USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 561 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 MET CE :methyl 160:sc= -0.84 (180deg=-1.86!) USER MOD Set 1.2: A 77 ASN : amide:sc= 0.0174 X(o=-0.82,f=-1) USER MOD Single : A 10 GLN : amide:sc= -0.016 X(o=-0.016,f=-0.081) USER MOD Single : A 16 SER OG : rot 52:sc= 0.656 USER MOD Single : A 19 SER OG : rot 180:sc= 0.101 USER MOD Single : A 24 SER OG : rot 91:sc= 0.771 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -0.274 USER MOD Single : A 38 SER OG : rot -58:sc= 0.00871 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0296) USER MOD Single : A 68 GLN : amide:sc= -1.59 K(o=-1.6,f=-2.3) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.917 -6.550 0.870 1.00 0.00 N ATOM 105 CA GLN A 10 -16.629 -7.168 1.982 1.00 0.00 C ATOM 106 C GLN A 10 -17.772 -8.043 1.478 1.00 0.00 C ATOM 107 O GLN A 10 -18.237 -7.908 0.346 1.00 0.00 O ATOM 108 CB GLN A 10 -17.171 -6.094 2.927 1.00 0.00 C ATOM 109 CG GLN A 10 -16.217 -5.739 4.056 1.00 0.00 C ATOM 110 CD GLN A 10 -16.704 -4.567 4.885 1.00 0.00 C ATOM 111 OE1 GLN A 10 -17.879 -4.494 5.248 1.00 0.00 O ATOM 112 NE2 GLN A 10 -15.802 -3.641 5.188 1.00 0.00 N ATOM 0 HA GLN A 10 -15.926 -7.799 2.525 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.392 -5.194 2.353 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -18.113 -6.439 3.353 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -16.086 -6.607 4.702 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -15.238 -5.502 3.639 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -14.839 -3.742 4.866 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -16.072 -2.829 5.743 1.00 0.00 H new ATOM 121 N PRO A 11 -18.237 -8.962 2.337 1.00 0.00 N ATOM 122 CA PRO A 11 -19.332 -9.878 2.001 1.00 0.00 C ATOM 123 C PRO A 11 -20.673 -9.161 1.889 1.00 0.00 C ATOM 124 O PRO A 11 -20.916 -8.143 2.538 1.00 0.00 O ATOM 125 CB PRO A 11 -19.346 -10.860 3.174 1.00 0.00 C ATOM 126 CG PRO A 11 -18.750 -10.102 4.310 1.00 0.00 C ATOM 127 CD PRO A 11 -17.730 -9.179 3.702 1.00 0.00 C ATOM 0 HA PRO A 11 -19.183 -10.354 1.032 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.360 -11.187 3.405 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.766 -11.755 2.948 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.514 -9.540 4.847 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.286 -10.777 5.029 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.654 -8.243 4.256 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.736 -9.627 3.695 1.00 0.00 H new ATOM 135 N PRO A 12 -21.566 -9.703 1.048 1.00 0.00 N ATOM 136 CA PRO A 12 -22.899 -9.131 0.834 1.00 0.00 C ATOM 137 C PRO A 12 -23.802 -9.292 2.052 1.00 0.00 C ATOM 138 O PRO A 12 -23.378 -9.804 3.087 1.00 0.00 O ATOM 139 CB PRO A 12 -23.445 -9.938 -0.347 1.00 0.00 C ATOM 140 CG PRO A 12 -22.714 -11.235 -0.290 1.00 0.00 C ATOM 141 CD PRO A 12 -21.345 -10.915 0.243 1.00 0.00 C ATOM 0 HA PRO A 12 -22.857 -8.057 0.652 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.521 -10.086 -0.261 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -23.268 -9.425 -1.292 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -23.229 -11.945 0.357 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.651 -11.692 -1.278 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.948 -11.731 0.847 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.632 -10.738 -0.562 1.00 0.00 H new ATOM 149 N ALA A 13 -25.049 -8.852 1.921 1.00 0.00 N ATOM 150 CA ALA A 13 -26.012 -8.949 3.010 1.00 0.00 C ATOM 151 C ALA A 13 -26.994 -10.092 2.774 1.00 0.00 C ATOM 152 O ALA A 13 -28.136 -10.047 3.233 1.00 0.00 O ATOM 153 CB ALA A 13 -26.760 -7.634 3.174 1.00 0.00 C ATOM 0 H ALA A 13 -25.416 -8.425 1.071 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.464 -9.159 3.928 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.476 -7.722 3.991 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -26.050 -6.837 3.397 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -27.290 -7.399 2.251 1.00 0.00 H new ATOM 159 N ASP A 14 -26.543 -11.114 2.056 1.00 0.00 N ATOM 160 CA ASP A 14 -27.383 -12.269 1.759 1.00 0.00 C ATOM 161 C ASP A 14 -26.592 -13.566 1.899 1.00 0.00 C ATOM 162 O ASP A 14 -27.087 -14.552 2.445 1.00 0.00 O ATOM 163 CB ASP A 14 -27.959 -12.159 0.346 1.00 0.00 C ATOM 164 CG ASP A 14 -29.160 -11.237 0.281 1.00 0.00 C ATOM 165 OD1 ASP A 14 -30.277 -11.695 0.599 1.00 0.00 O ATOM 166 OD2 ASP A 14 -28.984 -10.056 -0.087 1.00 0.00 O ATOM 0 H ASP A 14 -25.601 -11.167 1.669 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.203 -12.284 2.477 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.187 -11.793 -0.331 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.246 -13.150 -0.004 1.00 0.00 H new ATOM 171 N LEU A 15 -25.360 -13.558 1.401 1.00 0.00 N ATOM 172 CA LEU A 15 -24.500 -14.735 1.470 1.00 0.00 C ATOM 173 C LEU A 15 -25.170 -15.938 0.816 1.00 0.00 C ATOM 174 O LEU A 15 -24.884 -17.085 1.161 1.00 0.00 O ATOM 175 CB LEU A 15 -24.156 -15.056 2.925 1.00 0.00 C ATOM 176 CG LEU A 15 -23.181 -14.099 3.612 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.918 -12.886 4.159 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.427 -14.813 4.723 1.00 0.00 C ATOM 0 H LEU A 15 -24.934 -12.751 0.946 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.581 -14.515 0.927 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -25.082 -15.075 3.500 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -23.736 -16.061 2.965 1.00 0.00 H new ATOM 0 HG LEU A 15 -22.458 -13.755 2.872 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.207 -12.217 4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.411 -12.361 3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -24.664 -13.210 4.884 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.738 -14.117 5.201 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -23.136 -15.186 5.462 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -21.866 -15.648 4.304 1.00 0.00 H new ATOM 190 N SER A 16 -26.063 -15.670 -0.132 1.00 0.00 N ATOM 191 CA SER A 16 -26.776 -16.731 -0.833 1.00 0.00 C ATOM 192 C SER A 16 -26.373 -16.776 -2.304 1.00 0.00 C ATOM 193 O SER A 16 -27.120 -16.335 -3.177 1.00 0.00 O ATOM 194 CB SER A 16 -28.287 -16.526 -0.712 1.00 0.00 C ATOM 195 OG SER A 16 -28.679 -15.282 -1.266 1.00 0.00 O ATOM 0 H SER A 16 -26.310 -14.727 -0.432 1.00 0.00 H new ATOM 0 HA SER A 16 -26.508 -17.681 -0.372 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.809 -17.335 -1.222 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.580 -16.569 0.337 1.00 0.00 H new ATOM 0 HG SER A 16 -28.316 -15.198 -2.172 1.00 0.00 H new ATOM 201 N GLY A 17 -25.186 -17.312 -2.571 1.00 0.00 N ATOM 202 CA GLY A 17 -24.704 -17.405 -3.936 1.00 0.00 C ATOM 203 C GLY A 17 -23.190 -17.393 -4.018 1.00 0.00 C ATOM 204 O GLY A 17 -22.612 -17.817 -5.020 1.00 0.00 O ATOM 0 H GLY A 17 -24.550 -17.684 -1.866 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -25.082 -18.321 -4.390 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -25.103 -16.573 -4.516 1.00 0.00 H new ATOM 208 N LEU A 18 -22.546 -16.905 -2.964 1.00 0.00 N ATOM 209 CA LEU A 18 -21.089 -16.838 -2.921 1.00 0.00 C ATOM 210 C LEU A 18 -20.472 -18.201 -3.219 1.00 0.00 C ATOM 211 O LEU A 18 -20.981 -19.233 -2.781 1.00 0.00 O ATOM 212 CB LEU A 18 -20.622 -16.342 -1.552 1.00 0.00 C ATOM 213 CG LEU A 18 -21.037 -14.920 -1.175 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.555 -14.576 0.225 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.496 -13.921 -2.188 1.00 0.00 C ATOM 0 H LEU A 18 -23.009 -16.550 -2.128 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.759 -16.136 -3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.003 -17.024 -0.792 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.534 -16.402 -1.518 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.126 -14.865 -1.185 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.860 -13.560 0.475 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.991 -15.273 0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.468 -14.649 0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.801 -12.914 -1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.408 -13.978 -2.210 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.891 -14.155 -3.176 1.00 0.00 H new ATOM 227 N SER A 19 -19.372 -18.197 -3.965 1.00 0.00 N ATOM 228 CA SER A 19 -18.686 -19.433 -4.322 1.00 0.00 C ATOM 229 C SER A 19 -17.873 -19.963 -3.146 1.00 0.00 C ATOM 230 O SER A 19 -17.715 -19.284 -2.130 1.00 0.00 O ATOM 231 CB SER A 19 -17.772 -19.204 -5.527 1.00 0.00 C ATOM 232 OG SER A 19 -17.327 -17.859 -5.581 1.00 0.00 O ATOM 0 H SER A 19 -18.937 -17.351 -4.334 1.00 0.00 H new ATOM 0 HA SER A 19 -19.440 -20.175 -4.583 1.00 0.00 H new ATOM 0 HB2 SER A 19 -16.913 -19.873 -5.468 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.306 -19.451 -6.445 1.00 0.00 H new ATOM 0 HG SER A 19 -16.743 -17.739 -6.359 1.00 0.00 H new ATOM 238 N ILE A 20 -17.358 -21.180 -3.290 1.00 0.00 N ATOM 239 CA ILE A 20 -16.560 -21.801 -2.241 1.00 0.00 C ATOM 240 C ILE A 20 -15.292 -21.000 -1.968 1.00 0.00 C ATOM 241 O ILE A 20 -14.784 -20.986 -0.847 1.00 0.00 O ATOM 242 CB ILE A 20 -16.172 -23.245 -2.608 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.426 -24.078 -2.884 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.347 -23.872 -1.495 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.126 -25.499 -3.309 1.00 0.00 C ATOM 0 H ILE A 20 -17.480 -21.755 -4.124 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.178 -21.817 -1.343 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.566 -23.224 -3.514 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.044 -24.099 -1.986 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.012 -23.590 -3.663 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.081 -24.893 -1.770 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.439 -23.289 -1.342 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -15.929 -23.885 -0.574 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.061 -26.030 -3.488 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.534 -25.488 -4.224 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.566 -26.004 -2.522 1.00 0.00 H new ATOM 257 N GLU A 21 -14.786 -20.332 -3.000 1.00 0.00 N ATOM 258 CA GLU A 21 -13.577 -19.527 -2.871 1.00 0.00 C ATOM 259 C GLU A 21 -13.883 -18.190 -2.202 1.00 0.00 C ATOM 260 O GLU A 21 -13.016 -17.591 -1.566 1.00 0.00 O ATOM 261 CB GLU A 21 -12.946 -19.290 -4.244 1.00 0.00 C ATOM 262 CG GLU A 21 -11.523 -19.811 -4.358 1.00 0.00 C ATOM 263 CD GLU A 21 -11.446 -21.323 -4.273 1.00 0.00 C ATOM 264 OE1 GLU A 21 -11.856 -21.992 -5.244 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.976 -21.836 -3.236 1.00 0.00 O ATOM 0 H GLU A 21 -15.195 -20.332 -3.935 1.00 0.00 H new ATOM 0 HA GLU A 21 -12.872 -20.074 -2.245 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.562 -19.770 -5.005 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.951 -18.221 -4.457 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.094 -19.482 -5.305 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.916 -19.375 -3.565 1.00 0.00 H new ATOM 272 N GLU A 22 -15.121 -17.729 -2.352 1.00 0.00 N ATOM 273 CA GLU A 22 -15.540 -16.463 -1.763 1.00 0.00 C ATOM 274 C GLU A 22 -15.747 -16.604 -0.258 1.00 0.00 C ATOM 275 O GLU A 22 -15.389 -15.716 0.515 1.00 0.00 O ATOM 276 CB GLU A 22 -16.830 -15.971 -2.423 1.00 0.00 C ATOM 277 CG GLU A 22 -16.605 -15.266 -3.750 1.00 0.00 C ATOM 278 CD GLU A 22 -16.498 -13.760 -3.600 1.00 0.00 C ATOM 279 OE1 GLU A 22 -15.636 -13.302 -2.820 1.00 0.00 O ATOM 280 OE2 GLU A 22 -17.275 -13.041 -4.261 1.00 0.00 O ATOM 0 H GLU A 22 -15.850 -18.213 -2.876 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.750 -15.732 -1.936 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.494 -16.821 -2.581 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.340 -15.290 -1.741 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.693 -15.647 -4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.426 -15.503 -4.427 1.00 0.00 H new ATOM 287 N VAL A 23 -16.329 -17.727 0.150 1.00 0.00 N ATOM 288 CA VAL A 23 -16.584 -17.986 1.562 1.00 0.00 C ATOM 289 C VAL A 23 -15.308 -17.850 2.385 1.00 0.00 C ATOM 290 O VAL A 23 -15.336 -17.361 3.515 1.00 0.00 O ATOM 291 CB VAL A 23 -17.172 -19.394 1.777 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.426 -19.647 3.256 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.451 -19.565 0.972 1.00 0.00 C ATOM 0 H VAL A 23 -16.633 -18.472 -0.477 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.308 -17.242 1.894 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.447 -20.129 1.426 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.841 -20.646 3.388 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.488 -19.568 3.805 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.131 -18.908 3.636 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.853 -20.565 1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.183 -18.823 1.290 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.235 -19.430 -0.088 1.00 0.00 H new ATOM 303 N SER A 24 -14.191 -18.284 1.812 1.00 0.00 N ATOM 304 CA SER A 24 -12.904 -18.213 2.494 1.00 0.00 C ATOM 305 C SER A 24 -12.614 -16.790 2.961 1.00 0.00 C ATOM 306 O SER A 24 -11.952 -16.580 3.978 1.00 0.00 O ATOM 307 CB SER A 24 -11.785 -18.696 1.568 1.00 0.00 C ATOM 308 OG SER A 24 -12.307 -19.448 0.487 1.00 0.00 O ATOM 0 H SER A 24 -14.151 -18.689 0.877 1.00 0.00 H new ATOM 0 HA SER A 24 -12.948 -18.862 3.369 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.230 -17.839 1.185 1.00 0.00 H new ATOM 0 HB3 SER A 24 -11.080 -19.306 2.132 1.00 0.00 H new ATOM 0 HG SER A 24 -12.489 -18.851 -0.269 1.00 0.00 H new ATOM 314 N LYS A 25 -13.115 -15.815 2.211 1.00 0.00 N ATOM 315 CA LYS A 25 -12.913 -14.410 2.547 1.00 0.00 C ATOM 316 C LYS A 25 -14.027 -13.903 3.458 1.00 0.00 C ATOM 317 O LYS A 25 -13.833 -12.961 4.226 1.00 0.00 O ATOM 318 CB LYS A 25 -12.856 -13.563 1.274 1.00 0.00 C ATOM 319 CG LYS A 25 -11.659 -13.872 0.392 1.00 0.00 C ATOM 320 CD LYS A 25 -11.079 -12.609 -0.224 1.00 0.00 C ATOM 321 CE LYS A 25 -10.647 -12.839 -1.664 1.00 0.00 C ATOM 322 NZ LYS A 25 -10.187 -11.580 -2.313 1.00 0.00 N ATOM 0 H LYS A 25 -13.664 -15.971 1.366 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.965 -14.322 3.078 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.770 -13.721 0.701 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.831 -12.509 1.550 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.892 -14.376 0.981 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.957 -14.560 -0.399 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.821 -11.812 -0.189 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.224 -12.275 0.364 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.843 -13.575 -1.689 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.479 -13.257 -2.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.901 -11.779 -3.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.962 -10.886 -2.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.376 -11.195 -1.788 1.00 0.00 H new ATOM 336 N SER A 26 -15.193 -14.534 3.368 1.00 0.00 N ATOM 337 CA SER A 26 -16.338 -14.145 4.182 1.00 0.00 C ATOM 338 C SER A 26 -15.994 -14.205 5.667 1.00 0.00 C ATOM 339 O SER A 26 -16.390 -13.335 6.444 1.00 0.00 O ATOM 340 CB SER A 26 -17.533 -15.054 3.887 1.00 0.00 C ATOM 341 OG SER A 26 -18.086 -14.771 2.613 1.00 0.00 O ATOM 0 H SER A 26 -15.370 -15.317 2.739 1.00 0.00 H new ATOM 0 HA SER A 26 -16.600 -13.118 3.928 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.219 -16.097 3.927 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.294 -14.920 4.655 1.00 0.00 H new ATOM 0 HG SER A 26 -18.847 -15.366 2.447 1.00 0.00 H new ATOM 347 N LEU A 27 -15.254 -15.238 6.055 1.00 0.00 N ATOM 348 CA LEU A 27 -14.855 -15.413 7.447 1.00 0.00 C ATOM 349 C LEU A 27 -13.762 -14.421 7.830 1.00 0.00 C ATOM 350 O LEU A 27 -13.673 -13.992 8.980 1.00 0.00 O ATOM 351 CB LEU A 27 -14.367 -16.844 7.682 1.00 0.00 C ATOM 352 CG LEU A 27 -15.379 -17.954 7.397 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.777 -19.316 7.704 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.651 -17.736 8.203 1.00 0.00 C ATOM 0 H LEU A 27 -14.918 -15.967 5.425 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.726 -15.225 8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.488 -17.013 7.060 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.045 -16.931 8.720 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.635 -17.923 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.511 -20.094 7.495 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.896 -19.473 7.082 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.492 -19.359 8.755 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.360 -18.535 7.987 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.413 -17.739 9.267 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.093 -16.777 7.933 1.00 0.00 H new ATOM 366 N ARG A 28 -12.932 -14.059 6.857 1.00 0.00 N ATOM 367 CA ARG A 28 -11.845 -13.116 7.091 1.00 0.00 C ATOM 368 C ARG A 28 -12.374 -11.811 7.678 1.00 0.00 C ATOM 369 O ARG A 28 -11.655 -11.095 8.376 1.00 0.00 O ATOM 370 CB ARG A 28 -11.095 -12.835 5.787 1.00 0.00 C ATOM 371 CG ARG A 28 -9.592 -13.035 5.894 1.00 0.00 C ATOM 372 CD ARG A 28 -8.949 -13.167 4.522 1.00 0.00 C ATOM 373 NE ARG A 28 -7.650 -13.829 4.587 1.00 0.00 N ATOM 374 CZ ARG A 28 -6.937 -14.159 3.516 1.00 0.00 C ATOM 375 NH1 ARG A 28 -7.397 -13.888 2.302 1.00 0.00 N ATOM 376 NH2 ARG A 28 -5.763 -14.760 3.657 1.00 0.00 N ATOM 0 H ARG A 28 -12.992 -14.405 5.899 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.157 -13.564 7.808 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.485 -13.487 5.006 