USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 912 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 105 ASN : amide:sc= -11.2! C(o=-11!,f=-15!) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 160:sc= -1.68 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 173:sc= 0.19 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 53:sc= 0.819 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.174 K(o=0.17,f=-1.1!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.0847 X(o=-0.085,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -3.04 K(o=-3,f=-8!) USER MOD Single : A 67 LYS NZ :NH3+ -108:sc= -6.98! (180deg=-12.6!) USER MOD Single : A 77 TYR OH : rot 72:sc= 0.178 USER MOD Single : A 82 LYS NZ :NH3+ -97:sc= -0.0743 (180deg=-1.3) USER MOD Single : A 85 CYS SG : rot -104:sc= -2.05 USER MOD Single : A 90 LYS NZ :NH3+ -113:sc= -1.12 (180deg=-4.31!) USER MOD Single : A 91 THR OG1 : rot 80:sc= -1.31 USER MOD Single : A 94 SER OG : rot -173:sc= -1.79 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 102 N MET A 8 -3.836 6.966 -11.428 1.00 0.00 N ATOM 103 CA MET A 8 -2.657 7.399 -10.686 1.00 0.00 C ATOM 104 C MET A 8 -1.956 6.212 -10.033 1.00 0.00 C ATOM 105 O MET A 8 -2.449 5.648 -9.057 1.00 0.00 O ATOM 106 CB MET A 8 -3.041 8.430 -9.622 1.00 0.00 C ATOM 107 CG MET A 8 -1.965 9.474 -9.371 1.00 0.00 C ATOM 108 SD MET A 8 -2.484 11.137 -9.837 1.00 0.00 S ATOM 109 CE MET A 8 -1.475 12.127 -8.737 1.00 0.00 C ATOM 0 HA MET A 8 -1.968 7.861 -11.393 1.00 0.00 H new ATOM 0 HB2 MET A 8 -3.958 8.932 -9.929 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.258 7.912 -8.688 1.00 0.00 H new ATOM 0 HG2 MET A 8 -1.695 9.465 -8.315 1.00 0.00 H new ATOM 0 HG3 MET A 8 -1.069 9.208 -9.931 1.00 0.00 H new ATOM 0 HE1 MET A 8 -1.682 13.184 -8.905 1.00 0.00 H new ATOM 0 HE2 MET A 8 -1.706 11.872 -7.703 1.00 0.00 H new ATOM 0 HE3 MET A 8 -0.421 11.929 -8.933 1.00 0.00 H new ATOM 119 N ARG A 9 -0.808 5.831 -10.585 1.00 0.00 N ATOM 120 CA ARG A 9 -0.047 4.702 -10.053 1.00 0.00 C ATOM 121 C ARG A 9 1.302 5.135 -9.485 1.00 0.00 C ATOM 122 O ARG A 9 1.952 6.039 -10.009 1.00 0.00 O ATOM 123 CB ARG A 9 0.152 3.637 -11.140 1.00 0.00 C ATOM 124 CG ARG A 9 1.330 3.904 -12.069 1.00 0.00 C ATOM 125 CD ARG A 9 2.538 3.057 -11.700 1.00 0.00 C ATOM 126 NE ARG A 9 3.215 2.528 -12.882 1.00 0.00 N ATOM 127 CZ ARG A 9 4.500 2.178 -12.912 1.00 0.00 C ATOM 128 NH1 ARG A 9 5.252 2.293 -11.826 1.00 0.00 N ATOM 129 NH2 ARG A 9 5.032 1.710 -14.032 1.00 0.00 N ATOM 0 H ARG A 9 -0.385 6.283 -11.396 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.625 4.277 -9.232 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.294 2.668 -10.662 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.758 3.568 -11.736 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.038 3.693 -13.098 1.00 0.00 H new ATOM 0 HG3 ARG A 9 1.598 4.960 -12.024 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.238 3.657 -11.119 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.221 2.231 -11.063 1.00 0.00 H new ATOM 0 HE ARG A 9 2.670 2.420 -13.737 1.00 0.00 H new ATOM 0 HH11 ARG A 9 4.847 2.651 -10.961 1.00 0.00 H new ATOM 0 HH12 ARG A 9 6.235 2.023 -11.856 1.00 0.00 H new ATOM 0 HH21 ARG A 9 4.458 1.618 -14.870 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.016 1.442 -14.056 1.00 0.00 H new ATOM 143 N LEU A 10 1.722 4.456 -8.420 1.00 0.00 N ATOM 144 CA LEU A 10 3.009 4.740 -7.785 1.00 0.00 C ATOM 145 C LEU A 10 3.899 3.504 -7.838 1.00 0.00 C ATOM 146 O LEU A 10 3.423 2.395 -8.079 1.00 0.00 O ATOM 147 CB LEU A 10 2.855 5.205 -6.320 1.00 0.00 C ATOM 148 CG LEU A 10 1.425 5.279 -5.771 1.00 0.00 C ATOM 149 CD1 LEU A 10 1.442 5.380 -4.247 1.00 0.00 C ATOM 150 CD2 LEU A 10 0.690 6.467 -6.367 1.00 0.00 C ATOM 0 H LEU A 10 1.191 3.706 -7.978 1.00 0.00 H new ATOM 0 HA LEU A 10 3.468 5.557 -8.342 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.429 4.530 -5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.308 6.192 -6.226 1.00 0.00 H new ATOM 0 HG LEU A 10 0.901 4.366 -6.053 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.419 5.432 -3.874 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.936 4.503 -3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.983 6.278 -3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.323 6.506 -5.967 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.216 7.386 -6.111 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.649 6.363 -7.451 1.00 0.00 H new ATOM 162 N ARG A 11 5.192 3.702 -7.612 1.00 0.00 N ATOM 163 CA ARG A 11 6.144 2.600 -7.638 1.00 0.00 C ATOM 164 C ARG A 11 6.655 2.293 -6.234 1.00 0.00 C ATOM 165 O ARG A 11 6.790 3.191 -5.401 1.00 0.00 O ATOM 166 CB ARG A 11 7.316 2.937 -8.564 1.00 0.00 C ATOM 167 CG ARG A 11 7.695 1.803 -9.504 1.00 0.00 C ATOM 168 CD ARG A 11 8.230 0.599 -8.744 1.00 0.00 C ATOM 169 NE ARG A 11 9.426 0.043 -9.373 1.00 0.00 N ATOM 170 CZ ARG A 11 10.106 -0.991 -8.886 1.00 0.00 C ATOM 171 NH1 ARG A 11 9.712 -1.588 -7.767 1.00 0.00 N ATOM 172 NH2 ARG A 11 11.183 -1.436 -9.520 1.00 0.00 N ATOM 0 H ARG A 11 5.604 4.613 -7.409 1.00 0.00 H new ATOM 0 HA ARG A 11 5.634 1.715 -8.019 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.060 3.817 -9.154 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.183 3.200 -7.958 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.823 1.507 -10.088 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.448 2.152 -10.210 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.461 0.890 -7.719 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.458 -0.169 -8.691 1.00 0.00 H new ATOM 0 HE ARG A 11 9.759 0.473 -10.236 1.00 0.00 H new ATOM 0 HH11 ARG A 11 8.883 -1.254 -7.275 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.238 -2.381 -7.399 1.00 0.00 H new ATOM 0 HH21 ARG A 11 11.490 -0.985 -10.382 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.704 -2.229 -9.146 1.00 0.00 H new ATOM 186 N ILE A 12 6.945 1.021 -5.979 1.00 0.00 N ATOM 187 CA ILE A 12 7.449 0.594 -4.680 1.00 0.00 C ATOM 188 C ILE A 12 8.462 -0.533 -4.865 1.00 0.00 C ATOM 189 O ILE A 12 8.094 -1.683 -5.111 1.00 0.00 O ATOM 190 CB ILE A 12 6.290 0.164 -3.735 1.00 0.00 C ATOM 191 CG1 ILE A 12 5.943 1.309 -2.784 1.00 0.00 C ATOM 192 CG2 ILE A 12 6.627 -1.094 -2.939 1.00 0.00 C ATOM 193 CD1 ILE A 12 4.528 1.246 -2.251 1.00 0.00 C ATOM 0 H ILE A 12 6.839 0.267 -6.657 1.00 0.00 H new ATOM 0 HA ILE A 12 7.949 1.439 -4.206 1.00 0.00 H new ATOM 0 HB ILE A 12 5.429 -0.071 -4.361 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.639 1.297 -1.945 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.085 2.257 -3.303 1.00 0.00 H new ATOM 0 HG21 ILE A 12 5.787 -1.353 -2.295 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.825 -1.917 -3.626 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.511 -0.912 -2.327 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.353 2.090 -1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 12 3.824 1.289 -3.082 1.00 0.00 H new ATOM 0 HD13 ILE A 12 4.387 0.314 -1.703 1.00 0.00 H new ATOM 205 N ARG A 13 9.742 -0.188 -4.767 1.00 0.00 N ATOM 206 CA ARG A 13 10.809 -1.166 -4.944 1.00 0.00 C ATOM 207 C ARG A 13 11.376 -1.625 -3.605 1.00 0.00 C ATOM 208 O ARG A 13 11.289 -0.919 -2.601 1.00 0.00 O ATOM 209 CB ARG A 13 11.931 -0.594 -5.817 1.00 0.00 C ATOM 210 CG ARG A 13 12.491 0.725 -5.310 1.00 0.00 C ATOM 211 CD ARG A 13 13.492 1.323 -6.287 1.00 0.00 C ATOM 212 NE ARG A 13 14.788 1.567 -5.663 1.00 0.00 N ATOM 213 CZ ARG A 13 15.717 0.629 -5.484 1.00 0.00 C ATOM 214 NH1 ARG A 13 15.493 -0.619 -5.879 1.00 0.00 N ATOM 215 NH2 ARG A 13 16.871 0.938 -4.910 1.00 0.00 N ATOM 0 H ARG A 13 10.065 0.759 -4.567 1.00 0.00 H new ATOM 0 HA ARG A 13 10.375 -2.032 -5.445 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.740 -1.322 -5.876 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.554 -0.453 -6.830 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.675 1.429 -5.149 1.00 0.00 H new ATOM 0 HG3 ARG A 13 12.973 0.569 -4.345 1.00 0.00 H new ATOM 0 HD2 ARG A 13 13.619 0.649 -7.134 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.098 2.259 -6.682 1.00 0.00 H new ATOM 0 HE ARG A 13 14.995 2.513 -5.344 1.00 0.00 H new ATOM 0 HH11 ARG A 13 14.607 -0.863 -6.321 1.00 0.00 H new ATOM 0 HH12 ARG A 13 16.207 -1.334 -5.740 1.00 0.00 H new ATOM 0 HH21 ARG A 13 17.049 1.895 -4.605 1.00 0.00 H new ATOM 0 HH22 ARG A 13 17.581 0.219 -4.774 1.00 0.00 H new ATOM 229 N PHE A 14 11.963 -2.814 -3.614 1.00 0.00 N ATOM 230 CA PHE A 14 12.564 -3.399 -2.425 1.00 0.00 C ATOM 231 C PHE A 14 13.889 -4.054 -2.799 1.00 0.00 C ATOM 232 O PHE A 14 13.990 -4.725 -3.826 1.00 0.00 O ATOM 233 CB PHE A 14 11.622 -4.434 -1.797 1.00 0.00 C ATOM 234 CG PHE A 14 10.732 -3.874 -0.720 1.00 0.00 C ATOM 235 CD1 PHE A 14 9.826 -2.862 -1.003 1.00 0.00 C ATOM 236 CD2 PHE A 14 10.797 -4.363 0.577 1.00 0.00 C ATOM 237 CE1 PHE A 14 9.008 -2.348 -0.016 1.00 0.00 C ATOM 238 CE2 PHE A 14 9.980 -3.853 1.567 1.00 0.00 C ATOM 239 CZ PHE A 14 9.085 -2.844 1.271 1.00 0.00 C ATOM 0 H PHE A 14 12.036 -3.399 -4.446 1.00 0.00 H new ATOM 0 HA PHE A 14 12.741 -2.611 -1.693 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.000 -4.867 -2.580 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.217 -5.245 -1.378 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.760 -2.471 -2.008 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.495 -5.152 0.815 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.309 -1.559 -0.250 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.041 -4.243 2.572 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.446 -2.443 2.044 1.00 0.00 H new ATOM 249 N GLU A 15 14.904 -3.840 -1.974 1.00 0.00 N ATOM 250 CA GLU A 15 16.237 -4.394 -2.224 1.00 0.00 C ATOM 251 C GLU A 15 16.184 -5.840 -2.717 1.00 0.00 C ATOM 252 O GLU A 15 17.069 -6.287 -3.445 1.00 0.00 O ATOM 253 CB GLU A 15 17.100 -4.325 -0.957 1.00 0.00 C ATOM 254 CG GLU A 15 18.054 -3.142 -0.914 1.00 0.00 C ATOM 255 CD GLU A 15 17.471 -1.881 -1.526 1.00 0.00 C ATOM 256 OE1 GLU A 15 17.582 -1.712 -2.759 1.00 0.00 O ATOM 257 OE2 GLU A 15 16.905 -1.062 -0.771 1.00 0.00 O ATOM 0 H GLU A 15 14.834 -3.285 -1.121 1.00 0.00 H new ATOM 0 HA GLU A 15 16.683 -3.784 -3.010 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.445 -4.280 -0.087 1.00 0.00 H new ATOM 0 HB3 GLU A 15 17.677 -5.246 -0.874 1.00 0.00 H new ATOM 0 HG2 GLU A 15 18.328 -2.942 0.122 1.00 0.00 H new ATOM 0 HG3 GLU A 15 18.971 -3.404 -1.442 1.00 0.00 H new ATOM 264 N SER A 16 15.157 -6.573 -2.305 1.00 0.00 N ATOM 265 CA SER A 16 15.018 -7.970 -2.700 1.00 0.00 C ATOM 266 C SER A 16 13.658 -8.249 -3.335 1.00 0.00 C ATOM 267 O SER A 16 13.204 -9.393 -3.353 1.00 0.00 O ATOM 268 CB SER A 16 15.212 -8.878 -1.484 1.00 0.00 C ATOM 269 OG SER A 16 16.015 -8.249 -0.500 1.00 0.00 O ATOM 0 H SER A 16 14.412 -6.226 -1.701 1.00 0.00 H new ATOM 0 HA SER A 16 15.785 -8.178 -3.446 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.242 -9.132 -1.058 1.00 0.00 H new ATOM 0 HB3 SER A 16 15.678 -9.813 -1.795 1.00 0.00 H new ATOM 0 HG SER A 16 16.122 -8.849 0.267 1.00 0.00 H new ATOM 275 N ALA A 17 13.006 -7.214 -3.860 1.00 0.00 N ATOM 276 CA ALA A 17 11.695 -7.404 -4.492 1.00 0.00 C ATOM 277 C ALA A 17 11.174 -6.129 -5.153 1.00 0.00 C ATOM 278 O ALA A 17 11.512 -5.020 -4.745 1.00 0.00 O ATOM 279 CB ALA A 17 10.685 -7.920 -3.472 1.00 0.00 C ATOM 0 H ALA A 17 13.351 -6.254 -3.863 1.00 0.00 H new ATOM 0 HA ALA A 17 11.825 -8.145 -5.281 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.717 -8.056 -3.955 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.028 -8.874 -3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.587 -7.199 -2.660 1.00 0.00 H new ATOM 285 N GLU A 18 10.338 -6.307 -6.178 1.00 0.00 N ATOM 286 CA GLU A 18 9.752 -5.181 -6.908 1.00 0.00 C ATOM 287 C GLU A 18 8.231 -5.310 -6.978 1.00 0.00 C ATOM 288 O GLU A 18 7.701 -6.417 -7.063 1.00 0.00 O ATOM 289 CB GLU A 18 10.334 -5.104 -8.322 1.00 0.00 C ATOM 290 CG GLU A 18 10.227 -6.409 -9.095 1.00 0.00 C ATOM 291 CD GLU A 18 11.582 -6.993 -9.447 1.00 0.00 C ATOM 292 OE1 GLU A 18 12.490 -6.213 -9.806 1.00 0.00 O ATOM 293 OE2 GLU A 18 11.736 -8.230 -9.363 1.00 0.00 O ATOM 0 H GLU A 18 10.051 -7.223 -6.522 1.00 0.00 H new ATOM 0 HA GLU A 18 9.997 -4.265 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 18 9.818 -4.320 -8.876 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.383 -4.813 -8.259 1.00 0.00 H new ATOM 0 HG2 GLU A 18 9.667 -7.133 -8.503 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.660 -6.239 -10.010 1.00 0.00 H new ATOM 300 N CYS A 19 7.531 -4.176 -6.937 1.00 0.00 N ATOM 301 CA CYS A 19 6.062 -4.189 -6.994 1.00 0.00 C ATOM 302 C CYS A 19 5.499 -2.808 -7.340 1.00 0.00 C ATOM 303 O CYS A 19 6.079 -1.784 -6.976 1.00 0.00 O ATOM 304 CB CYS A 19 5.461 -4.674 -5.659 1.00 0.00 C ATOM 305 SG CYS A 19 6.647 -4.847 -4.301 1.00 0.00 S ATOM 0 H CYS A 19 7.946 -3.247 -6.866 1.00 0.00 H new ATOM 0 HA CYS A 19 5.780 -4.884 -7.785 1.00 0.00 H new ATOM 0 HB2 CYS A 19 4.682 -3.975 -5.354 1.00 0.00 H new ATOM 0 HB3 CYS A 19 4.978 -5.637 -5.824 1.00 0.00 H new ATOM 0 HG CYS A 19 6.012 -4.837 -3.167 1.00 0.00 H new ATOM 311 N GLU A 20 4.357 -2.786 -8.035 1.00 0.00 N ATOM 312 CA GLU A 20 3.714 -1.530 -8.414 1.00 0.00 C ATOM 313 C GLU A 20 2.225 -1.582 -8.087 1.00 0.00 C ATOM 314 O GLU A 20 1.655 -2.663 -7.938 1.00 0.00 O ATOM 315 CB GLU A 20 3.914 -1.239 -9.906 1.00 0.00 C ATOM 316 CG GLU A 20 5.177 -1.849 -10.488 1.00 0.00 C ATOM 317 CD GLU A 20 5.852 -0.942 -11.500 1.00 0.00 C ATOM 318 OE1 GLU A 20 5.189 -0.557 -12.487 1.00 0.00 O ATOM 319 OE2 GLU A 20 7.042 -0.617 -11.303 1.00 0.00 O ATOM 0 H GLU A 20 3.862 -3.623 -8.344 1.00 0.00 H new ATOM 0 HA GLU A 20 4.178 -0.725 -7.843 1.00 0.00 H