USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=18 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 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 140:sc= -0.854 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 168:sc= 1.52 USER MOD Single : A 42 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0878) USER MOD Single : A 43 SER OG : rot 145:sc= -1.92! USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.1 K(o=0.1,f=-0.97) 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 K(o=0,f=-1.2) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -4.74 K(o=-4.7,f=-9.3!) USER MOD Single : A 66 SER OG : rot -65:sc= -0.394 USER MOD Single : A 67 LYS NZ :NH3+ -110:sc= -6.89! (180deg=-12.4!) USER MOD Single : A 77 TYR OH : rot -118:sc= 1.27 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 CYS SG : rot 151:sc= -1.55 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot -161:sc= -1.09 USER MOD Single : A 94 SER OG : rot -54:sc= -0.925! USER MOD Single : A 102 SER OG : rot 180:sc= 0.00909 USER MOD Single : A 105 ASN : amide:sc= -8.27! C(o=-8.3!,f=-18!) 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 -4.002 6.760 -11.215 1.00 0.00 N ATOM 103 CA MET A 8 -2.676 7.187 -10.780 1.00 0.00 C ATOM 104 C MET A 8 -1.933 6.049 -10.090 1.00 0.00 C ATOM 105 O MET A 8 -2.363 5.557 -9.046 1.00 0.00 O ATOM 106 CB MET A 8 -2.786 8.388 -9.837 1.00 0.00 C ATOM 107 CG MET A 8 -1.598 9.334 -9.918 1.00 0.00 C ATOM 108 SD MET A 8 -2.010 10.906 -10.700 1.00 0.00 S ATOM 109 CE MET A 8 -1.906 12.018 -9.299 1.00 0.00 C ATOM 0 HA MET A 8 -2.110 7.479 -11.665 1.00 0.00 H new ATOM 0 HB2 MET A 8 -3.697 8.940 -10.070 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.884 8.028 -8.813 1.00 0.00 H new ATOM 0 HG2 MET A 8 -1.219 9.521 -8.913 1.00 0.00 H new ATOM 0 HG3 MET A 8 -0.795 8.854 -10.477 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.135 13.033 -9.623 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.621 11.710 -8.536 1.00 0.00 H new ATOM 0 HE3 MET A 8 -0.898 11.988 -8.885 1.00 0.00 H new ATOM 119 N ARG A 9 -0.823 5.628 -10.686 1.00 0.00 N ATOM 120 CA ARG A 9 -0.026 4.536 -10.132 1.00 0.00 C ATOM 121 C ARG A 9 1.314 5.019 -9.577 1.00 0.00 C ATOM 122 O ARG A 9 1.937 5.930 -10.121 1.00 0.00 O ATOM 123 CB ARG A 9 0.200 3.450 -11.192 1.00 0.00 C ATOM 124 CG ARG A 9 1.373 3.721 -12.128 1.00 0.00 C ATOM 125 CD ARG A 9 2.607 2.930 -11.723 1.00 0.00 C ATOM 126 NE ARG A 9 3.282 2.346 -12.880 1.00 0.00 N ATOM 127 CZ ARG A 9 4.568 2.000 -12.896 1.00 0.00 C ATOM 128 NH1 ARG A 9 5.323 2.170 -11.818 1.00 0.00 N ATOM 129 NH2 ARG A 9 5.100 1.479 -13.994 1.00 0.00 N ATOM 0 H ARG A 9 -0.454 6.024 -11.551 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.590 4.117 -9.299 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.364 2.497 -10.689 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.707 3.345 -11.787 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.092 3.461 -13.149 1.00 0.00 H new ATOM 0 HG3 ARG A 9 1.605 4.786 -12.123 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.298 3.583 -11.190 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.320 2.138 -11.032 1.00 0.00 H new ATOM 0 HE ARG A 9 2.735 2.194 -13.727 1.00 0.00 H new ATOM 0 HH11 ARG A 9 4.919 2.568 -10.970 1.00 0.00 H new ATOM 0 HH12 ARG A 9 6.307 1.903 -11.837 1.00 0.00 H new ATOM 0 HH21 ARG A 9 4.524 1.344 -14.825 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.085 1.214 -14.007 1.00 0.00 H new ATOM 143 N LEU A 10 1.754 4.370 -8.502 1.00 0.00 N ATOM 144 CA LEU A 10 3.033 4.693 -7.871 1.00 0.00 C ATOM 145 C LEU A 10 3.943 3.469 -7.892 1.00 0.00 C ATOM 146 O LEU A 10 3.487 2.352 -8.134 1.00 0.00 O ATOM 147 CB LEU A 10 2.863 5.194 -6.420 1.00 0.00 C ATOM 148 CG LEU A 10 1.425 5.284 -5.895 1.00 0.00 C ATOM 149 CD1 LEU A 10 1.415 5.434 -4.375 1.00 0.00 C ATOM 150 CD2 LEU A 10 0.699 6.455 -6.541 1.00 0.00 C ATOM 0 H LEU A 10 1.242 3.614 -8.047 1.00 0.00 H new ATOM 0 HA LEU A 10 3.483 5.504 -8.444 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.426 4.533 -5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.317 6.182 -6.344 1.00 0.00 H new ATOM 0 HG LEU A 10 0.907 4.361 -6.155 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.386 5.496 -4.022 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.903 4.571 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.950 6.342 -4.095 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.321 6.507 -6.159 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.222 7.382 -6.306 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.675 6.316 -7.622 1.00 0.00 H new ATOM 162 N ARG A 11 5.228 3.685 -7.645 1.00 0.00 N ATOM 163 CA ARG A 11 6.194 2.595 -7.643 1.00 0.00 C ATOM 164 C ARG A 11 6.686 2.304 -6.225 1.00 0.00 C ATOM 165 O ARG A 11 6.824 3.214 -5.407 1.00 0.00 O ATOM 166 CB ARG A 11 7.380 2.937 -8.550 1.00 0.00 C ATOM 167 CG ARG A 11 7.754 1.821 -9.512 1.00 0.00 C ATOM 168 CD ARG A 11 8.416 0.657 -8.793 1.00 0.00 C ATOM 169 NE ARG A 11 9.775 0.419 -9.272 1.00 0.00 N ATOM 170 CZ ARG A 11 10.060 -0.217 -10.408 1.00 0.00 C ATOM 171 NH1 ARG A 11 9.083 -0.678 -11.181 1.00 0.00 N ATOM 172 NH2 ARG A 11 11.323 -0.390 -10.772 1.00 0.00 N ATOM 0 H ARG A 11 5.625 4.603 -7.444 1.00 0.00 H new ATOM 0 HA ARG A 11 5.699 1.702 -8.025 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.142 3.834 -9.122 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.244 3.175 -7.930 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.860 1.470 -10.027 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.429 2.209 -10.275 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.439 0.859 -7.722 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.819 -0.244 -8.935 1.00 0.00 H new ATOM 0 HE ARG A 11 10.551 0.759 -8.704 1.00 0.00 H new ATOM 0 HH11 ARG A 11 8.110 -0.546 -10.906 1.00 0.00 H new ATOM 0 HH12 ARG A 11 9.306 -1.164 -12.050 1.00 0.00 H new ATOM 0 HH21 ARG A 11 12.077 -0.036 -10.183 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.541 -0.877 -11.641 1.00 0.00 H new ATOM 186 N ILE A 12 6.959 1.033 -5.948 1.00 0.00 N ATOM 187 CA ILE A 12 7.447 0.619 -4.639 1.00 0.00 C ATOM 188 C ILE A 12 8.433 -0.532 -4.801 1.00 0.00 C ATOM 189 O ILE A 12 8.042 -1.679 -5.012 1.00 0.00 O ATOM 190 CB ILE A 12 6.273 0.229 -3.694 1.00 0.00 C ATOM 191 CG1 ILE A 12 5.932 1.405 -2.780 1.00 0.00 C ATOM 192 CG2 ILE A 12 6.591 -1.008 -2.860 1.00 0.00 C ATOM 193 CD1 ILE A 12 4.535 1.338 -2.201 1.00 0.00 C ATOM 0 H ILE A 12 6.850 0.270 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 12 7.962 1.460 -4.175 1.00 0.00 H new ATOM 0 HB ILE A 12 5.414 -0.014 -4.319 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.653 1.441 -1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.040 2.333 -3.341 1.00 0.00 H new ATOM 0 HG21 ILE A 12 5.743 -1.241 -2.217 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.788 -1.852 -3.521 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.470 -0.816 -2.245 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.364 2.205 -1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 12 3.805 1.334 -3.011 1.00 0.00 H new ATOM 0 HD13 ILE A 12 4.429 0.427 -1.612 1.00 0.00 H new ATOM 205 N ARG A 13 9.720 -0.208 -4.726 1.00 0.00 N ATOM 206 CA ARG A 13 10.765 -1.213 -4.887 1.00 0.00 C ATOM 207 C ARG A 13 11.356 -1.624 -3.545 1.00 0.00 C ATOM 208 O ARG A 13 11.310 -0.875 -2.569 1.00 0.00 O ATOM 209 CB ARG A 13 11.874 -0.697 -5.806 1.00 0.00 C ATOM 210 CG ARG A 13 12.487 0.615 -5.345 1.00 0.00 C ATOM 211 CD ARG A 13 13.732 0.962 -6.146 1.00 0.00 C ATOM 212 NE ARG A 13 13.410 1.719 -7.354 1.00 0.00 N ATOM 213 CZ ARG A 13 14.305 2.413 -8.052 1.00 0.00 C ATOM 214 NH1 ARG A 13 15.575 2.450 -7.666 1.00 0.00 N ATOM 215 NH2 ARG A 13 13.930 3.074 -9.141 1.00 0.00 N ATOM 0 H ARG A 13 10.063 0.737 -4.556 1.00 0.00 H new ATOM 0 HA ARG A 13 10.305 -2.091 -5.341 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.658 -1.451 -5.873 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.471 -0.567 -6.810 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.754 1.415 -5.446 1.00 0.00 H new ATOM 0 HG3 ARG A 13 12.741 0.547 -4.287 1.00 0.00 H new ATOM 0 HD2 ARG A 13 14.413 1.543 -5.524 1.00 0.00 H new ATOM 0 HD3 ARG A 13 14.254 0.045 -6.420 1.00 0.00 H new ATOM 0 HE ARG A 13 12.444 1.715 -7.681 1.00 0.00 H new ATOM 0 HH11 ARG A 13 15.869 1.945 -6.830 1.00 0.00 H new ATOM 0 HH12 ARG A 13 16.257 2.984 -8.205 1.00 0.00 H new ATOM 0 HH21 ARG A 13 12.956 3.050 -9.442 1.00 0.00 H new ATOM 0 HH22 ARG A 13 14.616 3.606 -9.676 1.00 0.00 H new ATOM 229 N PHE A 14 11.921 -2.825 -3.517 1.00 0.00 N ATOM 230 CA PHE A 14 12.542 -3.369 -2.319 1.00 0.00 C ATOM 231 C PHE A 14 13.887 -3.989 -2.683 1.00 0.00 C ATOM 232 O PHE A 14 14.013 -4.656 -3.709 1.00 0.00 O ATOM 233 CB PHE A 14 11.633 -4.418 -1.670 1.00 0.00 C ATOM 234 CG PHE A 14 10.754 -3.872 -0.577 1.00 0.00 C ATOM 235 CD1 PHE A 14 9.883 -2.822 -0.823 1.00 0.00 C ATOM 236 CD2 PHE A 14 10.799 -4.411 0.700 1.00 0.00 C ATOM 237 CE1 PHE A 14 9.075 -2.321 0.180 1.00 0.00 C ATOM 238 CE2 PHE A 14 9.993 -3.914 1.707 1.00 0.00 C ATOM 239 CZ PHE A 14 9.131 -2.868 1.447 1.00 0.00 C ATOM 0 H PHE A 14 11.961 -3.447 -4.324 1.00 0.00 H new ATOM 0 HA PHE A 14 12.697 -2.563 -1.602 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.004 -4.865 -2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.251 -5.217 -1.260 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.835 -2.390 -1.812 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.472 -5.229 0.910 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.401 -1.503 -0.027 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.038 -4.344 2.697 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.501 -2.478 2.233 1.00 0.00 H new ATOM 249 N GLU A 15 14.891 -3.750 -1.848 1.00 0.00 N ATOM 250 CA GLU A 15 16.239 -4.269 -2.090 1.00 0.00 C ATOM 251 C GLU A 15 16.226 -5.717 -2.579 1.00 0.00 C ATOM 252 O GLU A 15 17.131 -6.144 -3.297 1.00 0.00 O ATOM 253 CB GLU A 15 17.093 -4.178 -0.817 1.00 0.00 C ATOM 254 CG GLU A 15 18.017 -2.971 -0.769 1.00 0.00 C ATOM 255 CD GLU A 15 17.403 -1.723 -1.377 1.00 0.00 C ATOM 256 OE1 GLU A 15 16.229 -1.428 -1.065 1.00 0.00 O ATOM 257 OE2 GLU A 15 18.094 -1.042 -2.162 1.00 0.00 O ATOM 0 H GLU A 15 14.800 -3.199 -0.994 1.00 0.00 H new ATOM 0 HA GLU A 15 16.673 -3.648 -2.874 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.432 -4.149 0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 15 17.693 -5.084 -0.730 1.00 0.00 H new ATOM 0 HG2 GLU A 15 18.285 -2.768 0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 15 18.941 -3.208 -1.297 1.00 0.00 H new ATOM 264 N SER A 16 15.213 -6.474 -2.177 1.00 0.00 N ATOM 265 CA SER A 16 15.114 -7.876 -2.568 1.00 0.00 C ATOM 266 C SER A 16 13.770 -8.186 -3.222 1.00 0.00 C ATOM 267 O SER A 16 13.337 -9.338 -3.235 1.00 0.00 O ATOM 268 CB SER A 16 15.309 -8.775 -1.347 1.00 0.00 C ATOM 269 OG SER A 16 16.169 -8.168 -0.399 1.00 0.00 O ATOM 0 H SER A 16 14.452 -6.144 -1.584 1.00 0.00 H new ATOM 0 HA SER A 16 15.899 -8.071 -3.299 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.343 -8.982 -0.886 1.00 0.00 H new ATOM 0 HB3 SER A 16 15.725 -9.733 -1.659 1.00 0.00 H new ATOM 0 HG SER A 16 16.276 -8.762 0.373 1.00 0.00 H new ATOM 275 N ALA A 17 13.108 -7.168 -3.771 1.00 0.00 N ATOM 276 CA ALA A 17 11.811 -7.390 -4.422 1.00 0.00 C ATOM 277 C ALA A 17 11.297 -6.143 -5.140 1.00 0.00 C ATOM 278 O ALA A 17 11.601 -5.017 -4.752 1.00 0.00 O ATOM 279 CB ALA A 17 10.782 -7.876 -3.406 1.00 0.00 C ATOM 0 H ALA A 17 13.436 -6.202 -3.781 1.00 0.00 H new ATOM 0 HA ALA A 17 11.962 -8.159 -5.180 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.826 -8.036 -3.904 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.122 -8.813 -2.964 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.662 -7.127 -2.623 1.00 0.00 H new ATOM 285 N GLU A 18 10.509 -6.365 -6.193 1.00 0.00 N ATOM 286 CA GLU A 18 9.933 -5.272 -6.981 1.00 0.00 C ATOM 287 C GLU A 18 8.415 -5.408 -7.076 1.00 0.00 C ATOM 288 O GLU A 18 7.894 -6.515 -7.206 1.00 0.00 O ATOM 289 CB GLU A 18 10.543 -5.253 -8.383 1.00 0.00 C ATOM 290 CG GLU A 18 10.259 -6.514 -9.185 1.00 0.00 C ATOM 291 CD GLU A 18 11.399 -6.883 -10.113 1.00 0.00 C ATOM 292 OE1 GLU A 18 12.468 -7.289 -9.610 1.00 0.00 O ATOM 293 OE2 GLU A 18 11.224 -6.766 -11.345 1.00 0.00 O ATOM 0 H GLU A 18 10.254 -7.296 -6.522 1.00 0.00 H new ATOM 0 HA GLU A 18 10.164 -4.333 -6.477 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.157 -4.391 -8.927 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.622 -5.120 -8.300 1.00 0.00 H new ATOM 0 HG2 GLU A 18 10.070 -7.341 -8.500 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.351 -6.371 -9.770 1.00 0.00 H new ATOM 300 N CYS A 19 7.703 -4.278 -7.008 1.00 0.00 N ATOM 301 CA CYS A 19 6.235 -4.302 -7.087 1.00 0.00 C ATOM 302 C CYS A 19 5.664 -2.914 -7.392 1.00 0.00 C ATOM 303 O CYS A 19 6.236 -1.898 -6.995 1.00 0.00 O ATOM 304 CB CYS A 19 5.617 -4.841 -5.781 1.00 0.00 C ATOM 305 SG CYS A 19 6.789 -5.091 -4.422 1.00 0.00 S ATOM 0 H CYS A 19 8.109 -3.349 -6.900 1.00 0.00 H new ATOM 0 HA CYS A 19 5.972 -4.971 -7.906 1.00 0.00 H new ATOM 0 HB2 CYS A 19 4.844 -4.148 -5.450 1.00 0.00 H new ATOM 0 HB3 CYS A 19 5.125 -5.790 -5.995 1.00 0.00 H new ATOM 0 HG CYS A 19 6.244 -4.713 -3.304 1.00 0.00 H new ATOM 311 N GLU A 20 4.524 -2.879 -8.091 1.00 0.00 N ATOM 312 CA GLU A 20 3.869 -1.619 -8.434 1.00 0.00 C ATOM 313 C GLU A 20 2.400 -1.661 -8.022 1.00 0.00 C ATOM 314 O GLU A 20 1.837 -2.739 -7.829 1.00 0.00 O ATOM 315 CB GLU A 20 3.995 -1.336 -9.936 1.00 0.00 C ATOM 316 CG GLU A 20 5.263 -1.894 -10.558 1.00 0.00 C ATOM 317 CD GLU A 20 5.745 -1.078 -11.741 1.00 0.00 C ATOM 318 OE1 GLU A 20 6.518 -0.120 -11.526 1.00 0.00 O ATOM 