 1.00 0.00 H new ATOM 0 HG2 GLU A 4 8.188 11.054 12.095 1.00 0.00 H new ATOM 0 HG3 GLU A 4 8.911 10.961 13.689 1.00 0.00 H new ATOM 64 N LYS A 5 10.541 6.531 12.319 1.00 0.00 N ATOM 65 CA LYS A 5 11.247 5.410 11.689 1.00 0.00 C ATOM 66 C LYS A 5 10.258 4.347 11.256 1.00 0.00 C ATOM 67 O LYS A 5 10.361 3.790 10.162 1.00 0.00 O ATOM 68 CB LYS A 5 12.283 4.799 12.620 1.00 0.00 C ATOM 69 CG LYS A 5 13.389 5.745 13.022 1.00 0.00 C ATOM 70 CD LYS A 5 14.433 5.024 13.841 1.00 0.00 C ATOM 71 CE LYS A 5 15.560 5.945 14.247 1.00 0.00 C ATOM 72 NZ LYS A 5 16.594 5.228 15.027 1.00 0.00 N ATOM 0 H LYS A 5 10.625 6.587 13.334 1.00 0.00 H new ATOM 0 HA LYS A 5 11.770 5.802 10.816 1.00 0.00 H new ATOM 0 HB2 LYS A 5 11.781 4.442 13.519 1.00 0.00 H new ATOM 0 HB3 LYS A 5 12.724 3.929 12.134 1.00 0.00 H new ATOM 0 HG2 LYS A 5 13.849 6.174 12.132 1.00 0.00 H new ATOM 0 HG3 LYS A 5 12.975 6.573 13.598 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.969 4.602 14.732 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.834 4.190 13.266 1.00 0.00 H new ATOM 0 HE2 LYS A 5 16.012 6.382 13.357 1.00 0.00 H new ATOM 0 HE3 LYS A 5 15.162 6.769 14.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 17.352 5.890 15.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 16.167 4.832 15.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 16.991 4.458 14.452 1.00 0.00 H new ATOM 86 N LEU A 6 9.296 4.078 12.114 1.00 0.00 N ATOM 87 CA LEU A 6 8.261 3.105 11.826 1.00 0.00 C ATOM 88 C LEU A 6 7.292 3.671 10.791 1.00 0.00 C ATOM 89 O LEU A 6 6.790 2.957 9.926 1.00 0.00 O ATOM 90 CB LEU A 6 7.525 2.730 13.115 1.00 0.00 C ATOM 91 CG LEU A 6 8.407 2.147 14.232 1.00 0.00 C ATOM 92 CD1 LEU A 6 7.597 1.925 15.499 1.00 0.00 C ATOM 93 CD2 LEU A 6 9.056 0.846 13.781 1.00 0.00 C ATOM 0 H LEU A 6 9.209 4.525 13.027 1.00 0.00 H new ATOM 0 HA LEU A 6 8.715 2.203 11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 6 7.023 3.618 13.498 1.00 0.00 H new ATOM 0 HB3 LEU A 6 6.749 2.004 12.872 1.00 0.00 H new ATOM 0 HG LEU A 6 9.195 2.867 14.451 1.00 0.00 H new ATOM 0 HD11 LEU A 6 8.241 1.512 16.275 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.184 2.875 15.838 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.784 1.228 15.294 1.00 0.00 H new ATOM 0 HD21 LEU A 6 9.676 0.450 14.586 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.282 0.121 13.529 1.00 0.00 H new ATOM 0 HD23 LEU A 6 9.676 1.034 12.904 1.00 0.00 H new ATOM 105 N ARG A 7 7.057 4.973 10.885 1.00 0.00 N ATOM 106 CA ARG A 7 6.180 5.674 9.966 1.00 0.00 C ATOM 107 C ARG A 7 6.811 5.780 8.584 1.00 0.00 C ATOM 108 O ARG A 7 6.113 5.749 7.584 1.00 0.00 O ATOM 109 CB ARG A 7 5.860 7.080 10.480 1.00 0.00 C ATOM 110 CG ARG A 7 4.855 7.819 9.613 1.00 0.00 C ATOM 111 CD ARG A 7 4.844 9.312 9.894 1.00 0.00 C ATOM 112 NE ARG A 7 3.861 10.003 9.055 1.00 0.00 N ATOM 113 CZ ARG A 7 4.072 10.349 7.773 1.00 0.00 C ATOM 114 NH1 ARG A 7 5.268 10.159 7.216 1.00 0.00 N ATOM 115 NH2 ARG A 7 3.096 10.904 7.057 1.00 0.00 N ATOM 0 H ARG A 7 7.470 5.570 11.601 1.00 0.00 H new ATOM 0 HA ARG A 7 5.257 5.098 9.896 1.00 0.00 H new ATOM 0 HB2 ARG A 7 5.471 7.009 11.496 1.00 0.00 H new ATOM 0 HB3 ARG A 7 6.782 7.660 10.531 1.00 0.00 H new ATOM 0 HG2 ARG A 7 5.091 7.650 8.562 1.00 0.00 H new ATOM 0 HG3 ARG A 7 3.859 7.411 9.786 1.00 0.00 H new ATOM 0 HD2 ARG A 7 4.614 9.485 10.945 1.00 0.00 H new ATOM 0 HD3 ARG A 7 5.836 9.726 9.712 1.00 0.00 H new ATOM 0 HE ARG A 7 2.959 10.236 9.470 1.00 0.00 H new ATOM 0 HH11 ARG A 7 6.026 9.750 7.763 1.00 0.00 H new ATOM 0 HH12 ARG A 7 5.425 10.422 6.243 1.00 0.00 H new ATOM 0 HH21 ARG A 7 2.183 11.069 7.481 1.00 0.00 H new ATOM 0 HH22 ARG A 7 3.262 11.165 6.085 1.00 0.00 H new ATOM 129 N GLN A 8 8.137 5.899 8.540 1.00 0.00 N ATOM 130 CA GLN A 8 8.863 6.087 7.279 1.00 0.00 C ATOM 131 C GLN A 8 8.632 4.923 6.324 1.00 0.00 C ATOM 132 O GLN A 8 8.510 5.124 5.119 1.00 0.00 O ATOM 133 CB GLN A 8 10.364 6.288 7.553 1.00 0.00 C ATOM 134 CG GLN A 8 11.213 6.546 6.311 1.00 0.00 C ATOM 135 CD GLN A 8 11.889 5.294 5.791 1.00 0.00 C ATOM 136 OE1 GLN A 8 12.219 4.386 6.557 1.00 0.00 O ATOM 137 NE2 GLN A 8 12.106 5.234 4.495 1.00 0.00 N ATOM 0 H GLN A 8 8.735 5.869 9.366 1.00 0.00 H new ATOM 0 HA GLN A 8 8.476 6.984 6.796 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.485 7.127 8.239 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.748 5.403 8.061 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.583 6.966 5.527 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.972 7.293 6.544 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.818 6.006 3.893 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.562 4.416 4.092 1.00 0.00 H new ATOM 146 N THR A 9 8.553 3.717 6.858 1.00 0.00 N ATOM 147 CA THR A 9 8.287 2.555 6.035 1.00 0.00 C ATOM 148 C THR A 9 6.914 2.709 5.362 1.00 0.00 C ATOM 149 O THR A 9 6.757 2.458 4.163 1.00 0.00 O ATOM 150 CB THR A 9 8.317 1.271 6.881 1.00 0.00 C ATOM 151 OG1 THR A 9 9.532 1.239 7.652 1.00 0.00 O ATOM 152 CG2 THR A 9 8.261 0.042 5.986 1.00 0.00 C ATOM 0 H THR A 9 8.669 3.519 7.852 1.00 0.00 H new ATOM 0 HA THR A 9 9.061 2.479 5.272 1.00 0.00 H new ATOM 0 HB THR A 9 7.451 1.266 7.543 1.00 0.00 H new ATOM 0 HG1 THR A 9 9.554 0.423 8.194 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.283 -0.857 6.601 1.00 0.00 H new ATOM 0 HG22 THR A 9 7.341 0.059 5.401 1.00 0.00 H new ATOM 0 HG23 THR A 9 9.119 0.043 5.313 1.00 0.00 H new ATOM 160 N GLY A 10 5.936 3.146 6.150 1.00 0.00 N ATOM 161 CA GLY A 10 4.605 3.412 5.637 1.00 0.00 C ATOM 162 C GLY A 10 4.588 4.606 4.694 1.00 0.00 C ATOM 163 O GLY A 10 3.877 4.607 3.691 1.00 0.00 O ATOM 0 H GLY A 10 6.045 3.322 7.149 1.00 0.00 H new ATOM 0 HA2 GLY A 10 4.235 2.531 5.113 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.926 3.597 6.469 1.00 0.00 H new ATOM 167 N ASP A 11 5.376 5.626 5.035 1.00 0.00 N ATOM 168 CA ASP A 11 5.465 6.864 4.252 1.00 0.00 C ATOM 169 C ASP A 11 5.918 6.572 2.830 1.00 0.00 C ATOM 170 O ASP A 11 5.415 7.165 1.879 1.00 0.00 O ATOM 171 CB ASP A 11 6.438 7.845 4.922 1.00 0.00 C ATOM 172 CG ASP A 11 6.520 9.188 4.215 1.00 0.00 C ATOM 173 OD1 ASP A 11 5.703 10.084 4.534 1.00 0.00 O ATOM 174 OD2 ASP A 11 7.419 9.367 3.365 1.00 0.00 O1- ATOM 0 H ASP A 11 5.972 5.619 5.863 1.00 0.00 H new ATOM 0 HA ASP A 11 4.474 7.316 4.212 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.128 8.004 5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 11 7.431 7.397 4.952 1.00 0.00 H new ATOM 179 N GLU A 12 6.847 5.627 2.689 1.00 0.00 N ATOM 180 CA GLU A 12 7.336 5.228 1.373 1.00 0.00 C ATOM 181 C GLU A 12 6.183 4.708 0.534 1.00 0.00 C ATOM 182 O GLU A 12 6.073 5.014 -0.656 1.00 0.00 O ATOM 183 CB GLU A 12 8.402 4.139 1.499 1.00 0.00 C ATOM 184 CG GLU A 12 9.659 4.581 2.217 1.00 0.00 C ATOM 185 CD GLU A 12 10.336 5.741 1.532 1.00 0.00 C ATOM 186 OE1 GLU A 12 10.775 5.580 0.369 1.00 0.00 O ATOM 187 OE2 GLU A 12 10.456 6.811 2.149 1.00 0.00 O1- ATOM 0 H GLU A 12 7.274 5.126 3.468 1.00 0.00 H new ATOM 0 HA GLU A 12 7.780 6.100 0.892 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.975 3.288 2.029 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.670 3.792 0.501 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.410 4.862 3.240 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.353 3.743 2.277 1.00 0.00 H new ATOM 194 N LEU A 13 5.318 3.936 1.171 1.00 0.00 N ATOM 195 CA LEU A 13 4.149 3.394 0.514 1.00 0.00 C ATOM 196 C LEU A 13 3.183 4.508 0.142 1.00 0.00 C ATOM 197 O LEU A 13 2.712 4.571 -0.986 1.00 0.00 O ATOM 198 CB LEU A 13 3.450 2.364 1.407 1.00 0.00 C ATOM 199 CG LEU A 13 4.220 1.064 1.658 1.00 0.00 C ATOM 200 CD1 LEU A 13 3.466 0.180 2.636 1.00 0.00 C ATOM 201 CD2 LEU A 13 4.452 0.321 0.351 1.00 0.00 C ATOM 0 H LEU A 13 5.409 3.671 2.152 1.00 0.00 H new ATOM 0 HA LEU A 13 4.475 2.894 -0.398 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.239 2.830 2.369 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.490 2.114 0.957 1.00 0.00 H new ATOM 0 HG LEU A 13 5.188 1.317 2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 13 4.027 -0.739 2.803 1.00 0.00 H new ATOM 0 HD12 LEU A 13 3.343 0.707 3.582 1.00 0.00 H new ATOM 0 HD13 LEU A 13 2.486 -0.063 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 13 5.000 -0.600 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.492 0.081 -0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.030 0.949 -0.327 1.00 0.00 H new ATOM 213 N VAL A 14 2.913 5.403 1.091 1.00 0.00 N ATOM 214 CA VAL A 14 1.976 6.503 0.862 1.00 0.00 C ATOM 215 C VAL A 14 2.416 7.362 -0.308 1.00 0.00 C ATOM 216 O VAL A 14 1.619 7.684 -1.173 1.00 0.00 O ATOM 217 CB VAL A 14 1.821 7.408 2.105 1.00 0.00 C ATOM 218 CG1 VAL A 14 0.895 8.583 1.795 1.00 0.00 C ATOM 219 CG2 VAL A 14 1.297 6.611 3.290 1.00 0.00 C ATOM 0 H VAL A 14 3.328 5.389 2.023 1.00 0.00 H new ATOM 0 HA VAL A 14 1.014 6.039 0.643 1.00 0.00 H new ATOM 0 HB VAL A 14 2.803 7.801 2.369 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.796 9.211 2.680 1.00 0.00 H new ATOM 0 HG12 VAL A 14 1.314 9.171 0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -0.086 8.207 1.505 1.00 0.00 H new ATOM 0 HG21 VAL A 14 1.196 7.268 4.154 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.325 6.186 3.041 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.995 5.807 3.525 1.00 0.00 H new ATOM 229 N GLN A 15 3.691 7.708 -0.341 1.00 0.00 N ATOM 230 CA GLN A 15 4.224 8.539 -1.410 1.00 0.00 C ATOM 231 C GLN A 15 4.086 7.839 -2.759 1.00 0.00 C ATOM 232 O GLN A 15 3.722 8.463 -3.756 1.00 0.00 O ATOM 233 CB GLN A 15 5.683 8.889 -1.134 1.00 0.00 C ATOM 234 CG GLN A 15 5.892 9.654 0.166 1.00 0.00 C ATOM 235 CD GLN A 15 5.292 11.043 0.142 1.00 0.00 C ATOM 236 OE1 GLN A 15 4.120 11.239 0.474 1.00 0.00 O ATOM 237 NE2 GLN A 15 6.095 12.019 -0.234 1.00 0.00 N ATOM 0 H GLN A 15 4.377 7.427 0.359 1.00 0.00 H new ATOM 0 HA GLN A 15 3.647 9.463 -1.446 1.00 0.00 H new ATOM 0 HB2 GLN A 15 6.269 7.970 -1.103 1.00 0.00 H new ATOM 0 HB3 GLN A 15 6.068 9.484 -1.962 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.452 9.089 0.988 1.00 0.00 H new ATOM 0 HG3 GLN A 15 6.960 9.730 0.368 1.00 0.00 H new ATOM 0 HE21 GLN A 15 7.058 11.813 -0.501 1.00 0.00 H new ATOM 0 HE22 GLN A 15 5.753 12.980 -0.258 1.00 0.00 H new ATOM 246 N ALA A 16 4.345 6.536 -2.774 1.00 0.00 N ATOM 247 CA ALA A 16 4.237 5.753 -3.997 1.00 0.00 C ATOM 248 C ALA A 16 2.779 5.630 -4.437 1.00 0.00 C ATOM 249 O ALA A 16 2.462 5.808 -5.610 1.00 0.00 O ATOM 250 CB ALA A 16 4.851 4.376 -3.801 1.00 0.00 C ATOM 0 H ALA A 16 4.631 6.001 -1.954 1.00 0.00 H new ATOM 0 HA ALA A 16 4.787 6.271 -4.783 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.762 3.803 -4.724 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.904 4.481 -3.539 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.328 3.855 -2.999 1.00 0.00 H new ATOM 256 N PHE A 17 1.896 5.338 -3.487 1.00 0.00 N ATOM 257 CA PHE A 17 0.471 5.208 -3.778 1.00 0.00 C ATOM 258 C PHE A 17 -0.132 6.546 -4.166 1.00 0.00 C ATOM 259 O PHE A 17 -0.978 6.618 -5.059 1.00 0.00 O ATOM 260 CB PHE A 17 -0.290 4.601 -2.599 1.00 0.00 C ATOM 261 CG PHE A 17 -0.019 3.137 -2.398 1.00 0.00 C ATOM 262 CD1 PHE A 17 0.492 2.670 -1.205 1.00 0.00 C ATOM 263 CD2 PHE A 17 -0.278 2.230 -3.410 1.00 0.00 C ATOM 264 CE1 PHE A 17 0.741 1.327 -1.020 1.00 0.00 C ATOM 265 CE2 PHE A 17 -0.032 0.886 -3.230 1.00 0.00 C ATOM 266 CZ PHE A 17 0.479 0.436 -2.034 1.00 0.00 C ATOM 0 H PHE A 17 2.142 5.187 -2.509 1.00 0.00 H new ATOM 0 HA PHE A 17 0.375 4.529 -4.625 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.024 5.139 -1.689 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.359 4.746 -2.754 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.700 3.366 -0.405 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.677 2.579 -4.351 1.00 0.00 H new ATOM 0 HE1 PHE A 17 1.141 0.975 -0.081 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -0.240 0.187 -4.026 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.674 -0.617 -1.892 1.00 0.00 H new ATOM 276 N GLN A 18 0.300 7.601 -3.494 1.00 0.00 N ATOM 277 CA GLN A 18 -0.164 8.939 -3.802 1.00 0.00 C ATOM 278 C GLN A 18 0.222 9.293 -5.232 1.00 0.00 C ATOM 279 O GLN A 18 -0.588 9.818 -5.991 1.00 0.00 O ATOM 280 CB GLN A 18 0.434 9.956 -2.821 1.00 0.00 C ATOM 281 CG GLN A 18 -0.037 11.378 -3.047 1.00 0.00 C ATOM 282 CD GLN A 18 0.655 12.382 -2.150 1.00 0.00 C ATOM 283 OE1 GLN A 18 1.047 12.071 -1.030 1.00 0.00 O ATOM 284 NE2 GLN A 18 0.817 13.593 -2.641 1.00 0.00 N ATOM 0 H GLN A 18 0.974 7.553 -2.730 1.00 0.00 H new ATOM 0 HA GLN A 18 -1.249 8.970 -3.704 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.180 9.657 -1.804 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.521 9.927 -2.900 1.00 0.00 H new ATOM 0 HG2 GLN A 18 0.135 11.650 -4.088 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -1.113 11.429 -2.878 1.00 0.00 H new ATOM 0 HE21 GLN A 18 0.477 13.813 -3.577 1.00 0.00 H new ATOM 0 HE22 GLN A 18 1.282 14.311 -2.085 1.00 0.00 H new ATOM 293 N ARG A 19 1.458 8.961 -5.600 1.00 0.00 N ATOM 294 CA ARG A 19 1.948 9.200 -6.951 1.00 0.00 C ATOM 295 