USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1063 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot 180:sc= 0.221 USER MOD Set 1.2: A 36 SER OG : rot 170:sc= 0.238 USER MOD Set 1.3: A 47 THR OG1 : rot 180:sc= 0.153 USER MOD Single : A 6 LYS NZ :NH3+ -147:sc= -0.0843 (180deg=-0.817) USER MOD Single : A 7 TYR OH : rot 30:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -164:sc= -0.0064 (180deg=-0.127) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -140:sc= -0.485 (180deg=-4.54!) USER MOD Single : A 38 SER OG : rot 83:sc= 1.28 USER MOD Single : A 49 GLN : amide:sc= -0.355 X(o=-0.36,f=-0.24) USER MOD Single : A 54 TYR OH : rot 78:sc= 2.11 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -1.26 K(o=-1.3,f=-2.6) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -123:sc= 1.2 (180deg=0.137) USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 68 CYS SG : rot -86:sc= -1.48 USER MOD Single : A 69 THR OG1 : rot 175:sc= 0.341 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -150:sc= 1.12 (180deg=-0.564!) USER MOD Single : A 84 MET CE :methyl 149:sc= -1.34 (180deg=-3.54!) USER MOD Single : A 93 GLN : amide:sc= -0.475 X(o=-0.47,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.00082) USER MOD Single : A 99 LYS NZ :NH3+ -169:sc=-0.00197 (180deg=-0.18) USER MOD Single : A 101 SER OG : rot -8:sc= 0.753 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.0913 X(o=-0.091,f=-0.25) USER MOD Single : A 105 ASN : amide:sc= -0.608 K(o=-0.61,f=0.97) USER MOD Single : A 108 SER OG : rot 5:sc= 1.13 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= -1.19 USER MOD Single : A 124 THR OG1 : rot -144:sc= 0.533 USER MOD Single : A 125 THR OG1 : rot 65:sc= 1.15 USER MOD Single : A 130 THR OG1 : rot 138:sc= -1.74! USER MOD Single : A 133 LYS NZ :NH3+ 159:sc= -0.163 (180deg=-0.711) USER MOD Single : A 139 GLN : amide:sc= -0.406 X(o=-0.41,f=-0.43) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -4.458 9.631 2.934 1.00 0.00 N ATOM 22 CA LEU A 4 -4.425 8.935 1.656 1.00 0.00 C ATOM 23 C LEU A 4 -5.461 9.509 0.690 1.00 0.00 C ATOM 24 O LEU A 4 -5.369 9.307 -0.521 1.00 0.00 O ATOM 25 CB LEU A 4 -4.658 7.430 1.849 1.00 0.00 C ATOM 26 CG LEU A 4 -5.248 7.006 3.201 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.229 7.178 4.321 1.00 0.00 C ATOM 28 CD2 LEU A 4 -6.533 7.770 3.500 1.00 0.00 C ATOM 0 HA LEU A 4 -3.435 9.082 1.224 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.324 7.082 1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -3.707 6.915 1.713 1.00 0.00 H new ATOM 0 HG LEU A 4 -5.498 5.947 3.141 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.673 6.870 5.268 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.354 6.563 4.114 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.930 8.224 4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.930 7.451 4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.322 8.839 3.531 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.267 7.567 2.720 1.00 0.00 H new ATOM 40 N ASP A 5 -6.443 10.226 1.229 1.00 0.00 N ATOM 41 CA ASP A 5 -7.489 10.826 0.409 1.00 0.00 C ATOM 42 C ASP A 5 -7.059 12.200 -0.091 1.00 0.00 C ATOM 43 O ASP A 5 -7.297 12.555 -1.246 1.00 0.00 O ATOM 44 CB ASP A 5 -8.790 10.943 1.207 1.00 0.00 C ATOM 45 CG ASP A 5 -10.017 10.712 0.348 1.00 0.00 C ATOM 46 OD1 ASP A 5 -10.144 9.606 -0.221 1.00 0.00 O ATOM 47 OD2 ASP A 5 -10.853 11.634 0.246 1.00 0.00 O ATOM 0 H ASP A 5 -6.536 10.405 2.229 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.659 10.180 -0.452 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -8.779 10.220 2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -8.848 11.933 1.660 1.00 0.00 H new ATOM 52 N LYS A 6 -6.423 12.970 0.786 1.00 0.00 N ATOM 53 CA LYS A 6 -5.957 14.306 0.433 1.00 0.00 C ATOM 54 C LYS A 6 -4.750 14.233 -0.498 1.00 0.00 C ATOM 55 O LYS A 6 -4.496 15.156 -1.272 1.00 0.00 O ATOM 56 CB LYS A 6 -5.596 15.093 1.695 1.00 0.00 C ATOM 57 CG LYS A 6 -4.426 14.505 2.466 1.00 0.00 C ATOM 58 CD LYS A 6 -4.243 15.190 3.811 1.00 0.00 C ATOM 59 CE LYS A 6 -2.781 15.502 4.085 1.00 0.00 C ATOM 60 NZ LYS A 6 -1.895 14.348 3.761 1.00 0.00 N ATOM 0 H LYS A 6 -6.219 12.692 1.746 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.765 14.820 -0.088 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.358 16.120 1.417 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -6.467 15.134 2.349 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.589 13.438 2.619 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.514 14.606 1.878 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -4.823 16.113 3.832 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -4.634 14.550 4.602 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.478 16.368 3.497 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.658 15.771 5.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.088 14.336 4.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -2.431 13.462 3.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -1.547 14.440 2.785 1.00 0.00 H new ATOM 74 N TYR A 7 -4.009 13.130 -0.419 1.00 0.00 N ATOM 75 CA TYR A 7 -2.830 12.940 -1.257 1.00 0.00 C ATOM 76 C TYR A 7 -3.192 13.052 -2.735 1.00 0.00 C ATOM 77 O TYR A 7 -2.514 13.737 -3.501 1.00 0.00 O ATOM 78 CB TYR A 7 -2.192 11.575 -0.976 1.00 0.00 C ATOM 79 CG TYR A 7 -0.724 11.655 -0.623 1.00 0.00 C ATOM 80 CD1 TYR A 7 0.146 12.448 -1.361 1.00 0.00 C ATOM 81 CD2 TYR A 7 -0.208 10.935 0.448 1.00 0.00 C ATOM 82 CE1 TYR A 7 1.488 12.522 -1.042 1.00 0.00 C ATOM 83 CE2 TYR A 7 1.134 11.005 0.772 1.00 0.00 C ATOM 84 CZ TYR A 7 1.977 11.800 0.025 1.00 0.00 C ATOM 85 OH TYR A 7 3.313 11.870 0.346 1.00 0.00 O ATOM 0 H TYR A 7 -4.205 12.356 0.216 1.00 0.00 H new ATOM 0 HA TYR A 7 -2.112 13.724 -1.016 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.728 11.094 -0.158 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.312 10.939 -1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.233 13.016 -2.198 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -0.865 10.312 1.036 1.00 0.00 H new ATOM 0 HE1 TYR A 7 2.151 13.143 -1.626 1.00 0.00 H new ATOM 0 HE2 TYR A 7 1.520 10.439 1.607 1.00 0.00 H new ATOM 0 HH TYR A 7 3.664 12.750 0.095 1.00 0.00 H new ATOM 135 N ILE A 11 -10.098 9.944 -5.430 1.00 0.00 N ATOM 136 CA ILE A 11 -10.222 8.514 -5.170 1.00 0.00 C ATOM 137 C ILE A 11 -11.630 8.157 -4.702 1.00 0.00 C ATOM 138 O ILE A 11 -12.191 7.142 -5.115 1.00 0.00 O ATOM 139 CB ILE A 11 -9.205 8.039 -4.110 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.791 8.492 -4.482 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.259 6.525 -3.963 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.363 8.069 -5.871 1.00 0.00 C ATOM 0 HA ILE A 11 -10.015 8.007 -6.112 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.469 8.488 -3.153 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.736 9.578 -4.409 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.086 8.088 -3.755 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.536 6.206 -3.212 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.260 6.225 -3.653 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.020 6.058 -4.918 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.351 8.425 -6.064 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.385 6.982 -5.943 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.044 8.495 -6.607 1.00 0.00 H new ATOM 154 N GLU A 12 -12.194 8.997 -3.837 1.00 0.00 N ATOM 155 CA GLU A 12 -13.537 8.769 -3.308 1.00 0.00 C ATOM 156 C GLU A 12 -13.567 7.523 -2.427 1.00 0.00 C ATOM 157 O GLU A 12 -13.637 7.619 -1.202 1.00 0.00 O ATOM 158 CB GLU A 12 -14.547 8.631 -4.452 1.00 0.00 C ATOM 159 CG GLU A 12 -15.391 9.875 -4.670 1.00 0.00 C ATOM 160 CD GLU A 12 -16.730 9.804 -3.962 1.00 0.00 C ATOM 161 OE1 GLU A 12 -16.749 9.454 -2.763 1.00 0.00 O ATOM 162 OE2 GLU A 12 -17.759 10.098 -4.606 1.00 0.00 O ATOM 0 H GLU A 12 -11.742 9.842 -3.487 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.813 9.630 -2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.011 8.399 -5.373 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.205 7.787 -4.245 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -14.843 10.748 -4.316 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.556 10.015 -5.738 1.00 0.00 H new ATOM 169 N LYS A 13 -13.509 6.357 -3.060 1.00 0.00 N ATOM 170 CA LYS A 13 -13.522 5.088 -2.333 1.00 0.00 C ATOM 171 C LYS A 13 -12.495 4.127 -2.919 1.00 0.00 C ATOM 172 O LYS A 13 -12.024 4.314 -4.041 1.00 0.00 O ATOM 173 CB LYS A 13 -14.913 4.453 -2.382 1.00 0.00 C ATOM 174 CG LYS A 13 -15.994 5.306 -1.735 1.00 0.00 C ATOM 175 CD LYS A 13 -16.981 5.836 -2.763 1.00 0.00 C ATOM 176 CE LYS A 13 -17.708 4.704 -3.471 1.00 0.00 C ATOM 177 NZ LYS A 13 -19.071 5.109 -3.913 1.00 0.00 N ATOM 0 H LYS A 13 -13.453 6.261 -4.074 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.265 5.291 -1.293 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.182 4.267 -3.422 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.879 3.484 -1.883 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.527 4.715 -0.990 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.532 6.142 -1.209 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.706 6.485 -2.272 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.453 6.446 -3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.126 4.384 -4.335 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.783 3.847 -2.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.533 4.309 -4.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.635 5.390 -3.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.998 5.911 -4.571 1.00 0.00 H new ATOM 191 N LEU A 14 -12.150 3.101 -2.153 1.00 0.00 N ATOM 192 CA LEU A 14 -11.176 2.111 -2.598 1.00 0.00 C ATOM 193 C LEU A 14 -11.868 0.844 -3.091 1.00 0.00 C ATOM 194 O LEU A 14 -13.052 0.631 -2.833 1.00 0.00 O ATOM 195 CB LEU A 14 -10.213 1.771 -1.461 1.00 0.00 C ATOM 196 CG LEU A 14 -9.180 2.852 -1.142 1.00 0.00 C ATOM 197 CD1 LEU A 14 -8.309 2.429 0.031 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.324 3.147 -2.365 1.00 0.00 C ATOM 0 H LEU A 14 -12.529 2.932 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.614 2.539 -3.428 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.794 1.569 -0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.687 0.851 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.709 3.763 -0.864 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.580 3.211 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.934 2.268 0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.788 1.505 -0.218 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.594 3.919 -2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.804 2.240 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.960 3.494 -3.179 1.00 0.00 H new ATOM 210 N ARG A 15 -11.117 0.006 -3.796 1.00 0.00 N ATOM 211 CA ARG A 15 -11.639 -1.241 -4.323 1.00 0.00 C ATOM 212 C ARG A 15 -11.256 -2.401 -3.428 1.00 0.00 C ATOM 213 O ARG A 15 -10.132 -2.903 -3.467 1.00 0.00 O ATOM 214 CB ARG A 15 -11.132 -1.504 -5.731 1.00 0.00 C ATOM 215 CG ARG A 15 -11.300 -0.327 -6.678 1.00 0.00 C ATOM 216 CD ARG A 15 -12.448 -0.552 -7.649 1.00 0.00 C ATOM 217 NE ARG A 15 -12.354 -1.847 -8.318 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.376 -2.443 -8.929 1.00 0.00 C ATOM 219 NH1 ARG A 15 -14.569 -1.864 -8.958 1.00 0.00 N ATOM 220 NH2 ARG A 15 -13.202 -3.622 -9.511 1.00 0.00 N ATOM 0 H ARG A 15 -10.135 0.174 -4.015 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.725 -1.150 -4.355 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.076 -1.770 -5.682 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.659 -2.365 -6.141 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -11.481 0.581 -6.103 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.376 -0.172 -7.235 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -13.394 -0.489 -7.112 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -12.452 0.242 -8.396 1.00 0.00 H new ATOM 0 HE ARG A 15 -11.452 -2.323 -8.317 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -14.707 -0.958 -8.511 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -15.348 -2.325 -9.427 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -12.286 -4.071 -9.490 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -13.984 -4.080 -9.979 1.00 0.00 H new ATOM 234 N ARG A 16 -12.210 -2.810 -2.631 1.00 0.00 N ATOM 235 CA ARG A 16 -12.027 -3.917 -1.699 1.00 0.00 C ATOM 236 C ARG A 16 -12.403 -5.244 -2.351 1.00 0.00 C ATOM 237 O ARG A 16 -12.745 -5.291 -3.533 1.00 0.00 O ATOM 238 CB ARG A 16 -12.870 -3.696 -0.442 1.00 0.00 C ATOM 239 CG ARG A 16 -12.158 -2.892 0.631 1.00 0.00 C ATOM 240 CD ARG A 16 -12.339 -3.509 2.008 1.00 0.00 C ATOM 241 NE ARG A 16 -11.738 -4.837 2.097 1.00 0.00 N ATOM 242 CZ ARG A 16 -11.571 -5.501 3.238 1.00 0.00 C ATOM 243 NH1 ARG A 16 -11.962 -4.965 4.389 1.00 0.00 N ATOM 244 NH2 ARG A 16 -11.011 -6.703 3.231 1.00 0.00 N ATOM 0 H ARG A 16 -13.140 -2.391 -2.602 1.00 0.00 H new ATOM 0 HA ARG A 16 -10.974 -3.955 -1.420 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.791 -3.183 -0.718 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.155 -4.664 -0.030 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -11.095 -2.832 0.396 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -12.542 -1.872 0.636 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.891 -2.858 2.759 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.402 -3.576 2.238 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.428 -5.282 1.233 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -12.392 -4.040 4.401 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -11.832 -5.478 5.261 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -10.708 -7.119 2.351 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -10.883 -7.211 4.106 1.00 0.00 H new ATOM 258 N GLY A 17 -12.340 -6.320 -1.574 1.00 0.00 N ATOM 259 CA GLY A 17 -12.677 -7.631 -2.094 1.00 0.00 C ATOM 260 C GLY A 17 -14.166 -7.796 -2.331 1.00 0.00 C ATOM 261 O GLY A 17 -14.669 -7.469 -3.406 1.00 0.00 O ATOM 0 H GLY A 17 -12.061 -6.307 -0.593 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.143 -7.796 -3.030 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.337 -8.394 -1.394 1.00 0.00 H new ATOM 265 N ASP A 18 -14.870 -8.312 -1.326 1.00 0.00 N ATOM 266 CA ASP A 18 -16.307 -8.531 -1.418 1.00 0.00 C ATOM 267 C ASP A 18 -17.016 -7.339 -2.059 1.00 0.00 C ATOM 268 O ASP A 18 -18.001 -7.503 -2.778 1.00 0.00 O ATOM 269 CB ASP A 18 -16.891 -8.796 -0.030 1.00 0.00 C ATOM 270 CG ASP A 18 -16.683 -7.631 0.917 1.00 0.00 C ATOM 271 OD1 ASP A 18 -17.529 -6.712 0.924 1.00 0.00 O ATOM 272 OD2 ASP A 18 -15.674 -7.637 1.653 1.00 0.00 O ATOM 0 H ASP A 18 -14.462 -8.587 -0.433 1.00 0.00 H new ATOM 0 HA ASP A 18 -16.469 -9.402 -2.053 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.958 -9.001 -0.121 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -16.430 -9.689 0.391 1.00 0.00 H new ATOM 277 N GLY A 19 -16.506 -6.142 -1.791 1.00 0.00 N ATOM 278 CA GLY A 19 -17.100 -4.942 -2.348 1.00 0.00 C ATOM 279 C GLY A 19 -16.185 -3.738 -2.241 1.00 0.00 C ATOM 280 O GLY A 19 -15.019 -3.799 -2.630 1.00 0.00 O ATOM 0 H GLY A 19 -15.692 -5.982 -1.198 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.346 -5.115 -3.396 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.036 -4.730 -1.831 1.00 0.00 H new ATOM 284 N GLU A 20 -16.715 -2.640 -1.712 1.00 0.00 N ATOM 285 CA GLU A 20 -15.938 -1.414 -1.555 1.00 0.00 C ATOM 286 C GLU A 20 -16.145 -0.815 -0.170 1.00 0.00 C ATOM 287 O GLU A 20 -17.186 -1.019 0.454 1.00 0.00 O ATOM 288 CB GLU A 20 -16.333 -0.397 -2.628 1.00 0.00 C ATOM 289 CG GLU A 20 -15.452 -0.448 -3.863 1.00 0.00 C ATOM 290 CD GLU A 20 -15.226 0.919 -4.477 1.00 0.00 C ATOM 291 OE1 GLU A 20 -15.087 1.897 -3.712 1.00 0.00 O ATOM 292 OE2 GLU A 20 -15.188 1.013 -5.722 1.00 0.00 O ATOM 0 H GLU A 20 -17.679 -2.573 -1.385 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.883 -1.662 -1.670 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -17.368 -0.574 -2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.290 0.605 -2.201 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.490 -0.887 -3.600 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -15.910 -1.103 -4.604 1.00 0.00 H new ATOM 299 N VAL A 21 -15.150 -0.073 0.307 1.00 0.00 N ATOM 300 CA VAL A 21 -15.235 0.554 1.619 1.00 0.00 C ATOM 301 C VAL A 21 -14.901 2.038 1.541 1.00 0.00 C ATOM 302 O VAL A 21 -13.908 2.429 0.926 1.00 0.00 O ATOM 303 CB VAL A 21 -14.291 -0.122 2.632 1.00 0.00 C ATOM 304 CG1 VAL A 21 -14.707 -1.565 2.871 1.00 0.00 C ATOM 305 CG2 VAL A 21 -12.852 -0.047 2.151 1.00 0.00 C ATOM 0 H VAL A 21 -14.280 0.107 -0.194 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.263 0.433 1.959 1.00 0.00 H new ATOM 0 HB VAL A 21 -14.362 0.412 3.579 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.028 -2.025 3.589 