new ATOM 0 HB2 GLU A 20 3.053 -1.615 -10.458 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.941 -0.160 -10.055 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.875 -2.069 -9.680 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.931 -2.798 -10.964 1.00 0.00 H new ATOM 326 N VAL A 21 1.600 -0.416 -7.963 1.00 0.00 N ATOM 327 CA VAL A 21 0.179 -0.352 -7.636 1.00 0.00 C ATOM 328 C VAL A 21 -0.454 0.952 -8.124 1.00 0.00 C ATOM 329 O VAL A 21 0.192 1.999 -8.157 1.00 0.00 O ATOM 330 CB VAL A 21 -0.056 -0.521 -6.110 1.00 0.00 C ATOM 331 CG1 VAL A 21 1.256 -0.421 -5.346 1.00 0.00 C ATOM 332 CG2 VAL A 21 -1.064 0.489 -5.573 1.00 0.00 C ATOM 0 H VAL A 21 2.050 0.491 -8.083 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.304 -1.180 -8.156 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.475 -1.516 -5.958 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.066 -0.542 -4.280 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.935 -1.203 -5.685 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.708 0.555 -5.525 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.198 0.335 -4.502 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.697 1.500 -5.751 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -2.019 0.355 -6.081 1.00 0.00 H new ATOM 342 N GLU A 22 -1.731 0.870 -8.487 1.00 0.00 N ATOM 343 CA GLU A 22 -2.479 2.031 -8.959 1.00 0.00 C ATOM 344 C GLU A 22 -3.238 2.668 -7.802 1.00 0.00 C ATOM 345 O GLU A 22 -3.133 2.213 -6.664 1.00 0.00 O ATOM 346 CB GLU A 22 -3.449 1.626 -10.071 1.00 0.00 C ATOM 347 CG GLU A 22 -2.855 1.740 -11.465 1.00 0.00 C ATOM 348 CD GLU A 22 -3.170 0.539 -12.333 1.00 0.00 C ATOM 349 OE1 GLU A 22 -4.354 0.355 -12.686 1.00 0.00 O ATOM 350 OE2 GLU A 22 -2.233 -0.219 -12.662 1.00 0.00 O ATOM 0 H GLU A 22 -2.272 0.006 -8.463 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.776 2.759 -9.363 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.771 0.598 -9.905 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -4.339 2.252 -10.012 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.236 2.641 -11.946 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.774 1.854 -11.387 1.00 0.00 H new ATOM 357 N LEU A 23 -3.999 3.723 -8.083 1.00 0.00 N ATOM 358 CA LEU A 23 -4.754 4.394 -7.033 1.00 0.00 C ATOM 359 C LEU A 23 -6.064 4.964 -7.567 1.00 0.00 C ATOM 360 O LEU A 23 -6.095 5.623 -8.607 1.00 0.00 O ATOM 361 CB LEU A 23 -3.907 5.504 -6.399 1.00 0.00 C ATOM 362 CG LEU A 23 -4.647 6.455 -5.451 1.00 0.00 C ATOM 363 CD1 LEU A 23 -4.684 5.887 -4.037 1.00 0.00 C ATOM 364 CD2 LEU A 23 -3.984 7.822 -5.457 1.00 0.00 C ATOM 0 H LEU A 23 -4.107 4.125 -9.014 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.000 3.655 -6.270 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.088 5.040 -5.850 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.460 6.095 -7.199 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.674 6.562 -5.801 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.214 6.578 -3.381 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.199 4.926 -4.044 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -3.666 5.750 -3.673 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.518 8.489 -4.780 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.949 7.726 -5.129 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -4.008 8.234 -6.466 1.00 0.00 H new ATOM 376 N TYR A 24 -7.142 4.713 -6.831 1.00 0.00 N ATOM 377 CA TYR A 24 -8.464 5.209 -7.212 1.00 0.00 C ATOM 378 C TYR A 24 -8.944 6.268 -6.218 1.00 0.00 C ATOM 379 O TYR A 24 -8.741 6.139 -5.011 1.00 0.00 O ATOM 380 CB TYR A 24 -9.474 4.054 -7.306 1.00 0.00 C ATOM 381 CG TYR A 24 -8.988 2.894 -8.146 1.00 0.00 C ATOM 382 CD1 TYR A 24 -8.280 3.110 -9.321 1.00 0.00 C ATOM 383 CD2 TYR A 24 -9.240 1.582 -7.764 1.00 0.00 C ATOM 384 CE1 TYR A 24 -7.836 2.053 -10.091 1.00 0.00 C ATOM 385 CE2 TYR A 24 -8.799 0.519 -8.529 1.00 0.00 C ATOM 386 CZ TYR A 24 -8.098 0.760 -9.691 1.00 0.00 C ATOM 387 OH TYR A 24 -7.657 -0.296 -10.456 1.00 0.00 O ATOM 0 H TYR A 24 -7.128 4.170 -5.968 1.00 0.00 H new ATOM 0 HA TYR A 24 -8.386 5.671 -8.196 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.699 3.696 -6.301 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.407 4.431 -7.726 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -8.073 4.122 -9.638 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -9.790 1.390 -6.854 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.286 2.238 -11.002 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -9.003 -0.495 -8.218 1.00 0.00 H new ATOM 0 HH TYR A 24 -7.923 -1.139 -10.034 1.00 0.00 H new ATOM 397 N GLU A 25 -9.567 7.324 -6.741 1.00 0.00 N ATOM 398 CA GLU A 25 -10.062 8.426 -5.907 1.00 0.00 C ATOM 399 C GLU A 25 -11.043 7.963 -4.824 1.00 0.00 C ATOM 400 O GLU A 25 -11.424 8.753 -3.960 1.00 0.00 O ATOM 401 CB GLU A 25 -10.733 9.507 -6.763 1.00 0.00 C ATOM 402 CG GLU A 25 -9.781 10.269 -7.679 1.00 0.00 C ATOM 403 CD GLU A 25 -10.511 11.211 -8.616 1.00 0.00 C ATOM 404 OE1 GLU A 25 -11.692 10.944 -8.922 1.00 0.00 O ATOM 405 OE2 GLU A 25 -9.902 12.214 -9.044 1.00 0.00 O ATOM 0 H GLU A 25 -9.742 7.442 -7.739 1.00 0.00 H new ATOM 0 HA GLU A 25 -9.184 8.838 -5.409 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -11.508 9.041 -7.372 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -11.230 10.218 -6.103 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.076 10.838 -7.073 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.198 9.558 -8.264 1.00 0.00 H new ATOM 412 N GLU A 26 -11.468 6.700 -4.873 1.00 0.00 N ATOM 413 CA GLU A 26 -12.419 6.177 -3.891 1.00 0.00 C ATOM 414 C GLU A 26 -12.036 6.589 -2.467 1.00 0.00 C ATOM 415 O GLU A 26 -12.900 6.738 -1.604 1.00 0.00 O ATOM 416 CB GLU A 26 -12.501 4.649 -3.991 1.00 0.00 C ATOM 417 CG GLU A 26 -11.286 3.927 -3.427 1.00 0.00 C ATOM 418 CD GLU A 26 -11.274 2.451 -3.774 1.00 0.00 C ATOM 419 OE1 GLU A 26 -12.316 1.789 -3.588 1.00 0.00 O ATOM 420 OE2 GLU A 26 -10.221 1.958 -4.231 1.00 0.00 O ATOM 0 H GLU A 26 -11.171 6.024 -5.577 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.396 6.604 -4.115 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.391 4.308 -3.463 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.624 4.369 -5.037 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.379 4.394 -3.811 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.270 4.042 -2.343 1.00 0.00 H new ATOM 427 N TRP A 27 -10.743 6.801 -2.234 1.00 0.00 N ATOM 428 CA TRP A 27 -10.269 7.225 -0.926 1.00 0.00 C ATOM 429 C TRP A 27 -10.511 8.725 -0.766 1.00 0.00 C ATOM 430 O TRP A 27 -11.205 9.151 0.155 1.00 0.00 O ATOM 431 CB TRP A 27 -8.781 6.880 -0.767 1.00 0.00 C ATOM 432 CG TRP A 27 -8.104 7.552 0.391 1.00 0.00 C ATOM 433 CD1 TRP A 27 -6.784 7.888 0.473 1.00 0.00 C ATOM 434 CD2 TRP A 27 -8.701 7.961 1.630 1.00 0.00 C ATOM 435 NE1 TRP A 27 -6.522 8.481 1.683 1.00 0.00 N ATOM 436 CE2 TRP A 27 -7.682 8.539 2.410 1.00 0.00 C ATOM 437 CE3 TRP A 27 -9.995 7.898 2.156 1.00 0.00 C ATOM 438 CZ2 TRP A 27 -7.918 9.048 3.686 1.00 0.00 C ATOM 439 CZ3 TRP A 27 -10.226 8.404 3.420 1.00 0.00 C ATOM 440 CH2 TRP A 27 -9.192 8.973 4.172 1.00 0.00 C ATOM 0 H TRP A 27 -10.010 6.686 -2.933 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.817 6.698 -0.145 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -8.682 5.801 -0.652 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -8.258 7.152 -1.684 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.052 7.713 -0.301 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.612 8.823 1.991 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -10.800 7.461 1.584 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -7.122 9.486 4.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -11.222 8.360 3.835 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -9.406 9.361 5.157 1.00 0.00 H new ATOM 451 N ALA A 28 -9.965 9.516 -1.697 1.00 0.00 N ATOM 452 CA ALA A 28 -10.148 10.973 -1.687 1.00 0.00 C ATOM 453 C ALA A 28 -9.032 11.690 -2.446 1.00 0.00 C ATOM 454 O ALA A 28 -7.870 11.636 -2.046 1.00 0.00 O ATOM 455 CB ALA A 28 -10.227 11.514 -0.262 1.00 0.00 C ATOM 0 H ALA A 28 -9.392 9.172 -2.468 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.093 11.171 -2.193 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.362 12.595 -0.290 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.070 11.056 0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.305 11.278 0.269 1.00 0.00 H new ATOM 461 N PRO A 29 -9.369 12.381 -3.557 1.00 0.00 N ATOM 462 CA PRO A 29 -8.383 13.113 -4.355 1.00 0.00 C ATOM 463 C PRO A 29 -7.435 13.940 -3.487 1.00 0.00 C ATOM 464 O PRO A 29 -6.257 14.096 -3.811 1.00 0.00 O ATOM 465 CB PRO A 29 -9.223 14.041 -5.248 1.00 0.00 C ATOM 466 CG PRO A 29 -10.661 13.777 -4.917 1.00 0.00 C ATOM 467 CD PRO A 29 -10.722 12.505 -4.112 1.00 0.00 C ATOM 0 HA PRO A 29 -7.748 12.430 -4.919 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -8.970 15.085 -5.066 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -9.027 13.845 -6.302 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -11.081 14.608 -4.351 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -11.251 13.681 -5.828 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -11.474 12.564 -3.325 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -10.980 11.648 -4.735 1.00 0.00 H new ATOM 475 N GLU A 30 -7.962 14.473 -2.387 1.00 0.00 N ATOM 476 CA GLU A 30 -7.172 15.291 -1.472 1.00 0.00 C ATOM 477 C GLU A 30 -5.983 14.514 -0.914 1.00 0.00 C ATOM 478 O GLU A 30 -4.842 14.971 -0.992 1.00 0.00 O ATOM 479 CB GLU A 30 -8.048 15.794 -0.322 1.00 0.00 C ATOM 480 CG GLU A 30 -8.963 16.943 -0.711 1.00 0.00 C ATOM 481 CD GLU A 30 -10.413 16.520 -0.831 1.00 0.00 C ATOM 482 OE1 GLU A 30 -10.819 15.582 -0.113 1.00 0.00 O ATOM 483 OE2 GLU A 30 -11.144 17.126 -1.644 1.00 0.00 O ATOM 0 H GLU A 30 -8.936 14.352 -2.108 1.00 0.00 H new ATOM 0 HA GLU A 30 -6.788 16.142 -2.035 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.654 14.968 0.050 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.406 16.114 0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.880 17.736 0.032 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.631 17.361 -1.661 1.00 0.00 H new ATOM 490 N THR A 31 -6.250 13.339 -0.354 1.00 0.00 N ATOM 491 CA THR A 31 -5.181 12.509 0.213 1.00 0.00 C ATOM 492 C THR A 31 -4.188 12.112 -0.876 1.00 0.00 C ATOM 493 O THR A 31 -2.976 12.206 -0.686 1.00 0.00 O ATOM 494 CB THR A 31 -5.752 11.256 0.895 1.00 0.00 C ATOM 495 OG1 THR A 31 -7.145 11.146 0.662 1.00 0.00 O ATOM 496 CG2 THR A 31 -5.531 11.238 2.396 1.00 0.00 C ATOM 0 H THR A 31 -7.185 12.939 -0.278 1.00 0.00 H new ATOM 0 HA THR A 31 -4.662 13.097 0.970 1.00 0.00 H new ATOM 0 HB THR A 31 -5.213 10.417 0.455 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.468 10.289 1.010 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.958 10.327 2.816 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.462 11.268 2.607 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.014 12.106 2.845 1.00 0.00 H new ATOM 504 N VAL A 32 -4.712 11.681 -2.020 1.00 0.00 N ATOM 505 CA VAL A 32 -3.875 11.283 -3.149 1.00 0.00 C ATOM 506 C VAL A 32 -2.777 12.315 -3.413 1.00 0.00 C ATOM 507 O VAL A 32 -1.685 11.972 -3.867 1.00 0.00 O ATOM 508 CB VAL A 32 -4.720 11.110 -4.429 1.00 0.00 C ATOM 509 CG1 VAL A 32 -3.836 10.813 -5.632 1.00 0.00 C ATOM 510 CG2 VAL A 32 -5.757 10.012 -4.237 1.00 0.00 C ATOM 0 H VAL A 32 -5.714 11.598 -2.190 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.415 10.330 -2.888 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.241 12.048 -4.621 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.457 10.696 -6.520 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.139 11.637 -5.783 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.278 9.893 -5.455 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.344 9.903 -5.149 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.254 9.071 -4.015 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.416 10.275 -3.410 1.00 0.00 H new ATOM 520 N ARG A 33 -3.080 13.577 -3.132 1.00 0.00 N ATOM 521 CA ARG A 33 -2.126 14.661 -3.345 1.00 0.00 C ATOM 522 C ARG A 33 -0.880 14.480 -2.481 1.00 0.00 C ATOM 523 O ARG A 33 0.233 14.775 -2.914 1.00 0.00 O ATOM 524 CB ARG A 33 -2.780 16.015 -3.043 1.00 0.00 C ATOM 525 CG ARG A 33 -2.110 17.194 -3.737 1.00 0.00 C ATOM 526 CD ARG A 33 -2.893 17.641 -4.962 1.00 0.00 C ATOM 527 NE ARG A 33 -3.169 16.532 -5.872 1.00 0.00 N ATOM 528 CZ ARG A 33 -4.154 16.533 -6.768 1.00 0.00 C ATOM 529 NH1 ARG A 33 -4.957 17.583 -6.881 1.00 0.00 N ATOM 530 NH2 ARG A 33 -4.335 15.480 -7.554 1.00 0.00 N ATOM 0 H ARG A 33 -3.980 13.876 -2.756 1.00 0.00 H new ATOM 0 HA ARG A 33 -1.822 14.636 -4.391 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -3.827 15.977 -3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.764 16.183 -1.966 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.021 18.026 -3.038 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -1.098 16.916 -4.033 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -3.833 18.093 -4.646 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -2.331 18.411 -5.490 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.571 15.707 -5.818 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -4.822 18.396 -6.280 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.710 17.578 -7.569 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.720 14.670 -7.472 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.089 15.480 -8.241 1.00 0.00 H new ATOM 544 N ALA A 34 -1.073 13.997 -1.255 1.00 0.00 N ATOM 545 CA ALA A 34 0.042 13.783 -0.337 1.00 0.00 C ATOM 546 C ALA A 34 0.944 12.654 -0.819 1.00 0.00 C ATOM 547 O ALA A 34 2.165 12.801 -0.861 1.00 0.00 O ATOM 548 CB ALA A 34 -0.472 13.493 1.063 1.00 0.00 C ATOM 0 H ALA A 34 -1.987 13.748 -0.876 1.00 0.00 H new ATOM 0 HA ALA A 34 0.635 14.697 -0.309 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.372 13.336 1.735 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.064 14.338 1.415 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.093 12.597 1.044 1.00 0.00 H new ATOM 554 N ILE A 35 0.338 11.532 -1.195 1.00 0.00 N ATOM 555 CA ILE A 35 1.107 10.389 -1.687 1.00 0.00 C ATOM 556 C ILE A 35 2.013 10.834 -2.836 1.00 0.00 C ATOM 557 O ILE A 35 3.221 10.595 -2.814 1.00 0.00 O ATOM 558 CB ILE A 35 0.217 9.223 -2.190 1.00 0.00 C ATOM 559 CG1 ILE A 35 -1.230 9.360 -1.706 1.00 0.00 C ATOM 560 CG2 ILE A 35 0.796 7.889 -1.738 1.00 0.00 C ATOM 561 CD1 ILE A 35 -1.371 9.340 -0.200 1.00 0.00 C ATOM 0 H ILE A 35 -0.671 11.388 -1.170 1.00 0.00 H new ATOM 0 HA ILE A 35 1.688 10.022 -0.841 1.00 0.00 H new ATOM 0 HB ILE A 35 0.206 9.263 -3.279 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.645 10.292 -2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.824 8.549 -2.129 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.163 7.077 -2.097 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.801 7.772 -2.144 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.839 7.861 -0.649 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.423 9.441 0.068 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.987 8.397 0.189 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.806 10.167 0.229 1.00 0.00 H new ATOM 573 N ALA A 36 1.421 11.500 -3.837 1.00 0.00 N ATOM 574 CA ALA A 36 2.179 11.994 -4.981 1.00 0.00 C ATOM 575 C ALA A 36 3.222 13.007 -4.529 1.00 0.00 C ATOM 576 O ALA A 36 4.271 13.151 -5.149 1.00 0.00 O ATOM 577 CB ALA A 36 1.247 12.610 -6.013 1.00 0.00 C ATOM 0 H ALA A 36 0.423 11.706 -3.872 1.00 0.00 H new ATOM 0 HA ALA A 36 2.694 11.152 -5.444 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.830 12.973 -6.859 1.00 0.00 H new ATOM 0 HB2 ALA A 36 0.537 11.858 -6.357 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.704 13.441 -5.563 1.00 0.00 H new ATOM 583 N ASP A 37 2.933 13.712 -3.442 1.00 0.00 N ATOM 584 CA ASP A 37 3.873 14.698 -2.919 1.00 0.00 C ATOM 585 C ASP A 37 5.090 14.004 -2.299 1.00 0.00 C ATOM 586 O ASP A 37 6.173 14.584 -2.217 1.00 0.00 O ATOM 587 CB ASP A 37 3.192 15.587 -1.880 1.00 0.00 C ATOM 588 CG ASP A 37 3.893 16.923 -1.715 1.00 0.00 C ATOM 589 OD1 ASP A 37 4.240 17.543 -2.743 1.00 0.00 O ATOM 590 OD2 ASP A 37 4.095 17.347 -0.557 1.00 0.00 O ATOM 0 H ASP A 37 2.067 13.622 -2.911 1.00 0.00 H new ATOM 0 HA ASP A 37 4.210 15.321 -3.747 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.156 15.757 -2.174 1.00 0.00 H new ATOM 0 HB3 ASP A 37 3.171 15.070 -0.921 1.00 0.00 H new ATOM 595 N ALA A 38 4.894 12.763 -1.854 1.00 0.00 N ATOM 596 CA ALA A 38 5.949 11.978 -1.230 1.00 0.00 C ATOM 597 C ALA A 38 6.601 11.010 -2.224 1.00 0.00 C ATOM 598 O ALA A 38 6.733 9.819 -1.948 1.00 0.00 O ATOM 599 CB ALA A 38 5.369 11.215 -0.047 1.00 0.00 C ATOM 0 H ALA A 38 3.999 12.278 -1.918 1.00 0.00 H new ATOM 0 HA ALA A 38 6.729 12.658 -0.886 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.154 10.625 0.425 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.961 11.921 0.676 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.576 10.553 -0.395 1.00 0.00 H new ATOM 605 N LEU A 39 7.024 11.536 -3.373 1.00 0.00 N ATOM 606 CA LEU A 39 7.683 10.724 -4.404 1.00 0.00 C ATOM 607 C LEU A 39 8.990 10.120 -3.840 1.00 0.00 C ATOM 608 O LEU A 39 9.106 10.019 -2.619 1.00 0.00 O ATOM 609 CB LEU A 39 7.891 11.555 -5.677 1.00 0.00 C ATOM 610 CG LEU A 39 6.610 12.134 -6.295 1.00 0.00 C ATOM 611 CD1 LEU A 39 6.834 12.453 -7.764 1.00 0.00 C ATOM 612 CD2 LEU A 39 5.439 11.164 -6.143 1.00 0.00 C ATOM 0 H LEU A 39 6.923 12.521 -3.617 1.00 0.00 H new ATOM 0 HA LEU A 39 7.048 9.884 -4.687 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.569 12.377 -5.448 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.385 10.932 -6.422 1.00 0.00 H new ATOM 0 HG LEU A 39 6.363 13.053 -5.763 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.919 12.863 -8.191 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.638 13.183 -7.859 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.107 11.542 -8.297 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.545 11.600 -6.589 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.676 10.226 -6.646 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.260 10.973 -5.085 1.00 0.00 H new ATOM 624 N PRO A 40 9.987 9.671 -4.666 1.00 0.00 N ATOM 625 CA PRO A 40 11.217 9.066 -4.150 1.00 0.00 C ATOM 626 C PRO A 40 11.598 9.534 -2.751 1.00 0.00 C ATOM 627 O PRO A 40 12.027 10.670 -2.549 1.00 0.00 O ATOM 628 CB PRO A 40 12.245 9.496 -5.181 1.00 0.00 C ATOM 629 CG PRO A 40 11.496 9.471 -6.473 1.00 0.00 C ATOM 630 CD PRO A 40 10.030 9.688 -6.146 1.00 0.00 C ATOM 0 HA PRO A 40 11.123 7.987 -4.028 1.00 0.00 H new ATOM 0 HB2 PRO A 40 12.634 10.491 -4.965 1.00 0.00 H new ATOM 0 HB3 PRO A 40 13.098 8.817 -5.201 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.860 10.249 -7.144 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.640 8.518 -6.983 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.668 10.636 -6.545 1.00 0.00 H new ATOM 0 HD3 PRO A 40 9.405 8.903 -6.573 1.00 0.00 H new ATOM 638 N ILE A 41 11.433 8.630 -1.791 1.00 0.00 N ATOM 639 CA ILE A 41 11.749 8.903 -0.395 1.00 0.00 C ATOM 640 C ILE A 41 12.225 7.623 0.282 1.00 0.00 C ATOM 641 O ILE A 41 11.871 6.525 -0.139 1.00 0.00 O ATOM 642 CB ILE A 41 10.519 9.469 0.363 1.00 0.00 C ATOM 643 CG1 ILE A 41 10.332 10.959 0.049 1.00 0.00 C ATOM 644 CG2 ILE A 41 10.664 9.259 1.866 1.00 0.00 C ATOM 645 CD1 ILE A 41 9.168 11.594 0.782 1.00 0.00 C ATOM 0 H ILE A 41 11.077 7.689 -1.959 1.00 0.00 H new ATOM 0 HA ILE A 41 12.539 9.653 -0.366 1.00 0.00 H new ATOM 0 HB ILE A 41 9.635 8.928 0.025 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.247 11.493 0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.183 11.079 -1.024 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.790 9.664 2.376 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.747 8.193 2.078 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.559 9.770 2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 41 9.098 12.647 0.510 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.244 11.086 0.507 1.00 0.00 H new ATOM 0 HD13 ILE A 41 9.324 11.506 1.857 1.00 0.00 H new ATOM 657 N LYS A 42 13.030 7.765 1.329 1.00 0.00 N ATOM 658 CA LYS A 42 13.541 6.601 2.042 1.00 0.00 C ATOM 659 C LYS A 42 12.593 6.185 3.165 1.00 0.00 C ATOM 660 O LYS A 42 12.142 7.016 3.954 1.00 0.00 O ATOM 661 CB LYS A 42 14.942 6.879 2.596 1.00 0.00 C ATOM 662 CG LYS A 42 16.046 6.701 1.564 1.00 0.00 C ATOM 663 CD LYS A 42 17.349 6.242 2.203 1.00 0.00 C ATOM 664 CE LYS A 42 18.068 7.391 2.891 1.00 0.00 C ATOM 665 NZ LYS A 42 17.843 7.385 4.362 1.00 0.00 N ATOM 0 H LYS A 42 13.340 8.663 1.699 1.00 0.00 H new ATOM 0 HA LYS A 42 13.607 5.776 1.333 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.976 7.898 2.982 1.00 0.00 H new ATOM 0 HB3 LYS A 42 15.131 6.213 3.438 1.00 0.00 H new ATOM 0 HG2 LYS A 42 15.731 5.972 0.817 1.00 0.00 H new ATOM 0 HG3 LYS A 42 16.210 7.643 1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 42 17.142 5.455 2.928 1.00 0.00 H new ATOM 0 HD3 LYS A 42 17.997 5.811 1.440 1.00 0.00 H new ATOM 0 HE2 LYS A 42 19.137 7.325 2.687 1.00 0.00 H new ATOM 0 HE3 LYS A 42 17.722 8.337 2.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 18.350 8.184 4.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 16.825 7.474 4.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 18.196 6.493 4.764 1.00 0.00 H new ATOM 679 N SER A 43 12.292 4.890 3.221 1.00 0.00 N ATOM 680 CA SER A 43 11.390 4.345 4.231 1.00 0.00 C ATOM 681 C SER A 43 11.879 2.982 4.722 1.00 0.00 C ATOM 682 O SER A 43 12.496 2.229 3.969 1.00 0.00 O ATOM 683 CB SER A 43 9.973 4.216 3.662 1.00 0.00 C ATOM 684 OG SER A 43 9.943 4.537 2.283 1.00 0.00 O ATOM 0 H SER A 43 12.663 4.195 2.574 1.00 0.00 H new ATOM 0 HA SER A 43 11.375 5.032 5.077 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.611 3.199 3.809 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.298 4.877 4.206 1.00 0.00 H new ATOM 0 HG SER A 43 10.618 4.007 1.809 1.00 0.00 H new ATOM 690 N THR A 44 11.599 2.670 5.985 1.00 0.00 N ATOM 691 CA THR A 44 12.013 1.393 6.569 1.00 0.00 C ATOM 692 C THR A 44 10.830 0.429 6.637 1.00 0.00 C ATOM 693 O THR A 44 9.761 0.777 7.136 1.00 0.00 O ATOM 694 CB THR A 44 12.594 1.608 7.968 1.00 0.00 C ATOM 695 OG1 THR A 44 13.001 2.954 8.140 1.00 0.00 O ATOM 696 CG2 THR A 44 13.790 0.726 8.262 1.00 0.00 C ATOM 0 H THR A 44 11.089 3.280 6.623 1.00 0.00 H new ATOM 0 HA THR A 44 12.784 0.959 5.932 1.00 0.00 H new ATOM 0 HB THR A 44 11.791 1.346 8.658 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.368 3.072 9.041 1.00 0.00 H new ATOM 0 HG21 THR A 44 14.153 0.929 9.270 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.497 -0.321 8.186 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.582 0.935 7.542 1.00 0.00 H new ATOM 704 N ALA A 45 11.024 -0.778 6.111 1.00 0.00 N ATOM 705 CA ALA A 45 9.966 -1.783 6.089 1.00 0.00 C ATOM 706 C ALA A 45 9.986 -2.692 7.313 1.00 0.00 C ATOM 707 O ALA A 45 11.025 -3.238 7.686 1.00 0.00 O ATOM 708 CB ALA A 45 10.064 -2.629 4.825 1.00 0.00 C ATOM 0 H ALA A 45 11.904 -1.083 5.695 1.00 0.00 H new ATOM 0 HA ALA A 45 9.022 -1.239 6.103 1.00 0.00 H new ATOM 0 HB1 ALA A 45 9.268 -3.374 4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 45 9.963 -1.988 3.949 1.00 0.00 H new ATOM 0 HB3 ALA A 45 11.031 -3.131 4.797 1.00 0.00 H new ATOM 714 N ASN A 46 8.810 -2.878 7.902 1.00 0.00 N ATOM 715 CA ASN A 46 8.649 -3.757 9.055 1.00 0.00 C ATOM 716 C ASN A 46 8.069 -5.089 8.578 1.00 0.00 C ATOM 717 O ASN A 46 7.095 -5.101 7.826 1.00 0.00 O ATOM 718 CB ASN A 46 7.726 -3.118 10.095 1.00 0.00 C ATOM 719 CG ASN A 46 8.455 -2.135 10.989 1.00 0.00 C ATOM 720 OD1 ASN A 46 9.611 -2.349 11.353 1.00 0.00 O ATOM 721 ND2 ASN A 46 7.779 -1.050 11.350 1.00 0.00 N ATOM 0 H ASN A 46 7.947 -2.428 7.597 1.00 0.00 H new ATOM 0 HA ASN A 46 9.618 -3.923 9.525 1.00 0.00 H new ATOM 0 HB2 ASN A 46 6.910 -2.606 9.586 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.278 -3.900 10.709 1.00 0.00 H new ATOM 0 HD21 ASN A 46 8.217 -0.353 11.953 1.00 0.00 H new ATOM 0 HD22 ASN A 46 6.822 -0.913 11.024 1.00 0.00 H new ATOM 728 N ARG A 47 8.677 -6.209 8.970 1.00 0.00 N ATOM 729 CA ARG A 47 8.203 -7.508 8.510 1.00 0.00 C ATOM 730 C ARG A 47 7.220 -8.168 9.482 1.00 0.00 C ATOM 731 O ARG A 47 7.448 -8.205 10.691 1.00 0.00 O ATOM 732 CB ARG A 47 9.396 -8.425 8.256 1.00 0.00 C ATOM 733 CG ARG A 47 9.872 -8.382 6.813 1.00 0.00 C ATOM 734 CD ARG A 47 9.504 -9.649 6.066 1.00 0.00 C ATOM 735 NE ARG A 47 8.066 -9.902 6.087 1.00 0.00 N ATOM 736 CZ ARG A 47 7.487 -10.941 5.490 1.00 0.00 C ATOM 737 NH1 ARG A 47 8.219 -11.827 4.826 1.00 0.00 N ATOM 738 NH2 ARG A 47 6.172 -11.097 5.556 1.00 0.00 N ATOM 0 H ARG A 47 9.484 -6.241 9.593 1.00 0.00 H new ATOM 0 HA ARG A 47 7.653 -7.342 7.584 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.216 -8.138 8.914 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.124 -9.448 8.514 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.432 -7.521 6.310 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.953 -8.246 6.790 1.00 0.00 H new ATOM 0 HD2 ARG A 47 9.843 -9.571 5.033 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.027 -10.496 6.510 1.00 0.00 H new ATOM 0 HE ARG A 47 7.470 -9.244 6.589 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.231 -11.714 4.771 1.00 0.00 H new ATOM 0 HH12 ARG A 47 7.769 -12.621 4.371 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.603 -10.420 6.065 1.00 0.00 H new ATOM 0 HH22 ARG A 47 5.729 -11.894 5.098 1.00 0.00 H new ATOM 752 N TRP A 48 6.131 -8.702 8.923 1.00 0.00 N ATOM 753 CA TRP A 48 5.100 -9.387 9.694 1.00 0.00 C ATOM 754 C TRP A 48 4.374 -10.377 8.786 1.00 0.00 C ATOM 755 O TRP A 48 4.262 -10.135 7.587 1.00 0.00 O ATOM 756 CB TRP A 48 4.110 -8.383 10.293 1.00 0.00 C ATOM 757 CG TRP A 48 2.984 -9.031 11.040 1.00 0.00 C ATOM 758 CD1 TRP A 48 1.966 -9.769 10.507 1.00 0.00 C ATOM 759 CD2 TRP A 48 2.761 -8.996 12.454 1.00 0.00 C ATOM 760 NE1 TRP A 48 1.124 -10.197 11.504 1.00 0.00 N ATOM 761 CE2 TRP A 48 1.589 -9.736 12.708 1.00 0.00 C ATOM 762 CE3 TRP A 48 3.436 -8.413 13.529 1.00 0.00 C ATOM 763 CZ2 TRP A 48 1.081 -9.907 13.993 1.00 0.00 C ATOM 764 CZ3 TRP A 48 2.931 -8.584 14.804 1.00 0.00 C ATOM 765 CH2 TRP A 48 1.763 -9.326 15.027 1.00 0.00 C ATOM 0 H TRP A 48 5.943 -8.669 7.921 1.00 0.00 H new ATOM 0 HA TRP A 48 5.567 -9.924 10.519 1.00 0.00 H new ATOM 0 HB2 TRP A 48 4.645 -7.714 10.966 1.00 0.00 H new ATOM 0 HB3 TRP A 48 3.699 -7.768 9.493 1.00 0.00 H new ATOM 0 HD1 TRP A 48 1.841 -9.984 9.456 1.00 0.00 H new ATOM 0 HE1 TRP A 48 0.288 -10.766 11.370 1.00 0.00 H new ATOM 0 HE3 TRP A 48 4.336 -7.839 13.367 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 0.181 -10.478 14.