C ARG A 19 1.197 8.324 -7.942 1.00 0.00 C ATOM 296 O ARG A 19 0.860 8.759 -9.040 1.00 0.00 O ATOM 297 CB ARG A 19 3.448 8.910 -7.034 1.00 0.00 C ATOM 298 CG ARG A 19 4.055 9.192 -8.399 1.00 0.00 C ATOM 299 CD ARG A 19 5.536 8.877 -8.417 1.00 0.00 C ATOM 300 NE ARG A 19 6.185 9.343 -9.643 1.00 0.00 N ATOM 301 CZ ARG A 19 7.504 9.304 -9.853 1.00 0.00 C ATOM 302 NH1 ARG A 19 8.311 8.758 -8.948 1.00 0.00 N ATOM 303 NH2 ARG A 19 8.010 9.796 -10.977 1.00 0.00 N ATOM 0 H ARG A 19 2.138 8.525 -4.978 1.00 0.00 H new ATOM 0 HA ARG A 19 1.779 10.247 -7.201 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.966 9.510 -6.286 1.00 0.00 H new ATOM 0 HB3 ARG A 19 3.621 7.864 -6.779 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.545 8.597 -9.156 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.900 10.239 -8.659 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.015 9.341 -7.555 1.00 0.00 H new ATOM 0 HD3 ARG A 19 5.678 7.801 -8.319 1.00 0.00 H new ATOM 0 HE ARG A 19 5.594 9.721 -10.383 1.00 0.00 H new ATOM 0 HH11 ARG A 19 7.924 8.367 -8.089 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.317 8.730 -9.113 1.00 0.00 H new ATOM 0 HH21 ARG A 19 7.392 10.203 -11.679 1.00 0.00 H new ATOM 0 HH22 ARG A 19 9.017 9.767 -11.139 1.00 0.00 H new ATOM 317 N LEU A 20 0.920 7.094 -7.531 1.00 0.00 N ATOM 318 CA LEU A 20 0.191 6.144 -8.359 1.00 0.00 C ATOM 319 C LEU A 20 -1.191 6.696 -8.681 1.00 0.00 C ATOM 320 O LEU A 20 -1.658 6.617 -9.819 1.00 0.00 O ATOM 321 CB LEU A 20 0.051 4.809 -7.619 1.00 0.00 C ATOM 322 CG LEU A 20 -0.575 3.663 -8.412 1.00 0.00 C ATOM 323 CD1 LEU A 20 0.403 3.129 -9.443 1.00 0.00 C ATOM 324 CD2 LEU A 20 -1.035 2.553 -7.478 1.00 0.00 C ATOM 0 H LEU A 20 1.193 6.728 -6.619 1.00 0.00 H new ATOM 0 HA LEU A 20 0.741 5.985 -9.286 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.041 4.496 -7.287 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.548 4.974 -6.724 1.00 0.00 H new ATOM 0 HG LEU A 20 -1.448 4.048 -8.939 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.062 2.314 -9.997 1.00 0.00 H new ATOM 0 HD12 LEU A 20 0.676 3.927 -10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.298 2.762 -8.940 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.478 1.746 -8.062 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -0.181 2.170 -6.920 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.776 2.947 -6.782 1.00 0.00 H new ATOM 336 N ARG A 21 -1.830 7.272 -7.671 1.00 0.00 N ATOM 337 CA ARG A 21 -3.144 7.861 -7.831 1.00 0.00 C ATOM 338 C ARG A 21 -3.082 9.036 -8.799 1.00 0.00 C ATOM 339 O ARG A 21 -3.955 9.197 -9.649 1.00 0.00 O ATOM 340 CB ARG A 21 -3.689 8.317 -6.477 1.00 0.00 C ATOM 341 CG ARG A 21 -5.140 8.755 -6.518 1.00 0.00 C ATOM 342 CD ARG A 21 -5.678 9.032 -5.127 1.00 0.00 C ATOM 343 NE ARG A 21 -7.120 9.264 -5.140 1.00 0.00 N ATOM 344 CZ ARG A 21 -7.930 9.055 -4.102 1.00 0.00 C ATOM 345 NH1 ARG A 21 -7.444 8.642 -2.934 1.00 0.00 N ATOM 346 NH2 ARG A 21 -9.228 9.258 -4.228 1.00 0.00 N ATOM 0 H ARG A 21 -1.452 7.342 -6.726 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.816 7.107 -8.241 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -3.585 7.502 -5.761 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -3.080 9.143 -6.110 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -5.233 9.652 -7.130 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.741 7.980 -6.994 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -5.451 8.189 -4.475 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.173 9.903 -4.709 1.00 0.00 H new ATOM 0 HE ARG A 21 -7.537 9.610 -6.004 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -6.442 8.482 -2.826 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.073 8.485 -2.147 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -9.611 9.574 -5.119 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -9.849 9.098 -3.434 1.00 0.00 H new ATOM 360 N GLU A 22 -2.037 9.843 -8.667 1.00 0.00 N ATOM 361 CA GLU A 22 -1.829 10.991 -9.542 1.00 0.00 C ATOM 362 C GLU A 22 -1.646 10.539 -10.986 1.00 0.00 C ATOM 363 O GLU A 22 -2.239 11.099 -11.905 1.00 0.00 O ATOM 364 CB GLU A 22 -0.607 11.780 -9.093 1.00 0.00 C ATOM 365 CG GLU A 22 -0.724 12.348 -7.697 1.00 0.00 C ATOM 366 CD GLU A 22 0.511 13.099 -7.275 1.00 0.00 C ATOM 367 OE1 GLU A 22 0.382 14.257 -6.831 1.00 0.00 O ATOM 368 OE2 GLU A 22 1.624 12.539 -7.388 1.00 0.00 O1- ATOM 0 H GLU A 22 -1.315 9.723 -7.957 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.710 11.630 -9.483 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.269 11.132 -9.139 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.436 12.597 -9.794 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.585 13.015 -7.651 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.911 11.537 -6.993 1.00 0.00 H new ATOM 375 N ILE A 23 -0.829 9.515 -11.171 1.00 0.00 N ATOM 376 CA ILE A 23 -0.577 8.959 -12.488 1.00 0.00 C ATOM 377 C ILE A 23 -1.866 8.403 -13.095 1.00 0.00 C ATOM 378 O ILE A 23 -2.136 8.586 -14.290 1.00 0.00 O ATOM 379 CB ILE A 23 0.499 7.856 -12.425 1.00 0.00 C ATOM 380 CG1 ILE A 23 1.834 8.455 -11.976 1.00 0.00 C ATOM 381 CG2 ILE A 23 0.647 7.174 -13.773 1.00 0.00 C ATOM 382 CD1 ILE A 23 2.922 7.432 -11.762 1.00 0.00 C ATOM 0 H ILE A 23 -0.325 9.049 -10.417 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.209 9.763 -13.125 1.00 0.00 H new ATOM 0 HB ILE A 23 0.188 7.105 -11.699 1.00 0.00 H new ATOM 0 HG12 ILE A 23 2.168 9.175 -12.723 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.680 9.007 -11.049 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.411 6.399 -13.707 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.303 6.723 -14.059 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.940 7.909 -14.523 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.836 7.934 -11.445 1.00 0.00 H new ATOM 0 HD12 ILE A 23 2.611 6.725 -10.993 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.106 6.896 -12.693 1.00 0.00 H new ATOM 394 N PHE A 24 -2.661 7.737 -12.266 1.00 0.00 N ATOM 395 CA PHE A 24 -3.947 7.210 -12.697 1.00 0.00 C ATOM 396 C PHE A 24 -4.886 8.352 -13.075 1.00 0.00 C ATOM 397 O PHE A 24 -5.629 8.263 -14.056 1.00 0.00 O ATOM 398 CB PHE A 24 -4.575 6.343 -11.601 1.00 0.00 C ATOM 399 CG PHE A 24 -6.005 5.977 -11.881 1.00 0.00 C ATOM 400 CD1 PHE A 24 -6.328 5.153 -12.946 1.00 0.00 C ATOM 401 CD2 PHE A 24 -7.024 6.468 -11.085 1.00 0.00 C ATOM 402 CE1 PHE A 24 -7.641 4.829 -13.210 1.00 0.00 C ATOM 403 CE2 PHE A 24 -8.340 6.144 -11.343 1.00 0.00 C ATOM 404 CZ PHE A 24 -8.649 5.325 -12.407 1.00 0.00 C ATOM 0 H PHE A 24 -2.435 7.550 -11.289 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.785 6.584 -13.575 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.989 5.431 -11.488 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.522 6.875 -10.651 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.543 4.761 -13.576 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -6.787 7.113 -10.252 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.882 4.187 -14.045 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -9.126 6.532 -10.712 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.678 5.071 -12.613 1.00 0.00 H new ATOM 414 N ASP A 25 -4.840 9.421 -12.292 1.00 0.00 N ATOM 415 CA ASP A 25 -5.657 10.604 -12.545 1.00 0.00 C ATOM 416 C ASP A 25 -5.284 11.229 -13.886 1.00 0.00 C ATOM 417 O ASP A 25 -6.137 11.750 -14.601 1.00 0.00 O ATOM 418 CB ASP A 25 -5.477 11.619 -11.411 1.00 0.00 C ATOM 419 CG ASP A 25 -6.254 12.897 -11.635 1.00 0.00 C ATOM 420 OD1 ASP A 25 -7.496 12.875 -11.511 1.00 0.00 O ATOM 421 OD2 ASP A 25 -5.624 13.938 -11.920 1.00 0.00 O1- ATOM 0 H ASP A 25 -4.241 9.495 -11.470 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.705 10.307 -12.584 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -5.795 11.167 -10.472 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.418 11.857 -11.308 1.00 0.00 H new ATOM 426 N LYS A 26 -4.003 11.148 -14.225 1.00 0.00 N ATOM 427 CA LYS A 26 -3.507 11.650 -15.499 1.00 0.00 C ATOM 428 C LYS A 26 -3.827 10.659 -16.621 1.00 0.00 C ATOM 429 O LYS A 26 -3.808 11.008 -17.803 1.00 0.00 O ATOM 430 CB LYS A 26 -1.996 11.888 -15.421 1.00 0.00 C ATOM 431 CG LYS A 26 -1.594 12.985 -14.446 1.00 0.00 C ATOM 432 CD LYS A 26 -0.092 12.986 -14.181 1.00 0.00 C ATOM 433 CE LYS A 26 0.714 13.202 -15.453 1.00 0.00 C ATOM 434 NZ LYS A 26 2.173 13.198 -15.189 1.00 0.00 N ATOM 0 H LYS A 26 -3.285 10.736 -13.630 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.001 12.597 -15.717 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -1.506 10.959 -15.129 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -1.627 12.145 -16.414 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.893 13.954 -14.846 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.129 12.849 -13.506 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.148 13.770 -13.463 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.196 12.038 -13.727 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.473 12.420 -16.173 1.00 0.00 H new ATOM 0 HE3 LYS A 26 0.429 14.151 -15.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.687 13.348 -16.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.407 13.960 -14.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.449 12.283 -14.780 1.00 0.00 H new ATOM 448 N GLY A 27 -4.137 9.429 -16.236 1.00 0.00 N ATOM 449 CA GLY A 27 -4.484 8.399 -17.200 1.00 0.00 C ATOM 450 C GLY A 27 -3.279 7.840 -17.928 1.00 0.00 C ATOM 451 O GLY A 27 -3.410 7.287 -19.023 1.00 0.00 O ATOM 0 H GLY A 27 -4.155 9.122 -15.263 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.000 7.588 -16.687 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.183 8.811 -17.928 1.00 0.00 H new ATOM 455 N ASP A 28 -2.111 7.967 -17.324 1.00 0.00 N ATOM 456 CA ASP A 28 -0.879 7.490 -17.943 1.00 0.00 C ATOM 457 C ASP A 28 -0.596 6.051 -17.531 1.00 0.00 C ATOM 458 O ASP A 28 -0.008 5.796 -16.484 1.00 0.00 O ATOM 459 CB ASP A 28 0.302 8.394 -17.578 1.00 0.00 C ATOM 460 CG ASP A 28 1.538 8.090 -18.400 1.00 0.00 C ATOM 461 OD1 ASP A 28 2.319 7.203 -18.012 1.00 0.00 O ATOM 462 OD2 ASP A 28 1.737 8.744 -19.441 1.00 0.00 O1- ATOM 0 H ASP A 28 -1.986 8.395 -16.407 1.00 0.00 H new ATOM 0 HA ASP A 28 -1.009 7.522 -19.025 1.00 0.00 H new ATOM 0 HB2 ASP A 28 0.018 9.436 -17.726 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.534 8.274 -16.520 1.00 0.00 H new ATOM 467 N ASP A 29 -1.045 5.115 -18.349 1.00 0.00 N ATOM 468 CA ASP A 29 -0.886 3.683 -18.058 1.00 0.00 C ATOM 469 C ASP A 29 0.584 3.266 -18.047 1.00 0.00 C ATOM 470 O ASP A 29 0.959 2.311 -17.363 1.00 0.00 O ATOM 471 CB ASP A 29 -1.663 2.827 -19.071 1.00 0.00 C ATOM 472 CG ASP A 29 -1.061 2.864 -20.465 1.00 0.00 C ATOM 473 OD1 ASP A 29 -1.394 3.786 -21.238 1.00 0.00 O ATOM 474 OD2 ASP A 29 -0.254 1.974 -20.794 1.00 0.00 O1- ATOM 0 H ASP A 29 -1.526 5.313 -19.226 1.00 0.00 H new ATOM 0 HA ASP A 29 -1.294 3.514 -17.062 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -1.691 1.795 -18.721 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -2.695 3.176 -19.117 1.00 0.00 H new ATOM 479 N ASP A 30 1.408 3.991 -18.792 1.00 0.00 N ATOM 480 CA ASP A 30 2.833 3.681 -18.898 1.00 0.00 C ATOM 481 C ASP A 30 3.532 3.817 -17.547 1.00 0.00 C ATOM 482 O ASP A 30 4.218 2.899 -17.095 1.00 0.00 O ATOM 483 CB ASP A 30 3.490 4.602 -19.933 1.00 0.00 C ATOM 484 CG ASP A 30 4.997 4.457 -19.987 1.00 0.00 C ATOM 485 OD1 ASP A 30 5.485 3.392 -20.430 1.00 0.00 O ATOM 486 OD2 ASP A 30 5.704 5.419 -19.603 1.00 0.00 O1- ATOM 0 H ASP A 30 1.115 4.803 -19.336 1.00 0.00 H new ATOM 0 HA ASP A 30 2.935 2.645 -19.222 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.075 4.386 -20.918 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.239 5.637 -19.701 1.00 0.00 H new ATOM 491 N SER A 31 3.337 4.950 -16.904 1.00 0.00 N ATOM 492 CA SER A 31 3.928 5.203 -15.601 1.00 0.00 C ATOM 493 C SER A 31 3.235 4.374 -14.521 1.00 0.00 C ATOM 494 O SER A 31 3.866 3.935 -13.555 1.00 0.00 O ATOM 495 CB SER A 31 3.846 6.687 -15.269 1.00 0.00 C ATOM 496 OG SER A 31 4.324 7.472 -16.353 1.00 0.00 O ATOM 0 H SER A 31 2.770 5.717 -17.264 1.00 0.00 H new ATOM 0 HA SER A 31 4.977 4.907 -15.633 1.00 0.00 H new ATOM 0 HB2 SER A 31 2.814 6.958 -15.045 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.433 6.898 -14.375 1.00 0.00 H new ATOM 0 HG SER A 31 3.625 7.547 -17.036 1.00 0.00 H new ATOM 502 N LEU A 32 1.937 4.146 -14.709 1.00 0.00 N ATOM 503 CA LEU A 32 1.126 3.402 -13.750 1.00 0.00 C ATOM 504 C LEU A 32 1.663 1.985 -13.582 1.00 0.00 C ATOM 505 O LEU A 32 1.821 1.497 -12.463 1.00 0.00 O ATOM 506 CB LEU A 32 -0.328 3.345 -14.244 1.00 0.00 C ATOM 507 CG LEU A 32 -1.356 2.782 -13.258 1.00 0.00 C ATOM 508 CD1 LEU A 32 -1.649 3.788 -12.160 1.00 0.00 C ATOM 509 CD2 LEU A 32 -2.635 2.391 -13.982 1.00 0.00 C ATOM 0 H LEU A 32 1.420 4.470 -15.527 1.00 0.00 H new ATOM 0 HA LEU A 32 1.169 3.909 -12.786 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.635 4.353 -14.521 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.358 2.742 -15.152 