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -15.723 -1.590 3.264 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -14.668 -2.115 1.931 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.199 -0.529 2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -12.762 -0.555 1.191 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.560 0.997 2.038 1.00 0.00 H new ATOM 315 N GLU A 22 -15.734 2.860 2.169 1.00 0.00 N ATOM 316 CA GLU A 22 -15.523 4.301 2.171 1.00 0.00 C ATOM 317 C GLU A 22 -14.172 4.648 2.784 1.00 0.00 C ATOM 318 O GLU A 22 -13.649 3.909 3.618 1.00 0.00 O ATOM 319 CB GLU A 22 -16.642 5.001 2.946 1.00 0.00 C ATOM 320 CG GLU A 22 -17.841 5.365 2.085 1.00 0.00 C ATOM 321 CD GLU A 22 -19.132 5.420 2.879 1.00 0.00 C ATOM 322 OE1 GLU A 22 -19.152 6.085 3.936 1.00 0.00 O ATOM 323 OE2 GLU A 22 -20.123 4.796 2.444 1.00 0.00 O ATOM 0 H GLU A 22 -16.560 2.553 2.682 1.00 0.00 H new ATOM 0 HA GLU A 22 -15.535 4.648 1.138 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -16.971 4.353 3.758 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.245 5.907 3.403 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -17.666 6.333 1.615 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.943 4.635 1.282 1.00 0.00 H new ATOM 330 N VAL A 23 -13.611 5.777 2.367 1.00 0.00 N ATOM 331 CA VAL A 23 -12.320 6.222 2.876 1.00 0.00 C ATOM 332 C VAL A 23 -12.340 6.332 4.401 1.00 0.00 C ATOM 333 O VAL A 23 -11.310 6.186 5.058 1.00 0.00 O ATOM 334 CB VAL A 23 -11.920 7.581 2.265 1.00 0.00 C ATOM 335 CG1 VAL A 23 -10.650 8.115 2.912 1.00 0.00 C ATOM 336 CG2 VAL A 23 -11.744 7.454 0.758 1.00 0.00 C ATOM 0 H VAL A 23 -14.030 6.401 1.678 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.582 5.475 2.585 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.722 8.293 2.461 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.389 9.074 2.464 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.814 8.247 3.981 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.836 7.407 2.754 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.462 8.421 0.342 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -10.963 6.725 0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -12.681 7.125 0.309 1.00 0.00 H new ATOM 346 N LYS A 24 -13.521 6.588 4.953 1.00 0.00 N ATOM 347 CA LYS A 24 -13.688 6.717 6.398 1.00 0.00 C ATOM 348 C LYS A 24 -13.096 5.517 7.135 1.00 0.00 C ATOM 349 O LYS A 24 -12.680 5.629 8.287 1.00 0.00 O ATOM 350 CB LYS A 24 -15.170 6.864 6.749 1.00 0.00 C ATOM 351 CG LYS A 24 -15.641 8.308 6.805 1.00 0.00 C ATOM 352 CD LYS A 24 -16.189 8.768 5.463 1.00 0.00 C ATOM 353 CE LYS A 24 -17.097 9.977 5.618 1.00 0.00 C ATOM 354 NZ LYS A 24 -18.407 9.614 6.226 1.00 0.00 N ATOM 0 H LYS A 24 -14.382 6.711 4.419 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.152 7.611 6.717 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.765 6.325 6.012 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.355 6.392 7.714 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.412 8.411 7.569 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.812 8.951 7.100 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -15.363 9.015 4.797 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.742 7.953 4.996 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -16.603 10.724 6.239 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.264 10.433 4.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.088 10.385 6.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -18.764 8.742 5.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.285 9.461 7.247 1.00 0.00 H new ATOM 368 N SER A 25 -13.064 4.368 6.464 1.00 0.00 N ATOM 369 CA SER A 25 -12.525 3.149 7.061 1.00 0.00 C ATOM 370 C SER A 25 -11.054 3.322 7.443 1.00 0.00 C ATOM 371 O SER A 25 -10.519 2.555 8.243 1.00 0.00 O ATOM 372 CB SER A 25 -12.677 1.974 6.094 1.00 0.00 C ATOM 373 OG SER A 25 -12.254 0.761 6.693 1.00 0.00 O ATOM 0 H SER A 25 -13.404 4.256 5.509 1.00 0.00 H new ATOM 0 HA SER A 25 -13.091 2.943 7.969 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.718 1.886 5.785 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.092 2.162 5.194 1.00 0.00 H new ATOM 0 HG SER A 25 -12.363 0.026 6.055 1.00 0.00 H new ATOM 379 N LEU A 26 -10.410 4.336 6.873 1.00 0.00 N ATOM 380 CA LEU A 26 -9.008 4.614 7.162 1.00 0.00 C ATOM 381 C LEU A 26 -8.890 5.881 8.002 1.00 0.00 C ATOM 382 O LEU A 26 -8.092 6.770 7.705 1.00 0.00 O ATOM 383 CB LEU A 26 -8.208 4.768 5.862 1.00 0.00 C ATOM 384 CG LEU A 26 -8.581 3.806 4.726 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.478 3.764 3.681 1.00 0.00 C ATOM 386 CD2 LEU A 26 -8.858 2.408 5.263 1.00 0.00 C ATOM 0 H LEU A 26 -10.838 4.979 6.207 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.597 3.774 7.723 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.331 5.789 5.502 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.151 4.636 6.091 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.493 4.175 4.256 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.759 3.077 2.883 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.331 4.761 3.266 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.552 3.423 4.143 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.120 1.746 4.437 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -7.968 2.028 5.764 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.685 2.448 5.972 1.00 0.00 H new ATOM 398 N ALA A 27 -9.704 5.954 9.050 1.00 0.00 N ATOM 399 CA ALA A 27 -9.723 7.092 9.939 1.00 0.00 C ATOM 400 C ALA A 27 -9.042 6.771 11.251 1.00 0.00 C ATOM 401 O ALA A 27 -9.668 6.355 12.226 1.00 0.00 O ATOM 402 CB ALA A 27 -11.139 7.521 10.187 1.00 0.00 C ATOM 0 H ALA A 27 -10.367 5.220 9.300 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.175 7.906 9.464 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.147 8.380 10.858 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.607 7.795 9.242 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.694 6.700 10.642 1.00 0.00 H new ATOM 408 N GLY A 28 -7.756 6.983 11.247 1.00 0.00 N ATOM 409 CA GLY A 28 -6.936 6.740 12.421 1.00 0.00 C ATOM 410 C GLY A 28 -6.236 5.396 12.386 1.00 0.00 C ATOM 411 O GLY A 28 -6.272 4.641 13.357 1.00 0.00 O ATOM 0 H GLY A 28 -7.239 7.328 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.190 7.530 12.506 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.561 6.795 13.312 1.00 0.00 H new ATOM 415 N LYS A 29 -5.590 5.102 11.263 1.00 0.00 N ATOM 416 CA LYS A 29 -4.870 3.849 11.095 1.00 0.00 C ATOM 417 C LYS A 29 -3.670 4.041 10.172 1.00 0.00 C ATOM 418 O LYS A 29 -3.556 5.064 9.498 1.00 0.00 O ATOM 419 CB LYS A 29 -5.811 2.785 10.533 1.00 0.00 C ATOM 420 CG LYS A 29 -6.217 3.019 9.084 1.00 0.00 C ATOM 421 CD LYS A 29 -6.472 1.706 8.359 1.00 0.00 C ATOM 422 CE LYS A 29 -7.839 1.134 8.701 1.00 0.00 C ATOM 423 NZ LYS A 29 -7.745 -0.264 9.205 1.00 0.00 N ATOM 0 H LYS A 29 -5.552 5.720 10.452 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.502 3.520 12.067 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.329 1.811 10.612 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.709 2.747 11.149 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -7.116 3.635 9.052 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.432 3.574 8.570 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.402 1.864 7.283 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.698 0.986 8.626 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.317 1.760 9.454 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.475 1.159 7.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.526 -0.828 8.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.838 -0.679 8.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.805 -0.264 10.243 1.00 0.00 H new ATOM 437 N LEU A 30 -2.784 3.051 10.132 1.00 0.00 N ATOM 438 CA LEU A 30 -1.609 3.125 9.275 1.00 0.00 C ATOM 439 C LEU A 30 -1.880 2.417 7.956 1.00 0.00 C ATOM 440 O LEU A 30 -1.750 1.199 7.854 1.00 0.00 O ATOM 441 CB LEU A 30 -0.391 2.504 9.965 1.00 0.00 C ATOM 442 CG LEU A 30 0.955 2.829 9.310 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.308 4.295 9.513 1.00 0.00 C ATOM 444 CD2 LEU A 30 2.053 1.936 9.870 1.00 0.00 C ATOM 0 H LEU A 30 -2.857 2.194 10.680 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.393 4.175 9.079 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.366 2.843 11.001 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.516 1.421 9.987 1.00 0.00 H new ATOM 0 HG LEU A 30 0.869 2.639 8.240 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.267 4.507 9.041 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.536 4.921 9.064 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.373 4.509 10.580 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.001 2.182 9.392 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.137 2.093 10.945 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.808 0.892 9.674 1.00 0.00 H new ATOM 456 N VAL A 31 -2.268 3.187 6.947 1.00 0.00 N ATOM 457 CA VAL A 31 -2.569 2.623 5.639 1.00 0.00 C ATOM 458 C VAL A 31 -1.309 2.488 4.797 1.00 0.00 C ATOM 459 O VAL A 31 -0.604 3.465 4.548 1.00 0.00 O ATOM 460 CB VAL A 31 -3.599 3.478 4.876 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.126 2.720 3.666 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.741 3.892 5.794 1.00 0.00 C ATOM 0 H VAL A 31 -2.381 4.199 7.009 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.993 1.634 5.813 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.103 4.383 4.525 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.852 3.338 3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.299 2.481 2.998 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.605 1.798 3.995 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.457 4.495 5.235 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.239 3.002 6.179 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.346 4.476 6.625 1.00 0.00 H new ATOM 472 N PHE A 32 -1.034 1.265 4.364 1.00 0.00 N ATOM 473 CA PHE A 32 0.141 0.987 3.549 1.00 0.00 C ATOM 474 C PHE A 32 -0.154 1.229 2.074 1.00 0.00 C ATOM 475 O PHE A 32 -1.310 1.208 1.652 1.00 0.00 O ATOM 476 CB PHE A 32 0.608 -0.459 3.751 1.00 0.00 C ATOM 477 CG PHE A 32 1.621 -0.618 4.848 1.00 0.00 C ATOM 478 CD1 PHE A 32 2.740 0.196 4.899 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.453 -1.583 5.829 1.00 0.00 C ATOM 480 CE1 PHE A 32 3.673 0.053 5.909 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.382 -1.731 6.841 1.00 0.00 C ATOM 482 CZ PHE A 32 3.494 -0.912 6.881 1.00 0.00 C ATOM 0 H PHE A 32 -1.610 0.448 4.564 1.00 0.00 H new ATOM 0 HA PHE A 32 0.935 1.664 3.865 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.257 -1.083 3.974 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.035 -0.827 2.818 1.00 0.00 H new ATOM 0 HD1 PHE A 32 2.886 0.951 4.141 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.586 -2.226 5.802 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.541 0.695 5.938 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.239 -2.486 7.600 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.222 -1.026 7.671 1.00 0.00 H new ATOM 492 N PHE A 33 0.898 1.440 1.293 1.00 0.00 N ATOM 493 CA PHE A 33 0.745 1.665 -0.139 1.00 0.00 C ATOM 494 C PHE A 33 1.791 0.867 -0.909 1.00 0.00 C ATOM 495 O PHE A 33 2.970 1.218 -0.930 1.00 0.00 O ATOM 496 CB PHE A 33 0.857 3.161 -0.478 1.00 0.00 C ATOM 497 CG PHE A 33 -0.435 3.913 -0.319 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.019 4.061 0.928 1.00 0.00 C ATOM 499 CD2 PHE A 33 -1.066 4.471 -1.420 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.208 4.752 1.076 1.00 0.00 C ATOM 501 CE2 PHE A 33 -2.254 5.161 -1.278 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.826 5.302 -0.029 1.00 0.00 C ATOM 0 H PHE A 33 1.862 1.460 1.625 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.248 1.326 -0.434 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.613 3.615 0.163 1.00 0.00 H new ATOM 0 HB3 PHE A 33 1.205 3.267 -1.505 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -0.540 3.632 1.796 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -0.624 4.365 -2.400 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -2.652 4.861 2.054 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.736 5.590 -2.144 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.755 5.841 0.083 1.00 0.00 H new ATOM 512 N TYR A 34 1.340 -0.211 -1.536 1.00 0.00 N ATOM 513 CA TYR A 34 2.217 -1.080 -2.311 1.00 0.00 C ATOM 514 C TYR A 34 2.163 -0.722 -3.793 1.00 0.00 C ATOM 515 O TYR A 34 1.105 -0.787 -4.418 1.00 0.00 O ATOM 516 CB TYR A 34 1.810 -2.541 -2.103 1.00 0.00 C ATOM 517 CG TYR A 34 2.490 -3.519 -3.043 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.830 -3.858 -2.887 1.00 0.00 C ATOM 519 CD2 TYR A 34 1.786 -4.106 -4.087 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.445 -4.750 -3.744 1.00 0.00 C ATOM 521 CE2 TYR A 34 2.396 -5.000 -4.947 1.00 0.00 C ATOM 522 CZ TYR A 34 3.724 -5.317 -4.771 1.00 0.00 C ATOM 523 OH TYR A 34 4.336 -6.206 -5.626 1.00 0.00 O ATOM 0 H TYR A 34 0.364 -0.507 -1.523 1.00 0.00 H new ATOM 0 HA TYR A 34 3.241 -0.940 -1.966 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.036 -2.826 -1.075 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.731 -2.626 -2.227 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.399 -3.416 -2.082 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.744 -3.860 -4.229 1.00 0.00 H new ATOM 0 HE1 TYR A 34 5.487 -5.002 -3.609 1.00 0.00 H new ATOM 0 HE2 TYR A 34 1.833 -5.448 -5.753 1.00 0.00 H new ATOM 0 HH TYR A 34 3.689 -6.515 -6.294 1.00 0.00 H new ATOM 533 N PHE A 35 3.310 -0.346 -4.346 1.00 0.00 N ATOM 534 CA PHE A 35 3.386 0.024 -5.759 1.00 0.00 C ATOM 535 C PHE A 35 3.904 -1.137 -6.607 1.00 0.00 C ATOM 536 O PHE A 35 4.963 -1.699 -6.322 1.00 0.00 O ATOM 537 CB PHE A 35 4.283 1.248 -5.942 1.00 0.00 C ATOM 538 CG PHE A 35 3.731 2.492 -5.307 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.883 2.719 -3.949 1.00 0.00 C ATOM 540 CD2 PHE A 35 3.058 3.432 -6.070 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.373 3.862 -3.362 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.547 4.578 -5.489 1.00 0.00 C ATOM 543 CZ PHE A 35 2.705 4.792 -4.134 1.00 0.00 C ATOM 0 H PHE A 35 4.196 -0.289 -3.844 1.00 0.00 H new ATOM 0 HA PHE A 35 2.378 0.268 -6.095 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.264 1.037 -5.517 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.429 1.427 -7.007 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.406 1.995 -3.342 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.931 3.268 -7.130 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.497 4.027 -2.302 1.00 0.00 H new ATOM 0 HE2 PHE A 35 2.025 5.305 -6.094 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.306 5.686 -3.678 1.00 0.00 H new ATOM 553 N SER A 36 3.154 -1.493 -7.650 1.00 0.00 N ATOM 554 CA SER A 36 3.543 -2.585 -8.535 1.00 0.00 C ATOM 555 C SER A 36 2.584 -2.688 -9.716 1.00 0.00 C ATOM 556 O SER A 36 1.493 -2.123 -9.687 1.00 0.00 O ATOM 557 CB SER A 36 3.571 -3.908 -7.767 1.00 0.00 C ATOM 558 OG SER A 36 4.655 -4.719 -8.187 1.00 0.00 O ATOM 0 H SER A 36 2.275 -1.040 -7.901 1.00 0.00 H new ATOM 0 HA SER A 36 4.543 -2.376 -8.916 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.654 -3.710 -6.698 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.633 -4.441 -7.921 1.00 0.00 H new ATOM 0 HG SER A 36 4.752 -5.479 -7.575 1.00 0.00 H new ATOM 564 N ALA A 37 2.994 -3.413 -10.751 1.00 0.00 N ATOM 565 CA ALA A 37 2.159 -3.585 -11.934 1.00 0.00 C ATOM 566 C ALA A 37 2.028 -5.053 -12.312 1.00 0.00 C ATOM 567 O ALA A 37 3.013 -5.783 -12.359 1.00 0.00 O ATOM 568 CB ALA A 37 2.721 -2.795 -13.101 1.00 0.00 C ATOM 0 H ALA A 37 3.895 -3.889 -10.795 1.00 0.00 H new ATOM 0 HA ALA A 37 1.165 -3.207 -11.695 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.085 -2.935 -13.975 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.754 -1.737 -12.842 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.729 -3.145 -13.326 1.00 0.00 H new ATOM 574 N SER A 38 0.804 -5.476 -12.587 1.00 0.00 N ATOM 575 CA SER A 38 0.533 -6.862 -12.965 1.00 0.00 C ATOM 576 C SER A 38 1.477 -7.333 -14.070 1.00 0.00 C ATOM 577 O SER A 38 1.750 -8.528 -14.195 1.00 0.00 O ATOM 578 CB SER A 38 -0.921 -7.010 -13.424 1.00 0.00 C ATOM 579 OG SER A 38 -1.091 -8.161 -14.237 1.00 0.00 O ATOM 0 H SER A 38 -0.023 -4.880 -12.556 1.00 0.00 H new ATOM 0 HA SER A 38 0.701 -7.486 -12.087 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.574 -7.077 -12.554 1.00 0.00 H new ATOM 0 HB3 SER A 38 -1.221 -6.122 -13.980 1.00 0.00 H new ATOM 0 HG SER A 38 -1.203 -8.950 -13.667 1.00 0.00 H new ATOM 585 N TRP A 39 1.968 -6.395 -14.874 1.00 0.00 N ATOM 586 CA TRP A 39 2.874 -6.732 -15.967 1.00 0.00 C ATOM 587 C TRP A 39 4.329 -6.437 -15.603 1.00 0.00 C ATOM 588 O TRP A 39 5.171 -6.265 -16.485 1.00 0.00 O ATOM 589 CB TRP A 39 2.485 -5.969 -17.236 1.00 0.00 C ATOM 590 CG TRP A 39 2.638 -4.482 -17.118 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.014 -3.777 -16.011 1.00 0.00 C ATOM 592 CD2 TRP A 39 2.416 -3.514 -18.152 1.00 0.00 C ATOM 593 NE1 TRP A 39 3.038 -2.433 -16.292 1.00 0.00 N ATOM 594 CE2 TRP A 39 2.675 -2.246 -17.600 1.00 0.00 C ATOM 595 CE3 TRP A 39 2.024 -3.598 -19.491 1.00 0.00 C ATOM 596 CZ2 TRP A 39 2.555 -1.072 -18.340 1.00 0.00 C ATOM 597 CZ3 TRP A 39 1.905 -2.433 -20.224 1.00 0.00 C ATOM 598 CH2 TRP A 39 2.170 -1.184 -19.648 1.00 0.00 C ATOM 0 H TRP A 39 1.755 -5.401 -14.790 1.00 0.00 H new ATOM 0 HA TRP A 39 2.785 -7.803 -16.151 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.098 -6.324 -18.064 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.449 -6.200 -17.485 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.257 -4.213 -15.053 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.286 -1.694 -15.634 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.818 -4.556 -19.