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.295 -11.810 5.476 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.149 -12.193 6.425 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.384 -13.929 6.482 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -9.611 -13.731 3.865 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -8.830 -12.177 4.081 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.268 -14.051 5.506 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.299 -13.426 2.190 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.849 -14.142 1.480 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.406 -14.970 4.589 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.217 -15.013 2.833 1.00 0.00 H new ATOM 390 N PHE A 29 -13.635 -11.507 7.389 1.00 0.00 N ATOM 391 CA PHE A 29 -14.260 -10.287 7.886 1.00 0.00 C ATOM 392 C PHE A 29 -14.149 -10.199 9.405 1.00 0.00 C ATOM 393 O PHE A 29 -13.805 -9.151 9.953 1.00 0.00 O ATOM 394 CB PHE A 29 -15.731 -10.235 7.467 1.00 0.00 C ATOM 395 CG PHE A 29 -16.447 -9.004 7.945 1.00 0.00 C ATOM 396 CD1 PHE A 29 -16.222 -7.777 7.341 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.346 -9.074 8.997 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.880 -6.643 7.778 1.00 0.00 C ATOM 399 CE2 PHE A 29 -18.007 -7.943 9.438 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.773 -6.726 8.828 1.00 0.00 C ATOM 0 H PHE A 29 -14.244 -12.089 6.813 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.735 -9.436 7.451 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.793 -10.282 6.380 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.242 -11.116 7.854 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.525 -7.706 6.519 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.532 -10.023 9.478 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.696 -5.693 7.299 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.706 -8.011 10.259 1.00 0.00 H new ATOM 0 HZ PHE A 29 -18.288 -5.841 9.172 1.00 0.00 H new ATOM 410 N ILE A 30 -14.443 -11.306 10.079 1.00 0.00 N ATOM 411 CA ILE A 30 -14.376 -11.354 11.534 1.00 0.00 C ATOM 412 C ILE A 30 -12.992 -11.787 12.006 1.00 0.00 C ATOM 413 O ILE A 30 -12.568 -11.450 13.111 1.00 0.00 O ATOM 414 CB ILE A 30 -15.428 -12.317 12.114 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.278 -13.707 11.492 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.830 -11.775 11.879 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.109 -14.769 12.177 1.00 0.00 C ATOM 0 H ILE A 30 -14.730 -12.181 9.641 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.581 -10.346 11.893 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.267 -12.401 13.189 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.561 -13.658 10.441 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.229 -14.000 11.526 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.562 -12.467 12.295 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -16.931 -10.805 12.365 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.003 -11.664 10.808 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -15.953 -15.728 11.683 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -15.811 -14.846 13.222 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.163 -14.499 12.120 1.00 0.00 H new ATOM 429 N GLY A 31 -12.291 -12.535 11.160 1.00 0.00 N ATOM 430 CA GLY A 31 -10.961 -13.001 11.507 1.00 0.00 C ATOM 431 C GLY A 31 -10.987 -14.301 12.286 1.00 0.00 C ATOM 432 O GLY A 31 -10.878 -14.301 13.513 1.00 0.00 O ATOM 0 H GLY A 31 -12.620 -12.827 10.240 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.378 -13.139 10.596 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.454 -12.237 12.097 1.00 0.00 H new ATOM 436 N LEU A 32 -11.133 -15.412 11.574 1.00 0.00 N ATOM 437 CA LEU A 32 -11.175 -16.726 12.206 1.00 0.00 C ATOM 438 C LEU A 32 -9.844 -17.453 12.041 1.00 0.00 C ATOM 439 O LEU A 32 -8.910 -16.928 11.435 1.00 0.00 O ATOM 440 CB LEU A 32 -12.305 -17.566 11.609 1.00 0.00 C ATOM 441 CG LEU A 32 -13.726 -17.139 11.977 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.747 -18.050 11.313 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.909 -17.141 13.488 1.00 0.00 C ATOM 0 H LEU A 32 -11.224 -15.430 10.558 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.361 -16.583 13.271 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.211 -17.546 10.523 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.166 -18.601 11.922 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.885 -16.124 11.613 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.752 -17.730 11.587 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.632 -17.997 10.230 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.590 -19.076 11.645 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.926 -16.835 13.732 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.730 -18.144 13.875 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.202 -16.446 13.941 1.00 0.00 H new ATOM 455 N SER A 33 -9.766 -18.665 12.582 1.00 0.00 N ATOM 456 CA SER A 33 -8.549 -19.463 12.496 1.00 0.00 C ATOM 457 C SER A 33 -8.329 -19.967 11.072 1.00 0.00 C ATOM 458 O SER A 33 -9.283 -20.279 10.360 1.00 0.00 O ATOM 459 CB SER A 33 -8.621 -20.647 13.462 1.00 0.00 C ATOM 460 OG SER A 33 -9.761 -20.554 14.298 1.00 0.00 O ATOM 0 H SER A 33 -10.531 -19.115 13.084 1.00 0.00 H new ATOM 0 HA SER A 33 -7.707 -18.828 12.773 1.00 0.00 H new ATOM 0 HB2 SER A 33 -8.655 -21.579 12.898 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.719 -20.677 14.073 1.00 0.00 H new ATOM 0 HG SER A 33 -9.785 -21.323 14.905 1.00 0.00 H new ATOM 466 N GLU A 34 -7.066 -20.043 10.666 1.00 0.00 N ATOM 467 CA GLU A 34 -6.721 -20.508 9.328 1.00 0.00 C ATOM 468 C GLU A 34 -7.298 -21.897 9.069 1.00 0.00 C ATOM 469 O GLU A 34 -7.611 -22.248 7.932 1.00 0.00 O ATOM 470 CB GLU A 34 -5.201 -20.534 9.149 1.00 0.00 C ATOM 471 CG GLU A 34 -4.544 -19.176 9.329 1.00 0.00 C ATOM 472 CD GLU A 34 -3.165 -19.107 8.702 1.00 0.00 C ATOM 473 OE1 GLU A 34 -3.009 -19.586 7.559 1.00 0.00 O ATOM 474 OE2 GLU A 34 -2.243 -18.575 9.354 1.00 0.00 O ATOM 0 H GLU A 34 -6.265 -19.789 11.244 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.153 -19.814 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.771 -21.234 9.865 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.967 -20.912 8.154 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.179 -18.408 8.887 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.467 -18.952 10.393 1.00 0.00 H new ATOM 481 N ASP A 35 -7.434 -22.682 10.132 1.00 0.00 N ATOM 482 CA ASP A 35 -7.974 -24.032 10.021 1.00 0.00 C ATOM 483 C ASP A 35 -9.482 -23.998 9.799 1.00 0.00 C ATOM 484 O ASP A 35 -10.038 -24.850 9.105 1.00 0.00 O ATOM 485 CB ASP A 35 -7.649 -24.839 11.279 1.00 0.00 C ATOM 486 CG ASP A 35 -6.784 -26.049 10.983 1.00 0.00 C ATOM 487 OD1 ASP A 35 -7.109 -26.792 10.034 1.00 0.00 O ATOM 488 OD2 ASP A 35 -5.783 -26.253 11.702 1.00 0.00 O ATOM 0 H ASP A 35 -7.178 -22.407 11.080 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.509 -24.513 9.160 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.138 -24.197 11.997 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.577 -25.165 11.748 1.00 0.00 H new ATOM 493 N VAL A 36 -10.141 -23.009 10.395 1.00 0.00 N ATOM 494 CA VAL A 36 -11.586 -22.863 10.263 1.00 0.00 C ATOM 495 C VAL A 36 -11.979 -22.580 8.817 1.00 0.00 C ATOM 496 O VAL A 36 -12.833 -23.263 8.251 1.00 0.00 O ATOM 497 CB VAL A 36 -12.120 -21.732 11.160 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.623 -21.577 10.987 1.00 0.00 C ATOM 499 CG2 VAL A 36 -11.768 -21.995 12.616 1.00 0.00 C ATOM 0 H VAL A 36 -9.697 -22.297 10.974 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.030 -23.807 10.579 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.645 -20.799 10.858 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -13.982 -20.773 11.629 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -13.847 -21.339 9.947 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.119 -22.508 11.260 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.153 -21.185 13.236 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.213 -22.938 12.933 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.685 -22.051 12.724 1.00 0.00 H new ATOM 509 N ILE A 37 -11.352 -21.569 8.226 1.00 0.00 N ATOM 510 CA ILE A 37 -11.635 -21.196 6.846 1.00 0.00 C ATOM 511 C ILE A 37 -11.498 -22.395 5.914 1.00 0.00 C ATOM 512 O ILE A 37 -12.401 -22.693 5.132 1.00 0.00 O ATOM 513 CB ILE A 37 -10.699 -20.074 6.362 1.00 0.00 C ATOM 514 CG1 ILE A 37 -10.832 -18.844 7.264 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.007 -19.713 4.917 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.868 -17.732 6.915 1.00 0.00 C ATOM 0 H ILE A 37 -10.644 -20.993 8.682 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.663 -20.835 6.821 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.671 -20.431 6.415 