USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 873 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 72 THR OG1 : rot 160:sc= 0 USER MOD Set 1.2: A 122 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 113 MET CE :methyl -170:sc= 0 (180deg=-0.17) USER MOD Set 2.2: A 138 CYS SG : rot 42:sc= 0.0736 USER MOD Set 3.1: A 111 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 142 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 102 SER OG : rot -61:sc= 0.123 USER MOD Set 4.2: A 106 MET CE :methyl -114:sc= -0.0261 (180deg=0) USER MOD Set 5.1: A 71 GLN : amide:sc= 0 X(o=0,f=0.026) USER MOD Set 5.2: A 73 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 47 LYS NZ :NH3+ 176:sc= 1.61 (180deg=0.998) USER MOD Set 6.2: A 49 THR OG1 : rot 180:sc= 0.434 USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -11:sc= 0.377 USER MOD Single : A 58 SER OG : rot 29:sc= 0.0562 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 69 HIS : no HE2:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 76 ASN : amide:sc=-0.00696 X(o=-0.007,f=-0.0013) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : A 81 GLN : amide:sc= -0.0166 K(o=-0.017,f=-1.5!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 115 THR OG1 : rot -99:sc= 0.176 USER MOD Single : A 118 SER OG : rot -18:sc= 0.513 USER MOD Single : A 119 LYS NZ :NH3+ 154:sc= 1.17 (180deg=0.925) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot -53:sc= -1.39 USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 HIS : no HD1:sc=-0.00557 K(o=-0.0056,f=-1.3!) USER MOD Single : A 144 LYS NZ :NH3+ 151:sc= 0.0985 (180deg=-0.848!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 42 N GLU A 35 -2.507 22.383 -0.818 1.00 0.00 N ATOM 43 CA GLU A 35 -1.986 21.382 -1.795 1.00 0.00 C ATOM 44 C GLU A 35 -2.417 19.930 -1.421 1.00 0.00 C ATOM 45 O GLU A 35 -1.765 19.233 -0.633 1.00 0.00 O ATOM 46 CB GLU A 35 -0.457 21.587 -2.029 1.00 0.00 C ATOM 47 CG GLU A 35 0.508 21.393 -0.822 1.00 0.00 C ATOM 48 CD GLU A 35 1.800 22.200 -0.820 1.00 0.00 C ATOM 49 OE1 GLU A 35 1.813 23.374 -1.241 1.00 0.00 O ATOM 50 OE2 GLU A 35 2.799 21.717 -0.250 1.00 0.00 O ATOM 0 HA GLU A 35 -2.449 21.550 -2.767 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -0.146 20.900 -2.816 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.312 22.597 -2.411 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.040 21.633 0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 35 0.771 20.337 -0.767 1.00 0.00 H new ATOM 57 N TRP A 36 -3.528 19.479 -2.038 1.00 0.00 N ATOM 58 CA TRP A 36 -3.982 18.056 -2.023 1.00 0.00 C ATOM 59 C TRP A 36 -4.467 17.620 -0.596 1.00 0.00 C ATOM 60 O TRP A 36 -5.208 18.363 0.056 1.00 0.00 O ATOM 61 CB TRP A 36 -2.992 17.115 -2.791 1.00 0.00 C ATOM 62 CG TRP A 36 -2.658 17.327 -4.283 1.00 0.00 C ATOM 63 CD1 TRP A 36 -2.829 18.478 -5.091 1.00 0.00 C ATOM 64 CD2 TRP A 36 -2.124 16.369 -5.134 1.00 0.00 C ATOM 65 NE1 TRP A 36 -2.442 18.249 -6.425 1.00 0.00 N ATOM 66 CE2 TRP A 36 -2.030 16.928 -6.433 1.00 0.00 C ATOM 67 CE3 TRP A 36 -1.757 15.017 -4.909 1.00 0.00 C ATOM 68 CZ2 TRP A 36 -1.603 16.129 -7.522 1.00 0.00 C ATOM 69 CZ3 TRP A 36 -1.319 14.257 -5.992 1.00 0.00 C ATOM 70 CH2 TRP A 36 -1.257 14.798 -7.281 1.00 0.00 C ATOM 0 H TRP A 36 -4.148 20.091 -2.568 1.00 0.00 H new ATOM 0 HA TRP A 36 -4.890 17.948 -2.616 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -2.046 17.143 -2.249 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -3.383 16.102 -2.697 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -3.211 19.420 -4.727 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -2.461 18.905 -7.206 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -1.816 14.586 -3.