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 2.759 -0.108 -17.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.602 -2.486 -21.259 1.00 0.00 H new ATOM 0 HH2 TRP A 39 2.068 -0.292 -20.248 1.00 0.00 H new ATOM 609 N CYS A 40 4.626 -6.390 -14.306 1.00 0.00 N ATOM 610 CA CYS A 40 5.986 -6.127 -13.851 1.00 0.00 C ATOM 611 C CYS A 40 6.844 -7.388 -13.986 1.00 0.00 C ATOM 612 O CYS A 40 6.313 -8.487 -14.145 1.00 0.00 O ATOM 613 CB CYS A 40 5.980 -5.607 -12.403 1.00 0.00 C ATOM 614 SG CYS A 40 6.219 -6.878 -11.116 1.00 0.00 S ATOM 0 H CYS A 40 3.947 -6.530 -13.558 1.00 0.00 H new ATOM 0 HA CYS A 40 6.424 -5.352 -14.480 1.00 0.00 H new ATOM 0 HB2 CYS A 40 6.765 -4.858 -12.300 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.032 -5.102 -12.220 1.00 0.00 H new ATOM 619 N PRO A 41 8.182 -7.250 -13.944 1.00 0.00 N ATOM 620 CA PRO A 41 9.088 -8.391 -14.083 1.00 0.00 C ATOM 621 C PRO A 41 8.997 -9.378 -12.915 1.00 0.00 C ATOM 622 O PRO A 41 8.700 -10.554 -13.128 1.00 0.00 O ATOM 623 CB PRO A 41 10.488 -7.765 -14.172 1.00 0.00 C ATOM 624 CG PRO A 41 10.268 -6.294 -14.346 1.00 0.00 C ATOM 625 CD PRO A 41 8.909 -5.985 -13.780 1.00 0.00 C ATOM 0 HA PRO A 41 8.833 -8.986 -14.960 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.066 -7.970 -13.271 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.048 -8.178 -15.011 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.040 -5.724 -13.829 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.320 -6.018 -15.399 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.967 -5.687 -12.733 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.425 -5.170 -14.317 1.00 0.00 H new ATOM 633 N PRO A 42 9.245 -8.937 -11.664 1.00 0.00 N ATOM 634 CA PRO A 42 9.175 -9.829 -10.501 1.00 0.00 C ATOM 635 C PRO A 42 7.748 -10.303 -10.220 1.00 0.00 C ATOM 636 O PRO A 42 7.400 -11.445 -10.522 1.00 0.00 O ATOM 637 CB PRO A 42 9.712 -8.978 -9.337 1.00 0.00 C ATOM 638 CG PRO A 42 10.334 -7.777 -9.971 1.00 0.00 C ATOM 639 CD PRO A 42 9.611 -7.566 -11.269 1.00 0.00 C ATOM 0 HA PRO A 42 9.750 -10.741 -10.659 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.909 -8.691 -8.658 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.443 -9.534 -8.750 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.239 -6.903 -9.326 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.399 -7.934 -10.140 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.733 -6.933 -11.145 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.247 -7.087 -12.013 1.00 0.00 H new ATOM 647 N CYS A 43 6.926 -9.415 -9.649 1.00 0.00 N ATOM 648 CA CYS A 43 5.521 -9.731 -9.327 1.00 0.00 C ATOM 649 C CYS A 43 5.345 -11.203 -8.961 1.00 0.00 C ATOM 650 O CYS A 43 5.040 -12.036 -9.814 1.00 0.00 O ATOM 651 CB CYS A 43 4.621 -9.380 -10.510 1.00 0.00 C ATOM 652 SG CYS A 43 4.358 -7.593 -10.739 1.00 0.00 S ATOM 0 H CYS A 43 7.207 -8.467 -9.398 1.00 0.00 H new ATOM 0 HA CYS A 43 5.236 -9.133 -8.461 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.058 -9.792 -11.420 1.00 0.00 H new ATOM 0 HB3 CYS A 43 3.654 -9.864 -10.373 1.00 0.00 H new ATOM 657 N ARG A 44 5.544 -11.507 -7.688 1.00 0.00 N ATOM 658 CA ARG A 44 5.415 -12.875 -7.196 1.00 0.00 C ATOM 659 C ARG A 44 5.526 -12.919 -5.675 1.00 0.00 C ATOM 660 O ARG A 44 4.583 -13.305 -4.985 1.00 0.00 O ATOM 661 CB ARG A 44 6.490 -13.765 -7.822 1.00 0.00 C ATOM 662 CG ARG A 44 6.039 -15.199 -8.047 1.00 0.00 C ATOM 663 CD ARG A 44 7.198 -16.096 -8.456 1.00 0.00 C ATOM 664 NE ARG A 44 8.071 -15.455 -9.437 1.00 0.00 N ATOM 665 CZ ARG A 44 9.139 -14.723 -9.123 1.00 0.00 C ATOM 666 NH1 ARG A 44 9.478 -14.535 -7.852 1.00 0.00 N ATOM 667 NH2 ARG A 44 9.873 -14.178 -10.083 1.00 0.00 N ATOM 0 H ARG A 44 5.796 -10.825 -6.973 1.00 0.00 H new ATOM 0 HA ARG A 44 4.431 -13.247 -7.481 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.795 -13.335 -8.776 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.369 -13.766 -7.177 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.585 -15.585 -7.134 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.271 -15.222 -8.820 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.779 -16.361 -7.573 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.807 -17.025 -8.871 1.00 0.00 H new ATOM 0 HE ARG A 44 7.849 -15.576 -10.425 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.919 -14.953 -7.108 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.297 -13.973 -7.620 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.620 -14.319 -11.061 1.00 0.00 H new ATOM 0 HH22 ARG A 44 10.691 -13.617 -9.844 1.00 0.00 H new ATOM 681 N GLY A 45 6.685 -12.523 -5.161 1.00 0.00 N ATOM 682 CA GLY A 45 6.901 -12.527 -3.726 1.00 0.00 C ATOM 683 C GLY A 45 6.559 -11.197 -3.082 1.00 0.00 C ATOM 684 O GLY A 45 6.119 -10.268 -3.758 1.00 0.00 O ATOM 0 H GLY A 45 7.479 -12.199 -5.713 1.00 0.00 H new ATOM 0 HA2 GLY A 45 6.296 -13.312 -3.273 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.944 -12.769 -3.520 1.00 0.00 H new ATOM 688 N PHE A 46 6.764 -11.109 -1.771 1.00 0.00 N ATOM 689 CA PHE A 46 6.479 -9.887 -1.021 1.00 0.00 C ATOM 690 C PHE A 46 4.977 -9.635 -0.922 1.00 0.00 C ATOM 691 O PHE A 46 4.418 -9.591 0.174 1.00 0.00 O ATOM 692 CB PHE A 46 7.167 -8.680 -1.664 1.00 0.00 C ATOM 693 CG PHE A 46 7.126 -7.453 -0.802 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.724 -7.448 0.449 1.00 0.00 C ATOM 695 CD2 PHE A 46 6.484 -6.306 -1.238 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.682 -6.323 1.247 1.00 0.00 C ATOM 697 CE2 PHE A 46 6.439 -5.177 -0.444 1.00 0.00 C ATOM 698 CZ PHE A 46 7.039 -5.185 0.801 1.00 0.00 C ATOM 0 H PHE A 46 7.128 -11.873 -1.202 1.00 0.00 H new ATOM 0 HA PHE A 46 6.873 -10.023 -0.014 1.00 0.00 H new ATOM 0 HB2 PHE A 46 8.206 -8.932 -1.878 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.689 -8.462 -2.619 1.00 0.00 H new ATOM 0 HD1 PHE A 46 8.229 -8.335 0.803 1.00 0.00 H new ATOM 0 HD2 PHE A 46 6.013 -6.294 -2.210 1.00 0.00 H new ATOM 0 HE1 PHE A 46 8.152 -6.332 2.220 1.00 0.00 H new ATOM 0 HE2 PHE A 46 5.935 -4.289 -0.796 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.005 -4.303 1.424 1.00 0.00 H new ATOM 708 N THR A 47 4.328 -9.465 -2.072 1.00 0.00 N ATOM 709 CA THR A 47 2.889 -9.213 -2.117 1.00 0.00 C ATOM 710 C THR A 47 2.126 -10.142 -1.169 1.00 0.00 C ATOM 711 O THR A 47 1.320 -9.683 -0.359 1.00 0.00 O ATOM 712 CB THR A 47 2.366 -9.382 -3.544 1.00 0.00 C ATOM 713 OG1 THR A 47 3.425 -9.297 -4.481 1.00 0.00 O ATOM 714 CG2 THR A 47 1.330 -8.347 -3.927 1.00 0.00 C ATOM 0 H THR A 47 4.777 -9.497 -2.987 1.00 0.00 H new ATOM 0 HA THR A 47 2.723 -8.187 -1.790 1.00 0.00 H new ATOM 0 HB THR A 47 1.899 -10.367 -3.566 1.00 0.00 H new ATOM 0 HG1 THR A 47 3.070 -9.409 -5.387 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.001 -8.524 -4.951 1.00 0.00 H new ATOM 0 HG22 THR A 47 0.476 -8.420 -3.253 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.766 -7.351 -3.853 1.00 0.00 H new ATOM 722 N PRO A 48 2.361 -11.464 -1.259 1.00 0.00 N ATOM 723 CA PRO A 48 1.681 -12.442 -0.406 1.00 0.00 C ATOM 724 C PRO A 48 2.224 -12.465 1.022 1.00 0.00 C ATOM 725 O PRO A 48 1.665 -13.133 1.892 1.00 0.00 O ATOM 726 CB PRO A 48 1.962 -13.770 -1.106 1.00 0.00 C ATOM 727 CG PRO A 48 3.262 -13.562 -1.804 1.00 0.00 C ATOM 728 CD PRO A 48 3.300 -12.109 -2.201 1.00 0.00 C ATOM 0 HA PRO A 48 0.621 -12.213 -0.294 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.024 -14.590 -0.390 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.170 -14.021 -1.811 1.00 0.00 H new ATOM 0 HG2 PRO A 48 4.098 -13.809 -1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.341 -14.207 -2.679 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.305 -11.695 -2.111 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.989 -11.968 -3.236 1.00 0.00 H new ATOM 736 N GLN A 49 3.306 -11.730 1.265 1.00 0.00 N ATOM 737 CA GLN A 49 3.901 -11.673 2.596 1.00 0.00 C ATOM 738 C GLN A 49 3.083 -10.754 3.496 1.00 0.00 C ATOM 739 O GLN A 49 2.844 -11.062 4.664 1.00 0.00 O ATOM 740 CB GLN A 49 5.359 -11.202 2.523 1.00 0.00 C ATOM 741 CG GLN A 49 6.360 -12.272 2.933 1.00 0.00 C ATOM 742 CD GLN A 49 6.163 -13.574 2.182 1.00 0.00 C ATOM 743 OE1 GLN A 49 5.847 -14.605 2.776 1.00 0.00 O ATOM 744 NE2 GLN A 49 6.351 -13.533 0.868 1.00 0.00 N ATOM 0 H GLN A 49 3.786 -11.169 0.562 1.00 0.00 H new ATOM 0 HA GLN A 49 3.894 -12.676 3.022 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.579 -10.880 1.505 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.485 -10.331 3.167 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.371 -11.905 2.757 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.270 -12.457 4.003 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.612 -12.656 0.417 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.234 -14.378 0.309 1.00 0.00 H new ATOM 753 N LEU A 50 2.645 -9.629 2.938 1.00 0.00 N ATOM 754 CA LEU A 50 1.840 -8.667 3.675 1.00 0.00 C ATOM 755 C LEU A 50 0.625 -9.340 4.298 1.00 0.00 C ATOM 756 O LEU A 50 0.329 -9.154 5.477 1.00 0.00 O ATOM 757 CB LEU A 50 1.368 -7.569 2.725 1.00 0.00 C ATOM 758 CG LEU A 50 1.392 -6.144 3.279 1.00 0.00 C ATOM 759 CD1 LEU A 50 1.098 -6.124 4.774 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.729 -5.491 2.980 1.00 0.00 C ATOM 0 H LEU A 50 2.837 -9.363 1.972 1.00 0.00 H new ATOM 0 HA LEU A 50 2.452 -8.242 4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.989 -7.600 1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.349 -7.799 2.414 1.00 0.00 H new ATOM 0 HG LEU A 50 0.606 -5.573 2.786 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.123 -5.096 5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.111 -6.549 4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.850 -6.712 5.301 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.736 -4.477 3.379 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.528 -6.069 3.445 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.885 -5.458 1.902 1.00 0.00 H new ATOM 772 N ILE A 51 -0.077 -10.116 3.483 1.00 0.00 N ATOM 773 CA ILE A 51 -1.273 -10.821 3.934 1.00 0.00 C ATOM 774 C ILE A 51 -0.977 -11.702 5.145 1.00 0.00 C ATOM 775 O ILE A 51 -1.762 -11.751 6.090 1.00 0.00 O ATOM 776 CB ILE A 51 -1.877 -11.685 2.804 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.413 -10.793 1.682 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.985 -12.580 3.346 1.00 0.00 C ATOM 779 CD1 ILE A 51 -3.520 -9.862 2.127 1.00 0.00 C ATOM 0 H ILE A 51 0.161 -10.274 2.504 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.998 -10.060 4.222 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.090 -12.321 2.399 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -1.593 -10.201 1.276 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.782 -11.423 0.873 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.397 -13.180 2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.578 -13.238 4.114 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.773 -11.963 3.777 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.851 -9.260 1.281 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.358 -10.448 2.506 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.149 -9.207 2.915 1.00 0.00 H new ATOM 791 N GLU A 52 0.151 -12.400 5.112 1.00 0.00 N ATOM 792 CA GLU A 52 0.533 -13.278 6.213 1.00 0.00 C ATOM 793 C GLU A 52 0.874 -12.470 7.461 1.00 0.00 C ATOM 794 O GLU A 52 0.357 -12.738 8.546 1.00 0.00 O ATOM 795 CB GLU A 52 1.723 -14.151 5.811 1.00 0.00 C ATOM 796 CG GLU A 52 1.654 -15.564 6.368 1.00 0.00 C ATOM 797 CD GLU A 52 2.794 -16.438 5.883 1.00 0.00 C ATOM 798 OE1 GLU A 52 3.958 -15.987 5.947 1.00 0.00 O ATOM 799 OE2 GLU A 52 2.524 -17.574 5.439 1.00 0.00 O ATOM 0 H GLU A 52 0.816 -12.376 4.339 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.316 -13.922 6.442 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.777 -14.200 4.723 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.643 -13.678 6.155 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.671 -15.523 7.457 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.705 -16.018 6.081 1.00 0.00 H new ATOM 806 N PHE A 53 1.744 -11.480 7.302 1.00 0.00 N ATOM 807 CA PHE A 53 2.151 -10.632 8.418 1.00 0.00 C ATOM 808 C PHE A 53 0.987 -9.770 8.897 1.00 0.00 C ATOM 809 O PHE A 53 0.926 -9.381 10.064 1.00 0.00 O ATOM 810 CB PHE A 53 3.328 -9.742 8.005 1.00 0.00 C ATOM 811 CG PHE A 53 3.745 -8.761 9.066 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.693 -9.107 10.015 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.186 -7.494 9.113 1.00 0.00 C ATOM 814 CE1 PHE A 53 5.077 -8.206 10.991 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.565 -6.590 10.087 1.00 0.00 C ATOM 816 CZ PHE A 53 4.512 -6.946 11.027 1.00 0.00 C ATOM 0 H PHE A 53 2.182 -11.244 6.412 1.00 0.00 H new ATOM 0 HA PHE A 53 2.463 -11.276 9.240 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.179 -10.374 7.752 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.059 -9.194 7.102 1.00 0.00 H new ATOM 0 HD1 PHE A 53 5.137 -10.091 9.992 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.446 -7.210 8.380 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.818 -8.487 11.725 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.121 -5.606 10.113 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.810 -6.241 11.789 1.00 0.00 H new ATOM 826 N TYR A 54 0.070 -9.466 7.985 1.00 0.00 N ATOM 827 CA TYR A 54 -1.087 -8.640 8.305 1.00 0.00 C ATOM 828 C TYR A 54 -2.234 -9.476 8.869 1.00 0.00 C ATOM 829 O TYR A 54 -2.753 -9.183 9.941 1.00 0.00 O ATOM 830 CB TYR A 54 -1.552 -7.886 7.053 1.00 0.00 C ATOM 831 CG TYR A 54 -2.845 -7.119 7.232 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.198 -6.582 8.464 1.00 0.00 C ATOM 833 CD2 TYR A 54 -3.712 -6.929 6.163 1.00 0.00 C ATOM 834 CE1 TYR A 54 -4.378 -5.882 8.626 1.00 0.00 C ATOM 835 CE2 TYR A 54 -4.894 -6.230 6.316 1.00 0.00 C ATOM 836 CZ TYR A 54 -5.222 -5.707 7.549 1.00 0.00 C ATOM 837 OH TYR A 54 -6.397 -5.010 7.707 1.00 0.00 O ATOM 0 H TYR A 54 0.106 -9.781 7.015 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.788 -7.925 9.071 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.769 -7.190 6.751 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.676 -8.600 6.239 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.539 -6.714 9.309 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.457 -7.335 5.195 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -4.638 -5.474 9.591 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.557 -6.094 5.475 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.207 -4.049 7.729 1.00 0.00 H new ATOM 847 N ASP A 55 -2.631 -10.508 8.138 1.00 0.00 N ATOM 848 CA ASP A 55 -3.727 -11.371 8.567 1.00 0.00 C ATOM 849 C ASP A 55 -3.458 -11.992 9.937 1.00 0.00 C ATOM 850 O ASP A 55 -4.391 -12.344 10.659 1.00 0.00 O ATOM 851 CB ASP A 55 -3.963 -12.476 7.537 1.00 0.00 C ATOM 852 CG ASP A 55 -5.294 -13.175 7.733 1.00 0.00 C ATOM 853 OD1 ASP A 55 -6.332 -12.482 7.746 1.00 0.00 O ATOM 854 OD2 ASP A 55 -5.298 -14.416 7.873 1.00 0.00 O ATOM 0 H ASP A 55 -2.212 -10.769 7.245 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.619 -10.750 8.649 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.924 -12.049 6.535 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.158 -13.208 7.603 1.00 0.00 H new ATOM 859 N LYS A 56 -2.184 -12.151 10.280 1.00 0.00 N ATOM 860 CA LYS A 56 -1.808 -12.758 11.548 1.00 0.00 C ATOM 861 C LYS A 56 -1.560 -11.727 12.653 1.00 0.00 C ATOM 862 O LYS A 56 -1.442 -12.091 13.822 1.00 0.00 O ATOM 863 CB LYS A 56 -0.560 -13.623 11.364 1.00 0.00 C ATOM 864 CG LYS A 56 -0.762 -14.784 10.405 1.00 0.00 C ATOM 865 CD LYS A 56 0.433 -15.723 10.408 1.00 0.00 C ATOM 866 CE LYS A 56 0.194 -16.925 11.308 1.00 0.00 C ATOM 867 NZ LYS A 56 1.451 -17.399 11.948 1.00 0.00 N ATOM 0 H LYS A 56 -1.396 -11.868 9.697 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.651 -13.373 11.864 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.255 -12.998 10.998 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.252 -14.013 12.334 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.660 -15.335 10.684 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.923 -14.401 9.397 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.633 -16.062 9.392 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.319 -15.185 10.745 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -0.529 -16.662 12.080 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -0.243 -17.735 10.