USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 792 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 29 CYS SG : rot 130:sc= 0.569 USER MOD Set 1.2: A 32 CYS SG : rot 75:sc= 0.311 USER MOD Set 2.1: A 7 THR OG1 : rot 108:sc= 1.24 USER MOD Set 2.2: A 9 GLN : amide:sc= 0.796 K(o=2,f=-3.3!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -88:sc= 1.21 USER MOD Single : A 16 SER OG : rot 103:sc= 1.26 USER MOD Single : A 33 LYS NZ :NH3+ -167:sc= 0.878 (180deg=0.756) USER MOD Single : A 34 MET CE :methyl 177:sc= 0 (180deg=-0.0107) USER MOD Single : A 44 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 173:sc= 3.64 (180deg=3.62) USER MOD Single : A 54 LYS NZ :NH3+ -176:sc=-0.00528 (180deg=-0.0394) USER MOD Single : A 60 ASN : amide:sc= 0.599 K(o=0.6,f=-8.3!) USER MOD Single : A 61 GLN : amide:sc= -1.11! C(o=-1.1!,f=-2.7!) USER MOD Single : A 63 THR OG1 : rot -60:sc= 0.754 USER MOD Single : A 66 LYS NZ :NH3+ -160:sc= 1.21 (180deg=0.8) USER MOD Single : A 67 TYR OH : rot -141:sc= 0.434 USER MOD Single : A 70 MET CE :methyl 162:sc= 0 (180deg=-0.024) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 112:sc= 1.3 USER MOD Single : A 79 LYS NZ :NH3+ -157:sc= 2.01 (180deg=1.29) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 1.2 (180deg=1.2) USER MOD Single : A 93 LYS NZ :NH3+ 163:sc= 2.42 (180deg=2.26) USER MOD Single : A 97 GLN : amide:sc= 0.0219 K(o=0.022,f=-0.68) USER MOD Single : A 101 ASN : amide:sc= -0.0746 X(o=-0.075,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HE2:sc= 0 K(o=0,f=-0.97) USER MOD ----------------------------------------------------------------- ATOM 30 N ILE A 3 -1.873 -3.401 -2.874 1.00 0.00 N ATOM 31 CA ILE A 3 -2.869 -4.302 -3.425 1.00 0.00 C ATOM 32 C ILE A 3 -3.119 -5.394 -2.370 1.00 0.00 C ATOM 33 O ILE A 3 -2.196 -5.845 -1.685 1.00 0.00 O ATOM 34 CB ILE A 3 -2.361 -4.851 -4.783 1.00 0.00 C ATOM 35 CG1 ILE A 3 -2.509 -3.781 -5.887 1.00 0.00 C ATOM 36 CG2 ILE A 3 -3.124 -6.109 -5.253 1.00 0.00 C ATOM 37 CD1 ILE A 3 -1.545 -3.946 -7.061 1.00 0.00 C ATOM 0 HA ILE A 3 -3.818 -3.808 -3.636 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.316 -5.116 -4.620 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -3.531 -3.806 -6.266 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -2.358 -2.797 -5.444 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -2.721 -6.443 -6.209 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.009 -6.902 -4.514 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.181 -5.871 -5.369 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.718 -3.153 -7.788 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.518 -3.889 -6.700 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.710 -4.914 -7.534 1.00 0.00 H new ATOM 49 N VAL A 4 -4.369 -5.831 -2.268 1.00 0.00 N ATOM 50 CA VAL A 4 -4.907 -6.804 -1.325 1.00 0.00 C ATOM 51 C VAL A 4 -5.904 -7.659 -2.132 1.00 0.00 C ATOM 52 O VAL A 4 -6.270 -7.299 -3.253 1.00 0.00 O ATOM 53 CB VAL A 4 -5.563 -6.049 -0.132 1.00 0.00 C ATOM 54 CG1 VAL A 4 -6.019 -6.983 1.002 1.00 0.00 C ATOM 55 CG2 VAL A 4 -4.620 -5.009 0.504 1.00 0.00 C ATOM 0 H VAL A 4 -5.093 -5.484 -2.897 1.00 0.00 H new ATOM 0 HA VAL A 4 -4.148 -7.453 -0.887 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.427 -5.560 -0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.467 -6.393 1.801 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -6.754 -7.690 0.617 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.160 -7.529 1.392 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.129 -4.513 1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.726 -5.509 0.876 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.337 -4.269 -0.244 1.00 0.00 H new ATOM 65 N LYS A 5 -6.366 -8.788 -1.595 1.00 0.00 N ATOM 66 CA LYS A 5 -7.417 -9.610 -2.199 1.00 0.00 C ATOM 67 C LYS A 5 -8.506 -9.794 -1.153 1.00 0.00 C ATOM 68 O LYS A 5 -8.188 -9.915 0.032 1.00 0.00 O ATOM 69 CB LYS A 5 -6.853 -10.975 -2.631 1.00 0.00 C ATOM 70 CG LYS A 5 -5.944 -10.888 -3.871 1.00 0.00 C ATOM 71 CD LYS A 5 -4.576 -11.561 -3.690 1.00 0.00 C ATOM 72 CE LYS A 5 -3.698 -10.781 -2.699 1.00 0.00 C ATOM 73 NZ LYS A 5 -2.356 -11.397 -2.535 1.00 0.00 N ATOM 0 H LYS A 5 -6.016 -9.164 -0.714 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.817 -9.125 -3.089 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.289 -11.407 -1.804 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.680 -11.653 -2.841 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -6.455 -11.348 -4.717 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.791 -9.839 -4.124 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.715 -12.581 -3.332 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.070 -11.627 -4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.585 -9.754 -3.046 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.197 -10.737 -1.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.798 -10.838 -1.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.461 -12.368 -2.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.868 -11.416 -3.453 1.00 0.00 H new ATOM 87 N ALA A 6 -9.768 -9.828 -1.578 1.00 0.00 N ATOM 88 CA ALA A 6 -10.896 -10.077 -0.690 1.00 0.00 C ATOM 89 C ALA A 6 -11.976 -10.884 -1.406 1.00 0.00 C ATOM 90 O ALA A 6 -11.936 -11.057 -2.626 1.00 0.00 O ATOM 91 CB ALA A 6 -11.467 -8.748 -0.177 1.00 0.00 C ATOM 0 H ALA A 6 -10.035 -9.683 -2.552 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.546 -10.659 0.163 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.310 -8.946 0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -10.695 -8.207 0.370 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -11.803 -8.146 -1.021 1.00 0.00 H new ATOM 97 N THR A 7 -12.961 -11.347 -0.638 1.00 0.00 N ATOM 98 CA THR A 7 -14.126 -12.070 -1.120 1.00 0.00 C ATOM 99 C THR A 7 -15.351 -11.492 -0.403 1.00 0.00 C ATOM 100 O THR A 7 -15.180 -10.690 0.518 1.00 0.00 O ATOM 101 CB THR A 7 -13.935 -13.582 -0.868 1.00 0.00 C ATOM 102 OG1 THR A 7 -13.729 -13.852 0.504 1.00 0.00 O ATOM 103 CG2 THR A 7 -12.742 -14.177 -1.621 1.00 0.00 C ATOM 0 H THR A 7 -12.965 -11.222 0.374 1.00 0.00 H new ATOM 0 HA THR A 7 -14.267 -11.954 -2.195 1.00 0.00 H new ATOM 0 HB THR A 7 -14.855 -14.040 -1.231 1.00 0.00 H new ATOM 0 HG1 THR A 7 -14.525 -14.286 0.875 1.00 0.00 H new ATOM 0 HG21 THR A 7 -12.666 -15.241 -1.399 1.00 0.00 H new ATOM 0 HG22 THR A 7 -12.883 -14.039 -2.693 1.00 0.00 H new ATOM 0 HG23 THR A 7 -11.827 -13.675 -1.308 1.00 0.00 H new ATOM 111 N ASP A 8 -16.575 -11.889 -0.761 1.00 0.00 N ATOM 112 CA ASP A 8 -17.820 -11.358 -0.182 1.00 0.00 C ATOM 113 C ASP A 8 -17.813 -11.343 1.351 1.00 0.00 C ATOM 114 O ASP A 8 -18.397 -10.465 1.985 1.00 0.00 O ATOM 115 CB ASP A 8 -19.028 -12.195 -0.624 1.00 0.00 C ATOM 116 CG ASP A 8 -20.320 -11.418 -0.328 1.00 0.00 C ATOM 117 OD1 ASP A 8 -20.474 -10.301 -0.877 1.00 0.00 O ATOM 118 OD2 ASP A 8 -21.170 -11.920 0.443 1.00 0.00 O ATOM 0 H ASP A 8 -16.735 -12.601 -1.474 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.892 -10.333 -0.546 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -18.960 -12.418 -1.689 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -19.036 -13.150 -0.098 1.00 0.00 H new ATOM 123 N GLN A 9 -17.123 -12.327 1.932 1.00 0.00 N ATOM 124 CA GLN A 9 -16.973 -12.548 3.358 1.00 0.00 C ATOM 125 C GLN A 9 -16.263 -11.383 4.070 1.00 0.00 C ATOM 126 O GLN A 9 -16.583 -11.118 5.232 1.00 0.00 O ATOM 127 CB GLN A 9 -16.208 -13.868 3.577 1.00 0.00 C ATOM 128 CG GLN A 9 -16.975 -15.133 3.124 1.00 0.00 C ATOM 129 CD GLN A 9 -17.037 -15.342 1.605 1.00 0.00 C ATOM 130 OE1 GLN A 9 -16.197 -14.842 0.864 1.00 0.00 O ATOM 131 NE2 GLN A 9 -18.027 -16.056 1.091 1.00 0.00 N ATOM 0 H GLN A 9 -16.628 -13.028 1.381 1.00 0.00 H new ATOM 0 HA GLN A 9 -17.968 -12.610 3.798 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -15.262 -13.819 3.038 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -15.968 -13.963 4.636 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.506 -16.006 3.577 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -17.993 -15.081 3.511 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -18.727 -16.473 1.705 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -18.089 -16.189 0.082 1.00 0.00 H new ATOM 140 N SER A 10 -15.340 -10.681 3.398 1.00 0.00 N ATOM 141 CA SER A 10 -14.485 -9.669 4.035 1.00 0.00 C ATOM 142 C SER A 10 -14.254 -8.411 3.193 1.00 0.00 C ATOM 143 O SER A 10 -13.661 -7.451 3.687 1.00 0.00 O ATOM 144 CB SER A 10 -13.139 -10.304 4.423 1.00 0.00 C ATOM 145 OG SER A 10 -13.309 -11.511 5.155 1.00 0.00 O ATOM 0 H SER A 10 -15.165 -10.798 2.400 1.00 0.00 H new ATOM 0 HA SER A 10 -15.023 -9.330 4.920 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.560 -10.506 3.522 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.563 -9.596 5.020 1.00 0.00 H new ATOM 0 HG SER A 10 -12.431 -11.883 5.381 1.00 0.00 H new ATOM 151 N PHE A 11 -14.752 -8.364 1.955 1.00 0.00 N ATOM 152 CA PHE A 11 -14.661 -7.204 1.076 1.00 0.00 C ATOM 153 C PHE A 11 -15.204 -5.951 1.764 1.00 0.00 C ATOM 154 O PHE A 11 -14.633 -4.868 1.619 1.00 0.00 O ATOM 155 CB PHE A 11 -15.428 -7.514 -0.217 1.00 0.00 C ATOM 156 CG PHE A 11 -15.422 -6.396 -1.238 1.00 0.00 C ATOM 157 CD1 PHE A 11 -14.397 -6.335 -2.200 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.435 -5.418 -1.230 1.00 0.00 C ATOM 159 CE1 PHE A 11 -14.391 -5.310 -3.157 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.420 -4.385 -2.183 1.00 0.00 C ATOM 161 CZ PHE A 11 -15.407 -4.338 -3.154 1.00 0.00 C ATOM 0 H PHE A 11 -15.240 -9.152 1.529 1.00 0.00 H new ATOM 0 HA PHE A 11 -13.617 -7.001 0.837 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -14.999 -8.407 -0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.461 -7.751 0.037 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -13.614 -7.079 -2.201 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -17.223 -5.462 -0.492 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -13.605 -5.267 -3.897 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -17.189 -3.626 -2.168 1.00 0.00 H new ATOM 0 HZ PHE A 11 -15.408 -3.556 -3.898 1.00 0.00 H new ATOM 171 N SER A 12 -16.272 -6.093 2.551 1.00 0.00 N ATOM 172 CA SER A 12 -16.900 -4.969 3.225 1.00 0.00 C ATOM 173 C SER A 12 -15.982 -4.381 4.296 1.00 0.00 C ATOM 174 O SER A 12 -15.897 -3.162 4.434 1.00 0.00 O ATOM 175 CB SER A 12 -18.243 -5.415 3.818 1.00 0.00 C ATOM 176 OG SER A 12 -18.997 -6.149 2.859 1.00 0.00 O ATOM 0 H SER A 12 -16.721 -6.990 2.735 1.00 0.00 H new ATOM 0 HA SER A 12 -17.084 -4.177 2.498 1.00 0.00 H new ATOM 0 HB2 SER A 12 -18.070 -6.031 4.701 1.00 0.00 H new ATOM 0 HB3 SER A 12 -18.810 -4.543 4.144 1.00 0.00 H new ATOM 0 HG SER A 12 -19.849 -6.426 3.256 1.00 0.00 H new ATOM 182 N ALA A 13 -15.254 -5.230 5.028 1.00 0.00 N ATOM 183 CA ALA A 13 -14.280 -4.780 6.007 1.00 0.00 C ATOM 184 C ALA A 13 -13.117 -4.090 5.292 1.00 0.00 C ATOM 185 O ALA A 13 -12.695 -3.009 5.698 1.00 0.00 O ATOM 186 CB ALA A 13 -13.785 -5.964 6.845 1.00 0.00 C ATOM 0 H ALA A 13 -15.329 -6.245 4.953 1.00 0.00 H new ATOM 0 HA ALA A 13 -14.748 -4.064 6.682 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -13.055 -5.613 7.575 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.628 -6.420 7.365 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.319 -6.702 6.192 1.00 0.00 H new ATOM 192 N GLU A 14 -12.619 -4.692 4.209 1.00 0.00 N ATOM 193 CA GLU A 14 -11.458 -4.183 3.491 1.00 0.00 C ATOM 194 C GLU A 14 -11.744 -2.819 2.866 1.00 0.00 C ATOM 195 O GLU A 14 -10.870 -1.952 2.883 1.00 0.00 O ATOM 196 CB GLU A 14 -11.004 -5.186 2.418 1.00 0.00 C ATOM 197 CG GLU A 14 -10.321 -6.418 3.032 1.00 0.00 C ATOM 198 CD GLU A 14 -9.001 -6.113 3.767 1.00 0.00 C ATOM 199 OE1 GLU A 14 -8.379 -5.055 3.512 1.00 0.00 O ATOM 200 OE2 GLU A 14 -8.579 -6.938 4.609 1.00 0.00 O ATOM 0 H GLU A 14 -13.012 -5.544 3.809 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.650 -4.055 4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.866 -5.504 1.832 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.315 -4.695 1.731 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.011 -6.891 3.731 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.124 -7.141 2.241 1.00 0.00 H new ATOM 207 N THR A 15 -12.957 -2.597 2.362 1.00 0.00 N ATOM 208 CA THR A 15 -13.340 -1.332 1.753 1.00 0.00 C ATOM 209 C THR A 15 -13.638 -0.238 2.790 1.00 0.00 C ATOM 210 O THR A 15 -13.899 0.903 2.404 1.00 0.00 O ATOM 211 CB THR A 15 -14.483 -1.558 0.747 1.00 0.00 C ATOM 212 OG1 THR A 15 -15.528 -2.344 1.281 1.00 0.00 O ATOM 213 CG2 THR A 15 -13.954 -2.256 -0.511 1.00 0.00 C ATOM 0 H THR A 15 -13.702 -3.294 2.366 1.00 0.00 H new ATOM 0 HA THR A 15 -12.486 -0.946 1.195 1.00 0.00 H new ATOM 0 HB THR A 15 -14.880 -0.572 0.507 1.00 0.00 H new ATOM 0 HG1 THR A 15 -15.335 -3.293 1.128 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.773 -2.409 -1.214 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.188 -1.636 -0.976 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.524 -3.220 -0.239 1.00 0.00 H new ATOM 221 N SER A 16 -13.552 -0.539 4.093 1.00 0.00 N ATOM 222 CA SER A 16 -13.970 0.349 5.176 1.00 0.00 C ATOM 223 C SER A 16 -12.773 0.915 5.946 1.00 0.00 C ATOM 224 O SER A 16 -12.859 1.141 7.155 1.00 0.00 O ATOM 225 CB SER A 16 -14.981 -0.369 6.085 1.00 0.00 C ATOM 226 OG SER A 16 -16.148 -0.721 5.371 1.00 0.00 O ATOM 0 H SER A 16 -13.181 -1.429 4.426 1.00 0.00 H new ATOM 0 HA SER A 16 -14.473 1.214 4.743 1.00 0.00 H new ATOM 0 HB2 SER A 16 -14.524 -1.265 6.505 1.00 0.00 H new ATOM 0 HB3 SER A 16 -15.245 0.277 6.922 1.00 0.00 H new ATOM 0 HG SER A 16 -16.125 -1.677 5.157 1.00 0.00 H new ATOM 232 N GLU A 17 -11.651 1.148 5.255 1.00 0.00 N ATOM 233 CA GLU A 17 -10.421 1.642 5.883 1.00 0.00 C ATOM 234 C GLU A 17 -9.773 2.815 5.132 1.00 0.00 C ATOM 235 O GLU A 17 -8.728 3.306 5.565 1.00 0.00 O ATOM 236 CB GLU A 17 -9.413 0.491 6.051 1.00 0.00 C ATOM 237 CG GLU A 17 -9.938 -0.671 6.905 1.00 0.00 C ATOM 238 CD GLU A 17 -8.825 -1.678 7.239 1.00 0.00 C ATOM 239 OE1 GLU A 17 -8.106 -2.115 6.311 1.00 0.00 O ATOM 240 OE2 GLU A 17 -8.667 -2.045 8.426 1.00 0.00 O ATOM 0 H GLU A 17 -11.570 1.000 4.249 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.709 2.030 6.860 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.141 0.112 5.066 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.502 0.881 6.505 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.365 -0.280 7.829 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -10.742 -1.180 6.373 1.00 0.00 H new ATOM 247 N GLY A 18 -10.354 3.285 4.025 1.00 0.00 N ATOM 248 CA GLY A 18 -9.740 4.333 3.218 1.00 0.00 C ATOM 249 C GLY A 18 -10.411 4.454 1.864 1.00 0.00 C ATOM 250 O GLY A 18 -11.515 3.940 1.683 1.00 0.00 O ATOM 0 H GLY A 18 -11.251 2.953 3.670 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.806 5.285 3.745 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.680 4.116 3.082 1.00 0.00 H new ATOM 254 N VAL A 19 -9.769 5.157 0.929 1.00 0.00 N ATOM 255 CA VAL A 19 -10.162 5.112 -0.475 1.00 0.00 C ATOM 256 C VAL A 19 -9.685 3.745 -0.965 1.00 0.00 C ATOM 257 O VAL A 19 -8.515 3.390 -0.777 1.00 0.00 O ATOM 258 CB VAL A 19 -9.527 6.274 -1.270 1.00 0.00 C ATOM 259 CG1 VAL A 19 -9.852 6.192 -2.770 1.00 0.00 C ATOM 260 CG2 VAL A 19 -10.038 7.628 -0.756 1.00 0.00 C ATOM 0 H VAL A 19 -8.973 5.765 1.123 1.00 0.00 H new ATOM 0 HA VAL A 19 -11.237 5.232 -0.613 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.450 6.188 -1.127 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.385 7.029 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.470 5.255 -3.174 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -10.932 6.234 -2.911 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -9.578 8.432 -1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.121 7.675 -0.869 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -9.778 7.739 0.297 1.00 0.00 H new ATOM 270 N VAL A 20 -10.573 2.970 -1.577 1.00 0.00 N ATOM 271 CA VAL A 20 -10.290 1.611 -1.991 1.00 0.00 C ATOM 272 C VAL A 20 -10.800 1.455 -3.418 1.00 0.00 C ATOM 273 O VAL A 20 -11.975 1.693 -3.695 1.00 0.00 O ATOM 274 CB VAL A 20 -10.909 0.595 -1.004 1.00 0.00 C ATOM 275 CG1 VAL A 20 -10.492 -0.830 -1.385 1.00 0.00 C ATOM 276 CG2 VAL A 20 -10.488 0.877 0.451 1.00 0.00 C ATOM 0 H VAL A 20 -11.520 3.277 -1.800 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.220 1.406 -1.977 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.992 0.697 -1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.933 -1.538 -0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.840 -1.054 -2.393 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.406 -0.913 -1.349 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.945 0.140 1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.403 0.815 0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.818 1.875 0.738 1.00 0.00 H new ATOM 286 N LEU A 21 -9.905 1.076 -4.327 1.00 0.00 N ATOM 287 CA LEU A 21 -10.272 0.657 -5.669 1.00 0.00 C ATOM 288 C LEU A 21 -10.547 -0.841 -5.577 1.00 0.00 C ATOM 289 O LEU A 21 -9.799 -1.561 -4.915 1.00 0.00 O ATOM 290 CB LEU A 21 -9.102 0.931 -6.628 1.00 0.00 C ATOM 291 CG LEU A 21 -9.476 0.757 -8.113 1.00 0.00 C ATOM 292 CD1 LEU A 21 -10.339 1.923 -8.608 1.00 0.00 C ATOM 293 CD2 LEU A 21 -8.205 0.707 -8.959 1.00 0.00 C ATOM 0 H LEU A 21 -8.901 1.052 -4.148 1.00 0.00 H new ATOM 0 HA LEU A 21 -11.142 1.195 -6.045 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.741 1.947 -6.468 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.279 0.259 -6.387 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.040 -0.171 -8.209 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -10.587 1.772 -9.659 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.257 1.971 -8.022 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -9.788 2.857 -8.496 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -8.471 0.584 -10.009 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.647 1.635 -8.833 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.589 -0.133 -8.640 1.00 0.00 H new ATOM 305 N ALA A 22 -11.581 -1.330 -6.249 1.00 0.00 N ATOM 306 CA ALA A 22 -11.958 -2.732 -6.226 1.00 0.00 C ATOM 307 C ALA A 22 -12.008 -3.219 -7.663 1.00 0.00 C ATOM 308 O ALA A 22 -12.834 -2.758 -8.450 1.00 0.00 O ATOM 309 CB ALA A 22 -13.301 -2.887 -5.524 1.00 0.00 C ATOM 0 H ALA A 22 -12.188 -0.754 -6.832 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.235 -3.331 -5.672 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.583 -3.940 -5.507 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.222 -2.516 -4.502 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.060 -2.316 -6.060 1.00 0.00 H new ATOM 315 N ASP A 23 -11.093 -4.126 -7.993 1.00 0.00 N ATOM 316 CA ASP A 23 -10.924 -4.706 -9.312 1.00 0.00 C ATOM 317 C ASP A 23 -11.709 -6.008 -9.368 1.00 0.00 C ATOM 318 O ASP A 23 -11.218 -7.067 -8.968 1.00 0.00 O ATOM 319 CB ASP A 23 -9.438 -4.916 -9.620 1.00 0.00 C ATOM 320 CG ASP A 23 -9.230 -5.673 -10.945 1.00 0.00 C ATOM 321 OD1 ASP A 23 -9.942 -5.376 -11.930 1.00 0.00 O ATOM 322 OD2 ASP A 23 -8.319 -6.529 -10.998 1.00 0.00 O ATOM 0 H ASP A 23 -10.423 -4.489 -7.316 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.308 -4.031 -10.076 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -8.937 -3.949 -9.671 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.973 -5.473 -8.806 1.00 0.00 H new ATOM 327 N PHE A 24 -12.967 -5.894 -9.785 1.00 0.00 N ATOM 328 CA PHE A 24 -13.819 -7.020 -10.111 1.00 0.00 C ATOM 329 C PHE A 24 -13.294 -7.589 -11.427 1.00 0.00 C ATOM 330 O PHE A 24 -13.354 -6.913 -12.461 1.00 0.00 O ATOM 331 CB PHE A 24 -15.288 -6.569 -10.196 1.00 0.00 C ATOM 332 CG PHE A 24 -15.884 -6.203 -8.847 1.00 0.00 C ATOM 333 CD1 PHE A 24 -15.652 -4.929 -8.291 1.00 0.00 C ATOM 334 CD2 PHE A 24 -16.624 -7.152 -8.113 1.00 0.00 C ATOM 335 CE1 PHE A 24 -16.126 -4.627 -7.003 1.00 0.00 C ATOM 336 CE2 PHE A 24 -17.101 -6.846 -6.827 1.00 0.00 C ATOM 337 CZ PHE A 24 -16.836 -5.587 -6.265 1.00 0.00 C ATOM 0 H PHE A 24 -13.428 -4.992 -9.907 1.00 0.00 H new ATOM 0 HA PHE A 24 -13.794 -7.793 -9.343 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.359 -5.709 -10.862 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.881 -7.367 -10.643 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -15.110 -4.184 -8.855 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -16.826 -8.122 -8.542 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -15.943 -3.651 -6.579 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -17.670 -7.577 -6.272 1.00 0.00 H new ATOM 0 HZ PHE A 24 -17.178 -5.358 -5.267 1.00 0.00 H new ATOM 347 N TRP A 25 -12.753 -8.809 -11.385 1.00 0.00 N ATOM 348 CA TRP A 25 -12.016 -9.405 -12.498 1.00 0.00 C ATOM 349 C TRP A 25 -12.375 -10.881 -12.667 1.00 0.00 C ATOM 350 O TRP A 25 -13.134 -11.428 -11.865 1.00 0.00 O ATOM 351 CB TRP A 25 -10.504 -9.222 -12.281 1.00 0.00 C ATOM 352 CG TRP A 25 -9.851 -10.132 -11.283 1.00 0.00 C ATOM 353 CD1 TRP A 25 -10.048 -10.097 -9.949 1.00 0.00 C ATOM 354 CD2 TRP A 25 -8.891 -11.212 -11.507 1.00 0.00 C ATOM 355 NE1 TRP A 25 -9.316 -11.089 -9.334 1.00 0.00 N ATOM 356 CE2 TRP A 25 -8.569 -11.799 -10.246 1.00 0.00 C ATOM 357 CE3 TRP A 25 -8.245 -11.748 -12.644 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -7.661 -12.860 -10.119 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -7.322 -12.806 -12.526 1.00 0.00 C ATOM 360 CH2 TRP A 25 -7.038 -13.371 -11.269 1.00 0.00 C ATOM 0 H TRP A 25 -12.816 -9.416 -10.568 1.00 0.00 H new ATOM 0 HA TRP A 25 -12.299 -8.895 -13.418 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -10.004 -9.355 -13.240 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -10.327 -8.193 -11.969 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -10.687 -9.393 -9.437 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -9.326 -11.274 -8.331 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -8.463 -11.340 -13.620 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -7.443 -13.279 -9.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -6.828 -13.187 -13.408 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -6.344 -14.194 -11.189 1.00 0.00 H new ATOM 371 N ALA A 26 -11.825 -11.528 -13.698 1.00 0.00 N ATOM 372 CA ALA A 26 -11.873 -12.973 -13.881 1.00 0.00 C ATOM 373 C ALA A 26 -10.632 -13.396 -14.679 1.00 0.00 C ATOM 374 O ALA A 26 -10.198 -12.638 -15.551 1.00 0.00 O ATOM 375 CB ALA A 26 -13.148 -13.368 -14.632 1.00 0.00 C ATOM 0 H ALA A 26 -11.323 -11.046 -14.444 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.883 -13.474 -12.913 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.173 -14.450 -14.763 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -14.020 -13.052 -14.060 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.160 -12.884 -15.609 1.00 0.00 H new ATOM 381 N PRO A 27 -10.061 -14.589 -14.439 1.00 0.00 N ATOM 382 CA PRO A 27 -8.783 -14.986 -15.026 1.00 0.00 C ATOM 383 C PRO A 27 -8.883 -15.367 -16.506 1.00 0.00 C ATOM 384 O PRO A 27 -7.874 -15.341 -17.213 1.00 0.00 O ATOM 385 CB PRO A 27 -8.304 -16.166 -14.173 1.00 0.00 C ATOM 386 CG PRO A 27 -9.603 -16.798 -13.674 1.00 0.00 C ATOM 387 CD PRO A 27 -10.536 -15.600 -13.508 1.00 0.00 C ATOM 0 HA PRO A 27 -8.082 -14.151 -15.017 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.714 -16.871 -14.759 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.676 -15.834 -13.346 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -9.999 -17.520 -14.388 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -9.457 -17.328 -12.733 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.568 -15.876 -13.725 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -10.514 -15.228 -12.484 1.00 0.00 H new ATOM 395 N TRP A 28 -10.077 -15.704 -17.004 1.00 0.00 N ATOM 396 CA TRP A 28 -10.291 -16.016 -18.412 1.00 0.00 C ATOM 397 C TRP A 28 -10.457 -14.745 -19.260 1.00 0.00 C ATOM 398 O TRP A 28 -10.501 -14.835 -20.488 1.00 0.00 O ATOM 399 CB TRP A 28 -11.484 -16.979 -18.535 1.00 0.00 C ATOM 400 CG TRP A 28 -12.702 -16.701 -17.698 1.00 0.00 C ATOM 401 CD1 TRP A 28 -13.313 -15.503 -17.549 1.00 0.00 C ATOM 402 CD2 TRP A 28 -13.475 -17.634 -16.878 1.00 0.00 C ATOM 403 NE1 TRP A 28 -14.424 -15.638 -16.743 1.00 0.00 N ATOM 404 CE2 TRP A 28 -14.560 -16.926 -16.277 1.00 0.00 C ATOM 405 CE3 TRP A 28 -13.367 -19.009 -16.573 1.00 0.00 C ATOM 406 CZ2 TRP A 28 -15.483 -17.546 -15.420 1.00 0.00 C ATOM 407 CZ3 TRP A 28 -14.286 -19.643 -15.715 1.00 0.00 C ATOM 408 CH2 TRP A 28 -15.342 -18.915 -15.138 1.00 0.00 C ATOM 0 H TRP A 28 -10.922 -15.767 -16.436 1.00 0.00 H new ATOM 0 HA TRP A 28 -9.408 -16.513 -18.812 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -11.793 -16.996 -19.580 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -11.132 -17.981 -18.290 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -12.980 -14.578 -17.995 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -15.066 -14.877 -16.520 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -12.563 -19.586 -17.