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.936 1.887 -12.799 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.381 3.370 -11.469 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.730 4.015 -11.620 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.047 4.702 -12.601 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.352 1.993 -13.264 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.059 3.268 -14.471 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.412 1.631 -14.731 1.00 0.00 H new ATOM 521 N GLU A 33 1.964 1.348 -14.704 1.00 0.00 N ATOM 522 CA GLU A 33 2.476 -0.009 -14.718 1.00 0.00 C ATOM 523 C GLU A 33 3.818 -0.097 -13.979 1.00 0.00 C ATOM 524 O GLU A 33 4.050 -1.016 -13.192 1.00 0.00 O ATOM 525 CB GLU A 33 2.645 -0.461 -16.168 1.00 0.00 C ATOM 526 CG GLU A 33 2.988 -1.926 -16.331 1.00 0.00 C ATOM 527 CD GLU A 33 1.875 -2.846 -15.875 1.00 0.00 C ATOM 528 OE1 GLU A 33 2.169 -3.999 -15.505 1.00 0.00 O ATOM 529 OE2 GLU A 33 0.693 -2.426 -15.901 1.00 0.00 O1- ATOM 0 H GLU A 33 1.859 1.761 -15.631 1.00 0.00 H new ATOM 0 HA GLU A 33 1.768 -0.661 -14.206 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.722 -0.254 -16.710 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.429 0.137 -16.633 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.212 -2.127 -17.379 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.892 -2.148 -15.763 1.00 0.00 H new ATOM 536 N GLN A 34 4.680 0.881 -14.226 1.00 0.00 N ATOM 537 CA GLN A 34 6.010 0.914 -13.625 1.00 0.00 C ATOM 538 C GLN A 34 5.939 1.043 -12.108 1.00 0.00 C ATOM 539 O GLN A 34 6.619 0.318 -11.386 1.00 0.00 O ATOM 540 CB GLN A 34 6.823 2.062 -14.206 1.00 0.00 C ATOM 541 CG GLN A 34 7.096 1.926 -15.689 1.00 0.00 C ATOM 542 CD GLN A 34 7.822 3.122 -16.256 1.00 0.00 C ATOM 543 OE1 GLN A 34 8.585 3.790 -15.558 1.00 0.00 O ATOM 544 NE2 GLN A 34 7.592 3.405 -17.519 1.00 0.00 N ATOM 0 H GLN A 34 4.481 1.668 -14.843 1.00 0.00 H new ATOM 0 HA GLN A 34 6.500 -0.031 -13.859 1.00 0.00 H new ATOM 0 HB2 GLN A 34 6.293 2.998 -14.028 1.00 0.00 H new ATOM 0 HB3 GLN A 34 7.773 2.128 -13.675 1.00 0.00 H new ATOM 0 HG2 GLN A 34 7.689 1.028 -15.865 1.00 0.00 H new ATOM 0 HG3 GLN A 34 6.152 1.794 -16.218 1.00 0.00 H new ATOM 0 HE21 GLN A 34 6.952 2.826 -18.063 1.00 0.00 H new ATOM 0 HE22 GLN A 34 8.053 4.204 -17.955 1.00 0.00 H new ATOM 553 N VAL A 35 5.108 1.959 -11.628 1.00 0.00 N ATOM 554 CA VAL A 35 4.970 2.183 -10.190 1.00 0.00 C ATOM 555 C VAL A 35 4.433 0.938 -9.486 1.00 0.00 C ATOM 556 O VAL A 35 4.841 0.631 -8.372 1.00 0.00 O ATOM 557 CB VAL A 35 4.074 3.408 -9.877 1.00 0.00 C ATOM 558 CG1 VAL A 35 3.925 3.605 -8.373 1.00 0.00 C ATOM 559 CG2 VAL A 35 4.658 4.655 -10.514 1.00 0.00 C ATOM 0 H VAL A 35 4.521 2.558 -12.208 1.00 0.00 H new ATOM 0 HA VAL A 35 5.968 2.395 -9.807 1.00 0.00 H new ATOM 0 HB VAL A 35 3.084 3.224 -10.294 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.292 4.471 -8.180 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.470 2.718 -7.933 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.907 3.767 -7.928 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.022 5.511 -10.289 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.658 4.832 -10.118 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.715 4.519 -11.594 1.00 0.00 H new ATOM 569 N LEU A 36 3.543 0.205 -10.155 1.00 0.00 N ATOM 570 CA LEU A 36 2.988 -1.023 -9.582 1.00 0.00 C ATOM 571 C LEU A 36 4.104 -2.024 -9.294 1.00 0.00 C ATOM 572 O LEU A 36 4.073 -2.735 -8.289 1.00 0.00 O ATOM 573 CB LEU A 36 1.956 -1.650 -10.532 1.00 0.00 C ATOM 574 CG LEU A 36 0.687 -0.828 -10.785 1.00 0.00 C ATOM 575 CD1 LEU A 36 -0.185 -1.506 -11.828 1.00 0.00 C ATOM 576 CD2 LEU A 36 -0.093 -0.629 -9.494 1.00 0.00 C ATOM 0 H LEU A 36 3.193 0.436 -11.085 1.00 0.00 H new ATOM 0 HA LEU A 36 2.489 -0.767 -8.647 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.441 -1.837 -11.490 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.663 -2.619 -10.129 1.00 0.00 H new ATOM 0 HG LEU A 36 0.985 0.151 -11.161 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.082 -0.910 -11.996 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.370 -1.598 -12.762 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.469 -2.497 -11.476 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.989 -0.043 -9.697 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.378 -1.600 -9.088 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.529 -0.102 -8.771 1.00 0.00 H new ATOM 588 N GLU A 37 5.098 -2.051 -10.171 1.00 0.00 N ATOM 589 CA GLU A 37 6.244 -2.928 -10.009 1.00 0.00 C ATOM 590 C GLU A 37 7.102 -2.461 -8.828 1.00 0.00 C ATOM 591 O GLU A 37 7.642 -3.272 -8.069 1.00 0.00 O ATOM 592 CB GLU A 37 7.077 -2.941 -11.295 1.00 0.00 C ATOM 593 CG GLU A 37 8.174 -3.988 -11.313 1.00 0.00 C ATOM 594 CD GLU A 37 7.625 -5.391 -11.214 1.00 0.00 C ATOM 595 OE1 GLU A 37 7.606 -5.949 -10.097 1.00 0.00 O ATOM 596 OE2 GLU A 37 7.195 -5.941 -12.248 1.00 0.00 O1- ATOM 0 H GLU A 37 5.131 -1.469 -11.008 1.00 0.00 H new ATOM 0 HA GLU A 37 5.891 -3.939 -9.806 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.414 -3.111 -12.143 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.526 -1.958 -11.434 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.752 -3.890 -12.232 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.859 -3.808 -10.484 1.00 0.00 H new ATOM 603 N GLU A 38 7.211 -1.148 -8.680 1.00 0.00 N ATOM 604 CA GLU A 38 7.990 -0.545 -7.601 1.00 0.00 C ATOM 605 C GLU A 38 7.352 -0.845 -6.252 1.00 0.00 C ATOM 606 O GLU A 38 8.041 -1.125 -5.266 1.00 0.00 O ATOM 607 CB GLU A 38 8.082 0.971 -7.804 1.00 0.00 C ATOM 608 CG GLU A 38 8.610 1.378 -9.166 1.00 0.00 C ATOM 609 CD GLU A 38 9.976 0.808 -9.456 1.00 0.00 C ATOM 610 OE1 GLU A 38 10.974 1.533 -9.282 1.00 0.00 O ATOM 611 OE2 GLU A 38 10.064 -0.364 -9.865 1.00 0.00 O1- ATOM 0 H GLU A 38 6.765 -0.471 -9.300 1.00 0.00 H new ATOM 0 HA GLU A 38 8.993 -0.972 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.093 1.407 -7.664 1.00 0.00 H new ATOM 0 HB3 GLU A 38 8.728 1.392 -7.034 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.912 1.047 -9.935 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.655 2.466 -9.223 1.00 0.00 H new ATOM 618 N ILE A 39 6.033 -0.800 -6.227 1.00 0.00 N ATOM 619 CA ILE A 39 5.266 -1.054 -5.024 1.00 0.00 C ATOM 620 C ILE A 39 5.535 -2.457 -4.480 1.00 0.00 C ATOM 621 O ILE A 39 5.616 -2.647 -3.268 1.00 0.00 O ATOM 622 CB ILE A 39 3.750 -0.862 -5.275 1.00 0.00 C ATOM 623 CG1 ILE A 39 3.465 0.586 -5.683 1.00 0.00 C ATOM 624 CG2 ILE A 39 2.949 -1.228 -4.033 1.00 0.00 C ATOM 625 CD1 ILE A 39 2.030 0.838 -6.092 1.00 0.00 C ATOM 0 H ILE A 39 5.462 -0.585 -7.045 1.00 0.00 H new ATOM 0 HA ILE A 39 5.587 -0.328 -4.277 1.00 0.00 H new ATOM 0 HB ILE A 39 3.446 -1.524 -6.086 1.00 0.00 H new ATOM 0 HG12 ILE A 39 3.716 1.243 -4.851 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.121 0.855 -6.511 1.00 0.00 H new ATOM 0 HG21 ILE A 39 1.886 -1.086 -4.230 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.134 -2.271 -3.775 1.00 0.00 H new ATOM 0 HG23 ILE A 39 3.252 -0.590 -3.203 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.909 1.886 -6.367 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.779 0.208 -6.945 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.368 0.602 -5.259 1.00 0.00 H new ATOM 637 N GLU A 40 5.703 -3.431 -5.378 1.00 0.00 N ATOM 638 CA GLU A 40 5.935 -4.817 -4.962 1.00 0.00 C ATOM 639 C GLU A 40 7.187 -4.921 -4.089 1.00 0.00 C ATOM 640 O GLU A 40 7.202 -5.644 -3.086 1.00 0.00 O ATOM 641 CB GLU A 40 6.061 -5.749 -6.174 1.00 0.00 C ATOM 642 CG GLU A 40 6.175 -7.222 -5.795 1.00 0.00 C ATOM 643 CD GLU A 40 6.311 -8.134 -6.992 1.00 0.00 C ATOM 644 OE1 GLU A 40 7.410 -8.689 -7.205 1.00 0.00 O ATOM 645 OE2 GLU A 40 5.322 -8.310 -7.726 1.00 0.00 O1- ATOM 0 H GLU A 40 5.683 -3.288 -6.388 1.00 0.00 H new ATOM 0 HA GLU A 40 5.071 -5.131 -4.376 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.193 -5.613 -6.819 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.938 -5.462 -6.755 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.038 -7.357 -5.143 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.294 -7.513 -5.223 1.00 0.00 H new ATOM 652 N GLU A 41 8.227 -4.185 -4.460 1.00 0.00 N ATOM 653 CA GLU A 41 9.462 -4.179 -3.695 1.00 0.00 C ATOM 654 C GLU A 41 9.231 -3.556 -2.324 1.00 0.00 C ATOM 655 O GLU A 41 9.692 -4.076 -1.304 1.00 0.00 O ATOM 656 CB GLU A 41 10.557 -3.414 -4.438 1.00 0.00 C ATOM 657 CG GLU A 41 11.878 -3.373 -3.691 1.00 0.00 C ATOM 658 CD GLU A 41 12.953 -2.629 -4.442 1.00 0.00 C ATOM 659 OE1 GLU A 41 13.579 -3.232 -5.337 1.00 0.00 O ATOM 660 OE2 GLU A 41 13.183 -1.439 -4.133 1.00 0.00 O1- ATOM 0 H GLU A 41 8.238 -3.586 -5.285 1.00 0.00 H new ATOM 0 HA GLU A 41 9.787 -5.211 -3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 41 10.714 -3.875 -5.413 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.218 -2.394 -4.618 1.00 0.00 H new ATOM 0 HG2 GLU A 41 11.726 -2.901 -2.720 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.214 -4.392 -3.500 1.00 0.00 H new ATOM 667 N LEU A 42 8.493 -2.452 -2.307 1.00 0.00 N ATOM 668 CA LEU A 42 8.182 -1.748 -1.068 1.00 0.00 C ATOM 669 C LEU A 42 7.382 -2.643 -0.127 1.00 0.00 C ATOM 670 O LEU A 42 7.641 -2.683 1.077 1.00 0.00 O ATOM 671 CB LEU A 42 7.401 -0.467 -1.364 1.00 0.00 C ATOM 672 CG LEU A 42 8.115 0.563 -2.239 1.00 0.00 C ATOM 673 CD1 LEU A 42 7.202 1.744 -2.527 1.00 0.00 C ATOM 674 CD2 LEU A 42 9.397 1.035 -1.571 1.00 0.00 C ATOM 0 H LEU A 42 8.097 -2.023 -3.143 1.00 0.00 H new ATOM 0 HA LEU A 42 9.121 -1.483 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.464 -0.740 -1.849 1.00 0.00 H new ATOM 0 HB3 LEU A 42 7.144 0.006 -0.416 1.00 0.00 H new ATOM 0 HG LEU A 42 8.373 0.087 -3.185 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.728 2.467 -3.151 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.310 1.396 -3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.913 2.218 -1.589 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.891 1.768 -2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.160 1.492 -0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.060 0.184 -1.414 1.00 0.00 H new ATOM 686 N ILE A 43 6.419 -3.368 -0.689 1.00 0.00 N ATOM 687 CA ILE A 43 5.595 -4.289 0.086 1.00 0.00 C ATOM 688 C ILE A 43 6.464 -5.367 0.720 1.00 0.00 C ATOM 689 O ILE A 43 6.320 -5.683 1.905 1.00 0.00 O ATOM 690 CB ILE A 43 4.521 -4.977 -0.800 1.00 0.00 C ATOM 691 CG1 ILE A 43 3.566 -3.941 -1.395 1.00 0.00 C ATOM 692 CG2 ILE A 43 3.740 -6.015 0.004 1.00 0.00 C ATOM 693 CD1 ILE A 43 2.585 -4.523 -2.392 1.00 0.00 C ATOM 0 H ILE A 43 6.190 -3.335 -1.682 1.00 0.00 H new ATOM 0 HA ILE A 43 5.095 -3.704 0.858 1.00 0.00 H new ATOM 0 HB ILE A 43 5.033 -5.486 -1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.011 -3.465 -0.587 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.149 -3.161 -1.884 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.993 -6.484 -0.636 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.425 -6.775 0.380 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.244 -5.527 0.843 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.940 -3.731 -2.772 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.132 -4.974 -3.220 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.976 -5.283 -1.902 1.00 0.00 H new ATOM 705 N GLN A 44 7.376 -5.914 -0.071 1.00 0.00 N ATOM 706 CA GLN A 44 8.253 -6.961 0.386 1.00 0.00 C ATOM 707 C GLN A 44 9.163 -6.459 1.506 1.00 0.00 C ATOM 708 O GLN A 44 9.351 -7.140 2.511 1.00 0.00 O ATOM 709 CB GLN A 44 9.081 -7.484 -0.779 1.00 0.00 C ATOM 710 CG GLN A 44 9.776 -8.790 -0.486 1.00 0.00 C ATOM 711 CD GLN A 44 8.798 -9.903 -0.155 1.00 0.00 C ATOM 712 OE1 GLN A 44 7.665 -9.914 -0.637 1.00 0.00 O ATOM 713 NE2 GLN A 44 9.225 -10.840 0.663 1.00 0.00 N ATOM 0 H GLN A 44 7.522 -5.640 -1.043 1.00 0.00 H new ATOM 0 HA GLN A 44 7.647 -7.774 0.785 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.433 -7.613 -1.646 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.828 -6.737 -1.048 1.00 0.00 H new ATOM 0 HG2 GLN A 44 10.376 -9.081 -1.348 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.464 -8.654 0.349 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.171 -10.795 1.041 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.610 -11.612 0.919 1.00 0.00 H new ATOM 722 N LYS A 45 9.712 -5.262 1.328 1.00 0.00 N ATOM 723 CA LYS A 45 10.588 -4.657 2.329 1.00 0.00 C ATOM 724 C LYS A 45 9.845 -4.413 3.637 1.00 0.00 C ATOM 725 O LYS A 45 10.403 -4.595 4.720 1.00 0.00 O ATOM 726 CB LYS A 45 11.195 -3.359 1.799 1.00 0.00 C ATOM 727 CG LYS A 45 12.230 -3.582 0.711 1.00 0.00 C ATOM 728 CD LYS A 45 12.704 -2.272 0.111 1.00 0.00 C ATOM 729 CE LYS A 45 13.862 -2.501 -0.845 1.00 0.00 C ATOM 730 NZ LYS A 45 14.248 -1.265 -1.565 1.00 0.00 N ATOM 0 H LYS A 45 9.566 -4.689 0.497 1.00 0.00 H new ATOM 0 HA LYS A 45 11.398 -5.357 2.533 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.398 -2.726 1.409 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.657 -2.818 2.625 1.00 0.00 H new ATOM 0 HG2 LYS A 45 13.082 -4.122 1.124 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.805 -4.209 -0.073 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.881 -1.790 -0.417 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.013 -1.594 0.906 1.00 0.00 H new ATOM 0 HE2 LYS A 45 14.720 -2.878 -0.289 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.587 -3.269 -1.