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 3.445 -8.138 15.643 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.394 -9.441 16.035 1.00 0.00 H new ATOM 776 N GLY A 49 3.906 -11.490 9.358 1.00 0.00 N ATOM 777 CA GLY A 49 3.209 -12.518 8.583 1.00 0.00 C ATOM 778 C GLY A 49 2.466 -11.975 7.373 1.00 0.00 C ATOM 779 O GLY A 49 1.268 -11.706 7.443 1.00 0.00 O ATOM 0 H GLY A 49 3.997 -11.701 10.352 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.933 -13.262 8.250 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.500 -13.032 9.233 1.00 0.00 H new ATOM 783 N ASP A 50 3.186 -11.811 6.263 1.00 0.00 N ATOM 784 CA ASP A 50 2.608 -11.293 5.023 1.00 0.00 C ATOM 785 C ASP A 50 2.342 -9.787 5.108 1.00 0.00 C ATOM 786 O ASP A 50 2.514 -9.064 4.126 1.00 0.00 O ATOM 787 CB ASP A 50 1.310 -12.026 4.681 1.00 0.00 C ATOM 788 CG ASP A 50 0.826 -11.719 3.279 1.00 0.00 C ATOM 789 OD1 ASP A 50 1.510 -12.116 2.314 1.00 0.00 O ATOM 790 OD2 ASP A 50 -0.241 -11.082 3.147 1.00 0.00 O ATOM 0 H ASP A 50 4.180 -12.032 6.198 1.00 0.00 H new ATOM 0 HA ASP A 50 3.338 -11.467 4.232 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.465 -13.100 4.782 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.538 -11.747 5.398 1.00 0.00 H new ATOM 795 N GLU A 51 1.915 -9.322 6.279 1.00 0.00 N ATOM 796 CA GLU A 51 1.619 -7.910 6.479 1.00 0.00 C ATOM 797 C GLU A 51 2.896 -7.081 6.555 1.00 0.00 C ATOM 798 O GLU A 51 3.799 -7.379 7.335 1.00 0.00 O ATOM 799 CB GLU A 51 0.802 -7.723 7.761 1.00 0.00 C ATOM 800 CG GLU A 51 -0.304 -6.689 7.636 1.00 0.00 C ATOM 801 CD GLU A 51 0.043 -5.376 8.313 1.00 0.00 C ATOM 802 OE1 GLU A 51 0.913 -5.382 9.210 1.00 0.00 O ATOM 803 OE2 GLU A 51 -0.554 -4.343 7.946 1.00 0.00 O ATOM 0 H GLU A 51 1.767 -9.904 7.103 1.00 0.00 H new ATOM 0 HA GLU A 51 1.040 -7.563 5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.362 -8.680 8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.472 -7.429 8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.508 -6.506 6.581 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.220 -7.088 8.073 1.00 0.00 H new ATOM 810 N ILE A 52 2.956 -6.029 5.747 1.00 0.00 N ATOM 811 CA ILE A 52 4.113 -5.141 5.729 1.00 0.00 C ATOM 812 C ILE A 52 3.651 -3.688 5.819 1.00 0.00 C ATOM 813 O ILE A 52 2.834 -3.243 5.020 1.00 0.00 O ATOM 814 CB ILE A 52 4.979 -5.357 4.457 1.00 0.00 C ATOM 815 CG1 ILE A 52 6.426 -5.687 4.845 1.00 0.00 C ATOM 816 CG2 ILE A 52 4.951 -4.135 3.542 1.00 0.00 C ATOM 817 CD1 ILE A 52 6.636 -7.110 5.326 1.00 0.00 C ATOM 0 H ILE A 52 2.216 -5.770 5.095 1.00 0.00 H new ATOM 0 HA ILE A 52 4.735 -5.376 6.593 1.00 0.00 H new ATOM 0 HB ILE A 52 4.552 -6.197 3.909 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.070 -5.509 3.984 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.745 -5.000 5.629 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.568 -4.324 2.664 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.926 -3.938 3.230 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.340 -3.270 4.079 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.686 -7.257 5.579 1.00 0.00 H new ATOM 0 HD12 ILE A 52 6.021 -7.290 6.208 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.352 -7.806 4.537 1.00 0.00 H new ATOM 829 N TYR A 53 4.166 -2.957 6.799 1.00 0.00 N ATOM 830 CA TYR A 53 3.785 -1.560 6.981 1.00 0.00 C ATOM 831 C TYR A 53 5.001 -0.686 7.273 1.00 0.00 C ATOM 832 O TYR A 53 5.780 -0.972 8.184 1.00 0.00 O ATOM 833 CB TYR A 53 2.765 -1.428 8.118 1.00 0.00 C ATOM 834 CG TYR A 53 3.290 -1.880 9.465 1.00 0.00 C ATOM 835 CD1 TYR A 53 3.977 -1.002 10.298 1.00 0.00 C ATOM 836 CD2 TYR A 53 3.099 -3.185 9.904 1.00 0.00 C ATOM 837 CE1 TYR A 53 4.458 -1.413 11.526 1.00 0.00 C ATOM 838 CE2 TYR A 53 3.576 -3.601 11.132 1.00 0.00 C ATOM 839 CZ TYR A 53 4.256 -2.712 11.938 1.00 0.00 C ATOM 840 OH TYR A 53 4.731 -3.124 13.162 1.00 0.00 O ATOM 0 H TYR A 53 4.845 -3.304 7.477 1.00 0.00 H new ATOM 0 HA TYR A 53 3.333 -1.217 6.051 1.00 0.00 H new ATOM 0 HB2 TYR A 53 2.450 -0.387 8.192 1.00 0.00 H new ATOM 0 HB3 TYR A 53 1.879 -2.012 7.869 1.00 0.00 H new ATOM 0 HD1 TYR A 53 4.137 0.017 9.979 1.00 0.00 H new ATOM 0 HD2 TYR A 53 2.569 -3.885 9.275 1.00 0.00 H new ATOM 0 HE1 TYR A 53 4.990 -0.719 12.160 1.00 0.00 H new ATOM 0 HE2 TYR A 53 3.417 -4.618 11.459 1.00 0.00 H new ATOM 0 HH TYR A 53 4.504 -4.067 13.300 1.00 0.00 H new ATOM 850 N PHE A 54 5.151 0.384 6.499 1.00 0.00 N ATOM 851 CA PHE A 54 6.264 1.308 6.679 1.00 0.00 C ATOM 852 C PHE A 54 5.775 2.754 6.665 1.00 0.00 C ATOM 853 O PHE A 54 4.844 3.096 5.935 1.00 0.00 O ATOM 854 CB PHE A 54 7.322 1.100 5.587 1.00 0.00 C ATOM 855 CG PHE A 54 6.883 1.513 4.203 1.00 0.00 C ATOM 856 CD1 PHE A 54 6.667 2.848 3.894 1.00 0.00 C ATOM 857 CD2 PHE A 54 6.690 0.564 3.210 1.00 0.00 C ATOM 858 CE1 PHE A 54 6.267 3.225 2.626 1.00 0.00 C ATOM 859 CE2 PHE A 54 6.290 0.936 1.942 1.00 0.00 C ATOM 860 CZ PHE A 54 6.076 2.268 1.650 1.00 0.00 C ATOM 0 H PHE A 54 4.515 0.632 5.741 1.00 0.00 H new ATOM 0 HA PHE A 54 6.717 1.104 7.649 1.00 0.00 H new ATOM 0 HB2 PHE A 54 8.217 1.663 5.854 1.00 0.00 H new ATOM 0 HB3 PHE A 54 7.602 0.047 5.566 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.813 3.602 4.653 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.855 -0.480 3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 54 6.104 4.268 2.399 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.145 0.185 1.179 1.00 0.00 H new ATOM 0 HZ PHE A 54 5.760 2.561 0.660 1.00 0.00 H new ATOM 870 N THR A 55 6.416 3.602 7.462 1.00 0.00 N ATOM 871 CA THR A 55 6.049 5.017 7.522 1.00 0.00 C ATOM 872 C THR A 55 6.878 5.813 6.518 1.00 0.00 C ATOM 873 O THR A 55 8.033 5.479 6.256 1.00 0.00 O ATOM 874 CB THR A 55 6.263 5.564 8.936 1.00 0.00 C ATOM 875 OG1 THR A 55 6.288 4.511 9.882 1.00 0.00 O ATOM 876 CG2 THR A 55 5.190 6.542 9.365 1.00 0.00 C ATOM 0 H THR A 55 7.189 3.339 8.074 1.00 0.00 H new ATOM 0 HA THR A 55 4.994 5.117 7.268 1.00 0.00 H new ATOM 0 HB THR A 55 7.219 6.087 8.904 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.427 4.880 10.779 1.00 0.00 H new ATOM 0 HG21 THR A 55 5.400 6.892 10.376 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.178 7.391 8.682 1.00 0.00 H new ATOM 0 HG23 THR A 55 4.219 6.048 9.347 1.00 0.00 H new ATOM 884 N THR A 56 6.288 6.860 5.946 1.00 0.00 N ATOM 885 CA THR A 56 6.991 7.678 4.962 1.00 0.00 C ATOM 886 C THR A 56 7.091 9.140 5.399 1.00 0.00 C ATOM 887 O THR A 56 7.542 9.992 4.634 1.00 0.00 O ATOM 888 CB THR A 56 6.294 7.589 3.604 1.00 0.00 C ATOM 889 OG1 THR A 56 5.099 6.831 3.698 1.00 0.00 O ATOM 890 CG2 THR A 56 7.156 6.955 2.534 1.00 0.00 C ATOM 0 H THR A 56 5.334 7.160 6.145 1.00 0.00 H new ATOM 0 HA THR A 56 8.005 7.286 4.879 1.00 0.00 H new ATOM 0 HB THR A 56 6.083 8.620 3.319 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.669 6.788 2.819 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.604 6.921 1.595 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.063 7.545 2.401 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.423 5.942 2.835 1.00 0.00 H new ATOM 898 N GLN A 57 6.669 9.424 6.630 1.00 0.00 N ATOM 899 CA GLN A 57 6.713 10.786 7.175 1.00 0.00 C ATOM 900 C GLN A 57 5.507 11.617 6.729 1.00 0.00 C ATOM 901 O GLN A 57 5.303 12.725 7.224 1.00 0.00 O ATOM 902 CB GLN A 57 8.018 11.507 6.789 1.00 0.00 C ATOM 903 CG GLN A 57 9.247 10.609 6.818 1.00 0.00 C ATOM 904 CD GLN A 57 10.313 11.109 7.774 1.00 0.00 C ATOM 905 OE1 GLN A 57 10.779 10.371 8.641 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.702 12.369 7.618 1.00 0.00 N ATOM 0 H GLN A 57 6.291 8.729 7.273 1.00 0.00 H new ATOM 0 HA GLN A 57 6.678 10.687 8.260 1.00 0.00 H new ATOM 0 HB2 GLN A 57 7.909 11.926 5.789 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.175 12.344 7.469 1.00 0.00 H new ATOM 0 HG2 GLN A 57 8.949 9.601 7.107 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.667 10.542 5.814 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.287 12.944 6.885 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.416 12.762 8.232 1.00 0.00 H new ATOM 915 N VAL A 58 4.700 11.081 5.814 1.00 0.00 N ATOM 916 CA VAL A 58 3.518 11.797 5.345 1.00 0.00 C ATOM 917 C VAL A 58 2.349 11.554 6.294 1.00 0.00 C ATOM 918 O VAL A 58 1.875 10.425 6.432 1.00 0.00 O ATOM 919 CB VAL A 58 3.123 11.390 3.908 1.00 0.00 C ATOM 920 CG1 VAL A 58 2.773 9.911 3.827 1.00 0.00 C ATOM 921 CG2 VAL A 58 1.966 12.243 3.410 1.00 0.00 C ATOM 0 H VAL A 58 4.841 10.165 5.388 1.00 0.00 H new ATOM 0 HA VAL A 58 3.765 12.859 5.329 1.00 0.00 H new ATOM 0 HB VAL A 58 3.985 11.563 3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.500 9.657 2.803 1.00 0.00 H new ATOM 0 HG12 VAL A 58 3.634 9.316 4.131 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.934 9.699 4.490 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.702 11.942 2.396 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.105 12.107 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.261 13.292 3.412 1.00 0.00 H new ATOM 931 N ALA A 59 1.901 12.612 6.966 1.00 0.00 N ATOM 932 CA ALA A 59 0.800 12.492 7.919 1.00 0.00 C ATOM 933 C ALA A 59 -0.498 13.079 7.377 1.00 0.00 C ATOM 934 O ALA A 59 -0.750 14.278 7.500 1.00 0.00 O ATOM 935 CB ALA A 59 1.159 13.149 9.248 1.00 0.00 C ATOM 0 H ALA A 59 2.279 13.554 6.870 1.00 0.00 H new ATOM 0 HA ALA A 59 0.637 11.426 8.081 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.324 13.047 9.941 1.00 0.00 H new ATOM 0 HB2 ALA A 59 2.040 12.664 9.667 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.369 14.206 9.086 1.00 0.00 H new ATOM 941 N VAL A 60 -1.322 12.218 6.795 1.00 0.00 N ATOM 942 CA VAL A 60 -2.608 12.633 6.248 1.00 0.00 C ATOM 943 C VAL A 60 -3.709 11.679 6.710 1.00 0.00 C ATOM 944 O VAL A 60 -3.785 10.541 6.250 1.00 0.00 O ATOM 945 CB VAL A 60 -2.569 12.671 4.703 1.00 0.00 C ATOM 946 CG1 VAL A 60 -2.121 11.326 4.140 1.00 0.00 C ATOM 947 CG2 VAL A 60 -3.924 13.071 4.130 1.00 0.00 C ATOM 0 H VAL A 60 -1.122 11.223 6.689 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.820 13.638 6.614 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.842 13.426 4.405 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.101 11.376 3.051 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.124 11.090 4.511 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.818 10.549 4.455 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.868 13.090 3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.678 12.349 4.442 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.196 14.061 4.496 1.00 0.00 H new ATOM 957 N GLU A 61 -4.554 12.139 7.635 1.00 0.00 N ATOM 958 CA GLU A 61 -5.630 11.303 8.159 1.00 0.00 C ATOM 959 C GLU A 61 -6.993 11.967 7.986 1.00 0.00 C ATOM 960 O GLU A 61 -7.163 13.151 8.275 1.00 0.00 O ATOM 961 CB GLU A 61 -5.379 10.993 9.638 1.00 0.00 C ATOM 962 CG GLU A 61 -4.996 9.546 9.897 1.00 0.00 C ATOM 963 CD GLU A 61 -4.899 9.224 11.376 1.00 0.00 C ATOM 964 OE1 GLU A 61 -5.824 9.599 12.127 1.00 0.00 O ATOM 965 OE2 GLU A 61 -3.897 8.600 11.783 1.00 0.00 O ATOM 0 H GLU A 61 -4.513 13.078 8.032 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.639 10.373 7.590 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.585 11.642 10.008 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.277 11.231 10.208 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.733 8.890 9.434 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.039 9.336 9.420 1.00 0.00 H new ATOM 972 N LYS A 62 -7.965 11.186 7.520 1.00 0.00 N ATOM 973 CA LYS A 62 -9.320 11.683 7.315 1.00 0.00 C ATOM 974 C LYS A 62 -10.338 10.573 7.584 1.00 0.00 C ATOM 975 O LYS A 62 -9.976 9.399 7.658 1.00 0.00 O ATOM 976 CB LYS A 62 -9.476 12.216 5.886 1.00 0.00 C ATOM 977 CG LYS A 62 -10.880 12.703 5.553 1.00 0.00 C ATOM 978 CD LYS A 62 -10.880 13.595 4.323 1.00 0.00 C ATOM 979 CE LYS A 62 -10.671 15.054 4.694 1.00 0.00 C ATOM 980 NZ LYS A 62 -11.356 15.975 3.745 1.00 0.00 N ATOM 0 H LYS A 62 -7.837 10.204 7.277 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.504 12.499 8.014 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.774 13.036 5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.200 11.429 5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.533 11.847 5.384 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.287 13.252 6.402 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.093 13.276 3.640 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.826 13.485 3.792 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.045 15.229 5.703 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.604 15.275 4.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -11.188 16.960 4.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.981 15.827 2.