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 1.245 -18.219 12.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.133 -17.674 11.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.855 -16.635 12.526 1.00 0.00 H new ATOM 881 N PHE A 57 -1.460 -10.449 12.292 1.00 0.00 N ATOM 882 CA PHE A 57 -1.201 -9.407 13.284 1.00 0.00 C ATOM 883 C PHE A 57 -2.142 -8.210 13.129 1.00 0.00 C ATOM 884 O PHE A 57 -2.007 -7.214 13.841 1.00 0.00 O ATOM 885 CB PHE A 57 0.257 -8.943 13.187 1.00 0.00 C ATOM 886 CG PHE A 57 1.036 -9.134 14.460 1.00 0.00 C ATOM 887 CD1 PHE A 57 0.891 -10.289 15.211 1.00 0.00 C ATOM 888 CD2 PHE A 57 1.912 -8.156 14.903 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.605 -10.466 16.381 1.00 0.00 C ATOM 890 CE2 PHE A 57 2.629 -8.328 16.072 1.00 0.00 C ATOM 891 CZ PHE A 57 2.475 -9.484 16.813 1.00 0.00 C ATOM 0 H PHE A 57 -1.553 -10.113 11.333 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.386 -9.841 14.267 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.751 -9.489 12.383 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.276 -7.888 12.914 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.212 -11.060 14.878 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.036 -7.250 14.329 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.483 -11.371 16.957 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.310 -7.559 16.406 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.033 -9.619 17.727 1.00 0.00 H new ATOM 901 N HIS A 58 -3.080 -8.297 12.190 1.00 0.00 N ATOM 902 CA HIS A 58 -4.016 -7.206 11.944 1.00 0.00 C ATOM 903 C HIS A 58 -4.688 -6.734 13.232 1.00 0.00 C ATOM 904 O HIS A 58 -5.044 -5.564 13.362 1.00 0.00 O ATOM 905 CB HIS A 58 -5.084 -7.635 10.936 1.00 0.00 C ATOM 906 CG HIS A 58 -6.014 -8.689 11.456 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.942 -10.013 11.076 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.041 -8.609 12.335 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.884 -10.699 11.697 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.564 -9.871 12.468 1.00 0.00 N ATOM 0 H HIS A 58 -3.211 -9.110 11.588 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.442 -6.374 11.536 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.666 -6.761 10.643 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.594 -8.007 10.037 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.385 -7.717 12.838 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -7.067 -11.758 11.592 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.350 -10.127 13.065 1.00 0.00 H new ATOM 919 N GLU A 59 -4.878 -7.651 14.172 1.00 0.00 N ATOM 920 CA GLU A 59 -5.527 -7.325 15.434 1.00 0.00 C ATOM 921 C GLU A 59 -4.702 -6.347 16.262 1.00 0.00 C ATOM 922 O GLU A 59 -5.210 -5.325 16.723 1.00 0.00 O ATOM 923 CB GLU A 59 -5.758 -8.600 16.239 1.00 0.00 C ATOM 924 CG GLU A 59 -4.535 -9.500 16.337 1.00 0.00 C ATOM 925 CD GLU A 59 -4.877 -10.967 16.164 1.00 0.00 C ATOM 926 OE1 GLU A 59 -5.301 -11.599 17.155 1.00 0.00 O ATOM 927 OE2 GLU A 59 -4.721 -11.484 15.037 1.00 0.00 O ATOM 0 H GLU A 59 -4.592 -8.626 14.084 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.479 -6.849 15.201 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.079 -8.329 17.245 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -6.574 -9.162 15.785 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -3.811 -9.207 15.577 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.057 -9.354 17.306 1.00 0.00 H new ATOM 934 N SER A 60 -3.434 -6.670 16.452 1.00 0.00 N ATOM 935 CA SER A 60 -2.536 -5.825 17.233 1.00 0.00 C ATOM 936 C SER A 60 -2.011 -4.661 16.399 1.00 0.00 C ATOM 937 O SER A 60 -1.845 -3.550 16.903 1.00 0.00 O ATOM 938 CB SER A 60 -1.366 -6.649 17.769 1.00 0.00 C ATOM 939 OG SER A 60 -0.447 -5.833 18.476 1.00 0.00 O ATOM 0 H SER A 60 -2.999 -7.513 16.077 1.00 0.00 H new ATOM 0 HA SER A 60 -3.103 -5.418 18.071 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.741 -7.433 18.427 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.856 -7.143 16.942 1.00 0.00 H new ATOM 0 HG SER A 60 0.291 -6.385 18.810 1.00 0.00 H new ATOM 945 N LYS A 61 -1.746 -4.924 15.126 1.00 0.00 N ATOM 946 CA LYS A 61 -1.232 -3.899 14.224 1.00 0.00 C ATOM 947 C LYS A 61 -2.347 -2.978 13.740 1.00 0.00 C ATOM 948 O LYS A 61 -2.151 -1.770 13.607 1.00 0.00 O ATOM 949 CB LYS A 61 -0.541 -4.552 13.027 1.00 0.00 C ATOM 950 CG LYS A 61 0.647 -5.425 13.408 1.00 0.00 C ATOM 951 CD LYS A 61 1.665 -4.671 14.253 1.00 0.00 C ATOM 952 CE LYS A 61 1.416 -4.893 15.765 1.00 0.00 C ATOM 953 NZ LYS A 61 2.432 -4.191 16.597 1.00 0.00 N ATOM 0 H LYS A 61 -1.878 -5.838 14.694 1.00 0.00 H new ATOM 0 HA LYS A 61 -0.510 -3.297 14.776 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.267 -5.158 12.486 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.204 -3.773 12.344 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.294 -6.297 13.959 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.130 -5.794 12.503 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.671 -5.002 13.996 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.612 -3.606 14.026 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.420 -4.535 16.027 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.439 -5.960 15.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.910 -4.878 17.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.133 -3.735 15.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 1.964 -3.469 17.181 1.00 0.00 H new ATOM 967 N ASN A 62 -3.519 -3.553 13.476 1.00 0.00 N ATOM 968 CA ASN A 62 -4.668 -2.784 13.005 1.00 0.00 C ATOM 969 C ASN A 62 -4.267 -1.804 11.902 1.00 0.00 C ATOM 970 O ASN A 62 -4.171 -0.599 12.134 1.00 0.00 O ATOM 971 CB ASN A 62 -5.304 -2.028 14.170 1.00 0.00 C ATOM 972 CG ASN A 62 -6.784 -1.778 13.959 1.00 0.00 C ATOM 973 OD1 ASN A 62 -7.238 -1.582 12.833 1.00 0.00 O ATOM 974 ND2 ASN A 62 -7.546 -1.783 15.048 1.00 0.00 N ATOM 0 H ASN A 62 -3.697 -4.552 13.581 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.393 -3.483 12.588 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.162 -2.597 15.089 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.793 -1.075 14.303 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -8.550 -1.620 14.969 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.127 -1.950 15.963 1.00 0.00 H new ATOM 981 N PHE A 63 -4.032 -2.328 10.703 1.00 0.00 N ATOM 982 CA PHE A 63 -3.640 -1.494 9.570 1.00 0.00 C ATOM 983 C PHE A 63 -4.305 -1.969 8.280 1.00 0.00 C ATOM 984 O PHE A 63 -4.928 -3.029 8.245 1.00 0.00 O ATOM 985 CB PHE A 63 -2.120 -1.482 9.409 1.00 0.00 C ATOM 986 CG PHE A 63 -1.527 -2.831 9.123 1.00 0.00 C ATOM 987 CD1 PHE A 63 -1.397 -3.772 10.129 1.00 0.00 C ATOM 988 CD2 PHE A 63 -1.093 -3.152 7.848 1.00 0.00 C ATOM 989 CE1 PHE A 63 -0.845 -5.012 9.870 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.541 -4.390 7.582 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.416 -5.321 8.594 1.00 0.00 C ATOM 0 H PHE A 63 -4.106 -3.323 10.490 1.00 0.00 H new ATOM 0 HA PHE A 63 -3.978 -0.478 9.773 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -1.856 -0.801 8.600 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -1.671 -1.085 10.319 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -1.731 -3.535 11.128 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -1.187 -2.427 7.053 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.749 -5.738 10.664 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.207 -4.630 6.583 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.016 -6.289 8.388 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.173 -1.169 7.224 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.763 -1.496 5.938 1.00 0.00 C ATOM 1003 C GLU A 64 -3.740 -1.334 4.815 1.00 0.00 C ATOM 1004 O GLU A 64 -3.118 -0.283 4.671 1.00 0.00 O ATOM 1005 CB GLU A 64 -5.974 -0.599 5.672 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.267 -1.369 5.475 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.872 -1.842 6.781 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.252 -2.695 7.449 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -8.968 -1.358 7.138 1.00 0.00 O ATOM 0 H GLU A 64 -3.660 -0.288 7.239 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.086 -2.537 5.964 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.095 0.091 6.507 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.781 0.004 4.785 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.986 -0.736 4.955 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.078 -2.230 4.834 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.578 -2.385 4.023 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.638 -2.375 2.906 1.00 0.00 C ATOM 1018 C VAL A 65 -3.358 -2.143 1.582 1.00 0.00 C ATOM 1019 O VAL A 65 -4.143 -2.980 1.135 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.855 -3.703 2.816 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -0.789 -3.635 1.723 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.231 -4.047 4.160 1.00 0.00 C ATOM 0 H VAL A 65 -4.088 -3.261 4.133 1.00 0.00 H new ATOM 0 HA VAL A 65 -1.941 -1.557 3.091 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.556 -4.495 2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.251 -4.582 1.680 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.265 -3.444 0.761 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.089 -2.830 1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.683 -4.986 4.077 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.546 -3.253 4.457 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.015 -4.149 4.910 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.079 -1.006 0.953 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.692 -0.669 -0.325 1.00 0.00 C ATOM 1034 C VAL A 66 -2.829 -1.166 -1.480 1.00 0.00 C ATOM 1035 O VAL A 66 -1.604 -1.211 -1.371 1.00 0.00 O ATOM 1036 CB VAL A 66 -3.902 0.851 -0.470 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.722 1.161 -1.712 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.567 1.418 0.774 1.00 0.00 C ATOM 0 H VAL A 66 -2.432 -0.302 1.309 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.665 -1.160 -0.354 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.927 1.326 -0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.860 2.239 -1.797 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.200 0.791 -2.594 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.695 0.676 -1.636 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.707 2.492 0.654 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.535 0.939 0.919 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.935 1.229 1.642 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.468 -1.550 -2.581 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.739 -2.050 -3.737 1.00 0.00 C ATOM 1050 C PHE A 67 -2.574 -0.971 -4.796 1.00 0.00 C ATOM 1051 O PHE A 67 -3.467 -0.743 -5.613 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.450 -3.264 -4.337 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.504 -4.289 -4.895 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.394 -3.898 -5.628 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -2.718 -5.641 -4.680 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.518 -4.836 -6.136 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -1.845 -6.583 -5.187 1.00 0.00 C ATOM 1058 CZ PHE A 67 -0.743 -6.181 -5.915 1.00 0.00 C ATOM 0 H PHE A 67 -4.481 -1.524 -2.695 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.748 -2.350 -3.397 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -4.069 -3.730 -3.570 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.121 -2.929 -5.128 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.213 -2.848 -5.803 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -3.577 -5.962 -4.110 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.343 -4.519 -6.706 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -2.024 -7.634 -5.014 1.00 0.00 H new ATOM 0 HZ PHE A 67 -0.058 -6.916 -6.311 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.418 -0.318 -4.784 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.125 0.729 -5.753 1.00 0.00 C ATOM 1070 C CYS A 68 -0.607 0.108 -7.043 1.00 0.00 C ATOM 1071 O CYS A 68 0.542 -0.324 -7.117 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.093 1.713 -5.194 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.185 1.958 -3.404 1.00 0.00 S ATOM 0 H CYS A 68 -0.669 -0.495 -4.114 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.044 1.277 -5.960 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.905 1.357 -5.449 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -0.223 2.676 -5.687 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.055 2.886 -3.137 1.00 0.00 H new ATOM 1079 N THR A 69 -1.464 0.051 -8.052 1.00 0.00 N ATOM 1080 CA THR A 69 -1.088 -0.537 -9.331 1.00 0.00 C ATOM 1081 C THR A 69 -0.204 0.413 -10.136 1.00 0.00 C ATOM 1082 O THR A 69 -0.219 1.624 -9.929 1.00 0.00 O ATOM 1083 CB THR A 69 -2.334 -0.917 -10.138 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.003 -1.829 -11.170 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.018 0.269 -10.777 1.00 0.00 C ATOM 0 H THR A 69 -2.421 0.403 -8.011 1.00 0.00 H new ATOM 0 HA THR A 69 -0.515 -1.442 -9.126 1.00 0.00 H new ATOM 0 HB THR A 69 -3.019 -1.365 -9.418 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.821 -2.122 -11.622 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.892 -0.071 -11.333 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.330 0.970 -10.003 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.326 0.765 -11.457 1.00 0.00 H new ATOM 1093 N TRP A 70 0.564 -0.157 -11.053 1.00 0.00 N ATOM 1094 CA TRP A 70 1.468 0.621 -11.899 1.00 0.00 C ATOM 1095 C TRP A 70 1.420 0.152 -13.356 1.00 0.00 C ATOM 1096 O TRP A 70 2.414 0.242 -14.076 1.00 0.00 O ATOM 1097 CB TRP A 70 2.901 0.510 -11.368 1.00 0.00 C ATOM 1098 CG TRP A 70 3.433 1.792 -10.803 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.543 2.122 -9.484 1.00 0.00 C ATOM 1100 CD2 TRP A 70 3.930 2.914 -11.541 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.079 3.380 -9.354 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.326 3.888 -10.604 1.00 0.00 C ATOM 1103 CE3 TRP A 70 4.082 3.191 -12.903 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 4.861 5.115 -10.985 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 4.614 4.409 -13.280 1.00 0.00 C ATOM 1106 CH2 TRP A 70 4.997 5.358 -12.324 1.00 0.00 C ATOM 0 H TRP A 70 0.582 -1.161 -11.234 1.00 0.00 H new ATOM 0 HA TRP A 70 1.142 1.661 -11.869 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.935 -0.259 -10.596 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.554 0.180 -12.176 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.251 1.486 -8.661 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.263 3.858 -8.472 1.00 0.00 H new ATOM 0 HE3 TRP A 70 3.789 2.466 -13.647 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.158 5.849 -10.250 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 4.737 4.633 -14.329 1.00 0.00 H new ATOM 0 HH2 TRP A 70 5.408 6.302 -12.651 1.00 0.00 H new ATOM 1117 N ASP A 71 0.264 -0.346 -13.788 1.00 0.00 N ATOM 1118 CA ASP A 71 0.100 -0.825 -15.157 1.00 0.00 C ATOM 1119 C ASP A 71 -0.446 0.276 -16.059 1.00 0.00 C ATOM 1120 O ASP A 71 -0.957 1.290 -15.581 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.841 -2.031 -15.190 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.411 -3.128 -14.238 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.651 -2.985 -13.021 1.00 0.00 O ATOM 1124 OD2 ASP A 71 0.166 -4.130 -14.710 1.00 0.00 O ATOM 0 H ASP A 71 -0.572 -0.428 -13.210 1.00 0.00 H new ATOM 0 HA ASP A 71 1.081 -1.124 -15.527 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.850 -1.708 -14.935 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.881 -2.429 -16.204 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.338 0.066 -17.366 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.824 1.035 -18.340 1.00 0.00 C ATOM 1131 C GLU A 72 -2.153 0.580 -18.935 1.00 0.00 C ATOM 1132 O GLU A 72 -2.988 1.402 -19.315 1.00 0.00 O ATOM 1133 CB GLU A 72 0.205 1.232 -19.455 1.00 0.00 C ATOM 1134 CG GLU A 72 -0.051 2.464 -20.308 1.00 0.00 C ATOM 1135 CD GLU A 72 0.931 3.585 -20.027 1.00 0.00 C ATOM 1136 OE1 GLU A 72 2.039 3.562 -20.604 1.00 0.00 O ATOM 1137 OE2 GLU A 72 0.593 4.484 -19.229 1.00 0.00 O ATOM 0 H GLU A 72 0.083 -0.768 -17.776 