USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 954 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 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 1.17 K(o=1.2,f=-0.2) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0.621 K(o=0.62,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN :FLIP amide:sc= -0.686 F(o=-3!,f=-0.69) USER MOD Single : A 56 ASN : amide:sc= 0.735 K(o=0.74,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -71:sc= 0.486 USER MOD Single : A 68 MET CE :methyl 172:sc= 0 (180deg=-0.0728) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 71:sc= 0.433 USER MOD Single : A 79 CYS SG : rot -25:sc= 0.31 USER MOD Single : A 80 GLN : amide:sc= 0.532 K(o=0.53,f=-0.069) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 155:sc= 1.19 USER MOD Single : A 88 MET CE :methyl 169:sc= -1.65 (180deg=-2.15) USER MOD Single : A 90 LYS NZ :NH3+ 179:sc= 1.01 (180deg=1.01) USER MOD Single : A 91 HIS : no HE2:sc= -1.62 K(o=-1.6,f=-2.7) USER MOD Single : A 104 SER OG : rot 53:sc= 0.354 USER MOD Single : A 106 HIS : no HD1:sc=-0.00972 X(o=-0.0097,f=-0.0097) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0605 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HE2:sc= -0.48 K(o=-0.48,f=-1.1) USER MOD Single : A 134 HIS : no HD1:sc= -0.378 X(o=-0.38,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 122 N GLY A 10 7.780 28.978 26.152 1.00 0.00 N ATOM 123 CA GLY A 10 6.651 28.775 25.264 1.00 0.00 C ATOM 124 C GLY A 10 6.502 29.992 24.360 1.00 0.00 C ATOM 125 O GLY A 10 5.976 31.016 24.794 1.00 0.00 O ATOM 0 HA2 GLY A 10 6.801 27.877 24.664 1.00 0.00 H new ATOM 0 HA3 GLY A 10 5.740 28.623 25.843 1.00 0.00 H new ATOM 129 N VAL A 11 7.021 29.937 23.132 1.00 0.00 N ATOM 130 CA VAL A 11 6.928 31.034 22.172 1.00 0.00 C ATOM 131 C VAL A 11 7.014 30.468 20.746 1.00 0.00 C ATOM 132 O VAL A 11 7.592 29.397 20.530 1.00 0.00 O ATOM 133 CB VAL A 11 8.009 32.094 22.509 1.00 0.00 C ATOM 134 CG1 VAL A 11 9.445 31.630 22.214 1.00 0.00 C ATOM 135 CG2 VAL A 11 7.745 33.444 21.827 1.00 0.00 C ATOM 0 H VAL A 11 7.521 29.123 22.775 1.00 0.00 H new ATOM 0 HA VAL A 11 5.968 31.546 22.235 1.00 0.00 H new ATOM 0 HB VAL A 11 7.927 32.228 23.588 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.145 32.424 22.475 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.669 30.741 22.804 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.541 31.396 21.154 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.532 34.148 22.097 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.734 33.309 20.745 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.781 33.834 22.153 1.00 0.00 H new ATOM 145 N SER A 12 6.507 31.209 19.761 1.00 0.00 N ATOM 146 CA SER A 12 6.492 30.867 18.344 1.00 0.00 C ATOM 147 C SER A 12 7.373 31.830 17.553 1.00 0.00 C ATOM 148 O SER A 12 7.149 31.992 16.358 1.00 0.00 O ATOM 149 CB SER A 12 5.034 30.801 17.857 1.00 0.00 C ATOM 150 OG SER A 12 4.330 32.016 18.087 1.00 0.00 O ATOM 0 H SER A 12 6.072 32.114 19.943 1.00 0.00 H new ATOM 0 HA SER A 12 6.924 29.880 18.179 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.020 30.572 16.791 1.00 0.00 H new ATOM 0 HB3 SER A 12 4.521 29.985 18.365 1.00 0.00 H new ATOM 0 HG SER A 12 3.410 31.928 17.761 1.00 0.00 H new ATOM 156 N GLN A 13 8.343 32.494 18.198 1.00 0.00 N ATOM 157 CA GLN A 13 9.228 33.422 17.510 1.00 0.00 C ATOM 158 C GLN A 13 9.874 32.703 16.329 1.00 0.00 C ATOM 159 O GLN A 13 9.823 33.235 15.234 1.00 0.00 O ATOM 160 CB GLN A 13 10.286 34.029 18.445 1.00 0.00 C ATOM 161 CG GLN A 13 10.972 35.228 17.759 1.00 0.00 C ATOM 162 CD GLN A 13 12.221 35.710 18.495 1.00 0.00 C ATOM 163 OE1 GLN A 13 12.320 35.596 19.715 1.00 0.00 O ATOM 164 NE2 GLN A 13 13.196 36.236 17.773 1.00 0.00 N ATOM 0 H GLN A 13 8.528 32.400 19.197 1.00 0.00 H new ATOM 0 HA GLN A 13 8.635 34.262 17.148 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.819 34.351 19.376 1.00 0.00 H new ATOM 0 HB3 GLN A 13 11.029 33.275 18.705 1.00 0.00 H new ATOM 0 HG2 GLN A 13 11.243 34.949 16.741 1.00 0.00 H new ATOM 0 HG3 GLN A 13 10.261 36.051 17.685 1.00 0.00 H new ATOM 0 HE21 GLN A 13 13.093 36.321 16.762 1.00 0.00 H new ATOM 0 HE22 GLN A 13 14.051 36.557 18.227 1.00 0.00 H new ATOM 173 N ALA A 14 10.393 31.479 16.501 1.00 0.00 N ATOM 174 CA ALA A 14 11.023 30.737 15.409 1.00 0.00 C ATOM 175 C ALA A 14 10.074 30.520 14.220 1.00 0.00 C ATOM 176 O ALA A 14 10.527 30.355 13.090 1.00 0.00 O ATOM 177 CB ALA A 14 11.552 29.396 15.928 1.00 0.00 C ATOM 0 H ALA A 14 10.387 30.983 17.392 1.00 0.00 H new ATOM 0 HA ALA A 14 11.854 31.339 15.041 1.00 0.00 H new ATOM 0 HB1 ALA A 14 12.020 28.848 15.110 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.287 29.574 16.713 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.726 28.810 16.331 1.00 0.00 H new ATOM 183 N LEU A 15 8.762 30.454 14.464 1.00 0.00 N ATOM 184 CA LEU A 15 7.766 30.274 13.411 1.00 0.00 C ATOM 185 C LEU A 15 7.587 31.596 12.676 1.00 0.00 C ATOM 186 O LEU A 15 7.302 31.582 11.479 1.00 0.00 O ATOM 187 CB LEU A 15 6.441 29.746 13.979 1.00 0.00 C ATOM 188 CG LEU A 15 6.406 28.210 13.968 1.00 0.00 C ATOM 189 CD1 LEU A 15 7.488 27.580 14.855 1.00 0.00 C ATOM 190 CD2 LEU A 15 5.032 27.742 14.436 1.00 0.00 C ATOM 0 H LEU A 15 8.363 30.524 15.400 1.00 0.00 H new ATOM 0 HA LEU A 15 8.113 29.521 12.703 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.309 30.108 14.999 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.609 30.136 13.392 1.00 0.00 H new ATOM 0 HG LEU A 15 6.604 27.887 12.946 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.412 26.494 14.806 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.472 27.891 14.505 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.349 27.907 15.886 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.998 26.653 14.431 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.848 28.107 15.447 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.267 28.132 13.765 1.00 0.00 H new ATOM 202 N LEU A 16 7.708 32.721 13.388 1.00 0.00 N ATOM 203 CA LEU A 16 7.613 34.047 12.781 1.00 0.00 C ATOM 204 C LEU A 16 8.906 34.261 11.986 1.00 0.00 C ATOM 205 O LEU A 16 8.834 34.658 10.831 1.00 0.00 O ATOM 206 CB LEU A 16 7.407 35.169 13.817 1.00 0.00 C ATOM 207 CG LEU A 16 5.925 35.473 14.112 1.00 0.00 C ATOM 208 CD1 LEU A 16 5.227 34.339 14.875 1.00 0.00 C ATOM 209 CD2 LEU A 16 5.813 36.762 14.935 1.00 0.00 C ATOM 0 H LEU A 16 7.873 32.736 14.394 1.00 0.00 H new ATOM 0 HA LEU A 16 6.735 34.092 12.136 1.00 0.00 H new ATOM 0 HB2 LEU A 16 7.904 34.890 14.746 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.891 36.077 13.457 1.00 0.00 H new ATOM 0 HG LEU A 16 5.429 35.582 13.148 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.186 34.608 15.055 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.268 33.424 14.284 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.730 34.178 15.828 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.763 36.972 15.141 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.350 36.641 15.876 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.246 37.590 14.374 1.00 0.00 H new ATOM 221 N GLU A 17 10.071 33.903 12.544 1.00 0.00 N ATOM 222 CA GLU A 17 11.378 34.033 11.901 1.00 0.00 C ATOM 223 C GLU A 17 11.354 33.353 10.534 1.00 0.00 C ATOM 224 O GLU A 17 11.850 33.899 9.551 1.00 0.00 O ATOM 225 CB GLU A 17 12.491 33.348 12.724 1.00 0.00 C ATOM 226 CG GLU A 17 12.884 33.982 14.064 1.00 0.00 C ATOM 227 CD GLU A 17 13.282 35.451 13.964 1.00 0.00 C ATOM 228 OE1 GLU A 17 13.814 35.822 12.894 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.051 36.160 14.971 1.00 0.00 O ATOM 0 H GLU A 17 10.127 33.504 13.481 1.00 0.00 H new ATOM 0 HA GLU A 17 11.584 35.100 11.817 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.180 32.321 12.918 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.385 33.299 12.102 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.048 33.889 14.757 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.715 33.420 14.490 1.00 0.00 H new ATOM 236 N ARG A 18 10.776 32.149 10.449 1.00 0.00 N ATOM 237 CA ARG A 18 10.698 31.379 9.208 1.00 0.00 C ATOM 238 C ARG A 18 9.867 32.043 8.111 1.00 0.00 C ATOM 239 O ARG A 18 9.974 31.585 6.977 1.00 0.00 O ATOM 240 CB ARG A 18 10.192 29.960 9.515 1.00 0.00 C ATOM 241 CG ARG A 18 11.297 29.126 10.186 1.00 0.00 C ATOM 242 CD ARG A 18 10.732 27.945 10.976 1.00 0.00 C ATOM 243 NE ARG A 18 10.264 26.843 10.117 1.00 0.00 N ATOM 244 CZ ARG A 18 9.383 25.899 10.468 1.00 0.00 C ATOM 245 NH1 ARG A 18 8.960 25.813 11.726 1.00 0.00 N ATOM 246 NH2 ARG A 18 8.938 25.026 9.571 1.00 0.00 N ATOM 0 H ARG A 18 10.347 31.681 11.247 1.00 0.00 H new ATOM 0 HA ARG A 18 11.708 31.332 8.801 1.00 0.00 H new ATOM 0 HB2 ARG A 18 9.321 30.012 10.168 1.00 0.00 H new ATOM 0 HB3 ARG A 18 9.871 29.475 8.593 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.983 28.756 9.424 1.00 0.00 H new ATOM 0 HG3 ARG A 18 11.876 29.764 10.854 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.499 27.569 11.653 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.904 28.292 11.594 1.00 0.00 H new ATOM 0 HE ARG A 18 10.645 26.796 9.172 1.00 0.00 H new ATOM 0 HH11 ARG A 18 9.307 26.468 12.427 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.288 25.092 11.990 1.00 0.00 H new ATOM 0 HH21 ARG A 18 9.268 25.072 8.607 1.00 0.00 H new ATOM 0 HH22 ARG A 18 8.266 24.309 9.846 1.00 0.00 H new ATOM 260 N ILE A 19 9.110 33.114 8.373 1.00 0.00 N ATOM 261 CA ILE A 19 8.293 33.786 7.356 1.00 0.00 C ATOM 262 C ILE A 19 9.130 34.166 6.121 1.00 0.00 C ATOM 263 O ILE A 19 8.615 34.068 5.010 1.00 0.00 O ATOM 264 CB ILE A 19 7.451 34.939 7.965 1.00 0.00 C ATOM 265 CG1 ILE A 19 6.350 34.319 8.866 1.00 0.00 C ATOM 266 CG2 ILE A 19 6.795 35.831 6.892 1.00 0.00 C ATOM 267 CD1 ILE A 19 5.588 35.328 9.734 1.00 0.00 C ATOM 0 H ILE A 19 9.046 33.540 9.298 1.00 0.00 H new ATOM 0 HA ILE A 19 7.552 33.080 6.980 1.00 0.00 H new ATOM 0 HB ILE A 19 8.122 35.577 8.540 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.636 33.793 8.233 1.00 0.00 H new ATOM 0 HG13 ILE A 19 6.809 33.574 9.516 1.00 0.00 H new ATOM 0 HG21 ILE A 19 6.219 36.620 7.377 1.00 0.00 H new ATOM 0 HG22 ILE A 19 7.569 36.278 6.268 1.00 0.00 H new ATOM 0 HG23 ILE A 19 6.133 35.227 6.272 1.00 0.00 H new ATOM 0 HD11 ILE A 19 4.840 34.804 10.329 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.287 35.838 10.397 1.00 0.00 H new ATOM 0 HD13 ILE A 19 5.095 36.060 9.094 1.00 0.00 H new ATOM 279 N ARG A 20 10.425 34.508 6.241 1.00 0.00 N ATOM 280 CA ARG A 20 11.227 34.845 5.047 1.00 0.00 C ATOM 281 C ARG A 20 11.256 33.701 4.027 1.00 0.00 C ATOM 282 O ARG A 20 11.436 33.933 2.836 1.00 0.00 O ATOM 283 CB ARG A 20 12.673 35.279 5.387 1.00 0.00 C ATOM 284 CG ARG A 20 13.702 34.167 5.710 1.00 0.00 C ATOM 285 CD ARG A 20 13.319 33.420 6.987 1.00 0.00 C ATOM 286 NE ARG A 20 14.314 32.430 7.446 1.00 0.00 N ATOM 287 CZ ARG A 20 14.890 32.384 8.659 1.00 0.00 C ATOM 288 NH1 ARG A 20 14.650 33.321 9.578 1.00 0.00 N ATOM 289 NH2 ARG A 20 15.704 31.373 8.954 1.00 0.00 N ATOM 0 H ARG A 20 10.930 34.559 7.126 1.00 0.00 H new ATOM 0 HA ARG A 20 10.721 35.701 4.600 1.00 0.00 H new ATOM 0 HB2 ARG A 20 13.056 35.856 4.546 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.628 35.953 6.242 1.00 0.00 H new ATOM 0 HG2 ARG A 20 13.758 33.466 4.877 1.00 0.00 H new ATOM 0 HG3 ARG A 20 14.693 34.606 5.825 1.00 0.00 H new ATOM 0 HD2 ARG A 20 13.157 34.148 7.782 1.00 0.00 H new ATOM 0 HD3 ARG A 20 12.369 32.911 6.823 1.00 0.00 H new ATOM 0 HE ARG A 20 14.591 31.711 6.777 1.00 0.00 H new ATOM 0 HH11 ARG A 20 14.018 34.093 9.366 1.00 0.00 H new ATOM 0 HH12 ARG A 20 15.099 33.265 10.492 1.00 0.00 H new ATOM 0 HH21 ARG A 20 15.884 30.645 8.263 1.00 0.00 H new ATOM 0 HH22 ARG A 20 16.148 31.326 9.871 1.00 0.00 H new ATOM 303 N ALA A 21 11.135 32.454 4.489 1.00 0.00 N ATOM 304 CA ALA A 21 11.161 31.283 3.638 1.00 0.00 C ATOM 305 C ALA A 21 9.824 31.029 2.929 1.00 0.00 C ATOM 306 O ALA A 21 9.757 30.124 2.099 1.00 0.00 O ATOM 307 CB ALA A 21 11.584 30.061 4.460 1.00 0.00 C ATOM 0 H ALA A 21 11.015 32.237 5.478 1.00 0.00 H new ATOM 0 HA ALA A 21 11.891 31.467 2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 21 11.603 29.180 3.819 1.00 0.00 H new ATOM 0 HB2 ALA A 21 12.577 30.229 4.876 1.00 0.00 H new ATOM 0 HB3 ALA A 21 10.873 29.904 5.271 1.00 0.00 H new ATOM 313 N LYS A 22 8.760 31.787 3.229 1.00 0.00 N ATOM 314 CA LYS A 22 7.448 31.591 2.617 1.00 0.00 C ATOM 315 C LYS A 22 7.499 31.818 1.119 1.00 0.00 C ATOM 316 O LYS A 22 6.692 31.220 0.412 1.00 0.00 O ATOM 317 CB LYS A 22 6.394 32.493 3.279 1.00 0.00 C ATOM 318 CG LYS A 22 6.186 32.149 4.765 1.00 0.00 C ATOM 319 CD LYS A 22 5.297 30.931 5.024 1.00 0.00 C ATOM 320 CE LYS A 22 3.830 31.294 4.796 1.00 0.00 C ATOM 321 NZ LYS A 22 2.898 30.346 5.436 1.00 0.00 N ATOM 0 H LYS A 22 8.790 32.552 3.903 1.00 0.00 H new ATOM 0 HA LYS A 22 7.155 30.554 2.782 1.00 0.00 H new ATOM 0 HB2 LYS A 22 6.701 33.535 3.188 1.00 0.00 H new ATOM 0 HB3 LYS A 22 5.447 32.393 2.748 1.00 0.00 H new ATOM 0 HG2 LYS A 22 7.160 31.974 5.223 1.00 0.00 H new ATOM 0 HG3 LYS A 22 5.749 33.013 5.266 1.00 0.00 H new ATOM 0 HD2 LYS A 22 5.585 30.114 4.363 1.00 0.00 H new ATOM 0 HD3 LYS A 22 5.438 30.579 6.046 1.00 0.00 H new ATOM 0 HE2 LYS A 22 3.644 32.296 5.183 1.00 0.00 H new ATOM 0 HE3 LYS A 22 3.631 31.325 3.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 1.919 30.642 5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 3.052 29.393 5.