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -16.291 -16.978 -14.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -14.179 -20.696 -15.498 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -16.043 -19.407 -14.480 1.00 0.00 H new ATOM 419 N CYS A 29 -10.551 -13.563 -18.635 1.00 0.00 N ATOM 420 CA CYS A 29 -10.712 -12.300 -19.335 1.00 0.00 C ATOM 421 C CYS A 29 -9.320 -11.759 -19.671 1.00 0.00 C ATOM 422 O CYS A 29 -8.540 -11.450 -18.766 1.00 0.00 O ATOM 423 CB CYS A 29 -11.498 -11.336 -18.437 1.00 0.00 C ATOM 424 SG CYS A 29 -11.770 -9.753 -19.281 1.00 0.00 S ATOM 0 H CYS A 29 -10.516 -13.466 -17.620 1.00 0.00 H new ATOM 0 HA CYS A 29 -11.269 -12.423 -20.264 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -12.456 -11.780 -18.169 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -10.953 -11.170 -17.508 1.00 0.00 H new ATOM 0 HG CYS A 29 -13.028 -9.432 -19.207 1.00 0.00 H new ATOM 430 N GLY A 30 -9.013 -11.621 -20.964 1.00 0.00 N ATOM 431 CA GLY A 30 -7.784 -10.995 -21.439 1.00 0.00 C ATOM 432 C GLY A 30 -7.619 -9.580 -20.878 1.00 0.00 C ATOM 433 O GLY A 30 -6.641 -9.337 -20.174 1.00 0.00 O ATOM 0 H GLY A 30 -9.621 -11.946 -21.716 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.929 -11.604 -21.148 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.792 -10.957 -22.528 1.00 0.00 H new ATOM 437 N PRO A 31 -8.571 -8.653 -21.105 1.00 0.00 N ATOM 438 CA PRO A 31 -8.523 -7.298 -20.565 1.00 0.00 C ATOM 439 C PRO A 31 -8.247 -7.198 -19.055 1.00 0.00 C ATOM 440 O PRO A 31 -7.515 -6.297 -18.649 1.00 0.00 O ATOM 441 CB PRO A 31 -9.852 -6.657 -20.965 1.00 0.00 C ATOM 442 CG PRO A 31 -10.159 -7.333 -22.300 1.00 0.00 C ATOM 443 CD PRO A 31 -9.638 -8.755 -22.093 1.00 0.00 C ATOM 0 HA PRO A 31 -7.664 -6.770 -20.981 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.631 -6.845 -20.227 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.766 -5.575 -21.069 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.226 -7.322 -22.522 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -9.656 -6.836 -23.129 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.432 -9.414 -21.743 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -9.265 -9.174 -23.028 1.00 0.00 H new ATOM 451 N CYS A 32 -8.758 -8.115 -18.220 1.00 0.00 N ATOM 452 CA CYS A 32 -8.406 -8.148 -16.795 1.00 0.00 C ATOM 453 C CYS A 32 -6.900 -8.352 -16.595 1.00 0.00 C ATOM 454 O CYS A 32 -6.272 -7.660 -15.795 1.00 0.00 O ATOM 455 CB CYS A 32 -9.155 -9.268 -16.061 1.00 0.00 C ATOM 456 SG CYS A 32 -10.928 -8.910 -15.940 1.00 0.00 S ATOM 0 H CYS A 32 -9.414 -8.841 -18.507 1.00 0.00 H new ATOM 0 HA CYS A 32 -8.698 -7.183 -16.380 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -9.008 -10.211 -16.587 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -8.738 -9.392 -15.061 1.00 0.00 H new ATOM 0 HG CYS A 32 -11.490 -9.105 -17.096 1.00 0.00 H new ATOM 462 N LYS A 33 -6.298 -9.292 -17.325 1.00 0.00 N ATOM 463 CA LYS A 33 -4.863 -9.546 -17.231 1.00 0.00 C ATOM 464 C LYS A 33 -4.070 -8.396 -17.854 1.00 0.00 C ATOM 465 O LYS A 33 -2.979 -8.095 -17.378 1.00 0.00 O ATOM 466 CB LYS A 33 -4.531 -10.903 -17.870 1.00 0.00 C ATOM 467 CG LYS A 33 -5.136 -12.044 -17.030 1.00 0.00 C ATOM 468 CD LYS A 33 -4.978 -13.434 -17.656 1.00 0.00 C ATOM 469 CE LYS A 33 -5.795 -13.561 -18.950 1.00 0.00 C ATOM 470 NZ LYS A 33 -6.009 -14.979 -19.327 1.00 0.00 N ATOM 0 H LYS A 33 -6.786 -9.892 -17.990 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.570 -9.596 -16.182 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.923 -10.941 -18.886 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.450 -11.026 -17.941 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.666 -12.045 -16.046 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.197 -11.845 -16.877 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.925 -13.622 -17.868 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.300 -14.194 -16.944 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.759 -13.069 -18.821 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.279 -13.043 -19.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.365 -15.029 -20.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.109 -15.496 -19.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.704 -15.408 -18.683 1.00 0.00 H new ATOM 484 N MET A 34 -4.615 -7.716 -18.869 1.00 0.00 N ATOM 485 CA MET A 34 -3.980 -6.553 -19.482 1.00 0.00 C ATOM 486 C MET A 34 -3.953 -5.365 -18.519 1.00 0.00 C ATOM 487 O MET A 34 -2.933 -4.682 -18.444 1.00 0.00 O ATOM 488 CB MET A 34 -4.701 -6.153 -20.777 1.00 0.00 C ATOM 489 CG MET A 34 -4.580 -7.225 -21.865 1.00 0.00 C ATOM 490 SD MET A 34 -5.680 -6.999 -23.294 1.00 0.00 S ATOM 491 CE MET A 34 -5.067 -5.424 -23.955 1.00 0.00 C ATOM 0 H MET A 34 -5.513 -7.961 -19.287 1.00 0.00 H new ATOM 0 HA MET A 34 -2.954 -6.832 -19.720 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.755 -5.973 -20.563 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.286 -5.215 -21.146 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.549 -7.247 -22.219 1.00 0.00 H new ATOM 0 HG3 MET A 34 -4.784 -8.198 -21.419 1.00 0.00 H new ATOM 0 HE1 MET A 34 -5.609 -5.177 -24.868 1.00 0.00 H new ATOM 0 HE2 MET A 34 -5.220 -4.636 -23.218 1.00 0.00 H new ATOM 0 HE3 MET A 34 -4.003 -5.512 -24.177 1.00 0.00 H new ATOM 501 N ILE A 35 -5.041 -5.097 -17.784 1.00 0.00 N ATOM 502 CA ILE A 35 -5.088 -3.960 -16.866 1.00 0.00 C ATOM 503 C ILE A 35 -4.306 -4.257 -15.576 1.00 0.00 C ATOM 504 O ILE A 35 -3.879 -3.319 -14.914 1.00 0.00 O ATOM 505 CB ILE A 35 -6.546 -3.489 -16.629 1.00 0.00 C ATOM 506 CG1 ILE A 35 -6.567 -2.024 -16.134 1.00 0.00 C ATOM 507 CG2 ILE A 35 -7.339 -4.427 -15.705 1.00 0.00 C ATOM 508 CD1 ILE A 35 -7.969 -1.478 -15.842 1.00 0.00 C ATOM 0 H ILE A 35 -5.896 -5.653 -17.810 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.581 -3.113 -17.328 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.060 -3.531 -17.589 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -5.965 -1.950 -15.228 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.093 -1.392 -16.885 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.351 -4.043 -15.578 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.381 -5.423 -16.147 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.848 -4.482 -14.734 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -7.894 -0.446 -15.500 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.571 -1.516 -16.750 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.441 -2.083 -15.068 1.00 0.00 H new ATOM 520 N ALA A 36 -4.071 -5.526 -15.219 1.00 0.00 N ATOM 521 CA ALA A 36 -3.379 -5.890 -13.980 1.00 0.00 C ATOM 522 C ALA A 36 -2.044 -5.140 -13.764 1.00 0.00 C ATOM 523 O ALA A 36 -1.896 -4.519 -12.708 1.00 0.00 O ATOM 524 CB ALA A 36 -3.214 -7.413 -13.887 1.00 0.00 C ATOM 0 H ALA A 36 -4.356 -6.328 -15.782 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.014 -5.560 -13.158 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.698 -7.667 -12.961 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.196 -7.887 -13.897 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.631 -7.768 -14.737 1.00 0.00 H new ATOM 530 N PRO A 37 -1.090 -5.095 -14.717 1.00 0.00 N ATOM 531 CA PRO A 37 0.130 -4.315 -14.534 1.00 0.00 C ATOM 532 C PRO A 37 -0.147 -2.809 -14.453 1.00 0.00 C ATOM 533 O PRO A 37 0.568 -2.103 -13.748 1.00 0.00 O ATOM 534 CB PRO A 37 1.047 -4.672 -15.710 1.00 0.00 C ATOM 535 CG PRO A 37 0.084 -5.177 -16.781 1.00 0.00 C ATOM 536 CD PRO A 37 -1.011 -5.850 -15.959 1.00 0.00 C ATOM 0 HA PRO A 37 0.604 -4.558 -13.583 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.611 -3.805 -16.055 1.00 0.00 H new ATOM 0 HB3 PRO A 37 1.774 -5.436 -15.433 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.309 -4.362 -17.388 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.567 -5.878 -17.462 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.964 -5.834 -16.488 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.770 -6.896 -15.767 1.00 0.00 H new ATOM 544 N VAL A 38 -1.186 -2.298 -15.119 1.00 0.00 N ATOM 545 CA VAL A 38 -1.582 -0.899 -15.011 1.00 0.00 C ATOM 546 C VAL A 38 -2.065 -0.611 -13.581 1.00 0.00 C ATOM 547 O VAL A 38 -1.750 0.442 -13.027 1.00 0.00 O ATOM 548 CB VAL A 38 -2.648 -0.547 -16.076 1.00 0.00 C ATOM 549 CG1 VAL A 38 -2.824 0.970 -16.194 1.00 0.00 C ATOM 550 CG2 VAL A 38 -2.282 -1.080 -17.472 1.00 0.00 C ATOM 0 H VAL A 38 -1.774 -2.846 -15.747 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.722 -0.259 -15.209 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.570 -1.020 -15.739 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.579 1.191 -16.949 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.142 1.375 -15.233 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.877 1.425 -16.484 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.062 -0.806 -18.182 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.334 -0.647 -17.790 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.190 -2.165 -17.434 1.00 0.00 H new ATOM 560 N LEU A 39 -2.775 -1.552 -12.947 1.00 0.00 N ATOM 561 CA LEU A 39 -3.163 -1.437 -11.549 1.00 0.00 C ATOM 562 C LEU A 39 -1.942 -1.529 -10.637 1.00 0.00 C ATOM 563 O LEU A 39 -1.922 -0.854 -9.615 1.00 0.00 O ATOM 564 CB LEU A 39 -4.209 -2.489 -11.146 1.00 0.00 C ATOM 565 CG LEU A 39 -5.558 -2.384 -11.882 1.00 0.00 C ATOM 566 CD1 LEU A 39 -6.508 -3.459 -11.347 1.00 0.00 C ATOM 567 CD2 LEU A 39 -6.215 -1.007 -11.729 1.00 0.00 C ATOM 0 H LEU A 39 -3.093 -2.412 -13.395 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.623 -0.456 -11.429 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -3.792 -3.480 -11.324 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.390 -2.407 -10.074 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.360 -2.530 -12.944 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.465 -3.389 -11.865 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.075 -4.445 -11.517 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.662 -3.309 -10.278 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.162 -0.994 -12.269 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.396 -0.806 -10.673 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.554 -0.241 -12.136 1.00 0.00 H new ATOM 579 N GLU A 40 -0.912 -2.306 -10.982 1.00 0.00 N ATOM 580 CA GLU A 40 0.340 -2.297 -10.223 1.00 0.00 C ATOM 581 C GLU A 40 1.065 -0.950 -10.354 1.00 0.00 C ATOM 582 O GLU A 40 1.660 -0.472 -9.386 1.00 0.00 O ATOM 583 CB GLU A 40 1.256 -3.463 -10.627 1.00 0.00 C ATOM 584 CG GLU A 40 0.702 -4.820 -10.170 1.00 0.00 C ATOM 585 CD GLU A 40 1.660 -5.970 -10.523 1.00 0.00 C ATOM 586 OE1 GLU A 40 2.591 -6.255 -9.734 1.00 0.00 O ATOM 587 OE2 GLU A 40 1.484 -6.621 -11.578 1.00 0.00 O ATOM 0 H GLU A 40 -0.920 -2.945 -11.777 1.00 0.00 H new ATOM 0 HA GLU A 40 0.082 -2.433 -9.173 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.378 -3.468 -11.710 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.245 -3.312 -10.195 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.536 -4.802 -9.093 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.266 -4.995 -10.639 1.00 0.00 H new ATOM 594 N GLU A 41 1.017 -0.297 -11.518 1.00 0.00 N ATOM 595 CA GLU A 41 1.544 1.055 -11.683 1.00 0.00 C ATOM 596 C GLU A 41 0.723 2.047 -10.851 1.00 0.00 C ATOM 597 O GLU A 41 1.290 2.940 -10.223 1.00 0.00 O ATOM 598 CB GLU A 41 1.589 1.470 -13.165 1.00 0.00 C ATOM 599 CG GLU A 41 2.622 0.701 -14.005 1.00 0.00 C ATOM 600 CD GLU A 41 4.070 0.890 -13.516 1.00 0.00 C ATOM 601 OE1 GLU A 41 4.623 2.004 -13.654 1.00 0.00 O ATOM 602 OE2 GLU A 41 4.673 -0.085 -13.013 1.00 0.00 O ATOM 0 H GLU A 41 0.613 -0.691 -12.368 1.00 0.00 H new ATOM 0 HA GLU A 41 2.572 1.066 -11.319 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.601 1.323 -13.602 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.809 2.536 -13.225 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.376 -0.361 -13.987 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.551 1.027 -15.043 1.00 0.00 H new ATOM 609 N LEU A 