319 OE2 GLU A 20 5.353 -1.396 -12.883 1.00 0.00 O ATOM 0 H GLU A 20 4.039 -3.710 -8.429 1.00 0.00 H new ATOM 0 HA GLU A 20 4.363 -0.813 -7.892 1.00 0.00 H new ATOM 0 HB2 GLU A 20 3.132 -1.759 -10.450 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.965 -0.258 -10.097 1.00 0.00 H new ATOM 0 HG2 GLU A 20 6.048 -1.929 -9.803 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.084 -2.920 -10.879 1.00 0.00 H new ATOM 326 N VAL A 21 1.784 -0.493 -7.870 1.00 0.00 N ATOM 327 CA VAL A 21 0.384 -0.425 -7.459 1.00 0.00 C ATOM 328 C VAL A 21 -0.301 0.835 -7.988 1.00 0.00 C ATOM 329 O VAL A 21 0.283 1.918 -7.999 1.00 0.00 O ATOM 330 CB VAL A 21 0.251 -0.493 -5.911 1.00 0.00 C ATOM 331 CG1 VAL A 21 1.617 -0.653 -5.259 1.00 0.00 C ATOM 332 CG2 VAL A 21 -0.468 0.727 -5.347 1.00 0.00 C ATOM 0 H VAL A 21 2.227 0.413 -8.023 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.117 -1.290 -7.893 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.355 -1.369 -5.678 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.500 -0.698 -4.176 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.083 -1.573 -5.613 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.247 0.197 -5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.539 0.639 -4.263 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.090 1.628 -5.602 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.470 0.788 -5.773 1.00 0.00 H new ATOM 342 N GLU A 22 -1.553 0.680 -8.412 1.00 0.00 N ATOM 343 CA GLU A 22 -2.341 1.794 -8.927 1.00 0.00 C ATOM 344 C GLU A 22 -3.185 2.396 -7.809 1.00 0.00 C ATOM 345 O GLU A 22 -3.111 1.949 -6.666 1.00 0.00 O ATOM 346 CB GLU A 22 -3.243 1.329 -10.072 1.00 0.00 C ATOM 347 CG GLU A 22 -2.476 0.874 -11.304 1.00 0.00 C ATOM 348 CD GLU A 22 -2.994 -0.438 -11.863 1.00 0.00 C ATOM 349 OE1 GLU A 22 -3.533 -1.246 -11.078 1.00 0.00 O ATOM 350 OE2 GLU A 22 -2.859 -0.656 -13.085 1.00 0.00 O ATOM 0 H GLU A 22 -2.045 -0.213 -8.408 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.660 2.554 -9.309 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.869 0.509 -9.720 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.912 2.143 -10.351 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.542 1.644 -12.073 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.421 0.766 -11.051 1.00 0.00 H new ATOM 357 N LEU A 23 -3.985 3.410 -8.130 1.00 0.00 N ATOM 358 CA LEU A 23 -4.827 4.040 -7.119 1.00 0.00 C ATOM 359 C LEU A 23 -6.059 4.680 -7.746 1.00 0.00 C ATOM 360 O LEU A 23 -6.020 5.157 -8.881 1.00 0.00 O ATOM 361 CB LEU A 23 -4.015 5.079 -6.323 1.00 0.00 C ATOM 362 CG LEU A 23 -4.814 6.219 -5.667 1.00 0.00 C ATOM 363 CD1 LEU A 23 -5.534 5.734 -4.413 1.00 0.00 C ATOM 364 CD2 LEU A 23 -3.887 7.376 -5.329 1.00 0.00 C ATOM 0 H LEU A 23 -4.067 3.807 -9.066 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.172 3.266 -6.433 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.464 4.555 -5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.277 5.521 -6.992 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.568 6.561 -6.376 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.090 6.560 -3.970 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.224 4.932 -4.677 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.803 5.363 -3.695 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.461 8.178 -4.865 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.116 7.035 -4.638 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.419 7.745 -6.241 1.00 0.00 H new ATOM 376 N TYR A 24 -7.152 4.688 -6.990 1.00 0.00 N ATOM 377 CA TYR A 24 -8.404 5.272 -7.458 1.00 0.00 C ATOM 378 C TYR A 24 -8.922 6.309 -6.459 1.00 0.00 C ATOM 379 O TYR A 24 -8.692 6.198 -5.255 1.00 0.00 O ATOM 380 CB TYR A 24 -9.452 4.177 -7.700 1.00 0.00 C ATOM 381 CG TYR A 24 -8.990 3.096 -8.653 1.00 0.00 C ATOM 382 CD1 TYR A 24 -8.174 3.396 -9.737 1.00 0.00 C ATOM 383 CD2 TYR A 24 -9.370 1.772 -8.467 1.00 0.00 C ATOM 384 CE1 TYR A 24 -7.751 2.410 -10.607 1.00 0.00 C ATOM 385 CE2 TYR A 24 -8.951 0.781 -9.332 1.00 0.00 C ATOM 386 CZ TYR A 24 -8.142 1.104 -10.401 1.00 0.00 C ATOM 387 OH TYR A 24 -7.722 0.119 -11.264 1.00 0.00 O ATOM 0 H TYR A 24 -7.196 4.296 -6.049 1.00 0.00 H new ATOM 0 HA TYR A 24 -8.215 5.778 -8.405 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.715 3.720 -6.746 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.359 4.635 -8.095 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -7.865 4.418 -9.902 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -10.004 1.514 -7.631 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.117 2.661 -11.445 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -9.255 -0.243 -9.172 1.00 0.00 H new ATOM 0 HH TYR A 24 -8.085 -0.745 -10.976 1.00 0.00 H new ATOM 397 N GLU A 25 -9.605 7.329 -6.976 1.00 0.00 N ATOM 398 CA GLU A 25 -10.143 8.412 -6.143 1.00 0.00 C ATOM 399 C GLU A 25 -11.107 7.920 -5.057 1.00 0.00 C ATOM 400 O GLU A 25 -11.514 8.701 -4.196 1.00 0.00 O ATOM 401 CB GLU A 25 -10.854 9.459 -7.007 1.00 0.00 C ATOM 402 CG GLU A 25 -9.932 10.210 -7.962 1.00 0.00 C ATOM 403 CD GLU A 25 -10.650 10.684 -9.210 1.00 0.00 C ATOM 404 OE1 GLU A 25 -11.863 10.412 -9.340 1.00 0.00 O ATOM 405 OE2 GLU A 25 -9.999 11.327 -10.060 1.00 0.00 O ATOM 0 H GLU A 25 -9.801 7.431 -7.972 1.00 0.00 H new ATOM 0 HA GLU A 25 -9.283 8.856 -5.642 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -11.635 8.967 -7.586 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -11.347 10.179 -6.354 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.502 11.068 -7.446 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.104 9.561 -8.247 1.00 0.00 H new ATOM 412 N GLU A 26 -11.490 6.644 -5.098 1.00 0.00 N ATOM 413 CA GLU A 26 -12.423 6.096 -4.112 1.00 0.00 C ATOM 414 C GLU A 26 -12.051 6.521 -2.690 1.00 0.00 C ATOM 415 O GLU A 26 -12.918 6.634 -1.824 1.00 0.00 O ATOM 416 CB GLU A 26 -12.461 4.566 -4.211 1.00 0.00 C ATOM 417 CG GLU A 26 -11.228 3.879 -3.642 1.00 0.00 C ATOM 418 CD GLU A 26 -11.170 2.405 -3.992 1.00 0.00 C ATOM 419 OE1 GLU A 26 -12.105 1.668 -3.614 1.00 0.00 O ATOM 420 OE2 GLU A 26 -10.191 1.987 -4.643 1.00 0.00 O ATOM 0 H GLU A 26 -11.172 5.974 -5.798 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.413 6.496 -4.333 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.343 4.200 -3.686 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.572 4.282 -5.258 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.333 4.374 -4.020 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.221 3.992 -2.558 1.00 0.00 H new ATOM 427 N TRP A 27 -10.768 6.777 -2.459 1.00 0.00 N ATOM 428 CA TRP A 27 -10.301 7.212 -1.150 1.00 0.00 C ATOM 429 C TRP A 27 -10.551 8.712 -0.996 1.00 0.00 C ATOM 430 O TRP A 27 -11.253 9.140 -0.081 1.00 0.00 O ATOM 431 CB TRP A 27 -8.814 6.869 -0.987 1.00 0.00 C ATOM 432 CG TRP A 27 -8.139 7.514 0.188 1.00 0.00 C ATOM 433 CD1 TRP A 27 -6.808 7.799 0.296 1.00 0.00 C ATOM 434 CD2 TRP A 27 -8.742 7.940 1.419 1.00 0.00 C ATOM 435 NE1 TRP A 27 -6.545 8.375 1.512 1.00 0.00 N ATOM 436 CE2 TRP A 27 -7.714 8.476 2.219 1.00 0.00 C ATOM 437 CE3 TRP A 27 -10.044 7.924 1.923 1.00 0.00 C ATOM 438 CZ2 TRP A 27 -7.951 8.990 3.492 1.00 0.00 C ATOM 439 CZ3 TRP A 27 -10.276 8.436 3.187 1.00 0.00 C ATOM 440 CH2 TRP A 27 -9.235 8.964 3.957 1.00 0.00 C ATOM 0 H TRP A 27 -10.034 6.690 -3.162 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.850 6.691 -0.366 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -8.714 5.787 -0.896 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -8.287 7.162 -1.895 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.069 7.600 -0.466 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.627 8.679 1.838 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -10.855 7.519 1.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -7.148 9.395 4.090 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -11.279 8.428 3.586 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -9.451 9.359 4.939 1.00 0.00 H new ATOM 451 N ALA A 28 -10.007 9.506 -1.926 1.00 0.00 N ATOM 452 CA ALA A 28 -10.197 10.962 -1.917 1.00 0.00 C ATOM 453 C ALA A 28 -9.062 11.689 -2.634 1.00 0.00 C ATOM 454 O ALA A 28 -7.932 11.718 -2.145 1.00 0.00 O ATOM 455 CB ALA A 28 -10.324 11.497 -0.492 1.00 0.00 C ATOM 0 H ALA A 28 -9.431 9.164 -2.695 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.125 11.156 -2.454 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.464 12.578 -0.520 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.181 11.033 -0.004 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.418 11.263 0.067 1.00 0.00 H new ATOM 461 N PRO A 29 -9.344 12.295 -3.807 1.00 0.00 N ATOM 462 CA PRO A 29 -8.339 13.030 -4.578 1.00 0.00 C ATOM 463 C PRO A 29 -7.411 13.869 -3.696 1.00 0.00 C ATOM 464 O PRO A 29 -6.252 14.097 -4.041 1.00 0.00 O ATOM 465 CB PRO A 29 -9.183 13.941 -5.470 1.00 0.00 C ATOM 466 CG PRO A 29 -10.470 13.212 -5.667 1.00 0.00 C ATOM 467 CD PRO A 29 -10.665 12.312 -4.470 1.00 0.00 C ATOM 0 HA PRO A 29 -7.677 12.357 -5.122 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -9.347 14.910 -4.999 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -8.687 14.129 -6.422 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -11.299 13.914 -5.759 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -10.444 12.628 -6.587 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -11.439 12.696 -3.805 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -10.972 11.310 -4.771 1.00 0.00 H new ATOM 475 N GLU A 30 -7.932 14.332 -2.560 1.00 0.00 N ATOM 476 CA GLU A 30 -7.158 15.150 -1.635 1.00 0.00 C ATOM 477 C GLU A 30 -5.963 14.381 -1.075 1.00 0.00 C ATOM 478 O GLU A 30 -4.837 14.875 -1.095 1.00 0.00 O ATOM 479 CB GLU A 30 -8.043 15.640 -0.488 1.00 0.00 C ATOM 480 CG GLU A 30 -7.326 16.586 0.456 1.00 0.00 C ATOM 481 CD GLU A 30 -7.097 15.984 1.828 1.00 0.00 C ATOM 482 OE1 GLU A 30 -7.959 15.203 2.285 1.00 0.00 O ATOM 483 OE2 GLU A 30 -6.057 16.292 2.447 1.00 0.00 O ATOM 0 H GLU A 30 -8.890 14.152 -2.260 1.00 0.00 H new ATOM 0 HA GLU A 30 -6.780 16.008 -2.191 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.917 16.143 -0.901 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.406 14.780 0.075 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.366 16.866 0.022 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.909 17.501 0.558 1.00 0.00 H new ATOM 490 N THR A 31 -6.211 13.172 -0.579 1.00 0.00 N ATOM 491 CA THR A 31 -5.134 12.350 -0.016 1.00 0.00 C ATOM 492 C THR A 31 -4.140 11.959 -1.104 1.00 0.00 C ATOM 493 O THR A 31 -2.927 12.057 -0.914 1.00 0.00 O ATOM 494 CB THR A 31 -5.697 11.096 0.669 1.00 0.00 C ATOM 495 OG1 THR A 31 -7.084 10.960 0.414 1.00 0.00 O ATOM 496 CG2 THR A 31 -5.505 11.095 2.175 1.00 0.00 C ATOM 0 H THR A 31 -7.135 12.740 -0.553 1.00 0.00 H new ATOM 0 HA THR A 31 -4.615 12.943 0.737 1.00 0.00 H new ATOM 0 HB THR A 31 -5.135 10.263 0.246 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.383 10.071 0.697 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.925 10.181 2.595 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.441 11.144 2.406 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.011 11.959 2.607 1.00 0.00 H new ATOM 504 N VAL A 32 -4.660 11.522 -2.249 1.00 0.00 N ATOM 505 CA VAL A 32 -3.818 11.126 -3.373 1.00 0.00 C ATOM 506 C VAL A 32 -2.742 12.173 -3.657 1.00 0.00 C ATOM 507 O VAL A 32 -1.662 11.848 -4.151 1.00 0.00 O ATOM 508 CB VAL A 32 -4.656 10.917 -4.650 1.00 0.00 C ATOM 509 CG1 VAL A 32 -3.798 10.336 -5.764 1.00 0.00 C ATOM 510 CG2 VAL A 32 -5.852 10.025 -4.365 1.00 0.00 C ATOM 0 H VAL A 32 -5.661 11.434 -2.422 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.341 10.186 -3.094 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.028 11.887 -4.980 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.407 10.196 -6.657 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.979 11.020 -5.987 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.392 9.375 -5.447 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.431 9.890 -5.279 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.506 9.055 -4.008 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.479 10.489 -3.604 1.00 0.00 H new ATOM 520 N ARG A 33 -3.048 13.429 -3.343 1.00 0.00 N ATOM 521 CA ARG A 33 -2.110 14.524 -3.567 1.00 0.00 C ATOM 522 C ARG A 33 -0.870 14.378 -2.688 1.00 0.00 C ATOM 523 O ARG A 33 0.246 14.661 -3.124 1.00 0.00 O ATOM 524 CB ARG A 33 -2.790 15.869 -3.296 1.00 0.00 C ATOM 525 CG ARG A 33 -2.101 17.051 -3.962 1.00 0.00 C ATOM 526 CD ARG A 33 -2.516 18.368 -3.326 1.00 0.00 C ATOM 527 NE ARG A 33 -1.722 19.491 -3.820 1.00 0.00 N ATOM 528 CZ ARG A 33 -1.919 20.073 -5.002 1.00 0.00 C ATOM 529 NH1 ARG A 33 -2.879 19.644 -5.810 1.00 0.00 N ATOM 530 NH2 ARG A 33 -1.152 21.088 -5.375 1.00 0.00 N ATOM 0 H ARG A 33 -3.938 13.713 -2.933 1.00 0.00 H new ATOM 0 HA ARG A 33 -1.794 14.487 -4.609 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -3.822 15.820 -3.642 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.823 16.039 -2.220 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.020 16.934 -3.886 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.346 17.065 -5.024 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -3.571 18.552 -3.531 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -2.409 18.297 -2.244 1.00 0.00 H new ATOM 0 HE ARG A 33 -0.974 19.850 -3.226 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -3.472 18.864 -5.528 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -3.024 20.094 -6.714 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -0.412 21.422 -4.757 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -1.302 21.535 -6.280 1.00 0.00 H new ATOM 