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -11.852 -18.464 7.199 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.669 -19.143 8.299 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.337 -18.918 4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.866 -20.590 4.285 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.039 -19.372 4.839 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.019 -16.893 7.595 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.845 -18.095 7.008 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.045 -17.405 5.890 1.00 0.00 H new ATOM 528 N SER A 38 -10.363 -23.080 6.003 1.00 0.00 N ATOM 529 CA SER A 38 -10.106 -24.247 5.166 1.00 0.00 C ATOM 530 C SER A 38 -11.094 -25.367 5.477 1.00 0.00 C ATOM 531 O SER A 38 -11.391 -26.203 4.624 1.00 0.00 O ATOM 532 CB SER A 38 -8.673 -24.743 5.372 1.00 0.00 C ATOM 533 OG SER A 38 -8.639 -25.850 6.256 1.00 0.00 O ATOM 0 H SER A 38 -9.606 -22.848 6.646 1.00 0.00 H new ATOM 0 HA SER A 38 -10.235 -23.952 4.125 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.241 -25.027 4.412 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.059 -23.936 5.771 1.00 0.00 H new ATOM 0 HG SER A 38 -9.042 -25.597 7.113 1.00 0.00 H new ATOM 539 N PHE A 39 -11.599 -25.377 6.706 1.00 0.00 N ATOM 540 CA PHE A 39 -12.553 -26.394 7.132 1.00 0.00 C ATOM 541 C PHE A 39 -13.851 -26.290 6.337 1.00 0.00 C ATOM 542 O PHE A 39 -14.569 -27.275 6.166 1.00 0.00 O ATOM 543 CB PHE A 39 -12.845 -26.256 8.628 1.00 0.00 C ATOM 544 CG PHE A 39 -12.461 -27.467 9.428 1.00 0.00 C ATOM 545 CD1 PHE A 39 -12.872 -28.731 9.037 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.690 -27.342 10.572 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.520 -29.848 9.771 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.334 -28.455 11.310 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.751 -29.710 10.910 1.00 0.00 C ATOM 0 H PHE A 39 -11.363 -24.692 7.424 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.110 -27.372 6.944 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.310 -25.389 9.016 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -13.909 -26.062 8.766 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.475 -28.845 8.148 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.363 -26.363 10.891 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.846 -30.828 9.454 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.730 -28.344 12.199 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.476 -30.581 11.487 1.00 0.00 H new ATOM 559 N PHE A 40 -14.147 -25.088 5.854 1.00 0.00 N ATOM 560 CA PHE A 40 -15.359 -24.852 5.078 1.00 0.00 C ATOM 561 C PHE A 40 -15.112 -25.104 3.593 1.00 0.00 C ATOM 562 O PHE A 40 -15.930 -25.723 2.912 1.00 0.00 O ATOM 563 CB PHE A 40 -15.854 -23.420 5.288 1.00 0.00 C ATOM 564 CG PHE A 40 -16.744 -23.264 6.488 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.385 -23.811 7.709 1.00 0.00 C ATOM 566 CD2 PHE A 40 -17.940 -22.570 6.395 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.202 -23.669 8.816 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.760 -22.424 7.497 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.391 -22.975 8.709 1.00 0.00 C ATOM 0 H PHE A 40 -13.564 -24.262 5.986 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.123 -25.548 5.425 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -14.994 -22.759 5.395 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.396 -23.097 4.399 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.456 -24.355 7.798 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.234 -22.138 5.450 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -16.911 -24.100 9.762 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.689 -21.880 7.411 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.031 -22.863 9.571 1.00 0.00 H new ATOM 579 N VAL A 41 -13.978 -24.619 3.097 1.00 0.00 N ATOM 580 CA VAL A 41 -13.622 -24.791 1.694 1.00 0.00 C ATOM 581 C VAL A 41 -13.356 -26.257 1.370 1.00 0.00 C ATOM 582 O VAL A 41 -13.527 -26.694 0.232 1.00 0.00 O ATOM 583 CB VAL A 41 -12.378 -23.961 1.325 1.00 0.00 C ATOM 584 CG1 VAL A 41 -12.012 -24.168 -0.137 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.614 -22.488 1.620 1.00 0.00 C ATOM 0 H VAL A 41 -13.290 -24.104 3.646 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.471 -24.441 1.107 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.542 -24.301 1.936 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.131 -23.574 -0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.798 -25.222 -0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.844 -23.857 -0.768 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.725 -21.917 1.353 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.463 -22.132 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.823 -22.359 2.682 1.00 0.00 H new ATOM 595 N THR A 42 -12.937 -27.013 2.380 1.00 0.00 N ATOM 596 CA THR A 42 -12.647 -28.431 2.203 1.00 0.00 C ATOM 597 C THR A 42 -13.924 -29.262 2.234 1.00 0.00 C ATOM 598 O THR A 42 -13.977 -30.356 1.673 1.00 0.00 O ATOM 599 CB THR A 42 -11.685 -28.947 3.290 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.252 -30.274 2.971 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.358 -28.942 4.654 1.00 0.00 C ATOM 0 H THR A 42 -12.791 -26.667 3.329 1.00 0.00 H new ATOM 0 HA THR A 42 -12.172 -28.537 1.228 1.00 0.00 H new ATOM 0 HB THR A 42 -10.822 -28.282 3.326 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.640 -30.594 3.666 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.660 -29.310 5.406 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.661 -27.926 4.907 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.237 -29.586 4.629 1.00 0.00 H new ATOM 609 N GLU A 43 -14.952 -28.735 2.893 1.00 0.00 N ATOM 610 CA GLU A 43 -16.229 -29.430 2.997 1.00 0.00 C ATOM 611 C GLU A 43 -17.197 -28.953 1.917 1.00 0.00 C ATOM 612 O GLU A 43 -18.414 -29.065 2.065 1.00 0.00 O ATOM 613 CB GLU A 43 -16.844 -29.211 4.381 1.00 0.00 C ATOM 614 CG GLU A 43 -16.387 -30.224 5.417 1.00 0.00 C ATOM 615 CD GLU A 43 -17.371 -31.363 5.593 1.00 0.00 C ATOM 616 OE1 GLU A 43 -18.576 -31.086 5.765 1.00 0.00 O ATOM 617 OE2 GLU A 43 -16.936 -32.534 5.557 1.00 0.00 O ATOM 0 H GLU A 43 -14.925 -27.830 3.362 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.046 -30.495 2.853 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.590 -28.209 4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.930 -29.254 4.298 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.419 -30.628 5.122 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.245 -29.721 6.373 1.00 0.00 H new ATOM 624 N LYS A 44 -16.647 -28.420 0.832 1.00 0.00 N ATOM 625 CA LYS A 44 -17.459 -27.926 -0.274 1.00 0.00 C ATOM 626 C LYS A 44 -18.481 -26.905 0.215 1.00 0.00 C ATOM 627 O LYS A 44 -19.537 -26.729 -0.393 1.00 0.00 O ATOM 628 CB LYS A 44 -18.175 -29.087 -0.967 1.00 0.00 C ATOM 629 CG LYS A 44 -18.494 -28.820 -2.428 1.00 0.00 C ATOM 630 CD LYS A 44 -18.910 -30.091 -3.149 1.00 0.00 C ATOM 631 CE LYS A 44 -19.178 -29.833 -4.624 1.00 0.00 C ATOM 632 NZ LYS A 44 -20.558 -30.232 -5.015 1.00 0.00 N ATOM 0 H LYS A 44 -15.641 -28.319 0.694 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.796 -27.438 -0.988 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.554 -29.980 -0.897 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.102 -29.301 -0.435 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -19.294 -28.083 -2.498 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.621 -28.391 -2.920 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -18.127 -30.842 -3.046 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -19.806 -30.499 -2.681 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -19.031 -28.775 -4.840 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -18.456 -30.385 -5.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -20.701 -30.040 -6.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -20.691 -31.247 -4.