42 -0.600 1.880 -10.791 1.00 0.00 N ATOM 610 CA LEU A 42 -1.460 2.710 -9.959 1.00 0.00 C ATOM 611 C LEU A 42 -1.173 2.471 -8.477 1.00 0.00 C ATOM 612 O LEU A 42 -1.194 3.412 -7.691 1.00 0.00 O ATOM 613 CB LEU A 42 -2.932 2.424 -10.281 1.00 0.00 C ATOM 614 CG LEU A 42 -3.916 3.326 -9.514 1.00 0.00 C ATOM 615 CD1 LEU A 42 -3.803 4.801 -9.920 1.00 0.00 C ATOM 616 CD2 LEU A 42 -5.328 2.814 -9.786 1.00 0.00 C ATOM 0 H LEU A 42 -1.100 1.165 -11.319 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.252 3.758 -10.175 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.093 2.552 -11.351 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.150 1.382 -10.049 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.676 3.281 -8.452 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.519 5.392 -9.349 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.794 5.158 -9.716 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.016 4.903 -10.984 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.049 3.435 -9.254 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -5.531 2.858 -10.856 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.414 1.783 -9.442 1.00 0.00 H new ATOM 628 N ASP A 43 -0.874 1.237 -8.079 1.00 0.00 N ATOM 629 CA ASP A 43 -0.511 0.907 -6.710 1.00 0.00 C ATOM 630 C ASP A 43 0.820 1.545 -6.326 1.00 0.00 C ATOM 631 O ASP A 43 0.975 2.046 -5.217 1.00 0.00 O ATOM 632 CB ASP A 43 -0.415 -0.606 -6.527 1.00 0.00 C ATOM 633 CG ASP A 43 -0.241 -0.932 -5.042 1.00 0.00 C ATOM 634 OD1 ASP A 43 -1.161 -0.597 -4.265 1.00 0.00 O ATOM 635 OD2 ASP A 43 0.790 -1.535 -4.666 1.00 0.00 O ATOM 0 H ASP A 43 -0.878 0.433 -8.706 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.293 1.301 -6.061 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.314 -1.087 -6.913 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.427 -0.999 -7.097 1.00 0.00 H new ATOM 640 N GLN A 44 1.776 1.602 -7.253 1.00 0.00 N ATOM 641 CA GLN A 44 3.010 2.350 -7.050 1.00 0.00 C ATOM 642 C GLN A 44 2.734 3.858 -6.915 1.00 0.00 C ATOM 643 O GLN A 44 3.432 4.547 -6.168 1.00 0.00 O ATOM 644 CB GLN A 44 3.971 2.050 -8.204 1.00 0.00 C ATOM 645 CG GLN A 44 4.619 0.663 -8.072 1.00 0.00 C ATOM 646 CD GLN A 44 5.227 0.236 -9.405 1.00 0.00 C ATOM 647 OE1 GLN A 44 6.394 0.490 -9.699 1.00 0.00 O ATOM 648 NE2 GLN A 44 4.426 -0.387 -10.250 1.00 0.00 N ATOM 0 H GLN A 44 1.715 1.134 -8.157 1.00 0.00 H new ATOM 0 HA GLN A 44 3.473 2.036 -6.115 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.431 2.109 -9.149 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.750 2.812 -8.234 1.00 0.00 H new ATOM 0 HG2 GLN A 44 5.391 0.686 -7.303 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.874 -0.066 -7.754 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.462 -0.587 -9.985 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.772 -0.668 -11.168 1.00 0.00 H new ATOM 657 N GLU A 45 1.723 4.376 -7.615 1.00 0.00 N ATOM 658 CA GLU A 45 1.377 5.794 -7.634 1.00 0.00 C ATOM 659 C GLU A 45 0.590 6.216 -6.380 1.00 0.00 C ATOM 660 O GLU A 45 0.839 7.296 -5.840 1.00 0.00 O ATOM 661 CB GLU A 45 0.550 6.066 -8.907 1.00 0.00 C ATOM 662 CG GLU A 45 0.310 7.548 -9.218 1.00 0.00 C ATOM 663 CD GLU A 45 1.572 8.244 -9.751 1.00 0.00 C ATOM 664 OE1 GLU A 45 2.373 8.776 -8.949 1.00 0.00 O ATOM 665 OE2 GLU A 45 1.755 8.273 -10.989 1.00 0.00 O ATOM 0 H GLU A 45 1.109 3.806 -8.197 1.00 0.00 H new ATOM 0 HA GLU A 45 2.294 6.383 -7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.058 5.609 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.415 5.570 -8.808 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -0.490 7.638 -9.953 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.029 8.056 -8.315 1.00 0.00 H new ATOM 672 N MET A 46 -0.330 5.372 -5.894 1.00 0.00 N ATOM 673 CA MET A 46 -1.337 5.740 -4.893 1.00 0.00 C ATOM 674 C MET A 46 -1.485 4.735 -3.743 1.00 0.00 C ATOM 675 O MET A 46 -2.174 5.046 -2.775 1.00 0.00 O ATOM 676 CB MET A 46 -2.697 5.909 -5.604 1.00 0.00 C ATOM 677 CG MET A 46 -2.790 7.140 -6.514 1.00 0.00 C ATOM 678 SD MET A 46 -2.840 8.713 -5.613 1.00 0.00 S ATOM 679 CE MET A 46 -3.154 9.859 -6.981 1.00 0.00 C ATOM 0 H MET A 46 -0.395 4.398 -6.191 1.00 0.00 H new ATOM 0 HA MET A 46 -0.998 6.669 -4.434 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.895 5.017 -6.199 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.482 5.970 -4.850 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.935 7.146 -7.190 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.684 7.057 -7.132 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.214 10.877 -6.596 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.342 9.792 -7.706 1.00 0.00 H new ATOM 0 HE3 MET A 46 -4.095 9.598 -7.465 1.00 0.00 H new ATOM 689 N GLY A 47 -0.841 3.567 -3.778 1.00 0.00 N ATOM 690 CA GLY A 47 -1.000 2.481 -2.799 1.00 0.00 C ATOM 691 C GLY A 47 -0.536 2.813 -1.378 1.00 0.00 C ATOM 692 O GLY A 47 -0.658 1.995 -0.464 1.00 0.00 O ATOM 0 H GLY A 47 -0.171 3.340 -4.512 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.051 2.196 -2.764 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.446 1.611 -3.151 1.00 0.00 H new ATOM 696 N ASP A 48 0.029 4.003 -1.192 1.00 0.00 N ATOM 697 CA ASP A 48 0.405 4.569 0.096 1.00 0.00 C ATOM 698 C ASP A 48 -0.791 5.222 0.801 1.00 0.00 C ATOM 699 O ASP A 48 -0.834 5.266 2.032 1.00 0.00 O ATOM 700 CB ASP A 48 1.510 5.612 -0.112 1.00 0.00 C ATOM 701 CG ASP A 48 1.931 6.262 1.216 1.00 0.00 C ATOM 702 OD1 ASP A 48 2.592 5.590 2.041 1.00 0.00 O ATOM 703 OD2 ASP A 48 1.642 7.461 1.425 1.00 0.00 O ATOM 0 H ASP A 48 0.246 4.625 -1.971 1.00 0.00 H new ATOM 0 HA ASP A 48 0.764 3.758 0.730 1.00 0.00 H new ATOM 0 HB2 ASP A 48 2.375 5.139 -0.577 1.00 0.00 H new ATOM 0 HB3 ASP A 48 1.160 6.382 -0.800 1.00 0.00 H new ATOM 708 N LYS A 49 -1.776 5.700 0.031 1.00 0.00 N ATOM 709 CA LYS A 49 -2.913 6.489 0.491 1.00 0.00 C ATOM 710 C LYS A 49 -4.254 5.930 0.004 1.00 0.00 C ATOM 711 O LYS A 49 -5.307 6.463 0.356 1.00 0.00 O ATOM 712 CB LYS A 49 -2.695 7.953 0.071 1.00 0.00 C ATOM 713 CG LYS A 49 -2.797 8.195 -1.449 1.00 0.00 C ATOM 714 CD LYS A 49 -2.550 9.662 -1.826 1.00 0.00 C ATOM 715 CE LYS A 49 -1.071 10.053 -1.686 1.00 0.00 C ATOM 716 NZ LYS A 49 -0.826 11.474 -2.042 1.00 0.00 N ATOM 0 H LYS A 49 -1.798 5.537 -0.976 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.968 6.434 1.578 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.430 8.578 0.578 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.712 8.275 0.414 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.073 7.564 -1.964 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.786 7.895 -1.796 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.874 9.831 -2.853 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.157 10.307 -1.190 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.747 9.877 -0.660 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.466 9.411 -2.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.185 11.690 -1.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.110 11.639 -3.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.382 12.090 -1.415 1.00 0.00 H new ATOM 730 N LEU A 50 -4.223 4.855 -0.781 1.00 0.00 N ATOM 731 CA LEU A 50 -5.364 4.131 -1.310 1.00 0.00 C ATOM 732 C LEU A 50 -5.029 2.648 -1.218 1.00 0.00 C ATOM 733 O LEU A 50 -3.857 2.277 -1.207 1.00 0.00 O ATOM 734 CB LEU A 50 -5.695 4.630 -2.741 1.00 0.00 C ATOM 735 CG LEU A 50 -5.985 3.582 -3.845 1.00 0.00 C ATOM 736 CD1 LEU A 50 -6.629 4.269 -5.046 1.00 0.00 C ATOM 737 CD2 LEU A 50 -4.731 2.864 -4.369 1.00 0.00 C ATOM 0 H LEU A 50 -3.339 4.444 -1.081 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.275 4.307 -0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.564 5.285 -2.670 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.860 5.244 -3.079 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.637 2.843 -3.379 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.832 3.531 -5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.563 4.739 -4.739 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.952 5.029 -5.437 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.017 2.147 -5.138 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.043 3.596 -4.793 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.242 2.339 -3.548 1.00 0.00 H new ATOM 749 N LYS A 51 -6.047 1.795 -1.170 1.00 0.00 N ATOM 750 CA LYS A 51 -5.902 0.343 -1.224 1.00 0.00 C ATOM 751 C LYS A 51 -6.450 -0.120 -2.571 1.00 0.00 C ATOM 752 O LYS A 51 -7.372 0.504 -3.095 1.00 0.00 O ATOM 753 CB LYS A 51 -6.686 -0.238 -0.038 1.00 0.00 C ATOM 754 CG LYS A 51 -6.502 -1.748 0.173 1.00 0.00 C ATOM 755 CD LYS A 51 -7.484 -2.301 1.217 1.00 0.00 C ATOM 756 CE LYS A 51 -7.294 -1.685 2.613 1.00 0.00 C ATOM 757 NZ LYS A 51 -8.189 -2.330 3.594 1.00 0.00 N ATOM 0 H LYS A 51 -7.017 2.100 -1.091 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.867 0.009 -1.146 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.383 0.282 0.871 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.746 -0.032 -0.184 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.647 -2.268 -0.774 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.480 -1.949 0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.504 -2.116 0.881 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.362 -3.382 1.284 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.257 -1.800 2.929 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.499 -0.615 2.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.963 -1.985 4.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.177 -2.099 3.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.058 -3.361 3.558 1.00 0.00 H new ATOM 771 N ILE A 52 -5.949 -1.223 -3.116 1.00 0.00 N ATOM 772 CA ILE A 52 -6.547 -1.859 -4.288 1.00 0.00 C ATOM 773 C ILE A 52 -6.932 -3.262 -3.825 1.00 0.00 C ATOM 774 O ILE A 52 -6.152 -3.899 -3.123 1.00 0.00 O ATOM 775 CB ILE A 52 -5.585 -1.816 -5.503 1.00 0.00 C ATOM 776 CG1 ILE A 52 -5.139 -0.365 -5.809 1.00 0.00 C ATOM 777 CG2 ILE A 52 -6.240 -2.485 -6.731 1.00 0.00 C ATOM 778 CD1 ILE A 52 -4.343 -0.151 -7.104 1.00 0.00 C ATOM 0 H ILE A 52 -5.121 -1.701 -2.761 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.433 -1.340 -4.654 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.687 -2.381 -5.255 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -6.028 0.264 -5.847 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.534 -0.011 -4.974 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.552 -2.447 -7.576 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.472 -3.524 -6.499 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.158 -1.957 -6.987 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.090 0.904 -7.205 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.428 -0.742 -7.071 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.945 -0.463 -7.957 1.00 0.00 H new ATOM 790 N VAL A 53 -8.118 -3.750 -4.187 1.00 0.00 N ATOM 791 CA VAL A 53 -8.635 -5.041 -3.745 1.00 0.00 C ATOM 792 C VAL A 53 -9.016 -5.826 -4.995 1.00 0.00 C ATOM 793 O VAL A 53 -9.912 -5.418 -5.736 1.00 0.00 O ATOM 794 CB VAL A 53 -9.818 -4.845 -2.771 1.00 0.00 C ATOM 795 CG1 VAL A 53 -10.448 -6.178 -2.348 1.00 0.00 C ATOM 796 CG2 VAL A 53 -9.379 -4.114 -1.494 1.00 0.00 C ATOM 0 H VAL A 53 -8.756 -3.250 -4.806 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.886 -5.603 -3.187 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.551 -4.251 -3.316 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.275 -5.989 -1.664 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.819 -6.701 -3.229 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.698 -6.793 -1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.236 -3.993 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.608 -4.696 -0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.981 -3.133 -1.755 1.00 0.00 H new ATOM 806 N LYS A 54 -8.329 -6.938 -5.255 1.00 0.00 N ATOM 807 CA LYS A 54 -8.725 -7.869 -6.309 1.00 0.00 C ATOM 808 C LYS A 54 -9.936 -8.650 -5.797 1.00 0.00 C ATOM 809 O LYS A 54 -9.936 -9.055 -4.629 1.00 0.00 O ATOM 810 CB LYS A 54 -7.584 -8.848 -6.654 1.00 0.00 C ATOM 811 CG LYS A 54 -6.148 -8.289 -6.636 1.00 0.00 C ATOM 812 CD LYS A 54 -5.889 -7.049 -7.504 1.00 0.00 C ATOM 813 CE LYS A 54 -5.962 -7.280 -9.013 1.00 0.00 C ATOM 814 NZ LYS A 54 -5.026 -8.323 -9.510 1.00 0.00 N ATOM 0 H LYS A 54 -7.490 -7.216 -4.746 1.00 0.00 H new ATOM 0 HA LYS A 54 -8.964 -7.315 -7.217 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.631 -9.682 -5.954 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -7.776 -9.254 -7.647 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -5.889 -8.045 -5.606 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.469 -9.079 -6.957 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -6.614 -6.280 -7.235 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -4.902 -6.656 -7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.980 -7.564 -9.278 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.749 -6.341 -9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.084 -8.376 -10.