544 N ALA A 34 -1.070 13.933 -1.452 1.00 0.00 N ATOM 545 CA ALA A 34 0.038 13.749 -0.521 1.00 0.00 C ATOM 546 C ALA A 34 0.952 12.622 -0.980 1.00 0.00 C ATOM 547 O ALA A 34 2.174 12.769 -0.996 1.00 0.00 O ATOM 548 CB ALA A 34 -0.484 13.474 0.878 1.00 0.00 C ATOM 0 H ALA A 34 -1.986 13.694 -1.072 1.00 0.00 H new ATOM 0 HA ALA A 34 0.620 14.670 -0.500 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.356 13.339 1.560 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.091 14.316 1.212 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.092 12.569 0.868 1.00 0.00 H new ATOM 554 N ILE A 35 0.353 11.501 -1.370 1.00 0.00 N ATOM 555 CA ILE A 35 1.128 10.357 -1.847 1.00 0.00 C ATOM 556 C ILE A 35 2.032 10.798 -3.000 1.00 0.00 C ATOM 557 O ILE A 35 3.240 10.561 -2.980 1.00 0.00 O ATOM 558 CB ILE A 35 0.245 9.182 -2.340 1.00 0.00 C ATOM 559 CG1 ILE A 35 -1.199 9.314 -1.846 1.00 0.00 C ATOM 560 CG2 ILE A 35 0.836 7.857 -1.885 1.00 0.00 C ATOM 561 CD1 ILE A 35 -1.326 9.315 -0.338 1.00 0.00 C ATOM 0 H ILE A 35 -0.657 11.359 -1.366 1.00 0.00 H new ATOM 0 HA ILE A 35 1.709 10.000 -0.997 1.00 0.00 H new ATOM 0 HB ILE A 35 0.227 9.214 -3.429 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.626 10.237 -2.239 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.789 8.492 -2.251 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.208 7.039 -2.237 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.840 7.746 -2.295 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.885 7.835 -0.796 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.376 9.412 -0.061 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.930 8.381 0.061 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.764 10.153 0.074 1.00 0.00 H new ATOM 573 N ALA A 36 1.435 11.463 -4.001 1.00 0.00 N ATOM 574 CA ALA A 36 2.187 11.955 -5.146 1.00 0.00 C ATOM 575 C ALA A 36 3.220 12.983 -4.700 1.00 0.00 C ATOM 576 O ALA A 36 4.272 13.129 -5.315 1.00 0.00 O ATOM 577 CB ALA A 36 1.251 12.556 -6.184 1.00 0.00 C ATOM 0 H ALA A 36 0.436 11.668 -4.033 1.00 0.00 H new ATOM 0 HA ALA A 36 2.709 11.114 -5.602 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.832 12.918 -7.032 1.00 0.00 H new ATOM 0 HB2 ALA A 36 0.548 11.795 -6.524 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.701 13.386 -5.741 1.00 0.00 H new ATOM 583 N ASP A 37 2.919 13.696 -3.622 1.00 0.00 N ATOM 584 CA ASP A 37 3.848 14.695 -3.102 1.00 0.00 C ATOM 585 C ASP A 37 5.065 14.019 -2.464 1.00 0.00 C ATOM 586 O ASP A 37 6.144 14.605 -2.381 1.00 0.00 O ATOM 587 CB ASP A 37 3.153 15.596 -2.081 1.00 0.00 C ATOM 588 CG ASP A 37 3.832 16.945 -1.945 1.00 0.00 C ATOM 589 OD1 ASP A 37 5.020 16.976 -1.563 1.00 0.00 O ATOM 590 OD2 ASP A 37 3.173 17.971 -2.221 1.00 0.00 O ATOM 0 H ASP A 37 2.050 13.604 -3.095 1.00 0.00 H new ATOM 0 HA ASP A 37 4.187 15.309 -3.936 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.114 15.743 -2.378 1.00 0.00 H new ATOM 0 HB3 ASP A 37 3.140 15.099 -1.111 1.00 0.00 H new ATOM 595 N ALA A 38 4.874 12.780 -2.008 1.00 0.00 N ATOM 596 CA ALA A 38 5.929 12.009 -1.369 1.00 0.00 C ATOM 597 C ALA A 38 6.586 11.026 -2.346 1.00 0.00 C ATOM 598 O ALA A 38 6.712 9.837 -2.052 1.00 0.00 O ATOM 599 CB ALA A 38 5.356 11.267 -0.171 1.00 0.00 C ATOM 0 H ALA A 38 3.983 12.288 -2.074 1.00 0.00 H new ATOM 0 HA ALA A 38 6.705 12.699 -1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.145 10.688 0.310 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.948 11.985 0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.564 10.595 -0.504 1.00 0.00 H new ATOM 605 N LEU A 39 7.016 11.536 -3.497 1.00 0.00 N ATOM 606 CA LEU A 39 7.682 10.713 -4.516 1.00 0.00 C ATOM 607 C LEU A 39 8.980 10.111 -3.932 1.00 0.00 C ATOM 608 O LEU A 39 9.080 10.015 -2.711 1.00 0.00 O ATOM 609 CB LEU A 39 7.905 11.534 -5.794 1.00 0.00 C ATOM 610 CG LEU A 39 6.631 12.115 -6.427 1.00 0.00 C ATOM 611 CD1 LEU A 39 6.872 12.432 -7.894 1.00 0.00 C ATOM 612 CD2 LEU A 39 5.455 11.150 -6.285 1.00 0.00 C ATOM 0 H LEU A 39 6.917 12.518 -3.753 1.00 0.00 H new ATOM 0 HA LEU A 39 7.048 9.873 -4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.585 12.355 -5.566 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.402 10.903 -6.530 1.00 0.00 H new ATOM 0 HG LEU A 39 6.381 13.035 -5.899 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.962 12.843 -8.332 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.678 13.161 -7.981 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.149 11.520 -8.423 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.568 11.588 -6.742 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.693 10.210 -6.783 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.264 10.962 -5.228 1.00 0.00 H new ATOM 624 N PRO A 40 9.986 9.657 -4.742 1.00 0.00 N ATOM 625 CA PRO A 40 11.209 9.051 -4.205 1.00 0.00 C ATOM 626 C PRO A 40 11.582 9.539 -2.807 1.00 0.00 C ATOM 627 O PRO A 40 12.073 10.653 -2.626 1.00 0.00 O ATOM 628 CB PRO A 40 12.250 9.464 -5.230 1.00 0.00 C ATOM 629 CG PRO A 40 11.514 9.428 -6.531 1.00 0.00 C ATOM 630 CD PRO A 40 10.047 9.665 -6.222 1.00 0.00 C ATOM 0 HA PRO A 40 11.106 7.974 -4.070 1.00 0.00 H new ATOM 0 HB2 PRO A 40 12.642 10.459 -5.021 1.00 0.00 H new ATOM 0 HB3 PRO A 40 13.099 8.781 -5.233 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.893 10.193 -7.209 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.653 8.467 -7.025 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.702 10.615 -6.630 1.00 0.00 H new ATOM 0 HD3 PRO A 40 9.418 8.886 -6.652 1.00 0.00 H new ATOM 638 N ILE A 41 11.345 8.674 -1.826 1.00 0.00 N ATOM 639 CA ILE A 41 11.649 8.966 -0.431 1.00 0.00 C ATOM 640 C ILE A 41 12.068 7.681 0.279 1.00 0.00 C ATOM 641 O ILE A 41 11.636 6.592 -0.095 1.00 0.00 O ATOM 642 CB ILE A 41 10.435 9.606 0.296 1.00 0.00 C ATOM 643 CG1 ILE A 41 10.260 11.066 -0.138 1.00 0.00 C ATOM 644 CG2 ILE A 41 10.604 9.529 1.809 1.00 0.00 C ATOM 645 CD1 ILE A 41 9.135 11.788 0.578 1.00 0.00 C ATOM 0 H ILE A 41 10.937 7.751 -1.976 1.00 0.00 H new ATOM 0 HA ILE A 41 12.467 9.686 -0.403 1.00 0.00 H new ATOM 0 HB ILE A 41 9.543 9.045 0.019 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.193 11.602 0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.073 11.096 -1.211 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.741 9.984 2.295 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.684 8.485 2.114 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.508 10.063 2.102 1.00 0.00 H new ATOM 0 HD11 ILE A 41 9.074 12.815 0.217 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.192 11.278 0.382 1.00 0.00 H new ATOM 0 HD13 ILE A 41 9.329 11.791 1.651 1.00 0.00 H new ATOM 657 N LYS A 42 12.921 7.807 1.289 1.00 0.00 N ATOM 658 CA LYS A 42 13.401 6.639 2.020 1.00 0.00 C ATOM 659 C LYS A 42 12.453 6.247 3.152 1.00 0.00 C ATOM 660 O LYS A 42 12.001 7.094 3.922 1.00 0.00 O ATOM 661 CB LYS A 42 14.805 6.899 2.574 1.00 0.00 C ATOM 662 CG LYS A 42 15.915 6.615 1.574 1.00 0.00 C ATOM 663 CD LYS A 42 17.202 6.195 2.265 1.00 0.00 C ATOM 664 CE LYS A 42 18.190 7.349 2.351 1.00 0.00 C ATOM 665 NZ LYS A 42 17.603 8.532 3.037 1.00 0.00 N ATOM 0 H LYS A 42 13.292 8.698 1.619 1.00 0.00 H new ATOM 0 HA LYS A 42 13.439 5.806 1.318 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.873 7.938 2.895 1.00 0.00 H new ATOM 0 HB3 LYS A 42 14.958 6.281 3.459 1.00 0.00 H new ATOM 0 HG2 LYS A 42 15.596 5.828 0.890 1.00 0.00 H new ATOM 0 HG3 LYS A 42 16.099 7.505 0.972 1.00 0.00 H new ATOM 0 HD2 LYS A 42 16.976 5.832 3.268 1.00 0.00 H new ATOM 0 HD3 LYS A 42 17.655 5.366 1.721 1.00 0.00 H new ATOM 0 HE2 LYS A 42 19.082 7.024 2.887 1.00 0.00 H new ATOM 0 HE3 LYS A 42 18.507 7.632 1.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 18.356 9.215 3.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 16.900 8.980 2.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 17.142 8.229 3.919 1.00 0.00 H new ATOM 679 N SER A 43 12.166 4.950 3.245 1.00 0.00 N ATOM 680 CA SER A 43 11.282 4.417 4.277 1.00 0.00 C ATOM 681 C SER A 43 11.793 3.067 4.776 1.00 0.00 C ATOM 682 O SER A 43 12.410 2.314 4.023 1.00 0.00 O ATOM 683 CB SER A 43 9.856 4.271 3.744 1.00 0.00 C ATOM 684 OG SER A 43 9.654 3.010 3.134 1.00 0.00 O ATOM 0 H SER A 43 12.538 4.243 2.610 1.00 0.00 H new ATOM 0 HA SER A 43 11.273 5.119 5.110 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.147 4.398 4.562 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.654 5.062 3.021 1.00 0.00 H new ATOM 0 HG SER A 43 8.741 2.703 3.312 1.00 0.00 H new ATOM 690 N THR A 44 11.535 2.763 6.044 1.00 0.00 N ATOM 691 CA THR A 44 11.976 1.495 6.627 1.00 0.00 C ATOM 692 C THR A 44 10.811 0.514 6.704 1.00 0.00 C ATOM 693 O THR A 44 9.736 0.846 7.204 1.00 0.00 O ATOM 694 CB THR A 44 12.566 1.721 8.019 1.00 0.00 C ATOM 695 OG1 THR A 44 12.968 3.069 8.183 1.00 0.00 O ATOM 696 CG2 THR A 44 13.768 0.845 8.310 1.00 0.00 C ATOM 0 H THR A 44 11.026 3.371 6.686 1.00 0.00 H new ATOM 0 HA THR A 44 12.750 1.073 5.986 1.00 0.00 H new ATOM 0 HB THR A 44 11.768 1.460 8.715 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.341 3.192 9.081 1.00 0.00 H new ATOM 0 HG21 THR A 44 14.137 1.056 9.314 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.479 -0.204 8.243 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.554 1.052 7.583 1.00 0.00 H new ATOM 704 N ALA A 45 11.027 -0.687 6.177 1.00 0.00 N ATOM 705 CA ALA A 45 9.990 -1.713 6.156 1.00 0.00 C ATOM 706 C ALA A 45 10.018 -2.616 7.381 1.00 0.00 C ATOM 707 O ALA A 45 11.059 -3.153 7.756 1.00 0.00 O ATOM 708 CB ALA A 45 10.112 -2.559 4.892 1.00 0.00 C ATOM 0 H ALA A 45 11.912 -0.974 5.758 1.00 0.00 H new ATOM 0 HA ALA A 45 9.035 -1.188 6.167 1.00 0.00 H new ATOM 0 HB1 ALA A 45 9.333 -3.321 4.888 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.001 -1.921 4.015 1.00 0.00 H new ATOM 0 HB3 ALA A 45 11.090 -3.040 4.869 1.00 0.00 H new ATOM 714 N ASN A 46 8.842 -2.804 7.967 1.00 0.00 N ATOM 715 CA ASN A 46 8.681 -3.677 9.126 1.00 0.00 C ATOM 716 C ASN A 46 8.105 -5.015 8.657 1.00 0.00 C ATOM 717 O ASN A 46 7.054 -5.042 8.017 1.00 0.00 O ATOM 718 CB ASN A 46 7.752 -3.034 10.158 1.00 0.00 C ATOM 719 CG ASN A 46 8.494 -2.119 11.112 1.00 0.00 C ATOM 720 OD1 ASN A 46 9.612 -2.417 11.534 1.00 0.00 O ATOM 721 ND2 ASN A 46 7.873 -0.998 11.460 1.00 0.00 N ATOM 0 H ASN A 46 7.978 -2.360 7.656 1.00 0.00 H new ATOM 0 HA ASN A 46 9.650 -3.837 9.599 1.00 0.00 H new ATOM 0 HB2 ASN A 46 6.978 -2.466 9.642 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.248 -3.816 10.726 1.00 0.00 H new ATOM 0 HD21 ASN A 46 8.322 -0.344 12.101 1.00 0.00 H new ATOM 0 HD22 ASN A 46 6.947 -0.791 11.086 1.00 0.00 H new ATOM 728 N ARG A 47 8.797 -6.121 8.930 1.00 0.00 N ATOM 729 CA ARG A 47 8.331 -7.425 8.474 1.00 0.00 C ATOM 730 C ARG A 47 7.352 -8.085 9.449 1.00 0.00 C ATOM 731 O ARG A 47 7.564 -8.088 10.661 1.00 0.00 O ATOM 732 CB ARG A 47 9.527 -8.340 8.220 1.00 0.00 C ATOM 733 CG ARG A 47 9.912 -8.418 6.750 1.00 0.00 C ATOM 734 CD ARG A 47 9.660 -9.799 6.166 1.00 0.00 C ATOM 735 NE ARG A 47 8.432 -10.406 6.679 1.00 0.00 N ATOM 736 CZ ARG A 47 8.101 -11.681 6.488 1.00 0.00 C ATOM 737 NH1 ARG A 47 8.901 -12.486 5.801 1.00 0.00 N ATOM 738 NH2 ARG A 47 6.967 -12.154 6.987 1.00 0.00 N ATOM 0 H ARG A 47 9.670 -6.139 9.457 1.00 0.00 H new ATOM 0 HA ARG A 47 7.782 -7.264 7.546 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.381 -7.982 8.795 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.295 -9.341 8.583 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.344 -7.677 6.187 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.966 -8.164 6.638 1.00 0.00 H new ATOM 0 HD2 ARG A 47 9.600 -9.726 5.080 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.506 -10.447 6.395 1.00 0.00 H new ATOM 0 HE ARG A 47 7.792 -9.818 7.214 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.775 -12.129 5.416 1.00 0.00 H new ATOM 0 HH12 ARG A 47 8.642 -13.462 5.658 1.00 0.00 H new ATOM 0 HH21 ARG A 47 6.348 -11.541 7.517 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.714 -13.131 6.840 1.00 0.00 H new ATOM 752 N TRP A 48 6.285 -8.658 8.887 1.00 0.00 N ATOM 753 CA TRP A 48 5.258 -9.351 9.656 1.00 0.00 C ATOM 754 C TRP A 48 4.573 -10.373 8.754 1.00 0.00 C ATOM 755 O TRP A 48 4.479 -10.158 7.547 1.00 0.00 O ATOM 756 CB TRP A 48 4.232 -8.360 10.223 1.00 0.00 C ATOM 757 CG TRP A 48 3.025 -9.023 10.823 1.00 0.00 C ATOM 758 CD1 TRP A 48 2.037 -9.689 10.154 1.00 0.00 C ATOM 759 CD2 TRP A 48 2.681 -9.083 12.211 1.00 0.00 C ATOM 760 NE1 TRP A 48 1.100 -10.159 11.041 1.00 0.00 N ATOM 761 CE2 TRP A 48 1.471 -9.800 12.311 1.00 0.00 C ATOM 762 CE3 TRP A 48 3.276 -8.602 13.381 1.00 0.00 C ATOM 763 CZ2 TRP A 48 0.850 -10.046 13.532 1.00 0.00 C ATOM 764 CZ3 TRP A 48 2.656 -8.846 14.593 1.00 0.00 C ATOM 765 CH2 TRP A 48 1.456 -9.562 14.660 1.00 0.00 C ATOM 0 H TRP A 48 6.112 -8.652 7.882 1.00 0.00 H new ATOM 0 HA TRP A 48 5.724 -9.859 10.500 1.00 0.00 H new ATOM 0 HB2 TRP A 48 4.714 -7.745 10.983 1.00 0.00 H new ATOM 0 HB3 TRP A 48 3.910 -7.688 9.427 1.00 0.00 H new ATOM 0 HD1 TRP A 48 1.999 -9.826 9.083 1.00 0.00 H new ATOM 0 HE1 TRP A 48 0.264 -10.689 10.795 1.00 0.00 H new ATOM 0 HE3 TRP A 48 4.203 -8.050 13.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 -0.076 -10.599 13.