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -1.546 16.541 -8.519 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -1.022 13.231 -5.833 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -0.936 14.176 -8.103 1.00 0.00 H new ATOM 81 N LEU A 37 -4.072 16.422 -0.129 1.00 0.00 N ATOM 82 CA LEU A 37 -4.453 15.880 1.204 1.00 0.00 C ATOM 83 C LEU A 37 -3.180 15.219 1.796 1.00 0.00 C ATOM 84 O LEU A 37 -2.658 14.251 1.236 1.00 0.00 O ATOM 85 CB LEU A 37 -5.641 14.878 1.054 1.00 0.00 C ATOM 86 CG LEU A 37 -6.534 14.623 2.301 1.00 0.00 C ATOM 87 CD1 LEU A 37 -7.812 13.864 1.887 1.00 0.00 C ATOM 88 CD2 LEU A 37 -5.836 13.852 3.440 1.00 0.00 C ATOM 0 H LEU A 37 -3.475 15.792 -0.664 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.803 16.660 1.880 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.283 15.237 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.233 13.920 0.732 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.771 15.611 2.697 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.432 13.689 2.766 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.369 14.458 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.539 12.908 1.440 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.531 13.719 4.269 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.515 12.876 3.075 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.968 14.415 3.782 1.00 0.00 H new ATOM 100 N ASP A 38 -2.713 15.718 2.957 1.00 0.00 N ATOM 101 CA ASP A 38 -1.581 15.111 3.715 1.00 0.00 C ATOM 102 C ASP A 38 -1.942 13.699 4.288 1.00 0.00 C ATOM 103 O ASP A 38 -2.733 13.583 5.233 1.00 0.00 O ATOM 104 CB ASP A 38 -1.159 16.078 4.862 1.00 0.00 C ATOM 105 CG ASP A 38 -0.392 17.319 4.419 1.00 0.00 C ATOM 106 OD1 ASP A 38 -0.995 18.243 3.837 1.00 0.00 O ATOM 107 OD2 ASP A 38 0.850 17.349 4.554 1.00 0.00 O ATOM 0 H ASP A 38 -3.102 16.550 3.401 1.00 0.00 H new ATOM 0 HA ASP A 38 -0.748 14.965 3.027 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -2.055 16.396 5.395 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -0.544 15.526 5.573 1.00 0.00 H new ATOM 112 N ILE A 39 -1.345 12.636 3.706 1.00 0.00 N ATOM 113 CA ILE A 39 -1.430 11.250 4.273 1.00 0.00 C ATOM 114 C ILE A 39 -0.101 10.812 4.986 1.00 0.00 C ATOM 115 O ILE A 39 0.357 9.675 4.832 1.00 0.00 O ATOM 116 CB ILE A 39 -1.988 10.216 3.228 1.00 0.00 C ATOM 117 CG1 ILE A 39 -1.160 10.092 1.915 1.00 0.00 C ATOM 118 CG2 ILE A 39 -3.488 10.453 2.921 1.00 0.00 C ATOM 119 CD1 ILE A 39 -1.299 8.742 1.197 1.00 0.00 C ATOM 0 H ILE A 39 -0.799 12.699 2.847 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.173 11.267 5.071 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.880 9.252 3.725 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.465 10.885 1.232 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -0.108 10.259 2.147 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -3.832 9.716 2.195 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.067 