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.378 15.782 3.751 1.00 0.00 H new ATOM 994 N GLU A 63 -11.609 10.943 7.732 1.00 0.00 N ATOM 995 CA GLU A 63 -12.659 9.962 7.995 1.00 0.00 C ATOM 996 C GLU A 63 -13.461 9.658 6.732 1.00 0.00 C ATOM 997 O GLU A 63 -14.439 10.338 6.422 1.00 0.00 O ATOM 998 CB GLU A 63 -13.591 10.446 9.115 1.00 0.00 C ATOM 999 CG GLU A 63 -14.223 11.810 8.867 1.00 0.00 C ATOM 1000 CD GLU A 63 -13.320 12.956 9.279 1.00 0.00 C ATOM 1001 OE1 GLU A 63 -12.424 12.733 10.120 1.00 0.00 O ATOM 1002 OE2 GLU A 63 -13.510 14.077 8.761 1.00 0.00 O ATOM 0 H GLU A 63 -11.935 11.908 7.675 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.175 9.041 8.320 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -14.385 9.712 9.252 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -13.028 10.485 10.047 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.466 11.906 7.809 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.162 11.877 9.417 1.00 0.00 H new ATOM 1009 N GLU A 64 -13.041 8.628 6.005 1.00 0.00 N ATOM 1010 CA GLU A 64 -13.720 8.233 4.776 1.00 0.00 C ATOM 1011 C GLU A 64 -13.191 6.887 4.272 1.00 0.00 C ATOM 1012 O GLU A 64 -12.064 6.501 4.583 1.00 0.00 O ATOM 1013 CB GLU A 64 -13.538 9.325 3.710 1.00 0.00 C ATOM 1014 CG GLU A 64 -13.620 8.826 2.274 1.00 0.00 C ATOM 1015 CD GLU A 64 -13.996 9.923 1.297 1.00 0.00 C ATOM 1016 OE1 GLU A 64 -14.680 10.881 1.714 1.00 0.00 O ATOM 1017 OE2 GLU A 64 -13.606 9.824 0.114 1.00 0.00 O ATOM 0 H GLU A 64 -12.234 8.052 6.245 1.00 0.00 H new ATOM 0 HA GLU A 64 -14.784 8.116 4.982 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -14.299 10.091 3.859 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -12.570 9.804 3.860 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.659 8.401 1.985 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -14.355 8.023 2.214 1.00 0.00 H new ATOM 1024 N ASN A 65 -14.006 6.181 3.488 1.00 0.00 N ATOM 1025 CA ASN A 65 -13.612 4.887 2.940 1.00 0.00 C ATOM 1026 C ASN A 65 -13.377 3.868 4.052 1.00 0.00 C ATOM 1027 O ASN A 65 -14.252 3.059 4.358 1.00 0.00 O ATOM 1028 CB ASN A 65 -12.344 5.040 2.087 1.00 0.00 C ATOM 1029 CG ASN A 65 -11.895 3.728 1.473 1.00 0.00 C ATOM 1030 OD1 ASN A 65 -11.766 2.718 2.164 1.00 0.00 O ATOM 1031 ND2 ASN A 65 -11.656 3.736 0.167 1.00 0.00 N ATOM 0 H ASN A 65 -14.942 6.485 3.219 1.00 0.00 H new ATOM 0 HA ASN A 65 -14.425 4.522 2.312 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -12.529 5.764 1.294 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.541 5.442 2.705 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -11.353 2.882 -0.301 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.776 4.596 -0.368 1.00 0.00 H new ATOM 1038 N SER A 66 -12.189 3.928 4.651 1.00 0.00 N ATOM 1039 CA SER A 66 -11.798 3.027 5.745 1.00 0.00 C ATOM 1040 C SER A 66 -12.508 1.669 5.671 1.00 0.00 C ATOM 1041 O SER A 66 -13.507 1.453 6.357 1.00 0.00 O ATOM 1042 CB SER A 66 -12.101 3.687 7.091 1.00 0.00 C ATOM 1043 OG SER A 66 -11.002 4.460 7.540 1.00 0.00 O ATOM 0 H SER A 66 -11.467 4.601 4.395 1.00 0.00 H new ATOM 0 HA SER A 66 -10.728 2.843 5.644 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.982 4.322 6.998 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.337 2.921 7.830 1.00 0.00 H new ATOM 0 HG SER A 66 -11.222 4.872 8.401 1.00 0.00 H new ATOM 1049 N LYS A 67 -11.985 0.745 4.859 1.00 0.00 N ATOM 1050 CA LYS A 67 -12.593 -0.589 4.750 1.00 0.00 C ATOM 1051 C LYS A 67 -11.789 -1.606 5.558 1.00 0.00 C ATOM 1052 O LYS A 67 -10.604 -1.400 5.822 1.00 0.00 O ATOM 1053 CB LYS A 67 -12.732 -1.056 3.287 1.00 0.00 C ATOM 1054 CG LYS A 67 -11.456 -0.978 2.460 1.00 0.00 C ATOM 1055 CD LYS A 67 -10.546 -2.169 2.719 1.00 0.00 C ATOM 1056 CE LYS A 67 -9.227 -2.034 1.982 1.00 0.00 C ATOM 1057 NZ LYS A 67 -8.199 -2.978 2.503 1.00 0.00 N ATOM 0 H LYS A 67 -11.159 0.889 4.278 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.600 -0.516 5.160 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.087 -2.087 3.283 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.499 -0.453 2.801 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.710 -0.938 1.401 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.925 -0.056 2.696 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.358 -2.258 3.789 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.047 -3.085 2.406 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -9.384 -2.219 0.919 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.862 -1.011 2.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.482 -2.449 3.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.653 -3.675 3.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.744 -3.470 1.707 1.00 0.00 H new ATOM 1071 N ASP A 68 -12.440 -2.695 5.966 1.00 0.00 N ATOM 1072 CA ASP A 68 -11.771 -3.724 6.766 1.00 0.00 C ATOM 1073 C ASP A 68 -11.717 -5.077 6.053 1.00 0.00 C ATOM 1074 O ASP A 68 -11.075 -6.007 6.541 1.00 0.00 O ATOM 1075 CB ASP A 68 -12.482 -3.884 8.111 1.00 0.00 C ATOM 1076 CG ASP A 68 -13.987 -3.995 7.961 1.00 0.00 C ATOM 1077 OD1 ASP A 68 -14.441 -4.653 7.002 1.00 0.00 O ATOM 1078 OD2 ASP A 68 -14.711 -3.424 8.803 1.00 0.00 O ATOM 0 H ASP A 68 -13.420 -2.888 5.759 1.00 0.00 H new ATOM 0 HA ASP A 68 -10.744 -3.392 6.920 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -12.104 -4.773 8.615 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -12.245 -3.031 8.748 1.00 0.00 H new ATOM 1083 N VAL A 69 -12.383 -5.197 4.907 1.00 0.00 N ATOM 1084 CA VAL A 69 -12.382 -6.458 4.168 1.00 0.00 C ATOM 1085 C VAL A 69 -11.960 -6.258 2.715 1.00 0.00 C ATOM 1086 O VAL A 69 -12.282 -5.242 2.099 1.00 0.00 O ATOM 1087 CB VAL A 69 -13.765 -7.147 4.214 1.00 0.00 C ATOM 1088 CG1 VAL A 69 -14.762 -6.456 3.291 1.00 0.00 C ATOM 1089 CG2 VAL A 69 -13.635 -8.622 3.861 1.00 0.00 C ATOM 0 H VAL A 69 -12.923 -4.448 4.474 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.653 -7.103 4.659 1.00 0.00 H new ATOM 0 HB VAL A 69 -14.147 -7.065 5.231 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -15.724 -6.966 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -14.883 -5.417 3.599 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -14.393 -6.490 2.266 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.617 -9.093 3.898 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.223 -8.721 2.857 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -12.972 -9.110 4.575 1.00 0.00 H new ATOM 1099 N VAL A 70 -11.240 -7.239 2.175 1.00 0.00 N ATOM 1100 CA VAL A 70 -10.772 -7.177 0.790 1.00 0.00 C ATOM 1101 C VAL A 70 -10.452 -8.571 0.246 1.00 0.00 C ATOM 1102 O VAL A 70 -10.286 -9.519 1.013 1.00 0.00 O ATOM 1103 CB VAL A 70 -9.522 -6.274 0.652 1.00 0.00 C ATOM 1104 CG1 VAL A 70 -9.864 -4.833 1.005 1.00 0.00 C ATOM 1105 CG2 VAL A 70 -8.358 -6.772 1.514 1.00 0.00 C ATOM 0 H VAL A 70 -10.968 -8.086 2.674 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.584 -6.746 0.205 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.202 -6.319 -0.389 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.974 -4.212 0.903 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.640 -4.468 0.332 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.223 -4.786 2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -7.502 -6.110 1.387 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -8.658 -6.780 2.562 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -8.084 -7.782 1.208 1.00 0.00 H new ATOM 1115 N GLU A 71 -10.353 -8.688 -1.082 1.00 0.00 N ATOM 1116 CA GLU A 71 -10.032 -9.982 -1.709 1.00 0.00 C ATOM 1117 C GLU A 71 -8.620 -9.975 -2.279 1.00 0.00 C ATOM 1118 O GLU A 71 -8.145 -8.959 -2.784 1.00 0.00 O ATOM 1119 CB GLU A 71 -11.048 -10.388 -2.791 1.00 0.00 C ATOM 1120 CG GLU A 71 -11.055 -9.495 -4.008 1.00 0.00 C ATOM 1121 CD GLU A 71 -11.523 -8.082 -3.713 1.00 0.00 C ATOM 1122 OE1 GLU A 71 -12.511 -7.928 -2.966 1.00 0.00 O ATOM 1123 OE2 GLU A 71 -10.900 -7.132 -4.230 1.00 0.00 O ATOM 0 H GLU A 71 -10.487 -7.918 -1.738 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.091 -10.731 -0.920 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.835 -11.409 -3.106 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.046 -10.391 -2.352 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -10.050 -9.457 -4.428 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.702 -9.933 -4.768 1.00 0.00 H new ATOM 1130 N LEU A 72 -7.952 -11.119 -2.166 1.00 0.00 N ATOM 1131 CA LEU A 72 -6.570 -11.279 -2.640 1.00 0.00 C ATOM 1132 C LEU A 72 -6.320 -10.523 -3.946 1.00 0.00 C ATOM 1133 O LEU A 72 -7.094 -10.633 -4.898 1.00 0.00 O ATOM 1134 CB LEU A 72 -6.256 -12.774 -2.849 1.00 0.00 C ATOM 1135 CG LEU A 72 -4.958 -13.100 -3.610 1.00 0.00 C ATOM 1136 CD1 LEU A 72 -4.039 -13.957 -2.753 1.00 0.00 C ATOM 1137 CD2 LEU A 72 -5.276 -13.813 -4.917 1.00 0.00 C ATOM 0 H LEU A 72 -8.346 -11.961 -1.746 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.914 -10.860 -1.877 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.208 -13.253 -1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.090 -13.227 -3.386 1.00 0.00 H new ATOM 0 HG LEU A 72 -4.447 -12.164 -3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.126 -14.178 -3.307 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.788 -13.419 -1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.543 -14.889 -2.498 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.349 -14.037 -5.444 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.807 -14.741 -4.705 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.901 -13.172 -5.539 1.00 0.00 H new ATOM 1149 N GLY A 73 -5.225 -9.765 -3.985 1.00 0.00 N ATOM 1150 CA GLY A 73 -4.885 -9.012 -5.186 1.00 0.00 C ATOM 1151 C GLY A 73 -4.950 -7.503 -5.001 1.00 0.00 C ATOM 1152 O GLY A 73 -4.205 -6.767 -5.649 1.00 0.00 O ATOM 0 H GLY A 73 -4.569 -9.658 -3.211 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.879 -9.287 -5.504 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.563 -9.300 -5.989 1.00 0.00 H new ATOM 1156 N ASP A 74 -5.846 -7.035 -4.137 1.00 0.00 N ATOM 1157 CA ASP A 74 -6.002 -5.599 -3.904 1.00 0.00 C ATOM 1158 C ASP A 74 -4.985 -5.063 -2.895 1.00 0.00 C ATOM 1159 O ASP A 74 -4.455 -5.804 -2.068 1.00 0.00 O ATOM 1160 CB ASP A 74 -7.426 -5.283 -3.433 1.00 0.00 C ATOM 1161 CG ASP A 74 -7.944 -6.279 -2.418 1.00 0.00 C ATOM 1162 OD1 ASP A 74 -7.183 -6.637 -1.495 1.00 0.00 O ATOM 1163 OD2 ASP A 74 -9.112 -6.702 -2.546 1.00 0.00 O ATOM 0 H ASP A 74 -6.473 -7.624 -3.588 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.817 -5.099 -4.855 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.446 -4.284 -2.998 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -8.094 -5.269 -4.294 1.00 0.00 H new ATOM 1168 N VAL A 75 -4.731 -3.756 -2.980 1.00 0.00 N ATOM 1169 CA VAL A 75 -3.783 -3.077 -2.081 1.00 0.00 C ATOM 1170 C VAL A 75 -4.529 -2.062 -1.200 1.00 0.00 C ATOM 1171 O VAL A 75 -5.575 -1.556 -1.604 1.00 0.00 O ATOM 1172 CB VAL A 75 -2.678 -2.340 -2.887 1.00 0.00 C ATOM 1173 CG1 VAL A 75 -1.595 -1.785 -1.972 1.00 0.00 C ATOM 1174 CG2 VAL A 75 -2.073 -3.268 -3.930 1.00 0.00 C ATOM 0 H VAL A 75 -5.169 -3.140 -3.665 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.313 -3.835 -1.455 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.144 -1.496 -3.396 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.839 -1.276 -2.570 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.038 -1.079 -1.270 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.131 -2.602 -1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.301 -2.736 -4.486 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.633 -4.134 -3.435 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.851 -3.600 -4.617 1.00 0.00 H new ATOM 1184 N ALA A 76 -4.016 -1.767 0.004 1.00 0.00 N ATOM 1185 CA ALA A 76 -4.696 -0.820 0.885 1.00 0.00 C ATOM 1186 C ALA A 76 -3.719 -0.031 1.752 1.00 0.00 C ATOM 1187 O ALA A 76 -2.657 -0.532 2.123 1.00 0.00 O ATOM 1188 CB ALA A 76 -5.700 -1.552 1.763 1.00 0.00 C ATOM 0 H ALA A 76 -3.154 -2.162 0.379 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.218 -0.104 0.250 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.201 -0.837 2.416 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -6.439 -2.049 1.134 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.180 -2.294 2.369 1.00 0.00 H new ATOM 1194 N TYR A 77 -4.094 1.207 2.085 1.00 0.00 N ATOM 1195 CA TYR A 77 -3.258 2.062 2.924 1.00 0.00 C ATOM 1196 C TYR A 77 -3.860 2.182 4.323 1.00 0.00 C ATOM 1197 O TYR A 77 -5.011 2.584 4.480 1.00 0.00 O ATOM 1198 CB TYR A 77 -3.089 3.449 2.274 1.00 0.00 C ATOM 1199 CG TYR A 77 -3.519 4.616 3.143 1.00 0.00 C ATOM 1200 CD1 TYR A 77 -2.805 4.954 4.286 1.00 0.00 C ATOM 1201 CD2 TYR A 77 -4.635 5.377 2.818 1.00 0.00 C ATOM 1202 CE1 TYR A 77 -3.191 6.016 5.079 1.00 0.00 C ATOM 1203 CE2 TYR A 77 -5.026 6.442 3.608 1.00 0.00 C ATOM 1204 CZ TYR A 77 -4.301 6.757 4.737 1.00 0.00 C ATOM 1205 OH TYR A 77 -4.688 7.816 5.525 1.00 0.00 O ATOM 0 H TYR A 77 -4.969 1.637 1.786 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.271 1.609 3.017 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -2.042 3.583 2.003 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -3.663 3.473 1.348 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -1.934 4.377 4.558 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.206 5.133 1.934 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -2.625 6.265 5.964 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.896 7.024 3.342 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.054 8.555 5.414 1.00 0.00 H new ATOM 1215 N TRP A 78 -3.073 1.830 5.337 1.00 0.00 N ATOM 1216 CA TRP A 78 -3.534 1.901 6.720 1.00 0.00 C ATOM 1217 C TRP A 78 -3.788 3.348 7.133 1.00 0.00 C ATOM 1218 O TRP A 78 -2.851 4.136 7.265 1.00 0.00 O ATOM 1219 CB TRP A 78 -2.505 1.262 7.659 1.00 0.00 C ATOM 1220 CG TRP A 78 -3.096 0.784 8.951 1.00 0.00 C ATOM 1221 CD1 TRP A 78 -4.328 1.090 9.446 1.00 0.00 C ATOM 1222 CD2 TRP A 78 -2.479 -0.081 9.912 1.00 0.00 C ATOM 1223 NE1 TRP A 78 -4.518 0.473 10.657 1.00 0.00 N ATOM 1224 CE2 TRP A 78 -3.398 -0.254 10.966 1.00 0.00 C ATOM 1225 CE3 TRP A 78 -1.241 -0.726 9.986 1.00 0.00 C ATOM 1226 CZ2 TRP A 78 -3.116 -1.045 12.077 1.00 0.00 C ATOM 1227 CZ3 TRP A 78 -0.963 -1.509 11.089 1.00 0.00 C ATOM 1228 CH2 TRP A 78 -1.897 -1.664 12.122 1.00 0.00 C ATOM 0 H TRP A 78 -2.116 1.494 5.227 1.00 0.00 H new ATOM 0 HA TRP A 78 -4.471 1.350 6.793 1.00 0.00 H new ATOM 0 HB2 TRP A 78 -2.033 0.421 7.151 1.00 0.00 H new ATOM 0 HB3 TRP A 78 -1.720 1.987 7.873 1.00 0.00 H new ATOM 0 HD1 TRP A 78 -5.050 1.726 8.956 1.00 0.00 H new ATOM 0 HE1 TRP A 78 -5.356 0.544 11.233 1.00 0.00 H new ATOM 0 HE3 TRP A 78 -0.515 -0.614 9.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 -3.834 -1.165 12.