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.977 1.985 -17.827 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.198 1.307 -19.012 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.207 0.350 -20.096 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.008 2.190 -21.361 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.065 2.821 -20.128 1.00 0.00 H new ATOM 1144 N GLU A 73 -2.343 -0.733 -19.012 1.00 0.00 N ATOM 1145 CA GLU A 73 -3.571 -1.300 -19.558 1.00 0.00 C ATOM 1146 C GLU A 73 -4.613 -1.499 -18.461 1.00 0.00 C ATOM 1147 O GLU A 73 -4.294 -1.958 -17.365 1.00 0.00 O ATOM 1148 CB GLU A 73 -3.279 -2.634 -20.248 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.370 -3.071 -21.211 1.00 0.00 C ATOM 1150 CD GLU A 73 -3.823 -3.837 -22.400 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -2.989 -4.742 -22.191 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -4.231 -3.532 -23.542 1.00 0.00 O ATOM 0 H GLU A 73 -1.661 -1.426 -18.703 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.971 -0.599 -20.291 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.337 -2.555 -20.791 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.145 -3.405 -19.489 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.089 -3.695 -20.681 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.910 -2.193 -21.566 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.858 -1.149 -18.766 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.948 -1.288 -17.806 1.00 0.00 C ATOM 1161 C GLU A 74 -7.336 -2.755 -17.625 1.00 0.00 C ATOM 1162 O GLU A 74 -7.856 -3.142 -16.578 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.169 -0.481 -18.259 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.827 0.854 -18.907 1.00 0.00 C ATOM 1165 CD GLU A 74 -6.760 1.622 -18.149 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -6.551 1.328 -16.953 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -6.132 2.519 -18.751 1.00 0.00 O ATOM 0 H GLU A 74 -6.138 -0.767 -19.670 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.600 -0.901 -16.849 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.744 -1.079 -18.966 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.812 -0.300 -17.397 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.486 0.680 -19.928 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.729 1.463 -18.971 1.00 0.00 H new ATOM 1174 N ASP A 75 -7.088 -3.562 -18.650 1.00 0.00 N ATOM 1175 CA ASP A 75 -7.420 -4.983 -18.604 1.00 0.00 C ATOM 1176 C ASP A 75 -6.421 -5.762 -17.752 1.00 0.00 C ATOM 1177 O ASP A 75 -6.804 -6.644 -16.985 1.00 0.00 O ATOM 1178 CB ASP A 75 -7.457 -5.562 -20.020 1.00 0.00 C ATOM 1179 CG ASP A 75 -8.400 -6.744 -20.135 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -9.469 -6.716 -19.490 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -8.069 -7.698 -20.871 1.00 0.00 O ATOM 0 H ASP A 75 -6.658 -3.258 -19.524 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.404 -5.080 -18.146 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.765 -4.785 -20.720 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.453 -5.872 -20.310 1.00 0.00 H new ATOM 1186 N GLY A 76 -5.139 -5.436 -17.895 1.00 0.00 N ATOM 1187 CA GLY A 76 -4.110 -6.125 -17.135 1.00 0.00 C ATOM 1188 C GLY A 76 -4.347 -6.063 -15.637 1.00 0.00 C ATOM 1189 O GLY A 76 -4.423 -7.097 -14.972 1.00 0.00 O ATOM 0 H GLY A 76 -4.795 -4.709 -18.522 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -4.069 -7.168 -17.449 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.139 -5.685 -17.364 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.465 -4.852 -15.108 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.695 -4.657 -13.679 1.00 0.00 C ATOM 1195 C PHE A 77 -6.004 -5.316 -13.240 1.00 0.00 C ATOM 1196 O PHE A 77 -6.160 -5.691 -12.079 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.716 -3.158 -13.354 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.325 -2.824 -12.020 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -4.607 -3.004 -10.849 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.617 -2.328 -11.940 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -5.165 -2.696 -9.623 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.180 -2.019 -10.717 1.00 0.00 C ATOM 1203 CZ PHE A 77 -6.455 -2.202 -9.557 1.00 0.00 C ATOM 0 H PHE A 77 -4.405 -3.988 -15.646 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.880 -5.130 -13.130 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.695 -2.778 -13.380 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.270 -2.636 -14.134 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.599 -3.390 -10.895 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -7.190 -2.182 -12.844 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.594 -2.841 -8.718 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.188 -1.634 -10.669 1.00 0.00 H new ATOM 0 HZ PHE A 77 -6.894 -1.960 -8.600 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.941 -5.441 -14.172 1.00 0.00 N ATOM 1214 CA ALA A 78 -8.239 -6.040 -13.879 1.00 0.00 C ATOM 1215 C ALA A 78 -8.161 -7.552 -13.813 1.00 0.00 C ATOM 1216 O ALA A 78 -8.550 -8.166 -12.820 1.00 0.00 O ATOM 1217 CB ALA A 78 -9.212 -5.668 -14.955 1.00 0.00 C ATOM 0 H ALA A 78 -6.827 -5.135 -15.138 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.562 -5.664 -12.908 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -10.182 -6.114 -14.738 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.312 -4.583 -14.996 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.850 -6.035 -15.915 1.00 0.00 H new ATOM 1223 N GLY A 79 -7.625 -8.148 -14.874 1.00 0.00 N ATOM 1224 CA GLY A 79 -7.470 -9.582 -14.910 1.00 0.00 C ATOM 1225 C GLY A 79 -6.613 -10.042 -13.760 1.00 0.00 C ATOM 1226 O GLY A 79 -6.552 -11.230 -13.441 1.00 0.00 O ATOM 0 H GLY A 79 -7.297 -7.659 -15.707 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.447 -10.062 -14.859 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -7.016 -9.882 -15.854 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.938 -9.077 -13.144 1.00 0.00 N ATOM 1231 CA TYR A 80 -5.055 -9.364 -12.016 1.00 0.00 C ATOM 1232 C TYR A 80 -5.732 -9.081 -10.674 1.00 0.00 C ATOM 1233 O TYR A 80 -5.183 -9.398 -9.619 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.762 -8.554 -12.133 1.00 0.00 C ATOM 1235 CG TYR A 80 -2.527 -9.416 -12.266 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -2.419 -10.357 -13.282 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.470 -9.290 -11.374 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -1.293 -11.150 -13.406 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.340 -10.078 -11.491 1.00 0.00 C ATOM 1240 CZ TYR A 80 -0.257 -11.005 -12.508 1.00 0.00 C ATOM 1241 OH TYR A 80 0.866 -11.791 -12.627 1.00 0.00 O ATOM 0 H TYR A 80 -5.984 -8.092 -13.405 1.00 0.00 H new ATOM 0 HA TYR A 80 -4.819 -10.428 -12.050 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.831 -7.895 -12.998 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.659 -7.917 -11.254 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.229 -10.471 -13.988 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -1.532 -8.565 -10.576 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -1.226 -11.878 -14.201 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.474 -9.968 -10.789 1.00 0.00 H new ATOM 0 HH TYR A 80 1.502 -11.563 -11.917 1.00 0.00 H new ATOM 1251 N PHE A 81 -6.920 -8.487 -10.713 1.00 0.00 N ATOM 1252 CA PHE A 81 -7.656 -8.169 -9.489 1.00 0.00 C ATOM 1253 C PHE A 81 -7.719 -9.373 -8.549 1.00 0.00 C ATOM 1254 O PHE A 81 -7.838 -9.215 -7.334 1.00 0.00 O ATOM 1255 CB PHE A 81 -9.075 -7.701 -9.828 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.916 -7.403 -8.619 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -9.433 -6.591 -7.606 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -11.189 -7.937 -8.495 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -10.203 -6.315 -6.492 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -11.965 -7.665 -7.383 1.00 0.00 C ATOM 1261 CZ PHE A 81 -11.470 -6.853 -6.380 1.00 0.00 C ATOM 0 H PHE A 81 -7.395 -8.216 -11.574 1.00 0.00 H new ATOM 0 HA PHE A 81 -7.123 -7.366 -8.980 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -9.015 -6.806 -10.448 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.569 -8.469 -10.423 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -8.442 -6.168 -7.688 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -11.579 -8.573 -9.276 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.814 -5.679 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -12.956 -8.086 -7.299 1.00 0.00 H new ATOM 0 HZ PHE A 81 -12.073 -6.640 -5.510 1.00 0.00 H new ATOM 1271 N ALA A 82 -7.641 -10.573 -9.118 1.00 0.00 N ATOM 1272 CA ALA A 82 -7.690 -11.801 -8.329 1.00 0.00 C ATOM 1273 C ALA A 82 -6.695 -11.762 -7.171 1.00 0.00 C ATOM 1274 O ALA A 82 -6.918 -12.378 -6.129 1.00 0.00 O ATOM 1275 CB ALA A 82 -7.421 -13.005 -9.217 1.00 0.00 C ATOM 0 H ALA A 82 -7.544 -10.721 -10.122 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.690 -11.887 -7.904 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.460 -13.915 -8.618 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.176 -13.054 -10.002 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -6.434 -12.910 -9.669 1.00 0.00 H new ATOM 1281 N LYS A 83 -5.598 -11.036 -7.360 1.00 0.00 N ATOM 1282 CA LYS A 83 -4.571 -10.919 -6.330 1.00 0.00 C ATOM 1283 C LYS A 83 -5.135 -10.270 -5.068 1.00 0.00 C ATOM 1284 O LYS A 83 -6.351 -10.135 -4.922 1.00 0.00 O ATOM 1285 CB LYS A 83 -3.379 -10.114 -6.858 1.00 0.00 C ATOM 1286 CG LYS A 83 -3.715 -8.667 -7.183 1.00 0.00 C ATOM 1287 CD LYS A 83 -2.908 -8.160 -8.370 1.00 0.00 C ATOM 1288 CE LYS A 83 -1.412 -8.245 -8.110 1.00 0.00 C ATOM 1289 NZ LYS A 83 -0.690 -7.049 -8.629 1.00 0.00 N ATOM 0 H LYS A 83 -5.397 -10.520 -8.216 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.231 -11.922 -6.072 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.581 -10.135 -6.116 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.993 -10.599 -7.755 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.779 -8.580 -7.401 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.516 -8.042 -6.313 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.157 -8.744 -9.256 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -3.182 -7.127 -8.582 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.234 -8.340 -7.039 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.012 -9.143 -8.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 0.275 -7.319 -8.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -1.195 -6.671 -9.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -0.646 -6.321 -7.887 1.00 0.00 H new ATOM 1303 N MET A 84 -4.248 -9.873 -4.156 1.00 0.00 N ATOM 1304 CA MET A 84 -4.658 -9.240 -2.901 1.00 0.00 C ATOM 1305 C MET A 84 -5.730 -8.172 -3.145 1.00 0.00 C ATOM 1306 O MET A 84 -5.432 -7.085 -3.636 1.00 0.00 O ATOM 1307 CB MET A 84 -3.450 -8.613 -2.200 1.00 0.00 C ATOM 1308 CG MET A 84 -2.203 -9.488 -2.210 1.00 0.00 C ATOM 1309 SD MET A 84 -2.537 -11.199 -1.746 1.00 0.00 S ATOM 1310 CE MET A 84 -1.014 -11.991 -2.256 1.00 0.00 C ATOM 0 H MET A 84 -3.239 -9.978 -4.262 1.00 0.00 H new ATOM 0 HA MET A 84 -5.082 -10.013 -2.260 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.218 -7.662 -2.680 1.00 0.00 H new ATOM 0 HB3 MET A 84 -3.717 -8.392 -1.167 1.00 0.00 H new ATOM 0 HG2 MET A 84 -1.760 -9.467 -3.206 1.00 0.00 H new ATOM 0 HG3 MET A 84 -1.466 -9.069 -1.524 1.00 0.00 H new ATOM 0 HE1 MET A 84 -0.808 -12.838 -1.602 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.112 -12.341 -3.283 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.194 -11.276 -2.193 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.000 -8.479 -2.818 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.117 -7.555 -3.019 1.00 0.00 C ATOM 1322 C PRO A 85 -8.327 -6.578 -1.863 1.00 0.00 C ATOM 1323 O PRO A 85 -9.072 -5.608 -2.001 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.307 -8.500 -3.120 1.00 0.00 C ATOM 1325 CG PRO A 85 -8.956 -9.646 -2.232 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.452 -9.763 -2.248 1.00 0.00 C ATOM 0 HA PRO A 85 -7.954 -6.914 -3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -10.227 -8.014 -2.795 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.466 -8.829 -4.147 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.320 -9.476 -1.219 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.419 -10.567 -2.587 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -7.053 -9.917 -1.245 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.124 -10.607 -2.855 1.00 0.00 H new ATOM 1334 N TRP A 86 -7.686 -6.851 -0.726 1.00 0.00 N ATOM 1335 CA TRP A 86 -7.809 -6.011 0.478 1.00 0.00 C ATOM 1336 C TRP A 86 -8.290 -4.587 0.150 1.00 0.00 C ATOM 1337 O TRP A 86 -9.484 -4.308 0.253 1.00 0.00 O ATOM 1338 CB TRP A 86 -6.486 -5.992 1.255 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.267 -5.953 0.376 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.200 -5.545 -0.928 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.943 -6.361 0.731 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -3.912 -5.645 -1.389 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.124 -6.150 -0.394 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -3.370 -6.877 1.895 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -1.763 -6.438 -0.389 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -2.019 -7.167 1.899 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.228 -6.945 0.761 1.00 0.00 C ATOM 0 H TRP A 86 -7.069 -7.655 -0.608 1.00 0.00 H new ATOM 0 HA TRP A 86 -8.575 -6.456 1.112 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -6.475 -5.124 1.914 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -6.436 -6.876 1.891 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.040 -5.195 -1.510 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.594 -5.385 -2.323 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -3.972 -7.046 2.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.152 -6.267 -1.263 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.565 -7.571 2.792 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.174 -7.180 0.795 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.390 -3.695 -0.278 1.00 0.00 N ATOM 1359 CA LEU A 87 -7.781 -2.350 -0.641 1.00 0.00 C ATOM 1360 C LEU A 87 -7.008 -1.926 -1.880 1.00 0.00 C ATOM 1361 O LEU A 87 -5.801 -2.132 -1.954 1.00 0.00 O ATOM 1362 CB LEU A 87 -7.533 -1.359 0.495 1.00 0.00 C ATOM 1363 CG LEU A 87 -8.731 -1.102 1.416 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -8.315 -0.237 2.596 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -9.868 -0.441 0.646 1.00 0.00 C ATOM 0 H LEU A 87 -6.394 -3.889 -0.377 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.852 -2.348 -0.845 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.703 -1.726 1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.218 -0.409 0.063 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.086 -2.060 1.795 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.176 -0.063 3.241 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.534 -0.745 3.162 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.936 0.718 2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.709 -0.267 1.317 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.526 0.510 0.238 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.183 -1.093 -0.169 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.695 -1.367 -2.863 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.037 -0.963 -4.091 1.00 0.00 C ATOM 1379 C ALA A 88 -7.771 0.166 -4.799 1.00 0.00 C ATOM 1380 O ALA A 88 -8.964 0.067 -5.074 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.955 -2.167 -4.993 1.00 0.00 C ATOM 0 H ALA A 88 -8.698 -1.185 -2.834 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.044 -0.585 -3.846 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.463 -1.890 -5.926 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.382 -2.953 -4.500 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.960 -2.531 -5.207 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.045 1.231 -5.122 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.639 2.359 -5.828 1.00 0.00 C ATOM 1389 C VAL A 89 -8.142 1.912 -7.196 1.00 0.00 C ATOM 1390 O VAL A 89 -7.427 1.232 -7.932 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.633 3.515 -6.020 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.240 4.630 -6.868 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.174 4.051 -4.672 1.00 0.00 C ATOM 0 H VAL A 89 -6.053 1.336 -4.908 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.467 2.721 -5.218 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.763 3.126 -6.549 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.512 5.432 -6.989 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.511 4.236 -7.847 