10.355 3.839 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.622 11.455 2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.689 8.746 0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.965 7.942 1.858 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.343 8.578 0.929 1.00 0.00 H new ATOM 131 N LEU A 40 0.477 11.709 5.816 1.00 0.00 N ATOM 132 CA LEU A 40 1.637 11.434 6.703 1.00 0.00 C ATOM 133 C LEU A 40 1.937 12.676 7.599 1.00 0.00 C ATOM 134 O LEU A 40 1.939 12.539 8.826 1.00 0.00 O ATOM 135 CB LEU A 40 2.924 10.896 5.989 1.00 0.00 C ATOM 136 CG LEU A 40 3.429 9.549 6.566 1.00 0.00 C ATOM 137 CD1 LEU A 40 4.402 8.846 5.606 1.00 0.00 C ATOM 138 CD2 LEU A 40 4.091 9.710 7.950 1.00 0.00 C ATOM 0 H LEU A 40 0.143 12.670 5.892 1.00 0.00 H new ATOM 0 HA LEU A 40 1.331 10.597 7.331 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.716 10.773 4.926 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.716 11.640 6.075 1.00 0.00 H new ATOM 0 HG LEU A 40 2.542 8.927 6.686 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.733 7.906 6.047 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.899 8.646 4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.265 9.487 5.429 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.427 8.737 8.308 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.946 10.381 7.869 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.369 10.126 8.653 1.00 0.00 H new ATOM 150 N GLY A 41 2.215 13.854 6.996 1.00 0.00 N ATOM 151 CA GLY A 41 2.591 15.079 7.737 1.00 0.00 C ATOM 152 C GLY A 41 4.001 15.519 7.320 1.00 0.00 C ATOM 153 O GLY A 41 4.158 16.249 6.336 1.00 0.00 O ATOM 0 H GLY A 41 2.185 13.982 5.984 1.00 0.00 H new ATOM 0 HA2 GLY A 41 1.875 15.875 7.532 1.00 0.00 H new ATOM 0 HA3 GLY A 41 2.560 14.891 8.810 1.00 0.00 H new ATOM 157 N ASN A 42 5.016 15.034 8.055 1.00 0.00 N ATOM 158 CA ASN A 42 6.449 15.209 7.677 1.00 0.00 C ATOM 159 C ASN A 42 6.956 14.332 6.485 1.00 0.00 C ATOM 160 O ASN A 42 7.811 14.803 5.727 1.00 0.00 O ATOM 161 CB ASN A 42 7.367 15.093 8.931 1.00 0.00 C ATOM 162 CG ASN A 42 7.532 13.699 9.583 1.00 0.00 C ATOM 163 OD1 ASN A 42 6.728 13.280 10.414 1.00 0.00 O ATOM 164 ND2 ASN A 42 8.574 12.963 9.217 1.00 0.00 N ATOM 0 H ASN A 42 4.880 14.513 8.921 1.00 0.00 H new ATOM 0 HA ASN A 42 6.512 16.222 7.279 1.00 0.00 H new ATOM 0 HB2 ASN A 42 8.358 15.452 8.654 1.00 0.00 H new ATOM 0 HB3 ASN A 42 6.983 15.774 9.691 1.00 0.00 H new ATOM 0 HD21 ASN A 42 8.715 12.039 9.626 1.00 0.00 H new ATOM 0 HD22 ASN A 42 9.234 13.321 8.527 1.00 0.00 H new ATOM 171 N GLY A 43 6.483 13.075 6.348 1.00 0.00 N ATOM 172 CA GLY A 43 7.083 12.090 5.424 1.00 0.00 C ATOM 173 C GLY A 43 6.476 12.055 4.009 1.00 0.00 C ATOM 174 O GLY A 43 5.720 11.136 3.694 1.00 0.00 O ATOM 0 H GLY A 43 5.683 12.717 6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.149 12.300 5.338 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.988 11.098 5.866 1.00 0.00 H new ATOM 178 N LEU A 44 6.877 13.041 3.185 1.00 0.00 N ATOM 179 CA LEU A 44 6.712 13.110 1.696 1.00 0.00 C ATOM 180 C LEU A 44 5.696 12.153 0.972 1.00 0.00 C ATOM 181 O LEU A 44 6.088 11.290 0.177 1.00 0.00 O ATOM 182 CB LEU A 44 8.120 13.092 1.010 1.00 0.00 C ATOM 183 CG LEU A 44 9.252 14.017 1.573 1.00 0.00 C ATOM 184 CD1 LEU A 44 10.167 