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.065 30.334 6.462 1.00 0.00 H new ATOM 335 N GLU A 23 8.414 32.655 0.625 1.00 0.00 N ATOM 336 CA GLU A 23 8.545 32.913 -0.805 1.00 0.00 C ATOM 337 C GLU A 23 9.600 32.000 -1.427 1.00 0.00 C ATOM 338 O GLU A 23 9.457 31.634 -2.591 1.00 0.00 O ATOM 339 CB GLU A 23 8.876 34.381 -1.086 1.00 0.00 C ATOM 340 CG GLU A 23 7.756 35.329 -0.611 1.00 0.00 C ATOM 341 CD GLU A 23 7.577 36.579 -1.500 1.00 0.00 C ATOM 342 OE1 GLU A 23 8.423 36.818 -2.399 1.00 0.00 O ATOM 343 OE2 GLU A 23 6.551 37.273 -1.335 1.00 0.00 O ATOM 0 H GLU A 23 9.079 33.168 1.203 1.00 0.00 H new ATOM 0 HA GLU A 23 7.581 32.695 -1.264 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.809 34.644 -0.587 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.037 34.518 -2.155 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.816 34.779 -0.581 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.971 35.648 0.409 1.00 0.00 H new ATOM 350 N VAL A 24 10.602 31.552 -0.657 1.00 0.00 N ATOM 351 CA VAL A 24 11.695 30.679 -1.108 1.00 0.00 C ATOM 352 C VAL A 24 11.169 29.429 -1.832 1.00 0.00 C ATOM 353 O VAL A 24 11.888 28.846 -2.644 1.00 0.00 O ATOM 354 CB VAL A 24 12.667 30.400 0.063 1.00 0.00 C ATOM 355 CG1 VAL A 24 13.825 29.463 -0.307 1.00 0.00 C ATOM 356 CG2 VAL A 24 13.291 31.715 0.566 1.00 0.00 C ATOM 0 H VAL A 24 10.676 31.796 0.331 1.00 0.00 H new ATOM 0 HA VAL A 24 12.283 31.192 -1.869 1.00 0.00 H new ATOM 0 HB VAL A 24 12.061 29.917 0.829 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.464 29.314 0.563 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.426 28.503 -0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.408 29.906 -1.114 1.00 0.00 H new ATOM 0 HG21 VAL A 24 13.972 31.503 1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.841 32.191 -0.246 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.502 32.384 0.911 1.00 0.00 H new ATOM 366 N GLN A 25 9.909 29.033 -1.607 1.00 0.00 N ATOM 367 CA GLN A 25 9.239 27.905 -2.252 1.00 0.00 C ATOM 368 C GLN A 25 9.394 27.970 -3.783 1.00 0.00 C ATOM 369 O GLN A 25 9.388 26.936 -4.451 1.00 0.00 O ATOM 370 CB GLN A 25 7.744 27.925 -1.886 1.00 0.00 C ATOM 371 CG GLN A 25 7.054 29.253 -2.256 1.00 0.00 C ATOM 372 CD GLN A 25 5.543 29.139 -2.249 1.00 0.00 C ATOM 373 OE1 GLN A 25 4.969 28.646 -3.217 1.00 0.00 O ATOM 374 NE2 GLN A 25 4.880 29.604 -1.208 1.00 0.00 N ATOM 0 H GLN A 25 9.306 29.514 -0.940 1.00 0.00 H new ATOM 0 HA GLN A 25 9.699 26.982 -1.900 1.00 0.00 H new ATOM 0 HB2 GLN A 25 7.239 27.105 -2.396 1.00 0.00 H new ATOM 0 HB3 GLN A 25 7.635 27.750 -0.816 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.361 30.027 -1.553 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.387 29.570 -3.244 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.386 30.007 -0.420 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.861 29.560 -1.191 1.00 0.00 H new ATOM 383 N LYS A 26 9.533 29.177 -4.351 1.00 0.00 N ATOM 384 CA LYS A 26 9.705 29.411 -5.781 1.00 0.00 C ATOM 385 C LYS A 26 10.908 28.630 -6.308 1.00 0.00 C ATOM 386 O LYS A 26 10.888 28.103 -7.413 1.00 0.00 O ATOM 387 CB LYS A 26 9.793 30.919 -6.046 1.00 0.00 C ATOM 388 CG LYS A 26 10.955 31.679 -5.394 1.00 0.00 C ATOM 389 CD LYS A 26 10.597 33.132 -5.064 1.00 0.00 C ATOM 390 CE LYS A 26 10.458 34.028 -6.300 1.00 0.00 C ATOM 391 NZ LYS A 26 11.087 35.350 -6.104 1.00 0.00 N ATOM 0 H LYS A 26 9.528 30.039 -3.806 1.00 0.00 H new ATOM 0 HA LYS A 26 8.840 29.040 -6.331 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.853 31.070 -7.124 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.861 31.376 -5.712 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.253 31.165 -4.480 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.815 31.664 -6.063 1.00 0.00 H new ATOM 0 HD2 LYS A 26 9.660 33.149 -4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.364 33.546 -4.410 1.00 0.00 H new ATOM 0 HE2 LYS A 26 10.914 33.534 -7.158 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.402 34.161 -6.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.969 35.922 -6.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.635 35.834 -5.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.101 35.226 -5.907 1.00 0.00 H new ATOM 405 N GLN A 27 11.968 28.578 -5.510 1.00 0.00 N ATOM 406 CA GLN A 27 13.209 27.879 -5.803 1.00 0.00 C ATOM 407 C GLN A 27 13.223 26.494 -5.133 1.00 0.00 C ATOM 408 O GLN A 27 13.678 25.521 -5.733 1.00 0.00 O ATOM 409 CB GLN A 27 14.402 28.755 -5.369 1.00 0.00 C ATOM 410 CG GLN A 27 14.316 30.277 -5.609 1.00 0.00 C ATOM 411 CD GLN A 27 14.076 30.807 -7.035 1.00 0.00 C ATOM 412 OE1 GLN A 27 13.405 30.104 -7.936 1.00 0.00 O flip ATOM 413 NE2 GLN A 27 14.420 31.954 -7.305 1.00 0.00 N flip ATOM 0 H GLN A 27 11.985 29.043 -4.602 1.00 0.00 H new ATOM 0 HA GLN A 27 13.292 27.706 -6.876 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.562 28.595 -4.303 1.00 0.00 H new ATOM 0 HB3 GLN A 27 15.290 28.387 -5.883 1.00 0.00 H new ATOM 0 HG2 GLN A 27 13.515 30.662 -4.978 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.246 30.718 -5.249 1.00 0.00 H new ATOM 0 HE21 GLN A 27 14.937 32.506 -6.620 1.00 0.00 H new ATOM 0 HE22 GLN A 27 14.189 32.355 -8.214 1.00 0.00 H new ATOM 422 N LEU A 28 12.677 26.374 -3.917 1.00 0.00 N ATOM 423 CA LEU A 28 12.625 25.137 -3.137 1.00 0.00 C ATOM 424 C LEU A 28 11.846 24.008 -3.826 1.00 0.00 C ATOM 425 O LEU A 28 12.124 22.832 -3.577 1.00 0.00 O ATOM 426 CB LEU A 28 12.061 25.433 -1.736 1.00 0.00 C ATOM 427 CG LEU A 28 12.847 24.812 -0.565 1.00 0.00 C ATOM 428 CD1 LEU A 28 12.746 23.289 -0.490 1.00 0.00 C ATOM 429 CD2 LEU A 28 14.315 25.253 -0.497 1.00 0.00 C ATOM 0 H LEU A 28 12.246 27.163 -3.435 1.00 0.00 H new ATOM 0 HA LEU A 28 13.647 24.769 -3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.027 26.514 -1.597 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.033 25.074 -1.693 1.00 0.00 H new ATOM 0 HG LEU A 28 12.345 25.216 0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 28 13.325 22.927 0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.702 22.999 -0.367 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.138 22.853 -1.409 1.00 0.00 H new ATOM 0 HD21 LEU A 28 14.800 24.773 0.353 1.00 0.00 H new ATOM 0 HD22 LEU A 28 14.825 24.964 -1.416 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.365 26.336 -0.380 1.00 0.00 H new ATOM 441 N ALA A 29 10.887 24.319 -4.704 1.00 0.00 N ATOM 442 CA ALA A 29 10.078 23.319 -5.404 1.00 0.00 C ATOM 443 C ALA A 29 10.721 22.715 -6.656 1.00 0.00 C ATOM 444 O ALA A 29 10.039 22.039 -7.428 1.00 0.00 O ATOM 445 CB ALA A 29 8.695 23.910 -5.703 1.00 0.00 C ATOM 0 H ALA A 29 10.649 25.280 -4.950 1.00 0.00 H new ATOM 0 HA ALA A 29 9.989 22.468 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.088 23.170 -6.224 1.00 0.00 H new ATOM 0 HB2 ALA A 29 8.207 24.186 -4.768 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.805 24.795 -6.330 1.00 0.00 H new ATOM 451 N ARG A 30 12.010 22.947 -6.870 1.00 0.00 N ATOM 452 CA ARG A 30 12.738 22.442 -8.034 1.00 0.00 C ATOM 453 C ARG A 30 13.436 21.117 -7.728 1.00 0.00 C ATOM 454 O ARG A 30 13.937 20.908 -6.619 1.00 0.00 O ATOM 455 CB ARG A 30 13.727 23.521 -8.507 1.00 0.00 C ATOM 456 CG ARG A 30 13.930 23.581 -10.031 1.00 0.00 C ATOM 457 CD ARG A 30 12.856 24.393 -10.779 1.00 0.00 C ATOM 458 NE ARG A 30 11.516 23.775 -10.731 1.00 0.00 N ATOM 459 CZ ARG A 30 10.342 24.408 -10.610 1.00 0.00 C ATOM 460 NH1 ARG A 30 10.292 25.733 -10.705 1.00 0.00 N ATOM 461 NH2 ARG A 30 9.229 23.711 -10.402 1.00 0.00 N ATOM 0 H ARG A 30 12.588 23.497 -6.235 1.00 0.00 H new ATOM 0 HA ARG A 30 12.034 22.232 -8.839 1.00 0.00 H new ATOM 0 HB2 ARG A 30 13.376 24.493 -8.162 1.00 0.00 H new ATOM 0 HB3 ARG A 30 14.692 23.344 -8.032 1.00 0.00 H new ATOM 0 HG2 ARG A 30 14.908 24.015 -10.239 1.00 0.00 H new ATOM 0 HG3 ARG A 30 13.941 22.565 -10.425 1.00 0.00 H new ATOM 0 HD2 ARG A 30 12.802 25.393 -10.349 1.00 0.00 H new ATOM 0 HD3 ARG A 30 13.158 24.509 -11.820 1.00 0.00 H new ATOM 0 HE ARG A 30 11.481 22.758 -10.797 1.00 0.00 H new ATOM 0 HH11 ARG A 30 11.146 26.265 -10.870 1.00 0.00 H new ATOM 0 HH12 ARG A 30 9.399 26.218 -10.613 1.00 0.00 H new ATOM 0 HH21 ARG A 30 9.269 22.694 -10.335 1.00 0.00 H new ATOM 0 HH22 ARG A 30 8.335 24.193 -10.310 1.00 0.00 H new ATOM 724 N GLU A 45 1.610 0.743 -7.003 1.00 0.00 N ATOM 725 CA GLU A 45 1.120 -0.443 -7.714 1.00 0.00 C ATOM 726 C GLU A 45 0.172 -1.232 -6.813 1.00 0.00 C ATOM 727 O GLU A 45 -0.660 -1.998 -7.303 1.00 0.00 O ATOM 728 CB GLU A 45 2.272 -1.375 -8.153 1.00 0.00 C ATOM 729 CG GLU A 45 2.809 -1.083 -9.555 1.00 0.00 C ATOM 730 CD GLU A 45 1.679 -1.087 -10.584 1.00 0.00 C ATOM 731 OE1 GLU A 45 1.024 -2.141 -10.758 1.00 0.00 O ATOM 732 OE2 GLU A 45 1.396 0.022 -11.099 1.00 0.00 O ATOM 0 HA GLU A 45 0.602 -0.092 -8.606 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.089 -1.288 -7.437 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.924 -2.407 -8.116 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.310 -0.115 -9.563 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.555 -1.830 -9.826 1.00 0.00 H new ATOM 739 N ARG A 46 0.257 -1.039 -5.493 1.00 0.00 N ATOM 740 CA ARG A 46 -0.612 -1.742 -4.569 1.00 0.00 C ATOM 741 C ARG A 46 -2.024 -1.168 -4.538 1.00 0.00 C ATOM 742 O ARG A 46 -2.910 -1.829 -4.006 1.00 0.00 O ATOM 743 CB ARG A 46 0.046 -1.839 -3.187 1.00 0.00 C ATOM 744 CG ARG A 46 0.108 -3.305 -2.715 1.00 0.00 C ATOM 745 CD ARG A 46 1.460 -3.635 -2.085 1.00 0.00 C ATOM 746 NE ARG A 46 2.530 -3.625 -3.089 1.00 0.00 N ATOM 747 CZ ARG A 46 3.795 -3.250 -2.894 1.00 0.00 C ATOM 748 NH1 ARG A 46 4.231 -2.825 -1.708 1.00 0.00 N ATOM 749 NH2 ARG A 46 4.647 -3.299 -3.903 1.00 0.00 N ATOM 0 H ARG A 46 0.919 -0.402 -5.050 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.742 -2.761 -4.932 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.052 -1.422 -3.228 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.517 -1.244 -2.468 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -0.686 -3.489 -1.991 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.072 -3.968 -3.561 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.686 -2.911 -1.302 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.413 -4.615 -1.609 1.00 0.00 H new ATOM 0 HE ARG A 46 2.282 -3.935 -4.028 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.590 -2.779 -0.916 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.205 -2.546 -1.593 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.335 -3.621 -4.819 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.617 -3.015 -3.766 1.00 0.00 H new ATOM 763 N LEU A 47 -2.255 0.034 -5.079 1.00 0.00 N ATOM 764 CA LEU A 47 -3.587 0.640 -5.113 1.00 0.00 C ATOM 765 C LEU A 47 -4.505 -0.236 -5.971 1.00 0.00 C ATOM 766 O LEU A 47 -5.506 -0.731 -5.447 1.00 0.00 O ATOM 767 CB LEU A 47 -3.554 2.103 -5.587 1.00 0.00 C ATOM 768 CG LEU A 47 -2.759 3.052 -4.681 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.814 4.450 -5.293 1.00 0.00 C ATOM 770 CD2 LEU A 47 -3.322 3.110 -3.261 1.00 0.00 C ATOM 0 H LEU A 47 -1.527 0.609 -5.503 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.985 0.682 -4.099 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.127 2.137 -6.589 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.578 2.469 -5.664 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.736 2.681 -4.612 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.255 5.144 -4.666 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.375 4.428 -6.290 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.852 4.777 -5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.724 3.795 -2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.354 3.461 -3.293 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.290 2.115 -2.816 1.00 0.00 H new ATOM 782 N PRO A 48 -4.212 -0.475 -7.269 1.00 0.00 N ATOM 783 CA PRO A 48 -5.068 -1.333 -8.071 1.00 0.00 C ATOM 784 C PRO A 48 -5.028 -2.772 -7.540 1.00 0.00 C ATOM 785 O PRO A 48 -6.009 -3.486 -7.718 1.00 0.00 O ATOM 786 CB PRO A 48 -4.540 -1.235 -9.500 1.00 0.00 C ATOM 787 CG PRO A 48 -3.066 -0.900 -9.319 1.00 0.00 C ATOM 788 CD PRO A 48 -3.105 0.006 -8.092 1.00 0.00 C ATOM 0 HA PRO A 48 -6.113 -1.025 -8.030 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -4.674 -2.172 -10.041 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.059 -0.462 -10.067 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.461 -1.791 -9.151 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -2.651 -0.392 -10.190 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.164 -0.039 -7.544 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.257 1.046 -8.380 1.00 0.00 H new ATOM 796 N GLU A 49 -3.941 -3.184 -6.872 1.00 0.00 N ATOM 797 CA GLU A 49 -3.784 -4.516 -6.305 1.00 0.00 C ATOM 798 C GLU A 49 -4.884 -4.773 -5.279 1.00 0.00 C ATOM 799 O GLU A 49 -5.664 -5.708 -5.442 1.00 0.00 O ATOM 800 CB GLU A 49 -2.403 -4.664 -5.645 1.00 0.00 C ATOM 801 CG GLU A 49 -1.959 -6.112 -5.424 1.00 0.00 C ATOM 802 CD GLU A 49 -1.319 -6.642 -6.697 1.00 0.00 C ATOM 803 OE1 GLU A 49 -0.174 -6.225 -6.996 1.00 0.00 O ATOM 804 OE2 GLU A 49 -2.003 -7.356 -7.465 1.00 0.00 O ATOM 0 H GLU A 49 -3.133 -2.582 -6.712 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.862 -5.249 -7.108 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.662 -4.160 -6.265 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.416 -4.150 -4.684 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.250 -6.165 -4.598 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.815 -6.729 -5.150 1.00 0.00 H new ATOM 811 N LEU A 50 -4.954 -3.950 -4.224 1.00 0.00 N ATOM 812 CA LEU A 50 -5.957 -4.112 -3.179 1.00 0.00 C ATOM 813 C LEU A 50 -7.339 -3.970 -3.789 1.00 0.00 C ATOM 814 O LEU A 50 -8.188 -4.794 -3.478 1.00 0.00 O ATOM 815 CB LEU A 50 -5.765 -3.122 -2.012 1.00 0.00 C ATOM 816 CG LEU A 50 -4.933 -3.626 -0.809 1.00 0.00 C ATOM 817 CD1 LEU A 50 -5.588 -4.822 -0.108 1.00 0.00 C ATOM 818 CD2 LEU A 50 -3.508 -3.994 -1.234 1.00 0.00 C ATOM 0 H LEU A 50 -4.321 -3.163 -4.077 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.841 -5.108 -2.752 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.290 -2.222 -2.403 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.750 -2.830 -1.647 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.892 -2.801 -0.098 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.966 -5.139 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.572 -4.533 0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.692 -5.646 -0.814 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.949 -4.344 -0.367 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.545 -4.783 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.015 -3.117 -1.653 1.00 0.00 H new ATOM 830 N ALA A 51 -7.574 -2.986 -4.664 1.00 0.00 N ATOM 831 CA ALA A 51 -8.880 -2.798 -5.291 1.00 0.00 C ATOM 832 C ALA A 51 -9.333 -4.065 -6.036 1.00 0.00 C ATOM 833 O ALA A 51 -10.456 -4.536 -5.834 1.00 0.00 O ATOM 834 CB ALA A 51 -8.843 -1.583 -6.226 1.00 0.00 C ATOM 0 H ALA A 51 -6.871 -2.306 -4.953 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.614 -2.609 -4.508 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.821 -1.450 -6.689 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.589 -0.691 -5.654 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.093 -1.743 -7.001 1.00 0.00 H new ATOM 840 N ARG A 52 -8.476 -4.619 -6.901 1.00 0.00 N ATOM 841 CA ARG A 52 -8.793 -5.818 -7.668 1.00 0.00 C ATOM 842 C ARG A 52 -8.971 -7.020 -6.751 1.00 0.00 C ATOM 843 O ARG A 52 -9.997 -7.694 -6.866 1.00 0.00 O ATOM 844 CB ARG A 52 -7.716 -6.116 -8.728 1.00 0.00 C ATOM 845 CG ARG A 52 -7.843 -5.224 -9.975 1.00 0.00 C ATOM 846 CD ARG A 52 -6.934 -5.698 -11.121 1.00 0.00 C ATOM 847 NE ARG A 52 -5.502 -5.572 -10.792 1.00 0.00 N ATOM 848 CZ ARG A 52 -4.632 -4.647 -11.211 1.00 0.00 C ATOM 849 NH1 ARG A 52 -5.024 -3.691 -12.045 1.00 0.00 N ATOM 850 NH2 ARG A 52 -3.375 -4.669 -10.783 1.00 0.00 N ATOM 0 H ARG A 52 -7.545 -4.245 -7.085 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.733 -5.629 -8.186 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.729 -5.976 -8.286 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.786 -7.162 -9.027 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.879 -5.220 -10.313 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.589 -4.197 -9.713 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.160 -6.739 -11.354 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.151 -5.116 -12.017 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.127 -6.282 -10.164 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -5.991 -3.661 -12.368 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.358 -2.987 -12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.070 -5.393 -10.132 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -2.714 -3.962 -11.105 1.00 0.00 H new ATOM 864 N VAL A 53 -8.010 -7.296 -5.867 1.00 0.00 N ATOM 865 CA VAL A 53 -8.070 -8.430 -4.954 1.00 0.00 C ATOM 866 C VAL A 53 -9.331 -8.347 -4.096 1.00 0.00 C ATOM 867 O VAL A 53 -10.043 -9.343 -4.009 1.00 0.00 O ATOM 868 CB VAL A 53 -6.762 -8.552 -4.145 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.869 -9.621 -3.048 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.603 -8.945 -5.079 1.00 0.00 C ATOM 0 H VAL A 53 -7.165 -6.733 -5.767 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.148 -9.358 -5.520 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.579 -7.582 -3.682 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.928 -9.676 -2.501 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.673 -9.358 -2.361 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.082 -10.589 -3.502 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.683 -9.029 -4.501 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.824 -9.902 -5.551 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.480 -8.182 -5.848 1.00 0.00 H new ATOM 880 N LEU A 54 -9.644 -7.189 -3.507 1.00 0.00 N ATOM 881 CA LEU A 54 -10.823 -6.948 -2.673 1.00 0.00 C ATOM 882 C LEU A 54 -12.078 -7.374 -3.424 1.00 0.00 C ATOM 883 O LEU A 54 -12.849 -8.210 -2.944 1.00 0.00 O ATOM 884 CB LEU A 54 -10.855 -5.460 -2.291 1.00 0.00 C ATOM 885 CG LEU A 54 -12.197 -4.968 -1.720 1.00 0.00 C ATOM 886 CD1 LEU A 54 -11.953 -4.013 -0.552 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.997 -4.207 -2.778 1.00 0.00 C ATOM 0 H LEU A 54 -9.058 -6.360 -3.603 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.779 -7.538 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.073 -5.271 -1.556 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.613 -4.868 -3.173 1.00 0.00 H new ATOM 0 HG LEU A 54 -12.753 -5.847 -1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -12.909 -3.671 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -11.400 -4.530 0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.376 -3.155 -0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.941 -3.871 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -12.424 -3.344 -3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.198 -4.864 -3.625 1.00 0.00 H new ATOM 899 N ARG A 55 -12.256 -6.844 -4.639 1.00 0.00 N ATOM 900 CA ARG A 55 -13.403 -7.178 -5.468 1.00 0.00 C ATOM 901 C ARG A 55 -13.446 -8.687 -5.694 1.00 0.00 C ATOM 902 O ARG A 55 -14.545 -9.241 -5.721 1.00 0.00 O ATOM 903 CB ARG A 55 -13.337 -6.398 -6.788 1.00 0.00 C ATOM 904 CG ARG A 55 -14.690 -6.450 -7.510 1.00 0.00 C ATOM 905 CD ARG A 55 -14.643 -5.829 -8.908 1.00 0.00 C ATOM 906 NE ARG A 55 -13.710 -6.496 -9.839 1.00 0.00 N ATOM 907 CZ ARG A 55 -13.762 -7.731 -10.361 1.00 0.00 C ATOM 908 NH1 ARG A 55 -14.632 -8.645 -9.940 1.00 0.00 N ATOM 909 NH2 ARG A 55 -12.923 -8.044 -11.337 1.00 0.00 N ATOM 0 H ARG A 55 -11.612 -6.178 -5.066 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.326 -6.890 -4.965 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.062 -5.362 -6.592 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.560 -6.818 -7.427 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.014 -7.488 -7.590 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.436 -5.928 -6.911 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.645 -5.853 -9.337 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.360 -4.780 -8.818 1.00 0.00 H new ATOM 0 HE ARG A 55 -12.908 -5.935 -10.127 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.291 -8.417 -9.195 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.641 -9.574 -10.362 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -12.255 -7.352 -11.677 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -12.945 -8.977 -11.749 1.00 0.00 H new ATOM 923 N ASN A 56 -12.289 -9.339 -5.883 1.00 0.00 N ATOM 924 CA ASN A 56 -12.194 -10.774 -6.087 1.00 0.00 C ATOM 925 C ASN A 56 -12.711 -11.501 -4.843 1.00 0.00 C ATOM 926 O ASN A 56 -13.486 -12.439 -5.002 1.00 0.00 O ATOM 927 CB ASN A 56 -10.766 -11.218 -6.473 1.00 0.00 C ATOM 928 CG ASN A 56 -10.260 -12.392 -5.646 1.00 0.00 C ATOM 929 OD1 ASN A 56 -10.460 -13.551 -5.996 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.624 -12.127 -4.522 1.00 0.00 N ATOM 0 H ASN A 56 -11.385 -8.868 -5.897 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.823 -11.046 -6.935 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.750 -11.491 -7.528 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.085 -10.376 -6.351 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.292 -12.890 -3.932 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.464 -11.159 -4.242 1.00 0.00 H new ATOM 937 N VAL A 57 -12.343 -11.077 -3.628 1.00 0.00 N ATOM 938 CA VAL A 57 -12.803 -11.752 -2.421 1.00 0.00 C ATOM 939 C VAL A 57 -14.323 -11.655 -2.339 1.00 0.00 C ATOM 940 O VAL A 57 -14.982 -12.686 -2.272 1.00 0.00 O ATOM 941 CB VAL A 57 -12.139 -11.242 -1.119 1.00 0.00 C ATOM 942 CG1 VAL A 57 -12.272 -12.317 -0.030 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.644 -10.916 -1.234 1.00 0.00 C ATOM 0 H VAL A 57 -11.733 -10.276 -3.461 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.496 -12.795 -2.502 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.660 -10.314 -0.884 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.806 -11.963 0.890 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.327 -12.521 0.153 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.778 -13.231 -0.359 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.273 -10.567 -0.270 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.098 -11.812 -1.531 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.498 -10.137 -1.983 1.00 0.00 H new ATOM 953 N PHE A 58 -14.913 -10.458 -2.434 1.00 0.00 N ATOM 954 CA PHE A 58 -16.358 -10.314 -2.331 1.00 0.00 C ATOM 955 C PHE A 58 -17.076 -11.111 -3.406 1.00 0.00 C ATOM 956 O PHE A 58 -18.023 -11.842 -3.106 1.00 0.00 O ATOM 957 CB PHE A 58 -16.757 -8.842 -2.394 1.00 0.00 C ATOM 958 CG PHE A 58 -16.862 -8.172 -1.040 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.704 -7.877 -0.297 1.00 0.00 C ATOM 960 CD2 PHE A 58 -18.125 -7.798 -0.542 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.814 -7.194 0.925 1.00 0.00 C ATOM 962 CE2 PHE A 58 -18.227 -7.079 0.661 1.00 0.00 C ATOM 963 CZ PHE A 58 -17.069 -6.785 1.398 1.00 0.00 C ATOM 0 H PHE A 58 -14.410 -9.583 -2.581 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.663 -10.716 -1.365 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -16.026 -8.304 -2.998 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.716 -8.758 -2.904 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.734 -8.175 -0.665 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -19.019 -8.065 -1.087 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.927 -6.983 1.504 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -19.193 -6.754 1.017 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.145 -6.244 2.329 1.00 0.00 H new ATOM 973 N VAL A 59 -16.669 -10.978 -4.666 1.00 0.00 N ATOM 974 CA VAL A 59 -17.337 -11.722 -5.734 1.00 0.00 C ATOM 975 C VAL A 59 -17.177 -13.246 -5.551 1.00 0.00 C ATOM 976 O VAL A 59 -18.031 -14.016 -6.001 1.00 0.00 O ATOM 977 CB VAL A 59 -16.893 -11.153 -7.092 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.556 -11.698 -7.576 1.00 0.00 C ATOM 979 CG2 VAL A 59 -17.951 -11.371 -8.171 1.00 0.00 C ATOM 0 H VAL A 59 -15.901 -10.379 -4.969 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.417 -11.583 -5.690 1.00 0.00 H new ATOM 0 HB VAL A 59 -16.766 -10.084 -6.918 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.308 -11.252 -8.539 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.779 -11.452 -6.852 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.622 -12.781 -7.684 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.599 -10.955 -9.115 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.134 -12.439 -8.291 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.877 -10.875 -7.879 1.00 0.00 H new ATOM 989 N SER A 60 -16.114 -13.701 -4.886 1.00 0.00 N ATOM 990 CA SER A 60 -15.828 -15.101 -4.609 1.00 0.00 C ATOM 991 C SER A 60 -16.595 -15.549 -3.351 1.00 0.00 C ATOM 992 O SER A 60 -17.002 -16.707 -3.283 1.00 0.00 O ATOM 993 CB SER A 60 -14.303 -15.232 -4.477 1.00 0.00 C ATOM 994 OG SER A 60 -13.810 -16.542 -4.272 1.00 0.00 O ATOM 0 H SER A 60 -15.402 -13.074 -4.512 1.00 0.00 H new ATOM 0 HA SER A 60 -16.163 -15.760 -5.410 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.844 -14.829 -5.380 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.975 -14.607 -3.646 1.00 0.00 H new ATOM 0 HG SER A 60 -12.833 -16.517 -4.203 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.907 -14.644 -2.418 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.622 -14.888 -1.161 1.00 0.00 C ATOM 1002 C GLU A 61 -19.102 -15.217 -1.387 1.00 0.00 C ATOM 1003 O GLU A 61 -19.801 -15.605 -0.454 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.551 -13.615 -0.302 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.844 -13.828 1.193 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.650 -14.222 2.057 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.521 -13.727 1.835 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -16.909 -14.892 3.080 1.00 0.00 O ATOM 0 H GLU A 61 -16.652 -13.662 -2.527 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.150 -15.741 -0.673 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.557 -13.179 -0.405 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.260 -12.887 -0.697 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -18.270 -12.909 1.594 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.607 -14.601 1.287 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.628 -15.018 -2.603 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.030 -15.283 -2.945 1.00 0.00 C ATOM 1017 C ARG A 62 -22.019 -14.374 -2.188 1.00 0.00 C ATOM 1018 O ARG A 62 -23.217 -14.482 -2.436 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.302 -16.794 -2.765 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.582 -17.337 -3.413 1.00 0.00 C ATOM 1021 CD ARG A 62 -22.517 -18.868 -3.488 1.00 0.00 C ATOM 1022 NE ARG A 62 -22.502 -19.516 -2.156 1.00 0.00 N ATOM 1023 CZ ARG A 62 -22.001 -20.729 -1.867 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -21.360 -21.444 -2.791 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -22.139 -21.237 -0.645 1.00 0.00 N ATOM 0 H ARG A 62 -19.082 -14.663 -3.388 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.202 -15.025 -3.990 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.453 -17.345 -3.170 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -21.341 -17.010 -1.697 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.453 -17.029 -2.834 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -22.700 -16.919 -4.413 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -23.373 -19.235 -4.054 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -21.623 -19.161 -4.038 1.00 0.00 H new ATOM 0 HE ARG A 62 -22.912 -18.991 -1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -21.244 -21.072 -3.734 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -20.986 -22.363 -2.556 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -22.626 -20.705 0.076 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -21.757 -22.158 -0.429 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.580 -13.450 -1.318 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.438 -12.548 -0.549 1.00 0.00 C ATOM 1041 C LYS A 63 -21.906 -11.131 -0.643 1.00 0.00 C ATOM 1042 O LYS A 63 -20.694 -10.934 -0.541 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.657 -13.057 0.886 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.410 -12.971 1.762 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.616 -13.447 3.202 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.715 -14.972 3.294 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.498 -15.440 4.680 1.00 0.00 N ATOM 0 H LYS A 63 -20.588 -13.310 -1.128 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.438 -12.532 -0.983 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.457 -12.479 1.349 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -22.993 -14.093 0.848 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.618 -13.565 1.305 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -21.064 -11.938 1.780 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.788 -13.100 3.820 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -22.525 -13.000 3.605 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -22.696 -15.297 2.947 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -20.977 -15.427 2.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -21.571 -16.477 4.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.552 -15.149 5.