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.130 5.019 -6.374 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.466 4.865 -4.826 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -7.035 4.420 -4.115 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.692 3.252 -4.108 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.374 2.293 -7.570 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.942 1.926 -8.867 1.00 0.00 C ATOM 1405 C PRO A 90 -8.993 2.276 -10.004 1.00 0.00 C ATOM 1406 O PRO A 90 -8.385 3.348 -10.005 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.231 2.757 -8.959 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.156 3.747 -7.842 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.301 3.115 -6.783 1.00 0.00 C ATOM 0 HA PRO A 90 -10.123 0.854 -8.951 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.304 3.260 -9.923 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.113 2.124 -8.862 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.723 4.687 -8.183 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.150 3.975 -7.456 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.776 3.861 -6.187 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.891 2.513 -6.092 1.00 0.00 H new ATOM 1417 N PHE A 91 -8.862 1.374 -10.972 1.00 0.00 N ATOM 1418 CA PHE A 91 -7.974 1.604 -12.107 1.00 0.00 C ATOM 1419 C PHE A 91 -8.198 2.999 -12.685 1.00 0.00 C ATOM 1420 O PHE A 91 -7.281 3.614 -13.229 1.00 0.00 O ATOM 1421 CB PHE A 91 -8.189 0.534 -13.182 1.00 0.00 C ATOM 1422 CG PHE A 91 -9.457 0.702 -13.972 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -10.695 0.588 -13.359 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -9.409 0.969 -15.330 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -11.860 0.740 -14.087 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -10.570 1.122 -16.063 1.00 0.00 C ATOM 1427 CZ PHE A 91 -11.797 1.007 -15.440 1.00 0.00 C ATOM 0 H PHE A 91 -9.356 0.482 -10.994 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.943 1.538 -11.759 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -7.342 0.548 -13.868 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -8.197 -0.447 -12.706 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -10.750 0.378 -12.301 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -8.452 1.059 -15.822 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -12.819 0.650 -13.598 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -10.518 1.331 -17.121 1.00 0.00 H new ATOM 0 HZ PHE A 91 -12.706 1.126 -16.011 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.426 3.491 -12.553 1.00 0.00 N ATOM 1438 CA ALA A 92 -9.780 4.815 -13.049 1.00 0.00 C ATOM 1439 C ALA A 92 -8.866 5.901 -12.477 1.00 0.00 C ATOM 1440 O ALA A 92 -8.522 6.854 -13.176 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.233 5.124 -12.723 1.00 0.00 C ATOM 0 H ALA A 92 -10.194 2.991 -12.105 1.00 0.00 H new ATOM 0 HA ALA A 92 -9.646 4.810 -14.131 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -11.487 6.115 -13.098 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -11.877 4.382 -13.194 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.377 5.097 -11.643 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.474 5.766 -11.205 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.609 6.754 -10.574 1.00 0.00 C ATOM 1449 C GLN A 93 -6.198 6.208 -10.377 1.00 0.00 C ATOM 1450 O GLN A 93 -5.455 6.689 -9.521 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.189 7.183 -9.226 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.688 7.440 -9.260 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.040 8.740 -9.955 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -10.049 9.805 -9.337 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -10.335 8.659 -11.248 1.00 0.00 N ATOM 0 H GLN A 93 -8.742 4.988 -10.602 1.00 0.00 H new ATOM 0 HA GLN A 93 -7.554 7.619 -11.235 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.978 6.410 -8.487 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.681 8.088 -8.893 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.183 6.614 -9.770 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.073 7.462 -8.240 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -10.315 7.755 -11.720 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -10.582 9.501 -11.769 1.00 0.00 H new ATOM 1464 N SER A 94 -5.828 5.210 -11.173 1.00 0.00 N ATOM 1465 CA SER A 94 -4.500 4.618 -11.072 1.00 0.00 C ATOM 1466 C SER A 94 -3.426 5.664 -11.351 1.00 0.00 C ATOM 1467 O SER A 94 -2.304 5.560 -10.856 1.00 0.00 O ATOM 1468 CB SER A 94 -4.356 3.441 -12.037 1.00 0.00 C ATOM 1469 OG SER A 94 -3.961 3.879 -13.326 1.00 0.00 O ATOM 0 H SER A 94 -6.424 4.797 -11.890 1.00 0.00 H new ATOM 0 HA SER A 94 -4.370 4.247 -10.055 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.620 2.737 -11.648 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.303 2.906 -12.106 1.00 0.00 H new ATOM 0 HG SER A 94 -3.875 3.106 -13.922 1.00 0.00 H new ATOM 1475 N GLU A 95 -3.778 6.680 -12.136 1.00 0.00 N ATOM 1476 CA GLU A 95 -2.841 7.749 -12.464 1.00 0.00 C ATOM 1477 C GLU A 95 -2.267 8.352 -11.187 1.00 0.00 C ATOM 1478 O GLU A 95 -1.114 8.783 -11.151 1.00 0.00 O ATOM 1479 CB GLU A 95 -3.535 8.833 -13.292 1.00 0.00 C ATOM 1480 CG GLU A 95 -2.572 9.830 -13.915 1.00 0.00 C ATOM 1481 CD GLU A 95 -3.287 10.935 -14.670 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -3.858 10.647 -15.743 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -3.274 12.086 -14.189 1.00 0.00 O ATOM 0 H GLU A 95 -4.702 6.784 -12.555 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.027 7.329 -13.054 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.116 8.359 -14.083 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.240 9.369 -12.656 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.954 10.270 -13.133 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.901 9.306 -14.595 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.082 8.362 -10.136 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.663 8.892 -8.846 1.00 0.00 C ATOM 1492 C ALA A 96 -1.480 8.106 -8.306 1.00 0.00 C ATOM 1493 O ALA A 96 -0.620 8.647 -7.616 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.812 8.828 -7.855 1.00 0.00 C ATOM 0 H ALA A 96 -4.038 8.008 -10.155 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.364 9.931 -8.983 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.487 9.227 -6.894 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.648 9.419 -8.229 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.127 7.792 -7.730 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.454 6.822 -8.626 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.390 5.937 -8.180 1.00 0.00 C ATOM 1502 C VAL A 97 0.928 6.285 -8.853 1.00 0.00 C ATOM 1503 O VAL A 97 2.003 6.120 -8.276 1.00 0.00 O ATOM 1504 CB VAL A 97 -0.755 4.478 -8.463 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.408 3.556 -8.140 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -1.991 4.116 -7.662 1.00 0.00 C ATOM 0 H VAL A 97 -2.165 6.366 -9.198 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.271 6.070 -7.105 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.972 4.355 -9.524 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.124 2.525 -8.349 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.268 3.827 -8.752 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.668 3.654 -7.086 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.260 3.078 -7.857 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.786 4.245 -6.599 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.817 4.765 -7.954 1.00 0.00 H new ATOM 1516 N GLN A 98 0.826 6.776 -10.073 1.00 0.00 N ATOM 1517 CA GLN A 98 1.999 7.168 -10.845 1.00 0.00 C ATOM 1518 C GLN A 98 2.530 8.510 -10.358 1.00 0.00 C ATOM 1519 O GLN A 98 3.740 8.719 -10.273 1.00 0.00 O ATOM 1520 CB GLN A 98 1.655 7.249 -12.334 1.00 0.00 C ATOM 1521 CG GLN A 98 1.232 5.917 -12.934 1.00 0.00 C ATOM 1522 CD GLN A 98 0.985 6.002 -14.427 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.220 6.845 -14.894 1.00 0.00 O ATOM 1524 NE2 GLN A 98 1.634 5.125 -15.185 1.00 0.00 N ATOM 0 H GLN A 98 -0.061 6.915 -10.557 1.00 0.00 H new ATOM 0 HA GLN A 98 2.772 6.413 -10.704 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.852 7.973 -12.474 1.00 0.00 H new ATOM 0 HB3 GLN A 98 2.521 7.625 -12.879 1.00 0.00 H new ATOM 0 HG2 GLN A 98 2.005 5.173 -12.739 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.325 5.571 -12.439 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.259 4.443 -14.755 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.507 5.134 -16.197 1.00 0.00 H new ATOM 1533 N LYS A 99 1.613 9.416 -10.030 1.00 0.00 N ATOM 1534 CA LYS A 99 1.982 10.737 -9.541 1.00 0.00 C ATOM 1535 C LYS A 99 2.323 10.685 -8.056 1.00 0.00 C ATOM 1536 O LYS A 99 3.295 11.295 -7.610 1.00 0.00 O ATOM 1537 CB LYS A 99 0.843 11.731 -9.783 1.00 0.00 C ATOM 1538 CG LYS A 99 0.654 12.095 -11.246 1.00 0.00 C ATOM 1539 CD LYS A 99 1.926 12.672 -11.846 1.00 0.00 C ATOM 1540 CE LYS A 99 1.690 13.202 -13.250 1.00 0.00 C ATOM 1541 NZ LYS A 99 1.076 12.175 -14.137 1.00 0.00 N ATOM 0 H LYS A 99 0.608 9.257 -10.095 1.00 0.00 H new ATOM 0 HA LYS A 99 2.864 11.070 -10.088 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.085 11.307 -9.400 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.038 12.640 -9.213 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.355 11.209 -11.807 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.155 12.819 -11.340 1.00 0.00 H new ATOM 0 HD2 LYS A 99 2.297 13.476 -11.210 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.699 11.903 -11.871 1.00 0.00 H new ATOM 0 HE2 LYS A 99 1.040 14.076 -13.203 1.00 0.00 H new ATOM 0 HE3 LYS A 99 2.637 13.531 -13.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 1.102 12.507 -15.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 1.608 11.285 -14.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 0.089 12.015 -13.852 1.00 0.00 H new ATOM 1555 N LEU A 100 1.518 9.948 -7.296 1.00 0.00 N ATOM 1556 CA LEU A 100 1.740 9.811 -5.857 1.00 0.00 C ATOM 1557 C LEU A 100 3.078 9.131 -5.581 1.00 0.00 C ATOM 1558 O LEU A 100 3.698 9.357 -4.542 1.00 0.00 O ATOM 1559 CB LEU A 100 0.600 9.013 -5.217 1.00 0.00 C ATOM 1560 CG LEU A 100 0.782 8.655 -3.746 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.356 9.820 -2.871 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.016 7.396 -3.408 1.00 0.00 C ATOM 0 H LEU A 100 0.709 9.438 -7.649 1.00 0.00 H new ATOM 0 HA LEU A 100 1.762 10.808 -5.417 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.321 9.586 -5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.466 8.090 -5.782 1.00 0.00 H new ATOM 0 HG LEU A 100 1.836 8.451 -3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.489 9.555 -1.822 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.965 10.693 -3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.693 10.050 -3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.121 7.150 -2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.074 7.572 -3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 100 0.334 6.567 -4.023 1.00 0.00 H new ATOM 1574 N SER A 101 3.519 8.298 -6.521 1.00 0.00 N ATOM 1575 CA SER A 101 4.784 7.586 -6.381 1.00 0.00 C ATOM 1576 C SER A 101 5.945 8.564 -6.238 1.00 0.00 C ATOM 1577 O SER A 101 6.771 8.435 -5.334 1.00 0.00 O ATOM 1578 CB SER A 101 5.016 6.675 -7.588 1.00 0.00 C ATOM 1579 OG SER A 101 4.376 5.423 -7.413 1.00 0.00 O ATOM 0 H SER A 101 3.018 8.100 -7.387 1.00 0.00 H new ATOM 0 HA SER A 101 4.732 6.977 -5.479 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.638 7.157 -8.489 1.00 0.00 H new ATOM 0 HB3 SER A 101 6.086 6.523 -7.733 1.00 0.00 H new ATOM 0 HG SER A 101 4.033 5.356 -6.498 1.00 0.00 H new ATOM 1585 N LYS A 102 6.003 9.544 -7.136 1.00 0.00 N ATOM 1586 CA LYS A 102 7.063 10.547 -7.108 1.00 0.00 C ATOM 1587 C LYS A 102 7.104 11.255 -5.758 1.00 0.00 C ATOM 1588 O LYS A 102 8.173 11.619 -5.268 1.00 0.00 O ATOM 1589 CB LYS A 102 6.858 11.567 -8.228 1.00 0.00 C ATOM 1590 CG LYS A 102 8.157 12.105 -8.806 1.00 0.00 C ATOM 1591 CD LYS A 102 7.953 12.670 -10.203 1.00 0.00 C ATOM 1592 CE LYS A 102 7.697 11.567 -11.217 1.00 0.00 C ATOM 1593 NZ LYS A 102 7.730 12.080 -12.615 1.00 0.00 N ATOM 0 H LYS A 102 5.329 9.665 -7.892 1.00 0.00 H new ATOM 0 HA LYS A 102 8.015 10.039 -7.260 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.278 11.105 -9.027 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.267 12.400 -7.846 1.00 0.00 H new ATOM 0 HG2 LYS A 102 8.553 12.882 -8.152 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.899 11.308 -8.840 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.112 13.363 -10.197 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.834 13.240 -10.498 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.447 10.785 -11.100 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.727 11.111 -11.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 7.551 11.297 -13.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.998 12.809 -12.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.664 12.492 -12.811 1.00 0.00 H new ATOM 1607 N HIS A 103 5.932 11.443 -5.162 1.00 0.00 N ATOM 1608 CA HIS A 103 5.831 12.103 -3.865 1.00 0.00 C ATOM 1609 C HIS A 103 6.215 11.148 -2.740 1.00 0.00 C ATOM 1610 O HIS A 103 6.653 11.577 -1.672 1.00 0.00 O ATOM 1611 CB HIS A 103 4.408 12.621 -3.645 1.00 0.00 C ATOM 1612 CG HIS A 103 4.183 13.999 -4.186 1.00 0.00 C ATOM 1613 ND1 HIS A 103 5.072 14.630 -5.031 1.00 0.00 N ATOM 1614 CD2 HIS A 103 3.161 14.868 -4.000 1.00 0.00 C ATOM 1615 CE1 HIS A 103 4.607 15.828 -5.340 1.00 0.00 C ATOM 1616 NE2 HIS A 103 3.449 15.996 -4.727 1.00 0.00 N ATOM 0 H HIS A 103 5.039 11.148 -5.556 1.00 0.00 H new ATOM 0 HA HIS A 103 6.523 12.945 -3.856 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.704 11.935 -4.116 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.190 12.619 -2.577 1.00 0.00 H new ATOM 0 HD2 HIS A 103 2.283 14.704 -3.393 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.091 16.547 -5.984 1.00 0.00 H new ATOM 0 HE2 HIS A 103 2.864 16.829 -4.785 1.00 0.00 H new ATOM 1625 N PHE A 104 6.049 9.852 -2.986 1.00 0.00 N ATOM 1626 CA PHE A 104 6.380 8.836 -1.993 1.00 0.00 C ATOM 1627 C PHE A 104 7.815 8.336 -2.167 1.00 0.00 C ATOM 1628 O PHE A 104 8.181 7.286 -1.641 1.00 0.00 O ATOM 1629 CB PHE A 104 5.404 7.661 -2.097 1.00 0.00 C ATOM 1630 CG PHE A 104 4.282 7.720 -1.098 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.524 8.066 0.222 1.00 0.00 C ATOM 1632 CD2 PHE A 104 2.983 7.429 -1.483 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.491 8.120 1.139 1.00 0.00 C ATOM 1634 CE2 PHE A 104 1.946 7.482 -0.572 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.200 7.828 0.741 1.00 0.00 C ATOM 0 H PHE A 104 5.687 9.481 -3.864 1.00 0.00 H new ATOM 0 HA PHE A 104 6.296 9.291 -1.006 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.983 7.637 -3.102 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.954 6.730 -1.959 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.531 8.296 0.538 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.779 7.157 -2.508 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.692 8.390 2.165 1.00 0.00 H new ATOM 0 HE2 PHE A 104 0.938 7.253 -0.886 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.391 7.870 1.455 1.00 0.00 H new ATOM 1645 N ASN A 105 8.624 9.095 -2.903 1.00 0.00 N ATOM 1646 CA ASN A 105 10.016 8.728 -3.136 1.00 0.00 C ATOM 1647 C ASN A 105 10.132 7.321 -3.717 1.00 0.00 C ATOM 1648 O ASN A 105 11.137 6.638 -3.515 1.00 0.00 O ATOM 1649 CB ASN A 105 10.809 8.822 -1.834 1.00 0.00 C ATOM 1650 CG ASN A 105 12.289 9.051 -2.071 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.942 8.286 -2.781 1.00 0.00 O ATOM 1652 ND2 ASN A 105 12.827 10.110 -1.478 1.00 0.00 N ATOM 0 H ASN A 105 8.338 9.967 -3.348 1.00 0.00 H new ATOM 0 HA ASN A 105 10.429 9.428 -3.862 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.411 9.636 -1.228 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.674 7.904 -1.263 1.00 0.00 H new ATOM 0 HD21 ASN A 105 13.818 10.316 -1.603 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.249 10.718 -0.898 1.00 0.00 H new ATOM 1659 N VAL A 106 9.103 6.892 -4.441 1.00 0.00 N ATOM 1660 CA VAL A 106 9.103 5.565 -5.051 1.00 0.00 C ATOM 1661 C VAL A 106 10.144 5.477 -6.161 1.00 0.00 C ATOM 1662 O VAL A 106 9.911 5.926 -7.283 1.00 0.00 O ATOM 1663 CB VAL A 106 7.722 5.193 -5.630 1.00 0.00 C ATOM 1664 CG1 VAL A 106 7.709 3.741 -6.085 1.00 0.00 C ATOM 1665 CG2 VAL A 106 6.625 5.447 -4.608 1.00 0.00 C ATOM 0 H VAL A 106 8.262 7.440 -4.620 1.00 0.00 H new ATOM 0 HA VAL A 106 9.348 4.859 -4.257 1.00 0.00 H new ATOM 0 HB VAL A 106 7.531 5.826 -6.497 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.727 3.496 -6.491 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.467 3.594 -6.855 