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 3.106 -8.478 15.503 1.00 0.00 H new ATOM 0 HH2 TRP A 48 0.998 -9.737 15.622 1.00 0.00 H new ATOM 776 N GLY A 49 4.116 -11.484 9.336 1.00 0.00 N ATOM 777 CA GLY A 49 3.459 -12.535 8.561 1.00 0.00 C ATOM 778 C GLY A 49 2.661 -12.003 7.383 1.00 0.00 C ATOM 779 O GLY A 49 1.463 -11.743 7.505 1.00 0.00 O ATOM 0 H GLY A 49 4.189 -11.677 10.335 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.213 -13.232 8.195 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.795 -13.099 9.216 1.00 0.00 H new ATOM 783 N ASP A 50 3.336 -11.828 6.246 1.00 0.00 N ATOM 784 CA ASP A 50 2.706 -11.309 5.029 1.00 0.00 C ATOM 785 C ASP A 50 2.405 -9.811 5.147 1.00 0.00 C ATOM 786 O ASP A 50 2.509 -9.074 4.166 1.00 0.00 O ATOM 787 CB ASP A 50 1.423 -12.083 4.709 1.00 0.00 C ATOM 788 CG ASP A 50 0.710 -11.548 3.482 1.00 0.00 C ATOM 789 OD1 ASP A 50 1.398 -11.200 2.500 1.00 0.00 O ATOM 790 OD2 ASP A 50 -0.536 -11.474 3.505 1.00 0.00 O ATOM 0 H ASP A 50 4.328 -12.040 6.142 1.00 0.00 H new ATOM 0 HA ASP A 50 3.413 -11.447 4.211 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.666 -13.134 4.554 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.751 -12.034 5.565 1.00 0.00 H new ATOM 795 N GLU A 51 2.035 -9.366 6.345 1.00 0.00 N ATOM 796 CA GLU A 51 1.722 -7.963 6.582 1.00 0.00 C ATOM 797 C GLU A 51 2.991 -7.116 6.607 1.00 0.00 C ATOM 798 O GLU A 51 3.974 -7.472 7.257 1.00 0.00 O ATOM 799 CB GLU A 51 0.974 -7.813 7.910 1.00 0.00 C ATOM 800 CG GLU A 51 0.043 -6.615 7.962 1.00 0.00 C ATOM 801 CD GLU A 51 0.695 -5.398 8.591 1.00 0.00 C ATOM 802 OE1 GLU A 51 1.491 -5.576 9.536 1.00 0.00 O ATOM 803 OE2 GLU A 51 0.407 -4.269 8.140 1.00 0.00 O ATOM 0 H GLU A 51 1.945 -9.961 7.169 1.00 0.00 H new ATOM 0 HA GLU A 51 1.090 -7.612 5.766 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.395 -8.718 8.094 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.701 -7.730 8.718 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.282 -6.367 6.951 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -0.850 -6.878 8.528 1.00 0.00 H new ATOM 810 N ILE A 52 2.961 -5.989 5.904 1.00 0.00 N ATOM 811 CA ILE A 52 4.105 -5.086 5.856 1.00 0.00 C ATOM 812 C ILE A 52 3.636 -3.636 5.942 1.00 0.00 C ATOM 813 O ILE A 52 2.787 -3.208 5.168 1.00 0.00 O ATOM 814 CB ILE A 52 4.948 -5.307 4.567 1.00 0.00 C ATOM 815 CG1 ILE A 52 6.381 -5.726 4.930 1.00 0.00 C ATOM 816 CG2 ILE A 52 4.977 -4.057 3.693 1.00 0.00 C ATOM 817 CD1 ILE A 52 6.555 -7.212 5.188 1.00 0.00 C ATOM 0 H ILE A 52 2.156 -5.679 5.359 1.00 0.00 H new ATOM 0 HA ILE A 52 4.742 -5.305 6.713 1.00 0.00 H new ATOM 0 HB ILE A 52 4.473 -6.105 3.997 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.049 -5.430 4.121 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.693 -5.177 5.818 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.575 -4.250 2.802 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.961 -3.796 3.398 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.416 -3.231 4.253 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.596 -7.419 5.437 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.916 -7.514 6.018 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.278 -7.771 4.294 1.00 0.00 H new ATOM 829 N TYR A 53 4.182 -2.888 6.894 1.00 0.00 N ATOM 830 CA TYR A 53 3.802 -1.488 7.073 1.00 0.00 C ATOM 831 C TYR A 53 5.022 -0.609 7.326 1.00 0.00 C ATOM 832 O TYR A 53 5.836 -0.897 8.203 1.00 0.00 O ATOM 833 CB TYR A 53 2.813 -1.349 8.236 1.00 0.00 C ATOM 834 CG TYR A 53 3.387 -1.757 9.577 1.00 0.00 C ATOM 835 CD1 TYR A 53 3.295 -3.071 10.023 1.00 0.00 C ATOM 836 CD2 TYR A 53 4.020 -0.829 10.397 1.00 0.00 C ATOM 837 CE1 TYR A 53 3.816 -3.447 11.246 1.00 0.00 C ATOM 838 CE2 TYR A 53 4.543 -1.201 11.622 1.00 0.00 C ATOM 839 CZ TYR A 53 4.438 -2.509 12.041 1.00 0.00 C ATOM 840 OH TYR A 53 4.958 -2.881 13.260 1.00 0.00 O ATOM 0 H TYR A 53 4.886 -3.223 7.552 1.00 0.00 H new ATOM 0 HA TYR A 53 3.325 -1.154 6.151 1.00 0.00 H new ATOM 0 HB2 TYR A 53 2.478 -0.313 8.294 1.00 0.00 H new ATOM 0 HB3 TYR A 53 1.933 -1.957 8.027 1.00 0.00 H new ATOM 0 HD1 TYR A 53 2.808 -3.810 9.403 1.00 0.00 H new ATOM 0 HD2 TYR A 53 4.104 0.198 10.072 1.00 0.00 H new ATOM 0 HE1 TYR A 53 3.736 -4.472 11.578 1.00 0.00 H new ATOM 0 HE2 TYR A 53 5.032 -0.469 12.248 1.00 0.00 H new ATOM 0 HH TYR A 53 5.363 -2.102 13.694 1.00 0.00 H new ATOM 850 N PHE A 54 5.135 0.470 6.557 1.00 0.00 N ATOM 851 CA PHE A 54 6.248 1.398 6.703 1.00 0.00 C ATOM 852 C PHE A 54 5.759 2.842 6.668 1.00 0.00 C ATOM 853 O PHE A 54 4.811 3.168 5.954 1.00 0.00 O ATOM 854 CB PHE A 54 7.297 1.163 5.605 1.00 0.00 C ATOM 855 CG PHE A 54 6.852 1.546 4.211 1.00 0.00 C ATOM 856 CD1 PHE A 54 6.564 2.866 3.886 1.00 0.00 C ATOM 857 CD2 PHE A 54 6.727 0.581 3.222 1.00 0.00 C ATOM 858 CE1 PHE A 54 6.159 3.209 2.610 1.00 0.00 C ATOM 859 CE2 PHE A 54 6.323 0.921 1.946 1.00 0.00 C ATOM 860 CZ PHE A 54 6.038 2.237 1.639 1.00 0.00 C ATOM 0 H PHE A 54 4.469 0.722 5.827 1.00 0.00 H new ATOM 0 HA PHE A 54 6.713 1.217 7.672 1.00 0.00 H new ATOM 0 HB2 PHE A 54 8.195 1.729 5.853 1.00 0.00 H new ATOM 0 HB3 PHE A 54 7.574 0.109 5.606 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.658 3.633 4.640 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.949 -0.450 3.453 1.00 0.00 H new ATOM 0 HE1 PHE A 54 5.937 4.239 2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.230 0.157 1.188 1.00 0.00 H new ATOM 0 HZ PHE A 54 5.721 2.504 0.642 1.00 0.00 H new ATOM 870 N THR A 55 6.419 3.709 7.431 1.00 0.00 N ATOM 871 CA THR A 55 6.054 5.125 7.468 1.00 0.00 C ATOM 872 C THR A 55 6.876 5.903 6.444 1.00 0.00 C ATOM 873 O THR A 55 8.021 5.551 6.162 1.00 0.00 O ATOM 874 CB THR A 55 6.278 5.696 8.868 1.00 0.00 C ATOM 875 OG1 THR A 55 6.257 4.665 9.840 1.00 0.00 O ATOM 876 CG2 THR A 55 5.241 6.724 9.268 1.00 0.00 C ATOM 0 H THR A 55 7.206 3.459 8.030 1.00 0.00 H new ATOM 0 HA THR A 55 4.997 5.221 7.219 1.00 0.00 H new ATOM 0 HB THR A 55 7.253 6.182 8.829 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.404 5.050 10.729 1.00 0.00 H new ATOM 0 HG21 THR A 55 5.459 7.089 10.272 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.265 7.557 8.566 1.00 0.00 H new ATOM 0 HG23 THR A 55 4.252 6.267 9.255 1.00 0.00 H new ATOM 884 N THR A 56 6.289 6.955 5.879 1.00 0.00 N ATOM 885 CA THR A 56 6.982 7.762 4.879 1.00 0.00 C ATOM 886 C THR A 56 7.089 9.227 5.301 1.00 0.00 C ATOM 887 O THR A 56 7.514 10.076 4.517 1.00 0.00 O ATOM 888 CB THR A 56 6.266 7.663 3.533 1.00 0.00 C ATOM 889 OG1 THR A 56 5.054 6.939 3.657 1.00 0.00 O ATOM 890 CG2 THR A 56 7.097 6.986 2.464 1.00 0.00 C ATOM 0 H THR A 56 5.342 7.267 6.095 1.00 0.00 H new ATOM 0 HA THR A 56 7.994 7.367 4.786 1.00 0.00 H new ATOM 0 HB THR A 56 6.079 8.693 3.230 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.612 6.890 2.784 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.531 6.948 1.533 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.017 7.550 2.307 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.342 5.973 2.781 1.00 0.00 H new ATOM 898 N GLN A 57 6.703 9.517 6.541 1.00 0.00 N ATOM 899 CA GLN A 57 6.757 10.885 7.076 1.00 0.00 C ATOM 900 C GLN A 57 5.564 11.722 6.608 1.00 0.00 C ATOM 901 O GLN A 57 5.382 12.852 7.063 1.00 0.00 O ATOM 902 CB GLN A 57 8.073 11.591 6.693 1.00 0.00 C ATOM 903 CG GLN A 57 9.315 10.720 6.837 1.00 0.00 C ATOM 904 CD GLN A 57 10.553 11.379 6.263 1.00 0.00 C ATOM 905 OE1 GLN A 57 10.466 12.210 5.360 1.00 0.00 O ATOM 906 NE2 GLN A 57 11.717 11.008 6.784 1.00 0.00 N ATOM 0 H GLN A 57 6.348 8.824 7.200 1.00 0.00 H new ATOM 0 HA GLN A 57 6.713 10.797 8.162 1.00 0.00 H new ATOM 0 HB2 GLN A 57 8.001 11.934 5.661 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.191 12.478 7.316 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.480 10.499 7.892 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.148 9.767 6.334 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.743 10.315 7.532 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.585 11.416 6.436 1.00 0.00 H new ATOM 915 N VAL A 58 4.744 11.172 5.712 1.00 0.00 N ATOM 916 CA VAL A 58 3.574 11.891 5.223 1.00 0.00 C ATOM 917 C VAL A 58 2.374 11.625 6.125 1.00 0.00 C ATOM 918 O VAL A 58 1.903 10.492 6.227 1.00 0.00 O ATOM 919 CB VAL A 58 3.227 11.507 3.765 1.00 0.00 C ATOM 920 CG1 VAL A 58 2.887 10.029 3.649 1.00 0.00 C ATOM 921 CG2 VAL A 58 2.082 12.364 3.248 1.00 0.00 C ATOM 0 H VAL A 58 4.869 10.241 5.315 1.00 0.00 H new ATOM 0 HA VAL A 58 3.816 12.954 5.241 1.00 0.00 H new ATOM 0 HB VAL A 58 4.107 11.694 3.149 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.648 9.791 2.613 1.00 0.00 H new ATOM 0 HG12 VAL A 58 3.741 9.433 3.970 1.00 0.00 H new ATOM 0 HG13 VAL A 58 2.028 9.803 4.281 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.851 12.081 2.221 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.202 12.212 3.873 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.371 13.414 3.278 1.00 0.00 H new ATOM 931 N ALA A 59 1.888 12.669 6.793 1.00 0.00 N ATOM 932 CA ALA A 59 0.749 12.526 7.697 1.00 0.00 C ATOM 933 C ALA A 59 -0.528 13.085 7.088 1.00 0.00 C ATOM 934 O ALA A 59 -0.809 14.279 7.186 1.00 0.00 O ATOM 935 CB ALA A 59 1.028 13.191 9.039 1.00 0.00 C ATOM 0 H ALA A 59 2.261 13.616 6.727 1.00 0.00 H new ATOM 0 HA ALA A 59 0.603 11.458 7.861 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.164 13.069 9.692 1.00 0.00 H new ATOM 0 HB2 ALA A 59 1.900 12.727 9.501 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.220 14.253 8.886 1.00 0.00 H new ATOM 941 N VAL A 60 -1.305 12.205 6.469 1.00 0.00 N ATOM 942 CA VAL A 60 -2.567 12.593 5.849 1.00 0.00 C ATOM 943 C VAL A 60 -3.687 11.662 6.306 1.00 0.00 C ATOM 944 O VAL A 60 -3.743 10.504 5.894 1.00 0.00 O ATOM 945 CB VAL A 60 -2.457 12.555 4.307 1.00 0.00 C ATOM 946 CG1 VAL A 60 -2.060 11.162 3.826 1.00 0.00 C ATOM 947 CG2 VAL A 60 -3.759 13.000 3.655 1.00 0.00 C ATOM 0 H VAL A 60 -1.083 11.213 6.383 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.796 13.613 6.158 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.675 13.254 4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.989 11.159 2.738 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.095 10.891 4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.813 10.440 4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.654 12.964 2.571 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.566 12.336 3.964 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -3.990 14.020 3.963 1.00 0.00 H new ATOM 957 N GLU A 61 -4.570 12.160 7.175 1.00 0.00 N ATOM 958 CA GLU A 61 -5.665 11.342 7.686 1.00 0.00 C ATOM 959 C GLU A 61 -7.011 12.044 7.534 1.00 0.00 C ATOM 960 O GLU A 61 -7.152 13.222 7.860 1.00 0.00 O ATOM 961 CB GLU A 61 -5.416 10.994 9.157 1.00 0.00 C ATOM 962 CG GLU A 61 -5.019 9.545 9.380 1.00 0.00 C ATOM 963 CD GLU A 61 -4.756 9.232 10.841 1.00 0.00 C ATOM 964 OE1 GLU A 61 -5.728 9.187 11.624 1.00 0.00 O ATOM 965 OE2 GLU A 61 -3.578 9.031 11.201 1.00 0.00 O ATOM 0 H GLU A 61 -4.547 13.114 7.534 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.700 10.426 7.097 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.631 11.641 9.547 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.318 11.207 9.730 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.811 8.894 9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.125 9.323 8.798 1.00 0.00 H new ATOM 972 N LYS A 62 -8.001 11.303 7.043 1.00 0.00 N ATOM 973 CA LYS A 62 -9.344 11.841 6.853 1.00 0.00 C ATOM 974 C LYS A 62 -10.392 10.776 7.192 1.00 0.00 C ATOM 975 O LYS A 62 -10.090 9.583 7.191 1.00 0.00 O ATOM 976 CB LYS A 62 -9.522 12.313 5.407 1.00 0.00 C ATOM 977 CG LYS A 62 -10.570 13.404 5.234 1.00 0.00 C ATOM 978 CD LYS A 62 -9.970 14.790 5.410 1.00 0.00 C ATOM 979 CE LYS A 62 -9.869 15.173 6.879 1.00 0.00 C ATOM 980 NZ LYS A 62 -10.433 16.526 7.139 1.00 0.00 N ATOM 0 H LYS A 62 -7.897 10.326 6.769 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.479 12.692 7.521 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.565 12.681 5.036 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.797 11.459 4.788 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.019 13.324 4.244 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.370 13.259 5.959 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.979 14.819 4.957 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.583 15.522 4.884 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -10.398 14.437 7.484 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -8.824 15.149 7.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -10.345 16.750 8.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -9.912 17.232 6.