13.286 2.582 1.00 0.00 C ATOM 185 CD2 LEU A 44 10.118 14.627 0.454 1.00 0.00 C ATOM 0 H LEU A 44 7.354 13.866 3.549 1.00 0.00 H new ATOM 0 HA LEU A 44 6.195 14.060 1.561 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.488 12.066 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.978 13.348 -0.040 1.00 0.00 H new ATOM 0 HG LEU A 44 8.732 14.821 2.094 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.934 13.972 2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 44 9.572 12.934 3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.642 12.435 2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.888 15.260 0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.589 13.828 -0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.490 15.225 -0.207 1.00 0.00 H new ATOM 197 N LEU A 45 4.388 12.296 1.276 1.00 0.00 N ATOM 198 CA LEU A 45 3.336 11.364 0.781 1.00 0.00 C ATOM 199 C LEU A 45 1.974 12.106 0.834 1.00 0.00 C ATOM 200 O LEU A 45 1.518 12.525 1.906 1.00 0.00 O ATOM 201 CB LEU A 45 3.316 10.037 1.601 1.00 0.00 C ATOM 202 CG LEU A 45 2.525 8.862 0.967 1.00 0.00 C ATOM 203 CD1 LEU A 45 3.202 8.303 -0.296 1.00 0.00 C ATOM 204 CD2 LEU A 45 2.321 7.727 1.985 1.00 0.00 C ATOM 0 H LEU A 45 4.028 13.048 1.863 1.00 0.00 H new ATOM 0 HA LEU A 45 3.549 11.072 -0.247 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.345 9.714 1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.894 10.246 2.584 1.00 0.00 H new ATOM 0 HG LEU A 45 1.558 9.269 0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.605 7.484 -0.697 1.00 0.00 H new ATOM 0 HD12 LEU A 45 3.284 9.092 -1.044 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.197 7.937 -0.044 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.764 6.915 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.291 7.358 2.317 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.763 8.103 2.842 1.00 0.00 H new ATOM 216 N ARG A 46 1.356 12.293 -0.348 1.00 0.00 N ATOM 217 CA ARG A 46 0.273 13.302 -0.542 1.00 0.00 C ATOM 218 C ARG A 46 -0.747 12.822 -1.624 1.00 0.00 C ATOM 219 O ARG A 46 -0.372 12.705 -2.792 1.00 0.00 O ATOM 220 CB ARG A 46 1.011 14.623 -0.914 1.00 0.00 C ATOM 221 CG ARG A 46 0.119 15.856 -1.173 1.00 0.00 C ATOM 222 CD ARG A 46 0.882 17.200 -1.303 1.00 0.00 C ATOM 223 NE ARG A 46 1.661 17.589 -0.087 1.00 0.00 N ATOM 224 CZ ARG A 46 1.145 17.839 1.117 1.00 0.00 C ATOM 225 NH1 ARG A 46 -0.113 18.136 1.324 1.00 0.00 N ATOM 226 NH2 ARG A 46 1.937 17.770 2.148 1.00 0.00 N ATOM 0 H ARG A 46 1.582 11.763 -1.189 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.335 13.453 0.350 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.704 14.866 -0.109 1.00 0.00 H new ATOM 0 HB3 ARG A 46 1.610 14.441 -1.806 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -0.450 15.689 -2.087 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.602 15.942 -0.360 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.564 17.136 -2.151 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.166 17.990 -1.529 1.00 0.00 H new ATOM 0 HE ARG A 46 2.673 17.670 -0.187 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -0.761 18.187 0.538 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -0.445 18.317 2.271 1.00 0.00 H new ATOM 0 HH21 ARG A 46 2.920 17.531 2.021 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.574 