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 15.270 -1.279 -1.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.730 -1.211 -2.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 14.015 -0.436 -0.981 1.00 0.00 H new ATOM 744 N HIS A 46 8.583 -4.010 3.530 1.00 0.00 N ATOM 745 CA HIS A 46 7.740 -3.802 4.702 1.00 0.00 C ATOM 746 C HIS A 46 7.620 -5.112 5.485 1.00 0.00 C ATOM 747 O HIS A 46 7.696 -5.131 6.712 1.00 0.00 O ATOM 748 CB HIS A 46 6.346 -3.303 4.270 1.00 0.00 C ATOM 749 CG HIS A 46 5.400 -3.016 5.406 1.00 0.00 C ATOM 750 ND1 HIS A 46 4.306 -3.795 5.713 1.00 0.00 N ATOM 751 CD2 HIS A 46 5.393 -1.999 6.303 1.00 0.00 C ATOM 752 CE1 HIS A 46 3.684 -3.240 6.758 1.00 0.00 C ATOM 753 NE2 HIS A 46 4.305 -2.147 7.155 1.00 0.00 N ATOM 0 H HIS A 46 8.120 -3.820 2.641 1.00 0.00 H new ATOM 0 HA HIS A 46 8.193 -3.046 5.343 1.00 0.00 H new ATOM 0 HB2 HIS A 46 6.467 -2.396 3.678 1.00 0.00 H new ATOM 0 HB3 HIS A 46 5.893 -4.050 3.618 1.00 0.00 H new ATOM 0 HD2 HIS A 46 6.118 -1.200 6.348 1.00 0.00 H new ATOM 0 HE1 HIS A 46 2.790 -3.635 7.217 1.00 0.00 H new ATOM 0 HE2 HIS A 46 4.041 -1.536 7.928 1.00 0.00 H new ATOM 761 N ARG A 47 7.458 -6.206 4.750 1.00 0.00 N ATOM 762 CA ARG A 47 7.347 -7.531 5.345 1.00 0.00 C ATOM 763 C ARG A 47 8.665 -7.942 5.995 1.00 0.00 C ATOM 764 O ARG A 47 8.676 -8.542 7.064 1.00 0.00 O ATOM 765 CB ARG A 47 6.954 -8.564 4.284 1.00 0.00 C ATOM 766 CG ARG A 47 5.650 -8.254 3.572 1.00 0.00 C ATOM 767 CD ARG A 47 5.343 -9.284 2.495 1.00 0.00 C ATOM 768 NE ARG A 47 5.038 -10.600 3.058 1.00 0.00 N ATOM 769 CZ ARG A 47 4.613 -11.647 2.344 1.00 0.00 C ATOM 770 NH1 ARG A 47 4.503 -11.556 1.018 1.00 0.00 N ATOM 771 NH2 ARG A 47 4.306 -12.782 2.954 1.00 0.00 N ATOM 0 H ARG A 47 7.400 -6.200 3.732 1.00 0.00 H new ATOM 0 HA ARG A 47 6.572 -7.492 6.110 1.00 0.00 H new ATOM 0 HB2 ARG A 47 7.752 -8.632 3.545 1.00 0.00 H new ATOM 0 HB3 ARG A 47 6.874 -9.543 4.757 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.836 -8.230 4.296 1.00 0.00 H new ATOM 0 HG3 ARG A 47 5.706 -7.262 3.123 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.498 -8.942 1.898 1.00 0.00 H new ATOM 0 HD3 ARG A 47 6.196 -9.368 1.821 1.00 0.00 H new ATOM 0 HE ARG A 47 5.158 -10.727 4.063 1.00 0.00 H new ATOM 0 HH11 ARG A 47 4.744 -10.685 0.545 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.178 -12.357 0.477 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.394 -12.856 3.967 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.982 -13.582 2.410 1.00 0.00 H new ATOM 785 N GLN A 48 9.773 -7.585 5.350 1.00 0.00 N ATOM 786 CA GLN A 48 11.106 -7.948 5.829 1.00 0.00 C ATOM 787 C GLN A 48 11.389 -7.361 7.202 1.00 0.00 C ATOM 788 O GLN A 48 11.924 -8.041 8.068 1.00 0.00 O ATOM 789 CB GLN A 48 12.181 -7.471 4.853 1.00 0.00 C ATOM 790 CG GLN A 48 12.149 -8.149 3.498 1.00 0.00 C ATOM 791 CD GLN A 48 13.185 -7.578 2.551 1.00 0.00 C ATOM 792 OE1 GLN A 48 14.239 -7.110 2.976 1.00 0.00 O ATOM 793 NE2 GLN A 48 12.892 -7.610 1.270 1.00 0.00 N ATOM 0 H GLN A 48 9.774 -7.040 4.488 1.00 0.00 H new ATOM 0 HA GLN A 48 11.131 -9.035 5.901 1.00 0.00 H new ATOM 0 HB2 GLN A 48 12.071 -6.396 4.709 1.00 0.00 H new ATOM 0 HB3 GLN A 48 13.160 -7.634 5.303 1.00 0.00 H new ATOM 0 HG2 GLN A 48 12.323 -9.218 3.624 1.00 0.00 H new ATOM 0 HG3 GLN A 48 11.157 -8.037 3.060 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.006 -8.008 0.959 1.00 0.00 H new ATOM 0 HE22 GLN A 48 13.551 -7.237 0.587 1.00 0.00 H new ATOM 802 N LEU A 49 11.021 -6.107 7.400 1.00 0.00 N ATOM 803 CA LEU A 49 11.287 -5.431 8.663 1.00 0.00 C ATOM 804 C LEU A 49 10.576 -6.117 9.828 1.00 0.00 C ATOM 805 O LEU A 49 11.172 -6.345 10.882 1.00 0.00 O ATOM 806 CB LEU A 49 10.884 -3.958 8.580 1.00 0.00 C ATOM 807 CG LEU A 49 11.652 -3.121 7.553 1.00 0.00 C ATOM 808 CD1 LEU A 49 11.154 -1.691 7.553 1.00 0.00 C ATOM 809 CD2 LEU A 49 13.150 -3.162 7.831 1.00 0.00 C ATOM 0 H LEU A 49 10.539 -5.536 6.706 1.00 0.00 H new ATOM 0 HA LEU A 49 12.359 -5.490 8.849 1.00 0.00 H new ATOM 0 HB2 LEU A 49 9.821 -3.903 8.346 1.00 0.00 H new ATOM 0 HB3 LEU A 49 11.017 -3.507 9.563 1.00 0.00 H new ATOM 0 HG LEU A 49 11.476 -3.550 6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 49 11.711 -1.112 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 49 10.094 -1.675 7.300 1.00 0.00 H new ATOM 0 HD13 LEU A 49 11.298 -1.256 8.542 1.00 0.00 H new ATOM 0 HD21 LEU A 49 13.674 -2.560 7.089 1.00 0.00 H new ATOM 0 HD22 LEU A 49 13.346 -2.763 8.826 1.00 0.00 H new ATOM 0 HD23 LEU A 49 13.502 -4.192 7.777 1.00 0.00 H new ATOM 821 N PHE A 50 9.317 -6.462 9.630 1.00 0.00 N ATOM 822 CA PHE A 50 8.538 -7.125 10.671 1.00 0.00 C ATOM 823 C PHE A 50 8.961 -8.582 10.837 1.00 0.00 C ATOM 824 O PHE A 50 9.013 -9.099 11.957 1.00 0.00 O ATOM 825 CB PHE A 50 7.039 -7.041 10.364 1.00 0.00 C ATOM 826 CG PHE A 50 6.455 -5.666 10.549 1.00 0.00 C ATOM 827 CD1 PHE A 50 6.628 -4.686 9.586 1.00 0.00 C ATOM 828 CD2 PHE A 50 5.732 -5.357 11.688 1.00 0.00 C ATOM 829 CE1 PHE A 50 6.093 -3.426 9.755 1.00 0.00 C ATOM 830 CE2 PHE A 50 5.194 -4.097 11.865 1.00 0.00 C ATOM 831 CZ PHE A 50 5.376 -3.130 10.896 1.00 0.00 C ATOM 0 H PHE A 50 8.809 -6.296 8.761 1.00 0.00 H new ATOM 0 HA PHE A 50 8.733 -6.606 11.609 1.00 0.00 H new ATOM 0 HB2 PHE A 50 6.870 -7.362 9.336 1.00 0.00 H new ATOM 0 HB3 PHE A 50 6.506 -7.741 11.008 1.00 0.00 H new ATOM 0 HD1 PHE A 50 7.189 -4.911 8.691 1.00 0.00 H new ATOM 0 HD2 PHE A 50 5.587 -6.110 12.448 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.235 -2.672 8.995 1.00 0.00 H new ATOM 0 HE2 PHE A 50 4.633 -3.869 12.759 1.00 0.00 H new ATOM 0 HZ PHE A 50 4.958 -2.144 11.031 1.00 0.00 H new ATOM 841 N ASP A 51 9.274 -9.230 9.727 1.00 0.00 N ATOM 842 CA ASP A 51 9.669 -10.639 9.737 1.00 0.00 C ATOM 843 C ASP A 51 11.038 -10.818 10.390 1.00 0.00 C ATOM 844 O ASP A 51 11.258 -11.765 11.146 1.00 0.00 O ATOM 845 CB ASP A 51 9.695 -11.184 8.304 1.00 0.00 C ATOM 846 CG ASP A 51 9.817 -12.691 8.242 1.00 0.00 C ATOM 847 OD1 ASP A 51 10.952 -13.207 8.239 1.00 0.00 O ATOM 848 OD2 ASP A 51 8.771 -13.371 8.176 1.00 0.00 O1- ATOM 0 H ASP A 51 9.264 -8.805 8.800 1.00 0.00 H new ATOM 0 HA ASP A 51 8.937 -11.197 10.321 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.784 -10.878 7.789 1.00 0.00 H new ATOM 0 HB3 ASP A 51 10.531 -10.736 7.767 1.00 0.00 H new ATOM 853 N ASN A 52 11.945 -9.891 10.105 1.00 0.00 N ATOM 854 CA ASN A 52 13.305 -9.929 10.648 1.00 0.00 C ATOM 855 C ASN A 52 13.318 -9.608 12.140 1.00 0.00 C ATOM 856 O ASN A 52 14.062 -10.217 12.909 1.00 0.00 O ATOM 857 CB ASN A 52 14.205 -8.945 9.885 1.00 0.00 C ATOM 858 CG ASN A 52 15.603 -8.841 10.464 1.00 0.00 C ATOM 859 OD1 ASN A 52 15.873 -7.995 11.318 1.00 0.00 O ATOM 860 ND2 ASN A 52 16.498 -9.687 10.003 1.00 0.00 N ATOM 0 H ASN A 52 11.764 -9.094 9.495 1.00 0.00 H new ATOM 0 HA ASN A 52 13.690 -10.941 10.521 1.00 0.00 H new ATOM 0 HB2 ASN A 52 14.273 -9.258 8.843 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.742 -7.958 9.892 1.00 0.00 H new ATOM 0 HD21 ASN A 52 17.456 -9.657 10.353 1.00 0.00 H new ATOM 0 HD22 ASN A 52 16.235 -10.373 9.296 1.00 0.00 H new ATOM 867 N ARG A 53 12.488 -8.659 12.547 1.00 0.00 N ATOM 868 CA ARG A 53 12.406 -8.267 13.950 1.00 0.00 C ATOM 869 C ARG A 53 11.699 -9.342 14.770 1.00 0.00 C ATOM 870 O ARG A 53 11.915 -9.457 15.978 1.00 0.00 O ATOM 871 CB ARG A 53 11.668 -6.930 14.096 1.00 0.00 C ATOM 872 CG ARG A 53 11.648 -6.390 15.521 1.00 0.00 C ATOM 873 CD ARG A 53 10.884 -5.081 15.614 1.00 0.00 C ATOM 874 NE ARG A 53 9.445 -5.256 15.382 1.00 0.00 N ATOM 875 CZ ARG A 53 8.710 -4.477 14.580 1.00 0.00 C ATOM 876 NH1 ARG A 53 9.289 -3.506 13.870 1.00 0.00 N ATOM 877 NH2 ARG A 53 7.396 -4.666 14.489 1.00 0.00 N ATOM 0 H ARG A 53 11.861 -8.145 11.928 1.00 0.00 H new ATOM 0 HA ARG A 53 13.422 -8.151 14.326 1.00 0.00 H new ATOM 0 HB2 ARG A 53 12.138 -6.193 13.445 1.00 0.00 H new ATOM 0 HB3 ARG A 53 10.642 -7.053 13.750 1.00 0.00 H new ATOM 0 HG2 ARG A 53 11.191 -7.126 16.183 1.00 0.00 H new ATOM 0 HG3 ARG A 53 12.670 -6.240 15.868 1.00 0.00 H new ATOM 0 HD2 ARG A 53 11.040 -4.642 16.599 1.00 0.00 H new ATOM 0 HD3 ARG A 53 11.284 -4.377 14.884 1.00 0.00 H new ATOM 0 HE ARG A 53 8.974 -6.022 15.864 1.00 0.00 H new ATOM 0 HH11 ARG A 53 10.296 -3.356 13.938 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.725 -2.915 13.260 1.00 0.00 H new ATOM 0 HH21 ARG A 53 6.948 -5.405 15.031 1.00 0.00 H new ATOM 0 HH22 ARG A 53 6.836 -4.072 13.877 1.00 0.00 H new ATOM 891 N GLN A 54 10.860 -10.123 14.087 1.00 0.00 N ATOM 892 CA GLN A 54 10.048 -11.166 14.707 1.00 0.00 C ATOM 893 C GLN A 54 8.929 -10.540 15.523 1.00 0.00 C ATOM 894 O GLN A 54 9.111 -10.173 16.691 1.00 0.00 O ATOM 895 CB GLN A 54 10.880 -12.126 15.579 1.00 0.00 C ATOM 896 CG GLN A 54 10.050 -13.237 16.206 1.00 0.00 C ATOM 897 CD GLN A 54 10.793 -14.011 17.274 1.00 0.00 C ATOM 898 OE1 GLN A 54 12.009 -14.162 17.222 1.00 0.00 O ATOM 899 NE2 GLN A 54 10.062 -14.501 18.255 1.00 0.00 N ATOM 0 H GLN A 54 10.725 -10.047 13.079 1.00 0.00 H new ATOM 0 HA GLN A 54 9.621 -11.764 13.902 1.00 0.00 H new ATOM 0 HB2 GLN A 54 11.668 -12.569 14.970 1.00 0.00 H new ATOM 0 HB3 GLN A 54 11.370 -11.557 16.369 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.148 -12.806 16.641 1.00 0.00 H new ATOM 0 HG3 GLN A 54 9.729 -13.926 15.425 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.053 -14.353 18.262 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.505 -15.028 19.007 1.00 0.00 H new ATOM 908 N GLU A 55 7.791 -10.385 14.899 1.00 0.00 N ATOM 909 CA GLU A 55 6.644 -9.808 15.551 1.00 0.00 C ATOM 910 C GLU A 55 5.765 -10.914 16.122 1.00 0.00 C ATOM 911 O GLU A 55 5.759 -12.032 15.610 1.00 0.00 O ATOM 912 CB GLU A 55 5.860 -8.939 14.557 1.00 0.00 C ATOM 913 CG GLU A 55 4.785 -8.082 15.197 1.00 0.00 C ATOM 914 CD GLU A 55 5.324 -7.254 16.341 1.00 0.00 C ATOM 915 OE1 GLU A 55 5.891 -6.175 16.089 1.00 0.00 O ATOM 916 OE2 GLU A 55 5.189 -7.688 17.503 1.00 0.00 O1- ATOM 0 H GLU A 55 7.633 -10.654 13.928 1.00 0.00 H new ATOM 0 HA GLU A 55 6.974 -9.173 16.373 1.00 0.00 H new ATOM 0 HB2 GLU A 55 6.559 -8.291 14.028 1.00 0.00 H new ATOM 0 HB3 GLU A 55 5.398 -9.586 13.811 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.352 -7.422 14.445 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.981 -8.722 15.560 1.00 0.00 H new ATOM 923 N ALA A 56 5.032 -10.603 17.178 1.00 0.00 N ATOM 924 CA ALA A 56 4.155 -11.577 17.823 1.00 0.00 C ATOM 925 C ALA A 56 2.751 -11.490 17.241 1.00 0.00 C ATOM 926 O ALA A 56 1.765 -11.861 17.882 1.00 0.00 O ATOM 927 CB ALA A 56 4.129 -11.341 19.328 1.00 0.00 C ATOM 0 H ALA A 56 5.024 -9.680 17.612 1.00 0.00 H new ATOM 0 HA ALA A 56 4.541 -12.579 17.636 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.472 -12.072 19.800 1.00 0.00 H new ATOM 0 HB2 ALA A 56 5.137 -11.446 19.730 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.759 -10.336 19.532 1.00 0.00 H new ATOM 933 N ALA A 57 2.674 -11.010 16.016 1.00 0.00 N ATOM 934 CA ALA A 57 1.414 -10.845 15.332 1.00 0.00 C ATOM 935 C ALA A 57 1.510 -11.379 13.907 1.00 0.00 C ATOM 936 O ALA A 57 1.094 -10.719 12.953 1.00 0.00 O ATOM 937 CB ALA A 57 1.014 -9.376 15.330 1.00 0.00 C ATOM 0 H ALA A 57 3.486 -10.724 15.469 1.00 0.00 H new ATOM 0 HA ALA A 57 0.648 -11.414 15.858 1.00 0.00 H new ATOM 0 HB1 ALA A 57 0.062 -9.259 14.812 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.914 -9.025 16.357 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.779 -8.791 14.819 1.00 0.00 H new ATOM 943 N ASP A 58 2.047 -12.585 13.772 1.00 0.00 N ATOM 944 CA ASP A 58 2.211 -13.219 12.462 1.00 0.00 C ATOM 945 C ASP A 58 0.867 -13.425 11.786 1.00 0.00 C ATOM 946 O ASP A 58 0.717 -13.158 10.597 1.00 0.00 O ATOM 947 CB ASP A 58 2.935 -14.562 12.598 1.00 0.00 C ATOM 948 CG ASP A 58 2.932 -15.367 11.311 1.00 0.00 C ATOM 949 OD1 ASP A 58 3.783 -15.108 10.441 1.00 0.00 O ATOM 950 OD2 ASP A 58 2.085 -16.274 11.175 1.00 0.00 O1- ATOM 0 H ASP A 58 2.379 -13.149 14.555 1.00 0.00 H new ATOM 0 HA ASP A 58 2.813 -12.553 11.844 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.965 -14.384 12.907 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.462 -15.146 13.387 1.00 0.00 H new ATOM 955 N THR A 59 -0.116 -13.873 12.551 1.00 0.00 N ATOM 956 CA THR A 59 -1.445 -14.100 12.014 1.00 0.00 C ATOM 957 C THR A 59 -2.095 -12.772 11.598 1.00 0.00 C ATOM 958 O THR A 59 -2.889 -12.723 10.657 1.00 0.00 O ATOM 959 CB THR A 59 -2.354 -14.859 13.023 1.00 0.00 C ATOM 960 OG1 THR A 59 -3.592 -15.224 12.397 1.00 0.00 O ATOM 961 CG2 THR A 59 -2.643 -14.011 14.256 1.00 0.00 C ATOM 0 H THR A 59 -0.017 -14.086 13.544 1.00 0.00 H new ATOM 0 HA THR A 59 -1.337 -14.730 11.131 1.00 0.00 H new ATOM 0 HB THR A 59 -1.822 -15.757 13.337 1.00 0.00 