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -21.248 -29.687 -4.459 1.00 0.00 H new ATOM 646 N ILE A 45 -18.160 -26.233 1.316 1.00 0.00 N ATOM 647 CA ILE A 45 -19.049 -25.228 1.884 1.00 0.00 C ATOM 648 C ILE A 45 -18.991 -23.929 1.088 1.00 0.00 C ATOM 649 O ILE A 45 -17.928 -23.327 0.939 1.00 0.00 O ATOM 650 CB ILE A 45 -18.698 -24.932 3.354 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.560 -26.236 4.142 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.756 -24.037 3.982 1.00 0.00 C ATOM 653 CD1 ILE A 45 -19.845 -27.029 4.228 1.00 0.00 C ATOM 0 H ILE A 45 -17.290 -26.367 1.832 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.058 -25.636 1.835 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.742 -24.409 3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.792 -26.853 3.676 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.216 -26.007 5.151 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.493 -23.837 5.021 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.809 -23.096 3.434 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.725 -24.535 3.942 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.673 -27.940 4.801 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.610 -26.430 4.722 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.180 -27.289 3.224 1.00 0.00 H new ATOM 665 N ASP A 46 -20.142 -23.503 0.578 1.00 0.00 N ATOM 666 CA ASP A 46 -20.223 -22.273 -0.202 1.00 0.00 C ATOM 667 C ASP A 46 -21.154 -21.266 0.467 1.00 0.00 C ATOM 668 O ASP A 46 -21.581 -21.461 1.604 1.00 0.00 O ATOM 669 CB ASP A 46 -20.712 -22.574 -1.620 1.00 0.00 C ATOM 670 CG ASP A 46 -22.144 -23.070 -1.645 1.00 0.00 C ATOM 671 OD1 ASP A 46 -22.350 -24.296 -1.517 1.00 0.00 O ATOM 672 OD2 ASP A 46 -23.059 -22.234 -1.793 1.00 0.00 O ATOM 0 H ASP A 46 -21.031 -23.991 0.691 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.225 -21.839 -0.255 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.632 -21.673 -2.228 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.063 -23.323 -2.074 1.00 0.00 H new ATOM 677 N GLY A 47 -21.464 -20.189 -0.248 1.00 0.00 N ATOM 678 CA GLY A 47 -22.341 -19.167 0.293 1.00 0.00 C ATOM 679 C GLY A 47 -23.711 -19.709 0.651 1.00 0.00 C ATOM 680 O GLY A 47 -24.139 -19.620 1.801 1.00 0.00 O ATOM 0 H GLY A 47 -21.124 -20.006 -1.192 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.882 -18.732 1.181 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.450 -18.364 -0.435 1.00 0.00 H new ATOM 684 N ASN A 48 -24.400 -20.270 -0.337 1.00 0.00 N ATOM 685 CA ASN A 48 -25.730 -20.827 -0.120 1.00 0.00 C ATOM 686 C ASN A 48 -25.709 -21.870 0.993 1.00 0.00 C ATOM 687 O ASN A 48 -26.712 -22.086 1.676 1.00 0.00 O ATOM 688 CB ASN A 48 -26.260 -21.453 -1.412 1.00 0.00 C ATOM 689 CG ASN A 48 -27.694 -21.053 -1.702 1.00 0.00 C ATOM 690 OD1 ASN A 48 -27.964 -20.308 -2.644 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.622 -21.549 -0.891 1.00 0.00 N ATOM 0 H ASN A 48 -24.060 -20.351 -1.295 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.392 -20.015 0.181 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.626 -21.151 -2.246 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -26.196 -22.539 -1.339 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.604 -21.316 -1.037 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -28.352 -22.163 -0.122 1.00 0.00 H new ATOM 698 N LEU A 49 -24.561 -22.515 1.170 1.00 0.00 N ATOM 699 CA LEU A 49 -24.409 -23.536 2.201 1.00 0.00 C ATOM 700 C LEU A 49 -24.270 -22.900 3.580 1.00 0.00 C ATOM 701 O LEU A 49 -24.914 -23.327 4.540 1.00 0.00 O ATOM 702 CB LEU A 49 -23.188 -24.409 1.904 1.00 0.00 C ATOM 703 CG LEU A 49 -23.267 -25.858 2.385 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.376 -25.912 3.901 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.446 -26.572 1.739 1.00 0.00 C ATOM 0 H LEU A 49 -23.722 -22.349 0.613 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.304 -24.159 2.197 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.023 -24.413 0.827 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.314 -23.943 2.359 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.351 -26.369 2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.431 -26.951 4.225 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.500 -25.439 4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.275 -25.384 4.220 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.486 -27.602 2.093 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.371 -26.061 2.005 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.326 -26.565 0.656 1.00 0.00 H new ATOM 717 N LEU A 50 -23.427 -21.877 3.673 1.00 0.00 N ATOM 718 CA LEU A 50 -23.206 -21.180 4.935 1.00 0.00 C ATOM 719 C LEU A 50 -24.519 -20.656 5.506 1.00 0.00 C ATOM 720 O LEU A 50 -24.837 -20.885 6.673 1.00 0.00 O ATOM 721 CB LEU A 50 -22.225 -20.024 4.736 1.00 0.00 C ATOM 722 CG LEU A 50 -21.998 -19.120 5.949 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.614 -19.947 7.166 1.00 0.00 C ATOM 724 CD2 LEU A 50 -20.927 -18.082 5.647 1.00 0.00 C ATOM 0 H LEU A 50 -22.885 -21.512 2.889 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.782 -21.891 5.644 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.264 -20.438 4.431 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.583 -19.408 3.911 1.00 0.00 H new ATOM 0 HG LEU A 50 -22.929 -18.598 6.169 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.456 -19.287 8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.414 -20.651 7.395 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.696 -20.496 6.958 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.779 -17.448 6.521 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -19.992 -18.585 5.401 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.242 -17.469 4.803 1.00 0.00 H new ATOM 736 N VAL A 51 -25.281 -19.952 4.674 1.00 0.00 N ATOM 737 CA VAL A 51 -26.562 -19.397 5.094 1.00 0.00 C ATOM 738 C VAL A 51 -27.517 -20.498 5.541 1.00 0.00 C ATOM 739 O VAL A 51 -28.415 -20.263 6.349 1.00 0.00 O ATOM 740 CB VAL A 51 -27.222 -18.588 3.962 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.429 -17.322 3.678 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.353 -19.438 2.707 1.00 0.00 C ATOM 0 H VAL A 51 -25.033 -19.753 3.705 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.359 -18.732 5.934 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.222 -18.297 4.282 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.911 -16.763 2.875 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.392 -16.707 4.577 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.415 -17.587 3.378 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.821 -18.851 1.917 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.364 -19.761 2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -27.968 -20.312 2.922 1.00 0.00 H new ATOM 752 N GLN A 52 -27.315 -21.700 5.011 1.00 0.00 N ATOM 753 CA GLN A 52 -28.160 -22.838 5.356 1.00 0.00 C ATOM 754 C GLN A 52 -27.710 -23.471 6.669 1.00 0.00 C ATOM 755 O GLN A 52 -28.521 -24.025 7.412 1.00 0.00 O ATOM 756 CB GLN A 52 -28.129 -23.880 4.237 1.00 0.00 C ATOM 757 CG GLN A 52 -29.159 -23.632 3.146 1.00 0.00 C ATOM 758 CD GLN A 52 -29.351 -24.832 2.241 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.466 -25.327 2.073 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.261 -25.308 1.650 1.00 0.00 N ATOM 0 H GLN A 52 -26.575 -21.911 4.342 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.181 -22.477 5.479 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.135 -23.892 3.791 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.298 -24.868 4.667 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.113 -23.371 3.605 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -28.849 -22.776 2.547 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.356 -24.867 1.817 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.328 -26.114 1.029 1.00 0.00 H new ATOM 769 N LEU A 53 -26.414 -23.385 6.948 1.00 0.00 N ATOM 770 CA LEU A 53 -25.857 -23.950 8.172 1.00 0.00 C ATOM 771 C LEU A 53 -26.502 -23.325 9.404 1.00 0.00 C ATOM 772 O LEU A 53 -26.791 -22.128 9.428 1.00 0.00 O ATOM 773 CB LEU A 53 -24.342 -23.737 8.211 1.00 0.00 C ATOM 774 CG LEU A 53 -23.505 -24.710 7.381 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.061 -24.239 7.302 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.580 -26.112 7.966 1.00 0.00 C ATOM 0 H LEU A 53 -25.730 -22.930 6.344 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.068 -25.019 8.178 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.129 -22.724 7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.013 -23.800 9.248 1.00 0.00 H new ATOM 0 HG LEU A 53 -23.912 -24.738 6.370 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.480 -24.944 6.707 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.024 -23.255 6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.642 -24.180 8.307 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -22.978 -26.791 7.362 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.200 -26.101 8.987 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.616 -26.450 7.968 1.00 0.00 H new ATOM 788 N THR A 54 -26.724 -24.142 10.429 1.00 0.00 N ATOM 789 CA THR A 54 -27.335 -23.669 11.665 1.00 0.00 C ATOM 790 C THR A 54 -26.457 -23.991 12.869 1.00 0.00 C ATOM 791 O THR A 54 -25.499 -24.756 12.764 1.00 0.00 O ATOM 792 CB THR A 54 -28.727 -24.291 11.878 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.632 -25.720 11.871 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.694 -23.838 10.795 1.00 0.00 C ATOM 0 H THR A 54 -26.490 -25.135 10.427 1.00 0.00 H new ATOM 0 HA THR A 54 -27.440 -22.588 11.573 1.00 0.00 H new ATOM 0 HB THR A 54 -29.105 -23.957 12.844 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.521 -26.108 12.009 