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -4.055 -8.080 -9.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -5.284 -9.244 -9.102 1.00 0.00 H new ATOM 828 N ILE A 55 -10.921 -8.921 -6.655 1.00 0.00 N ATOM 829 CA ILE A 55 -12.053 -9.782 -6.320 1.00 0.00 C ATOM 830 C ILE A 55 -12.531 -10.501 -7.596 1.00 0.00 C ATOM 831 O ILE A 55 -12.957 -9.874 -8.568 1.00 0.00 O ATOM 832 CB ILE A 55 -13.123 -8.968 -5.544 1.00 0.00 C ATOM 833 CG1 ILE A 55 -14.297 -9.884 -5.147 1.00 0.00 C ATOM 834 CG2 ILE A 55 -13.597 -7.692 -6.265 1.00 0.00 C ATOM 835 CD1 ILE A 55 -15.209 -9.292 -4.066 1.00 0.00 C ATOM 0 H ILE A 55 -10.955 -8.548 -7.604 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.776 -10.580 -5.632 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.639 -8.598 -4.640 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.893 -10.099 -6.034 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.899 -10.835 -4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -14.343 -7.185 -5.654 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -12.748 -7.028 -6.426 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -14.036 -7.959 -7.226 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -16.011 -9.995 -3.841 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.628 -9.103 -3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -15.638 -8.356 -4.424 1.00 0.00 H new ATOM 847 N ASP A 56 -12.374 -11.828 -7.629 1.00 0.00 N ATOM 848 CA ASP A 56 -12.753 -12.665 -8.774 1.00 0.00 C ATOM 849 C ASP A 56 -14.270 -12.851 -8.765 1.00 0.00 C ATOM 850 O ASP A 56 -14.803 -13.415 -7.805 1.00 0.00 O ATOM 851 CB ASP A 56 -12.039 -14.023 -8.690 1.00 0.00 C ATOM 852 CG ASP A 56 -12.391 -15.005 -9.828 1.00 0.00 C ATOM 853 OD1 ASP A 56 -13.292 -14.737 -10.653 1.00 0.00 O ATOM 854 OD2 ASP A 56 -11.734 -16.070 -9.888 1.00 0.00 O ATOM 0 H ASP A 56 -11.976 -12.358 -6.854 1.00 0.00 H new ATOM 0 HA ASP A 56 -12.454 -12.183 -9.705 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -10.962 -13.854 -8.694 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.285 -14.490 -7.736 1.00 0.00 H new ATOM 859 N VAL A 57 -14.975 -12.374 -9.793 1.00 0.00 N ATOM 860 CA VAL A 57 -16.435 -12.412 -9.843 1.00 0.00 C ATOM 861 C VAL A 57 -16.990 -13.838 -9.842 1.00 0.00 C ATOM 862 O VAL A 57 -18.101 -14.047 -9.354 1.00 0.00 O ATOM 863 CB VAL A 57 -16.986 -11.597 -11.034 1.00 0.00 C ATOM 864 CG1 VAL A 57 -16.541 -10.133 -10.939 1.00 0.00 C ATOM 865 CG2 VAL A 57 -16.601 -12.156 -12.412 1.00 0.00 C ATOM 0 H VAL A 57 -14.547 -11.950 -10.616 1.00 0.00 H new ATOM 0 HA VAL A 57 -16.784 -11.940 -8.925 1.00 0.00 H new ATOM 0 HB VAL A 57 -18.071 -11.674 -10.957 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -16.939 -9.576 -11.787 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -16.915 -9.699 -10.012 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.452 -10.082 -10.951 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -17.028 -11.526 -13.192 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -15.515 -12.169 -12.509 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -16.987 -13.170 -12.514 1.00 0.00 H new ATOM 875 N ASP A 58 -16.245 -14.831 -10.338 1.00 0.00 N ATOM 876 CA ASP A 58 -16.733 -16.210 -10.384 1.00 0.00 C ATOM 877 C ASP A 58 -16.839 -16.795 -8.975 1.00 0.00 C ATOM 878 O ASP A 58 -17.715 -17.613 -8.694 1.00 0.00 O ATOM 879 CB ASP A 58 -15.822 -17.085 -11.250 1.00 0.00 C ATOM 880 CG ASP A 58 -16.363 -18.523 -11.335 1.00 0.00 C ATOM 881 OD1 ASP A 58 -17.447 -18.731 -11.923 1.00 0.00 O ATOM 882 OD2 ASP A 58 -15.688 -19.457 -10.849 1.00 0.00 O ATOM 0 H ASP A 58 -15.304 -14.705 -10.712 1.00 0.00 H new ATOM 0 HA ASP A 58 -17.727 -16.197 -10.832 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -15.747 -16.660 -12.251 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -14.815 -17.095 -10.832 1.00 0.00 H new ATOM 887 N GLU A 59 -15.995 -16.316 -8.059 1.00 0.00 N ATOM 888 CA GLU A 59 -15.981 -16.715 -6.654 1.00 0.00 C ATOM 889 C GLU A 59 -16.834 -15.762 -5.800 1.00 0.00 C ATOM 890 O GLU A 59 -17.060 -16.038 -4.622 1.00 0.00 O ATOM 891 CB GLU A 59 -14.524 -16.715 -6.154 1.00 0.00 C ATOM 892 CG GLU A 59 -13.670 -17.854 -6.734 1.00 0.00 C ATOM 893 CD GLU A 59 -14.058 -19.227 -6.151 1.00 0.00 C ATOM 894 OE1 GLU A 59 -13.556 -19.594 -5.064 1.00 0.00 O ATOM 895 OE2 GLU A 59 -14.848 -19.966 -6.779 1.00 0.00 O ATOM 0 H GLU A 59 -15.283 -15.620 -8.282 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.408 -17.714 -6.562 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -14.062 -15.761 -6.409 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.523 -16.790 -5.067 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -13.784 -17.876 -7.818 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -12.618 -17.658 -6.528 1.00 0.00 H new ATOM 902 N ASN A 60 -17.323 -14.654 -6.375 1.00 0.00 N ATOM 903 CA ASN A 60 -17.936 -13.541 -5.646 1.00 0.00 C ATOM 904 C ASN A 60 -19.126 -13.001 -6.428 1.00 0.00 C ATOM 905 O ASN A 60 -19.270 -11.794 -6.639 1.00 0.00 O ATOM 906 CB ASN A 60 -16.890 -12.457 -5.364 1.00 0.00 C ATOM 907 CG ASN A 60 -15.809 -12.994 -4.445 1.00 0.00 C ATOM 908 OD1 ASN A 60 -16.024 -13.132 -3.249 1.00 0.00 O ATOM 909 ND2 ASN A 60 -14.654 -13.349 -4.983 1.00 0.00 N ATOM 0 H ASN A 60 -17.301 -14.506 -7.384 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.308 -13.893 -4.684 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -16.446 -12.119 -6.300 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -17.368 -11.591 -4.907 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.920 -13.747 -4.398 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.498 -13.224 -5.983 1.00 0.00 H new ATOM 916 N GLN A 61 -19.968 -13.927 -6.887 1.00 0.00 N ATOM 917 CA GLN A 61 -21.136 -13.640 -7.704 1.00 0.00 C ATOM 918 C GLN A 61 -22.057 -12.684 -6.940 1.00 0.00 C ATOM 919 O GLN A 61 -22.585 -11.729 -7.508 1.00 0.00 O ATOM 920 CB GLN A 61 -21.891 -14.939 -8.079 1.00 0.00 C ATOM 921 CG GLN A 61 -21.083 -16.255 -8.139 1.00 0.00 C ATOM 922 CD GLN A 61 -20.761 -16.829 -6.750 1.00 0.00 C ATOM 923 OE1 GLN A 61 -21.549 -16.740 -5.813 1.00 0.00 O ATOM 924 NE2 GLN A 61 -19.565 -17.355 -6.547 1.00 0.00 N ATOM 0 H GLN A 61 -19.849 -14.921 -6.693 1.00 0.00 H new ATOM 0 HA GLN A 61 -20.812 -13.172 -8.634 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -22.699 -15.075 -7.360 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -22.354 -14.787 -9.054 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -21.646 -16.994 -8.709 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -20.152 -16.078 -8.677 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -18.904 -17.433 -7.320 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -19.303 -17.683 -5.617 1.00 0.00 H new ATOM 933 N GLU A 62 -22.200 -12.927 -5.632 1.00 0.00 N ATOM 934 CA GLU A 62 -23.021 -12.136 -4.734 1.00 0.00 C ATOM 935 C GLU A 62 -22.489 -10.707 -4.646 1.00 0.00 C ATOM 936 O GLU A 62 -23.274 -9.767 -4.739 1.00 0.00 O ATOM 937 CB GLU A 62 -23.035 -12.791 -3.343 1.00 0.00 C ATOM 938 CG GLU A 62 -23.772 -14.140 -3.299 1.00 0.00 C ATOM 939 CD GLU A 62 -25.276 -14.005 -3.602 1.00 0.00 C ATOM 940 OE1 GLU A 62 -26.052 -13.621 -2.699 1.00 0.00 O ATOM 941 OE2 GLU A 62 -25.705 -14.304 -4.740 1.00 0.00 O ATOM 0 H GLU A 62 -21.731 -13.703 -5.165 1.00 0.00 H new ATOM 0 HA GLU A 62 -24.039 -12.096 -5.121 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -22.007 -12.938 -3.011 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -23.504 -12.108 -2.635 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -23.320 -14.820 -4.021 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -23.643 -14.588 -2.314 1.00 0.00 H new ATOM 948 N THR A 63 -21.174 -10.519 -4.500 1.00 0.00 N ATOM 949 CA THR A 63 -20.599 -9.190 -4.339 1.00 0.00 C ATOM 950 C THR A 63 -20.725 -8.398 -5.633 1.00 0.00 C ATOM 951 O THR A 63 -21.121 -7.244 -5.591 1.00 0.00 O ATOM 952 CB THR A 63 -19.134 -9.258 -3.902 1.00 0.00 C ATOM 953 OG1 THR A 63 -18.914 -10.393 -3.105 1.00 0.00 O ATOM 954 CG2 THR A 63 -18.672 -8.029 -3.117 1.00 0.00 C ATOM 0 H THR A 63 -20.490 -11.276 -4.491 1.00 0.00 H new ATOM 0 HA THR A 63 -21.158 -8.682 -3.553 1.00 0.00 H new ATOM 0 HB THR A 63 -18.555 -9.304 -4.825 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.480 -10.347 -2.306 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.624 -8.147 -2.840 1.00 0.00 H new ATOM 0 HG22 THR A 63 -18.786 -7.138 -3.735 1.00 0.00 H new ATOM 0 HG23 THR A 63 -19.276 -7.925 -2.216 1.00 0.00 H new ATOM 962 N ALA A 64 -20.443 -8.996 -6.791 1.00 0.00 N ATOM 963 CA ALA A 64 -20.616 -8.292 -8.055 1.00 0.00 C ATOM 964 C ALA A 64 -22.100 -7.924 -8.237 1.00 0.00 C ATOM 965 O ALA A 64 -22.434 -6.764 -8.502 1.00 0.00 O ATOM 966 CB ALA A 64 -20.063 -9.166 -9.186 1.00 0.00 C ATOM 0 H ALA A 64 -20.099 -9.952 -6.877 1.00 0.00 H new ATOM 0 HA ALA A 64 -20.059 -7.355 -8.068 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -20.187 -8.650 -10.138 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -19.004 -9.359 -9.012 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.604 -10.112 -9.213 1.00 0.00 H new ATOM 972 N GLY A 65 -23.003 -8.876 -7.974 1.00 0.00 N ATOM 973 CA GLY A 65 -24.446 -8.665 -7.990 1.00 0.00 C ATOM 974 C GLY A 65 -24.904 -7.572 -7.019 1.00 0.00 C ATOM 975 O GLY A 65 -25.904 -6.904 -7.287 1.00 0.00 O ATOM 0 H GLY A 65 -22.740 -9.833 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -24.757 -8.399 -9.000 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -24.947 -9.600 -7.738 1.00 0.00 H new ATOM 979 N LYS A 66 -24.151 -7.321 -5.941 1.00 0.00 N ATOM 980 CA LYS A 66 -24.417 -6.283 -4.941 1.00 0.00 C ATOM 981 C LYS A 66 -24.488 -4.886 -5.571 1.00 0.00 C ATOM 982 O LYS A 66 -25.120 -4.000 -4.995 1.00 0.00 O ATOM 983 CB LYS A 66 -23.332 -6.348 -3.845 1.00 0.00 C ATOM 984 CG LYS A 66 -23.818 -5.895 -2.459 1.00 0.00 C ATOM 985 CD LYS A 66 -22.737 -6.076 -1.377 1.00 0.00 C ATOM 986 CE LYS A 66 -22.409 -7.563 -1.133 1.00 0.00 C ATOM 987 NZ LYS A 66 -21.404 -7.790 -0.068 1.00 0.00 N ATOM 0 H LYS A 66 -23.308 -7.857 -5.735 1.00 0.00 H new ATOM 0 HA LYS A 66 -25.394 -6.470 -4.495 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -22.963 -7.371 -3.773 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -22.489 -5.725 -4.145 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -24.113 -4.847 -2.504 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -24.705 -6.464 -2.183 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -21.831 -5.549 -1.677 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -23.076 -5.622 -0.446 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -23.327 -8.089 -0.871 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -22.045 -8.002 -2.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -20.986 -8.736 -0.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -20.656 -7.070 -0.