H new ATOM 0 HG1 THR A 59 -4.155 -15.702 13.041 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.280 -14.570 14.941 1.00 0.00 H new ATOM 0 HG22 THR A 59 -1.706 -13.762 14.754 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.150 -13.094 13.956 1.00 0.00 H new ATOM 969 N GLU A 60 -1.716 -11.693 12.280 1.00 0.00 N ATOM 970 CA GLU A 60 -2.242 -10.374 11.974 1.00 0.00 C ATOM 971 C GLU A 60 -1.653 -9.888 10.661 1.00 0.00 C ATOM 972 O GLU A 60 -2.365 -9.378 9.793 1.00 0.00 O ATOM 973 CB GLU A 60 -1.890 -9.394 13.092 1.00 0.00 C ATOM 974 CG GLU A 60 -2.567 -8.040 12.966 1.00 0.00 C ATOM 975 CD GLU A 60 -4.051 -8.116 13.222 1.00 0.00 C ATOM 976 OE1 GLU A 60 -4.468 -7.861 14.368 1.00 0.00 O ATOM 977 OE2 GLU A 60 -4.809 -8.439 12.287 1.00 0.00 O1- ATOM 0 H GLU A 60 -1.045 -11.711 13.048 1.00 0.00 H new ATOM 0 HA GLU A 60 -3.327 -10.433 11.888 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.164 -9.838 14.049 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.810 -9.248 13.106 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.114 -7.343 13.671 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.393 -7.641 11.967 1.00 0.00 H new ATOM 984 N ALA A 61 -0.345 -10.070 10.519 1.00 0.00 N ATOM 985 CA ALA A 61 0.361 -9.680 9.312 1.00 0.00 C ATOM 986 C ALA A 61 -0.082 -10.540 8.139 1.00 0.00 C ATOM 987 O ALA A 61 -0.228 -10.054 7.020 1.00 0.00 O ATOM 988 CB ALA A 61 1.865 -9.795 9.517 1.00 0.00 C ATOM 0 H ALA A 61 0.249 -10.489 11.234 1.00 0.00 H new ATOM 0 HA ALA A 61 0.121 -8.640 9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.380 -9.499 8.603 1.00 0.00 H new ATOM 0 HB2 ALA A 61 2.172 -9.142 10.334 1.00 0.00 H new ATOM 0 HB3 ALA A 61 2.121 -10.826 9.761 1.00 0.00 H new ATOM 994 N ALA A 62 -0.313 -11.820 8.412 1.00 0.00 N ATOM 995 CA ALA A 62 -0.764 -12.749 7.395 1.00 0.00 C ATOM 996 C ALA A 62 -2.117 -12.332 6.851 1.00 0.00 C ATOM 997 O ALA A 62 -2.340 -12.361 5.642 1.00 0.00 O ATOM 998 CB ALA A 62 -0.833 -14.162 7.957 1.00 0.00 C ATOM 0 H ALA A 62 -0.193 -12.235 9.336 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.044 -12.735 6.576 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.173 -14.846 7.180 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.156 -14.466 8.300 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -1.531 -14.187 8.794 1.00 0.00 H new ATOM 1004 N LYS A 63 -3.020 -11.930 7.743 1.00 0.00 N ATOM 1005 CA LYS A 63 -4.339 -11.491 7.325 1.00 0.00 C ATOM 1006 C LYS A 63 -4.267 -10.127 6.648 1.00 0.00 C ATOM 1007 O LYS A 63 -4.998 -9.860 5.689 1.00 0.00 O ATOM 1008 CB LYS A 63 -5.320 -11.456 8.503 1.00 0.00 C ATOM 1009 CG LYS A 63 -6.734 -11.046 8.102 1.00 0.00 C ATOM 1010 CD LYS A 63 -7.293 -11.970 7.027 1.00 0.00 C ATOM 1011 CE LYS A 63 -8.573 -11.422 6.427 1.00 0.00 C ATOM 1012 NZ LYS A 63 -9.066 -12.267 5.312 1.00 0.00 N ATOM 0 H LYS A 63 -2.860 -11.901 8.750 1.00 0.00 H new ATOM 0 HA LYS A 63 -4.712 -12.217 6.603 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.353 -12.441 8.968 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.948 -10.761 9.256 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -7.383 -11.068 8.977 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.727 -10.020 7.735 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.551 -12.104 6.240 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.484 -12.954 7.456 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.338 -11.358 7.200 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.400 -10.408 6.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.817 -11.762 4.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.282 -12.475 4.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.446 -13.157 5.693 1.00 0.00 H new ATOM 1026 N GLN A 64 -3.378 -9.268 7.136 1.00 0.00 N ATOM 1027 CA GLN A 64 -3.205 -7.950 6.549 1.00 0.00 C ATOM 1028 C GLN A 64 -2.707 -8.104 5.124 1.00 0.00 C ATOM 1029 O GLN A 64 -3.204 -7.453 4.211 1.00 0.00 O ATOM 1030 CB GLN A 64 -2.224 -7.108 7.395 1.00 0.00 C ATOM 1031 CG GLN A 64 -2.130 -5.632 6.991 1.00 0.00 C ATOM 1032 CD GLN A 64 -1.253 -5.391 5.771 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -0.283 -6.108 5.536 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -1.596 -4.386 4.989 1.00 0.00 N ATOM 0 H GLN A 64 -2.771 -9.462 7.932 1.00 0.00 H new ATOM 0 HA GLN A 64 -4.160 -7.425 6.535 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -2.526 -7.165 8.441 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -1.232 -7.553 7.325 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.132 -5.255 6.788 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -1.737 -5.058 7.830 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.409 -3.815 5.220 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -1.048 -4.180 4.153 1.00 0.00 H new ATOM 1043 N GLY A 65 -1.751 -9.006 4.942 1.00 0.00 N ATOM 1044 CA GLY A 65 -1.228 -9.285 3.627 1.00 0.00 C ATOM 1045 C GLY A 65 -2.261 -9.953 2.749 1.00 0.00 C ATOM 1046 O GLY A 65 -2.328 -9.695 1.553 1.00 0.00 O ATOM 0 H GLY A 65 -1.328 -9.552 5.692 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -0.899 -8.356 3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.351 -9.927 3.712 1.00 0.00 H new ATOM 1050 N ASP A 66 -3.081 -10.803 3.358 1.00 0.00 N ATOM 1051 CA ASP A 66 -4.136 -11.523 2.643 1.00 0.00 C ATOM 1052 C ASP A 66 -5.133 -10.544 2.024 1.00 0.00 C ATOM 1053 O ASP A 66 -5.515 -10.682 0.862 1.00 0.00 O ATOM 1054 CB ASP A 66 -4.854 -12.468 3.620 1.00 0.00 C ATOM 1055 CG ASP A 66 -6.115 -13.085 3.055 1.00 0.00 C ATOM 1056 OD1 ASP A 66 -7.216 -12.600 3.387 1.00 0.00 O ATOM 1057 OD2 ASP A 66 -6.013 -14.069 2.298 1.00 0.00 O1- ATOM 0 H ASP A 66 -3.036 -11.013 4.355 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.689 -12.104 1.836 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -4.169 -13.265 3.910 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.105 -11.917 4.526 1.00 0.00 H new ATOM 1062 N GLN A 67 -5.523 -9.541 2.794 1.00 0.00 N ATOM 1063 CA GLN A 67 -6.423 -8.510 2.297 1.00 0.00 C ATOM 1064 C GLN A 67 -5.689 -7.569 1.341 1.00 0.00 C ATOM 1065 O GLN A 67 -6.263 -7.072 0.372 1.00 0.00 O ATOM 1066 CB GLN A 67 -7.040 -7.721 3.459 1.00 0.00 C ATOM 1067 CG GLN A 67 -7.969 -6.596 3.012 1.00 0.00 C ATOM 1068 CD GLN A 67 -8.663 -5.894 4.165 1.00 0.00 C ATOM 1069 OE1 GLN A 67 -9.775 -5.381 4.015 1.00 0.00 O ATOM 1070 NE2 GLN A 67 -8.023 -5.866 5.321 1.00 0.00 N ATOM 0 H GLN A 67 -5.232 -9.418 3.764 1.00 0.00 H new ATOM 0 HA GLN A 67 -7.229 -8.998 1.749 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.596 -8.407 4.098 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.239 -7.299 4.066 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -7.395 -5.864 2.444 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -8.722 -7.003 2.338 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -7.105 -6.301 5.406 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -8.448 -5.409 6.128 1.00 0.00 H new ATOM 1079 N TRP A 68 -4.411 -7.354 1.617 1.00 0.00 N ATOM 1080 CA TRP A 68 -3.586 -6.455 0.853 1.00 0.00 C ATOM 1081 C TRP A 68 -3.384 -6.979 -0.572 1.00 0.00 C ATOM 1082 O TRP A 68 -3.566 -6.245 -1.542 1.00 0.00 O ATOM 1083 CB TRP A 68 -2.260 -6.300 1.581 1.00 0.00 C ATOM 1084 CG TRP A 68 -1.374 -5.246 1.047 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -0.231 -5.442 0.365 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -1.548 -3.831 1.162 1.00 0.00 C ATOM 1087 NE1 TRP A 68 0.339 -4.237 0.043 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -0.455 -3.230 0.520 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -2.522 -3.015 1.745 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -0.303 -1.851 0.444 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -2.371 -1.645 1.667 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -1.270 -1.076 1.020 1.00 0.00 C ATOM 0 H TRP A 68 -3.921 -7.808 2.388 1.00 0.00 H new ATOM 0 HA TRP A 68 -4.070 -5.483 0.764 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -2.462 -6.087 2.631 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -1.730 -7.252 1.545 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.178 -6.408 0.108 1.00 0.00 H new ATOM 0 HE1 TRP A 68 1.212 -4.112 -0.469 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -3.375 -3.448 2.246 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 0.548 -1.408 -0.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -3.116 -1.002 2.113 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -1.182 -0.001 0.974 1.00 0.00 H new ATOM 1103 N VAL A 69 -3.025 -8.252 -0.692 1.00 0.00 N ATOM 1104 CA VAL A 69 -2.841 -8.873 -1.999 1.00 0.00 C ATOM 1105 C VAL A 69 -4.173 -8.939 -2.746 1.00 0.00 C ATOM 1106 O VAL A 69 -4.231 -8.713 -3.959 1.00 0.00 O ATOM 1107 CB VAL A 69 -2.228 -10.293 -1.888 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -2.075 -10.929 -3.266 1.00 0.00 C ATOM 1109 CG2 VAL A 69 -0.880 -10.237 -1.183 1.00 0.00 C ATOM 0 H VAL A 69 -2.856 -8.874 0.099 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.140 -8.252 -2.557 1.00 0.00 H new ATOM 0 HB VAL A 69 -2.907 -10.909 -1.299 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -1.643 -11.924 -3.161 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.053 -11.006 -3.742 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.420 -10.312 -3.881 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -0.464 -11.242 -1.113 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -0.200 -9.601 -1.749 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -1.010 -9.828 -0.181 1.00 0.00 H new ATOM 1119 N GLN A 70 -5.244 -9.226 -2.008 1.00 0.00 N ATOM 1120 CA GLN A 70 -6.579 -9.287 -2.585 1.00 0.00 C ATOM 1121 C GLN A 70 -6.961 -7.926 -3.159 1.00 0.00 C ATOM 1122 O GLN A 70 -7.582 -7.836 -4.219 1.00 0.00 O ATOM 1123 CB GLN A 70 -7.595 -9.707 -1.517 1.00 0.00 C ATOM 1124 CG GLN A 70 -9.033 -9.728 -2.006 1.00 0.00 C ATOM 1125 CD GLN A 70 -10.027 -10.015 -0.898 1.00 0.00 C ATOM 1126 OE1 GLN A 70 -9.790 -9.694 0.269 1.00 0.00 O ATOM 1127 NE2 GLN A 70 -11.149 -10.605 -1.254 1.00 0.00 N ATOM 0 H GLN A 70 -5.209 -9.420 -1.007 1.00 0.00 H new ATOM 0 HA GLN A 70 -6.583 -10.025 -3.387 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -7.332 -10.699 -1.151 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -7.520 -9.024 -0.670 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -9.271 -8.767 -2.461 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -9.136 -10.484 -2.785 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -11.307 -10.854 -2.230 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -11.861 -10.813 -0.553 1.00 0.00 H new ATOM 1136 N LEU A 71 -6.565 -6.872 -2.455 1.00 0.00 N ATOM 1137 CA LEU A 71 -6.818 -5.521 -2.874 1.00 0.00 C ATOM 1138 C LEU A 71 -6.120 -5.238 -4.206 1.00 0.00 C ATOM 1139 O LEU A 71 -6.702 -4.632 -5.103 1.00 0.00 O ATOM 1140 CB LEU A 71 -6.325 -4.558 -1.791 1.00 0.00 C ATOM 1141 CG LEU A 71 -6.392 -3.084 -2.137 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -7.836 -2.618 -2.258 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -5.637 -2.256 -1.111 1.00 0.00 C ATOM 0 H LEU A 71 -6.057 -6.944 -1.573 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.889 -5.379 -3.018 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -6.911 -4.727 -0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.292 -4.809 -1.552 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.913 -2.941 -3.106 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.856 -1.557 -2.507 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.337 -3.184 -3.043 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.351 -2.778 -1.311 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.698 -1.201 -1.379 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.079 -2.406 -0.126 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.592 -2.566 -1.091 1.00 0.00 H new ATOM 1155 N PHE A 72 -4.879 -5.700 -4.331 1.00 0.00 N ATOM 1156 CA PHE A 72 -4.114 -5.510 -5.560 1.00 0.00 C ATOM 1157 C PHE A 72 -4.703 -6.295 -6.717 1.00 0.00 C ATOM 1158 O PHE A 72 -4.787 -5.786 -7.832 1.00 0.00 O ATOM 1159 CB PHE A 72 -2.646 -5.872 -5.361 1.00 0.00 C ATOM 1160 CG PHE A 72 -1.841 -4.752 -4.784 1.00 0.00 C ATOM 1161 CD1 PHE A 72 -1.739 -4.586 -3.417 1.00 0.00 C ATOM 1162 CD2 PHE A 72 -1.193 -3.856 -5.616 1.00 0.00 C ATOM 1163 CE1 PHE A 72 -1.006 -3.548 -2.889 1.00 0.00 C ATOM 1164 CE2 PHE A 72 -0.458 -2.817 -5.093 1.00 0.00 C ATOM 1165 CZ PHE A 72 -0.364 -2.662 -3.728 1.00 0.00 C ATOM 0 H PHE A 72 -4.383 -6.207 -3.598 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.174 -4.451 -5.811 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -2.577 -6.738 -4.703 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -2.217 -6.165 -6.319 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.240 -5.278 -2.756 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -1.265 -3.973 -6.687 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -0.934 -3.427 -1.818 1.00 0.00 H new ATOM 0 HE2 PHE A 72 0.044 -2.124 -5.752 1.00 0.00 H new ATOM 0 HZ PHE A 72 0.212 -1.847 -3.315 1.00 