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -22.218 -15.023 5.304 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.764 -10.127 -0.874 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.331 -8.747 -0.968 1.00 0.00 C ATOM 1063 C PRO A 64 -22.184 -8.085 0.409 1.00 0.00 C ATOM 1064 O PRO A 64 -21.785 -6.923 0.449 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.436 -8.061 -1.773 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.690 -8.774 -1.265 1.00 0.00 C ATOM 1067 CD PRO A 64 -24.209 -10.207 -1.043 1.00 0.00 C ATOM 0 HA PRO A 64 -21.347 -8.670 -1.431 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.472 -6.988 -1.584 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.299 -8.191 -2.847 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -25.062 -8.327 -0.343 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.501 -8.729 -1.992 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.681 -10.644 -0.163 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.468 -10.841 -1.891 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.537 -8.770 1.508 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.447 -8.237 2.870 1.00 0.00 C ATOM 1077 C ALA A 65 -21.471 -9.106 3.655 1.00 0.00 C ATOM 1078 O ALA A 65 -21.712 -10.307 3.809 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.831 -8.207 3.527 1.00 0.00 C ATOM 0 H ALA A 65 -22.898 -9.723 1.471 1.00 0.00 H new ATOM 0 HA ALA A 65 -22.083 -7.210 2.854 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.745 -7.808 4.538 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -24.498 -7.573 2.942 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.236 -9.218 3.569 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.380 -8.516 4.140 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.323 -9.193 4.885 1.00 0.00 C ATOM 1087 C LEU A 66 -19.206 -8.638 6.288 1.00 0.00 C ATOM 1088 O LEU A 66 -19.248 -7.424 6.462 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.974 -8.942 4.191 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.619 -9.909 3.051 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -17.162 -11.215 3.697 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.742 -10.193 2.034 1.00 0.00 C ATOM 0 H LEU A 66 -20.203 -7.519 4.020 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.569 -10.254 4.922 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.974 -7.927 3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.186 -8.991 4.942 1.00 0.00 H new ATOM 0 HG LEU A 66 -16.843 -9.427 2.457 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -16.899 -11.933 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -16.292 -11.025 4.325 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.969 -11.621 4.308 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.379 -10.887 1.276 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.597 -10.632 2.549 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -19.045 -9.261 1.557 1.00 0.00 H new ATOM 1104 N THR A 67 -19.050 -9.512 7.277 1.00 0.00 N ATOM 1105 CA THR A 67 -18.897 -9.091 8.659 1.00 0.00 C ATOM 1106 C THR A 67 -17.502 -8.480 8.820 1.00 0.00 C ATOM 1107 O THR A 67 -16.579 -8.871 8.097 1.00 0.00 O ATOM 1108 CB THR A 67 -19.093 -10.294 9.596 1.00 0.00 C ATOM 1109 OG1 THR A 67 -20.040 -11.218 9.077 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.557 -9.839 10.973 1.00 0.00 C ATOM 0 H THR A 67 -19.027 -10.523 7.142 1.00 0.00 H new ATOM 0 HA THR A 67 -19.648 -8.346 8.921 1.00 0.00 H new ATOM 0 HB THR A 67 -18.125 -10.789 9.677 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.938 -10.829 9.128 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.689 -10.708 11.618 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.810 -9.174 11.407 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.505 -9.309 10.881 1.00 0.00 H new ATOM 1118 N MET A 68 -17.340 -7.557 9.771 1.00 0.00 N ATOM 1119 CA MET A 68 -16.079 -6.882 10.067 1.00 0.00 C ATOM 1120 C MET A 68 -14.974 -7.907 10.286 1.00 0.00 C ATOM 1121 O MET A 68 -13.921 -7.823 9.664 1.00 0.00 O ATOM 1122 CB MET A 68 -16.287 -5.951 11.274 1.00 0.00 C ATOM 1123 CG MET A 68 -15.030 -5.182 11.692 1.00 0.00 C ATOM 1124 SD MET A 68 -14.394 -4.008 10.466 1.00 0.00 S ATOM 1125 CE MET A 68 -15.693 -2.744 10.497 1.00 0.00 C ATOM 0 H MET A 68 -18.105 -7.252 10.372 1.00 0.00 H new ATOM 0 HA MET A 68 -15.762 -6.267 9.225 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.075 -5.237 11.037 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.637 -6.543 12.120 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.246 -4.639 12.612 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.244 -5.901 11.923 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.380 -1.886 9.902 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.612 -3.157 10.082 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.869 -2.428 11.525 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.238 -8.917 11.106 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.275 -9.963 11.409 1.00 0.00 C ATOM 1137 C GLU A 69 -13.854 -10.754 10.167 1.00 0.00 C ATOM 1138 O GLU A 69 -12.688 -11.143 10.056 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.898 -10.867 12.474 1.00 0.00 C ATOM 1140 CG GLU A 69 -14.004 -12.055 12.841 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.386 -12.703 14.176 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -14.728 -11.980 15.140 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.254 -13.942 14.314 1.00 0.00 O ATOM 0 H GLU A 69 -16.133 -9.032 11.582 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.355 -9.514 11.783 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.100 -10.280 13.370 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.857 -11.238 12.113 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.062 -12.803 12.051 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.967 -11.721 12.889 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.778 -11.009 9.241 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.470 -11.762 8.033 1.00 0.00 C ATOM 1152 C VAL A 70 -13.514 -10.952 7.152 1.00 0.00 C ATOM 1153 O VAL A 70 -12.428 -11.426 6.820 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.758 -12.176 7.288 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.394 -13.002 6.044 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.685 -13.034 8.165 1.00 0.00 C ATOM 0 H VAL A 70 -15.749 -10.702 9.308 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.967 -12.690 8.305 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.278 -11.257 7.018 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.305 -13.292 5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.769 -12.404 5.380 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.849 -13.896 6.347 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.577 -13.301 7.599 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.162 -13.941 8.468 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.973 -12.469 9.051 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.911 -9.737 6.764 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.093 -8.881 5.903 1.00 0.00 C ATOM 1168 C VAL A 71 -11.737 -8.515 6.552 1.00 0.00 C ATOM 1169 O VAL A 71 -10.728 -8.322 5.868 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.971 -7.704 5.430 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.339 -6.699 6.529 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.349 -6.993 4.233 1.00 0.00 C ATOM 0 H VAL A 71 -14.802 -9.322 7.036 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.771 -9.411 5.007 1.00 0.00 H new ATOM 0 HB VAL A 71 -14.912 -8.162 5.126 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.957 -5.907 6.106 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.893 -7.209 7.317 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.429 -6.266 6.946 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -13.992 -6.169 3.925 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.369 -6.604 4.510 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.240 -7.697 3.408 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.704 -8.477 7.883 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.542 -8.175 8.703 1.00 0.00 C ATOM 1184 C CYS A 72 -9.494 -9.249 8.435 1.00 0.00 C ATOM 1185 O CYS A 72 -8.464 -8.959 7.827 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.958 -8.103 10.184 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.539 -7.993 11.311 1.00 0.00 S ATOM 0 H CYS A 72 -12.534 -8.667 8.444 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.114 -7.204 8.454 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.602 -7.237 10.334 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.547 -8.985 10.434 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.963 -7.934 12.538 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.762 -10.495 8.843 1.00 0.00 N ATOM 1194 CA ALA A 73 -8.833 -11.608 8.657 1.00 0.00 C ATOM 1195 C ALA A 73 -8.422 -11.778 7.191 1.00 0.00 C ATOM 1196 O ALA A 73 -7.293 -12.150 6.885 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.472 -12.886 9.196 1.00 0.00 C ATOM 0 H ALA A 73 -10.630 -10.757 9.311 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.920 -11.391 9.211 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.785 -13.721 9.061 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.691 -12.764 10.257 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.397 -13.086 8.656 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.338 -11.487 6.273 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.108 -11.588 4.836 1.00 0.00 C ATOM 1205 C ARG A 74 -8.004 -10.619 4.412 1.00 0.00 C ATOM 1206 O ARG A 74 -7.198 -10.948 3.534 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.433 -11.316 4.109 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.343 -12.552 3.992 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.913 -13.566 2.913 1.00 0.00 C ATOM 1210 NE ARG A 74 -9.960 -14.572 3.397 1.00 0.00 N ATOM 1211 CZ ARG A 74 -10.186 -15.536 4.295 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -11.409 -15.736 4.781 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -9.170 -16.292 4.682 1.00 0.00 N ATOM 0 H ARG A 74 -10.277 -11.169 6.511 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.769 -12.589 4.570 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.971 -10.529 4.637 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.217 -10.939 3.109 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.372 -13.058 4.957 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.358 -12.220 3.776 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.799 -14.072 2.529 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.466 -13.027 2.078 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.020 -14.531 3.004 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -12.184 -15.151 4.468 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.571 -16.474 5.466 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.239 -16.132 4.296 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.318 -17.034 5.366 1.00 0.00 H new ATOM 1227 N MET A 75 -7.960 -9.421 4.993 1.00 0.00 N ATOM 1228 CA MET A 75 -6.940 -8.439 4.676 1.00 0.00 C ATOM 1229 C MET A 75 -5.668 -8.847 5.390 1.00 0.00 C ATOM 1230 O MET A 75 -4.610 -8.837 4.775 1.00 0.00 O ATOM 1231 CB MET A 75 -7.417 -7.040 5.066 1.00 0.00 C ATOM 1232 CG MET A 75 -8.489 -6.625 4.059 1.00 0.00 C ATOM 1233 SD MET A 75 -7.834 -6.168 2.428 1.00 0.00 S ATOM 1234 CE MET A 75 -8.899 -7.210 1.398 1.00 0.00 C ATOM 0 H MET A 75 -8.632 -9.110 5.695 1.00 0.00 H new ATOM 0 HA MET A 75 -6.741 -8.404 3.605 1.00 0.00 H new ATOM 0 HB2 MET A 75 -7.821 -7.041 6.078 1.00 0.00 H new ATOM 0 HB3 MET A 75 -6.586 -6.334 5.055 1.00 0.00 H new ATOM 0 HG2 MET A 75 -9.196 -7.446 3.938 1.00 0.00 H new ATOM 0 HG3 MET A 75 -9.047 -5.781 4.465 1.00 0.00 H new ATOM 0 HE1 MET A 75 -8.644 -7.066 0.348 1.00 0.00 H new ATOM 0 HE2 MET A 75 -8.753 -8.256 1.666 1.00 0.00 H new ATOM 0 HE3 MET A 75 -9.942 -6.936 1.559 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.758 -9.272 6.649 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.609 -9.706 7.430 1.00 0.00 C ATOM 1246 C VAL A 76 -3.863 -10.812 6.683 1.00 0.00 C ATOM 1247 O VAL A 76 -2.634 -10.800 6.603 1.00 0.00 O ATOM 1248 CB VAL A 76 -5.097 -10.164 8.812 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -3.983 -10.859 9.594 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -5.657 -8.980 9.603 1.00 0.00 C ATOM 0 H VAL A 76 -6.641 -9.324 7.157 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.906 -8.885 7.572 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.897 -10.889 8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -4.362 -11.171 10.567 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.641 -11.734 9.041 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.151 -10.169 9.732 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.998 -9.324 10.580 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.878 -8.229 9.734 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.495 -8.543 9.059 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.586 -11.768 6.108 1.00 0.00 N ATOM 1261 CA ASP A 77 -3.999 -12.872 5.355 1.00 0.00 C ATOM 1262 C ASP A 77 -3.225 -12.359 4.134 1.00 0.00 C ATOM 1263 O ASP A 77 -2.194 -12.919 3.762 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.105 -13.838 4.973 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.527 -15.025 4.210 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -3.947 -15.936 4.844 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -4.678 -15.078 2.974 1.00 0.00 O ATOM 0 H ASP A 77 -5.605 -11.799 6.152 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.272 -13.399 5.972 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.618 -14.187 5.869 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.847 -13.328 4.359 1.00 0.00 H new ATOM 1272 N SER A 78 -3.679 -11.248 3.545 1.00 0.00 N ATOM 1273 CA SER A 78 -3.049 -10.609 2.394 1.00 0.00 C ATOM 1274 C SER A 78 -1.648 -10.063 2.758 1.00 0.00 C ATOM 1275 O SER A 78 -0.910 -9.650 1.866 1.00 0.00 O ATOM 1276 CB SER A 78 -3.978 -9.527 1.798 1.00 0.00 C ATOM 1277 OG SER A 78 -5.247 -10.078 1.456 1.00 0.00 O ATOM 0 H SER A 78 -4.515 -10.760 3.866 1.00 0.00 H new ATOM 0 HA SER A 78 -2.894 -11.358 1.617 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.110 -8.719 2.518 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.515 -9.092 0.912 1.00 0.00 H new ATOM 0 HG SER A 78 -5.744 -10.287 2.274 1.00 0.00 H new ATOM 1283 N CYS A 79 -1.240 -10.061 4.040 1.00 0.00 N ATOM 1284 CA CYS A 79 0.078 -9.600 4.481 1.00 0.00 C ATOM 1285 C CYS A 79 1.189 -10.532 3.982 1.00 0.00 C ATOM 1286 O CYS A 79 2.375 -10.195 4.062 1.00 0.00 O ATOM 1287 CB CYS A 79 0.090 -9.465 6.015 1.00 0.00 C ATOM 1288 SG CYS A 79 1.694 -8.930 6.687 1.00 0.00 S ATOM 0 H CYS A 79 -1.830 -10.386 4.806 1.00 0.00 H new ATOM 0 HA CYS A 79 0.275 -8.620 4.047 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -0.676 -8.750 6.314 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.178 -10.424 6.458 1.00 0.00 H new ATOM 0 HG CYS A 79 2.643 -9.265 5.864 1.00 0.00 H new ATOM 1294 N GLN A 80 0.854 -11.693 3.416 1.00 0.00 N ATOM 1295 CA GLN A 80 1.792 -12.679 2.878 1.00 0.00 C ATOM 1296 C GLN A 80 2.435 -12.184 1.554 1.00 0.00 C ATOM 1297 O GLN A 80 2.804 -12.972 0.683 1.00 0.00 O ATOM 1298 CB GLN A 80 1.044 -14.021 2.770 1.00 0.00 C ATOM 1299 CG GLN A 80 0.728 -14.590 4.170 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.490 -15.513 4.192 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -0.771 -16.249 3.247 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -1.241 -15.524 5.283 1.00 0.00 N ATOM 0 H GLN A 80 -0.119 -11.983 3.316 1.00 0.00 H new ATOM 0 HA GLN A 80 2.644 -12.824 3.542 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.118 -13.882 2.212 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.649 -14.735 2.211 1.00 0.00 H new ATOM 0 HG2 GLN A 80 1.596 -15.139 4.535 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.560 -13.763 4.860 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -1.010 -14.915 6.068 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.051 -16.142 5.339 1.00 0.00 H new ATOM 1311 N THR A 81 2.580 -10.865 1.426 1.00 0.00 N ATOM 1312 CA THR A 81 3.119 -10.050 0.348 1.00 0.00 C ATOM 1313 C THR A 81 4.255 -9.139 0.846 1.00 0.00 C ATOM 1314 O THR A 81 4.995 -8.573 0.038 1.00 0.00 O ATOM 1315 CB THR A 81 1.925 -9.226 -0.168 1.00 0.00 C ATOM 1316 OG1 THR A 81 2.068 -8.900 -1.537 1.00 0.00 O