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -21.863 -7.723 0.863 1.00 0.00 H new ATOM 1001 N TYR A 67 -23.896 -4.699 -6.758 1.00 0.00 N ATOM 1002 CA TYR A 67 -23.879 -3.436 -7.494 1.00 0.00 C ATOM 1003 C TYR A 67 -24.369 -3.646 -8.938 1.00 0.00 C ATOM 1004 O TYR A 67 -24.187 -2.772 -9.788 1.00 0.00 O ATOM 1005 CB TYR A 67 -22.464 -2.827 -7.446 1.00 0.00 C ATOM 1006 CG TYR A 67 -21.670 -3.125 -6.185 1.00 0.00 C ATOM 1007 CD1 TYR A 67 -21.883 -2.403 -4.996 1.00 0.00 C ATOM 1008 CD2 TYR A 67 -20.755 -4.193 -6.200 1.00 0.00 C ATOM 1009 CE1 TYR A 67 -21.182 -2.749 -3.826 1.00 0.00 C ATOM 1010 CE2 TYR A 67 -20.061 -4.551 -5.038 1.00 0.00 C ATOM 1011 CZ TYR A 67 -20.276 -3.834 -3.839 1.00 0.00 C ATOM 1012 OH TYR A 67 -19.655 -4.200 -2.683 1.00 0.00 O ATOM 0 H TYR A 67 -23.402 -5.447 -7.244 1.00 0.00 H new ATOM 0 HA TYR A 67 -24.564 -2.731 -7.024 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -21.900 -3.191 -8.305 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -22.548 -1.746 -7.555 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -22.585 -1.583 -4.981 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -20.586 -4.741 -7.115 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -21.336 -2.185 -2.918 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -19.362 -5.374 -5.058 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.725 -4.444 -2.874 1.00 0.00 H new ATOM 1022 N GLY A 68 -24.968 -4.808 -9.235 1.00 0.00 N ATOM 1023 CA GLY A 68 -25.444 -5.178 -10.564 1.00 0.00 C ATOM 1024 C GLY A 68 -24.316 -5.423 -11.572 1.00 0.00 C ATOM 1025 O GLY A 68 -24.553 -5.356 -12.780 1.00 0.00 O ATOM 0 H GLY A 68 -25.136 -5.531 -8.536 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -26.052 -6.079 -10.485 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -26.093 -4.388 -10.942 1.00 0.00 H new ATOM 1029 N VAL A 69 -23.096 -5.687 -11.103 1.00 0.00 N ATOM 1030 CA VAL A 69 -21.948 -6.012 -11.939 1.00 0.00 C ATOM 1031 C VAL A 69 -21.985 -7.517 -12.219 1.00 0.00 C ATOM 1032 O VAL A 69 -22.240 -8.319 -11.321 1.00 0.00 O ATOM 1033 CB VAL A 69 -20.648 -5.585 -11.211 1.00 0.00 C ATOM 1034 CG1 VAL A 69 -19.370 -5.999 -11.960 1.00 0.00 C ATOM 1035 CG2 VAL A 69 -20.608 -4.059 -11.023 1.00 0.00 C ATOM 0 H VAL A 69 -22.877 -5.680 -10.107 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.977 -5.478 -12.889 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.669 -6.100 -10.251 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -18.496 -5.670 -11.398 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -19.346 -7.083 -12.067 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -19.361 -5.537 -12.947 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -19.688 -3.780 -10.510 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.643 -3.571 -11.997 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.465 -3.743 -10.428 1.00 0.00 H new ATOM 1045 N MET A 70 -21.716 -7.897 -13.469 1.00 0.00 N ATOM 1046 CA MET A 70 -21.436 -9.276 -13.875 1.00 0.00 C ATOM 1047 C MET A 70 -20.647 -9.273 -15.199 1.00 0.00 C ATOM 1048 O MET A 70 -20.733 -10.198 -16.008 1.00 0.00 O ATOM 1049 CB MET A 70 -22.720 -10.143 -13.889 1.00 0.00 C ATOM 1050 CG MET A 70 -22.582 -11.308 -12.894 1.00 0.00 C ATOM 1051 SD MET A 70 -21.183 -12.433 -13.199 1.00 0.00 S ATOM 1052 CE MET A 70 -21.054 -13.234 -11.576 1.00 0.00 C ATOM 0 H MET A 70 -21.686 -7.238 -14.247 1.00 0.00 H new ATOM 0 HA MET A 70 -20.799 -9.758 -13.134 1.00 0.00 H new ATOM 0 HB2 MET A 70 -23.584 -9.532 -13.628 1.00 0.00 H new ATOM 0 HB3 MET A 70 -22.896 -10.530 -14.893 1.00 0.00 H new ATOM 0 HG2 MET A 70 -22.483 -10.896 -11.890 1.00 0.00 H new ATOM 0 HG3 MET A 70 -23.504 -11.889 -12.911 1.00 0.00 H new ATOM 0 HE1 MET A 70 -20.480 -14.156 -11.670 1.00 0.00 H new ATOM 0 HE2 MET A 70 -20.552 -12.564 -10.878 1.00 0.00 H new ATOM 0 HE3 MET A 70 -22.052 -13.465 -11.204 1.00 0.00 H new ATOM 1062 N SER A 71 -19.870 -8.206 -15.417 1.00 0.00 N ATOM 1063 CA SER A 71 -18.948 -8.025 -16.525 1.00 0.00 C ATOM 1064 C SER A 71 -17.648 -7.474 -15.936 1.00 0.00 C ATOM 1065 O SER A 71 -17.666 -6.860 -14.864 1.00 0.00 O ATOM 1066 CB SER A 71 -19.542 -7.066 -17.567 1.00 0.00 C ATOM 1067 OG SER A 71 -20.794 -7.528 -18.053 1.00 0.00 O ATOM 0 H SER A 71 -19.874 -7.405 -14.785 1.00 0.00 H new ATOM 0 HA SER A 71 -18.760 -8.968 -17.039 1.00 0.00 H new ATOM 0 HB2 SER A 71 -19.666 -6.078 -17.123 1.00 0.00 H new ATOM 0 HB3 SER A 71 -18.847 -6.957 -18.399 1.00 0.00 H new ATOM 0 HG SER A 71 -21.143 -6.893 -18.713 1.00 0.00 H new ATOM 1073 N ILE A 72 -16.524 -7.716 -16.609 1.00 0.00 N ATOM 1074 CA ILE A 72 -15.183 -7.451 -16.102 1.00 0.00 C ATOM 1075 C ILE A 72 -14.269 -7.034 -17.273 1.00 0.00 C ATOM 1076 O ILE A 72 -14.599 -7.359 -18.419 1.00 0.00 O ATOM 1077 CB ILE A 72 -14.628 -8.695 -15.358 1.00 0.00 C ATOM 1078 CG1 ILE A 72 -14.348 -9.953 -16.218 1.00 0.00 C ATOM 1079 CG2 ILE A 72 -15.457 -9.049 -14.112 1.00 0.00 C ATOM 1080 CD1 ILE A 72 -15.549 -10.770 -16.714 1.00 0.00 C ATOM 0 H ILE A 72 -16.524 -8.113 -17.549 1.00 0.00 H new ATOM 0 HA ILE A 72 -15.218 -6.633 -15.382 1.00 0.00 H new ATOM 0 HB ILE A 72 -13.638 -8.362 -15.048 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -13.774 -9.640 -17.090 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -13.709 -10.618 -15.638 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -15.028 -9.926 -13.627 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -15.447 -8.209 -13.418 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -16.484 -9.263 -14.407 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -15.195 -11.618 -17.301 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -16.120 -11.133 -15.859 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -16.186 -10.140 -17.334 1.00 0.00 H new ATOM 1092 N PRO A 73 -13.123 -6.365 -17.033 1.00 0.00 N ATOM 1093 CA PRO A 73 -12.709 -5.775 -15.764 1.00 0.00 C ATOM 1094 C PRO A 73 -13.632 -4.611 -15.410 1.00 0.00 C ATOM 1095 O PRO A 73 -13.989 -3.808 -16.276 1.00 0.00 O ATOM 1096 CB PRO A 73 -11.265 -5.302 -15.959 1.00 0.00 C ATOM 1097 CG PRO A 73 -11.118 -5.126 -17.468 1.00 0.00 C ATOM 1098 CD PRO A 73 -12.131 -6.102 -18.061 1.00 0.00 C ATOM 0 HA PRO A 73 -12.767 -6.490 -14.943 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -11.079 -4.367 -15.431 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -10.553 -6.032 -15.574 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -11.329 -4.101 -17.771 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -10.105 -5.354 -17.798 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.600 -5.678 -18.949 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.641 -7.026 -18.369 1.00 0.00 H new ATOM 1106 N THR A 74 -13.977 -4.508 -14.131 1.00 0.00 N ATOM 1107 CA THR A 74 -14.822 -3.454 -13.600 1.00 0.00 C ATOM 1108 C THR A 74 -14.126 -2.937 -12.345 1.00 0.00 C ATOM 1109 O THR A 74 -13.640 -3.712 -11.520 1.00 0.00 O ATOM 1110 CB THR A 74 -16.242 -4.001 -13.366 1.00 0.00 C ATOM 1111 OG1 THR A 74 -16.826 -4.312 -14.614 1.00 0.00 O ATOM 1112 CG2 THR A 74 -17.152 -2.998 -12.650 1.00 0.00 C ATOM 0 H THR A 74 -13.668 -5.172 -13.421 1.00 0.00 H new ATOM 0 HA THR A 74 -14.953 -2.617 -14.286 1.00 0.00 H new ATOM 0 HB THR A 74 -16.147 -4.883 -12.732 1.00 0.00 H new ATOM 0 HG1 THR A 74 -16.940 -5.282 -14.689 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.140 -3.437 -12.512 1.00 0.00 H new ATOM 0 HG22 THR A 74 -16.726 -2.750 -11.678 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.238 -2.092 -13.250 1.00 0.00 H new ATOM 1120 N LEU A 75 -14.049 -1.614 -12.229 1.00 0.00 N ATOM 1121 CA LEU A 75 -13.299 -0.905 -11.215 1.00 0.00 C ATOM 1122 C LEU A 75 -14.312 -0.084 -10.438 1.00 0.00 C ATOM 1123 O LEU A 75 -14.806 0.927 -10.941 1.00 0.00 O ATOM 1124 CB LEU A 75 -12.232 0.005 -11.849 1.00 0.00 C ATOM 1125 CG LEU A 75 -11.114 -0.703 -12.635 1.00 0.00 C ATOM 1126 CD1 LEU A 75 -10.130 0.353 -13.142 1.00 0.00 C ATOM 1127 CD2 LEU A 75 -10.357 -1.740 -11.801 1.00 0.00 C ATOM 0 H LEU A 75 -14.532 -0.986 -12.871 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.766 -1.599 -10.565 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.732 0.704 -12.519 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -11.772 0.597 -11.057 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.582 -1.241 -13.459 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.331 -0.133 -13.702 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -10.653 1.055 -13.792 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.704 0.890 -12.295 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.582 -2.203 -12.412 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.897 -1.251 -10.942 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.051 -2.505 -11.454 1.00 0.00 H new ATOM 1139 N LEU A 76 -14.675 -0.540 -9.243 1.00 0.00 N ATOM 1140 CA LEU A 76 -15.450 0.286 -8.326 1.00 0.00 C ATOM 1141 C LEU A 76 -14.457 1.150 -7.566 1.00 0.00 C ATOM 1142 O LEU A 76 -13.364 0.687 -7.235 1.00 0.00 O ATOM 1143 CB LEU A 76 -16.279 -0.564 -7.349 1.00 0.00 C ATOM 1144 CG LEU A 76 -17.724 -0.781 -7.821 1.00 0.00 C ATOM 1145 CD1 LEU A 76 -17.808 -1.562 -9.138 1.00 0.00 C ATOM 1146 CD2 LEU A 76 -18.522 -1.512 -6.739 1.00 0.00 C ATOM 0 H LEU A 76 -14.447 -1.469 -8.890 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.162 0.894 -8.884 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.796 -1.532 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -16.290 -0.079 -6.373 1.00 0.00 H new ATOM 0 HG LEU A 76 -18.150 0.206 -8.003 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -18.853 -1.685 -9.422 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.281 -1.015 -9.920 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -17.349 -2.542 -9.010 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -19.546 -1.662 -7.081 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -18.061 -2.479 -6.538 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -18.528 -0.916 -5.826 1.00 0.00 H new ATOM 1158 N VAL A 77 -14.861 2.370 -7.237 1.00 0.00 N ATOM 1159 CA VAL A 77 -14.134 3.235 -6.326 1.00 0.00 C ATOM 1160 C VAL A 77 -15.036 3.309 -5.106 1.00 0.00 C ATOM 1161 O VAL A 77 -16.231 3.599 -5.234 1.00 0.00 O ATOM 1162 CB VAL A 77 -13.878 4.626 -6.941 1.00 0.00 C ATOM 1163 CG1 VAL A 77 -12.937 5.453 -6.050 1.00 0.00 C ATOM 1164 CG2 VAL A 77 -13.273 4.562 -8.352 1.00 0.00 C ATOM 0 H VAL A 77 -15.716 2.790 -7.602 1.00 0.00 H new ATOM 0 HA VAL A 77 -13.140 2.856 -6.087 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.858 5.099 -7.011 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -12.771 6.430 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.388 5.582 -5.066 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -11.984 4.934 -5.947 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -13.118 5.573 -8.727 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.318 4.038 -8.315 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -13.954 4.029 -9.016 1.00 0.00 H new ATOM 1174 N LEU A 78 -14.471 3.028 -3.938 1.00 0.00 N ATOM 1175 CA LEU A 78 -15.145 3.048 -2.655 1.00 0.00 C ATOM 1176 C LEU A 78 -14.329 3.937 -1.724 1.00 0.00 C ATOM 1177 O LEU A 78 -13.132 4.143 -1.944 1.00 0.00 O ATOM 1178 CB LEU A 78 -15.291 1.628 -2.065 1.00 0.00 C ATOM 1179 CG LEU A 78 -16.034 0.617 -2.969 1.00 0.00 C ATOM 1180 CD1 LEU A 78 -15.055 -0.280 -3.737 1.00 0.00 C ATOM 1181 CD2 LEU A 78 -16.989 -0.266 -2.156 1.00 0.00 C ATOM 0 H LEU A 78 -13.487 2.769 -3.861 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.156 3.438 -2.775 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.297 1.237 -1.849 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.819 1.699 -1.114 1.00 0.00 H new ATOM 0 HG LEU A 78 -16.611 1.206 -3.682 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.614 -0.977 -4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.413 0.337 -4.366 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.441 -0.838 -3.030 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.495 -0.965 -2.822 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.423 -0.822 -1.409 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.729 0.361 -1.658 1.00 0.00 H new ATOM 1193 N LYS A 79 -14.955 4.447 -0.670 1.00 0.00 N ATOM 1194 CA LYS A 79 -14.288 5.224 0.360 1.00 0.00 C ATOM 1195 C LYS A 79 -14.971 4.912 1.678 1.00 0.00 C ATOM 1196 O LYS A 79 -16.195 5.031 1.762 1.00 0.00 O ATOM 1197 CB LYS A 79 -14.353 6.719 0.010 1.00 0.00 C ATOM 1198 CG LYS A 79 -13.482 7.564 0.954 1.00 0.00 C ATOM 1199 CD LYS A 79 -13.441 9.024 0.478 1.00 0.00 C ATOM 1200 CE LYS A 79 -12.336 9.813 1.196 1.00 0.00 C ATOM 1201 NZ LYS A 79 -12.200 11.177 0.637 1.00 0.00 N ATOM 0 H LYS A 79 -15.955 4.329 -0.507 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.232 4.966 0.436 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.023 6.866 -1.018 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.387 7.061 0.065 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.880 7.516 1.968 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.471 7.157 0.989 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.271 9.053 -0.598 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.406 9.496 0.662 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.563 9.875 2.260 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.388 9.283 1.