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.923 3.092 -5.236 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.659 5.178 -5.036 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.809 4.843 -3.719 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.620 6.502 -4.335 1.00 0.00 H new ATOM 1675 N GLU A 107 11.297 4.896 -5.839 1.00 0.00 N ATOM 1676 CA GLU A 107 12.375 4.751 -6.809 1.00 0.00 C ATOM 1677 C GLU A 107 12.014 3.724 -7.877 1.00 0.00 C ATOM 1678 O GLU A 107 12.189 3.967 -9.071 1.00 0.00 O ATOM 1679 CB GLU A 107 13.670 4.339 -6.107 1.00 0.00 C ATOM 1680 CG GLU A 107 13.580 2.993 -5.405 1.00 0.00 C ATOM 1681 CD GLU A 107 14.828 2.667 -4.608 1.00 0.00 C ATOM 1682 OE1 GLU A 107 15.331 3.564 -3.900 1.00 0.00 O ATOM 1683 OE2 GLU A 107 15.302 1.514 -4.692 1.00 0.00 O ATOM 0 H GLU A 107 11.507 4.519 -4.915 1.00 0.00 H new ATOM 0 HA GLU A 107 12.523 5.716 -7.294 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.476 4.304 -6.840 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.937 5.103 -5.377 1.00 0.00 H new ATOM 0 HG2 GLU A 107 12.717 2.992 -4.739 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.412 2.211 -6.146 1.00 0.00 H new ATOM 1690 N SER A 108 11.507 2.575 -7.440 1.00 0.00 N ATOM 1691 CA SER A 108 11.122 1.513 -8.361 1.00 0.00 C ATOM 1692 C SER A 108 10.206 0.502 -7.679 1.00 0.00 C ATOM 1693 O SER A 108 10.111 0.461 -6.453 1.00 0.00 O ATOM 1694 CB SER A 108 12.365 0.806 -8.904 1.00 0.00 C ATOM 1695 OG SER A 108 13.003 1.589 -9.898 1.00 0.00 O ATOM 0 H SER A 108 11.354 2.357 -6.455 1.00 0.00 H new ATOM 0 HA SER A 108 10.577 1.966 -9.189 1.00 0.00 H new ATOM 0 HB2 SER A 108 13.061 0.610 -8.089 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.084 -0.160 -9.323 1.00 0.00 H new ATOM 0 HG SER A 108 12.548 2.454 -9.975 1.00 0.00 H new ATOM 1701 N ILE A 109 9.537 -0.314 -8.486 1.00 0.00 N ATOM 1702 CA ILE A 109 8.628 -1.330 -7.968 1.00 0.00 C ATOM 1703 C ILE A 109 9.243 -2.724 -8.079 1.00 0.00 C ATOM 1704 O ILE A 109 10.125 -2.953 -8.905 1.00 0.00 O ATOM 1705 CB ILE A 109 7.259 -1.292 -8.694 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.406 -1.461 -10.216 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.557 0.018 -8.386 1.00 0.00 C ATOM 1708 CD1 ILE A 109 7.975 -2.795 -10.645 1.00 0.00 C ATOM 0 H ILE A 109 9.607 -0.292 -9.503 1.00 0.00 H new ATOM 0 HA ILE A 109 8.460 -1.105 -6.915 1.00 0.00 H new ATOM 0 HB ILE A 109 6.665 -2.130 -8.328 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.428 -1.331 -10.680 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.048 -0.667 -10.597 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.594 0.044 -8.897 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.399 0.102 -7.311 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.172 0.850 -8.729 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.044 -2.828 -11.732 1.00 0.00 H new ATOM 0 HD12 ILE A 109 8.968 -2.922 -10.214 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.323 -3.597 -10.298 1.00 0.00 H new ATOM 1720 N PRO A 110 8.792 -3.683 -7.244 1.00 0.00 N ATOM 1721 CA PRO A 110 7.744 -3.461 -6.239 1.00 0.00 C ATOM 1722 C PRO A 110 8.246 -2.685 -5.026 1.00 0.00 C ATOM 1723 O PRO A 110 9.404 -2.813 -4.629 1.00 0.00 O ATOM 1724 CB PRO A 110 7.348 -4.881 -5.832 1.00 0.00 C ATOM 1725 CG PRO A 110 8.580 -5.688 -6.048 1.00 0.00 C ATOM 1726 CD PRO A 110 9.283 -5.074 -7.229 1.00 0.00 C ATOM 0 HA PRO A 110 6.923 -2.863 -6.634 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.025 -4.920 -4.792 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.520 -5.251 -6.437 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.217 -5.670 -5.164 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.333 -6.732 -6.242 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.366 -5.115 -7.116 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.039 -5.595 -8.155 1.00 0.00 H new ATOM 1734 N THR A 111 7.363 -1.882 -4.438 1.00 0.00 N ATOM 1735 CA THR A 111 7.714 -1.090 -3.265 1.00 0.00 C ATOM 1736 C THR A 111 6.593 -1.134 -2.227 1.00 0.00 C ATOM 1737 O THR A 111 5.479 -1.568 -2.519 1.00 0.00 O ATOM 1738 CB THR A 111 8.021 0.360 -3.671 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.042 0.901 -2.850 1.00 0.00 O ATOM 1740 CG2 THR A 111 6.828 1.293 -3.586 1.00 0.00 C ATOM 0 H THR A 111 6.401 -1.763 -4.755 1.00 0.00 H new ATOM 0 HA THR A 111 8.609 -1.520 -2.815 1.00 0.00 H new ATOM 0 HB THR A 111 8.330 0.298 -4.715 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.226 1.824 -3.123 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.128 2.296 -3.889 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.039 0.935 -4.247 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.459 1.319 -2.561 1.00 0.00 H new ATOM 1748 N LEU A 112 6.894 -0.671 -1.019 1.00 0.00 N ATOM 1749 CA LEU A 112 5.902 -0.645 0.062 1.00 0.00 C ATOM 1750 C LEU A 112 6.146 0.561 0.972 1.00 0.00 C ATOM 1751 O LEU A 112 7.248 0.741 1.489 1.00 0.00 O ATOM 1752 CB LEU A 112 5.939 -1.950 0.891 1.00 0.00 C ATOM 1753 CG LEU A 112 4.587 -2.460 1.418 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.716 -1.326 1.919 1.00 0.00 C ATOM 1755 CD2 LEU A 112 3.842 -3.227 0.349 1.00 0.00 C ATOM 0 H LEU A 112 7.811 -0.309 -0.759 1.00 0.00 H new ATOM 0 HA LEU A 112 4.914 -0.560 -0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.385 -2.733 0.277 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.602 -1.796 1.742 1.00 0.00 H new ATOM 0 HG LEU A 112 4.806 -3.125 2.253 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.770 -1.727 2.283 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.226 -0.807 2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.525 -0.627 1.105 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.890 -3.576 0.748 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.660 -2.576 -0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.438 -4.083 0.033 1.00 0.00 H new ATOM 1767 N ILE A 113 5.121 1.388 1.161 1.00 0.00 N ATOM 1768 CA ILE A 113 5.243 2.573 2.006 1.00 0.00 C ATOM 1769 C ILE A 113 4.027 2.730 2.918 1.00 0.00 C ATOM 1770 O ILE A 113 2.888 2.575 2.478 1.00 0.00 O ATOM 1771 CB ILE A 113 5.414 3.846 1.150 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.618 3.688 0.219 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.572 5.078 2.030 1.00 0.00 C ATOM 1774 CD1 ILE A 113 6.902 4.914 -0.621 1.00 0.00 C ATOM 0 H ILE A 113 4.200 1.260 0.742 1.00 0.00 H new ATOM 0 HA ILE A 113 6.130 2.439 2.625 1.00 0.00 H new ATOM 0 HB ILE A 113 4.517 3.983 0.547 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.500 3.455 0.816 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.447 2.838 -0.441 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.691 5.961 1.402 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.687 5.194 2.656 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.452 4.962 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.769 4.728 -1.255 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.036 5.136 -1.245 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.106 5.763 0.032 1.00 0.00 H new ATOM 1786 N GLY A 114 4.275 3.037 4.193 1.00 0.00 N ATOM 1787 CA GLY A 114 3.184 3.204 5.139 1.00 0.00 C ATOM 1788 C GLY A 114 2.984 4.648 5.554 1.00 0.00 C ATOM 1789 O GLY A 114 3.951 5.372 5.796 1.00 0.00 O ATOM 0 H GLY A 114 5.207 3.172 4.584 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.263 2.827 4.695 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.381 2.600 6.025 1.00 0.00 H new ATOM 1793 N VAL A 115 1.725 5.067 5.641 1.00 0.00 N ATOM 1794 CA VAL A 115 1.395 6.424 6.033 1.00 0.00 C ATOM 1795 C VAL A 115 0.294 6.429 7.084 1.00 0.00 C ATOM 1796 O VAL A 115 -0.411 5.437 7.271 1.00 0.00 O ATOM 1797 CB VAL A 115 0.951 7.272 4.827 1.00 0.00 C ATOM 1798 CG1 VAL A 115 2.050 7.325 3.778 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.340 6.729 4.229 1.00 0.00 C ATOM 0 H VAL A 115 0.916 4.479 5.443 1.00 0.00 H new ATOM 0 HA VAL A 115 2.300 6.864 6.452 1.00 0.00 H new ATOM 0 HB VAL A 115 0.761 8.287 5.175 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.718 7.929 2.933 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.946 7.769 4.212 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.275 6.315 3.436 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.634 7.344 3.379 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.184 5.702 3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.127 6.751 4.982 1.00 0.00 H new ATOM 1809 N ASP A 116 0.153 7.554 7.761 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.863 7.707 8.797 1.00 0.00 C ATOM 1811 C ASP A 116 -2.014 8.576 8.301 1.00 0.00 C ATOM 1812 O ASP A 116 -1.856 9.781 8.105 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.253 8.316 10.064 1.00 0.00 C ATOM 1814 CG ASP A 116 0.732 9.430 9.764 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.414 10.291 8.916 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.819 9.442 10.375 1.00 0.00 O ATOM 0 H ASP A 116 0.731 8.382 7.614 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.253 6.718 9.036 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.052 8.704 10.696 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.251 7.534 10.631 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.171 7.956 8.098 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.349 8.672 7.621 1.00 0.00 C ATOM 1823 C ALA A 117 -4.694 9.842 8.539 1.00 0.00 C ATOM 1824 O ALA A 117 -5.165 10.883 8.083 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.531 7.722 7.512 1.00 0.00 C ATOM 0 H ALA A 117 -3.319 6.959 8.256 1.00 0.00 H new ATOM 0 HA ALA A 117 -4.123 9.075 6.634 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.405 8.268 7.155 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.291 6.922 6.811 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.746 7.294 8.491 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.459 9.660 9.834 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.748 10.696 10.818 1.00 0.00 C ATOM 1833 C ASP A 118 -3.804 11.885 10.659 1.00 0.00 C ATOM 1834 O ASP A 118 -4.238 12.999 10.361 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.635 10.130 12.234 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.252 11.043 13.275 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -4.603 12.044 13.647 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.385 10.759 13.717 1.00 0.00 O ATOM 0 H ASP A 118 -4.069 8.803 10.227 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.768 11.042 10.650 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -5.124 9.157 12.273 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.584 9.968 12.474 1.00 0.00 H new ATOM 1843 N SER A 119 -2.514 11.644 10.862 1.00 0.00 N ATOM 1844 CA SER A 119 -1.511 12.698 10.744 1.00 0.00 C ATOM 1845 C SER A 119 -1.447 13.235 9.319 1.00 0.00 C ATOM 1846 O SER A 119 -1.286 14.436 9.105 1.00 0.00 O ATOM 1847 CB SER A 119 -0.136 12.175 11.170 1.00 0.00 C ATOM 1848 OG SER A 119 -0.245 10.934 11.844 1.00 0.00 O ATOM 0 H SER A 119 -2.137 10.729 11.109 1.00 0.00 H new ATOM 0 HA SER A 119 -1.801 13.515 11.405 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.500 12.060 10.292 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.347 12.904 11.821 1.00 0.00 H new ATOM 0 HG SER A 119 0.648 10.623 12.103 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.578 12.339 8.346 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.534 12.746 6.954 1.00 0.00 C ATOM 1856 C GLY A 120 -0.165 12.549 6.332 1.00 0.00 C ATOM 1857 O GLY A 120 -0.041 11.947 5.265 1.00 0.00 O ATOM 0 H GLY A 120 -1.714 11.339 8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.271 12.176 6.389 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.816 13.796 6.877 1.00 0.00 H new ATOM 1861 N ASP A 121 0.865 13.060 6.998 1.00 0.00 N ATOM 1862 CA ASP A 121 2.233 12.940 6.503 1.00 0.00 C ATOM 1863 C ASP A 121 2.673 11.481 6.458 1.00 0.00 C ATOM 1864 O ASP A 121 2.097 10.626 7.130 1.00 0.00 O ATOM 1865 CB ASP A 121 3.188 13.745 7.386 1.00 0.00 C ATOM 1866 CG ASP A 121 4.316 14.374 6.593 1.00 0.00 C ATOM 1867 OD1 ASP A 121 4.969 13.651 5.812 1.00 0.00 O ATOM 1868 OD2 ASP A 121 4.546 15.592 6.753 1.00 0.00 O ATOM 0 H ASP A 121 0.779 13.561 7.882 1.00 0.00 H new ATOM 0 HA ASP A 121 2.261 13.339 5.489 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.630 14.527 7.902 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.606 13.093 8.153 1.00 0.00 H new ATOM 1873 N VAL A 122 3.699 11.203 5.660 1.00 0.00 N ATOM 1874 CA VAL A 122 4.221 9.850 5.525 1.00 0.00 C ATOM 1875 C VAL A 122 4.873 9.382 6.821 1.00 0.00 C ATOM 1876 O VAL A 122 5.415 10.188 7.579 1.00 0.00 O ATOM 1877 CB VAL A 122 5.253 9.761 4.384 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.614 8.311 4.102 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.726 10.442 3.130 1.00 0.00 C ATOM 0 H VAL A 122 4.186 11.900 5.096 1.00 0.00 H new ATOM 0 HA VAL A 122 3.374 9.204 5.293 1.00 0.00 H new ATOM 0 HB VAL A 122 6.158 10.282 4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.344 8.268 3.293 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.039 7.861 4.999 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.718 7.763 3.811 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.469 10.368 2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.805 9.954 2.811 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.526 11.492 3.343 1.00 0.00 H new ATOM 1889 N VAL A 123 4.822 8.077 7.072 1.00 0.00 N ATOM 1890 CA VAL A 123 5.412 7.511 8.276 1.00 0.00 C ATOM 1891 C VAL A 123 6.739 6.823 7.966 1.00 0.00 C ATOM 1892 O VAL A 123 7.699 6.944 8.725 1.00 0.00 O ATOM 1893 CB VAL A 123 4.459 6.512 8.965 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.034 6.056 10.297 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.083 7.135 9.156 1.00 0.00 C ATOM 0 H VAL A 123 4.378 7.394 6.457 1.00 0.00 H new ATOM 0 HA VAL A 123 5.592 8.341 8.959 1.00 0.00 H new ATOM 0 HB VAL A 123 4.353 5.637 8.324 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.348 5.352 10.768 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.995 5.570 10.131 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.172 6.919 10.948 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.423 6.417 9.643 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.170 8.027 9.776 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.669 7.408 8.185 1.00 0.00 H new ATOM 1905 N THR A 124 6.785 6.107 6.847 1.00 0.00 N ATOM 1906 CA THR A 124 7.996 5.405 6.438 1.00 0.00 C ATOM 1907 C THR A 124 7.937 5.045 4.954 1.00 0.00 C ATOM 1908 O THR A 124 6.862 4.795 4.411 1.00 0.00 O ATOM 1909 CB THR A 124 8.195 4.142 7.286 1.00 0.00 C ATOM 1910 OG1 THR A 124 8.780 3.104 6.519 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.909 3.604 7.877 1.00 0.00 C ATOM 0 H THR A 124 5.998 5.998 6.208 1.00 0.00 H new ATOM 0 HA THR A 124 8.846 6.069 6.597 1.00 0.00 H new ATOM 0 HB THR A 124 8.851 4.448 8.101 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.412 2.241 6.802 1.00 0.00 H new ATOM 0 HG21 THR A 124 7.124 2.711 8.464 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.459 4.361 8.519 1.00 0.00 H new ATOM 0 HG23 THR A 124 6.217 3.352 7.074 1.00 0.00 H new ATOM 1919 N THR A 125 9.099 5.017 4.306 1.00 0.00 N ATOM 1920 CA THR A 125 9.175 4.686 2.887 1.00 0.00 C ATOM 1921 C THR A 125 10.268 3.653 2.625 1.00 0.00 C ATOM 1922 O THR A 125 11.259 3.936 1.951 1.00 0.00 O ATOM 1923 CB THR A 125 9.437 5.946 2.060 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.774 6.384 2.223 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.528 7.101 2.422 1.00 0.00 C ATOM 0 H THR A 125 9.999 5.219 4.741 1.00 0.00 H new ATOM 0 HA THR A 125 8.218 4.258 2.589 1.00 0.00 H new ATOM 0 HB THR A 125 9.238 5.659 1.027 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.385 5.713 1.854 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.768 7.962 1.798 1.00 0.00 H new ATOM 0 HG22 THR A 125 7.490 6.812 2.259 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.671 7.362 3.471 1.00 0.00 H new ATOM 1933 N ARG A 126 10.079 2.454 3.166 1.00 0.00 N ATOM 1934 CA ARG A 126 11.043 1.372 2.995 1.00 0.00 C ATOM 1935 C ARG A 126 10.568 0.113 3.711 1.00 0.00 C ATOM 1936 O ARG A 126 11.324 -0.524 4.444 1.00 0.00 O ATOM 1937 CB ARG A 126 12.417 1.792 3.528 1.00 0.00 C ATOM 1938 CG ARG A 126 12.360 2.497 4.874 1.00 0.00 C ATOM 1939 CD ARG A 126 12.292 1.503 6.021 1.00 0.00 C ATOM 1940 NE ARG A 126 12.931 2.018 7.230 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.248 2.048 7.417 1.00 0.00 C ATOM 1942 NH1 ARG A 126 15.069 1.595 6.477 1.00 0.00 N ATOM 1943 NH2 ARG A 126 14.747 2.533 8.546 1.00 0.00 N ATOM 0 H ARG A 126 9.265 2.206 3.728 1.00 0.00 H new ATOM 0 HA ARG A 126 11.129 1.156 1.930 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.048 0.908 3.617 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.893 2.451 2.802 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.239 3.130 4.992 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.489 