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 -0.009 -2.011 11.157 1.00 0.00 H new ATOM 0 HH2 TRP A 78 -1.650 -2.285 12.971 1.00 0.00 H new ATOM 1239 N ILE A 79 -5.057 3.700 7.339 1.00 0.00 N ATOM 1240 CA ILE A 79 -5.412 5.057 7.737 1.00 0.00 C ATOM 1241 C ILE A 79 -4.877 5.368 9.139 1.00 0.00 C ATOM 1242 O ILE A 79 -3.965 6.183 9.278 1.00 0.00 O ATOM 1243 CB ILE A 79 -6.940 5.297 7.641 1.00 0.00 C ATOM 1244 CG1 ILE A 79 -7.311 5.665 6.198 1.00 0.00 C ATOM 1245 CG2 ILE A 79 -7.405 6.376 8.616 1.00 0.00 C ATOM 1246 CD1 ILE A 79 -8.347 6.767 6.072 1.00 0.00 C ATOM 0 H ILE A 79 -5.850 3.067 7.237 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.938 5.747 7.039 1.00 0.00 H new ATOM 0 HB ILE A 79 -7.452 4.376 7.920 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.407 5.972 5.672 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.685 4.774 5.695 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.482 6.515 8.518 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.170 6.071 9.636 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.896 7.313 8.391 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -8.547 6.960 5.018 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.269 6.458 6.565 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -7.971 7.676 6.542 1.00 0.00 H new ATOM 1258 N PRO A 80 -5.411 4.727 10.201 1.00 0.00 N ATOM 1259 CA PRO A 80 -4.935 4.963 11.570 1.00 0.00 C ATOM 1260 C PRO A 80 -3.441 4.673 11.708 1.00 0.00 C ATOM 1261 O PRO A 80 -3.047 3.601 12.168 1.00 0.00 O ATOM 1262 CB PRO A 80 -5.746 3.981 12.421 1.00 0.00 C ATOM 1263 CG PRO A 80 -6.940 3.643 11.599 1.00 0.00 C ATOM 1264 CD PRO A 80 -6.498 3.729 10.164 1.00 0.00 C ATOM 0 HA PRO A 80 -5.065 6.003 11.870 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.164 3.089 12.655 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.036 4.430 13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.305 2.643 11.835 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.758 4.336 11.797 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.147 2.766 9.793 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.312 4.045 9.511 1.00 0.00 H new ATOM 1272 N GLY A 81 -2.618 5.630 11.299 1.00 0.00 N ATOM 1273 CA GLY A 81 -1.179 5.459 11.375 1.00 0.00 C ATOM 1274 C GLY A 81 -0.460 5.996 10.145 1.00 0.00 C ATOM 1275 O GLY A 81 0.768 6.087 10.134 1.00 0.00 O ATOM 0 H GLY A 81 -2.922 6.525 10.915 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.803 5.968 12.262 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.948 4.400 11.493 1.00 0.00 H new ATOM 1279 N LYS A 82 -1.219 6.359 9.106 1.00 0.00 N ATOM 1280 CA LYS A 82 -0.624 6.895 7.875 1.00 0.00 C ATOM 1281 C LYS A 82 0.417 5.934 7.312 1.00 0.00 C ATOM 1282 O LYS A 82 1.410 6.356 6.718 1.00 0.00 O ATOM 1283 CB LYS A 82 0.030 8.258 8.135 1.00 0.00 C ATOM 1284 CG LYS A 82 -0.587 9.050 9.283 1.00 0.00 C ATOM 1285 CD LYS A 82 0.357 9.130 10.472 1.00 0.00 C ATOM 1286 CE LYS A 82 -0.194 10.030 11.567 1.00 0.00 C ATOM 1287 NZ LYS A 82 0.765 11.106 11.938 1.00 0.00 N ATOM 0 H LYS A 82 -2.237 6.293 9.091 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.426 7.017 7.147 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.088 8.104 8.345 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.031 8.855 7.225 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.832 10.056 8.943 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.522 8.581 9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.524 8.130 10.872 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.325 9.507 10.143 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -1.130 10.478 11.232 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -0.425 9.430 12.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 1.302 10.817 12.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.421 11.273 11.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 0.242 11.981 12.145 1.00 0.00 H new ATOM 1301 N ALA A 83 0.190 4.642 7.514 1.00 0.00 N ATOM 1302 CA ALA A 83 1.115 3.617 7.041 1.00 0.00 C ATOM 1303 C ALA A 83 0.506 2.773 5.920 1.00 0.00 C ATOM 1304 O ALA A 83 -0.631 2.319 6.021 1.00 0.00 O ATOM 1305 CB ALA A 83 1.533 2.730 8.206 1.00 0.00 C ATOM 0 H ALA A 83 -0.628 4.278 8.003 1.00 0.00 H new ATOM 0 HA ALA A 83 1.991 4.117 6.629 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.224 1.965 7.851 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.023 3.337 8.968 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.652 2.253 8.634 1.00 0.00 H new ATOM 1311 N ILE A 84 1.280 2.553 4.856 1.00 0.00 N ATOM 1312 CA ILE A 84 0.820 1.745 3.728 1.00 0.00 C ATOM 1313 C ILE A 84 1.198 0.282 3.938 1.00 0.00 C ATOM 1314 O ILE A 84 2.206 -0.013 4.580 1.00 0.00 O ATOM 1315 CB ILE A 84 1.423 2.234 2.397 1.00 0.00 C ATOM 1316 CG1 ILE A 84 1.332 3.759 2.296 1.00 0.00 C ATOM 1317 CG2 ILE A 84 0.715 1.578 1.222 1.00 0.00 C ATOM 1318 CD1 ILE A 84 1.920 4.317 1.016 1.00 0.00 C ATOM 0 H ILE A 84 2.225 2.922 4.753 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.264 1.846 3.676 1.00 0.00 H new ATOM 0 HB ILE A 84 2.475 1.950 2.368 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.286 4.058 2.366 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.848 4.203 3.147 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.152 1.934 0.289 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.829 0.496 1.287 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.344 1.834 1.247 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.821 5.402 1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.975 4.049 0.953 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.388 3.902 0.160 1.00 0.00 H new ATOM 1330 N CYS A 85 0.385 -0.637 3.421 1.00 0.00 N ATOM 1331 CA CYS A 85 0.662 -2.061 3.597 1.00 0.00 C ATOM 1332 C CYS A 85 0.301 -2.894 2.365 1.00 0.00 C ATOM 1333 O CYS A 85 -0.535 -2.504 1.551 1.00 0.00 O ATOM 1334 CB CYS A 85 -0.094 -2.579 4.826 1.00 0.00 C ATOM 1335 SG CYS A 85 0.003 -4.366 5.082 1.00 0.00 S ATOM 0 H CYS A 85 -0.457 -0.427 2.885 1.00 0.00 H new ATOM 0 HA CYS A 85 1.737 -2.169 3.742 1.00 0.00 H new ATOM 0 HB2 CYS A 85 0.296 -2.078 5.712 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -1.143 -2.296 4.735 1.00 0.00 H new ATOM 0 HG CYS A 85 -1.121 -4.916 4.731 1.00 0.00 H new ATOM 1341 N LEU A 86 0.938 -4.063 2.263 1.00 0.00 N ATOM 1342 CA LEU A 86 0.705 -5.000 1.162 1.00 0.00 C ATOM 1343 C LEU A 86 0.024 -6.266 1.689 1.00 0.00 C ATOM 1344 O LEU A 86 0.139 -6.588 2.872 1.00 0.00 O ATOM 1345 CB LEU A 86 2.033 -5.373 0.485 1.00 0.00 C ATOM 1346 CG LEU A 86 2.139 -5.012 -1.000 1.00 0.00 C ATOM 1347 CD1 LEU A 86 3.489 -4.381 -1.301 1.00 0.00 C ATOM 1348 CD2 LEU A 86 1.932 -6.245 -1.868 1.00 0.00 C ATOM 0 H LEU A 86 1.629 -4.386 2.940 1.00 0.00 H new ATOM 0 HA LEU A 86 0.058 -4.519 0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.845 -4.880 1.020 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.187 -6.447 0.592 1.00 0.00 H new ATOM 0 HG LEU A 86 1.356 -4.289 -1.230 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.546 -4.131 -2.361 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.607 -3.474 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.283 -5.084 -1.051 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.011 -5.967 -2.919 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.693 -6.989 -1.631 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.944 -6.663 -1.677 1.00 0.00 H new ATOM 1360 N PHE A 87 -0.679 -6.984 0.815 1.00 0.00 N ATOM 1361 CA PHE A 87 -1.361 -8.212 1.219 1.00 0.00 C ATOM 1362 C PHE A 87 -1.172 -9.321 0.190 1.00 0.00 C ATOM 1363 O PHE A 87 -1.385 -9.112 -1.005 1.00 0.00 O ATOM 1364 CB PHE A 87 -2.857 -7.959 1.424 1.00 0.00 C ATOM 1365 CG PHE A 87 -3.169 -6.629 2.042 1.00 0.00 C ATOM 1366 CD1 PHE A 87 -2.970 -6.412 3.397 1.00 0.00 C ATOM 1367 CD2 PHE A 87 -3.659 -5.594 1.266 1.00 0.00 C ATOM 1368 CE1 PHE A 87 -3.256 -5.187 3.965 1.00 0.00 C ATOM 1369 CE2 PHE A 87 -3.948 -4.369 1.829 1.00 0.00 C ATOM 1370 CZ PHE A 87 -3.748 -4.164 3.180 1.00 0.00 C ATOM 0 H PHE A 87 -0.791 -6.740 -0.169 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.916 -8.532 2.161 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.363 -8.029 0.461 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.266 -8.747 2.056 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.587 -7.211 4.015 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.817 -5.747 0.209 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.095 -5.029 5.021 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.331 -3.569 1.213 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.976 -3.205 3.621 1.00 0.00 H new ATOM 1380 N PHE A 88 -0.784 -10.503 0.658 1.00 0.00 N ATOM 1381 CA PHE A 88 -0.586 -11.641 -0.225 1.00 0.00 C ATOM 1382 C PHE A 88 -0.439 -12.938 0.570 1.00 0.00 C ATOM 1383 O PHE A 88 0.487 -13.716 0.343 1.00 0.00 O ATOM 1384 CB PHE A 88 0.638 -11.415 -1.117 1.00 0.00 C ATOM 1385 CG PHE A 88 0.292 -11.270 -2.570 1.00 0.00 C ATOM 1386 CD1 PHE A 88 0.120 -12.388 -3.369 1.00 0.00 C ATOM 1387 CD2 PHE A 88 0.133 -10.016 -3.136 1.00 0.00 C ATOM 1388 CE1 PHE A 88 -0.205 -12.259 -4.705 1.00 0.00 C ATOM 1389 CE2 PHE A 88 -0.191 -9.879 -4.473 1.00 0.00 C ATOM 1390 CZ PHE A 88 -0.360 -11.003 -5.258 1.00 0.00 C ATOM 0 H PHE A 88 -0.601 -10.695 1.643 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.468 -11.736 -0.858 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.162 -10.519 -0.784 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.327 -12.251 -0.996 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.241 -13.373 -2.942 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.264 -9.135 -2.526 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.338 -13.139 -5.317 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -0.312 -8.896 -4.903 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.613 -10.900 -6.303 1.00 0.00 H new ATOM 1400 N GLY A 89 -1.362 -13.169 1.501 1.00 0.00 N ATOM 1401 CA GLY A 89 -1.310 -14.379 2.303 1.00 0.00 C ATOM 1402 C GLY A 89 -2.153 -14.300 3.563 1.00 0.00 C ATOM 1403 O GLY A 89 -3.282 -14.793 3.595 1.00 0.00 O ATOM 0 H GLY A 89 -2.140 -12.544 1.713 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.648 -15.221 1.700 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.275 -14.580 2.579 1.00 0.00 H new ATOM 1407 N LYS A 90 -1.603 -13.688 4.607 1.00 0.00 N ATOM 1408 CA LYS A 90 -2.307 -13.556 5.879 1.00 0.00 C ATOM 1409 C LYS A 90 -2.102 -12.177 6.498 1.00 0.00 C ATOM 1410 O LYS A 90 -1.603 -11.255 5.853 1.00 0.00 O ATOM 1411 CB LYS A 90 -1.839 -14.639 6.860 1.00 0.00 C ATOM 1412 CG LYS A 90 -0.496 -14.342 7.517 1.00 0.00 C ATOM 1413 CD LYS A 90 -0.663 -13.984 8.987 1.00 0.00 C ATOM 1414 CE LYS A 90 0.055 -14.974 9.893 1.00 0.00 C ATOM 1415 NZ LYS A 90 1.127 -14.321 10.697 1.00 0.00 N ATOM 0 H LYS A 90 -0.670 -13.275 4.598 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.371 -13.680 5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.593 -14.761 7.638 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.771 -15.589 6.331 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.156 -15.211 7.424 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.008 -13.520 6.994 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.274 -12.981 9.164 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.723 -13.964 9.238 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.667 -15.441 10.563 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.490 -15.770 9.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.056 -14.675 10.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.086 -13.291 10.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.989 -14.541 11.704 1.00 0.00 H new ATOM 1429 N THR A 91 -2.494 -12.057 7.763 1.00 0.00 N ATOM 1430 CA THR A 91 -2.365 -10.810 8.504 1.00 0.00 C ATOM 1431 C THR A 91 -2.304 -11.102 10.004 1.00 0.00 C ATOM 1432 O THR A 91 -2.296 -12.264 10.409 1.00 0.00 O ATOM 1433 CB THR A 91 -3.542 -9.885 8.183 1.00 0.00 C ATOM 1434 OG1 THR A 91 -4.457 -10.519 7.307 1.00 0.00 O ATOM 1435 CG2 THR A 91 -3.117 -8.582 7.540 1.00 0.00 C ATOM 0 H THR A 91 -2.908 -12.819 8.300 1.00 0.00 H new ATOM 0 HA THR A 91 -1.443 -10.310 8.208 1.00 0.00 H new ATOM 0 HB THR A 91 -4.007 -9.665 9.144 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.030 -11.129 7.818 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.997 -7.972 7.338 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.450 -8.044 8.214 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.597 -8.790 6.605 1.00 0.00 H new ATOM 1443 N PRO A 92 -2.256 -10.064 10.859 1.00 0.00 N ATOM 1444 CA PRO A 92 -2.193 -10.251 12.311 1.00 0.00 C ATOM 1445 C PRO A 92 -3.179 -11.301 12.821 1.00 0.00 C ATOM 1446 O PRO A 92 -2.993 -11.858 13.904 1.00 0.00 O ATOM 1447 CB PRO A 92 -2.545 -8.867 12.850 1.00 0.00 C ATOM 1448 CG PRO A 92 -2.044 -7.932 11.807 1.00 0.00 C ATOM 1449 CD PRO A 92 -2.255 -8.632 10.491 1.00 0.00 C ATOM 0 HA PRO A 92 -1.219 -10.619 12.633 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.619 -8.759 12.999 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -2.069 -8.682 13.813 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -2.585 -6.986 11.838 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.990 -7.702 11.962 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -3.195 -8.336 10.025 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -1.461 -8.400 9.781 1.00 0.00 H new ATOM 1457 N ILE A 93 -4.228 -11.575 12.046 1.00 0.00 N ATOM 1458 CA ILE A 93 -5.224 -12.563 12.446 1.00 0.00 C ATOM 1459 C ILE A 93 -5.826 -13.299 11.247 1.00 0.00 C ATOM 1460 O ILE A 93 -7.022 -13.180 10.972 1.00 0.00 O ATOM 1461 CB ILE A 93 -6.361 -11.916 13.264 1.00 0.00 C ATOM 1462 CG1 ILE A 93 -6.981 -10.740 12.498 1.00 0.00 C ATOM 1463 CG2 ILE A 93 -5.849 -11.468 14.626 1.00 0.00 C ATOM 1464 CD1 ILE A 93 -6.095 -9.511 12.422 1.00 0.00 C ATOM 0 H ILE A 93 -4.408 -11.130 11.146 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.697 -13.288 13.067 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.140 -12.662 13.421 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.219 -11.066 11.485 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -7.922 -10.467 12.974 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -6.664 -11.014 15.190 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -5.466 -12.330 15.172 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.050 -10.739 14.492 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -6.607 -8.727 11.864 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -5.877 -9.157 13.430 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -5.163 -9.765 11.917 1.00 0.00 H new ATOM 1476 N SER A 94 -5.002 -14.075 10.541 1.00 0.00 N ATOM 1477 CA SER A 94 -5.471 -14.841 9.386 1.00 0.00 C ATOM 1478 C SER A 94 -6.729 -15.634 9.742 1.00 0.00 C ATOM 1479 O SER A 94 -7.835 -15.291 9.323 1.00 0.00 O ATOM 1480 CB SER A 94 -4.382 -15.803 8.906 1.00 0.00 C ATOM 1481 OG SER A 94 -3.168 -15.595 9.604 1.00 0.00 O ATOM 0 H SER A 94 -4.010 -14.189 10.748 1.00 0.00 H new ATOM 0 HA SER A 94 -5.707 -14.138 8.587 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.714 -16.831 9.048 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.218 -15.666 7.837 1.00 0.00 H new ATOM 0 HG SER A 94 -2.462 -16.144 9.204 1.00 0.00 H new ATOM 1533 N ILE A 98 -8.458 -12.901 5.557 1.00 0.00 N ATOM 1534 CA ILE A 98 -7.358 -11.957 5.700 1.00 0.00 C ATOM 1535 C ILE A 98 -7.848 -10.627 6.257 1.00 0.00 C ATOM 1536 O ILE A 98 -8.467 -9.836 5.546 1.00 0.00 O ATOM 1537 CB ILE A 98 -6.650 -11.714 4.347 1.00 0.00 C ATOM 1538 CG1 ILE A 98 -5.889 -12.964 3.906 1.00 0.00 C ATOM 1539 CG2 ILE A 98 -5.699 -10.525 4.427 1.00 0.00 C ATOM 1540 CD1 ILE A 98 -5.383 -12.878 2.483 1.00 0.00 C ATOM 0 HA ILE A 98 -6.646 -12.397 6.399 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.418 -11.488 3.607 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -5.045 -13.124 4.577 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -6.541 -13.832 4.002 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -5.216 -10.379 3.461 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.259 -9.628 4.692 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -4.941 -10.716 5.186 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -4.852 -13.795 2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.226 -12.748 1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.706 -12.029 2.388 1.00 0.00 H new ATOM 1552 N ARG A 99 -7.552 -10.378 7.527 1.00 0.00 N ATOM 1553 CA ARG A 99 -7.951 -9.130 8.161 1.00 0.00 C ATOM 1554 C ARG A 99 -6.770 -8.164 8.205 1.00 0.00 C ATOM 1555 O ARG A 99 -5.902 -8.271 9.070 1.00 0.00 O ATOM 1556 CB ARG A 99 -8.464 -9.392 9.579 1.00 0.00 C ATOM 1557 CG ARG A 99 -9.227 -8.219 10.174 1.00 0.00 C ATOM 1558 CD ARG A 99 -10.706 -8.535 10.331 1.00 0.00 C ATOM 1559 NE ARG A 99 -11.269 -7.936 11.538 1.00 0.00 N ATOM 1560 CZ ARG A 99 -11.068 -8.411 12.766 1.00 0.00 C ATOM 1561 NH1 ARG A 99 -10.320 -9.492 12.951 1.00 0.00 N ATOM 1562 NH2 ARG A 99 -11.616 -7.805 13.810 1.00 0.00 N ATOM 0 H ARG A 99 -7.041 -11.019 8.133 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.755 -8.684 7.575 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -9.112 -10.268 9.566 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -7.619 -9.630 10.224 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -8.804 -7.964 11.146 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.107 -7.344 9.535 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.249 -8.171 9.459 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.844 -9.616 10.364 1.00 0.00 H new ATOM 0 HE ARG A 99 -11.851 -7.105 11.434 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -9.897 -9.962 12.151 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.169 -9.852 13.893 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -12.192 -6.974 13.673 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.462 -8.169 14.750 1.00 0.00 H new ATOM 1576 N PRO A 100 -6.717 -7.207 7.263 1.00 0.00 N ATOM 1577 CA PRO A 100 -5.628 -6.226 7.195 1.00 0.00 C ATOM 1578 C PRO A 100 -5.657 -5.240 8.354 1.00 0.00 C ATOM 1579 O PRO A 100 -4.615 -4.750 8.791 1.00 0.00 O ATOM 1580 CB PRO A 100 -5.880 -5.510 5.866 1.00 0.00 C ATOM 1581 CG PRO A 100 -7.343 -5.660 5.636 1.00 0.00 C ATOM 1582 CD PRO A 100 -7.702 -7.010 6.183 1.00 0.00 C ATOM 0 HA PRO A 100 -4.648 -6.699 7.259 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.592 -4.460 5.919 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.303 -5.958 5.057 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -7.902 -4.872 6.140 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -7.582 -5.591 4.575 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.724 -7.033 6.561 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.626 -7.786 5.422 1.00 0.00 H new ATOM 1590 N ALA A 101 -6.855 -4.943 8.850 1.00 0.00 N ATOM 1591 CA ALA A 101 -7.012 -4.006 9.963 1.00 0.00 C ATOM 1592 C ALA A 101 -8.487 -3.768 10.271 1.00 0.00 C ATOM 1593 O ALA A 101 -9.347 -4.552 9.869 1.00 0.00 O ATOM 1594 CB ALA A 101 -6.315 -2.690 9.641 1.00 0.00 C ATOM 0 H ALA A 101 -7.730 -5.335 8.502 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.550 -4.442 10.848 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -6.438 -2.000 10.475 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.253 -2.872 9.474 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -6.755 -2.256 8.743 1.00 0.00 H new ATOM 1600 N SER A 102 -8.775 -2.687 10.989 1.00 0.00 N ATOM 1601 CA SER A 102 -10.147 -2.357 11.351 1.00 0.00 C ATOM 1602 C SER A 102 -10.661 -1.146 10.570 1.00 0.00 C ATOM 1603 O SER A 102 -11.842 -0.808 10.657 1.00 0.00 O ATOM 1604 CB SER A 102 -10.246 -2.088 12.857 1.00 0.00 C ATOM 1605 OG SER A 102 -8.980 -2.196 13.482 1.00 0.00 O ATOM 0 H SER A 102 -8.077 -2.026 11.331 1.00 0.00 H new ATOM 0 HA SER A 102 -10.772 -3.212 11.093 1.00 0.00 H new ATOM 0 HB2 SER A 102 -10.653 -1.091 13.025 1.00 0.00 H new ATOM 0 HB3 SER A 102 -10.940 -2.796 13.310 1.00 0.00 H new ATOM 0 HG SER A 102 -9.072 -2.018 14.441 1.00 0.00 H new ATOM 1611 N ALA A 103 -9.781 -0.488 9.814 1.00 0.00 N ATOM 1612 CA ALA A 103 -10.191 0.683 9.042 1.00 0.00 C ATOM 1613 C ALA A 103 -9.111 1.142 8.062 1.00 0.00 C ATOM 1614 O ALA A 103 -8.466 2.170 8.278 1.00 0.00 O ATOM 1615 CB ALA A 103 -10.556 1.818 9.984 1.00 0.00 C ATOM 0 H ALA A 103 -8.797 -0.741 9.721 1.00 0.00 H new ATOM 0 HA ALA A 103 -11.061 0.397 8.451 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.861 2.689 9.404 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.378 1.506 10.629 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.692 2.075 10.596 1.00 0.00 H new ATOM 1621 N VAL A 104 -8.926 0.394 6.977 1.00 0.00 N ATOM 1622 CA VAL A 104 -7.926 0.763 5.968 1.00 0.00 C ATOM 1623 C VAL A 104 -8.554 0.941 4.586 1.00 0.00 C ATOM 1624 O VAL A 104 -9.475 0.218 4.211 1.00 0.00 O ATOM 1625 CB VAL A 104 -6.766 -0.258 5.899 1.00 0.00 C ATOM 1626 CG1 VAL A 104 -6.139 -0.429 7.269 1.00 0.00 C ATOM 1627 CG2 VAL A 104 -7.238 -1.601 5.359 1.00 0.00 C ATOM 0 H VAL A 104 -9.445 -0.460 6.772 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.513 1.721 6.283 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.016 0.131 5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.324 -1.150 7.209 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.751 0.530 7.614 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.891 -0.790 7.971 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.398 -2.295 5.324 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.013 -2.003 6.011 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.641 -1.468 4.355 1.00 0.00 H new ATOM 1637 N ASN A 105 -8.054 1.934 3.846 1.00 0.00 N ATOM 1638 CA ASN A 105 -8.566 2.253 2.510 1.00 0.00 C ATOM 1639 C ASN A 105 -7.958 1.369 1.428 1.00 0.00 C ATOM 1640 O ASN A 105 -6.821 0.919 1.541 1.00 0.00 O ATOM 1641 CB ASN A 105 -8.267 3.720 2.170 1.00 0.00 C ATOM 1642 CG ASN A 105 -8.434 4.644 3.358 1.00 0.00 C ATOM 1643 OD1 ASN A 105 -7.708 5.626 3.502 1.00 0.00 O ATOM 1644 ND2 ASN A 105 -9.397 4.332 4.217 1.00 0.00 N ATOM 0 H ASN A 105 -7.289 2.535 4.152 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.641 2.073 2.533 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -7.247 3.800 1.794 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.929 4.044 1.367 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -9.558 4.917 5.037 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.975 3.507 4.057 1.00 0.00 H new ATOM 1651 N VAL A 106 -8.717 1.167 0.352 1.00 0.00 N ATOM 1652 CA VAL A 106 -8.251 0.381 -0.783 1.00 0.00 C ATOM 1653 C VAL A 106 -7.425 1.279 -1.696 1.00 0.00 C ATOM 1654 O VAL A 106 -7.926 1.824 -2.680 1.00 0.00 O ATOM 1655 CB VAL A 106 -9.408 -0.248 -1.602 1.00 0.00 C ATOM 1656 CG1 VAL A 106 -9.271 -1.763 -1.641 1.00 0.00 C ATOM 1657 CG2 VAL A 106 -10.774 0.154 -1.057 1.00 0.00 C ATOM 0 H VAL A 106 -9.660 1.540 0.245 1.00 0.00 H new ATOM 0 HA VAL A 106 -7.655 -0.441 -0.387 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.337 0.138 -2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.091 -2.188 -2.220 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.322 -2.031 -2.106 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.301 -2.157 -0.625 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -11.556 -0.308 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -10.866 -0.181 -0.024 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -10.877 1.238 -1.098 1.00 0.00 H new ATOM 1667 N ILE A 107 -6.164 1.453 -1.332 1.00 0.00 N ATOM 1668 CA ILE A 107 -5.241 2.312 -2.064 1.00 0.00 C ATOM 1669 C ILE A 107 -4.920 1.805 -3.478 1.00 0.00 C ATOM 1670 O ILE A 107 -3.914 2.208 -4.065 1.00 0.00 O ATOM 1671 CB ILE A 107 -3.936 2.488 -1.255 1.00 0.00 C ATOM 1672 CG1 ILE A 107 -3.328 3.872 -1.525 1.00 0.00 C ATOM 1673 CG2 ILE A 107 -2.943 1.361 -1.546 1.00 0.00 C ATOM 1674 CD1 ILE A 107 -2.023 3.842 -2.287 1.00 0.00 C ATOM 0 H ILE A 107 -5.749 1.001 -0.517 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.742 3.272 -2.189 1.00 0.00 H new ATOM 0 HB ILE A 107 -4.175 2.427 -0.193 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -4.048 4.469 -2.085 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.167 4.377 -0.573 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.036 1.515 -0.961 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -3.390 0.404 -1.277 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.694 1.360 -2.607 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.664 4.861 -2.434 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.284 3.275 -1.721 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -2.179 3.369 -3.256 1.00 0.00 H new ATOM 1686 N GLY A 108 -5.769 0.942 -4.035 1.00 0.00 N ATOM 1687 CA GLY A 108 -5.526 0.439 -5.376 1.00 0.00 C ATOM 1688 C GLY A 108 -5.239 -1.049 -5.404 1.00 0.00 C ATOM 1689 O GLY A 108 -5.740 -1.801 -4.569 1.00 0.00 O ATOM 0 H GLY A 108 -6.613 0.586 -3.586 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.395 0.648 -6.000 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -4.683 0.975 -5.813 1.00 0.00 H new ATOM 1693 N ARG A 109 -4.431 -1.475 -6.373 1.00 0.00 N ATOM 1694 CA ARG A 109 -4.082 -2.887 -6.510 1.00 0.00 C ATOM 1695 C ARG A 109 -2.760 -3.059 -7.256 1.00 0.00 C ATOM 1696 O ARG A 109 -2.286 -2.139 -7.921 1.00 0.00 O ATOM 1697 CB ARG A 109 -5.189 -3.644 -7.249 1.00 0.00 C ATOM 1698 CG ARG A 109 -6.596 -3.314 -6.768 1.00 0.00 C ATOM 1699 CD ARG A 109 -7.646 -4.118 -7.520 1.00 0.00 C ATOM 1700 NE ARG A 109 -8.594 -4.762 -6.615 1.00 0.00 N ATOM 1701 CZ ARG A 109 -9.542 -4.109 -5.945 1.00 0.00 C ATOM 1702 NH1 ARG A 109 -9.671 -2.795 -6.078 1.00 0.00 N ATOM 1703 NH2 ARG A 109 -10.361 -4.770 -5.142 1.00 0.00 N ATOM 0 H ARG A 109 -4.007 -0.865 -7.072 1.00 0.00 H new ATOM 0 HA ARG A 109 -3.972 -3.298 -5.507 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.119 -3.421 -8.314 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.020 -4.715 -7.136 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.674 -3.520 -5.701 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.787 -2.249 -6.902 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.185 -3.461 -8.202 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.154 -4.876 -8.129 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.526 -5.772 -6.488 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.043 -2.281 -6.695 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.399 -2.299 -5.563 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.266 -5.780 -5.036 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.087 -4.269 -4.629 1.00 0.00 H new ATOM 1717 N ILE A 110 -2.180 -4.252 -7.145 1.00 0.00 N ATOM 1718 CA ILE A 110 -0.919 -4.563 -7.814 1.00 0.00 C ATOM 1719 C ILE A 110 -1.186 -5.136 -9.206 1.00 0.00 C ATOM 1720 O ILE A 110 -1.788 -6.201 -9.339 1.00 0.00 O ATOM 1721 CB ILE A 110 -0.091 -5.579 -6.995 1.00 0.00 C ATOM 1722 CG1 ILE A 110 0.145 -5.060 -5.569 1.00 0.00 C ATOM 1723 CG2 ILE A 110 1.240 -5.870 -7.681 1.00 0.00 C ATOM 1724 CD1 ILE A 110 -0.605 -5.830 -4.498 1.00 0.00 C ATOM 0 H ILE A 110 -2.565 -5.021 -6.596 1.00 0.00 H new ATOM 0 HA ILE A 110 -0.351 -3.637 -7.901 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.658 -6.508 -6.936 1.00 0.00 H new ATOM 0 HG12 ILE A 110 1.212 -5.101 -5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -0.150 -4.012 -5.522 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.806 -6.587 -7.087 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.056 -6.285 -8.672 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.811 -4.946 -7.775 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.385 -5.401 -3.520 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.676 -5.768 -4.688 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.293 -6.874 -4.515 1.00 0.00 H new ATOM 1736 N