ATOM 1317 CG2 THR A 81 1.607 -7.972 0.648 1.00 0.00 C ATOM 0 H THR A 81 2.276 -10.262 2.191 1.00 0.00 H new ATOM 0 HA THR A 81 3.559 -10.662 -0.439 1.00 0.00 H new ATOM 0 HB THR A 81 1.067 -9.887 -0.041 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.292 -8.379 -1.832 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.752 -7.459 0.208 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.371 -8.255 1.674 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.471 -7.307 0.645 1.00 0.00 H new ATOM 1325 N ALA A 82 4.395 -9.020 2.172 1.00 0.00 N ATOM 1326 CA ALA A 82 5.362 -8.230 2.932 1.00 0.00 C ATOM 1327 C ALA A 82 5.058 -6.728 2.847 1.00 0.00 C ATOM 1328 O ALA A 82 5.509 -6.020 1.944 1.00 0.00 O ATOM 1329 CB ALA A 82 6.807 -8.577 2.563 1.00 0.00 C ATOM 0 H ALA A 82 3.770 -9.527 2.799 1.00 0.00 H new ATOM 0 HA ALA A 82 5.254 -8.502 3.982 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.490 -7.965 3.153 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.992 -9.631 2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.969 -8.382 1.503 1.00 0.00 H new ATOM 1335 N LEU A 83 4.240 -6.251 3.783 1.00 0.00 N ATOM 1336 CA LEU A 83 3.781 -4.870 3.951 1.00 0.00 C ATOM 1337 C LEU A 83 3.750 -4.525 5.440 1.00 0.00 C ATOM 1338 O LEU A 83 3.915 -5.414 6.283 1.00 0.00 O ATOM 1339 CB LEU A 83 2.407 -4.642 3.280 1.00 0.00 C ATOM 1340 CG LEU A 83 1.391 -5.790 3.439 1.00 0.00 C ATOM 1341 CD1 LEU A 83 0.946 -5.997 4.875 1.00 0.00 C ATOM 1342 CD2 LEU A 83 0.145 -5.566 2.589 1.00 0.00 C ATOM 0 H LEU A 83 3.850 -6.865 4.499 1.00 0.00 H new ATOM 0 HA LEU A 83 4.481 -4.201 3.451 1.00 0.00 H new ATOM 0 HB2 LEU A 83 1.968 -3.733 3.691 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.567 -4.466 2.216 1.00 0.00 H new ATOM 0 HG LEU A 83 1.923 -6.680 3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.231 -6.819 4.920 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.812 -6.235 5.493 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.475 -5.086 5.245 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.546 -6.397 2.730 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -0.339 -4.637 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.428 -5.503 1.538 1.00 0.00 H new ATOM 1354 N SER A 84 3.603 -3.247 5.784 1.00 0.00 N ATOM 1355 CA SER A 84 3.538 -2.832 7.179 1.00 0.00 C ATOM 1356 C SER A 84 2.151 -3.178 7.774 1.00 0.00 C ATOM 1357 O SER A 84 1.163 -3.219 7.033 1.00 0.00 O ATOM 1358 CB SER A 84 3.803 -1.331 7.285 1.00 0.00 C ATOM 1359 OG SER A 84 4.695 -0.835 6.303 1.00 0.00 O ATOM 0 H SER A 84 3.527 -2.482 5.113 1.00 0.00 H new ATOM 0 HA SER A 84 4.301 -3.366 7.746 1.00 0.00 H new ATOM 0 HB2 SER A 84 2.856 -0.798 7.204 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.208 -1.112 8.273 1.00 0.00 H new ATOM 0 HG SER A 84 4.528 0.120 6.162 1.00 0.00 H new ATOM 1365 N PRO A 85 2.026 -3.346 9.103 1.00 0.00 N ATOM 1366 CA PRO A 85 0.765 -3.685 9.769 1.00 0.00 C ATOM 1367 C PRO A 85 -0.286 -2.583 9.668 1.00 0.00 C ATOM 1368 O PRO A 85 -1.464 -2.840 9.421 1.00 0.00 O ATOM 1369 CB PRO A 85 1.139 -3.955 11.231 1.00 0.00 C ATOM 1370 CG PRO A 85 2.447 -3.192 11.430 1.00 0.00 C ATOM 1371 CD PRO A 85 3.111 -3.316 10.066 1.00 0.00 C ATOM 0 HA PRO A 85 0.304 -4.548 9.288 1.00 0.00 H new ATOM 0 HB2 PRO A 85 0.364 -3.602 11.912 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.267 -5.021 11.419 1.00 0.00 H new ATOM 0 HG2 PRO A 85 2.272 -2.151 11.703 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.057 -3.631 12.220 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.779 -2.475 9.878 1.00 0.00 H new ATOM 0 HD3 PRO A 85 3.714 -4.222 10.005 1.00 0.00 H new ATOM 1379 N GLY A 86 0.141 -1.345 9.885 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.690 -0.164 9.845 1.00 0.00 C ATOM 1381 C GLY A 86 -0.965 0.250 8.414 1.00 0.00 C ATOM 1382 O GLY A 86 -1.931 0.973 8.185 1.00 0.00 O ATOM 0 H GLY A 86 1.116 -1.136 10.102 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.631 -0.358 10.360 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.198 0.651 10.376 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.137 -0.145 7.438 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.383 0.208 6.064 1.00 0.00 C ATOM 1388 C GLU A 87 -1.628 -0.554 5.592 1.00 0.00 C ATOM 1389 O GLU A 87 -2.382 -0.001 4.795 1.00 0.00 O ATOM 1390 CB GLU A 87 0.878 -0.058 5.240 1.00 0.00 C ATOM 1391 CG GLU A 87 1.780 1.186 5.166 1.00 0.00 C ATOM 1392 CD GLU A 87 2.424 1.724 6.455 1.00 0.00 C ATOM 1393 OE1 GLU A 87 1.745 2.297 7.344 1.00 0.00 O ATOM 1394 OE2 GLU A 87 3.672 1.649 6.557 1.00 0.00 O ATOM 0 H GLU A 87 0.701 -0.706 7.589 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.596 1.270 5.939 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.434 -0.885 5.681 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.597 -0.365 4.232 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.585 0.966 4.464 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.190 1.994 4.732 1.00 0.00 H new ATOM 1401 N MET A 88 -1.894 -1.767 6.108 1.00 0.00 N ATOM 1402 CA MET A 88 -3.080 -2.541 5.737 1.00 0.00 C ATOM 1403 C MET A 88 -4.310 -1.700 6.092 1.00 0.00 C ATOM 1404 O MET A 88 -5.189 -1.472 5.260 1.00 0.00 O ATOM 1405 CB MET A 88 -3.107 -3.891 6.483 1.00 0.00 C ATOM 1406 CG MET A 88 -4.172 -4.845 5.888 1.00 0.00 C ATOM 1407 SD MET A 88 -3.785 -5.468 4.233 1.00 0.00 S ATOM 1408 CE MET A 88 -2.551 -6.676 4.759 1.00 0.00 C ATOM 0 H MET A 88 -1.294 -2.231 6.789 1.00 0.00 H new ATOM 0 HA MET A 88 -3.069 -2.764 4.670 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.124 -4.359 6.426 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.318 -3.721 7.539 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.298 -5.693 6.561 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.128 -4.323 5.851 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.302 -7.330 3.923 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.653 -6.157 5.093 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.952 -7.272 5.579 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.332 -1.185 7.326 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.409 -0.352 7.836 1.00 0.00 C ATOM 1420 C GLU A 89 -5.563 0.877 6.946 1.00 0.00 C ATOM 1421 O GLU A 89 -6.677 1.204 6.530 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.134 0.101 9.272 1.00 0.00 C ATOM 1423 CG GLU A 89 -4.708 -1.027 10.218 1.00 0.00 C ATOM 1424 CD GLU A 89 -4.665 -0.558 11.677 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -4.353 0.627 11.948 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -5.022 -1.345 12.581 1.00 0.00 O ATOM 0 H GLU A 89 -3.586 -1.342 8.004 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.325 -0.943 7.832 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.353 0.862 9.258 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.032 0.573 9.670 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.402 -1.862 10.125 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.725 -1.396 9.925 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.445 1.549 6.644 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.433 2.735 5.795 1.00 0.00 C ATOM 1435 C LYS A 90 -5.005 2.426 4.428 1.00 0.00 C ATOM 1436 O LYS A 90 -5.659 3.294 3.869 1.00 0.00 O ATOM 1437 CB LYS A 90 -3.039 3.340 5.660 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.695 4.016 6.985 1.00 0.00 C ATOM 1439 CD LYS A 90 -1.309 4.643 6.930 1.00 0.00 C ATOM 1440 CE LYS A 90 -0.740 4.763 8.345 1.00 0.00 C ATOM 1441 NZ LYS A 90 -0.359 3.447 8.903 1.00 0.00 N ATOM 0 H LYS A 90 -3.522 1.280 6.986 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.064 3.477 6.285 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.308 2.567 5.424 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.013 4.062 4.844 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.437 4.782 7.210 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.736 3.285 7.793 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.648 4.034 6.313 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.363 5.627 6.465 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.132 5.417 8.331 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.479 5.232 8.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.037 3.576 9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.199 2.836 8.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.353 3.003 8.289 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.800 1.223 3.888 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.312 0.891 2.577 1.00 0.00 C ATOM 1457 C HIS A 91 -6.830 0.786 2.625 1.00 0.00 C ATOM 1458 O HIS A 91 -7.512 1.166 1.675 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.676 -0.411 2.079 1.00 0.00 C ATOM 1460 CG HIS A 91 -4.399 -0.336 0.607 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -3.157 -0.324 0.021 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -5.323 -0.133 -0.379 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -3.328 -0.108 -1.289 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -4.629 0.034 -1.579 1.00 0.00 N ATOM 0 H HIS A 91 -4.283 0.471 4.345 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.050 1.682 1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -3.748 -0.598 2.620 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.341 -1.249 2.287 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -2.265 -0.456 0.498 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -6.395 -0.107 -0.253 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -2.528 -0.055 -2.013 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.371 0.270 3.727 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.809 0.111 3.899 1.00 0.00 C ATOM 1474 C LEU A 92 -9.485 1.463 4.009 1.00 0.00 C ATOM 1475 O LEU A 92 -10.527 1.677 3.384 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.108 -0.760 5.130 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.619 -2.196 4.901 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -8.509 -2.955 6.225 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.558 -2.929 3.937 1.00 0.00 C ATOM 0 H LEU A 92 -6.822 -0.049 4.525 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.212 -0.394 3.021 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.620 -0.339 6.009 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.179 -0.762 5.331 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.625 -2.152 4.455 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.160 -3.970 6.035 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.802 -2.445 6.879 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.487 -2.991 6.706 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.199 -3.947 3.783 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.563 -2.958 4.359 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.581 -2.404 2.982 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.935 2.360 4.829 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.538 3.679 4.974 1.00 0.00 C ATOM 1493 C VAL A 93 -9.347 4.450 3.669 1.00 0.00 C ATOM 1494 O VAL A 93 -10.294 5.068 3.202 1.00 0.00 O ATOM 1495 CB VAL A 93 -9.058 4.409 6.245 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.539 4.570 6.340 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.730 5.779 6.369 1.00 0.00 C ATOM 0 H VAL A 93 -8.096 2.202 5.387 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.612 3.587 5.138 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.353 3.767 7.075 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.286 5.093 7.262 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.068 3.587 6.339 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.180 5.145 5.486 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.377 6.277 7.272 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.481 6.387 5.499 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.811 5.650 6.424 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.172 4.364 3.040 1.00 0.00 N ATOM 1508 CA LEU A 94 -7.863 5.043 1.792 1.00 0.00 C ATOM 1509 C LEU A 94 -8.897 4.723 0.714 1.00 0.00 C ATOM 1510 O LEU A 94 -9.536 5.623 0.174 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.458 4.626 1.328 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.085 5.111 -0.077 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.096 6.641 -0.209 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.674 4.625 -0.417 1.00 0.00 C ATOM 0 H LEU A 94 -7.396 3.807 3.397 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.891 6.119 1.961 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.725 5.010 2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.388 3.539 1.354 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.835 4.706 -0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.824 6.920 -1.227 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.093 7.018 0.016 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.379 7.072 0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.402 4.967 -1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.966 5.026 0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.647 3.536 -0.386 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.039 3.434 0.406 1.00 0.00 N ATOM 1527 CA LEU A 95 -9.944 2.932 -0.614 1.00 0.00 C ATOM 1528 C LEU A 95 -11.370 3.380 -0.371 1.00 0.00 C ATOM 1529 O LEU A 95 -12.017 3.885 -1.282 1.00 0.00 O ATOM 1530 CB LEU A 95 -9.861 1.402 -0.623 1.00 0.00 C ATOM 1531 CG LEU A 95 -10.380 0.690 -1.882 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.682 1.138 -3.167 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -10.112 -0.811 -1.713 1.00 0.00 C ATOM 0 H LEU A 95 -8.512 2.696 0.874 1.00 0.00 H new ATOM 0 HA LEU A 95 -9.645 3.335 -1.581 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -8.819 1.117 -0.476 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.419 1.026 0.235 1.00 0.00 H new ATOM 0 HG LEU A 95 -11.438 0.933 -1.980 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -10.098 0.595 -4.015 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.835 2.208 -3.310 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.614 0.931 -3.092 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -10.470 -1.346 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.041 -0.979 -1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.634 -1.177 -0.829 1.00 0.00 H new ATOM 1545 N ALA A 96 -11.856 3.167 0.848 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.214 3.541 1.201 1.00 0.00 C ATOM 1547 C ALA A 96 -13.434 5.052 1.168 1.00 0.00 C ATOM 1548 O ALA A 96 -14.491 5.491 0.740 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.553 2.990 2.580 1.00 0.00 C ATOM 0 H ALA A 96 -11.326 2.737 1.606 1.00 0.00 H new ATOM 0 HA ALA A 96 -13.878 3.109 0.453 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.572 3.271 2.844 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.468 1.903 2.569 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.861 3.400 3.316 