17.955 3.083 1.00 0.00 H new ATOM 240 N LYS A 47 -2.030 12.561 -1.270 1.00 0.00 N ATOM 241 CA LYS A 47 -3.006 11.928 -2.211 1.00 0.00 C ATOM 242 C LYS A 47 -4.248 12.803 -2.595 1.00 0.00 C ATOM 243 O LYS A 47 -4.956 13.342 -1.743 1.00 0.00 O ATOM 244 CB LYS A 47 -3.323 10.473 -1.747 1.00 0.00 C ATOM 245 CG LYS A 47 -4.483 10.145 -0.768 1.00 0.00 C ATOM 246 CD LYS A 47 -5.869 10.044 -1.441 1.00 0.00 C ATOM 247 CE LYS A 47 -6.775 8.921 -0.904 1.00 0.00 C ATOM 248 NZ LYS A 47 -8.075 9.000 -1.615 1.00 0.00 N ATOM 0 H LYS A 47 -2.416 12.774 -0.350 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.516 11.859 -3.182 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.502 9.889 -2.650 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.412 10.085 -1.292 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.265 9.202 -0.267 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.521 10.914 0.003 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.385 10.996 -1.319 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.726 9.894 -2.511 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.311 7.948 -1.065 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -6.921 9.031 0.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -8.682 8.209 -1.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -8.542 9.900 -1.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.913 8.946 -2.641 1.00 0.00 H new ATOM 262 N LYS A 48 -4.566 12.850 -3.902 1.00 0.00 N ATOM 263 CA LYS A 48 -5.914 13.232 -4.420 1.00 0.00 C ATOM 264 C LYS A 48 -6.960 12.101 -4.190 1.00 0.00 C ATOM 265 O LYS A 48 -6.647 10.926 -4.397 1.00 0.00 O ATOM 266 CB LYS A 48 -5.798 13.444 -5.965 1.00 0.00 C ATOM 267 CG LYS A 48 -5.325 14.831 -6.444 1.00 0.00 C ATOM 268 CD LYS A 48 -6.479 15.853 -6.577 1.00 0.00 C ATOM 269 CE LYS A 48 -6.051 17.250 -7.067 1.00 0.00 C ATOM 270 NZ LYS A 48 -5.674 17.247 -8.510 1.00 0.00 N ATOM 0 H LYS A 48 -3.899 12.625 -4.640 1.00 0.00 H new ATOM 0 HA LYS A 48 -6.238 14.131 -3.896 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.110 12.696 -6.360 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.774 13.246 -6.409 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.584 15.217 -5.744 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.828 14.726 -7.408 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.222 15.453 -7.267 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.967 15.957 -5.608 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.867 17.955 -6.907 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.207 17.599 -6.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.393 18.206 -8.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.879 16.594 -8.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.487 16.939 -9.081 1.00 0.00 H new ATOM 284 N THR A 49 -8.221 12.459 -3.885 1.00 0.00 N ATOM 285 CA THR A 49 -9.364 11.523 -4.091 1.00 0.00 C ATOM 286 C THR A 49 -9.921 11.859 -5.505 1.00 0.00 C ATOM 287 O THR A 49 -10.741 12.769 -5.672 1.00 0.00 O ATOM 288 CB THR A 49 -10.413 11.616 -2.947 1.00 0.00 C ATOM 289 OG1 THR A 49 -9.793 11.463 -1.674 1.00 0.00 O ATOM 290 CG2 THR A 49 -11.512 10.542 -3.056 1.00 0.00 C ATOM 0 H THR A 49 -8.481 13.368 -3.502 1.00 0.00 H new ATOM 0 HA THR A 49 -9.056 10.478 -4.051 1.00 0.00 H new ATOM 0 HB THR A 49 -10.866 12.603 -3.047 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.472 11.527 -0.970 1.00 0.00 H new ATOM 0 HG21 THR A 49 -12.215 10.656 -2.231 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.041 10.657 -4.002 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.059 9.552 -3.012 1.00 0.00 H new ATOM 298 N LEU A 50 -9.406 11.139 -6.520 1.00 0.00 N ATOM 299 CA LEU A 50 -9.598 11.478 -7.954 1.00 0.00 C ATOM 300 C LEU A 50 -11.073 11.305 -8.430 1.00 0.00 C ATOM 301 O LEU A 50 -11.697 12.307 -8.790 1.00 0.00 O ATOM 302 CB LEU A 50 -8.542 10.702 -8.799 1.00 0.00 C ATOM 303 CG LEU A 50 -8.270 11.253 -10.226 1.00 0.00 C ATOM 304 CD1 LEU A 50 -7.532 12.609 -10.210 1.00 0.00 C ATOM 305 CD2 LEU A 50 -7.462 10.240 -11.061 1.00 0.00 C ATOM 0 H LEU A 50 -8.842 10.302 -6.374 1.00 0.00 H new ATOM 0 HA LEU A 50 -9.421 12.543 -8.104 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.601 10.694 -8.249 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -8.868 9.666 -8.888 1.00 0.00 H new ATOM 0 HG LEU A 50 -9.247 11.411 -10.683 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.368 12.946 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.134 13.345 -9.677 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.571 12.495 -9.708 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.284 10.648 -12.056 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.507 10.045 -10.573 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.023 9.309 -11.146 1.00 0.00 H new ATOM 317 N VAL A 51 -11.638 10.081 -8.359 1.00 0.00 N ATOM 318 CA VAL A 51 -13.116 9.876 -8.315 1.00 0.00 C ATOM 319 C VAL A 51 -13.484 9.276 -6.908 1.00 0.00 C ATOM 320 O VAL A 51 -12.850 8.291 -6.510 1.00 0.00 O ATOM 321 CB VAL A 51 -13.717 9.061 -9.510 1.00 0.00 C ATOM 322 CG1 VAL A 51 -13.654 9.845 -10.840 1.00 0.00 C ATOM 323 CG2 VAL A 51 -13.162 7.635 -9.720 1.00 0.00 C ATOM 0 H VAL A 51 -11.100 9.215 -8.331 1.00 0.00 H new ATOM 0 HA VAL A 51 -13.590 10.849 -8.445 1.00 0.00 H new ATOM 0 HB VAL A 51 -14.753 8.923 -9.201 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -14.082 9.240 -11.640 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -14.220 10.772 -10.743 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -12.616 10.077 -11.077 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -13.656 7.175 -10.576 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.089 7.686 -9.904 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.349 7.037 -8.828 1.00 0.00 H new ATOM 333 N PRO A 52 -14.480 9.799 -6.127 1.00 0.00 N ATOM 334 CA PRO A 52 -14.798 9.288 -4.764 1.00 0.00 C ATOM 335 C PRO A 52 -15.557 7.925 -4.732 1.00 0.00 C ATOM 336 O PRO A 52 -16.032 7.419 -5.755 1.00 0.00 O ATOM 337 CB PRO A 52 -15.605 10.464 -4.170 1.00 0.00 C ATOM 338 CG PRO A 52 -16.285 11.140 -5.360 1.00 0.00 C ATOM 339 CD PRO A 52 -15.268 10.995 -6.489 1.00 0.00 C ATOM 0 HA PRO A 52 -13.907 9.029 -4.193 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -16.341 10.109 -3.448 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -14.952 11.161 -3.644 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -17.230 10.657 -5.608 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -16.507 12.187 -5.153 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -15.761 10.869 -7.453 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -14.635 