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.671 -24.291 10.967 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.787 -22.752 10.822 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.318 -24.146 9.819 1.00 0.00 H new ATOM 802 N GLU A 55 -26.791 -23.402 14.014 1.00 0.00 N ATOM 803 CA GLU A 55 -26.032 -23.627 15.238 1.00 0.00 C ATOM 804 C GLU A 55 -26.098 -25.093 15.657 1.00 0.00 C ATOM 805 O GLU A 55 -25.137 -25.638 16.199 1.00 0.00 O ATOM 806 CB GLU A 55 -26.564 -22.739 16.365 1.00 0.00 C ATOM 807 CG GLU A 55 -25.509 -22.361 17.391 1.00 0.00 C ATOM 808 CD GLU A 55 -26.060 -21.483 18.498 1.00 0.00 C ATOM 809 OE1 GLU A 55 -26.609 -22.035 19.474 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.942 -20.245 18.388 1.00 0.00 O ATOM 0 H GLU A 55 -27.582 -22.766 14.119 1.00 0.00 H new ATOM 0 HA GLU A 55 -24.991 -23.369 15.042 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -26.981 -21.829 15.933 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.380 -23.256 16.869 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -25.090 -23.268 17.826 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.692 -21.840 16.892 1.00 0.00 H new ATOM 817 N GLU A 56 -27.239 -25.725 15.402 1.00 0.00 N ATOM 818 CA GLU A 56 -27.431 -27.127 15.754 1.00 0.00 C ATOM 819 C GLU A 56 -26.498 -28.023 14.945 1.00 0.00 C ATOM 820 O GLU A 56 -25.847 -28.914 15.492 1.00 0.00 O ATOM 821 CB GLU A 56 -28.885 -27.541 15.518 1.00 0.00 C ATOM 822 CG GLU A 56 -29.881 -26.787 16.384 1.00 0.00 C ATOM 823 CD GLU A 56 -31.045 -26.233 15.586 1.00 0.00 C ATOM 824 OE1 GLU A 56 -31.437 -26.872 14.587 1.00 0.00 O ATOM 825 OE2 GLU A 56 -31.563 -25.160 15.960 1.00 0.00 O ATOM 0 H GLU A 56 -28.044 -25.289 14.953 1.00 0.00 H new ATOM 0 HA GLU A 56 -27.195 -27.245 16.811 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -29.134 -27.381 14.469 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.985 -28.609 15.710 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -30.261 -27.453 17.159 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -29.370 -25.968 16.890 1.00 0.00 H new ATOM 832 N ILE A 57 -26.438 -27.781 13.640 1.00 0.00 N ATOM 833 CA ILE A 57 -25.585 -28.566 12.756 1.00 0.00 C ATOM 834 C ILE A 57 -24.117 -28.200 12.943 1.00 0.00 C ATOM 835 O ILE A 57 -23.232 -29.044 12.794 1.00 0.00 O ATOM 836 CB ILE A 57 -25.969 -28.363 11.278 1.00 0.00 C ATOM 837 CG1 ILE A 57 -27.432 -28.749 11.051 1.00 0.00 C ATOM 838 CG2 ILE A 57 -25.054 -29.180 10.377 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.987 -28.261 9.731 1.00 0.00 C ATOM 0 H ILE A 57 -26.970 -27.048 13.171 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.733 -29.613 13.021 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.848 -27.309 11.027 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.524 -29.834 11.096 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -28.037 -28.344 11.862 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -25.337 -29.027 9.336 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -24.022 -28.862 10.523 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -25.147 -30.237 10.626 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -29.028 -28.571 9.637 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.927 -27.173 9.691 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.407 -28.687 8.913 1.00 0.00 H new ATOM 851 N LEU A 58 -23.864 -26.939 13.272 1.00 0.00 N ATOM 852 CA LEU A 58 -22.502 -26.461 13.482 1.00 0.00 C ATOM 853 C LEU A 58 -21.885 -27.101 14.721 1.00 0.00 C ATOM 854 O LEU A 58 -20.666 -27.244 14.817 1.00 0.00 O ATOM 855 CB LEU A 58 -22.490 -24.937 13.622 1.00 0.00 C ATOM 856 CG LEU A 58 -22.526 -24.143 12.316 1.00 0.00 C ATOM 857 CD1 LEU A 58 -23.155 -22.776 12.540 1.00 0.00 C ATOM 858 CD2 LEU A 58 -21.125 -24.000 11.741 1.00 0.00 C ATOM 0 H LEU A 58 -24.584 -26.228 13.399 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.907 -26.745 12.614 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.347 -24.641 14.228 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.595 -24.650 14.174 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.138 -24.688 11.598 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.172 -22.225 11.600 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -24.174 -22.900 12.907 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.570 -22.222 13.274 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.169 -23.432 10.812 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.490 -23.477 12.456 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.710 -24.988 11.543 1.00 0.00 H new ATOM 870 N SER A 59 -22.735 -27.488 15.667 1.00 0.00 N ATOM 871 CA SER A 59 -22.274 -28.112 16.901 1.00 0.00 C ATOM 872 C SER A 59 -22.415 -29.629 16.828 1.00 0.00 C ATOM 873 O SER A 59 -21.683 -30.364 17.491 1.00 0.00 O ATOM 874 CB SER A 59 -23.061 -27.572 18.096 1.00 0.00 C ATOM 875 OG SER A 59 -22.299 -27.654 19.288 1.00 0.00 O ATOM 0 H SER A 59 -23.747 -27.380 15.602 1.00 0.00 H new ATOM 0 HA SER A 59 -21.219 -27.868 17.030 1.00 0.00 H new ATOM 0 HB2 SER A 59 -23.343 -26.535 17.911 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.985 -28.138 18.212 1.00 0.00 H new ATOM 0 HG SER A 59 -22.824 -27.301 20.037 1.00 0.00 H new ATOM 881 N GLU A 60 -23.363 -30.091 16.018 1.00 0.00 N ATOM 882 CA GLU A 60 -23.602 -31.520 15.859 1.00 0.00 C ATOM 883 C GLU A 60 -22.616 -32.129 14.866 1.00 0.00 C ATOM 884 O GLU A 60 -21.815 -32.994 15.221 1.00 0.00 O ATOM 885 CB GLU A 60 -25.037 -31.771 15.390 1.00 0.00 C ATOM 886 CG GLU A 60 -26.067 -31.666 16.501 1.00 0.00 C ATOM 887 CD GLU A 60 -26.531 -33.021 16.998 1.00 0.00 C ATOM 888 OE1 GLU A 60 -27.015 -33.822 16.170 1.00 0.00 O ATOM 889 OE2 GLU A 60 -26.412 -33.282 18.213 1.00 0.00 O ATOM 0 H GLU A 60 -23.977 -29.496 15.462 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.456 -31.997 16.828 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.285 -31.054 14.607 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -25.096 -32.764 14.944 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.642 -31.104 17.333 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.927 -31.101 16.141 1.00 0.00 H new ATOM 896 N ASP A 61 -22.683 -31.672 13.620 1.00 0.00 N ATOM 897 CA ASP A 61 -21.797 -32.171 12.575 1.00 0.00 C ATOM 898 C ASP A 61 -20.402 -31.567 12.710 1.00 0.00 C ATOM 899 O ASP A 61 -19.446 -32.259 13.059 1.00 0.00 O ATOM 900 CB ASP A 61 -22.372 -31.852 11.194 1.00 0.00 C ATOM 901 CG ASP A 61 -23.293 -32.943 10.684 1.00 0.00 C ATOM 902 OD1 ASP A 61 -23.630 -33.850 11.473 1.00 0.00 O ATOM 903 OD2 ASP A 61 -23.676 -32.890 9.497 1.00 0.00 O ATOM 0 H ASP A 61 -23.341 -30.957 13.310 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.718 -33.252 12.687 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.920 -30.911 11.240 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -21.554 -31.711 10.487 1.00 0.00 H new ATOM 908 N PHE A 62 -20.294 -30.272 12.432 1.00 0.00 N ATOM 909 CA PHE A 62 -19.017 -29.575 12.521 1.00 0.00 C ATOM 910 C PHE A 62 -18.372 -29.792 13.887 1.00 0.00 C ATOM 911 O PHE A 62 -17.170 -30.040 13.987 1.00 0.00 O ATOM 912 CB PHE A 62 -19.209 -28.078 12.268 1.00 0.00 C ATOM 913 CG PHE A 62 -19.124 -27.700 10.817 1.00 0.00 C ATOM 914 CD1 PHE A 62 -17.895 -27.500 10.210 1.00 0.00 C ATOM 915 CD2 PHE A 62 -20.274 -27.544 10.059 1.00 0.00 C ATOM 916 CE1 PHE A 62 -17.814 -27.151 8.875 1.00 0.00 C ATOM 917 CE2 PHE A 62 -20.199 -27.195 8.724 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.968 -27.000 8.131 1.00 0.00 C ATOM 0 H PHE A 62 -21.076 -29.684 12.143 1.00 0.00 H new ATOM 0 HA PHE A 62 -18.356 -29.984 11.757 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -20.180 -27.773 12.658 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -18.453 -27.524 12.825 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -16.989 -27.618 10.787 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -21.240 -27.697 10.517 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -16.850 -26.997 8.414 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -21.103 -27.075 8.145 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.907 -26.730 7.087 1.00 0.00 H new ATOM 928 N LYS A 63 -19.180 -29.697 14.937 1.00 0.00 N ATOM 929 CA LYS A 63 -18.692 -29.883 16.298 1.00 0.00 C ATOM 930 C LYS A 63 -17.620 -28.852 16.638 1.00 0.00 C ATOM 931 O LYS A 63 -16.758 -29.093 17.484 1.00 0.00 O ATOM 932 CB LYS A 63 -18.128 -31.296 16.471 1.00 0.00 C ATOM 933 CG LYS A 63 -18.755 -32.064 17.621 1.00 0.00 C ATOM 934 CD LYS A 63 -19.062 -33.500 17.231 1.00 0.00 C ATOM 935 CE LYS A 63 -18.721 -34.468 18.354 1.00 0.00 C ATOM 936 NZ LYS A 63 -19.040 -35.876 17.989 1.00 0.00 N ATOM 0 H LYS A 63 -20.177 -29.492 14.871 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.532 -29.747 16.980 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -18.279 -31.854 15.547 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -17.052 -31.232 16.632 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -18.080 -32.055 18.477 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.673 -31.567 17.934 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.118 -33.592 16.979 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -18.497 -33.764 16.337 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -17.661 -34.386 18.594 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -19.274 -34.192 19.