0.00 H new ATOM 1175 N GLN A 73 -5.113 -7.529 -6.454 1.00 0.00 N ATOM 1176 CA GLN A 73 -5.736 -8.349 -7.487 1.00 0.00 C ATOM 1177 C GLN A 73 -7.018 -7.688 -7.967 1.00 0.00 C ATOM 1178 O GLN A 73 -7.265 -7.577 -9.165 1.00 0.00 O ATOM 1179 CB GLN A 73 -6.028 -9.757 -6.965 1.00 0.00 C ATOM 1180 CG GLN A 73 -4.782 -10.561 -6.627 1.00 0.00 C ATOM 1181 CD GLN A 73 -3.837 -10.698 -7.808 1.00 0.00 C ATOM 1182 OE1 GLN A 73 -2.941 -9.878 -8.005 1.00 0.00 O ATOM 1183 NE2 GLN A 73 -4.032 -11.729 -8.603 1.00 0.00 N ATOM 0 H GLN A 73 -5.027 -7.982 -5.544 1.00 0.00 H new ATOM 0 HA GLN A 73 -5.043 -8.436 -8.324 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -6.652 -9.681 -6.074 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.606 -10.299 -7.714 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.258 -10.081 -5.801 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -5.076 -11.553 -6.285 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.785 -12.388 -8.408 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.430 -11.869 -9.414 1.00 0.00 H new ATOM 1192 N ARG A 74 -7.807 -7.223 -7.011 1.00 0.00 N ATOM 1193 CA ARG A 74 -9.048 -6.514 -7.284 1.00 0.00 C ATOM 1194 C ARG A 74 -8.766 -5.251 -8.110 1.00 0.00 C ATOM 1195 O ARG A 74 -9.474 -4.951 -9.073 1.00 0.00 O ATOM 1196 CB ARG A 74 -9.712 -6.156 -5.947 1.00 0.00 C ATOM 1197 CG ARG A 74 -10.938 -5.265 -6.039 1.00 0.00 C ATOM 1198 CD ARG A 74 -11.458 -4.941 -4.643 1.00 0.00 C ATOM 1199 NE ARG A 74 -12.432 -3.846 -4.644 1.00 0.00 N ATOM 1200 CZ ARG A 74 -12.660 -3.043 -3.596 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -12.010 -3.235 -2.455 1.00 0.00 N ATOM 1202 NH2 ARG A 74 -13.537 -2.048 -3.694 1.00 0.00 N ATOM 0 H ARG A 74 -7.603 -7.328 -6.017 1.00 0.00 H new ATOM 0 HA ARG A 74 -9.720 -7.147 -7.863 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -9.994 -7.081 -5.443 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.973 -5.662 -5.316 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -10.688 -4.344 -6.565 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -11.716 -5.762 -6.619 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.919 -5.831 -4.215 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.619 -4.676 -3.999 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.970 -3.685 -5.496 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.335 -3.995 -2.374 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.185 -2.622 -1.659 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -14.038 -1.894 -4.569 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -13.708 -1.439 -2.894 1.00 0.00 H new ATOM 1216 N PHE A 75 -7.713 -4.539 -7.732 1.00 0.00 N ATOM 1217 CA PHE A 75 -7.301 -3.323 -8.421 1.00 0.00 C ATOM 1218 C PHE A 75 -6.849 -3.638 -9.850 1.00 0.00 C ATOM 1219 O PHE A 75 -7.226 -2.953 -10.797 1.00 0.00 O ATOM 1220 CB PHE A 75 -6.166 -2.641 -7.630 1.00 0.00 C ATOM 1221 CG PHE A 75 -5.718 -1.307 -8.173 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -6.425 -0.152 -7.882 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -4.581 -1.208 -8.961 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -6.011 1.075 -8.367 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -4.164 0.016 -9.450 1.00 0.00 C ATOM 1226 CZ PHE A 75 -4.880 1.158 -9.152 1.00 0.00 C ATOM 0 H PHE A 75 -7.121 -4.788 -6.940 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.151 -2.643 -8.481 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -6.494 -2.504 -6.599 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -5.308 -3.312 -7.605 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -7.312 -0.211 -7.268 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -4.015 -2.097 -9.195 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.572 1.967 -8.131 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -3.278 0.079 -10.065 1.00 0.00 H new ATOM 0 HZ PHE A 75 -4.555 2.115 -9.533 1.00 0.00 H new ATOM 1236 N ARG A 76 -6.058 -4.692 -9.990 1.00 0.00 N ATOM 1237 CA ARG A 76 -5.534 -5.107 -11.287 1.00 0.00 C ATOM 1238 C ARG A 76 -6.664 -5.536 -12.223 1.00 0.00 C ATOM 1239 O ARG A 76 -6.686 -5.154 -13.396 1.00 0.00 O ATOM 1240 CB ARG A 76 -4.535 -6.253 -11.101 1.00 0.00 C ATOM 1241 CG ARG A 76 -3.736 -6.614 -12.349 1.00 0.00 C ATOM 1242 CD ARG A 76 -2.877 -5.448 -12.827 1.00 0.00 C ATOM 1243 NE ARG A 76 -1.740 -5.907 -13.630 1.00 0.00 N ATOM 1244 CZ ARG A 76 -0.860 -5.108 -14.245 1.00 0.00 C ATOM 1245 NH1 ARG A 76 -1.050 -3.792 -14.291 1.00 0.00 N ATOM 1246 NH2 ARG A 76 0.200 -5.632 -14.837 1.00 0.00 N ATOM 0 H ARG A 76 -5.761 -5.282 -9.213 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.025 -4.257 -11.741 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -3.839 -5.984 -10.306 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.076 -7.137 -10.765 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -3.099 -7.472 -12.137 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -4.419 -6.913 -13.144 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -3.487 -4.764 -13.417 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -2.512 -4.888 -11.966 1.00 0.00 H new ATOM 0 HE ARG A 76 -1.609 -6.914 -13.728 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.875 -3.380 -13.854 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.371 -3.195 -14.763 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.344 -6.642 -14.824 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.873 -5.027 -15.307 1.00 0.00 H new ATOM 1260 N GLU A 77 -7.601 -6.318 -11.696 1.00 0.00 N ATOM 1261 CA GLU A 77 -8.737 -6.793 -12.480 1.00 0.00 C ATOM 1262 C GLU A 77 -9.611 -5.634 -12.945 1.00 0.00 C ATOM 1263 O GLU A 77 -10.093 -5.629 -14.077 1.00 0.00 O ATOM 1264 CB GLU A 77 -9.560 -7.805 -11.686 1.00 0.00 C ATOM 1265 CG GLU A 77 -8.851 -9.134 -11.482 1.00 0.00 C ATOM 1266 CD GLU A 77 -9.642 -10.094 -10.627 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -10.711 -10.555 -11.071 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -9.191 -10.409 -9.508 1.00 0.00 O1- ATOM 0 H GLU A 77 -7.596 -6.637 -10.727 1.00 0.00 H new ATOM 0 HA GLU A 77 -8.343 -7.291 -13.366 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.805 -7.379 -10.713 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.503 -7.981 -12.203 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.660 -9.592 -12.453 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.881 -8.956 -11.018 1.00 0.00 H new ATOM 1275 N ALA A 78 -9.802 -4.647 -12.076 1.00 0.00 N ATOM 1276 CA ALA A 78 -10.594 -3.475 -12.421 1.00 0.00 C ATOM 1277 C ALA A 78 -9.946 -2.709 -13.577 1.00 0.00 C ATOM 1278 O ALA A 78 -10.639 -2.164 -14.444 1.00 0.00 O ATOM 1279 CB ALA A 78 -10.775 -2.578 -11.209 1.00 0.00 C ATOM 0 H ALA A 78 -9.420 -4.636 -11.130 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.580 -3.808 -12.746 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -11.369 -1.707 -11.486 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -11.286 -3.130 -10.421 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.799 -2.252 -10.849 1.00 0.00 H new ATOM 1285 N ILE A 79 -8.611 -2.681 -13.590 1.00 0.00 N ATOM 1286 CA ILE A 79 -7.864 -2.040 -14.670 1.00 0.00 C ATOM 1287 C ILE A 79 -8.074 -2.805 -15.972 1.00 0.00 C ATOM 1288 O ILE A 79 -8.323 -2.209 -17.025 1.00 0.00 O ATOM 1289 CB ILE A 79 -6.342 -1.979 -14.367 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -6.071 -1.148 -13.113 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -5.575 -1.408 -15.560 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -4.608 -1.085 -12.730 1.00 0.00 C ATOM 0 H ILE A 79 -8.027 -3.095 -12.864 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.239 -1.020 -14.761 1.00 0.00 H new ATOM 0 HB ILE A 79 -5.993 -2.996 -14.187 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.440 -0.135 -13.272 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -6.638 -1.566 -12.281 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.511 -1.374 -15.326 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.735 -2.042 -16.432 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.932 -0.400 -15.773 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.493 -0.479 -11.832 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.239 -2.092 -12.538 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.038 -0.639 -13.545 1.00 0.00 H new ATOM 1304 N ASP A 80 -7.986 -4.129 -15.888 1.00 0.00 N ATOM 1305 CA ASP A 80 -8.167 -4.994 -17.054 1.00 0.00 C ATOM 1306 C ASP A 80 -9.582 -4.867 -17.599 1.00 0.00 C ATOM 1307 O ASP A 80 -9.801 -4.913 -18.810 1.00 0.00 O ATOM 1308 CB ASP A 80 -7.869 -6.455 -16.695 1.00 0.00 C ATOM 1309 CG ASP A 80 -7.949 -7.377 -17.899 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -6.953 -7.474 -18.642 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -9.008 -8.009 -18.107 1.00 0.00 O1- ATOM 0 H ASP A 80 -7.790 -4.630 -15.022 1.00 0.00 H new ATOM 0 HA ASP A 80 -7.466 -4.675 -17.825 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -6.874 -6.522 -16.255 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.576 -6.791 -15.936 1.00 0.00 H new ATOM 1316 N LYS A 81 -10.536 -4.685 -16.700 1.00 0.00 N ATOM 1317 CA LYS A 81 -11.931 -4.530 -17.072 1.00 0.00 C ATOM 1318 C LYS A 81 -12.186 -3.117 -17.613 1.00 0.00 C ATOM 1319 O LYS A 81 -13.205 -2.858 -18.252 1.00 0.00 O ATOM 1320 CB LYS A 81 -12.819 -4.801 -15.845 1.00 0.00 C ATOM 1321 CG LYS A 81 -14.312 -4.688 -16.105 1.00 0.00 C ATOM 1322 CD LYS A 81 -14.776 -5.702 -17.132 1.00 0.00 C ATOM 1323 CE LYS A 81 -16.260 -5.555 -17.409 1.00 0.00 C ATOM 1324 NZ LYS A 81 -16.742 -6.526 -18.419 1.00 0.00 N ATOM 0 H LYS A 81 -10.365 -4.641 -15.695 1.00 0.00 H new ATOM 0 HA LYS A 81 -12.175 -5.245 -17.858 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.604 -5.802 -15.472 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.547 -4.101 -15.055 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -14.857 -4.837 -15.173 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -14.546 -3.682 -16.454 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.215 -5.571 -18.057 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.567 -6.710 -16.773 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -16.816 -5.693 -16.482 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -16.464 -4.542 -17.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -17.761 -6.387 -18.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.232 -6.379 -19.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.572 -7.494 -18.079 1.00 0.00 H new ATOM 1338 N GLY A 82 -11.238 -2.224 -17.381 1.00 0.00 N ATOM 1339 CA GLY A 82 -11.367 -0.861 -17.848 1.00 0.00 C ATOM 1340 C GLY A 82 -12.414 -0.085 -17.084 1.00 0.00 C ATOM 1341 O GLY A 82 -13.012 0.854 -17.613 1.00 0.00 O ATOM 0 H GLY A 82 -10.375 -2.421 -16.874 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.405 -0.356 -17.755 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -11.624 -0.866 -18.907 1.00 0.00 H new ATOM 1345 N ASP A 83 -12.633 -0.467 -15.841 1.00 0.00 N ATOM 1346 CA ASP A 83 -13.626 0.194 -15.016 1.00 0.00 C ATOM 1347 C ASP A 83 -12.950 1.174 -14.069 1.00 0.00 C ATOM 1348 O ASP A 83 -12.456 0.793 -13.005 1.00 0.00 O ATOM 1349 CB ASP A 83 -14.452 -0.829 -14.232 1.00 0.00 C ATOM 1350 CG ASP A 83 -15.669 -0.211 -13.575 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -15.517 0.471 -12.551 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -16.791 -0.415 -14.079 1.00 0.00 O1- ATOM 0 H ASP A 83 -12.138 -1.230 -15.380 1.00 0.00 H new ATOM 0 HA ASP A 83 -14.304 0.746 -15.667 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -14.771 -1.625 -14.904 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -13.825 -1.289 -13.468 1.00 0.00 H new ATOM 1357 N LYS A 84 -12.909 2.432 -14.471 1.00 0.00 N ATOM 1358 CA LYS A 84 -12.268 3.474 -13.679 1.00 0.00 C ATOM 1359 C LYS A 84 -13.074 3.799 -12.430 1.00 0.00 C ATOM 1360 O LYS A 84 -12.526 4.268 -11.431 1.00 0.00 O ATOM 1361 CB LYS A 84 -12.050 4.741 -14.509 1.00 0.00 C ATOM 1362 CG LYS A 84 -11.108 4.561 -15.689 1.00 0.00 C ATOM 1363 CD LYS A 84 -10.779 5.898 -16.335 1.00 0.00 C ATOM 1364 CE LYS A 84 -9.803 5.741 -17.490 1.00 0.00 C ATOM 1365 NZ LYS A 84 -10.419 5.063 -18.659 1.00 0.00 N ATOM 0 H LYS A 84 -13.314 2.761 -15.347 1.00 0.00 H new ATOM 0 HA LYS A 84 -11.296 3.090 -13.368 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -13.014 5.090 -14.879 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -11.656 5.523 -13.860 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -10.189 4.079 -15.355 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -11.565 3.900 -16.426 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.697 6.363 -16.695 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.354 6.568 -15.588 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -9.440 6.723 -17.792 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -8.937 5.170 -17.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -9.732 5.024 -19.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.697 4.097 -18.