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.437 16.542 6.867 1.00 0.00 H new ATOM 994 N GLU A 63 -11.623 11.203 7.483 1.00 0.00 N ATOM 995 CA GLU A 63 -12.689 10.259 7.821 1.00 0.00 C ATOM 996 C GLU A 63 -13.493 9.866 6.578 1.00 0.00 C ATOM 997 O GLU A 63 -14.494 10.495 6.237 1.00 0.00 O ATOM 998 CB GLU A 63 -13.599 10.832 8.924 1.00 0.00 C ATOM 999 CG GLU A 63 -14.670 11.812 8.450 1.00 0.00 C ATOM 1000 CD GLU A 63 -16.046 11.177 8.376 1.00 0.00 C ATOM 1001 OE1 GLU A 63 -16.127 9.974 8.052 1.00 0.00 O ATOM 1002 OE2 GLU A 63 -17.041 11.883 8.644 1.00 0.00 O ATOM 0 H GLU A 63 -11.904 12.184 7.492 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.227 9.352 8.210 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -14.090 10.003 9.433 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.974 11.334 9.662 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.703 12.665 9.128 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -14.397 12.196 7.467 1.00 0.00 H new ATOM 1009 N GLU A 64 -13.038 8.820 5.898 1.00 0.00 N ATOM 1010 CA GLU A 64 -13.708 8.347 4.691 1.00 0.00 C ATOM 1011 C GLU A 64 -13.133 7.003 4.241 1.00 0.00 C ATOM 1012 O GLU A 64 -12.017 6.639 4.610 1.00 0.00 O ATOM 1013 CB GLU A 64 -13.574 9.402 3.579 1.00 0.00 C ATOM 1014 CG GLU A 64 -13.491 8.832 2.168 1.00 0.00 C ATOM 1015 CD GLU A 64 -13.754 9.877 1.102 1.00 0.00 C ATOM 1016 OE1 GLU A 64 -13.119 10.953 1.154 1.00 0.00 O ATOM 1017 OE2 GLU A 64 -14.596 9.623 0.215 1.00 0.00 O ATOM 0 H GLU A 64 -12.211 8.284 6.160 1.00 0.00 H new ATOM 0 HA GLU A 64 -14.765 8.197 4.909 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -14.427 10.078 3.634 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -12.682 9.999 3.768 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.503 8.400 2.012 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -14.213 8.022 2.064 1.00 0.00 H new ATOM 1024 N ASN A 65 -13.902 6.274 3.436 1.00 0.00 N ATOM 1025 CA ASN A 65 -13.466 4.978 2.927 1.00 0.00 C ATOM 1026 C ASN A 65 -13.287 3.979 4.066 1.00 0.00 C ATOM 1027 O ASN A 65 -14.180 3.183 4.351 1.00 0.00 O ATOM 1028 CB ASN A 65 -12.155 5.125 2.145 1.00 0.00 C ATOM 1029 CG ASN A 65 -11.696 3.816 1.532 1.00 0.00 C ATOM 1030 OD1 ASN A 65 -11.789 2.759 2.156 1.00 0.00 O ATOM 1031 ND2 ASN A 65 -11.197 3.879 0.304 1.00 0.00 N ATOM 0 H ASN A 65 -14.830 6.559 3.123 1.00 0.00 H new ATOM 0 HA ASN A 65 -14.238 4.601 2.256 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -12.287 5.866 1.356 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.379 5.503 2.810 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.872 3.030 -0.159 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.138 4.776 -0.177 1.00 0.00 H new ATOM 1038 N SER A 66 -12.122 4.039 4.712 1.00 0.00 N ATOM 1039 CA SER A 66 -11.788 3.153 5.833 1.00 0.00 C ATOM 1040 C SER A 66 -12.519 1.805 5.749 1.00 0.00 C ATOM 1041 O SER A 66 -13.547 1.615 6.397 1.00 0.00 O ATOM 1042 CB SER A 66 -12.131 3.839 7.158 1.00 0.00 C ATOM 1043 OG SER A 66 -12.267 2.895 8.208 1.00 0.00 O ATOM 0 H SER A 66 -11.383 4.701 4.475 1.00 0.00 H new ATOM 0 HA SER A 66 -10.718 2.952 5.779 1.00 0.00 H new ATOM 0 HB2 SER A 66 -11.351 4.557 7.411 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.059 4.401 7.049 1.00 0.00 H new ATOM 0 HG SER A 66 -13.038 2.316 8.030 1.00 0.00 H new ATOM 1049 N LYS A 67 -11.982 0.865 4.966 1.00 0.00 N ATOM 1050 CA LYS A 67 -12.610 -0.457 4.845 1.00 0.00 C ATOM 1051 C LYS A 67 -11.877 -1.476 5.717 1.00 0.00 C ATOM 1052 O LYS A 67 -10.711 -1.281 6.062 1.00 0.00 O ATOM 1053 CB LYS A 67 -12.674 -0.942 3.382 1.00 0.00 C ATOM 1054 CG LYS A 67 -11.362 -0.858 2.615 1.00 0.00 C ATOM 1055 CD LYS A 67 -10.453 -2.028 2.945 1.00 0.00 C ATOM 1056 CE LYS A 67 -9.101 -1.889 2.270 1.00 0.00 C ATOM 1057 NZ LYS A 67 -8.125 -2.902 2.760 1.00 0.00 N ATOM 0 H LYS A 67 -11.132 0.988 4.416 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.638 -0.361 5.196 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.016 -1.977 3.373 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.424 -0.354 2.853 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.565 -0.843 1.544 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.857 0.077 2.856 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.317 -2.091 4.025 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -10.925 -2.958 2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -9.222 -1.994 1.192 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.707 -0.889 2.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.394 -2.432 3.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.619 -3.607 3.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.680 -3.376 1.948 1.00 0.00 H new ATOM 1071 N ASP A 68 -12.570 -2.552 6.092 1.00 0.00 N ATOM 1072 CA ASP A 68 -11.973 -3.580 6.949 1.00 0.00 C ATOM 1073 C ASP A 68 -11.885 -4.943 6.258 1.00 0.00 C ATOM 1074 O ASP A 68 -11.297 -5.877 6.802 1.00 0.00 O ATOM 1075 CB ASP A 68 -12.779 -3.715 8.242 1.00 0.00 C ATOM 1076 CG ASP A 68 -14.269 -3.823 7.987 1.00 0.00 C ATOM 1077 OD1 ASP A 68 -14.669 -4.661 7.151 1.00 0.00 O ATOM 1078 OD2 ASP A 68 -15.037 -3.069 8.621 1.00 0.00 O ATOM 0 H ASP A 68 -13.536 -2.735 5.820 1.00 0.00 H new ATOM 0 HA ASP A 68 -10.955 -3.258 7.171 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -12.442 -4.597 8.786 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -12.584 -2.853 8.880 1.00 0.00 H new ATOM 1083 N VAL A 69 -12.461 -5.064 5.065 1.00 0.00 N ATOM 1084 CA VAL A 69 -12.421 -6.331 4.334 1.00 0.00 C ATOM 1085 C VAL A 69 -12.001 -6.118 2.884 1.00 0.00 C ATOM 1086 O VAL A 69 -12.343 -5.108 2.271 1.00 0.00 O ATOM 1087 CB VAL A 69 -13.782 -7.062 4.361 1.00 0.00 C ATOM 1088 CG1 VAL A 69 -13.657 -8.442 3.729 1.00 0.00 C ATOM 1089 CG2 VAL A 69 -14.306 -7.170 5.787 1.00 0.00 C ATOM 0 H VAL A 69 -12.956 -4.311 4.587 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.683 -6.952 4.841 1.00 0.00 H new ATOM 0 HB VAL A 69 -14.497 -6.480 3.779 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -14.624 -8.944 3.756 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -13.330 -8.340 2.694 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -12.927 -9.031 4.284 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -15.265 -7.688 5.784 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.594 -7.728 6.395 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.434 -6.171 6.204 1.00 0.00 H new ATOM 1099 N VAL A 70 -11.256 -7.081 2.341 1.00 0.00 N ATOM 1100 CA VAL A 70 -10.786 -6.996 0.959 1.00 0.00 C ATOM 1101 C VAL A 70 -10.439 -8.373 0.391 1.00 0.00 C ATOM 1102 O VAL A 70 -10.174 -9.315 1.139 1.00 0.00 O ATOM 1103 CB VAL A 70 -9.552 -6.076 0.834 1.00 0.00 C ATOM 1104 CG1 VAL A 70 -9.903 -4.657 1.240 1.00 0.00 C ATOM 1105 CG2 VAL A 70 -8.374 -6.591 1.661 1.00 0.00 C ATOM 0 H VAL A 70 -10.966 -7.925 2.835 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.609 -6.572 0.383 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.246 -6.079 -0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -9.021 -4.023 1.146 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.694 -4.278 0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.247 -4.649 2.274 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -7.526 -5.916 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -8.660 -6.638 2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -8.095 -7.586 1.316 1.00 0.00 H new ATOM 1115 N GLU A 71 -10.446 -8.482 -0.940 1.00 0.00 N ATOM 1116 CA GLU A 71 -10.134 -9.749 -1.606 1.00 0.00 C ATOM 1117 C GLU A 71 -8.663 -9.829 -2.002 1.00 0.00 C ATOM 1118 O GLU A 71 -8.015 -8.819 -2.259 1.00 0.00 O ATOM 1119 CB GLU A 71 -11.016 -9.957 -2.848 1.00 0.00 C ATOM 1120 CG GLU A 71 -12.435 -9.459 -2.668 1.00 0.00 C ATOM 1121 CD GLU A 71 -13.151 -9.247 -3.989 1.00 0.00 C ATOM 1122 OE1 GLU A 71 -13.754 -10.214 -4.499 1.00 0.00 O ATOM 1123 OE2 GLU A 71 -13.110 -8.112 -4.510 1.00 0.00 O ATOM 0 H GLU A 71 -10.663 -7.713 -1.574 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.342 -10.542 -0.888 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.563 -9.443 -3.696 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.040 -11.019 -3.094 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.994 -10.176 -2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.419 -8.521 -2.113 1.00 0.00 H new ATOM 1130 N LEU A 72 -8.153 -11.049 -2.042 1.00 0.00 N ATOM 1131 CA LEU A 72 -6.753 -11.304 -2.398 1.00 0.00 C ATOM 1132 C LEU A 72 -6.323 -10.512 -3.637 1.00 0.00 C ATOM 1133 O LEU A 72 -6.944 -10.618 -4.694 1.00 0.00 O ATOM 1134 CB LEU A 72 -6.551 -12.806 -2.662 1.00 0.00 C ATOM 1135 CG LEU A 72 -5.146 -13.226 -3.115 1.00 0.00 C ATOM 1136 CD1 LEU A 72 -4.344 -13.756 -1.937 1.00 0.00 C ATOM 1137 CD2 LEU A 72 -5.237 -14.280 -4.209 1.00 0.00 C ATOM 0 H LEU A 72 -8.688 -11.891 -1.831 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.137 -10.979 -1.560 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.795 -13.351 -1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.266 -13.120 -3.423 1.00 0.00 H new ATOM 0 HG LEU A 72 -4.635 -12.350 -3.516 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.350 -14.049 -2.276 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.254 -12.978 -1.179 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.852 -14.621 -1.511 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.233 -14.569 -4.521 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.764 -15.155 -3.828 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.779 -13.873 -5.063 1.00 0.00 H new ATOM 1149 N GLY A 73 -5.239 -9.744 -3.510 1.00 0.00 N ATOM 1150 CA GLY A 73 -4.735 -8.981 -4.647 1.00 0.00 C ATOM 1151 C GLY A 73 -4.823 -7.470 -4.483 1.00 0.00 C ATOM 1152 O GLY A 73 -3.995 -6.742 -5.030 1.00 0.00 O ATOM 0 H GLY A 73 -4.704 -9.636 -2.648 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.694 -9.255 -4.819 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.292 -9.270 -5.538 1.00 0.00 H new ATOM 1156 N ASP A 74 -5.827 -6.990 -3.758 1.00 0.00 N ATOM 1157 CA ASP A 74 -5.998 -5.547 -3.571 1.00 0.00 C ATOM 1158 C ASP A 74 -4.998 -4.972 -2.565 1.00 0.00 C ATOM 1159 O ASP A 74 -4.473 -5.685 -1.711 1.00 0.00 O ATOM 1160 CB ASP A 74 -7.431 -5.218 -3.141 1.00 0.00 C ATOM 1161 CG ASP A 74 -7.975 -6.192 -2.123 1.00 0.00 C ATOM 1162 OD1 ASP A 74 -7.254 -6.506 -1.152 1.00 0.00 O ATOM 1163 OD2 ASP A 74 -9.128 -6.643 -2.294 1.00 0.00 O ATOM 0 H ASP A 74 -6.529 -7.567 -3.294 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.801 -5.078 -4.535 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.458 -4.211 -2.724 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -8.078 -5.218 -4.018 1.00 0.00 H new ATOM 1168 N VAL A 75 -4.745 -3.666 -2.686 1.00 0.00 N ATOM 1169 CA VAL A 75 -3.810 -2.955 -1.801 1.00 0.00 C ATOM 1170 C VAL A 75 -4.567 -1.927 -0.946 1.00 0.00 C ATOM 1171 O VAL A 75 -5.621 -1.447 -1.362 1.00 0.00 O ATOM 1172 CB VAL A 75 -2.709 -2.233 -2.622 1.00 0.00 C ATOM 1173 CG1 VAL A 75 -1.606 -1.685 -1.724 1.00 0.00 C ATOM 1174 CG2 VAL A 75 -2.125 -3.169 -3.670 1.00 0.00 C ATOM 0 H VAL A 75 -5.178 -3.073 -3.394 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.336 -3.691 -1.151 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.176 -1.387 -3.126 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.853 -1.186 -2.335 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.032 -0.971 -1.019 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.143 -2.505 -1.175 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.354 -2.646 -4.236 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.687 -4.038 -3.178 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.915 -3.495 -4.347 1.00 0.00 H new ATOM 1184 N ALA A 76 -4.061 -1.592 0.253 1.00 0.00 N ATOM 1185 CA ALA A 76 -4.760 -0.635 1.110 1.00 0.00 C ATOM 1186 C ALA A 76 -3.809 0.185 1.985 1.00 0.00 C ATOM 1187 O ALA A 76 -2.747 -0.292 2.384 1.00 0.00 O ATOM 1188 CB ALA A 76 -5.778 -1.369 1.973 1.00 0.00 C ATOM 0 H ALA A 76 -3.192 -1.962 0.639 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.269 0.074 0.458 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.297 -0.654 2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -6.500 -1.875 1.333 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.266 -2.104 2.594 1.00 0.00 H new ATOM 1194 N TYR A 77 -4.218 1.421 2.292 1.00 0.00 N ATOM 1195 CA TYR A 77 -3.425 2.315 3.134 1.00 0.00 C ATOM 1196 C TYR A 77 -4.022 2.375 4.540 1.00 0.00 C ATOM 1197 O TYR A 77 -5.220 2.603 4.704 1.00 0.00 O ATOM 1198 CB TYR A 77 -3.356 3.720 2.501 1.00 0.00 C ATOM 1199 CG TYR A 77 -3.714 4.869 3.431 1.00 0.00 C ATOM 1200 CD1 TYR A 77 -5.039 5.181 3.712 1.00 0.00 C ATOM 1201 CD2 TYR A 77 -2.722 5.648 4.017 1.00 0.00 C ATOM 1202 CE1 TYR A 77 -5.362 6.231 4.552 1.00 0.00 C ATOM 1203 CE2 TYR A 77 -3.040 6.698 4.858 1.00 0.00 C ATOM 1204 CZ TYR A 77 -4.360 6.985 5.122 1.00 0.00 C ATOM 1205 OH TYR A 77 -4.680 8.031 5.956 1.00 0.00 O ATOM 0 H TYR A 77 -5.097 1.823 1.967 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.409 1.928 3.210 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -2.346 3.881 2.123 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.026 3.747 1.642 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -5.829 4.594 3.267 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -1.685 5.429 3.811 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.397 6.459 4.760 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -2.256 7.291 5.306 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.356 8.870 5.567 1.00 0.00 H new ATOM 1215 N TRP A 78 -3.183 2.163 5.548 1.00 0.00 N ATOM 1216 CA TRP A 78 -3.645 2.189 6.934 1.00 0.00 C ATOM 1217 C TRP A 78 -4.025 3.608 7.358 1.00 0.00 C ATOM 1218 O TRP A 78 -3.180 4.504 7.369 1.00 0.00 O ATOM 1219 CB TRP A 78 -2.569 1.628 7.870 1.00 0.00 C ATOM 1220 CG TRP A 78 -3.130 0.980 9.099 1.00 0.00 C ATOM 1221 CD1 TRP A 78 -4.243 1.362 9.786 1.00 0.00 C ATOM 1222 CD2 TRP A 78 -2.607 -0.163 9.785 1.00 0.00 C ATOM 1223 NE1 TRP A 78 -4.446 0.529 10.859 1.00 0.00 N ATOM 1224 CE2 TRP A 78 -3.453 -0.415 10.879 1.00 0.00 C ATOM 1225 CE3 TRP A 78 -1.504 -0.997 9.579 1.00 0.00 C ATOM 1226 CZ2 TRP A 78 -3.233 -1.468 11.765 1.00 0.00 C ATOM 1227 CZ3 TRP A 78 -1.285 -2.040 10.459 1.00 0.00 C ATOM 1228 CH2 TRP A 78 -2.146 -2.268 11.540 1.00 0.00 C ATOM 0 H TRP A 78 -2.187 1.973 5.435 1.00 0.00 H new ATOM 0 HA TRP A 78 -4.533 1.561 7.004 1.00 0.00 H new ATOM 0 HB2 TRP A 78 -1.968 0.899 7.326 1.00 0.00 H new ATOM 0 HB3 TRP A 78 -1.899 2.435 8.167 1.00 0.00 H new ATOM 0 HD1 TRP A 78 -4.874 2.199 9.525 1.00 0.00 H new ATOM 0 HE1 TRP A 78 -5.210 0.601 11.531 1.00 0.00 H new ATOM 0 HE3 TRP A 78 -0.835 -0.829 8.