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.793 -36.504 18.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.056 -35.960 17.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.494 -36.149 17.147 1.00 0.00 H new ATOM 950 N LEU A 64 -17.680 -27.703 15.974 1.00 0.00 N ATOM 951 CA LEU A 64 -16.716 -26.633 16.207 1.00 0.00 C ATOM 952 C LEU A 64 -16.759 -26.167 17.659 1.00 0.00 C ATOM 953 O LEU A 64 -17.559 -26.659 18.455 1.00 0.00 O ATOM 954 CB LEU A 64 -16.995 -25.455 15.272 1.00 0.00 C ATOM 955 CG LEU A 64 -16.714 -25.695 13.788 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.768 -25.015 12.929 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.323 -25.198 13.422 1.00 0.00 C ATOM 0 H LEU A 64 -18.386 -27.488 15.270 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.720 -27.024 16.000 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -18.041 -25.170 15.382 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.397 -24.606 15.602 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.757 -26.767 13.598 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.552 -25.197 11.876 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.751 -25.418 13.172 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.758 -23.942 13.122 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -15.140 -25.377 12.362 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -15.253 -24.130 13.627 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.579 -25.731 14.014 1.00 0.00 H new ATOM 969 N SER A 65 -15.896 -25.214 17.995 1.00 0.00 N ATOM 970 CA SER A 65 -15.835 -24.681 19.351 1.00 0.00 C ATOM 971 C SER A 65 -17.028 -23.773 19.633 1.00 0.00 C ATOM 972 O SER A 65 -17.768 -23.399 18.722 1.00 0.00 O ATOM 973 CB SER A 65 -14.531 -23.909 19.560 1.00 0.00 C ATOM 974 OG SER A 65 -14.177 -23.869 20.932 1.00 0.00 O ATOM 0 H SER A 65 -15.229 -24.795 17.347 1.00 0.00 H new ATOM 0 HA SER A 65 -15.868 -25.520 20.046 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.731 -24.379 18.988 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.641 -22.893 19.180 1.00 0.00 H new ATOM 0 HG SER A 65 -13.339 -23.372 21.039 1.00 0.00 H new ATOM 980 N LYS A 66 -17.210 -23.421 20.901 1.00 0.00 N ATOM 981 CA LYS A 66 -18.311 -22.556 21.305 1.00 0.00 C ATOM 982 C LYS A 66 -18.145 -21.156 20.723 1.00 0.00 C ATOM 983 O LYS A 66 -19.123 -20.510 20.344 1.00 0.00 O ATOM 984 CB LYS A 66 -18.393 -22.479 22.831 1.00 0.00 C ATOM 985 CG LYS A 66 -17.118 -21.973 23.484 1.00 0.00 C ATOM 986 CD LYS A 66 -17.240 -21.945 24.998 1.00 0.00 C ATOM 987 CE LYS A 66 -15.874 -21.958 25.668 1.00 0.00 C ATOM 988 NZ LYS A 66 -15.253 -23.311 25.636 1.00 0.00 N ATOM 0 H LYS A 66 -16.608 -23.722 21.667 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.236 -22.984 20.919 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.219 -21.824 23.110 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.625 -23.469 23.224 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.283 -22.612 23.197 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -16.893 -20.971 23.118 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -17.788 -21.053 25.303 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -17.819 -22.805 25.333 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.218 -21.245 25.168 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -15.974 -21.629 26.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -14.409 -23.320 26.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -15.936 -24.015 25.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -14.979 -23.544 24.660 1.00 0.00 H new ATOM 1002 N LEU A 67 -16.902 -20.693 20.654 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.607 -19.369 20.116 1.00 0.00 C ATOM 1004 C LEU A 67 -16.862 -19.323 18.613 1.00 0.00 C ATOM 1005 O LEU A 67 -17.408 -18.349 18.096 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.155 -18.988 20.411 1.00 0.00 C ATOM 1007 CG LEU A 67 -14.950 -17.739 21.269 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.529 -16.515 20.577 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -15.579 -17.926 22.642 1.00 0.00 C ATOM 0 H LEU A 67 -16.082 -21.214 20.964 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.269 -18.651 20.600 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.674 -19.830 20.909 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.639 -18.841 19.462 1.00 0.00 H new ATOM 0 HG LEU A 67 -13.879 -17.584 21.400 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.374 -15.636 21.202 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.032 -16.370 19.618 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -16.597 -16.660 20.414 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.423 -17.027 23.239 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.648 -18.107 22.531 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.117 -18.778 23.141 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.463 -20.383 17.918 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.650 -20.464 16.474 1.00 0.00 C ATOM 1023 C GLN A 68 -18.131 -20.538 16.120 1.00 0.00 C ATOM 1024 O GLN A 68 -18.632 -19.738 15.330 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.917 -21.683 15.911 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.436 -21.445 15.669 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.573 -22.597 16.146 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.172 -22.647 17.308 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -13.284 -23.531 15.247 1.00 0.00 N ATOM 0 H GLN A 68 -16.008 -21.197 18.331 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.234 -19.561 16.028 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -16.034 -22.518 16.602 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.387 -21.978 14.973 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.267 -21.286 14.604 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -14.131 -20.532 16.180 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -13.638 -23.449 14.294 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -12.708 -24.331 15.510 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.828 -21.504 16.709 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.253 -21.682 16.456 1.00 0.00 C ATOM 1040 C VAL A 69 -21.016 -20.380 16.668 1.00 0.00 C ATOM 1041 O VAL A 69 -22.024 -20.123 16.010 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.853 -22.770 17.367 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.342 -22.928 17.101 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -20.124 -24.091 17.171 1.00 0.00 C ATOM 0 H VAL A 69 -18.429 -22.176 17.365 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.353 -21.993 15.416 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.725 -22.462 18.405 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.748 -23.701 17.754 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.849 -21.983 17.298 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.497 -23.213 16.061 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.561 -24.848 17.822 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.218 -24.408 16.132 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -19.070 -23.965 17.418 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.528 -19.558 17.592 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.162 -18.280 17.891 1.00 0.00 C ATOM 1056 C LYS A 70 -20.819 -17.241 16.828 1.00 0.00 C ATOM 1057 O LYS A 70 -21.707 -16.625 16.237 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.722 -17.779 19.269 1.00 0.00 C ATOM 1059 CG LYS A 70 -21.685 -16.781 19.889 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.055 -16.057 21.067 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.021 -15.060 21.689 1.00 0.00 C ATOM 1062 NZ LYS A 70 -21.324 -14.102 22.591 1.00 0.00 N ATOM 0 H LYS A 70 -19.695 -19.755 18.147 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.242 -18.430 17.893 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.614 -18.632 19.939 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -19.739 -17.316 19.181 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -21.992 -16.055 19.137 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.586 -17.299 20.218 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.746 -16.783 21.819 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -20.156 -15.537 20.737 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.533 -14.509 20.900 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -22.786 -15.597 22.