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -11.260 5.593 -18.964 1.00 0.00 H new ATOM 1379 N ASP A 85 -14.373 3.555 -12.493 1.00 0.00 N ATOM 1380 CA ASP A 85 -15.261 3.833 -11.371 1.00 0.00 C ATOM 1381 C ASP A 85 -14.876 2.995 -10.156 1.00 0.00 C ATOM 1382 O ASP A 85 -14.794 3.504 -9.030 1.00 0.00 O ATOM 1383 CB ASP A 85 -16.711 3.562 -11.755 1.00 0.00 C ATOM 1384 CG ASP A 85 -17.673 3.958 -10.664 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -18.029 5.153 -10.585 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -18.077 3.088 -9.880 1.00 0.00 O1- ATOM 0 H ASP A 85 -14.839 3.164 -13.311 1.00 0.00 H new ATOM 0 HA ASP A 85 -15.158 4.887 -11.113 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -16.952 4.110 -12.666 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -16.834 2.502 -11.978 1.00 0.00 H new ATOM 1391 N SER A 86 -14.638 1.716 -10.387 1.00 0.00 N ATOM 1392 CA SER A 86 -14.215 0.811 -9.335 1.00 0.00 C ATOM 1393 C SER A 86 -12.829 1.207 -8.833 1.00 0.00 C ATOM 1394 O SER A 86 -12.550 1.152 -7.637 1.00 0.00 O ATOM 1395 CB SER A 86 -14.209 -0.632 -9.847 1.00 0.00 C ATOM 1396 OG SER A 86 -15.480 -0.981 -10.381 1.00 0.00 O ATOM 0 H SER A 86 -14.732 1.278 -11.303 1.00 0.00 H new ATOM 0 HA SER A 86 -14.919 0.878 -8.506 1.00 0.00 H new ATOM 0 HB2 SER A 86 -13.443 -0.748 -10.613 1.00 0.00 H new ATOM 0 HB3 SER A 86 -13.952 -1.311 -9.034 1.00 0.00 H new ATOM 0 HG SER A 86 -15.726 -0.343 -11.083 1.00 0.00 H new ATOM 1402 N LEU A 87 -11.977 1.636 -9.762 1.00 0.00 N ATOM 1403 CA LEU A 87 -10.634 2.092 -9.426 1.00 0.00 C ATOM 1404 C LEU A 87 -10.698 3.294 -8.490 1.00 0.00 C ATOM 1405 O LEU A 87 -9.923 3.396 -7.545 1.00 0.00 O ATOM 1406 CB LEU A 87 -9.848 2.436 -10.698 1.00 0.00 C ATOM 1407 CG LEU A 87 -9.563 1.257 -11.637 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -8.869 1.724 -12.904 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -8.718 0.220 -10.935 1.00 0.00 C ATOM 0 H LEU A 87 -12.196 1.677 -10.757 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.113 1.284 -8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.401 3.194 -11.252 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.898 2.884 -10.407 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.517 0.809 -11.915 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.679 0.868 -13.551 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.506 2.439 -13.425 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.923 2.201 -12.646 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.524 -0.611 -11.613 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.772 0.668 -10.629 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.247 -0.146 -10.055 1.00 0.00 H new ATOM 1421 N GLU A 88 -11.641 4.191 -8.756 1.00 0.00 N ATOM 1422 CA GLU A 88 -11.853 5.374 -7.925 1.00 0.00 C ATOM 1423 C GLU A 88 -12.203 4.963 -6.483 1.00 0.00 C ATOM 1424 O GLU A 88 -11.750 5.579 -5.517 1.00 0.00 O ATOM 1425 CB GLU A 88 -12.973 6.234 -8.528 1.00 0.00 C ATOM 1426 CG GLU A 88 -13.225 7.542 -7.799 1.00 0.00 C ATOM 1427 CD GLU A 88 -12.025 8.462 -7.807 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -11.863 9.226 -8.779 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -11.249 8.443 -6.834 1.00 0.00 O1- ATOM 0 H GLU A 88 -12.278 4.121 -9.549 1.00 0.00 H new ATOM 0 HA GLU A 88 -10.934 5.959 -7.897 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -12.726 6.453 -9.567 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.895 5.653 -8.536 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -14.070 8.052 -8.261 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -13.506 7.329 -6.768 1.00 0.00 H new ATOM 1436 N GLN A 89 -13.005 3.917 -6.353 1.00 0.00 N ATOM 1437 CA GLN A 89 -13.381 3.387 -5.055 1.00 0.00 C ATOM 1438 C GLN A 89 -12.171 2.734 -4.384 1.00 0.00 C ATOM 1439 O GLN A 89 -11.941 2.896 -3.182 1.00 0.00 O ATOM 1440 CB GLN A 89 -14.512 2.373 -5.232 1.00 0.00 C ATOM 1441 CG GLN A 89 -14.911 1.642 -3.969 1.00 0.00 C ATOM 1442 CD GLN A 89 -15.359 2.573 -2.860 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -15.895 3.658 -3.110 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -15.145 2.157 -1.632 1.00 0.00 N ATOM 0 H GLN A 89 -13.411 3.415 -7.142 1.00 0.00 H new ATOM 0 HA GLN A 89 -13.728 4.198 -4.415 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -15.386 2.890 -5.628 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -14.210 1.640 -5.980 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -15.717 0.946 -4.199 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -14.067 1.048 -3.618 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -14.699 1.254 -1.470 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.425 2.737 -0.841 1.00 0.00 H new ATOM 1453 N LEU A 90 -11.397 2.019 -5.182 1.00 0.00 N ATOM 1454 CA LEU A 90 -10.195 1.343 -4.716 1.00 0.00 C ATOM 1455 C LEU A 90 -9.182 2.331 -4.162 1.00 0.00 C ATOM 1456 O LEU A 90 -8.510 2.047 -3.173 1.00 0.00 O ATOM 1457 CB LEU A 90 -9.582 0.541 -5.854 1.00 0.00 C ATOM 1458 CG LEU A 90 -10.262 -0.786 -6.154 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -10.021 -1.201 -7.591 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -9.749 -1.850 -5.207 1.00 0.00 C ATOM 0 H LEU A 90 -11.584 1.889 -6.176 1.00 0.00 H new ATOM 0 HA LEU A 90 -10.475 0.668 -3.907 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.599 1.151 -6.757 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.535 0.349 -5.619 1.00 0.00 H new ATOM 0 HG LEU A 90 -11.336 -0.668 -6.011 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -10.517 -2.153 -7.783 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.423 -0.441 -8.261 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.950 -1.308 -7.764 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.239 -2.799 -5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.672 -1.960 -5.333 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -9.966 -1.558 -4.180 1.00 0.00 H new ATOM 1472 N LEU A 91 -9.088 3.494 -4.790 1.00 0.00 N ATOM 1473 CA LEU A 91 -8.165 4.535 -4.354 1.00 0.00 C ATOM 1474 C LEU A 91 -8.475 4.962 -2.922 1.00 0.00 C ATOM 1475 O LEU A 91 -7.570 5.167 -2.111 1.00 0.00 O ATOM 1476 CB LEU A 91 -8.250 5.742 -5.289 1.00 0.00 C ATOM 1477 CG LEU A 91 -7.889 5.479 -6.751 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -8.172 6.706 -7.597 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -6.429 5.064 -6.881 1.00 0.00 C ATOM 0 H LEU A 91 -9.643 3.743 -5.609 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.153 4.132 -4.386 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -9.265 6.136 -5.251 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.591 6.521 -4.906 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.509 4.659 -7.114 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.909 6.501 -8.635 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -9.231 6.955 -7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.579 7.545 -7.232 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -6.194 4.882 -7.930 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.789 5.859 -6.499 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.257 4.153 -6.307 1.00 0.00 H new ATOM 1491 N GLU A 92 -9.757 5.070 -2.614 1.00 0.00 N ATOM 1492 CA GLU A 92 -10.186 5.460 -1.286 1.00 0.00 C ATOM 1493 C GLU A 92 -9.910 4.372 -0.269 1.00 0.00 C ATOM 1494 O GLU A 92 -9.399 4.648 0.814 1.00 0.00 O ATOM 1495 CB GLU A 92 -11.661 5.831 -1.281 1.00 0.00 C ATOM 1496 CG GLU A 92 -11.929 7.186 -1.889 1.00 0.00 C ATOM 1497 CD GLU A 92 -11.143 8.270 -1.194 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -10.140 8.739 -1.760 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -11.515 8.645 -0.063 1.00 0.00 O1- ATOM 0 H GLU A 92 -10.518 4.892 -3.269 1.00 0.00 H new ATOM 0 HA GLU A 92 -9.606 6.338 -1.001 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.222 5.075 -1.830 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -12.030 5.819 -0.255 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -11.669 7.169 -2.947 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -12.994 7.410 -1.826 1.00 0.00 H new ATOM 1506 N GLU A 93 -10.226 3.135 -0.623 1.00 0.00 N ATOM 1507 CA GLU A 93 -9.991 2.006 0.270 1.00 0.00 C ATOM 1508 C GLU A 93 -8.500 1.814 0.515 1.00 0.00 C ATOM 1509 O GLU A 93 -8.083 1.435 1.611 1.00 0.00 O ATOM 1510 CB GLU A 93 -10.629 0.733 -0.280 1.00 0.00 C ATOM 1511 CG GLU A 93 -12.148 0.783 -0.285 1.00 0.00 C ATOM 1512 CD GLU A 93 -12.784 -0.512 -0.729 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -12.279 -1.591 -0.356 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -13.810 -0.463 -1.439 1.00 0.00 O1- ATOM 0 H GLU A 93 -10.645 2.886 -1.519 1.00 0.00 H new ATOM 0 HA GLU A 93 -10.463 2.225 1.228 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -10.273 0.565 -1.297 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -10.301 -0.118 0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -12.500 1.029 0.717 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -12.477 1.586 -0.944 1.00 0.00 H new ATOM 1521 N LEU A 94 -7.708 2.084 -0.511 1.00 0.00 N ATOM 1522 CA LEU A 94 -6.259 2.015 -0.412 1.00 0.00 C ATOM 1523 C LEU A 94 -5.756 3.039 0.605 1.00 0.00 C ATOM 1524 O LEU A 94 -4.921 2.730 1.455 1.00 0.00 O ATOM 1525 CB LEU A 94 -5.636 2.281 -1.784 1.00 0.00 C ATOM 1526 CG LEU A 94 -4.112 2.295 -1.849 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -3.541 0.932 -1.487 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -3.655 2.720 -3.234 1.00 0.00 C ATOM 0 H LEU A 94 -8.050 2.356 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.968 1.019 -0.078 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.000 1.522 -2.477 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.002 3.243 -2.144 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.740 3.016 -1.121 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.453 0.967 -1.541 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.846 0.667 -0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.914 0.184 -2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.566 2.727 -3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.039 2.019 -3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.032 3.719 -3.451 1.00 0.00 H new ATOM 1540 N GLU A 95 -6.291 4.254 0.516 1.00 0.00 N ATOM 1541 CA GLU A 95 -5.943 5.333 1.436 1.00 0.00 C ATOM 1542 C GLU A 95 -6.299 4.935 2.873 1.00 0.00 C ATOM 1543 O GLU A 95 -5.535 5.181 3.814 1.00 0.00 O ATOM 1544 CB GLU A 95 -6.697 6.609 1.041 1.00 0.00 C ATOM 1545 CG GLU A 95 -6.316 7.842 1.844 1.00 0.00 C ATOM 1546 CD GLU A 95 -4.903 8.302 1.569 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -3.986 7.911 2.316 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -4.701 9.066 0.601 1.00 0.00 O1- ATOM 0 H GLU A 95 -6.975 4.518 -0.193 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.870 5.519 1.381 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.517 6.809 -0.015 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.767 6.433 1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.009 8.651 1.612 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.423 7.626 2.907 1.00 0.00 H new ATOM 1555 N GLN A 96 -7.460 4.305 3.024 1.00 0.00 N ATOM 1556 CA GLN A 96 -7.932 3.844 4.323 1.00 0.00 C ATOM 1557 C GLN A 96 -7.021 2.744 4.863 1.00 0.00 C ATOM 1558 O GLN A 96 -6.745 2.682 6.060 1.00 0.00 O ATOM 1559 CB GLN A 96 -9.367 3.329 4.208 1.00 0.00 C ATOM 1560 CG GLN A 96 -10.356 4.367 3.708 1.00 0.00 C ATOM 1561 CD GLN A 96 -11.732 3.792 3.440 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -11.876 2.619 3.091 1.00 0.00 O ATOM 1563 NE2 GLN A 96 -12.751 4.613 3.599 1.00 0.00 N ATOM 0 H GLN A 96 -8.096 4.101 2.253 1.00 0.00 H new ATOM 0 HA GLN A 96 -7.912 4.684 5.018 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.382 2.473 3.534 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -9.693 2.971 5.185 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.439 5.166 4.445 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -9.971 4.816 2.792 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -12.589 5.577 3.889 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -13.702 4.284 3.432 1.00 0.00 H new ATOM 1572 N ALA A 97 -6.549 1.886 3.969 1.00 0.00 N ATOM 1573 CA ALA A 97 -5.658 0.802 4.345 1.00 0.00 C ATOM 1574 C ALA A 97 -4.324 1.351 4.827 1.00 0.00 C ATOM 1575 O ALA A 97 -3.754 0.858 5.800 1.00 0.00 O ATOM 1576 CB ALA A 97 -5.454 -0.152 3.176 1.00 0.00 C ATOM 0 H ALA A 97 -6.771 1.922 2.974 1.00 0.00 H new ATOM 0 HA ALA A 97 -6.117 0.248 5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -4.784 -0.957 3.476 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.415 -0.572 2.877 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -5.017 0.389 2.337 1.00 0.00 H new ATOM 1582 N LEU A 98 -3.840 2.390 4.151 1.00 0.00 N ATOM 1583 CA LEU A 98 -2.583 3.038 4.520 1.00 0.00 C ATOM 1584 C LEU A 98 -2.693 3.658 5.904 1.00 0.00 C ATOM 1585 O LEU A 98 -1.719 3.705 6.662 1.00 0.00 O ATOM 1586 CB LEU A 98 -2.215 4.113 3.494 1.00 0.00 C ATOM 1587 CG LEU A 98 -1.948 