VAL A 111 -0.747 -4.424 -10.243 1.00 0.00 N ATOM 1737 CA VAL A 111 -0.961 -4.880 -11.619 1.00 0.00 C ATOM 1738 C VAL A 111 0.171 -5.791 -12.097 1.00 0.00 C ATOM 1739 O VAL A 111 0.069 -7.014 -12.005 1.00 0.00 O ATOM 1740 CB VAL A 111 -1.130 -3.708 -12.620 1.00 0.00 C ATOM 1741 CG1 VAL A 111 -2.607 -3.426 -12.879 1.00 0.00 C ATOM 1742 CG2 VAL A 111 -0.419 -2.452 -12.133 1.00 0.00 C ATOM 0 H VAL A 111 -0.247 -3.539 -10.161 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.893 -5.445 -11.596 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.667 -4.008 -13.560 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.702 -2.600 -13.584 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.079 -4.315 -13.296 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -3.097 -3.161 -11.942 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -0.558 -1.651 -12.859 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.835 -2.148 -11.172 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.645 -2.657 -12.019 1.00 0.00 H new ATOM 1816 N LEU A 117 6.076 -9.513 -2.817 1.00 0.00 N ATOM 1817 CA LEU A 117 6.815 -8.785 -1.789 1.00 0.00 C ATOM 1818 C LEU A 117 6.777 -9.528 -0.454 1.00 0.00 C ATOM 1819 O LEU A 117 7.757 -9.529 0.290 1.00 0.00 O ATOM 1820 CB LEU A 117 6.254 -7.373 -1.604 1.00 0.00 C ATOM 1821 CG LEU A 117 6.857 -6.598 -0.424 1.00 0.00 C ATOM 1822 CD1 LEU A 117 8.047 -5.759 -0.865 1.00 0.00 C ATOM 1823 CD2 LEU A 117 5.805 -5.728 0.244 1.00 0.00 C ATOM 0 HA LEU A 117 7.850 -8.713 -2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.423 -6.806 -2.519 1.00 0.00 H new ATOM 0 HB3 LEU A 117 5.175 -7.440 -1.465 1.00 0.00 H new ATOM 0 HG LEU A 117 7.213 -7.326 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.452 -5.222 -0.007 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.816 -6.409 -1.282 1.00 0.00 H new ATOM 0 HD13 LEU A 117 7.727 -5.043 -1.622 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.255 -5.188 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 117 5.410 -5.015 -0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.995 -6.356 0.614 1.00 0.00 H new ATOM 1835 N LYS A 118 5.634 -10.141 -0.151 1.00 0.00 N ATOM 1836 CA LYS A 118 5.456 -10.876 1.107 1.00 0.00 C ATOM 1837 C LYS A 118 6.681 -11.731 1.473 1.00 0.00 C ATOM 1838 O LYS A 118 6.858 -12.090 2.637 1.00 0.00 O ATOM 1839 CB LYS A 118 4.207 -11.768 1.048 1.00 0.00 C ATOM 1840 CG LYS A 118 3.831 -12.245 -0.350 1.00 0.00 C ATOM 1841 CD LYS A 118 3.319 -13.676 -0.328 1.00 0.00 C ATOM 1842 CE LYS A 118 4.461 -14.681 -0.284 1.00 0.00 C ATOM 1843 NZ LYS A 118 4.202 -15.776 0.690 1.00 0.00 N ATOM 0 H LYS A 118 4.814 -10.145 -0.758 1.00 0.00 H new ATOM 0 HA LYS A 118 5.332 -10.123 1.885 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.369 -12.639 1.683 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.365 -11.219 1.469 1.00 0.00 H new ATOM 0 HG2 LYS A 118 3.066 -11.590 -0.766 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.700 -12.178 -1.005 1.00 0.00 H new ATOM 0 HD2 LYS A 118 2.675 -13.819 0.540 1.00 0.00 H new ATOM 0 HD3 LYS A 118 2.708 -13.858 -1.212 1.00 0.00 H new ATOM 0 HE2 LYS A 118 4.608 -15.106 -1.277 1.00 0.00 H new ATOM 0 HE3 LYS A 118 5.385 -14.169 -0.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 5.004 -16.438 0.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 4.087 -15.374 1.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 3.334 -16.282 0.421 1.00 0.00 H new ATOM 1857 N GLY A 119 7.529 -12.050 0.492 1.00 0.00 N ATOM 1858 CA GLY A 119 8.714 -12.847 0.769 1.00 0.00 C ATOM 1859 C GLY A 119 9.928 -11.995 1.099 1.00 0.00 C ATOM 1860 O GLY A 119 11.063 -12.382 0.822 1.00 0.00 O ATOM 0 H GLY A 119 7.416 -11.772 -0.483 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.509 -13.519 1.603 1.00 0.00 H new ATOM 0 HA3 GLY A 119 8.937 -13.472 -0.096 1.00 0.00 H new ATOM 1864 N VAL A 120 9.683 -10.829 1.692 1.00 0.00 N ATOM 1865 CA VAL A 120 10.755 -9.907 2.065 1.00 0.00 C ATOM 1866 C VAL A 120 11.468 -10.363 3.339 1.00 0.00 C ATOM 1867 O VAL A 120 10.885 -11.063 4.167 1.00 0.00 O ATOM 1868 CB VAL A 120 10.224 -8.471 2.282 1.00 0.00 C ATOM 1869 CG1 VAL A 120 10.003 -7.769 0.951 1.00 0.00 C ATOM 1870 CG2 VAL A 120 8.943 -8.480 3.108 1.00 0.00 C ATOM 0 H VAL A 120 8.747 -10.498 1.926 1.00 0.00 H new ATOM 0 HA VAL A 120 11.461 -9.907 1.234 1.00 0.00 H new ATOM 0 HB VAL A 120 10.979 -7.915 2.838 1.00 0.00 H new ATOM 0 HG11 VAL A 120 9.629 -6.761 1.129 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.946 -7.716 0.407 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.275 -8.327 0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 120 8.591 -7.457 3.245 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.180 -9.060 2.589 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.141 -8.930 4.081 1.00 0.00 H new ATOM 1880 N ALA A 121 12.730 -9.962 3.496 1.00 0.00 N ATOM 1881 CA ALA A 121 13.505 -10.325 4.679 1.00 0.00 C ATOM 1882 C ALA A 121 13.155 -9.396 5.840 1.00 0.00 C ATOM 1883 O ALA A 121 12.838 -8.225 5.629 1.00 0.00 O ATOM 1884 CB ALA A 121 14.996 -10.267 4.376 1.00 0.00 C ATOM 0 H ALA A 121 13.234 -9.388 2.820 1.00 0.00 H new ATOM 0 HA ALA A 121 13.255 -11.347 4.964 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.559 -10.540 5.268 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.231 -10.963 3.571 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.266 -9.256 4.072 1.00 0.00 H new ATOM 1890 N ASP A 122 13.198 -9.919 7.064 1.00 0.00 N ATOM 1891 CA ASP A 122 12.865 -9.121 8.240 1.00 0.00 C ATOM 1892 C ASP A 122 13.681 -7.833 8.307 1.00 0.00 C ATOM 1893 O ASP A 122 14.893 -7.857 8.525 1.00 0.00 O ATOM 1894 CB ASP A 122 13.055 -9.931 9.523 1.00 0.00 C ATOM 1895 CG ASP A 122 14.514 -10.203 9.838 1.00 0.00 C ATOM 1896 OD1 ASP A 122 15.299 -10.402 8.888 1.00 0.00 O ATOM 1897 OD2 ASP A 122 14.870 -10.217 11.036 1.00 0.00 O ATOM 0 H ASP A 122 13.458 -10.884 7.266 1.00 0.00 H new ATOM 0 HA ASP A 122 11.814 -8.846 8.148 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.603 -9.394 10.356 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.526 -10.879 9.430 1.00 0.00 H new ATOM 1902 N GLY A 123 12.998 -6.706 8.135 1.00 0.00 N ATOM 1903 CA GLY A 123 13.655 -5.413 8.196 1.00 0.00 C ATOM 1904 C GLY A 123 14.552 -5.132 7.006 1.00 0.00 C ATOM 1905 O GLY A 123 15.690 -5.601 6.952 1.00 0.00 O ATOM 0 H GLY A 123 11.995 -6.665 7.953 1.00 0.00 H new ATOM 0 HA2 GLY A 123 12.897 -4.632 8.262 1.00 0.00 H new ATOM 0 HA3 GLY A 123 14.248 -5.359 9.109 1.00 0.00 H new ATOM 1909 N GLU A 124 14.050 -4.340 6.061 1.00 0.00 N ATOM 1910 CA GLU A 124 14.826 -3.970 4.880 1.00 0.00 C ATOM 1911 C GLU A 124 14.366 -2.621 4.331 1.00 0.00 C ATOM 1912 O GLU A 124 13.199 -2.253 4.450 1.00 0.00 O ATOM 1913 CB GLU A 124 14.747 -5.051 3.794 1.00 0.00 C ATOM 1914 CG GLU A 124 13.354 -5.603 3.542 1.00 0.00 C ATOM 1915 CD GLU A 124 13.299 -6.446 2.285 1.00 0.00 C ATOM 1916 OE1 GLU A 124 13.499 -5.888 1.186 1.00 0.00 O ATOM 1917 OE2 GLU A 124 13.068 -7.668 2.398 1.00 0.00 O ATOM 0 H GLU A 124 13.111 -3.943 6.090 1.00 0.00 H new ATOM 0 HA GLU A 124 15.869 -3.882 5.185 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.133 -4.638 2.862 1.00 0.00 H new ATOM 0 HB3 GLU A 124 15.404 -5.875 4.073 1.00 0.00 H new ATOM 0 HG2 GLU A 124 13.042 -6.204 4.396 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.647 -4.778 3.457 1.00 0.00 H new ATOM 1924 N SER A 125 15.304 -1.879 3.745 1.00 0.00 N ATOM 1925 CA SER A 125 15.014 -0.552 3.193 1.00 0.00 C ATOM 1926 C SER A 125 13.771 -0.549 2.301 1.00 0.00 C ATOM 1927 O SER A 125 13.278 -1.598 1.887 1.00 0.00 O ATOM 1928 CB SER A 125 16.218 -0.043 2.397 1.00 0.00 C ATOM 1929 OG SER A 125 16.397 1.352 2.581 1.00 0.00 O ATOM 0 H SER A 125 16.275 -2.173 3.639 1.00 0.00 H new ATOM 0 HA SER A 125 14.814 0.110 4.036 1.00 0.00 H new ATOM 0 HB2 SER A 125 17.117 -0.573 2.712 1.00 0.00 H new ATOM 0 HB3 SER A 125 16.075 -0.258 1.338 1.00 0.00 H new ATOM 0 HG SER A 125 17.173 1.653 2.064 1.00 0.00 H new ATOM 1935 N VAL A 126 13.288 0.656 2.010 1.00 0.00 N ATOM 1936 CA VAL A 126 12.113 0.858 1.163 1.00 0.00 C ATOM 1937 C VAL A 126 12.119 2.269 0.578 1.00 0.00 C ATOM 1938 O VAL A 126 12.248 3.245 1.312 1.00 0.00 O ATOM 1939 CB VAL A 126 10.793 0.652 1.942 1.00 0.00 C ATOM 1940 CG1 VAL A 126 9.596 0.750 1.009 1.00 0.00 C ATOM 1941 CG2 VAL A 126 10.792 -0.684 2.664 1.00 0.00 C ATOM 0 H VAL A 126 13.700 1.523 2.355 1.00 0.00 H new ATOM 0 HA VAL A 126 12.166 0.116 0.367 1.00 0.00 H new ATOM 0 HB VAL A 126 10.717 1.444 2.687 1.00 0.00 H new ATOM 0 HG11 VAL A 126 8.678 0.602 1.578 1.00 0.00 H new ATOM 0 HG12 VAL A 126 9.579 1.735 0.542 1.00 0.00 H new ATOM 0 HG13 VAL A 126 9.672 -0.016 0.238 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.853 -0.805 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 126 10.899 -1.490 1.938 1.00 0.00 H new ATOM 0 HG23 VAL A 126 11.623 -0.717 3.369 1.00 0.00 H new ATOM 1951 N VAL A 127 11.979 2.378 -0.741 1.00 0.00 N ATOM 1952 CA VAL A 127 11.970 3.686 -1.389 1.00 0.00 C ATOM 1953 C VAL A 127 10.715 3.874 -2.237 1.00 0.00 C ATOM 1954 O VAL A 127 10.573 3.273 -3.302 1.00 0.00 O ATOM 1955 CB VAL A 127 13.221 3.898 -2.268 1.00 0.00 C ATOM 1956 CG1 VAL A 127 14.481 3.948 -1.411 1.00 0.00 C ATOM 1957 CG2 VAL A 127 13.326 2.811 -3.329 1.00 0.00 C ATOM 0 H VAL A 127 11.871 1.586 -1.375 1.00 0.00 H new ATOM 0 HA VAL A 127 11.977 4.430 -0.592 1.00 0.00 H new ATOM 0 HB VAL A 127 13.122 4.857 -2.777 1.00 0.00 H new ATOM 0 HG11 VAL A 127 15.351 4.098 -2.051 1.00 0.00 H new ATOM 0 HG12 VAL A 127 14.406 4.772 -0.702 1.00 0.00 H new ATOM 0 HG13 VAL A 127 14.588 3.010 -0.867 1.00 0.00 H new ATOM 0 HG21 VAL A 127 14.215 2.980 -3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 127 13.397 1.837 -2.846 1.00 0.00 H new ATOM 0 HG23 VAL A 127 12.441 2.837 -3.965 1.00 0.00 H new ATOM 1967 N VAL A 128 9.805 4.714 -1.750 1.00 0.00 N ATOM 1968 CA VAL A 128 8.552 4.992 -2.452 1.00 0.00 C ATOM 1969 C VAL A 128 8.768 6.049 -3.542 1.00 0.00 C ATOM 1970 O VAL A 128 9.325 7.113 -3.271 1.00 0.00 O ATOM 1971 CB VAL A 128 7.450 5.499 -1.487 1.00 0.00 C ATOM 1972 CG1 VAL A 128 6.093 4.907 -1.840 1.00 0.00 C ATOM 1973 CG2 VAL A 128 7.791 5.187 -0.034 1.00 0.00 C ATOM 0 H VAL A 128 9.911 5.216 -0.869 1.00 0.00 H new ATOM 0 HA VAL A 128 8.226 4.052 -2.898 1.00 0.00 H new ATOM 0 HB VAL A 128 7.399 6.582 -1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 128 5.341 5.281 -1.145 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.824 5.195 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.141 3.820 -1.771 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.996 5.557 0.614 1.00 0.00 H new ATOM 0 HG22 VAL A 128 7.890 4.109 0.093 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.731 5.672 0.231 1.00 0.00 H new ATOM 1983 N GLU A 129 8.330 5.761 -4.768 1.00 0.00 N ATOM 1984 CA GLU A 129 8.489 6.702 -5.872 1.00 0.00 C ATOM 1985 C GLU A 129 7.396 6.512 -6.923 1.00 0.00 C ATOM 1986 O GLU A 129 7.160 5.399 -7.391 1.00 0.00 O ATOM 1987 CB GLU A 129 9.865 6.522 -6.517 1.00 0.00 C ATOM 1988 CG GLU A 129 10.208 5.073 -6.822 1.00 0.00 C ATOM 1989 CD GLU A 129 11.703 4.836 -6.918 1.00 0.00 C ATOM 1990 OE1 GLU A 129 12.341 4.629 -5.863 1.00 0.00 O ATOM 1991 OE2 GLU A 129 12.238 4.859 -8.046 1.00 0.00 O ATOM 0 H GLU A 129 7.865 4.888 -5.019 1.00 0.00 H new ATOM 0 HA GLU A 129 8.404 7.712 -5.470 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.902 7.098 -7.442 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.625 6.935 -5.854 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.792 4.433 -6.044 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.737 4.782 -7.761 1.00 0.00 H new ATOM 1998 N ARG A 130 6.734 7.607 -7.296 1.00 0.00 N ATOM 1999 CA ARG A 130 5.672 7.556 -8.297 1.00 0.00 C ATOM 2000 C ARG A 130 6.257 7.416 -9.698 1.00 0.00 C ATOM 2001 O ARG A 130 6.582 8.409 -10.349 1.00 0.00 O ATOM 2002 CB ARG A 130 4.807 8.816 -8.211 1.00 0.00 C ATOM 2003 CG ARG A 130 3.627 8.825 -9.170 1.00 0.00 C ATOM 2004 CD ARG A 130 3.982 9.479 -10.497 1.00 0.00 C ATOM 2005 NE ARG A 130 3.925 8.531 -11.607 1.00 0.00 N ATOM 2006 CZ ARG A 130 3.816 8.891 -12.885 1.00 0.00 C ATOM 2007 NH1 ARG A 130 3.762 10.174 -13.219 1.00 0.00 N ATOM 2008 NH2 ARG A 130 3.762 7.964 -13.831 1.00 0.00 N ATOM 0 H ARG A 130 6.915 8.538 -6.920 1.00 0.00 H new ATOM 0 HA ARG A 130 5.050 6.684 -8.095 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.434 8.919 -7.192 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.431 9.687 -8.412 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.294 7.802 -9.346 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.792 9.358 -8.714 1.00 0.00 H new ATOM 0 HD2 ARG A 130 3.296 10.304 -10.689 1.00 0.00 H new ATOM 0 HD3 ARG A 130 4.984 9.905 -10.435 1.00 0.00 H new ATOM 0 HE ARG A 130 3.971 7.535 -11.391 1.00 0.00 H new ATOM 0 HH11 ARG A 130 3.804 10.892 -12.495 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.679 10.443 -14.199 1.00 0.00 H new ATOM 0 HH21 ARG A 130 3.804 6.976 -13.580 1.00 0.00 H new ATOM 0 HH22 ARG A 130 3.679 8.238 -14.810 1.00 0.00 H new ATOM 2022 N ALA A 131 6.389 6.173 -10.154 1.00 0.00 N ATOM 2023 CA ALA A 131 6.934 5.886 -11.482 1.00 0.00 C ATOM 2024 C ALA A 131 8.135 6.771 -11.803 1.00 0.00 C ATOM 2025 O ALA A 131 9.268 6.384 -11.441 1.00 0.00 O ATOM 2026 CB ALA A 131 5.855 6.053 -12.537 1.00 0.00 C ATOM 2027 OXT ALA A 131 7.936 7.841 -12.415 1.00 0.00 O ATOM 0 H ALA A 131 6.125 5.344 -9.622 1.00 0.00 H new ATOM 0 HA ALA A 131 7.279 4.852 -11.484 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.272 5.837 -13.521 1.00 0.00 H new ATOM 0 HB2 ALA A 131 5.035 5.365 -12.331 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.483 7.077 -12.518 1.00 0.00 H new