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.446 5.856 1.553 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.583 7.304 1.575 1.00 0.00 C ATOM 1557 C GLU A 97 -12.697 7.899 0.169 1.00 0.00 C ATOM 1558 O GLU A 97 -13.418 8.877 -0.011 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.406 7.891 2.359 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.543 9.376 2.706 1.00 0.00 C ATOM 1561 CD GLU A 97 -12.701 9.610 3.682 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -12.496 9.408 4.900 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -13.825 9.958 3.247 1.00 0.00 O ATOM 0 H GLU A 97 -11.532 5.520 1.857 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.516 7.568 2.074 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -11.285 7.326 3.283 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.494 7.751 1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.614 9.737 3.146 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.709 9.952 1.795 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.002 7.348 -0.834 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.080 7.864 -2.210 1.00 0.00 C ATOM 1572 C LEU A 98 -13.207 7.174 -2.981 1.00 0.00 C ATOM 1573 O LEU A 98 -13.606 7.638 -4.052 1.00 0.00 O ATOM 1574 CB LEU A 98 -10.748 7.706 -2.970 1.00 0.00 C ATOM 1575 CG LEU A 98 -9.698 8.757 -2.563 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.989 8.382 -1.263 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -8.617 8.935 -3.630 1.00 0.00 C ATOM 0 H LEU A 98 -11.381 6.547 -0.721 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.293 8.931 -2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.347 6.709 -2.787 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.935 7.782 -4.041 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.257 9.684 -2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.257 9.150 -1.013 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.721 8.303 -0.459 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.482 7.425 -1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.899 9.686 -3.299 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.103 7.987 -3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.077 9.260 -4.563 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.718 6.054 -2.464 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.783 5.267 -3.066 1.00 0.00 C ATOM 1591 C LEU A 99 -15.842 4.987 -1.983 1.00 0.00 C ATOM 1592 O LEU A 99 -16.148 3.815 -1.734 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.181 3.974 -3.669 1.00 0.00 C ATOM 1594 CG LEU A 99 -12.833 4.083 -4.416 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.402 2.681 -4.847 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -12.882 5.017 -5.626 1.00 0.00 C ATOM 0 H LEU A 99 -13.386 5.661 -1.583 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.269 5.801 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.058 3.254 -2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -14.913 3.555 -4.360 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.108 4.522 -3.730 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -11.451 2.739 -5.376 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.289 2.048 -3.967 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.158 2.254 -5.506 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.902 5.046 -6.103 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -13.622 4.651 -6.338 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -13.157 6.020 -5.300 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.444 6.018 -1.354 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.420 5.811 -0.291 1.00 0.00 C ATOM 1610 C PRO A 100 -18.697 5.159 -0.793 1.00 0.00 C ATOM 1611 O PRO A 100 -19.317 4.387 -0.058 1.00 0.00 O ATOM 1612 CB PRO A 100 -17.651 7.186 0.335 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.336 8.160 -0.799 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.212 7.445 -1.544 1.00 0.00 C ATOM 0 HA PRO A 100 -17.050 5.108 0.455 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.677 7.299 0.686 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.001 7.349 1.194 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.202 8.332 -1.439 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.019 9.133 -0.423 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.220 7.703 -2.603 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.238 7.737 -1.152 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.069 5.423 -2.047 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.267 4.821 -2.613 1.00 0.00 C ATOM 1624 C ASP A 101 -19.978 3.392 -3.084 1.00 0.00 C ATOM 1625 O ASP A 101 -20.868 2.713 -3.588 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.842 5.683 -3.738 1.00 0.00 C ATOM 1627 CG ASP A 101 -22.323 5.391 -4.007 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -23.050 4.873 -3.122 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -22.816 5.904 -5.035 1.00 0.00 O ATOM 0 H ASP A 101 -18.562 6.042 -2.679 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.026 4.768 -1.832 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.724 6.736 -3.481 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -20.270 5.512 -4.650 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.712 2.948 -3.024 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.319 1.606 -3.409 1.00 0.00 C ATOM 1636 C TRP A 102 -18.261 0.762 -2.140 1.00 0.00 C ATOM 1637 O TRP A 102 -18.917 -0.278 -2.087 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.983 1.616 -4.155 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.615 0.330 -4.815 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.449 -0.419 -5.560 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.338 -0.373 -4.826 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.786 -1.530 -6.027 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.465 -1.537 -5.640 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.083 -0.143 -4.232 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.394 -2.415 -5.867 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.984 -0.973 -4.512 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.135 -2.102 -5.335 1.00 0.00 C ATOM 0 H TRP A 102 -17.935 3.525 -2.702 1.00 0.00 H new ATOM 0 HA TRP A 102 -19.044 1.177 -4.100 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -17.014 2.399 -4.913 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.194 1.884 -3.452 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.484 -0.183 -5.761 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.220 -2.260 -6.592 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.962 0.685 -3.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.537 -3.318 -6.442 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.016 -0.741 -4.092 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.283 -2.727 -5.557 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.445 1.171 -1.157 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.313 0.466 0.111 1.00 0.00 C ATOM 1660 C LEU A 103 -18.109 1.260 1.132 1.00 0.00 C ATOM 1661 O LEU A 103 -17.763 2.402 1.430 1.00 0.00 O ATOM 1662 CB LEU A 103 -15.839 0.444 0.573 1.00 0.00 C ATOM 1663 CG LEU A 103 -14.932 -0.525 -0.203 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -13.441 -0.169 -0.034 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -15.184 -1.960 0.281 1.00 0.00 C ATOM 0 H LEU A 103 -16.860 2.003 -1.227 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.664 -0.561 0.007 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.431 1.451 0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -15.809 0.180 1.630 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.174 -0.441 -1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.832 -0.876 -0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -13.263 0.840 -0.407 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -13.172 -0.219 1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.541 -2.648 -0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -14.962 -2.029 1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -16.228 -2.224 0.110 1.00 0.00 H new ATOM 1677 N SER A 104 -19.078 0.609 1.761 1.00 0.00 N ATOM 1678 CA SER A 104 -19.925 1.231 2.777 1.00 0.00 C ATOM 1679 C SER A 104 -20.095 0.275 3.952 1.00 0.00 C ATOM 1680 O SER A 104 -19.966 -0.937 3.772 1.00 0.00 O ATOM 1681 CB SER A 104 -21.262 1.650 2.160 1.00 0.00 C ATOM 1682 OG SER A 104 -21.209 2.989 1.712 1.00 0.00 O ATOM 0 H SER A 104 -19.302 -0.370 1.582 1.00 0.00 H new ATOM 0 HA SER A 104 -19.454 2.137 3.158 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.505 0.992 1.326 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.058 1.539 2.896 1.00 0.00 H new ATOM 0 HG SER A 104 -20.432 3.108 1.127 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.412 0.789 5.145 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.574 -0.033 6.342 1.00 0.00 C ATOM 1690 C LEU A 105 -21.900 0.190 7.050 1.00 0.00 C ATOM 1691 O LEU A 105 -22.552 1.228 6.918 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.357 0.141 7.272 1.00 0.00 C ATOM 1693 CG LEU A 105 -19.264 1.486 8.023 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -20.068 1.494 9.334 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.795 1.770 8.368 1.00 0.00 C ATOM 0 H LEU A 105 -20.563 1.785 5.305 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.609 -1.075 6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -19.370 -0.663 8.008 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -18.451 0.016 6.679 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.681 2.247 7.364 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -19.965 2.465 9.818 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.120 1.306 9.117 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -19.690 0.716 9.997 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -17.723 2.719 8.899 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -17.409 0.970 9.000 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -17.209 1.822 7.450 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.290 -0.808 7.840 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.512 -0.804 8.615 1.00 0.00 C ATOM 1709 C HIS A 106 -23.228 -1.443 9.973 1.00 0.00 C ATOM 1710 O HIS A 106 -22.823 -2.608 10.048 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.645 -1.515 7.861 1.00 0.00 C ATOM 1712 CG HIS A 106 -25.081 -0.810 6.597 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.976 0.234 6.524 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -24.641 -1.065 5.326 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -26.065 0.608 5.236 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -25.292 -0.176 4.461 1.00 0.00 N ATOM 0 H HIS A 106 -21.744 -1.662 7.956 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.851 0.220 8.774 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -24.321 -2.525 7.608 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.504 -1.612 8.525 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -23.920 -1.817 5.041 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -26.672 1.424 4.873 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -25.199 -0.131 3.446 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.320 -0.653 11.045 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.105 -1.104 12.411 1.00 0.00 C ATOM 1726 C ARG A 107 -24.473 -1.532 12.905 1.00 0.00 C ATOM 1727 O ARG A 107 -25.393 -0.724 13.012 1.00 0.00 O ATOM 1728 CB ARG A 107 -22.480 -0.004 13.276 1.00 0.00 C ATOM 1729 CG ARG A 107 -21.756 -0.613 14.485 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.617 -1.221 15.598 1.00 0.00 C ATOM 1731 NE ARG A 107 -23.484 -0.218 16.234 1.00 0.00 N ATOM 1732 CZ ARG A 107 -24.233 -0.370 17.329 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -24.365 -1.561 17.898 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -24.846 0.690 17.842 1.00 0.00 N ATOM 0 H ARG A 107 -23.551 0.338 10.980 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.394 -1.929 12.465 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -21.778 0.579 12.681 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.255 0.682 13.617 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.085 -1.389 14.118 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.133 0.163 14.929 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -23.231 -2.021 15.185 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -21.971 -1.671 16.351 1.00 0.00 H new ATOM 0 HE ARG A 107 -23.517 0.699 15.788 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -23.892 -2.372 17.499 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -24.940 -1.666 18.734 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -24.741 1.603 17.400 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -25.422 0.591 18.678 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.631 -2.823 13.141 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.883 -3.405 13.595 1.00 0.00 C ATOM 1750 C ILE A 108 -25.702 -3.785 15.052 1.00 0.00 C ATOM 1751 O ILE A 108 -24.614 -4.191 15.463 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.252 -4.643 12.742 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.925 -4.523 11.239 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.732 -5.020 12.921 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.600 -3.360 10.502 1.00 0.00 C ATOM 0 H ILE A 108 -23.883 -3.506 13.021 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.699 -2.691 13.488 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.610 -5.436 13.126 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.845 -4.422 11.128 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -26.210 -5.454 10.749 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.962 -5.893 12.310 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.925 -5.250 13.969 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.360 -4.185 12.611 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.301 -3.371 9.454 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.683 -3.465 10.571 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.297 -2.417 10.956 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.792 -3.744 15.822 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.803 -4.094 17.244 1.00 0.00 C ATOM 1769 C ARG A 109 -26.126 -5.438 17.536 1.00 0.00 C ATOM 1770 O ARG A 109 -25.597 -5.615 18.630 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.239 -4.030 17.796 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.236 -4.948 17.070 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.692 -4.584 17.395 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.614 -5.367 16.555 1.00 0.00 N ATOM 1775 CZ ARG A 109 -31.884 -6.671 16.689 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -31.524 -7.334 17.779 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -32.511 -7.302 15.710 1.00 0.00 N ATOM 0 H ARG A 109 -27.706 -3.462 15.469 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.201 -3.352 17.769 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.222 -4.295 18.853 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.596 -3.002 17.731 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.076 -4.879 15.994 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -29.049 -5.984 17.354 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.896 -4.777 18.448 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.854 -3.519 17.229 1.00 0.00 H new ATOM 0 HE ARG A 109 -32.090 -4.870 15.802 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -31.034 -6.850 18.531 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -31.737 -8.328 17.865 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -32.782 -6.795 14.867 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -32.724 -8.296 15.798 1.00 0.00 H new ATOM 1791 N THR A 110 -26.134 -6.358 16.569 1.00 0.00 N ATOM 1792 CA THR A 110 -25.532 -7.670 16.680 1.00 0.00 C ATOM 1793 C THR A 110 -24.049 -7.671 16.267 1.00 0.00 C ATOM 1794 O THR A 110 -23.263 -8.371 16.904 1.00 0.00 O ATOM 1795 CB THR A 110 -26.412 -8.652 15.875 1.00 0.00 C ATOM 1796 OG1 THR A 110 -26.115 -10.002 16.138 1.00 0.00 O ATOM 1797 CG2 THR A 110 -26.363 -8.469 14.354 1.00 0.00 C ATOM 0 H THR A 110 -26.575 -6.197 15.664 1.00 0.00 H new ATOM 0 HA THR A 110 -25.505 -7.994 17.720 1.00 0.00 H new ATOM 0 HB THR A 110 -27.413 -8.400 16.225 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.702 -10.576 15.603 1.00 0.00 H new ATOM 0 HG21 THR A 110 -27.013 -9.204 13.878 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.701 -7.465 14.097 1.00 0.00 H new ATOM 0 HG23 THR A 110 -25.340 -8.608 14.004 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.635 -6.914 15.238 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.246 -6.864 14.743 1.00 0.00 C ATOM 1807 C ASP A 111 -22.121 -5.804 13.641 1.00 0.00 C ATOM 1808 O ASP A 111 -23.120 -5.237 13.193 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.809 -8.233 14.168 1.00 0.00 C ATOM 1810 CG ASP A 111 -20.301 -8.499 14.257 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.488 -7.558 14.405 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.922 -9.684 14.166 1.00 0.00 O ATOM 0 H ASP A 111 -24.267 -6.307 14.716 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.602 -6.610 15.585 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.338 -9.024 14.700 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -22.116 -8.291 13.124 1.00 0.00 H new ATOM 1817 N THR A 112 -20.905 -5.520 13.196 1.00 0.00 N ATOM 1818 CA THR A 112 -20.574 -4.560 12.159 1.00 0.00 C ATOM 1819 C THR A 112 -20.331 -5.331 10.863 1.00 0.00 C ATOM 1820 O THR A 112 -19.774 -6.432 10.879 1.00 0.00 O ATOM 1821 CB THR A 112 -19.336 -3.757 12.594 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.496 -3.294 13.920 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.119 -2.533 11.699 1.00 0.00 C ATOM 0 H THR A 112 -20.077 -5.982 13.573 1.00 0.00 H new ATOM 0 HA THR A 112 -21.385 -3.850 11.995 1.00 0.00 H new ATOM 0 HB THR A 112 -18.478 -4.425 12.516 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.702 -2.786 14.187 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.236 -1.989 12.035 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.975 -2.857 10.668 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.991 -1.881 11.756 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.765 -4.770 9.735 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.608 -5.383 8.426 1.00 0.00 C ATOM 1833 C TYR A 113 -20.320 -4.286 7.398 1.00 0.00 C ATOM 1834 O TYR A 113 -20.608 -3.108 7.635 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.913 -6.097 8.015 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.462 -7.158 8.955 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -23.143 -6.774 10.127 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.338 -8.526 8.639 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.702 -7.742 10.975 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.855 -9.503 9.508 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.542 -9.112 10.680 1.00 0.00 C ATOM 1842 OH TYR A 113 -24.063 -10.046 11.514 1.00 0.00 O ATOM 0 H TYR A 113 -21.240 -3.868 9.709 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.791 -6.104 8.466 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.683 -5.337 7.880 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.750 -6.562 7.043 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -23.235 -5.727 10.375 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.844 -8.825 7.726 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -24.254 -7.439 11.852 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.727 -10.551 9.280 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.866 -10.941 11.167 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.842 -4.685 6.224 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.519 -3.838 5.089 1.00 0.00 C ATOM 1854 C VAL A 114 -20.241 -4.429 3.888 1.00 0.00 C ATOM 1855 O VAL A 114 -20.419 -5.648 3.773 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.986 -3.730 4.891 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.512 -3.445 3.452 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.430 -2.593 5.752 1.00 0.00 C ATOM 0 H VAL A 114 -19.660 -5.670 6.031 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.852 -2.812 5.244 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.619 -4.718 5.171 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.424 -3.390 3.432 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.847 -4.246 2.793 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.929 -2.497 3.112 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.352 -2.522 5.609 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.898 -1.653 5.460 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.644 -2.793 6.802 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.704 -3.545 3.015 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.394 -3.853 1.783 1.00 0.00 C ATOM 1870 C LYS A 115 -20.497 -3.314 0.687 1.00 0.00 C ATOM 1871 O LYS A 115 -19.866 -2.266 0.858 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.793 -3.241 1.758 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.750 -4.055 2.649 1.00 0.00 C ATOM 1874 CD LYS A 115 -25.166 -4.118 2.071 1.00 0.00 C ATOM 1875 CE LYS A 115 -25.220 -5.045 0.847 1.00 0.00 C ATOM 1876 NZ LYS A 115 -26.588 -5.157 0.302 1.00 0.00 N ATOM 0 H LYS A 115 -20.599 -2.541 3.161 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.563 -4.923 1.659 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.752 -2.209 2.106 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -23.169 -3.218 0.735 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.362 -5.067 2.766 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -23.785 -3.610 3.643 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.858 -4.476 2.833 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.492 -3.117 1.788 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -24.551 -4.666 0.074 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -24.857 -6.035 1.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -26.582 -5.791 -0.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -27.222 -5.543 1.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -26.925 -4.216 0.013 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.439 -4.033 -0.430 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.607 -3.640 -1.548 1.00 0.00 C ATOM 1892 C LEU A 116 -20.310 -3.885 -2.863 1.00 0.00 C ATOM 1893 O LEU A 116 -20.660 -5.031 -3.175 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.308 -4.449 -1.520 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.435 -4.167 -2.747 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -17.076 -2.686 -2.834 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.212 -5.068 -2.729 1.00 0.00 C ATOM 0 H LEU A 116 -20.964 -4.895 -0.579 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.395 -2.574 -1.460 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.750 -4.210 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.543 -5.513 -1.478 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.998 -4.398 -3.651 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.456 -2.513 -3.714 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -17.988 -2.094 -2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -16.527 -2.392 -1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -15.596 -4.862 -3.604 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -15.633 -4.878 -1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -16.528 -6.111 -2.745 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.436 -2.833 -3.666 1.00 0.00 N ATOM 1910 CA ASP A 117 -21.074 -2.954 -4.959 1.00 0.00 C ATOM 1911 C ASP A 117 -20.045 -3.252 -6.036 1.00 0.00 C ATOM 1912 O ASP A 117 -19.453 -2.363 -6.641 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.928 -1.725 -5.307 1.00 0.00 C ATOM 1914 CG ASP A 117 -23.397 -2.063 -5.097 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.884 -3.032 -5.737 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -24.052 -1.436 -4.237 1.00 0.00 O ATOM 0 H ASP A 117 -20.105 -1.895 -3.440 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.764 -3.797 -4.908 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.643 -0.880 -4.680 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.755 -1.428 -6.341 1.00 0.00 H new ATOM 1921 N LYS A 118 -19.842 -4.530 -6.357 1.00 0.00 N ATOM 1922 CA LYS A 118 -18.895 -4.904 -7.413 1.00 0.00 C ATOM 1923 C LYS A 118 -19.413 -4.458 -8.791 1.00 0.00 C ATOM 1924 O LYS A 118 -18.720 -4.661 -9.788 1.00 0.00 O ATOM 1925 CB LYS A 118 -18.622 -6.410 -7.419 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.293 -6.992 -6.033 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.476 -7.699 -5.363 1.00 0.00 C ATOM 1928 CE LYS A 118 -19.893 -8.940 -6.162 1.00 0.00 C ATOM 1929 NZ LYS A 118 -21.142 -9.522 -5.654 1.00 0.00 N ATOM 0 H LYS A 118 -20.313 -5.316 -5.909 1.00 0.00 H new ATOM 0 HA LYS A 118 -17.956 -4.391 -7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -19.495 -6.925 -7.820 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -17.792 -6.616 -8.095 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.468 -7.698 -6.132 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -17.948 -6.187 -5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.205 -7.989 -4.348 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -20.319 -7.012 -5.284 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.017 -8.672 -7.211 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -19.099 -9.686 -6.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.391 -10.358 -6.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -21.016 -9.801 -4.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -21.905 -8.819 -5.722 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.644 -3.942 -8.851 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.313 -3.450 -10.035 1.00 0.00 C ATOM 1945 C ALA A 119 -20.704 -2.128 -10.507 1.00 0.00 C ATOM 1946 O ALA A 119 -20.778 -1.833 -11.705 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.790 -3.216 -9.685 1.00 0.00 C ATOM 0 H ALA A 119 -21.226 -3.856 -8.018 1.00 0.00 H new ATOM 0 HA ALA A 119 -21.203 -4.183 -10.835 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -23.318 -2.844 -10.563 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -23.240 -4.154 -9.362 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.862 -2.483 -8.881 1.00 0.00 H new ATOM 1953 N VAL A 120 -20.124 -1.332 -9.601 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.534 -0.043 -9.948 1.00 0.00 C ATOM 1955 C VAL A 120 -18.351 -0.277 -10.895 1.00 0.00 C ATOM 1956 O VAL A 120 -17.589 -1.235 -10.717 1.00 0.00 O ATOM 1957 CB VAL A 120 -19.163 0.721 -8.659 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.848 2.186 -8.923 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -20.318 0.761 -7.651 1.00 0.00 C ATOM 0 H VAL A 120 -20.053 -1.566 -8.611 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.244 0.589 -10.480 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.300 0.179 -8.273 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -18.593 2.678 -7.984 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -18.006 2.259 -9.611 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.719 2.672 -9.363 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -20.006 1.309 -6.762 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -21.177 1.258 -8.101 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.593 -0.256 -7.372 1.00 0.00 H new ATOM 1969 N ASP A 121 -18.200 0.589 -11.901 1.00 0.00 N ATOM 1970 CA ASP A 121 -17.150 0.526 -12.906 1.00 0.00 C ATOM 1971 C ASP A 121 -15.797 0.822 -12.277 1.00 0.00 C ATOM 1972 O ASP A 121 -15.373 1.975 -12.154 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.454 1.427 -14.110 1.00 0.00 C ATOM 1974 CG ASP A 121 -18.283 0.651 -15.133 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -17.690 -0.184 -15.856 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -19.527 0.818 -15.185 1.00 0.00 O ATOM 0 H ASP A 121 -18.831 1.379 -12.038 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.113 -0.490 -13.299 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.997 2.315 -13.785 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.525 1.770 -14.565 1.00 0.00 H new ATOM 1981 N LEU A 122 -15.100 -0.266 -11.935 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.780 -0.315 -11.312 1.00 0.00 C ATOM 1983 C LEU A 122 -12.776 0.567 -12.053 1.00 0.00 C ATOM 1984 O LEU A 122 -11.892 1.143 -11.432 1.00 0.00 O ATOM 1985 CB LEU A 122 -13.325 -1.787 -11.249 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.277 -2.173 -10.185 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.892 -1.565 -10.370 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.765 -1.899 -8.761 1.00 0.00 C ATOM 0 H LEU A 122 -15.473 -1.201 -12.099 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.836 0.085 -10.300 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.209 -2.404 -11.087 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -12.924 -2.055 -12.226 1.00 0.00 H new ATOM 0 HG LEU A 122 -12.161 -3.246 -10.340 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.236 -1.903 -9.567 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.482 -1.879 -11.330 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.966 -0.478 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -11.991 -2.188 -8.049 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.983 -0.837 -8.649 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.669 -2.477 -8.569 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.927 0.698 -13.371 1.00 