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -22.016 -13.439 22.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -20.857 -14.625 23.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -20.612 -13.571 22.050 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.526 -17.051 16.588 1.00 0.00 N ATOM 1077 CA LYS A 71 -19.065 -16.088 15.595 1.00 0.00 C ATOM 1078 C LYS A 71 -19.708 -16.357 14.238 1.00 0.00 C ATOM 1079 O LYS A 71 -20.224 -15.444 13.593 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.541 -16.145 15.469 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.857 -14.821 15.763 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.394 -15.017 16.125 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.162 -14.841 17.618 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.087 -13.405 18.003 1.00 0.00 N ATOM 0 H LYS A 71 -18.778 -17.552 17.068 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.359 -15.092 15.926 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.156 -16.903 16.152 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.280 -16.463 14.460 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.933 -14.170 14.892 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.371 -14.319 16.582 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.073 -16.013 15.821 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.783 -14.303 15.574 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -15.969 -15.323 18.170 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.237 -15.342 17.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -14.928 -13.328 19.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.301 -12.950 17.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -15.979 -12.932 17.755 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.673 -17.615 13.810 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.255 -18.003 12.532 1.00 0.00 C ATOM 1100 C ILE A 72 -21.737 -17.650 12.472 1.00 0.00 C ATOM 1101 O ILE A 72 -22.189 -16.981 11.544 1.00 0.00 O ATOM 1102 CB ILE A 72 -20.087 -19.512 12.272 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.605 -19.894 12.293 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.718 -19.894 10.941 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.366 -21.376 12.478 1.00 0.00 C ATOM 0 H ILE A 72 -19.248 -18.382 14.330 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.721 -17.448 11.761 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.596 -20.060 13.065 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -18.142 -19.573 11.360 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -18.109 -19.351 13.098 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.591 -20.963 10.772 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.781 -19.653 10.960 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.235 -19.339 10.137 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.294 -21.574 12.483 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.799 -21.699 13.425 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.832 -21.925 11.660 1.00 0.00 H new ATOM 1117 N MET A 73 -22.488 -18.104 13.470 1.00 0.00 N ATOM 1118 CA MET A 73 -23.920 -17.833 13.532 1.00 0.00 C ATOM 1119 C MET A 73 -24.197 -16.340 13.392 1.00 0.00 C ATOM 1120 O MET A 73 -24.990 -15.924 12.547 1.00 0.00 O ATOM 1121 CB MET A 73 -24.501 -18.350 14.850 1.00 0.00 C ATOM 1122 CG MET A 73 -25.336 -19.610 14.693 1.00 0.00 C ATOM 1123 SD MET A 73 -27.038 -19.261 14.213 1.00 0.00 S ATOM 1124 CE MET A 73 -26.880 -19.197 12.430 1.00 0.00 C ATOM 0 H MET A 73 -22.130 -18.661 14.246 1.00 0.00 H new ATOM 0 HA MET A 73 -24.400 -18.353 12.703 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.685 -18.549 15.544 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.116 -17.569 15.297 1.00 0.00 H new ATOM 0 HG2 MET A 73 -24.876 -20.255 13.944 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.334 -20.162 15.633 1.00 0.00 H new ATOM 0 HE1 MET A 73 -27.858 -19.345 11.973 1.00 0.00 H new ATOM 0 HE2 MET A 73 -26.484 -18.225 12.134 1.00 0.00 H new ATOM 0 HE3 MET A 73 -26.201 -19.982 12.096 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.540 -15.539 14.224 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.718 -14.092 14.192 1.00 0.00 C ATOM 1136 C GLN A 74 -23.414 -13.537 12.804 1.00 0.00 C ATOM 1137 O GLN A 74 -24.013 -12.551 12.374 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.816 -13.423 15.230 1.00 0.00 C ATOM 1139 CG GLN A 74 -23.420 -13.381 16.624 1.00 0.00 C ATOM 1140 CD GLN A 74 -23.383 -11.993 17.234 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -24.374 -11.523 17.795 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -22.238 -11.330 17.129 1.00 0.00 N ATOM 0 H GLN A 74 -22.880 -15.867 14.929 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.759 -13.874 14.431 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -21.866 -13.956 15.271 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.597 -12.405 14.907 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -24.453 -13.727 16.579 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -22.880 -14.073 17.271 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -21.442 -11.758 16.656 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -22.154 -10.392 17.522 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.481 -14.177 12.108 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.097 -13.747 10.768 1.00 0.00 C ATOM 1153 C PHE A 75 -23.207 -14.041 9.763 1.00 0.00 C ATOM 1154 O PHE A 75 -23.500 -13.224 8.889 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.805 -14.443 10.337 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.274 -13.958 9.018 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.691 -12.706 8.909 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.358 -14.755 7.887 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.202 -12.256 7.697 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -19.869 -14.311 6.673 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.292 -13.060 6.577 1.00 0.00 C ATOM 0 H PHE A 75 -21.977 -14.995 12.449 1.00 0.00 H new ATOM 0 HA PHE A 75 -21.930 -12.670 10.793 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -20.046 -14.289 11.104 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.983 -15.517 10.275 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.618 -12.074 9.782 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.810 -15.733 7.955 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.750 -11.278 7.626 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -19.938 -14.942 5.799 1.00 0.00 H new ATOM 0 HZ PHE A 75 -18.912 -12.711 5.628 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.819 -15.213 9.894 1.00 0.00 N ATOM 1172 CA ILE A 76 -24.897 -15.615 8.998 1.00 0.00 C ATOM 1173 C ILE A 76 -26.108 -14.701 9.150 1.00 0.00 C ATOM 1174 O ILE A 76 -26.691 -14.257 8.162 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.330 -17.070 9.257 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.142 -18.018 9.081 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.467 -17.458 8.323 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.405 -19.417 9.592 1.00 0.00 C ATOM 0 H ILE A 76 -23.587 -15.900 10.611 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.510 -15.535 7.982 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.686 -17.150 10.284 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -23.882 -18.069 8.024 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.278 -17.606 9.602 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.762 -18.489 8.518 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.318 -16.799 8.492 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.136 -17.365 7.289 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.520 -20.034 9.435 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.636 -19.378 10.657 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.249 -19.848 9.053 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.480 -14.422 10.395 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.621 -13.559 10.677 1.00 0.00 C ATOM 1192 C ASN A 77 -27.320 -12.115 10.290 1.00 0.00 C ATOM 1193 O ASN A 77 -28.113 -11.465 9.611 1.00 0.00 O ATOM 1194 CB ASN A 77 -27.991 -13.635 12.160 1.00 0.00 C ATOM 1195 CG ASN A 77 -28.909 -14.802 12.468 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.128 -14.646 12.536 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -28.325 -15.980 12.656 1.00 0.00 N ATOM 0 H ASN A 77 -26.008 -14.781 11.225 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.464 -13.908 10.081 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.082 -13.725 12.754 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -28.476 -12.706 12.459 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -28.891 -16.802 12.866 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -27.310 -16.063 12.590 1.00 0.00 H new