3.152 4.906 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.250 1.266 6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.776 0.572 5.724 1.00 0.00 H new ATOM 0 HE ARG A 126 12.332 2.376 7.974 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.691 1.222 5.606 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.078 1.620 6.626 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.121 2.883 9.271 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.757 2.556 8.689 1.00 0.00 H new ATOM 1957 N ALA A 127 9.304 -0.237 3.494 1.00 0.00 N ATOM 1958 CA ALA A 127 8.718 -1.416 4.120 1.00 0.00 C ATOM 1959 C ALA A 127 9.164 -2.701 3.433 1.00 0.00 C ATOM 1960 O ALA A 127 8.982 -3.794 3.970 1.00 0.00 O ATOM 1961 CB ALA A 127 7.198 -1.314 4.114 1.00 0.00 C ATOM 0 H ALA A 127 8.666 0.280 2.889 1.00 0.00 H new ATOM 0 HA ALA A 127 9.071 -1.454 5.150 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.772 -2.200 4.584 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.891 -0.427 4.667 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.842 -1.242 3.086 1.00 0.00 H new ATOM 1967 N ARG A 128 9.747 -2.573 2.246 1.00 0.00 N ATOM 1968 CA ARG A 128 10.213 -3.737 1.503 1.00 0.00 C ATOM 1969 C ARG A 128 11.099 -4.622 2.375 1.00 0.00 C ATOM 1970 O ARG A 128 10.977 -5.843 2.354 1.00 0.00 O ATOM 1971 CB ARG A 128 10.974 -3.308 0.243 1.00 0.00 C ATOM 1972 CG ARG A 128 11.834 -2.067 0.433 1.00 0.00 C ATOM 1973 CD ARG A 128 13.041 -2.080 -0.490 1.00 0.00 C ATOM 1974 NE ARG A 128 12.668 -2.339 -1.878 1.00 0.00 N ATOM 1975 CZ ARG A 128 13.511 -2.242 -2.903 1.00 0.00 C ATOM 1976 NH1 ARG A 128 14.775 -1.894 -2.701 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.089 -2.495 -4.134 1.00 0.00 N ATOM 0 H ARG A 128 9.907 -1.680 1.780 1.00 0.00 H new ATOM 0 HA ARG A 128 9.338 -4.313 1.203 1.00 0.00 H new ATOM 0 HB2 ARG A 128 11.609 -4.131 -0.084 1.00 0.00 H new ATOM 0 HB3 ARG A 128 10.257 -3.122 -0.557 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.237 -1.176 0.240 1.00 0.00 H new ATOM 0 HG3 ARG A 128 12.167 -2.009 1.469 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.556 -1.121 -0.426 1.00 0.00 H new ATOM 0 HD3 ARG A 128 13.744 -2.843 -0.156 1.00 0.00 H new ATOM 0 HE ARG A 128 11.704 -2.610 -2.073 1.00 0.00 H new ATOM 0 HH11 ARG A 128 15.106 -1.699 -1.756 1.00 0.00 H new ATOM 0 HH12 ARG A 128 15.416 -1.821 -3.491 1.00 0.00 H new ATOM 0 HH21 ARG A 128 12.118 -2.764 -4.295 1.00 0.00 H new ATOM 0 HH22 ARG A 128 13.735 -2.421 -4.920 1.00 0.00 H new ATOM 1991 N ALA A 129 11.996 -3.996 3.132 1.00 0.00 N ATOM 1992 CA ALA A 129 12.910 -4.721 4.011 1.00 0.00 C ATOM 1993 C ALA A 129 12.290 -5.029 5.375 1.00 0.00 C ATOM 1994 O ALA A 129 12.222 -6.182 5.797 1.00 0.00 O ATOM 1995 CB ALA A 129 14.184 -3.912 4.200 1.00 0.00 C ATOM 0 H ALA A 129 12.110 -2.983 3.154 1.00 0.00 H new ATOM 0 HA ALA A 129 13.133 -5.675 3.533 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.865 -4.454 4.856 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.661 -3.753 3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.940 -2.948 4.647 1.00 0.00 H new ATOM 2001 N THR A 130 11.878 -3.971 6.066 1.00 0.00 N ATOM 2002 CA THR A 130 11.305 -4.063 7.390 1.00 0.00 C ATOM 2003 C THR A 130 10.169 -5.064 7.489 1.00 0.00 C ATOM 2004 O THR A 130 10.169 -5.920 8.371 1.00 0.00 O ATOM 2005 CB THR A 130 10.839 -2.680 7.811 1.00 0.00 C ATOM 2006 OG1 THR A 130 10.026 -2.106 6.810 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.981 -1.723 8.075 1.00 0.00 C ATOM 0 H THR A 130 11.937 -3.016 5.711 1.00 0.00 H new ATOM 0 HA THR A 130 12.079 -4.432 8.063 1.00 0.00 H new ATOM 0 HB THR A 130 10.285 -2.827 8.738 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.262 -1.656 7.227 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.582 -0.753 8.372 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.608 -2.117 8.874 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.577 -1.609 7.169 1.00 0.00 H new ATOM 2015 N LEU A 131 9.197 -4.958 6.605 1.00 0.00 N ATOM 2016 CA LEU A 131 8.063 -5.864 6.641 1.00 0.00 C ATOM 2017 C LEU A 131 8.513 -7.322 6.652 1.00 0.00 C ATOM 2018 O LEU A 131 7.860 -8.175 7.252 1.00 0.00 O ATOM 2019 CB LEU A 131 7.148 -5.618 5.446 1.00 0.00 C ATOM 2020 CG LEU A 131 5.821 -6.375 5.497 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.654 -5.402 5.547 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.696 -7.313 4.305 1.00 0.00 C ATOM 0 H LEU A 131 9.167 -4.262 5.860 1.00 0.00 H new ATOM 0 HA LEU A 131 7.515 -5.668 7.563 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.940 -4.550 5.377 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.677 -5.899 4.535 1.00 0.00 H new ATOM 0 HG LEU A 131 5.800 -6.977 6.406 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.718 -5.959 5.583 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.739 -4.777 6.436 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.668 -4.772 4.658 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.745 -7.844 4.358 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.739 -6.735 3.382 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.515 -8.033 4.321 1.00 0.00 H new ATOM 2034 N VAL A 132 9.632 -7.606 5.992 1.00 0.00 N ATOM 2035 CA VAL A 132 10.153 -8.958 5.938 1.00 0.00 C ATOM 2036 C VAL A 132 11.104 -9.229 7.096 1.00 0.00 C ATOM 2037 O VAL A 132 11.130 -10.324 7.658 1.00 0.00 O ATOM 2038 CB VAL A 132 10.896 -9.238 4.616 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.415 -10.537 3.990 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.753 -8.086 3.638 1.00 0.00 C ATOM 0 H VAL A 132 10.191 -6.916 5.490 1.00 0.00 H new ATOM 0 HA VAL A 132 9.290 -9.620 6.007 1.00 0.00 H new ATOM 0 HB VAL A 132 11.955 -9.340 4.852 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.953 -10.713 3.059 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.599 -11.362 4.678 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.347 -10.468 3.784 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.290 -8.320 2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.698 -7.929 3.412 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.168 -7.180 4.080 1.00 0.00 H new ATOM 2050 N LYS A 133 11.911 -8.224 7.416 1.00 0.00 N ATOM 2051 CA LYS A 133 12.906 -8.336 8.471 1.00 0.00 C ATOM 2052 C LYS A 133 12.399 -7.766 9.794 1.00 0.00 C ATOM 2053 O LYS A 133 13.182 -7.410 10.674 1.00 0.00 O ATOM 2054 CB LYS A 133 14.182 -7.621 8.025 1.00 0.00 C ATOM 2055 CG LYS A 133 14.586 -7.946 6.594 1.00 0.00 C ATOM 2056 CD LYS A 133 15.137 -9.358 6.478 1.00 0.00 C ATOM 2057 CE LYS A 133 15.851 -9.570 5.153 1.00 0.00 C ATOM 2058 NZ LYS A 133 16.956 -8.592 4.954 1.00 0.00 N ATOM 0 H LYS A 133 11.893 -7.315 6.954 1.00 0.00 H new ATOM 0 HA LYS A 133 13.115 -9.392 8.644 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.039 -6.545 8.119 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.997 -7.894 8.696 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.723 -7.836 5.937 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.337 -7.232 6.256 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.828 -9.549 7.299 1.00 0.00 H new ATOM 0 HD3 LYS A 133 14.323 -10.076 6.573 1.00 0.00 H new ATOM 0 HE2 LYS A 133 16.252 -10.583 5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 133 15.135 -9.479 4.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 17.628 -8.965 4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.565 -7.691 4.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 17.449 -8.436 5.857 1.00 0.00 H new ATOM 2072 N ASP A 134 11.081 -7.697 9.926 1.00 0.00 N ATOM 2073 CA ASP A 134 10.444 -7.189 11.138 1.00 0.00 C ATOM 2074 C ASP A 134 9.104 -7.887 11.359 1.00 0.00 C ATOM 2075 O ASP A 134 8.043 -7.287 11.183 1.00 0.00 O ATOM 2076 CB ASP A 134 10.242 -5.674 11.047 1.00 0.00 C ATOM 2077 CG ASP A 134 10.373 -4.992 12.394 1.00 0.00 C ATOM 2078 OD1 ASP A 134 11.168 -5.473 13.229 1.00 0.00 O ATOM 2079 OD2 ASP A 134 9.682 -3.975 12.614 1.00 0.00 O ATOM 0 H ASP A 134 10.425 -7.989 9.202 1.00 0.00 H new ATOM 0 HA ASP A 134 11.097 -7.399 11.985 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.974 -5.253 10.357 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.256 -5.466 10.632 1.00 0.00 H new ATOM 2084 N PRO A 135 9.140 -9.177 11.738 1.00 0.00 N ATOM 2085 CA PRO A 135 7.929 -9.969 11.969 1.00 0.00 C ATOM 2086 C PRO A 135 7.283 -9.705 13.327 1.00 0.00 C ATOM 2087 O PRO A 135 6.343 -10.400 13.714 1.00 0.00 O ATOM 2088 CB PRO A 135 8.445 -11.404 11.897 1.00 0.00 C ATOM 2089 CG PRO A 135 9.852 -11.320 12.382 1.00 0.00 C ATOM 2090 CD PRO A 135 10.367 -9.970 11.954 1.00 0.00 C ATOM 0 HA PRO A 135 7.148 -9.730 11.247 1.00 0.00 H new ATOM 0 HB2 PRO A 135 7.850 -12.071 12.520 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.399 -11.792 10.879 1.00 0.00 H new ATOM 0 HG2 PRO A 135 9.897 -11.427 13.466 1.00 0.00 H new ATOM 0 HG3 PRO A 135 10.458 -12.120 11.957 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.002 -9.523 12.719 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.964 -10.039 11.044 1.00 0.00 H new ATOM 2098 N GLU A 136 7.777 -8.703 14.051 1.00 0.00 N ATOM 2099 CA GLU A 136 7.229 -8.369 15.350 1.00 0.00 C ATOM 2100 C GLU A 136 6.285 -7.177 15.240 1.00 0.00 C ATOM 2101 O GLU A 136 5.443 -6.957 16.109 1.00 0.00 O ATOM 2102 CB GLU A 136 8.367 -8.070 16.324 1.00 0.00 C ATOM 2103 CG GLU A 136 9.076 -6.754 16.055 1.00 0.00 C ATOM 2104 CD GLU A 136 10.581 -6.859 16.210 1.00 0.00 C ATOM 2105 OE1 GLU A 136 11.142 -7.915 15.854 1.00 0.00 O ATOM 2106 OE2 GLU A 136 11.198 -5.883 16.688 1.00 0.00 O ATOM 0 H GLU A 136 8.555 -8.113 13.755 1.00 0.00 H new ATOM 0 HA GLU A 136 6.657 -9.217 15.726 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.970 -8.057 17.339 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.095 -8.880 16.277 1.00 0.00 H new ATOM 0 HG2 GLU A 136 8.841 -6.419 15.045 1.00 0.00 H new ATOM 0 HG3 GLU A 136 8.696 -5.995 16.739 1.00 0.00 H new ATOM 2113 N GLY A 137 6.433 -6.408 14.160 1.00 0.00 N ATOM 2114 CA GLY A 137 5.586 -5.249 13.956 1.00 0.00 C ATOM 2115 C GLY A 137 5.591 -4.321 15.150 1.00 0.00 C ATOM 2116 O GLY A 137 4.636 -3.579 15.374 1.00 0.00 O ATOM 0 H GLY A 137 7.123 -6.569 13.427 1.00 0.00 H new ATOM 0 HA2 GLY A 137 5.924 -4.705 13.074 1.00 0.00 H new ATOM 0 HA3 GLY A 137 4.566 -5.577 13.757 1.00 0.00 H new ATOM 2120 N GLU A 138 6.670 -4.369 15.923 1.00 0.00 N ATOM 2121 CA GLU A 138 6.792 -3.527 17.109 1.00 0.00 C ATOM 2122 C GLU A 138 7.314 -2.133 16.758 1.00 0.00 C ATOM 2123 O GLU A 138 7.243 -1.214 17.574 1.00 0.00 O ATOM 2124 CB GLU A 138 7.699 -4.195 18.154 1.00 0.00 C ATOM 2125 CG GLU A 138 9.189 -3.969 17.932 1.00 0.00 C ATOM 2126 CD GLU A 138 9.713 -2.750 18.665 1.00 0.00 C ATOM 2127 OE1 GLU A 138 8.894 -2.003 19.242 1.00 0.00 O ATOM 2128 OE2 GLU A 138 10.945 -2.540 18.662 1.00 0.00 O ATOM 0 H GLU A 138 7.470 -4.979 15.752 1.00 0.00 H new ATOM 0 HA GLU A 138 5.795 -3.409 17.534 1.00 0.00 H new ATOM 0 HB2 GLU A 138 7.431 -3.821 19.142 1.00 0.00 H new ATOM 0 HB3 GLU A 138 7.503 -5.267 18.155 1.00 0.00 H new ATOM 0 HG2 GLU A 138 9.739 -4.850 18.262 1.00 0.00 H new ATOM 0 HG3 GLU A 138 9.380 -3.856 16.865 1.00 0.00 H new ATOM 2135 N GLN A 139 7.849 -1.979 15.548 1.00 0.00 N ATOM 2136 CA GLN A 139 8.390 -0.694 15.114 1.00 0.00 C ATOM 2137 C GLN A 139 7.790 -0.234 13.792 1.00 0.00 C ATOM 2138 O GLN A 139 8.238 0.761 13.236 1.00 0.00 O ATOM 2139 CB GLN A 139 9.907 -0.798 14.933 1.00 0.00 C ATOM 2140 CG GLN A 139 10.721 -0.434 16.156 1.00 0.00 C ATOM 2141 CD GLN A 139 10.238 0.829 16.843 1.00 0.00 C ATOM 2142 OE1 GLN A 139 9.949 1.833 16.191 1.00 0.00 O ATOM 2143 NE2 GLN A 139 10.149 0.787 18.168 1.00 0.00 N ATOM 0 H GLN A 139 7.919 -2.724 14.855 1.00 0.00 H new ATOM 0 HA GLN A 139 8.136 0.031 15.887 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.154 -1.818 14.640 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.205 -0.149 14.110 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.688 -1.261 16.865 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.764 -0.305 15.865 1.00 0.00 H new ATOM 0 HE21 GLN A 139 10.399 -0.066 18.669 1.00 0.00 H new ATOM 0 HE22 GLN A 139 9.831 1.607 18.684 1.00 0.00 H new ATOM 2152 N PHE A 140 6.811 -0.976 13.273 1.00 0.00 N ATOM 2153 CA PHE A 140 6.192 -0.660 11.980 1.00 0.00 C ATOM 2154 C PHE A 140 6.353 0.797 11.551 1.00 0.00 C ATOM 2155 O PHE A 140 6.835 1.039 10.444 1.00 0.00 O ATOM 2156 CB PHE A 140 4.746 -1.143 11.909 1.00 0.00 C ATOM 2157 CG PHE A 140 3.848 -0.674 13.021 1.00 0.00 C ATOM 2158 CD1 PHE A 140 4.122 -0.986 14.344 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.719 0.079 12.736 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.288 -0.554 15.359 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.884 0.514 13.747 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.169 0.196 15.060 1.00 0.00 C ATOM 0 H PHE A 140 6.427 -1.804 13.728 1.00 0.00 H new ATOM 0 HA PHE A 140 6.755 -1.226 11.238 1.00 0.00 H new ATOM 0 HB2 PHE A 140 4.319 -0.818 10.960 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.746 -2.233 11.901 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.996 -1.573 14.584 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.490 0.329 11.711 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.512 -0.804 16.386 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.009 1.102 13.511 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.517 0.534 15.852 1.00 0.00 H new ATOM 2172 N PRO A 141 6.033 1.805 12.385 1.00 0.00 N ATOM 2173 CA PRO A 141 6.258 3.193 11.985 1.00 0.00 C ATOM 2174 C PRO A 141 7.753 3.509 12.032 1.00 0.00 C ATOM 2175 O PRO A 141 8.162 4.607 12.405 1.00 0.00 O ATOM 2176 CB PRO A 141 5.501 3.990 13.037 1.00 0.00 C ATOM 2177 CG PRO A 141 5.561 3.132 14.254 1.00 0.00 C ATOM 2178 CD PRO A 141 5.497 1.709 13.759 1.00 0.00 C ATOM 0 HA PRO A 141 5.926 3.416 10.971 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.964 4.962 13.211 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.472 4.177 12.731 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.480 3.310 14.813 1.00 0.00 H new ATOM 0 HG3 PRO A 141 4.731 3.349 14.927 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.094 1.040 14.378 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.477 1.325 13.767 1.00 0.00 H new ATOM 2186 N TRP A 142 8.551 2.496 11.675 1.00 0.00 N ATOM 2187 CA TRP A 142 10.016 2.562 11.677 1.00 0.00 C ATOM 2188 C TRP A 142 10.553 3.980 11.483 1.00 0.00 C ATOM 2189 O TRP A 142 11.052 4.596 12.425 1.00 0.00 O ATOM 2190 CB TRP A 142 10.569 1.623 10.596 1.00 0.00 C ATOM 2191 CG TRP A 142 9.758 0.368 10.449 1.00 0.00 C ATOM 2192 CD1 TRP A 142 9.525 -0.586 11.404 1.00 0.00 C ATOM 2193 CD2 TRP A 142 9.052 -0.053 9.279 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.691 -1.560 10.898 1.00 0.00 N ATOM 2195 CE2 TRP A 142 8.401 -1.260 9.593 1.00 0.00 C ATOM 2196 CE3 TRP A 142 8.906 0.477 7.997 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 7.614 -1.943 8.670 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 8.126 -0.201 7.080 1.00 0.00 C ATOM 2199 CH2 TRP A 142 7.487 -1.401 7.422 1.00 0.00 C ATOM 0 H TRP A 142 8.190 1.592 11.371 1.00 0.00 H new ATOM 0 HA TRP A 142 10.356 2.242 12.662 1.00 0.00 H new ATOM 0 HB2 TRP A 142 10.593 2.149 9.642 1.00 0.00 H new ATOM 0 HB3 TRP A 142 11.598 1.359 10.841 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.934 -0.576 12.404 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.346 -2.371 11.411 1.00 0.00 H new ATOM 0 HE3 TRP A 142 9.394 1.401 7.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 7.121 -2.868 8.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 8.007 0.200 6.084 1.00 0.00 H new ATOM 0 HH2 TRP A 142 6.882 -1.907 6.684 1.00 0.00 H new ATOM 2210 N LYS A 143 10.458 4.486 10.264 1.00 0.00 N ATOM 2211 CA LYS A 143 10.949 5.827 9.957 1.00 0.00 C ATOM 2212 C LYS A 143 10.253 6.879 10.818 1.00 0.00 C ATOM 2213 O LYS A 143 9.410 6.553 11.652 1.00 0.00 O ATOM 2214 CB LYS A 143 10.744 6.144 8.476 1.00 0.00 C ATOM 2215 CG LYS A 143 11.418 5.150 7.545 1.00 0.00 C ATOM 2216 CD LYS A 143 11.884 5.816 6.261 1.00 0.00 C ATOM 2217 CE LYS A 143 13.152 6.626 6.480 1.00 0.00 C ATOM 2218 NZ LYS A 143 13.035 8.003 5.924 1.00 0.00 N ATOM 0 H LYS A 143 10.047 3.993 9.471 1.00 0.00 H new ATOM 0 HA LYS A 143 12.015 5.852 10.182 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.676 6.164 8.261 1.00 0.00 H new ATOM 0 HB3 LYS A 143 11.129 7.142 8.269 1.00 0.00 H new ATOM 0 HG2 LYS A 143 12.270 4.697 8.051 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.723 4.344 7.307 1.00 0.00 H new ATOM 0 HD2 LYS A 143 12.064 5.056 5.501 1.00 0.00 H new ATOM 0 HD3 LYS A 143 11.097 6.467 5.881 1.00 0.00 H new ATOM 0 HE2 LYS A 143 13.367 6.683 7.547 1.00 0.00 H new ATOM 0 HE3 LYS A 143 13.994 6.116 6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 13.920 8.522 6.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 12.855 7.950 4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 12.248 8.499 6.389 1.00 0.00 H new