0.00 N ATOM 2001 CA ALA A 123 -12.077 1.511 -14.223 1.00 0.00 C ATOM 2002 C ALA A 123 -11.906 2.910 -13.626 1.00 0.00 C ATOM 2003 O ALA A 123 -10.786 3.317 -13.300 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.723 1.579 -15.613 1.00 0.00 C ATOM 0 H ALA A 123 -13.669 0.224 -13.886 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.084 1.069 -14.301 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -12.103 2.185 -16.273 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -12.813 0.573 -16.022 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.713 2.027 -15.532 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.024 3.618 -13.444 1.00 0.00 N ATOM 2011 CA GLY A 124 -12.987 4.963 -12.896 1.00 0.00 C ATOM 2012 C GLY A 124 -12.566 4.971 -11.430 1.00 0.00 C ATOM 2013 O GLY A 124 -12.043 5.976 -10.946 1.00 0.00 O ATOM 0 H GLY A 124 -13.959 3.278 -13.669 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.293 5.572 -13.476 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -13.971 5.421 -12.993 1.00 0.00 H new ATOM 2017 N LEU A 125 -12.793 3.865 -10.710 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.426 3.742 -9.309 1.00 0.00 C ATOM 2019 C LEU A 125 -10.906 3.741 -9.213 1.00 0.00 C ATOM 2020 O LEU A 125 -10.352 4.592 -8.524 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.075 2.520 -8.636 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.619 2.538 -8.644 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -15.160 1.309 -7.905 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.222 3.791 -7.996 1.00 0.00 C ATOM 0 H LEU A 125 -13.239 3.031 -11.092 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.815 4.595 -8.752 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.731 1.617 -9.140 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.729 2.461 -7.604 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.912 2.534 -9.694 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -16.250 1.329 -7.915 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.809 0.403 -8.400 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.806 1.320 -6.874 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.310 3.735 -8.038 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.902 3.853 -6.956 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.884 4.677 -8.533 1.00 0.00 H new ATOM 2036 N THR A 126 -10.204 2.834 -9.900 1.00 0.00 N ATOM 2037 CA THR A 126 -8.743 2.807 -9.866 1.00 0.00 C ATOM 2038 C THR A 126 -8.162 4.143 -10.361 1.00 0.00 C ATOM 2039 O THR A 126 -7.111 4.564 -9.866 1.00 0.00 O ATOM 2040 CB THR A 126 -8.254 1.605 -10.691 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.541 0.423 -9.976 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.754 1.602 -10.981 1.00 0.00 C ATOM 0 H THR A 126 -10.625 2.112 -10.484 1.00 0.00 H new ATOM 0 HA THR A 126 -8.390 2.685 -8.842 1.00 0.00 H new ATOM 0 HB THR A 126 -8.771 1.670 -11.649 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.236 -0.353 -10.491 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.498 0.719 -11.567 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.490 2.499 -11.542 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.202 1.586 -10.041 1.00 0.00 H new ATOM 2050 N ALA A 127 -8.827 4.820 -11.306 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.357 6.093 -11.828 1.00 0.00 C ATOM 2052 C ALA A 127 -8.376 7.155 -10.725 1.00 0.00 C ATOM 2053 O ALA A 127 -7.317 7.683 -10.360 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.192 6.506 -13.043 1.00 0.00 C ATOM 0 H ALA A 127 -9.700 4.496 -11.723 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.325 5.990 -12.163 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.831 7.461 -13.425 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.103 5.747 -13.820 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.237 6.605 -12.750 1.00 0.00 H new ATOM 2060 N ARG A 128 -9.563 7.450 -10.179 1.00 0.00 N ATOM 2061 CA ARG A 128 -9.725 8.455 -9.128 1.00 0.00 C ATOM 2062 C ARG A 128 -8.867 8.134 -7.908 1.00 0.00 C ATOM 2063 O ARG A 128 -8.255 9.036 -7.339 1.00 0.00 O ATOM 2064 CB ARG A 128 -11.219 8.652 -8.780 1.00 0.00 C ATOM 2065 CG ARG A 128 -11.871 7.561 -7.924 1.00 0.00 C ATOM 2066 CD ARG A 128 -13.275 7.974 -7.465 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.321 7.671 -8.456 1.00 0.00 N ATOM 2068 CZ ARG A 128 -15.569 7.277 -8.168 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -15.954 7.100 -6.907 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.413 7.053 -9.168 1.00 0.00 N ATOM 0 H ARG A 128 -10.435 6.998 -10.455 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.362 9.410 -9.508 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -11.325 9.604 -8.259 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.778 8.734 -9.712 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -11.931 6.635 -8.496 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -11.247 7.358 -7.054 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -13.510 7.464 -6.531 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -13.282 9.043 -7.254 1.00 0.00 H new ATOM 0 HE ARG A 128 -14.076 7.769 -9.441 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -15.296 7.264 -6.145 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -16.907 6.800 -6.702 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -16.107 7.181 -10.132 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.368 6.752 -8.972 1.00 0.00 H new ATOM 2084 N LEU A 129 -8.781 6.848 -7.556 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.031 6.350 -6.421 1.00 0.00 C ATOM 2086 C LEU A 129 -6.569 6.766 -6.495 1.00 0.00 C ATOM 2087 O LEU A 129 -6.091 7.438 -5.588 1.00 0.00 O ATOM 2088 CB LEU A 129 -8.182 4.824 -6.346 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.449 4.173 -5.165 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.099 4.591 -3.840 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -7.499 2.653 -5.367 1.00 0.00 C ATOM 0 H LEU A 129 -9.251 6.108 -8.077 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.433 6.789 -5.508 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.242 4.579 -6.280 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.811 4.388 -7.274 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.410 4.500 -5.124 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.569 4.122 -3.011 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.049 5.675 -3.736 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.142 4.274 -3.830 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.985 2.159 -4.542 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.538 2.324 -5.397 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.010 2.394 -6.306 1.00 0.00 H new ATOM 2103 N ALA A 130 -5.859 6.359 -7.553 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.445 6.684 -7.711 1.00 0.00 C ATOM 2105 C ALA A 130 -4.180 8.179 -7.886 1.00 0.00 C ATOM 2106 O ALA A 130 -3.099 8.648 -7.526 1.00 0.00 O ATOM 2107 CB ALA A 130 -3.868 5.895 -8.888 1.00 0.00 C ATOM 0 H ALA A 130 -6.247 5.801 -8.314 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.946 6.398 -6.785 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -2.812 6.138 -9.006 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -3.976 4.827 -8.698 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.405 6.157 -9.800 1.00 0.00 H new ATOM 2113 N HIS A 131 -5.155 8.927 -8.407 1.00 0.00 N ATOM 2114 CA HIS A 131 -4.991 10.357 -8.620 1.00 0.00 C ATOM 2115 C HIS A 131 -5.028 11.166 -7.320 1.00 0.00 C ATOM 2116 O HIS A 131 -4.666 12.342 -7.358 1.00 0.00 O ATOM 2117 CB HIS A 131 -6.056 10.865 -9.601 1.00 0.00 C ATOM 2118 CG HIS A 131 -5.607 12.093 -10.352 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -6.033 13.382 -10.154 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -4.641 12.134 -11.317 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -5.356 14.185 -10.986 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -4.511 13.464 -11.743 1.00 0.00 N ATOM 0 H HIS A 131 -6.065 8.561 -8.688 1.00 0.00 H new ATOM 0 HA HIS A 131 -3.998 10.505 -9.045 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.297 10.075 -10.313 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -6.971 11.091 -9.054 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -4.077 11.291 -11.687 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -5.472 15.257 -11.041 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -3.898 13.814 -12.479 1.00 0.00 H new ATOM 2130 N HIS A 132 -5.461 10.568 -6.199 1.00 0.00 N ATOM 2131 CA HIS A 132 -5.574 11.180 -4.881 1.00 0.00 C ATOM 2132 C HIS A 132 -6.098 12.617 -4.954 1.00 0.00 C ATOM 2133 O HIS A 132 -5.374 13.571 -4.687 1.00 0.00 O ATOM 2134 CB HIS A 132 -4.243 11.036 -4.140 1.00 0.00 C ATOM 2135 CG HIS A 132 -3.930 9.603 -3.794 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -4.755 8.700 -3.158 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -2.827 8.924 -4.214 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -4.148 7.503 -3.207 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -2.941 7.597 -3.787 1.00 0.00 N ATOM 0 H HIS A 132 -5.756 9.592 -6.196 1.00 0.00 H new ATOM 0 HA HIS A 132 -6.328 10.651 -4.298 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -3.441 11.441 -4.757 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -4.273 11.629 -3.226 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -5.658 8.903 -2.730 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -2.006 9.339 -4.779 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -4.575 6.586 -2.829 1.00 0.00 H new ATOM 2147 N VAL A 133 -7.382 12.758 -5.278 1.00 0.00 N ATOM 2148 CA VAL A 133 -8.059 14.044 -5.423 1.00 0.00 C ATOM 2149 C VAL A 133 -7.994 14.902 -4.153 1.00 0.00 C ATOM 2150 O VAL A 133 -7.508 16.026 -4.202 1.00 0.00 O ATOM 2151 CB VAL A 133 -9.484 13.828 -5.969 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -10.074 15.148 -6.485 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -9.502 12.772 -7.098 1.00 0.00 C ATOM 0 H VAL A 133 -7.995 11.961 -5.451 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.520 14.638 -6.161 1.00 0.00 H new ATOM 0 HB VAL A 133 -10.096 13.461 -5.145 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -11.080 14.973 -6.866 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -10.115 15.871 -5.670 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.446 15.539 -7.286 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.522 12.644 -7.460 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.865 13.105 -7.917 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -9.132 11.822 -6.713 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.461 14.373 -3.023 1.00 0.00 N ATOM 2164 CA HIS A 134 -8.464 15.046 -1.719 1.00 0.00 C ATOM 2165 C HIS A 134 -7.506 14.333 -0.750 1.00 0.00 C ATOM 2166 O HIS A 134 -7.573 14.526 0.469 1.00 0.00 O ATOM 2167 CB HIS A 134 -9.911 15.071 -1.190 1.00 0.00 C ATOM 2168 CG HIS A 134 -10.554 13.703 -1.153 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -10.195 12.650 -0.338 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -11.547 13.261 -1.987 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -10.963 11.601 -0.667 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -11.778 11.911 -1.690 1.00 0.00 N ATOM 0 H HIS A 134 -8.861 13.435 -2.986 1.00 0.00 H new ATOM 0 HA HIS A 134 -8.108 16.072 -1.815 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -9.917 15.496 -0.186 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -10.510 15.730 -1.819 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.059 13.846 -2.737 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -10.931 10.639 -0.177 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -12.435 11.287 -2.158 1.00 0.00 H new ATOM 2180 N ALA A 135 -6.679 13.435 -1.287 1.00 0.00 N ATOM 2181 CA ALA A 135 -5.718 12.623 -0.571 1.00 0.00 C ATOM 2182 C ALA A 135 -4.291 12.983 -0.967 1.00 0.00 C ATOM 2183 O ALA A 135 -4.033 13.953 -1.670 1.00 0.00 O ATOM 2184 CB ALA A 135 -6.056 11.145 -0.839 1.00 0.00 C ATOM 0 H ALA A 135 -6.668 13.251 -2.290 1.00 0.00 H new ATOM 0 HA ALA A 135 -5.779 12.811 0.501 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -5.347 10.508 -0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -7.066 10.933 -0.487 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -5.995 10.946 -1.909 1.00 0.00 H new ATOM 2190 N GLU A 136 -3.366 12.151 -0.508 1.00 0.00 N ATOM 2191 CA GLU A 136 -1.938 12.261 -0.750 1.00 0.00 C ATOM 2192 C GLU A 136 -1.313 10.881 -0.954 1.00 0.00 C ATOM 2193 O GLU A 136 -0.248 10.765 -1.563 1.00 0.00 O ATOM 2194 CB GLU A 136 -1.285 12.966 0.441 1.00 0.00 C ATOM 2195 CG GLU A 136 -1.255 12.139 1.736 1.00 0.00 C ATOM 2196 CD GLU A 136 -0.770 12.969 2.923 1.00 0.00 C ATOM 2197 OE1 GLU A 136 0.262 13.665 2.798 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -1.416 12.884 3.995 1.00 0.00 O ATOM 0 H GLU A 136 -3.604 11.345 0.070 1.00 0.00 H new ATOM 0 HA GLU A 136 -1.773 12.841 -1.658 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -0.263 13.233 0.172 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.818 13.897 0.632 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -2.253 11.753 1.945 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -0.601 11.277 1.603 1.00 0.00 H new ATOM 2205 N GLY A 137 -1.984 9.832 -0.478 1.00 0.00 N ATOM 2206 CA GLY A 137 -1.562 8.451 -0.549 1.00 0.00 C ATOM 2207 C GLY A 137 -1.360 7.942 0.867 1.00 0.00 C ATOM 2208 O GLY A 137 -0.215 7.722 1.276 1.00 0.00 O ATOM 0 H GLY A 137 -2.884 9.939 -0.009 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.311 7.851 -1.065 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.637 8.365 -1.119 1.00 0.00 H new ATOM 2212 N LEU A 138 -2.481 7.813 1.591 1.00 0.00 N ATOM 2213 CA LEU A 138 -2.579 7.328 2.971 1.00 0.00 C ATOM 2214 C LEU A 138 -1.777 6.047 3.082 1.00 0.00 C ATOM 2215 O LEU A 138 -0.869 6.009 3.936 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.050 7.076 3.383 1.00 0.00 C ATOM 2217 CG LEU A 138 -4.765 8.298 3.983 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -4.950 9.410 2.942 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -6.129 7.865 4.531 1.00 0.00 C ATOM 0 H LEU A 138 -3.393 8.059 1.206 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.182 8.087 3.645 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.606 6.740 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.076 6.263 4.109 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.147 8.697 4.788 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.459 10.258 3.401 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.975 9.729 2.573 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.548 9.035 2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.640 8.728 4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.731 7.450 3.723 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -5.987 7.109 5.303 1.00 0.00 H new