3.613 2.075 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -1.689 4.781 1.137 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -0.775 2.647 2.064 1.00 0.00 C ATOM 0 H LEU A 98 -4.302 2.803 3.341 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.798 2.282 4.534 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.023 4.844 3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.327 4.637 3.847 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.833 3.083 1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.501 4.405 0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.560 5.436 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.820 5.340 1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.598 2.301 1.046 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.116 3.153 2.435 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.000 1.794 2.704 1.00 0.00 H new ATOM 1601 N GLN A 99 -3.892 4.116 6.231 1.00 0.00 N ATOM 1602 CA GLN A 99 -4.165 4.709 7.511 1.00 0.00 C ATOM 1603 C GLN A 99 -4.006 3.657 8.601 1.00 0.00 C ATOM 1604 O GLN A 99 -3.414 3.910 9.651 1.00 0.00 O ATOM 1605 CB GLN A 99 -5.590 5.262 7.513 1.00 0.00 C ATOM 1606 CG GLN A 99 -5.962 6.007 8.768 1.00 0.00 C ATOM 1607 CD GLN A 99 -5.135 7.256 8.962 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -4.077 7.225 9.595 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -5.598 8.360 8.410 1.00 0.00 N ATOM 0 H GLN A 99 -4.698 4.082 5.607 1.00 0.00 H new ATOM 0 HA GLN A 99 -3.465 5.523 7.702 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -5.710 5.929 6.659 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -6.288 4.437 7.374 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -7.018 6.276 8.728 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -5.832 5.351 9.629 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -6.478 8.342 7.894 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -5.076 9.232 8.498 1.00 0.00 H new ATOM 1618 N LYS A 100 -4.515 2.467 8.321 1.00 0.00 N ATOM 1619 CA LYS A 100 -4.448 1.353 9.251 1.00 0.00 C ATOM 1620 C LYS A 100 -3.005 0.893 9.434 1.00 0.00 C ATOM 1621 O LYS A 100 -2.570 0.615 10.552 1.00 0.00 O ATOM 1622 CB LYS A 100 -5.293 0.188 8.738 1.00 0.00 C ATOM 1623 CG LYS A 100 -6.727 0.559 8.407 1.00 0.00 C ATOM 1624 CD LYS A 100 -7.506 -0.648 7.909 1.00 0.00 C ATOM 1625 CE LYS A 100 -8.861 -0.249 7.347 1.00 0.00 C ATOM 1626 NZ LYS A 100 -9.711 0.439 8.348 1.00 0.00 N ATOM 0 H LYS A 100 -4.986 2.248 7.443 1.00 0.00 H new ATOM 0 HA LYS A 100 -4.838 1.687 10.213 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -4.821 -0.224 7.846 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -5.298 -0.602 9.490 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -7.213 0.969 9.292 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -6.737 1.341 7.647 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -6.929 -1.161 7.139 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -7.645 -1.355 8.727 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -8.716 0.405 6.487 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -9.377 -1.139 6.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.667 0.569 7.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -9.763 -0.136 9.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.300 1.367 8.573 1.00 0.00 H new ATOM 1640 N ILE A 101 -2.265 0.830 8.327 1.00 0.00 N ATOM 1641 CA ILE A 101 -0.876 0.384 8.352 1.00 0.00 C ATOM 1642 C ILE A 101 -0.028 1.284 9.240 1.00 0.00 C ATOM 1643 O ILE A 101 0.744 0.799 10.061 1.00 0.00 O ATOM 1644 CB ILE A 101 -0.260 0.337 6.928 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -1.015 -0.672 6.055 1.00 0.00 C ATOM 1646 CG2 ILE A 101 1.226 -0.016 6.992 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -0.500 -0.754 4.634 1.00 0.00 C ATOM 0 H ILE A 101 -2.607 1.083 7.400 1.00 0.00 H new ATOM 0 HA ILE A 101 -0.878 -0.626 8.761 1.00 0.00 H new ATOM 0 HB ILE A 101 -0.355 1.326 6.479 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -0.947 -1.658 6.514 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -2.071 -0.402 6.034 1.00 0.00 H new ATOM 0 HG21 ILE A 101 1.637 -0.043 5.983 1.00 0.00 H new ATOM 0 HG22 ILE A 101 1.754 0.736 7.579 1.00 0.00 H new ATOM 0 HG23 ILE A 101 1.348 -0.993 7.460 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -1.083 -1.488 4.078 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -0.594 0.221 4.156 1.00 0.00 H new ATOM 0 HD13 ILE A 101 0.548 -1.054 4.643 1.00 0.00 H new ATOM 1659 N ARG A 102 -0.192 2.593 9.092 1.00 0.00 N ATOM 1660 CA ARG A 102 0.569 3.543 9.892 1.00 0.00 C ATOM 1661 C ARG A 102 0.287 3.357 11.377 1.00 0.00 C ATOM 1662 O ARG A 102 1.209 3.291 12.184 1.00 0.00 O ATOM 1663 CB ARG A 102 0.271 4.986 9.472 1.00 0.00 C ATOM 1664 CG ARG A 102 0.881 6.030 10.402 1.00 0.00 C ATOM 1665 CD ARG A 102 0.740 7.435 9.848 1.00 0.00 C ATOM 1666 NE ARG A 102 -0.647 7.778 9.526 1.00 0.00 N ATOM 1667 CZ ARG A 102 -1.120 9.030 9.493 1.00 0.00 C ATOM 1668 NH1 ARG A 102 -0.367 10.043 9.902 1.00 0.00 N ATOM 1669 NH2 ARG A 102 -2.362 9.257 9.097 1.00 0.00 N ATOM 0 H ARG A 102 -0.841 3.018 8.430 1.00 0.00 H new ATOM 0 HA ARG A 102 1.626 3.347 9.714 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.648 5.147 8.462 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.809 5.130 9.436 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.397 5.974 11.377 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.936 5.805 10.557 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.127 8.149 10.575 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.352 7.531 8.951 1.00 0.00 H new ATOM 0 HE ARG A 102 -1.292 7.017 9.314 1.00 0.00 H new ATOM 0 HH11 ARG A 102 0.578 9.870 10.244 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -0.733 10.995 9.874 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -2.958 8.478 8.817 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -2.723 10.211 9.072 1.00 0.00 H new ATOM 1683 N GLU A 103 -0.987 3.237 11.723 1.00 0.00 N ATOM 1684 CA GLU A 103 -1.389 3.072 13.114 1.00 0.00 C ATOM 1685 C GLU A 103 -0.793 1.804 13.713 1.00 0.00 C ATOM 1686 O GLU A 103 -0.327 1.806 14.844 1.00 0.00 O ATOM 1687 CB GLU A 103 -2.915 3.042 13.226 1.00 0.00 C ATOM 1688 CG GLU A 103 -3.581 4.371 12.908 1.00 0.00 C ATOM 1689 CD GLU A 103 -3.347 5.415 13.982 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -4.326 5.818 14.647 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -2.191 5.834 14.176 1.00 0.00 O1- ATOM 0 H GLU A 103 -1.761 3.251 11.059 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.008 3.924 13.677 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -3.304 2.280 12.550 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.190 2.742 14.237 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.202 4.744 11.956 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -4.653 4.215 12.786 1.00 0.00 H new ATOM 1698 N LEU A 104 -0.810 0.729 12.955 1.00 0.00 N ATOM 1699 CA LEU A 104 -0.280 -0.540 13.429 1.00 0.00 C ATOM 1700 C LEU A 104 1.253 -0.543 13.479 1.00 0.00 C ATOM 1701 O LEU A 104 1.846 -1.035 14.439 1.00 0.00 O ATOM 1702 CB LEU A 104 -0.774 -1.691 12.546 1.00 0.00 C ATOM 1703 CG LEU A 104 -2.288 -1.930 12.542 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -2.651 -3.025 11.552 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -2.778 -2.291 13.938 1.00 0.00 C ATOM 0 H LEU A 104 -1.184 0.704 12.007 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.646 -0.680 14.446 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.453 -1.501 11.522 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.282 -2.608 12.869 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.780 -1.007 12.233 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.730 -3.182 11.562 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.337 -2.729 10.551 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.147 -3.950 11.832 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.855 -2.457 13.914 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.279 -3.199 14.275 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.552 -1.476 14.625 1.00 0.00 H new ATOM 1717 N ALA A 105 1.884 0.019 12.457 1.00 0.00 N ATOM 1718 CA ALA A 105 3.340 -0.026 12.347 1.00 0.00 C ATOM 1719 C ALA A 105 4.060 0.908 13.321 1.00 0.00 C ATOM 1720 O ALA A 105 5.162 0.593 13.764 1.00 0.00 O ATOM 1721 CB ALA A 105 3.770 0.278 10.920 1.00 0.00 C ATOM 0 H ALA A 105 1.416 0.509 11.695 1.00 0.00 H new ATOM 0 HA ALA A 105 3.633 -1.040 12.619 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.857 0.241 10.852 1.00 0.00 H new ATOM 0 HB2 ALA A 105 3.339 -0.461 10.245 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.422 1.272 10.639 1.00 0.00 H new ATOM 1727 N GLU A 106 3.450 2.034 13.680 1.00 0.00 N ATOM 1728 CA GLU A 106 4.128 2.970 14.578 1.00 0.00 C ATOM 1729 C GLU A 106 3.788 2.707 16.041 1.00 0.00 C ATOM 1730 O GLU A 106 4.539 3.085 16.937 1.00 0.00 O ATOM 1731 CB GLU A 106 3.831 4.431 14.219 1.00 0.00 C ATOM 1732 CG GLU A 106 2.408 4.855 14.489 1.00 0.00 C ATOM 1733 CD GLU A 106 2.304 6.309 14.876 1.00 0.00 C ATOM 1734 OE1 GLU A 106 3.258 6.838 15.479 1.00 0.00 O ATOM 1735 OE2 GLU A 106 1.250 6.920 14.619 1.00 0.00 O1- ATOM 0 H GLU A 106 2.518 2.317 13.376 1.00 0.00 H new ATOM 0 HA GLU A 106 5.196 2.799 14.442 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.504 5.077 14.783 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.051 4.586 13.163 1.00 0.00 H new ATOM 0 HG2 GLU A 106 1.803 4.674 13.600 1.00 0.00 H new ATOM 0 HG3 GLU A 106 1.994 4.239 15.287 1.00 0.00 H new ATOM 1742 N LYS A 107 2.667 2.044 16.288 1.00 0.00 N ATOM 1743 CA LYS A 107 2.251 1.761 17.657 1.00 0.00 C ATOM 1744 C LYS A 107 2.944 0.528 18.221 1.00 0.00 C ATOM 1745 O LYS A 107 2.531 -0.002 19.256 1.00 0.00 O ATOM 1746 CB LYS A 107 0.729 1.619 17.772 1.00 0.00 C ATOM 1747 CG LYS A 107 -0.001 2.911 18.152 1.00 0.00 C ATOM 1748 CD LYS A 107 0.114 3.977 17.072 1.00 0.00 C ATOM 1749 CE LYS A 107 -0.639 5.241 17.458 1.00 0.00 C ATOM 1750 NZ LYS A 107 -0.709 6.218 16.338 1.00 0.00 N ATOM 0 H LYS A 107 2.034 1.695 15.568 1.00 0.00 H new ATOM 0 HA LYS A 107 2.557 2.620 18.255 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.337 1.261 16.820 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.503 0.856 18.517 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.053 2.692 18.333 1.00 0.00 H new ATOM 0 HG3 LYS A 107 0.409 3.297 19.085 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.164 4.214 16.903 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.280 3.589 16.133 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.649 4.978 17.772 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.150 5.706 18.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.288 7.033 16.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.250 6.541 16.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.138 5.763 15.507 1.00 0.00 H new ATOM 1764 N LYS A 108 3.991 0.072 17.548 1.00 0.00 N ATOM 1765 CA LYS A 108 4.779 -1.036 18.048 1.00 0.00 C ATOM 1766 C LYS A 108 5.668 -0.508 19.168 1.00 0.00 C ATOM 1767 O LYS A 108 6.800 -0.074 18.935 1.00 0.00 O ATOM 1768 CB LYS A 108 5.625 -1.660 16.916 1.00 0.00 C ATOM 1769 CG LYS A 108 6.121 -3.093 17.182 1.00 0.00 C ATOM 1770 CD LYS A 108 7.127 -3.161 18.327 1.00 0.00 C ATOM 1771 CE LYS A 108 7.721 -4.555 18.481 1.00 0.00 C ATOM 1772 NZ LYS A 108 6.684 -5.591 18.715 1.00 0.00 N ATOM 0 H LYS A 108 4.311 0.453 16.658 1.00 0.00 H new ATOM 0 HA LYS A 108 4.127 -1.822 18.429 1.00 0.00 H new ATOM 0 HB2 LYS A 108 5.033 -1.662 16.001 1.00 0.00 H new ATOM 0 HB3 LYS A 108 6.489 -1.021 16.736 1.00 0.00 H new ATOM 0 HG2 LYS A 108 5.269 -3.732 17.413 1.00 0.00 H new ATOM 0 HG3 LYS A 108 6.580 -3.489 16.276 1.00 0.00 H new ATOM 0 HD2 LYS A 108 7.928 -2.443 18.149 1.00 0.00 H new ATOM 0 HD3 LYS A 108 6.638 -2.870 19.257 1.00 0.00 H new ATOM 0 HE2 LYS A 108 8.286 -4.807 17.584 1.00 0.00 H new ATOM 0 HE3 LYS A 108 8.426 -4.556 19.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 7.140 -6.519 18.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 6.149 -5.359 19.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 6.035 -5.622 17.903 1.00 0.00 H new ATOM 1786 N ASN A 109 5.131 -0.498 20.368 1.00 0.00 N ATOM 1787 CA ASN A 109 5.828 0.045 21.514 1.00 0.00 C ATOM 1788 C ASN A 109 6.005 -1.015 22.569 1.00 0.00 C ATOM 1789 O ASN A 109 5.009 -1.370 23.226 1.00 0.00 O ATOM 1790 CB ASN A 109 5.060 1.242 22.096 1.00 0.00 C ATOM 1791 CG ASN A 109 4.855 2.376 21.097 1.00 0.00 C ATOM 1792 OD1 ASN A 109 3.863 3.106 21.164 1.00 0.00 O ATOM 1793 ND2 ASN A 109 5.786 2.535 20.172 1.00 0.00 N ATOM 1794 OXT ASN A 109 7.137 -1.492 22.746 1.00 0.00 O ATOM 0 H ASN A 109 4.202 -0.864 20.577 1.00 0.00 H new ATOM 0 HA ASN A 109 6.810 0.386 21.187 1.00 0.00 H new ATOM 0 HB2 ASN A 109 4.088 0.902 22.452 1.00 0.00 H new ATOM 0 HB3 ASN A 109 5.600 1.624 22.962 1.00 0.00 H new ATOM 0 HD21 ASN A 109 5.698 3.281 19.482 1.00 0.00 H new ATOM 0 HD22 ASN A 109 6.593 1.911 20.148 1.00 0.00 H new TER 1801 ASN A 109