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 -3.896 -1.646 12.599 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 -0.436 -2.690 10.311 1.00 0.00 H new ATOM 0 HH2 TRP A 78 -1.948 -3.092 12.210 1.00 0.00 H new ATOM 1239 N ILE A 79 -5.296 3.810 7.705 1.00 0.00 N ATOM 1240 CA ILE A 79 -5.771 5.127 8.123 1.00 0.00 C ATOM 1241 C ILE A 79 -5.111 5.549 9.443 1.00 0.00 C ATOM 1242 O ILE A 79 -4.253 6.432 9.450 1.00 0.00 O ATOM 1243 CB ILE A 79 -7.319 5.167 8.242 1.00 0.00 C ATOM 1244 CG1 ILE A 79 -7.956 5.200 6.842 1.00 0.00 C ATOM 1245 CG2 ILE A 79 -7.776 6.360 9.074 1.00 0.00 C ATOM 1246 CD1 ILE A 79 -8.943 6.333 6.633 1.00 0.00 C ATOM 0 H ILE A 79 -6.011 3.082 7.705 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.484 5.840 7.350 1.00 0.00 H new ATOM 0 HB ILE A 79 -7.648 4.263 8.754 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -7.164 5.281 6.097 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.465 4.253 6.665 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.864 6.362 9.140 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.352 6.289 10.076 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.439 7.283 8.602 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.345 6.283 5.621 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.757 6.243 7.352 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.437 7.288 6.776 1.00 0.00 H new ATOM 1258 N PRO A 80 -5.486 4.928 10.582 1.00 0.00 N ATOM 1259 CA PRO A 80 -4.897 5.266 11.886 1.00 0.00 C ATOM 1260 C PRO A 80 -3.404 4.961 11.938 1.00 0.00 C ATOM 1261 O PRO A 80 -2.987 3.932 12.468 1.00 0.00 O ATOM 1262 CB PRO A 80 -5.658 4.372 12.871 1.00 0.00 C ATOM 1263 CG PRO A 80 -6.187 3.256 12.040 1.00 0.00 C ATOM 1264 CD PRO A 80 -6.492 3.860 10.701 1.00 0.00 C ATOM 0 HA PRO A 80 -4.983 6.330 12.107 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.001 4.002 13.658 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.465 4.919 13.359 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.455 2.453 11.950 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.082 2.824 12.488 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.401 3.128 9.898 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.507 4.255 10.658 1.00 0.00 H new ATOM 1272 N GLY A 81 -2.605 5.864 11.384 1.00 0.00 N ATOM 1273 CA GLY A 81 -1.164 5.681 11.374 1.00 0.00 C ATOM 1274 C GLY A 81 -0.518 6.173 10.088 1.00 0.00 C ATOM 1275 O GLY A 81 0.706 6.278 10.008 1.00 0.00 O ATOM 0 H GLY A 81 -2.929 6.723 10.940 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.729 6.212 12.221 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.935 4.624 11.509 1.00 0.00 H new ATOM 1279 N LYS A 82 -1.336 6.479 9.074 1.00 0.00 N ATOM 1280 CA LYS A 82 -0.812 6.968 7.792 1.00 0.00 C ATOM 1281 C LYS A 82 0.252 6.023 7.243 1.00 0.00 C ATOM 1282 O LYS A 82 1.192 6.452 6.573 1.00 0.00 O ATOM 1283 CB LYS A 82 -0.210 8.372 7.945 1.00 0.00 C ATOM 1284 CG LYS A 82 -0.827 9.212 9.060 1.00 0.00 C ATOM 1285 CD LYS A 82 0.132 9.379 10.228 1.00 0.00 C ATOM 1286 CE LYS A 82 -0.549 10.028 11.421 1.00 0.00 C ATOM 1287 NZ LYS A 82 0.391 10.872 12.208 1.00 0.00 N ATOM 0 H LYS A 82 -2.352 6.398 9.114 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.648 7.011 7.094 1.00 0.00 H new ATOM 0 HB2 LYS A 82 0.860 8.276 8.131 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.323 8.906 7.001 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.101 10.192 8.670 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.746 8.739 9.407 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.526 8.405 10.518 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.982 9.987 9.918 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -1.382 10.640 11.075 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -0.968 9.254 12.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -0.114 11.296 13.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.173 10.284 12.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 0.771 11.626 11.601 1.00 0.00 H new ATOM 1301 N ALA A 83 0.104 4.738 7.540 1.00 0.00 N ATOM 1302 CA ALA A 83 1.057 3.733 7.085 1.00 0.00 C ATOM 1303 C ALA A 83 0.455 2.843 5.999 1.00 0.00 C ATOM 1304 O ALA A 83 -0.666 2.357 6.133 1.00 0.00 O ATOM 1305 CB ALA A 83 1.522 2.893 8.266 1.00 0.00 C ATOM 0 H ALA A 83 -0.667 4.367 8.094 1.00 0.00 H new ATOM 0 HA ALA A 83 1.914 4.247 6.650 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.234 2.143 7.921 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.001 3.536 9.004 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.664 2.397 8.720 1.00 0.00 H new ATOM 1311 N ILE A 84 1.213 2.624 4.927 1.00 0.00 N ATOM 1312 CA ILE A 84 0.756 1.782 3.826 1.00 0.00 C ATOM 1313 C ILE A 84 1.152 0.329 4.067 1.00 0.00 C ATOM 1314 O ILE A 84 2.202 0.055 4.649 1.00 0.00 O ATOM 1315 CB ILE A 84 1.341 2.233 2.474 1.00 0.00 C ATOM 1316 CG1 ILE A 84 1.277 3.756 2.334 1.00 0.00 C ATOM 1317 CG2 ILE A 84 0.605 1.559 1.327 1.00 0.00 C ATOM 1318 CD1 ILE A 84 1.863 4.271 1.037 1.00 0.00 C ATOM 0 H ILE A 84 2.145 3.018 4.798 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.329 1.877 3.786 1.00 0.00 H new ATOM 0 HB ILE A 84 2.388 1.934 2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.237 4.076 2.405 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.809 4.212 3.169 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.030 1.888 0.379 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.707 0.477 1.415 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.451 1.828 1.364 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.783 5.358 1.008 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.912 3.983 0.972 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.316 3.844 0.196 1.00 0.00 H new ATOM 1330 N CYS A 85 0.309 -0.604 3.630 1.00 0.00 N ATOM 1331 CA CYS A 85 0.595 -2.022 3.824 1.00 0.00 C ATOM 1332 C CYS A 85 0.239 -2.862 2.595 1.00 0.00 C ATOM 1333 O CYS A 85 -0.602 -2.479 1.781 1.00 0.00 O ATOM 1334 CB CYS A 85 -0.156 -2.538 5.056 1.00 0.00 C ATOM 1335 SG CYS A 85 -0.111 -4.332 5.275 1.00 0.00 S ATOM 0 H CYS A 85 -0.567 -0.407 3.145 1.00 0.00 H new ATOM 0 HA CYS A 85 1.669 -2.123 3.978 1.00 0.00 H new ATOM 0 HB2 CYS A 85 0.265 -2.067 5.944 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -1.197 -2.220 4.989 1.00 0.00 H new ATOM 0 HG CYS A 85 -0.202 -4.617 6.540 1.00 0.00 H new ATOM 1341 N LEU A 86 0.894 -4.017 2.488 1.00 0.00 N ATOM 1342 CA LEU A 86 0.672 -4.951 1.381 1.00 0.00 C ATOM 1343 C LEU A 86 -0.053 -6.203 1.881 1.00 0.00 C ATOM 1344 O LEU A 86 0.023 -6.538 3.064 1.00 0.00 O ATOM 1345 CB LEU A 86 2.013 -5.354 0.751 1.00 0.00 C ATOM 1346 CG LEU A 86 2.193 -4.978 -0.722 1.00 0.00 C ATOM 1347 CD1 LEU A 86 3.583 -4.408 -0.957 1.00 0.00 C ATOM 1348 CD2 LEU A 86 1.968 -6.190 -1.614 1.00 0.00 C ATOM 0 H LEU A 86 1.591 -4.332 3.162 1.00 0.00 H new ATOM 0 HA LEU A 86 0.056 -4.456 0.630 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.817 -4.893 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.130 -6.433 0.849 1.00 0.00 H new ATOM 0 HG LEU A 86 1.454 -4.218 -0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.696 -4.146 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.719 -3.517 -0.344 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.332 -5.152 -0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.100 -5.903 -2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.686 -6.969 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.956 -6.567 -1.467 1.00 0.00 H new ATOM 1360 N PHE A 87 -0.749 -6.896 0.981 1.00 0.00 N ATOM 1361 CA PHE A 87 -1.470 -8.111 1.354 1.00 0.00 C ATOM 1362 C PHE A 87 -1.274 -9.208 0.318 1.00 0.00 C ATOM 1363 O PHE A 87 -1.503 -8.998 -0.873 1.00 0.00 O ATOM 1364 CB PHE A 87 -2.961 -7.821 1.527 1.00 0.00 C ATOM 1365 CG PHE A 87 -3.239 -6.513 2.204 1.00 0.00 C ATOM 1366 CD1 PHE A 87 -3.062 -6.370 3.571 1.00 0.00 C ATOM 1367 CD2 PHE A 87 -3.676 -5.424 1.472 1.00 0.00 C ATOM 1368 CE1 PHE A 87 -3.314 -5.163 4.194 1.00 0.00 C ATOM 1369 CE2 PHE A 87 -3.930 -4.217 2.087 1.00 0.00 C ATOM 1370 CZ PHE A 87 -3.749 -4.085 3.450 1.00 0.00 C ATOM 0 H PHE A 87 -0.829 -6.640 -0.003 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.063 -8.457 2.304 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.440 -7.824 0.548 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.415 -8.625 2.106 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.723 -7.212 4.156 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.820 -5.521 0.406 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.171 -5.063 5.260 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.271 -3.375 1.503 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.948 -3.140 3.933 1.00 0.00 H new ATOM 1380 N PHE A 88 -0.853 -10.380 0.777 1.00 0.00 N ATOM 1381 CA PHE A 88 -0.629 -11.513 -0.107 1.00 0.00 C ATOM 1382 C PHE A 88 -0.439 -12.801 0.694 1.00 0.00 C ATOM 1383 O PHE A 88 0.514 -13.549 0.471 1.00 0.00 O ATOM 1384 CB PHE A 88 0.593 -11.255 -0.992 1.00 0.00 C ATOM 1385 CG PHE A 88 0.325 -11.467 -2.452 1.00 0.00 C ATOM 1386 CD1 PHE A 88 -0.266 -10.470 -3.210 1.00 0.00 C ATOM 1387 CD2 PHE A 88 0.665 -12.661 -3.066 1.00 0.00 C ATOM 1388 CE1 PHE A 88 -0.515 -10.661 -4.556 1.00 0.00 C ATOM 1389 CE2 PHE A 88 0.419 -12.858 -4.413 1.00 0.00 C ATOM 1390 CZ PHE A 88 -0.172 -11.856 -5.158 1.00 0.00 C ATOM 0 H PHE A 88 -0.660 -10.569 1.760 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.508 -11.633 -0.740 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.935 -10.232 -0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.404 -11.913 -0.680 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.535 -9.533 -2.744 1.00 0.00 H new ATOM 0 HD2 PHE A 88 1.127 -13.447 -2.487 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.977 -9.877 -5.137 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.688 -13.793 -4.881 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.366 -12.007 -6.210 1.00 0.00 H new ATOM 1400 N GLY A 89 -1.352 -13.056 1.627 1.00 0.00 N ATOM 1401 CA GLY A 89 -1.257 -14.259 2.441 1.00 0.00 C ATOM 1402 C GLY A 89 -2.149 -14.219 3.670 1.00 0.00 C ATOM 1403 O GLY A 89 -3.249 -14.770 3.660 1.00 0.00 O ATOM 0 H GLY A 89 -2.151 -12.457 1.834 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.524 -15.124 1.833 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.222 -14.397 2.755 1.00 0.00 H new ATOM 1407 N LYS A 90 -1.673 -13.570 4.731 1.00 0.00 N ATOM 1408 CA LYS A 90 -2.440 -13.469 5.971 1.00 0.00 C ATOM 1409 C LYS A 90 -2.051 -12.231 6.776 1.00 0.00 C ATOM 1410 O LYS A 90 -1.142 -11.492 6.405 1.00 0.00 O ATOM 1411 CB LYS A 90 -2.286 -14.721 6.859 1.00 0.00 C ATOM 1412 CG LYS A 90 -0.861 -15.247 7.045 1.00 0.00 C ATOM 1413 CD LYS A 90 -0.152 -15.482 5.722 1.00 0.00 C ATOM 1414 CE LYS A 90 0.886 -16.582 5.840 1.00 0.00 C ATOM 1415 NZ LYS A 90 1.834 -16.579 4.691 1.00 0.00 N ATOM 0 H LYS A 90 -0.764 -13.108 4.757 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.484 -13.386 5.669 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.699 -14.496 7.842 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.893 -15.520 6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.289 -14.535 7.639 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.892 -16.180 7.608 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.882 -15.749 4.958 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.328 -14.560 5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.442 -16.458 6.769 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.385 -17.549 5.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.527 -17.346 4.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.307 -16.723 3.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.331 -15.666 4.653 1.00 0.00 H new ATOM 1429 N THR A 91 -2.754 -12.019 7.887 1.00 0.00 N ATOM 1430 CA THR A 91 -2.497 -10.887 8.761 1.00 0.00 C ATOM 1431 C THR A 91 -2.714 -11.312 10.212 1.00 0.00 C ATOM 1432 O THR A 91 -2.954 -12.488 10.481 1.00 0.00 O ATOM 1433 CB THR A 91 -3.422 -9.723 8.389 1.00 0.00 C ATOM 1434 OG1 THR A 91 -4.243 -10.066 7.287 1.00 0.00 O ATOM 1435 CG2 THR A 91 -2.676 -8.458 8.025 1.00 0.00 C ATOM 0 H THR A 91 -3.512 -12.625 8.201 1.00 0.00 H new ATOM 0 HA THR A 91 -1.466 -10.554 8.643 1.00 0.00 H new ATOM 0 HB THR A 91 -4.017 -9.532 9.282 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.597 -9.250 6.876 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.390 -7.674 7.772 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.069 -8.137 8.872 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.030 -8.650 7.168 1.00 0.00 H new ATOM 1443 N PRO A 92 -2.641 -10.376 11.178 1.00 0.00 N ATOM 1444 CA PRO A 92 -2.839 -10.703 12.594 1.00 0.00 C ATOM 1445 C PRO A 92 -4.048 -11.613 12.824 1.00 0.00 C ATOM 1446 O PRO A 92 -4.123 -12.308 13.837 1.00 0.00 O ATOM 1447 CB PRO A 92 -3.058 -9.337 13.234 1.00 0.00 C ATOM 1448 CG PRO A 92 -2.258 -8.407 12.389 1.00 0.00 C ATOM 1449 CD PRO A 92 -2.359 -8.938 10.984 1.00 0.00 C ATOM 0 HA PRO A 92 -1.997 -11.256 13.011 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -4.113 -9.064 13.239 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -2.721 -9.324 14.270 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -2.646 -7.390 12.451 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -1.220 -8.373 12.720 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -3.154 -8.445 10.425 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -1.434 -8.782 10.428 1.00 0.00 H new ATOM 1457 N ILE A 93 -4.991 -11.606 11.883 1.00 0.00 N ATOM 1458 CA ILE A 93 -6.187 -12.433 11.998 1.00 0.00 C ATOM 1459 C ILE A 93 -6.462 -13.217 10.713 1.00 0.00 C ATOM 1460 O ILE A 93 -7.346 -12.858 9.934 1.00 0.00 O ATOM 1461 CB ILE A 93 -7.426 -11.580 12.339 1.00 0.00 C ATOM 1462 CG1 ILE A 93 -7.106 -10.601 13.470 1.00 0.00 C ATOM 1463 CG2 ILE A 93 -8.596 -12.475 12.719 1.00 0.00 C ATOM 1464 CD1 ILE A 93 -6.714 -9.222 12.983 1.00 0.00 C ATOM 0 H ILE A 93 -4.949 -11.039 11.036 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.998 -13.138 12.807 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.706 -11.004 11.457 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.976 -10.514 14.121 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.295 -11.008 14.074 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -9.463 -11.859 12.957 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -8.837 -13.133 11.884 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -8.328 -13.075 13.588 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -6.501 -8.581 13.838 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -5.826 -9.297 12.356 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -7.532 -8.794 12.404 1.00 0.00 H new ATOM 1476 N SER A 94 -5.706 -14.295 10.502 1.00 0.00 N ATOM 1477 CA SER A 94 -5.875 -15.137 9.320 1.00 0.00 C ATOM 1478 C SER A 94 -6.875 -16.262 9.586 1.00 0.00 C ATOM 1479 O SER A 94 -6.775 -17.343 9.003 1.00 0.00 O ATOM 1480 CB SER A 94 -4.530 -15.739 8.906 1.00 0.00 C ATOM 1481 OG SER A 94 -3.473 -15.226 9.699 1.00 0.00 O ATOM 0 H SER A 94 -4.970 -14.605 11.136 1.00 0.00 H new ATOM 0 HA SER A 94 -6.260 -14.512 8.514 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.568 -16.824 9.004 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.339 -15.521 7.855 1.00 0.00 H new ATOM 0 HG SER A 94 -3.486 -14.247 9.667 1.00 0.00 H new ATOM 1533 N ILE A 98 -8.617 -12.783 5.677 1.00 0.00 N ATOM 1534 CA ILE A 98 -7.504 -11.853 5.823 1.00 0.00 C ATOM 1535 C ILE A 98 -7.968 -10.523 6.402 1.00 0.00 C ATOM 1536 O ILE A 98 -8.572 -9.707 5.705 1.00 0.00 O ATOM 1537 CB ILE A 98 -6.802 -11.598 4.468 1.00 0.00 C ATOM 1538 CG1 ILE A 98 -6.048 -12.848 4.011 1.00 0.00 C ATOM 1539 CG2 ILE A 98 -5.849 -10.411 4.561 1.00 0.00 C ATOM 1540 CD1 ILE A 98 -5.709 -12.833 2.538 1.00 0.00 C ATOM 0 HA ILE A 98 -6.795 -12.315 6.510 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.569 -11.363 3.731 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -5.128 -12.941 4.588 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -6.652 -13.729 4.229 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -5.369 -10.253 3.595 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.407 -9.517 4.839 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.089 -10.613 5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.175 -13.747 2.278 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.627 -12.771 1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.080 -11.970 2.318 1.00 0.00 H new ATOM 1552 N ARG A 99 -7.664 -10.300 7.674 1.00 0.00 N ATOM 1553 CA ARG A 99 -8.031 -9.055 8.332 1.00 0.00 C ATOM 1554 C ARG A 99 -6.824 -8.119 8.364 1.00 0.00 C ATOM 1555 O ARG A 99 -5.941 -8.263 9.209 1.00 0.00 O ATOM 1556 CB ARG A 99 -8.526 -9.328 9.755 1.00 0.00 C ATOM 1557 CG ARG A 99 -9.808 -8.591 10.104 1.00 0.00 C ATOM 1558 CD ARG A 99 -11.020 -9.506 10.015 1.00 0.00 C ATOM 1559 NE ARG A 99 -12.239 -8.769 9.687 1.00 0.00 N ATOM 1560 CZ ARG A 99 -13.467 -9.241 9.889 1.00 0.00 C ATOM 1561 NH1 ARG A 99 -13.644 -10.446 10.418 1.00 0.00 N ATOM 1562 NH2 ARG A 99 -14.521 -8.505 9.564 1.00 0.00 N ATOM 0 H ARG A 99 -7.166 -10.963 8.268 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.838 -8.582 7.773 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.688 -10.399 9.875 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -7.748 -9.042 10.463 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.732 -8.184 11.112 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.939 -7.746 9.428 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.843 -10.270 9.258 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.154 -10.024 10.965 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.143 -7.839 9.280 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.837 -11.015 10.672 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -14.587 -10.802 10.571 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -14.390 -7.578 9.159 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.462 -8.866 9.718 1.00 0.00 H new ATOM 1576 N PRO A 100 -6.763 -7.152 7.432 1.00 0.00 N ATOM 1577 CA PRO A 100 -5.646 -6.205 7.352 1.00 0.00 C ATOM 1578 C PRO A 100 -5.622 -5.227 8.519 1.00 0.00 C ATOM 1579 O PRO A 100 -4.556 -4.777 8.941 1.00 0.00 O ATOM 1580 CB PRO A 100 -5.902 -5.469 6.034 1.00 0.00 C ATOM 1581 CG PRO A 100 -7.373 -5.570 5.832 1.00 0.00 C ATOM 1582 CD PRO A 100 -7.763 -6.916 6.372 1.00 0.00 C ATOM 0 HA PRO A 100 -4.681 -6.710 7.394 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.579 -4.429 6.091 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.356 -5.928 5.210 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -7.897 -4.771 6.356 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -7.631 -5.481 4.777 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.778 -6.913 6.769 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.724 -7.686 5.602 1.00 0.00 H new ATOM 1590 N ALA A 101 -6.800 -4.896 9.040 1.00 0.00 N ATOM 1591 CA ALA A 101 -6.901 -3.962 10.162 1.00 0.00 C ATOM 1592 C ALA A 101 -8.358 -3.716 10.535 1.00 0.00 C ATOM 1593 O ALA A 101 -9.246 -4.477 10.146 1.00 0.00 O ATOM 1594 CB ALA A 101 -6.208 -2.649 9.816 1.00 0.00 C ATOM 0 H ALA A 101 -7.694 -5.257 8.707 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.403 -4.405 11.025 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -6.289 -1.962 10.658 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.156 -2.838 9.602 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -6.682 -2.207 8.940 1.00 0.00 H new ATOM 1600 N SER A 102 -8.601 -2.653 11.294 1.00 0.00 N ATOM 1601 CA SER A 102 -9.951 -2.312 11.720 1.00 0.00 C ATOM 1602 C SER A 102 -10.486 -1.089 10.975 1.00 0.00 C ATOM 1603 O SER A 102 -11.637 -0.699 11.169 1.00 0.00 O ATOM 1604 CB SER A 102 -9.978 -2.054 13.231 1.00 0.00 C ATOM 1605 OG SER A 102 -8.666 -1.987 13.764 1.00 0.00 O ATOM 0 H SER A 102 -7.880 -2.013 11.626 1.00 0.00 H new ATOM 0 HA SER A 102 -10.596 -3.158 11.483 1.00 0.00 H new ATOM 0 HB2 SER A 102 -10.504 -1.121 13.434 1.00 0.00 H new ATOM 0 HB3 SER A 102 -10.535 -2.848 13.728 1.00 0.00 H new ATOM 0 HG SER A 102 -8.713 -1.820 14.729 1.00 0.00 H new ATOM 1611 N ALA A 103 -9.657 -0.480 10.125 1.00 0.00 N ATOM 1612 CA ALA A 103 -10.087 0.696 9.376 1.00 0.00 C ATOM 1613 C ALA A 103 -9.028 1.174 8.382 1.00 0.00 C ATOM 1614 O ALA A 103 -8.341 2.166 8.629 1.00 0.00 O ATOM 1615 CB ALA A 103 -10.443 1.820 10.337 1.00 0.00 C ATOM 0 H ALA A 103 -8.699 -0.778 9.942 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.966 0.409 8.798 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.763 2.695 9.771 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.251 1.496 10.992 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.570 2.076 10.937 1.00 0.00 H new ATOM 1621 N VAL A 104 -8.914 0.482 7.253 1.00 0.00 N ATOM 1622 CA VAL A 104 -7.944 0.867 6.222 1.00 0.00 C ATOM 1623 C VAL A 104 -8.606 1.012 4.848 1.00 0.00 C ATOM 1624 O VAL A 104 -9.511 0.253 4.503 1.00 0.00 O ATOM 1625 CB VAL A 104 -6.764 -0.128 6.135 1.00 0.00 C ATOM 1626 CG1 VAL A 104 -6.089 -0.263 7.489 1.00 0.00 C ATOM 1627 CG2 VAL A 104 -7.222 -1.488 5.630 1.00 0.00 C ATOM 0 H VAL A 104 -9.473 -0.341 7.026 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.549 1.838 6.522 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.043 0.266 5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.260 -0.967 7.414 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.712 0.709 7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.810 -0.629 8.220 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.368 -2.164 5.581 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -7.969 -1.896 6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.657 -1.380 4.636 1.00 0.00 H new ATOM 1637 N ASN A 105 -8.157 2.012 4.084 1.00 0.00 N ATOM 1638 CA ASN A 105 -8.710 2.294 2.752 1.00 0.00 C ATOM 1639 C ASN A 105 -8.041 1.471 1.652 1.00 0.00 C ATOM 1640 O ASN A 105 -6.873 1.104 1.759 1.00 0.00 O ATOM 1641 CB ASN A 105 -8.528 3.778 2.415 1.00 0.00 C ATOM 1642 CG ASN A 105 -8.748 4.686 3.605 1.00 0.00 C ATOM 1643 OD1 ASN A 105 -9.405 4.314 4.577 1.00 0.00 O ATOM 1644 ND2 ASN A 105 -8.191 5.887 3.528 1.00 0.00 N ATOM 0 H ASN A 105 -7.408 2.644 4.366 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.766 2.025 2.790 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -7.522 3.936 2.026 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -9.223 4.053 1.622 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -8.298 6.549 4.296 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.655 6.149 2.700 1.00 0.00 H new ATOM 1651 N VAL A 106 -8.784 1.238 0.568 1.00 0.00 N ATOM 1652 CA VAL A 106 -8.257 0.516 -0.585 1.00 0.00 C ATOM 1653 C VAL A 106 -7.536 1.505 -1.494 1.00 0.00 C ATOM 1654 O VAL A 106 -8.168 2.240 -2.253 1.00 0.00 O ATOM 1655 CB VAL A 106 -9.356 -0.204 -1.407 1.00 0.00 C ATOM 1656 CG1 VAL A 106 -9.236 -1.713 -1.253 1.00 0.00 C ATOM 1657 CG2 VAL A 106 -10.751 0.274 -1.024 1.00 0.00 C ATOM 0 H VAL A 106 -9.753 1.540 0.467 1.00 0.00 H new ATOM 0 HA VAL A 106 -7.582 -0.251 -0.205 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.204 0.050 -2.456 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.016 -2.202 -1.837 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.258 -2.038 -1.609 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.348 -1.982 -0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -11.494 -0.254 -1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -10.927 0.073 0.033 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -10.832 1.345 -1.208 1.00 0.00 H new ATOM 1667 N ILE A 107 -6.219 1.543 -1.387 1.00 0.00 N ATOM 1668 CA ILE A 107 -5.410 2.466 -2.168 1.00 0.00 C ATOM 1669 C ILE A 107 -5.066 1.916 -3.552 1.00 0.00 C ATOM 1670 O ILE A 107 -4.092 2.343 -4.172 1.00 0.00 O ATOM 1671 CB ILE A 107 -4.117 2.814 -1.411 1.00 0.00 C ATOM 1672 CG1 ILE A 107 -3.500 4.095 -1.985 1.00 0.00 C ATOM 1673 CG2 ILE A 107 -3.132 1.648 -1.468 1.00 0.00 C ATOM 1674 CD1 ILE A 107 -1.992 4.131 -1.924 1.00 0.00 C ATOM 0 H ILE A 107 -5.683 0.941 -0.762 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.007 3.366 -2.313 1.00 0.00 H new ATOM 0 HB ILE A 107 -4.357 2.993 -0.363 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.814 4.204 -3.023 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.896 4.952 -1.441 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.223 1.913 -0.927 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -3.583 0.768 -1.010 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.885 1.431 -2.507 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.633 5.068 -2.349 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.668 4.055 -0.886 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.585 3.295 -2.493 1.00 0.00 H new ATOM 1686 N GLY A 108 -5.870 0.979 -4.037 1.00 0.00 N ATOM 1687 CA GLY A 108 -5.627 0.405 -5.350 1.00 0.00 C ATOM 1688 C GLY A 108 -5.308 -1.077 -5.301 1.00 0.00 C ATOM 1689 O GLY A 108 -5.812 -1.798 -4.442 1.00 0.00 O ATOM 0 H GLY A 108 -6.684 0.606 -3.548 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.505 0.561 -5.977 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -4.800 0.933 -5.824 1.00 0.00 H new ATOM 1693 N ARG A 109 -4.471 -1.532 -6.232 1.00 0.00 N ATOM 1694 CA ARG A 109 -4.093 -2.940 -6.293 1.00 0.00 C ATOM 1695 C ARG A 109 -2.757 -3.128 -7.007 1.00 0.00 C ATOM 1696 O ARG A 109 -2.244 -2.210 -7.646 1.00 0.00 O ATOM 1697 CB ARG A 109 -5.175 -3.757 -7.011 1.00 0.00 C ATOM 1698 CG ARG A 109 -6.596 -3.431 -6.576 1.00 0.00 C ATOM 1699 CD ARG A 109 -7.616 -4.266 -7.338 1.00 0.00 C ATOM 1700 NE ARG A 109 -8.678 -4.763 -6.465 1.00 0.00 N ATOM 1701 CZ ARG A 109 -9.475 -5.782 -6.777 1.00 0.00 C ATOM 1702 NH1 ARG A 109 -9.335 -6.415 -7.935 1.00 0.00 N ATOM 1703 NH2 ARG A 109 -10.417 -6.170 -5.927 1.00 0.00 N ATOM 0 H ARG A 109 -4.044 -0.948 -6.951 1.00 0.00 H new ATOM 0 HA ARG A 109 -3.991 -3.295 -5.267 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.088 -3.589 -8.085 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.988 -4.817 -6.838 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.701 -3.612 -5.506 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.795 -2.372 -6.741 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.053 -3.665 -8.135 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.113 -5.108 -7.813 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.816 -4.302 -5.565 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.613 -6.121 -8.593 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.950 -7.195 -8.167 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.530 -5.687 -5.036 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.028 -6.951 -6.165 1.00 0.00 H new ATOM 1717 N ILE A 110 -2.208 -4.337 -6.900 1.00 0.00 N ATOM 1718 CA ILE A 110 -0.938 -4.670 -7.540 1.00 0.00 C ATOM 1719 C ILE A 110 -1.187 -5.447 -8.832 1.00 0.00 C ATOM 1720 O ILE A 110 -1.706 -6.564 -8.800 1.00 0.00 O ATOM 1721 CB ILE A 110 -0.041 -5.512 -6.608 1.00 0.00 C ATOM 1722 CG1 ILE A 110 0.235 -4.759 -5.299 1.00 0.00 C ATOM 1723 CG2 ILE A 110 1.270 -5.868 -7.300 1.00 0.00 C ATOM 1724 CD1 ILE A 110 -0.086 -5.555 -4.050 1.00 0.00 C ATOM 0 H ILE A 110 -2.626 -5.105 -6.374 1.00 0.00 H new ATOM 0 HA ILE A 110 -0.426 -3.734 -7.763 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.569 -6.436 -6.372 1.00 0.00 H new ATOM 0 HG12 ILE A 110 1.286 -4.470 -5.273 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -0.349 -3.839 -5.291 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.888 -6.462 -6.626 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.061 -6.443 -8.202 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.800 -4.954 -7.568 1.00 0.00 H new ATOM 0 HD11 ILE A 110 0.136 -4.954 -3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.143 -5.822 -4.050 1.00 0.00 H new ATOM 0 HD13 ILE A 110 0.517 -6.463 -4.032 1.00 0.00 H new ATOM 1736 N VAL