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -11.247 11.541 0.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.349 11.147 -0.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.908 11.802 1.071 1.00 0.00 H new ATOM 1215 N ASP A 80 -14.186 4.523 2.686 1.00 0.00 N ATOM 1216 CA ASP A 80 -14.629 4.278 4.060 1.00 0.00 C ATOM 1217 C ASP A 80 -15.943 3.470 4.152 1.00 0.00 C ATOM 1218 O ASP A 80 -16.801 3.733 4.997 1.00 0.00 O ATOM 1219 CB ASP A 80 -14.664 5.612 4.827 1.00 0.00 C ATOM 1220 CG ASP A 80 -14.902 5.429 6.337 1.00 0.00 C ATOM 1221 OD1 ASP A 80 -14.247 4.564 6.960 1.00 0.00 O ATOM 1222 OD2 ASP A 80 -15.699 6.196 6.925 1.00 0.00 O ATOM 0 H ASP A 80 -13.186 4.364 2.562 1.00 0.00 H new ATOM 0 HA ASP A 80 -13.902 3.627 4.545 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -13.722 6.138 4.674 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -15.452 6.242 4.414 1.00 0.00 H new ATOM 1227 N GLY A 81 -16.120 2.491 3.256 1.00 0.00 N ATOM 1228 CA GLY A 81 -17.181 1.495 3.339 1.00 0.00 C ATOM 1229 C GLY A 81 -18.358 1.731 2.396 1.00 0.00 C ATOM 1230 O GLY A 81 -19.330 0.977 2.466 1.00 0.00 O ATOM 0 H GLY A 81 -15.517 2.372 2.442 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.756 0.514 3.128 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.554 1.467 4.363 1.00 0.00 H new ATOM 1234 N GLU A 82 -18.302 2.729 1.511 1.00 0.00 N ATOM 1235 CA GLU A 82 -19.360 3.004 0.542 1.00 0.00 C ATOM 1236 C GLU A 82 -18.744 3.144 -0.843 1.00 0.00 C ATOM 1237 O GLU A 82 -17.667 3.720 -0.984 1.00 0.00 O ATOM 1238 CB GLU A 82 -20.102 4.302 0.901 1.00 0.00 C ATOM 1239 CG GLU A 82 -20.910 4.225 2.203 1.00 0.00 C ATOM 1240 CD GLU A 82 -22.019 3.151 2.211 1.00 0.00 C ATOM 1241 OE1 GLU A 82 -22.596 2.829 1.147 1.00 0.00 O ATOM 1242 OE2 GLU A 82 -22.367 2.653 3.306 1.00 0.00 O ATOM 0 H GLU A 82 -17.514 3.373 1.448 1.00 0.00 H new ATOM 0 HA GLU A 82 -20.073 2.179 0.556 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -19.376 5.111 0.984 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -20.775 4.560 0.084 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -20.226 4.028 3.028 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -21.364 5.198 2.391 1.00 0.00 H new ATOM 1249 N VAL A 83 -19.429 2.628 -1.863 1.00 0.00 N ATOM 1250 CA VAL A 83 -19.095 2.870 -3.260 1.00 0.00 C ATOM 1251 C VAL A 83 -19.406 4.335 -3.566 1.00 0.00 C ATOM 1252 O VAL A 83 -20.435 4.873 -3.147 1.00 0.00 O ATOM 1253 CB VAL A 83 -19.796 1.829 -4.166 1.00 0.00 C ATOM 1254 CG1 VAL A 83 -21.327 1.784 -4.031 1.00 0.00 C ATOM 1255 CG2 VAL A 83 -19.414 2.004 -5.642 1.00 0.00 C ATOM 0 H VAL A 83 -20.241 2.023 -1.737 1.00 0.00 H new ATOM 0 HA VAL A 83 -18.035 2.727 -3.468 1.00 0.00 H new ATOM 0 HB VAL A 83 -19.424 0.872 -3.801 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -21.729 1.026 -4.703 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -21.595 1.537 -3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -21.744 2.757 -4.290 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -19.928 1.253 -6.242 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -19.706 2.999 -5.978 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.337 1.884 -5.756 1.00 0.00 H new ATOM 1265 N VAL A 84 -18.495 4.970 -4.298 1.00 0.00 N ATOM 1266 CA VAL A 84 -18.578 6.361 -4.708 1.00 0.00 C ATOM 1267 C VAL A 84 -18.445 6.476 -6.228 1.00 0.00 C ATOM 1268 O VAL A 84 -18.912 7.473 -6.780 1.00 0.00 O ATOM 1269 CB VAL A 84 -17.550 7.232 -3.948 1.00 0.00 C ATOM 1270 CG1 VAL A 84 -17.746 7.147 -2.424 1.00 0.00 C ATOM 1271 CG2 VAL A 84 -16.087 6.891 -4.281 1.00 0.00 C ATOM 0 H VAL A 84 -17.649 4.509 -4.632 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.561 6.749 -4.441 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.742 8.249 -4.290 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -17.005 7.772 -1.926 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -18.746 7.495 -2.166 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.626 6.114 -2.099 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.423 7.541 -3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.887 5.851 -4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.913 7.038 -5.347 1.00 0.00 H new ATOM 1281 N GLU A 85 -17.880 5.474 -6.921 1.00 0.00 N ATOM 1282 CA GLU A 85 -17.811 5.490 -8.387 1.00 0.00 C ATOM 1283 C GLU A 85 -17.710 4.074 -8.958 1.00 0.00 C ATOM 1284 O GLU A 85 -17.464 3.111 -8.229 1.00 0.00 O ATOM 1285 CB GLU A 85 -16.632 6.374 -8.868 1.00 0.00 C ATOM 1286 CG GLU A 85 -17.077 7.631 -9.632 1.00 0.00 C ATOM 1287 CD GLU A 85 -17.667 7.342 -11.026 1.00 0.00 C ATOM 1288 OE1 GLU A 85 -18.646 6.570 -11.131 1.00 0.00 O ATOM 1289 OE2 GLU A 85 -17.174 7.913 -12.025 1.00 0.00 O ATOM 0 H GLU A 85 -17.467 4.647 -6.490 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.737 5.925 -8.762 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -16.039 6.675 -8.005 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.982 5.780 -9.510 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.821 8.161 -9.037 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.222 8.298 -9.742 1.00 0.00 H new ATOM 1296 N THR A 86 -17.906 3.934 -10.269 1.00 0.00 N ATOM 1297 CA THR A 86 -17.784 2.688 -11.016 1.00 0.00 C ATOM 1298 C THR A 86 -17.304 3.011 -12.440 1.00 0.00 C ATOM 1299 O THR A 86 -17.759 3.982 -13.050 1.00 0.00 O ATOM 1300 CB THR A 86 -19.153 1.980 -11.012 1.00 0.00 C ATOM 1301 OG1 THR A 86 -19.515 1.649 -9.686 1.00 0.00 O ATOM 1302 CG2 THR A 86 -19.198 0.698 -11.854 1.00 0.00 C ATOM 0 H THR A 86 -18.165 4.722 -10.863 1.00 0.00 H new ATOM 0 HA THR A 86 -17.054 2.018 -10.561 1.00 0.00 H new ATOM 0 HB THR A 86 -19.851 2.687 -11.460 1.00 0.00 H new ATOM 0 HG1 THR A 86 -20.386 1.201 -9.687 1.00 0.00 H new ATOM 0 HG21 THR A 86 -20.195 0.261 -11.798 1.00 0.00 H new ATOM 0 HG22 THR A 86 -18.963 0.936 -12.892 1.00 0.00 H new ATOM 0 HG23 THR A 86 -18.468 -0.015 -11.471 1.00 0.00 H new ATOM 1310 N SER A 87 -16.421 2.168 -12.980 1.00 0.00 N ATOM 1311 CA SER A 87 -15.866 2.254 -14.328 1.00 0.00 C ATOM 1312 C SER A 87 -15.672 0.829 -14.861 1.00 0.00 C ATOM 1313 O SER A 87 -15.548 -0.110 -14.073 1.00 0.00 O ATOM 1314 CB SER A 87 -14.523 3.004 -14.289 1.00 0.00 C ATOM 1315 OG SER A 87 -14.639 4.280 -13.675 1.00 0.00 O ATOM 0 H SER A 87 -16.057 1.368 -12.462 1.00 0.00 H new ATOM 0 HA SER A 87 -16.543 2.801 -14.985 1.00 0.00 H new ATOM 0 HB2 SER A 87 -13.791 2.407 -13.746 1.00 0.00 H new ATOM 0 HB3 SER A 87 -14.146 3.124 -15.305 1.00 0.00 H new ATOM 0 HG SER A 87 -13.764 4.721 -13.670 1.00 0.00 H new ATOM 1321 N VAL A 88 -15.652 0.647 -16.184 1.00 0.00 N ATOM 1322 CA VAL A 88 -15.547 -0.664 -16.828 1.00 0.00 C ATOM 1323 C VAL A 88 -14.495 -0.567 -17.939 1.00 0.00 C ATOM 1324 O VAL A 88 -14.331 0.495 -18.551 1.00 0.00 O ATOM 1325 CB VAL A 88 -16.939 -1.103 -17.354 1.00 0.00 C ATOM 1326 CG1 VAL A 88 -16.929 -2.527 -17.932 1.00 0.00 C ATOM 1327 CG2 VAL A 88 -18.023 -1.058 -16.262 1.00 0.00 C ATOM 0 H VAL A 88 -15.709 1.419 -16.848 1.00 0.00 H new ATOM 0 HA VAL A 88 -15.227 -1.429 -16.121 1.00 0.00 H new ATOM 0 HB VAL A 88 -17.172 -0.385 -18.140 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -17.928 -2.783 -18.285 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -16.226 -2.577 -18.763 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.626 -3.232 -17.158 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -18.977 -1.375 -16.683 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -17.746 -1.727 -15.447 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -18.114 -0.041 -15.881 1.00 0.00 H new ATOM 1337 N GLY A 89 -13.807 -1.674 -18.218 1.00 0.00 N ATOM 1338 CA GLY A 89 -12.880 -1.807 -19.333 1.00 0.00 C ATOM 1339 C GLY A 89 -11.463 -1.368 -18.969 1.00 0.00 C ATOM 1340 O GLY A 89 -11.212 -0.836 -17.884 1.00 0.00 O ATOM 0 H GLY A 89 -13.884 -2.523 -17.658 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.862 -2.845 -19.665 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.238 -1.211 -20.172 1.00 0.00 H new ATOM 1344 N PHE A 90 -10.524 -1.610 -19.888 1.00 0.00 N ATOM 1345 CA PHE A 90 -9.136 -1.181 -19.756 1.00 0.00 C ATOM 1346 C PHE A 90 -9.079 0.348 -19.738 1.00 0.00 C ATOM 1347 O PHE A 90 -9.649 0.993 -20.621 1.00 0.00 O ATOM 1348 CB PHE A 90 -8.311 -1.767 -20.911 1.00 0.00 C ATOM 1349 CG PHE A 90 -6.834 -1.416 -20.872 1.00 0.00 C ATOM 1350 CD1 PHE A 90 -6.383 -0.196 -21.417 1.00 0.00 C ATOM 1351 CD2 PHE A 90 -5.906 -2.311 -20.305 1.00 0.00 C ATOM 1352 CE1 PHE A 90 -5.016 0.133 -21.382 1.00 0.00 C ATOM 1353 CE2 PHE A 90 -4.539 -1.985 -20.281 1.00 0.00 C ATOM 1354 CZ PHE A 90 -4.093 -0.764 -20.817 1.00 0.00 C ATOM 0 H PHE A 90 -10.712 -2.116 -20.754 1.00 0.00 H new ATOM 0 HA PHE A 90 -8.712 -1.545 -18.820 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -8.414 -2.852 -20.900 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -8.730 -1.416 -21.854 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -7.090 0.488 -21.863 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -6.245 -3.248 -19.889 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.676 1.074 -21.789 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -3.829 -2.675 -19.849 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.042 -0.516 -20.795 1.00 0.00 H new ATOM 1364 N LYS A 91 -8.359 0.917 -18.767 1.00 0.00 N ATOM 1365 CA LYS A 91 -8.157 2.354 -18.572 1.00 0.00 C ATOM 1366 C LYS A 91 -6.670 2.560 -18.256 1.00 0.00 C ATOM 1367 O LYS A 91 -6.098 1.713 -17.566 1.00 0.00 O ATOM 1368 CB LYS A 91 -9.009 2.856 -17.385 1.00 0.00 C ATOM 1369 CG LYS A 91 -10.262 3.666 -17.745 1.00 0.00 C ATOM 1370 CD LYS A 91 -11.313 2.912 -18.570 1.00 0.00 C ATOM 1371 CE LYS A 91 -12.617 3.716 -18.648 1.00 0.00 C ATOM 1372 NZ LYS A 91 -13.623 3.061 -19.521 1.00 0.00 N ATOM 0 H LYS A 91 -7.878 0.360 -18.061 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.453 2.907 -19.463 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.317 1.993 -16.795 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.376 3.470 -16.745 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.728 4.013 -16.823 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.955 4.552 -18.300 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.932 2.729 -19.575 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.506 1.938 -18.120 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -13.029 3.836 -17.646 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.404 4.716 -19.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -14.482 3.645 -19.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -13.234 2.954 -20.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.859 2.124 -19.137 1.00 0.00 H new ATOM 1386 N PRO A 92 -6.039 3.653 -18.724 1.00 0.00 N ATOM 1387 CA PRO A 92 -4.637 3.935 -18.440 1.00 0.00 C ATOM 1388 C PRO A 92 -4.458 4.421 -16.998 1.00 0.00 C ATOM 1389 O PRO A 92 -5.373 4.996 -16.400 1.00 0.00 O ATOM 1390 CB PRO A 92 -4.236 5.010 -19.454 1.00 0.00 C ATOM 1391 CG PRO A 92 -5.536 5.776 -19.691 1.00 0.00 C ATOM 1392 CD PRO A 92 -6.608 4.692 -19.570 1.00 0.00 C ATOM 0 HA PRO A 92 -4.011 3.048 -18.530 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.453 5.659 -19.063 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -3.855 4.571 -20.376 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.678 6.566 -18.954 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -5.551 6.249 -20.673 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.521 5.094 -19.132 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -6.873 4.295 -20.550 1.00 0.00 H new ATOM 1400 N LYS A 93 -3.245 4.263 -16.453 1.00 0.00 N ATOM 1401 CA LYS A 93 -2.927 4.630 -15.073 1.00 0.00 C ATOM 1402 C LYS A 93 -3.185 6.110 -14.822 1.00 0.00 C ATOM 1403 O LYS A 93 -3.606 6.471 -13.729 1.00 0.00 O ATOM 1404 CB LYS A 93 -1.465 4.232 -14.791 1.00 0.00 C ATOM 1405 CG LYS A 93 -0.981 4.490 -13.350 1.00 0.00 C ATOM 1406 CD LYS A 93 0.192 5.481 -13.284 1.00 0.00 C ATOM 1407 CE LYS A 93 -0.246 6.903 -13.660 1.00 0.00 C ATOM 1408 NZ LYS A 93 0.844 7.901 -13.568 1.00 0.00 N ATOM 0 H LYS A 93 -2.453 3.874 -16.964 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.578 4.094 -14.383 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.344 3.172 -15.013 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.818 4.777 -15.478 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.810 4.875 -12.757 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.678 3.545 -12.899 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.611 5.483 -12.278 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.984 5.154 -13.958 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.637 6.897 -14.677 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.063 7.208 -13.