A 111 -0.825 -4.853 -9.963 1.00 0.00 N ATOM 1737 CA VAL A 111 -1.025 -5.502 -11.258 1.00 0.00 C ATOM 1738 C VAL A 111 0.263 -6.149 -11.768 1.00 0.00 C ATOM 1739 O VAL A 111 0.492 -7.340 -11.553 1.00 0.00 O ATOM 1740 CB VAL A 111 -1.569 -4.524 -12.327 1.00 0.00 C ATOM 1741 CG1 VAL A 111 -3.086 -4.626 -12.420 1.00 0.00 C ATOM 1742 CG2 VAL A 111 -1.146 -3.090 -12.035 1.00 0.00 C ATOM 0 H VAL A 111 -0.394 -3.930 -10.013 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.772 -6.279 -11.093 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.140 -4.808 -13.288 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.452 -3.932 -13.176 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.366 -5.643 -12.695 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -3.527 -4.377 -11.455 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.545 -2.429 -12.805 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.532 -2.788 -11.062 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.058 -3.026 -12.029 1.00 0.00 H new ATOM 1816 N LEU A 117 5.498 -9.317 -2.446 1.00 0.00 N ATOM 1817 CA LEU A 117 6.381 -8.643 -1.495 1.00 0.00 C ATOM 1818 C LEU A 117 6.529 -9.460 -0.213 1.00 0.00 C ATOM 1819 O LEU A 117 7.562 -9.403 0.455 1.00 0.00 O ATOM 1820 CB LEU A 117 5.845 -7.246 -1.162 1.00 0.00 C ATOM 1821 CG LEU A 117 6.575 -6.528 -0.018 1.00 0.00 C ATOM 1822 CD1 LEU A 117 7.499 -5.439 -0.546 1.00 0.00 C ATOM 1823 CD2 LEU A 117 5.580 -5.946 0.979 1.00 0.00 C ATOM 0 HA LEU A 117 7.362 -8.546 -1.960 1.00 0.00 H new ATOM 0 HB2 LEU A 117 5.906 -6.627 -2.057 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.789 -7.330 -0.903 1.00 0.00 H new ATOM 0 HG LEU A 117 7.188 -7.268 0.497 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.000 -4.950 0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.244 -5.883 -1.207 1.00 0.00 H new ATOM 0 HD13 LEU A 117 6.915 -4.703 -1.099 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.120 -5.442 1.780 1.00 0.00 H new ATOM 0 HD22 LEU A 117 4.933 -5.230 0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.974 -6.749 1.399 1.00 0.00 H new ATOM 1835 N LYS A 118 5.483 -10.207 0.131 1.00 0.00 N ATOM 1836 CA LYS A 118 5.481 -11.030 1.345 1.00 0.00 C ATOM 1837 C LYS A 118 6.810 -11.771 1.561 1.00 0.00 C ATOM 1838 O LYS A 118 7.130 -12.149 2.686 1.00 0.00 O ATOM 1839 CB LYS A 118 4.322 -12.037 1.323 1.00 0.00 C ATOM 1840 CG LYS A 118 4.073 -12.700 -0.028 1.00 0.00 C ATOM 1841 CD LYS A 118 4.537 -14.151 -0.038 1.00 0.00 C ATOM 1842 CE LYS A 118 6.049 -14.264 -0.151 1.00 0.00 C ATOM 1843 NZ LYS A 118 6.468 -15.601 -0.654 1.00 0.00 N ATOM 0 H LYS A 118 4.622 -10.262 -0.413 1.00 0.00 H new ATOM 0 HA LYS A 118 5.348 -10.343 2.181 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.521 -12.814 2.061 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.411 -11.527 1.634 1.00 0.00 H new ATOM 0 HG2 LYS A 118 3.010 -12.656 -0.264 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.596 -12.145 -0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 118 4.204 -14.645 0.875 1.00 0.00 H new ATOM 0 HD3 LYS A 118 4.071 -14.675 -0.872 1.00 0.00 H new ATOM 0 HE2 LYS A 118 6.422 -13.490 -0.822 1.00 0.00 H new ATOM 0 HE3 LYS A 118 6.501 -14.085 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 7.505 -15.639 -0.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.134 -16.338 -0.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 6.058 -15.762 -1.596 1.00 0.00 H new ATOM 1857 N GLY A 119 7.579 -11.980 0.491 1.00 0.00 N ATOM 1858 CA GLY A 119 8.850 -12.676 0.619 1.00 0.00 C ATOM 1859 C GLY A 119 10.013 -11.750 0.940 1.00 0.00 C ATOM 1860 O GLY A 119 11.157 -12.043 0.595 1.00 0.00 O ATOM 0 H GLY A 119 7.346 -11.681 -0.456 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.767 -13.429 1.403 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.062 -13.205 -0.310 1.00 0.00 H new ATOM 1864 N VAL A 120 9.724 -10.632 1.603 1.00 0.00 N ATOM 1865 CA VAL A 120 10.759 -9.669 1.974 1.00 0.00 C ATOM 1866 C VAL A 120 11.526 -10.130 3.214 1.00 0.00 C ATOM 1867 O VAL A 120 10.994 -10.873 4.037 1.00 0.00 O ATOM 1868 CB VAL A 120 10.173 -8.267 2.256 1.00 0.00 C ATOM 1869 CG1 VAL A 120 9.844 -7.545 0.959 1.00 0.00 C ATOM 1870 CG2 VAL A 120 8.945 -8.359 3.152 1.00 0.00 C ATOM 0 H VAL A 120 8.782 -10.371 1.894 1.00 0.00 H new ATOM 0 HA VAL A 120 11.435 -9.608 1.121 1.00 0.00 H new ATOM 0 HB VAL A 120 10.931 -7.687 2.783 1.00 0.00 H new ATOM 0 HG11 VAL A 120 9.433 -6.561 1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.751 -7.432 0.365 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.112 -8.124 0.396 1.00 0.00 H new ATOM 0 HG21 VAL A 120 8.552 -7.359 3.335 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.182 -8.965 2.663 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.220 -8.820 4.101 1.00 0.00 H new ATOM 1880 N ALA A 121 12.774 -9.681 3.351 1.00 0.00 N ATOM 1881 CA ALA A 121 13.590 -10.045 4.504 1.00 0.00 C ATOM 1882 C ALA A 121 13.242 -9.156 5.697 1.00 0.00 C ATOM 1883 O ALA A 121 12.887 -7.990 5.522 1.00 0.00 O ATOM 1884 CB ALA A 121 15.070 -9.930 4.166 1.00 0.00 C ATOM 0 H ALA A 121 13.238 -9.068 2.680 1.00 0.00 H new ATOM 0 HA ALA A 121 13.379 -11.081 4.769 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.665 -10.205 5.037 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.307 -10.599 3.339 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.299 -8.904 3.880 1.00 0.00 H new ATOM 1890 N ASP A 122 13.330 -9.707 6.906 1.00 0.00 N ATOM 1891 CA ASP A 122 13.004 -8.945 8.108 1.00 0.00 C ATOM 1892 C ASP A 122 13.789 -7.638 8.176 1.00 0.00 C ATOM 1893 O ASP A 122 15.017 -7.640 8.247 1.00 0.00 O ATOM 1894 CB ASP A 122 13.255 -9.775 9.368 1.00 0.00 C ATOM 1895 CG ASP A 122 14.731 -9.980 9.652 1.00 0.00 C ATOM 1896 OD1 ASP A 122 15.461 -10.400 8.728 1.00 0.00 O ATOM 1897 OD2 ASP A 122 15.158 -9.721 10.797 1.00 0.00 O ATOM 0 H ASP A 122 13.622 -10.669 7.078 1.00 0.00 H new ATOM 0 HA ASP A 122 11.943 -8.700 8.055 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.791 -9.281 10.221 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.772 -10.746 9.260 1.00 0.00 H new ATOM 1902 N GLY A 123 13.063 -6.525 8.163 1.00 0.00 N ATOM 1903 CA GLY A 123 13.693 -5.222 8.232 1.00 0.00 C ATOM 1904 C GLY A 123 14.602 -4.941 7.054 1.00 0.00 C ATOM 1905 O GLY A 123 15.755 -5.375 7.032 1.00 0.00 O ATOM 0 H GLY A 123 12.045 -6.504 8.106 1.00 0.00 H new ATOM 0 HA2 GLY A 123 12.921 -4.454 8.280 1.00 0.00 H new ATOM 0 HA3 GLY A 123 14.270 -5.152 9.154 1.00 0.00 H new ATOM 1909 N GLU A 124 14.090 -4.202 6.076 1.00 0.00 N ATOM 1910 CA GLU A 124 14.873 -3.848 4.895 1.00 0.00 C ATOM 1911 C GLU A 124 14.418 -2.509 4.318 1.00 0.00 C ATOM 1912 O GLU A 124 13.240 -2.158 4.388 1.00 0.00 O ATOM 1913 CB GLU A 124 14.800 -4.950 3.830 1.00 0.00 C ATOM 1914 CG GLU A 124 13.397 -5.443 3.513 1.00 0.00 C ATOM 1915 CD GLU A 124 13.341 -6.188 2.193 1.00 0.00 C ATOM 1916 OE1 GLU A 124 13.634 -5.567 1.150 1.00 0.00 O ATOM 1917 OE2 GLU A 124 13.012 -7.392 2.203 1.00 0.00 O ATOM 0 H GLU A 124 13.138 -3.836 6.076 1.00 0.00 H new ATOM 0 HA GLU A 124 15.913 -3.749 5.206 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.255 -4.578 2.912 1.00 0.00 H new ATOM 0 HB3 GLU A 124 15.400 -5.797 4.163 1.00 0.00 H new ATOM 0 HG2 GLU A 124 13.053 -6.098 4.314 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.714 -4.595 3.480 1.00 0.00 H new ATOM 1924 N SER A 125 15.367 -1.758 3.763 1.00 0.00 N ATOM 1925 CA SER A 125 15.079 -0.441 3.185 1.00 0.00 C ATOM 1926 C SER A 125 13.838 -0.459 2.292 1.00 0.00 C ATOM 1927 O SER A 125 13.363 -1.517 1.880 1.00 0.00 O ATOM 1928 CB SER A 125 16.285 0.054 2.385 1.00 0.00 C ATOM 1929 OG SER A 125 16.466 1.451 2.545 1.00 0.00 O ATOM 0 H SER A 125 16.346 -2.038 3.700 1.00 0.00 H new ATOM 0 HA SER A 125 14.878 0.239 4.013 1.00 0.00 H new ATOM 0 HB2 SER A 125 17.182 -0.472 2.712 1.00 0.00 H new ATOM 0 HB3 SER A 125 16.145 -0.179 1.329 1.00 0.00 H new ATOM 0 HG SER A 125 17.244 1.742 2.025 1.00 0.00 H new ATOM 1935 N VAL A 126 13.335 0.737 1.999 1.00 0.00 N ATOM 1936 CA VAL A 126 12.155 0.911 1.152 1.00 0.00 C ATOM 1937 C VAL A 126 12.136 2.321 0.562 1.00 0.00 C ATOM 1938 O VAL A 126 12.264 3.304 1.289 1.00 0.00 O ATOM 1939 CB VAL A 126 10.844 0.677 1.937 1.00 0.00 C ATOM 1940 CG1 VAL A 126 9.638 0.772 1.019 1.00 0.00 C ATOM 1941 CG2 VAL A 126 10.869 -0.667 2.643 1.00 0.00 C ATOM 0 H VAL A 126 13.732 1.612 2.340 1.00 0.00 H new ATOM 0 HA VAL A 126 12.216 0.170 0.355 1.00 0.00 H new ATOM 0 HB VAL A 126 10.762 1.459 2.691 1.00 0.00 H new ATOM 0 HG11 VAL A 126 8.728 0.604 1.595 1.00 0.00 H new ATOM 0 HG12 VAL A 126 9.603 1.763 0.566 1.00 0.00 H new ATOM 0 HG13 VAL A 126 9.716 0.018 0.236 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.936 -0.809 3.188 1.00 0.00 H new ATOM 0 HG22 VAL A 126 10.984 -1.463 1.907 1.00 0.00 H new ATOM 0 HG23 VAL A 126 11.705 -0.696 3.341 1.00 0.00 H new ATOM 1951 N VAL A 127 11.981 2.420 -0.757 1.00 0.00 N ATOM 1952 CA VAL A 127 11.956 3.723 -1.419 1.00 0.00 C ATOM 1953 C VAL A 127 10.693 3.897 -2.259 1.00 0.00 C ATOM 1954 O VAL A 127 10.541 3.274 -3.310 1.00 0.00 O ATOM 1955 CB VAL A 127 13.196 3.928 -2.316 1.00 0.00 C ATOM 1956 CG1 VAL A 127 14.460 4.019 -1.472 1.00 0.00 C ATOM 1957 CG2 VAL A 127 13.305 2.808 -3.342 1.00 0.00 C ATOM 0 H VAL A 127 11.872 1.622 -1.383 1.00 0.00 H new ATOM 0 HA VAL A 127 11.964 4.474 -0.629 1.00 0.00 H new ATOM 0 HB VAL A 127 13.081 4.869 -2.853 1.00 0.00 H new ATOM 0 HG11 VAL A 127 15.322 4.163 -2.123 1.00 0.00 H new ATOM 0 HG12 VAL A 127 14.379 4.861 -0.785 1.00 0.00 H new ATOM 0 HG13 VAL A 127 14.585 3.098 -0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 127 14.185 2.970 -3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 127 13.395 1.851 -2.828 1.00 0.00 H new ATOM 0 HG23 VAL A 127 12.413 2.801 -3.969 1.00 0.00 H new ATOM 1967 N VAL A 128 9.790 4.753 -1.785 1.00 0.00 N ATOM 1968 CA VAL A 128 8.536 5.020 -2.488 1.00 0.00 C ATOM 1969 C VAL A 128 8.752 6.066 -3.588 1.00 0.00 C ATOM 1970 O VAL A 128 9.310 7.131 -3.327 1.00 0.00 O ATOM 1971 CB VAL A 128 7.438 5.540 -1.525 1.00 0.00 C ATOM 1972 CG1 VAL A 128 6.073 4.963 -1.880 1.00 0.00 C ATOM 1973 CG2 VAL A 128 7.775 5.227 -0.072 1.00 0.00 C ATOM 0 H VAL A 128 9.903 5.274 -0.916 1.00 0.00 H new ATOM 0 HA VAL A 128 8.208 4.076 -2.923 1.00 0.00 H new ATOM 0 HB VAL A 128 7.398 6.623 -1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 128 5.324 5.346 -1.187 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.808 5.253 -2.897 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.108 3.876 -1.811 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.984 5.606 0.575 1.00 0.00 H new ATOM 0 HG22 VAL A 128 7.864 4.148 0.057 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.719 5.703 0.193 1.00 0.00 H new ATOM 1983 N GLU A 129 8.317 5.768 -4.811 1.00 0.00 N ATOM 1984 CA GLU A 129 8.479 6.699 -5.925 1.00 0.00 C ATOM 1985 C GLU A 129 7.395 6.495 -6.982 1.00 0.00 C ATOM 1986 O GLU A 129 7.148 5.373 -7.418 1.00 0.00 O ATOM 1987 CB GLU A 129 9.861 6.519 -6.558 1.00 0.00 C ATOM 1988 CG GLU A 129 10.186 5.076 -6.906 1.00 0.00 C ATOM 1989 CD GLU A 129 11.621 4.707 -6.582 1.00 0.00 C ATOM 1990 OE1 GLU A 129 12.513 5.553 -6.801 1.00 0.00 O ATOM 1991 OE2 GLU A 129 11.851 3.575 -6.111 1.00 0.00 O ATOM 0 H GLU A 129 7.852 4.893 -5.055 1.00 0.00 H new ATOM 0 HA GLU A 129 8.385 7.712 -5.534 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.919 7.124 -7.463 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.618 6.898 -5.872 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.513 4.414 -6.361 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.004 4.912 -7.968 1.00 0.00 H new ATOM 1998 N ARG A 130 6.754 7.587 -7.397 1.00 0.00 N ATOM 1999 CA ARG A 130 5.703 7.524 -8.409 1.00 0.00 C ATOM 2000 C ARG A 130 6.301 7.346 -9.801 1.00 0.00 C ATOM 2001 O ARG A 130 6.618 8.321 -10.481 1.00 0.00 O ATOM 2002 CB ARG A 130 4.856 8.798 -8.363 1.00 0.00 C ATOM 2003 CG ARG A 130 3.745 8.840 -9.399 1.00 0.00 C ATOM 2004 CD ARG A 130 4.170 9.593 -10.651 1.00 0.00 C ATOM 2005 NE ARG A 130 4.162 8.736 -11.835 1.00 0.00 N ATOM 2006 CZ ARG A 130 4.510 9.152 -13.051 1.00 0.00 C ATOM 2007 NH1 ARG A 130 4.899 10.406 -13.247 1.00 0.00 N ATOM 2008 NH2 ARG A 130 4.468 8.312 -14.076 1.00 0.00 N ATOM 0 H ARG A 130 6.945 8.526 -7.047 1.00 0.00 H new ATOM 0 HA ARG A 130 5.070 6.663 -8.194 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.417 8.894 -7.370 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.507 9.660 -8.508 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.458 7.823 -9.666 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.864 9.317 -8.969 1.00 0.00 H new ATOM 0 HD2 ARG A 130 3.500 10.438 -10.811 1.00 0.00 H new ATOM 0 HD3 ARG A 130 5.170 10.002 -10.506 1.00 0.00 H new ATOM 0 HE ARG A 130 3.873 7.764 -11.723 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.933 11.058 -12.463 1.00 0.00 H new ATOM 0 HH12 ARG A 130 5.164 10.718 -14.181 1.00 0.00 H new ATOM 0 HH21 ARG A 130 4.169 7.347 -13.933 1.00 0.00 H new ATOM 0 HH22 ARG A 130 4.735 8.630 -15.008 1.00 0.00 H new ATOM 2022 N ALA A 131 6.450 6.090 -10.218 1.00 0.00 N ATOM 2023 CA ALA A 131 7.007 5.769 -11.531 1.00 0.00 C ATOM 2024 C ALA A 131 8.213 6.646 -11.864 1.00 0.00 C ATOM 2025 O ALA A 131 8.018 7.701 -12.504 1.00 0.00 O ATOM 2026 CB ALA A 131 5.938 5.909 -12.599 1.00 0.00 C ATOM 2027 OXT ALA A 131 9.341 6.270 -11.482 1.00 0.00 O ATOM 0 H ALA A 131 6.191 5.274 -9.663 1.00 0.00 H new ATOM 0 HA ALA A 131 7.352 4.736 -11.503 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.363 5.668 -13.573 1.00 0.00 H new ATOM 0 HB2 ALA A 131 5.116 5.227 -12.383 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.566 6.933 -12.609 1.00 0.00 H new