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.577 8.756 -14.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.007 8.146 -12.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.715 7.502 -13.973 1.00 0.00 H new ATOM 1422 N GLU A 94 -2.927 6.983 -15.798 1.00 0.00 N ATOM 1423 CA GLU A 94 -3.052 8.418 -15.613 1.00 0.00 C ATOM 1424 C GLU A 94 -4.518 8.828 -15.411 1.00 0.00 C ATOM 1425 O GLU A 94 -4.807 9.709 -14.599 1.00 0.00 O ATOM 1426 CB GLU A 94 -2.404 9.105 -16.822 1.00 0.00 C ATOM 1427 CG GLU A 94 -2.024 10.557 -16.535 1.00 0.00 C ATOM 1428 CD GLU A 94 -0.711 10.715 -15.737 1.00 0.00 C ATOM 1429 OE1 GLU A 94 -0.512 10.018 -14.716 1.00 0.00 O ATOM 1430 OE2 GLU A 94 0.134 11.553 -16.131 1.00 0.00 O ATOM 0 H GLU A 94 -2.627 6.710 -16.734 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.536 8.734 -14.706 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.513 8.551 -17.116 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.093 9.073 -17.666 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.929 11.091 -17.480 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.834 11.031 -15.981 1.00 0.00 H new ATOM 1437 N ALA A 95 -5.452 8.149 -16.085 1.00 0.00 N ATOM 1438 CA ALA A 95 -6.876 8.352 -15.881 1.00 0.00 C ATOM 1439 C ALA A 95 -7.301 7.819 -14.517 1.00 0.00 C ATOM 1440 O ALA A 95 -8.071 8.467 -13.812 1.00 0.00 O ATOM 1441 CB ALA A 95 -7.657 7.618 -16.971 1.00 0.00 C ATOM 0 H ALA A 95 -5.233 7.443 -16.788 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.086 9.421 -15.926 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.725 7.770 -16.818 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.371 8.007 -17.948 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.432 6.552 -16.925 1.00 0.00 H new ATOM 1447 N LEU A 96 -6.802 6.643 -14.129 1.00 0.00 N ATOM 1448 CA LEU A 96 -7.179 6.030 -12.865 1.00 0.00 C ATOM 1449 C LEU A 96 -6.656 6.857 -11.697 1.00 0.00 C ATOM 1450 O LEU A 96 -7.398 7.072 -10.743 1.00 0.00 O ATOM 1451 CB LEU A 96 -6.688 4.578 -12.767 1.00 0.00 C ATOM 1452 CG LEU A 96 -7.302 3.613 -13.799 1.00 0.00 C ATOM 1453 CD1 LEU A 96 -6.745 2.203 -13.581 1.00 0.00 C ATOM 1454 CD2 LEU A 96 -8.834 3.577 -13.729 1.00 0.00 C ATOM 0 H LEU A 96 -6.135 6.100 -14.677 1.00 0.00 H new ATOM 0 HA LEU A 96 -8.268 6.008 -12.819 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.604 4.568 -12.882 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -6.906 4.203 -11.767 1.00 0.00 H new ATOM 0 HG LEU A 96 -7.029 3.979 -14.789 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -7.181 1.522 -14.312 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.662 2.217 -13.700 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.995 1.864 -12.576 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -9.216 2.882 -14.477 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -9.145 3.250 -12.737 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -9.231 4.573 -13.924 1.00 0.00 H new ATOM 1466 N GLN A 97 -5.424 7.373 -11.761 1.00 0.00 N ATOM 1467 CA GLN A 97 -4.916 8.217 -10.683 1.00 0.00 C ATOM 1468 C GLN A 97 -5.674 9.541 -10.647 1.00 0.00 C ATOM 1469 O GLN A 97 -5.857 10.099 -9.569 1.00 0.00 O ATOM 1470 CB GLN A 97 -3.387 8.400 -10.724 1.00 0.00 C ATOM 1471 CG GLN A 97 -2.855 9.261 -11.874 1.00 0.00 C ATOM 1472 CD GLN A 97 -2.967 10.775 -11.680 1.00 0.00 C ATOM 1473 OE1 GLN A 97 -2.480 11.335 -10.702 1.00 0.00 O ATOM 1474 NE2 GLN A 97 -3.606 11.468 -12.612 1.00 0.00 N ATOM 0 H GLN A 97 -4.774 7.223 -12.533 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.104 7.699 -9.743 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -3.067 8.845 -9.782 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.923 7.416 -10.786 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.806 9.011 -12.035 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.391 8.990 -12.784 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -4.006 10.989 -13.419 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.698 12.480 -12.522 1.00 0.00 H new ATOM 1483 N GLU A 98 -6.149 10.037 -11.798 1.00 0.00 N ATOM 1484 CA GLU A 98 -6.952 11.247 -11.836 1.00 0.00 C ATOM 1485 C GLU A 98 -8.265 10.965 -11.106 1.00 0.00 C ATOM 1486 O GLU A 98 -8.634 11.712 -10.202 1.00 0.00 O ATOM 1487 CB GLU A 98 -7.160 11.720 -13.286 1.00 0.00 C ATOM 1488 CG GLU A 98 -8.021 12.986 -13.360 1.00 0.00 C ATOM 1489 CD GLU A 98 -8.098 13.534 -14.795 1.00 0.00 C ATOM 1490 OE1 GLU A 98 -8.993 13.118 -15.565 1.00 0.00 O ATOM 1491 OE2 GLU A 98 -7.278 14.406 -15.164 1.00 0.00 O ATOM 0 H GLU A 98 -5.986 9.612 -12.711 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.442 12.067 -11.330 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.191 11.913 -13.747 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.634 10.925 -13.862 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -9.026 12.765 -13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.606 13.748 -12.700 1.00 0.00 H new ATOM 1498 N LEU A 99 -8.910 9.842 -11.424 1.00 0.00 N ATOM 1499 CA LEU A 99 -10.150 9.422 -10.781 1.00 0.00 C ATOM 1500 C LEU A 99 -9.951 9.272 -9.270 1.00 0.00 C ATOM 1501 O LEU A 99 -10.779 9.745 -8.497 1.00 0.00 O ATOM 1502 CB LEU A 99 -10.644 8.118 -11.431 1.00 0.00 C ATOM 1503 CG LEU A 99 -11.938 7.547 -10.820 1.00 0.00 C ATOM 1504 CD1 LEU A 99 -13.115 8.524 -10.912 1.00 0.00 C ATOM 1505 CD2 LEU A 99 -12.299 6.246 -11.550 1.00 0.00 C ATOM 0 H LEU A 99 -8.582 9.195 -12.141 1.00 0.00 H new ATOM 0 HA LEU A 99 -10.915 10.185 -10.924 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.808 8.296 -12.494 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.858 7.367 -11.351 1.00 0.00 H new ATOM 0 HG LEU A 99 -11.752 7.365 -9.761 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -14.000 8.070 -10.467 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.869 9.441 -10.377 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.314 8.757 -11.958 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.214 5.833 -11.126 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -12.452 6.453 -12.609 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.488 5.527 -11.434 1.00 0.00 H new ATOM 1517 N VAL A 100 -8.843 8.669 -8.838 1.00 0.00 N ATOM 1518 CA VAL A 100 -8.511 8.531 -7.426 1.00 0.00 C ATOM 1519 C VAL A 100 -8.365 9.914 -6.797 1.00 0.00 C ATOM 1520 O VAL A 100 -8.993 10.176 -5.774 1.00 0.00 O ATOM 1521 CB VAL A 100 -7.245 7.661 -7.274 1.00 0.00 C ATOM 1522 CG1 VAL A 100 -6.628 7.733 -5.868 1.00 0.00 C ATOM 1523 CG2 VAL A 100 -7.581 6.197 -7.603 1.00 0.00 C ATOM 0 H VAL A 100 -8.149 8.261 -9.464 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.313 8.021 -6.892 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.507 8.057 -7.972 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.742 7.100 -5.827 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.349 8.763 -5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -7.355 7.388 -5.133 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.685 5.585 -7.495 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.351 5.838 -6.920 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.945 6.129 -8.628 1.00 0.00 H new ATOM 1533 N ASN A 101 -7.576 10.817 -7.392 1.00 0.00 N ATOM 1534 CA ASN A 101 -7.313 12.125 -6.790 1.00 0.00 C ATOM 1535 C ASN A 101 -8.581 12.976 -6.673 1.00 0.00 C ATOM 1536 O ASN A 101 -8.686 13.784 -5.752 1.00 0.00 O ATOM 1537 CB ASN A 101 -6.144 12.856 -7.477 1.00 0.00 C ATOM 1538 CG ASN A 101 -6.542 14.090 -8.280 1.00 0.00 C ATOM 1539 OD1 ASN A 101 -6.388 15.221 -7.829 1.00 0.00 O ATOM 1540 ND2 ASN A 101 -7.038 13.901 -9.489 1.00 0.00 N ATOM 0 H ASN A 101 -7.111 10.664 -8.287 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.987 11.946 -5.766 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.423 13.153 -6.716 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.637 12.156 -8.141 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -7.300 14.702 -10.064 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.159 12.954 -9.848 1.00 0.00 H new ATOM 1547 N LYS A 102 -9.572 12.754 -7.544 1.00 0.00 N ATOM 1548 CA LYS A 102 -10.894 13.373 -7.427 1.00 0.00 C ATOM 1549 C LYS A 102 -11.683 12.879 -6.201 1.00 0.00 C ATOM 1550 O LYS A 102 -12.614 13.575 -5.792 1.00 0.00 O ATOM 1551 CB LYS A 102 -11.699 13.157 -8.722 1.00 0.00 C ATOM 1552 CG LYS A 102 -11.146 13.995 -9.890 1.00 0.00 C ATOM 1553 CD LYS A 102 -11.786 13.645 -11.242 1.00 0.00 C ATOM 1554 CE LYS A 102 -13.293 13.949 -11.266 1.00 0.00 C ATOM 1555 NZ LYS A 102 -13.898 13.692 -12.597 1.00 0.00 N ATOM 0 H LYS A 102 -9.478 12.138 -8.352 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.734 14.441 -7.277 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.677 12.101 -8.991 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.742 13.420 -8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -11.310 15.052 -9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -10.068 13.847 -9.956 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.291 14.208 -12.033 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -11.627 12.588 -11.455 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.797 13.339 -10.516 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -13.456 14.991 -10.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -14.914 13.911 -12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -13.437 14.293 -13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -13.767 12.692 -12.850 1.00 0.00 H new ATOM 1569 N HIS A 103 -11.330 11.738 -5.597 1.00 0.00 N ATOM 1570 CA HIS A 103 -12.019 11.170 -4.433 1.00 0.00 C ATOM 1571 C HIS A 103 -11.158 11.140 -3.161 1.00 0.00 C ATOM 1572 O HIS A 103 -11.710 10.872 -2.091 1.00 0.00 O ATOM 1573 CB HIS A 103 -12.541 9.762 -4.767 1.00 0.00 C ATOM 1574 CG HIS A 103 -13.703 9.771 -5.727 1.00 0.00 C ATOM 1575 ND1 HIS A 103 -14.986 10.194 -5.454 1.00 0.00 N ATOM 1576 CD2 HIS A 103 -13.686 9.352 -7.029 1.00 0.00 C ATOM 1577 CE1 HIS A 103 -15.721 10.035 -6.568 1.00 0.00 C ATOM 1578 NE2 HIS A 103 -14.968 9.529 -7.561 1.00 0.00 N ATOM 0 H HIS A 103 -10.541 11.173 -5.911 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.855 11.833 -4.212 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -11.730 9.173 -5.194 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -12.844 9.266 -3.845 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -15.319 10.563 -4.563 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -12.831 8.954 -7.555 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -16.769 10.279 -6.654 1.00 0.00 H new ATOM 1586 N LEU A 104 -9.848 11.415 -3.231 1.00 0.00 N ATOM 1587 CA LEU A 104 -8.995 11.567 -2.046 1.00 0.00 C ATOM 1588 C LEU A 104 -9.590 12.618 -1.115 1.00 0.00 C ATOM 1589 O LEU A 104 -9.895 13.737 -1.584 1.00 0.00 O ATOM 1590 CB LEU A 104 -7.550 11.952 -2.416 1.00 0.00 C ATOM 1591 CG LEU A 104 -6.715 10.856 -3.103 1.00 0.00 C ATOM 1592 CD1 LEU A 104 -5.346 11.428 -3.480 1.00 0.00 C ATOM 1593 CD2 LEU A 104 -6.522 9.607 -2.236 1.00 0.00 C ATOM 1594 OXT LEU A 104 -9.741 12.324 0.089 1.00 0.00 O ATOM 0 H LEU A 104 -9.350 11.538 -4.113 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.957 10.602 -1.541 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.583 12.821 -3.073 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.033 12.259 -1.507 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.268 10.543 -3.989 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.751 10.656 -3.967 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.478 12.268 -4.162 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.833 11.768 -2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.925 8.875 -2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.009 9.880 -1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.494 9.176 -1.997 1.00 0.00 H new