11.878 -6.568 1.00 0.00 H new ATOM 347 N GLY A 53 -15.665 7.352 -3.519 1.00 0.00 N ATOM 348 CA GLY A 53 -16.384 6.080 -3.297 1.00 0.00 C ATOM 349 C GLY A 53 -17.938 6.161 -3.418 1.00 0.00 C ATOM 350 O GLY A 53 -18.494 7.232 -3.145 1.00 0.00 O ATOM 0 H GLY A 53 -15.261 7.751 -2.672 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -16.018 5.345 -4.014 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.132 5.708 -2.304 1.00 0.00 H new ATOM 354 N PRO A 54 -18.681 5.077 -3.791 1.00 0.00 N ATOM 355 CA PRO A 54 -20.164 5.122 -3.946 1.00 0.00 C ATOM 356 C PRO A 54 -20.980 5.320 -2.615 1.00 0.00 C ATOM 357 O PRO A 54 -20.397 5.144 -1.539 1.00 0.00 O ATOM 358 CB PRO A 54 -20.450 3.780 -4.657 1.00 0.00 C ATOM 359 CG PRO A 54 -19.300 2.844 -4.290 1.00 0.00 C ATOM 360 CD PRO A 54 -18.094 3.769 -4.147 1.00 0.00 C ATOM 0 HA PRO A 54 -20.494 6.000 -4.502 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -21.406 3.366 -4.335 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -20.509 3.917 -5.737 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -19.503 2.308 -3.363 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -19.136 2.093 -5.063 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -17.410 3.416 -3.375 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -17.524 3.827 -5.075 1.00 0.00 H new ATOM 368 N PRO A 55 -22.300 5.688 -2.623 1.00 0.00 N ATOM 369 CA PRO A 55 -23.070 5.994 -1.383 1.00 0.00 C ATOM 370 C PRO A 55 -23.265 4.751 -0.464 1.00 0.00 C ATOM 371 O PRO A 55 -23.900 3.765 -0.848 1.00 0.00 O ATOM 372 CB PRO A 55 -24.388 6.588 -1.925 1.00 0.00 C ATOM 373 CG PRO A 55 -24.519 6.069 -3.357 1.00 0.00 C ATOM 374 CD PRO A 55 -23.077 5.951 -3.851 1.00 0.00 C ATOM 0 HA PRO A 55 -22.552 6.686 -0.719 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -25.237 6.276 -1.317 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -24.364 7.678 -1.904 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -25.029 5.106 -3.386 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -25.097 6.754 -3.977 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -22.967 5.142 -4.574 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -22.748 6.866 -4.344 1.00 0.00 H new ATOM 382 N GLY A 56 -22.632 4.815 0.720 1.00 0.00 N ATOM 383 CA GLY A 56 -22.386 3.628 1.564 1.00 0.00 C ATOM 384 C GLY A 56 -20.884 3.293 1.562 1.00 0.00 C ATOM 385 O GLY A 56 -20.127 3.885 2.336 1.00 0.00 O ATOM 0 H GLY A 56 -22.278 5.684 1.119 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -22.725 3.817 2.583 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -22.958 2.779 1.190 1.00 0.00 H new ATOM 389 N SER A 57 -20.471 2.348 0.689 1.00 0.00 N ATOM 390 CA SER A 57 -19.059 1.893 0.527 1.00 0.00 C ATOM 391 C SER A 57 -18.370 1.420 1.842 1.00 0.00 C ATOM 392 O SER A 57 -17.701 2.207 2.521 1.00 0.00 O ATOM 393 CB SER A 57 -18.206 2.868 -0.320 1.00 0.00 C ATOM 394 OG SER A 57 -17.956 4.105 0.340 1.00 0.00 O ATOM 0 H SER A 57 -21.116 1.867 0.062 1.00 0.00 H new ATOM 0 HA SER A 57 -19.127 0.978 -0.061 1.00 0.00 H new ATOM 0 HB2 SER A 57 -17.255 2.393 -0.563 1.00 0.00 H new ATOM 0 HB3 SER A 57 -18.716 3.062 -1.264 1.00 0.00 H new ATOM 0 HG SER A 57 -18.526 4.173 1.134 1.00 0.00 H new ATOM 400 N SER A 58 -18.569 0.138 2.205 1.00 0.00 N ATOM 401 CA SER A 58 -18.083 -0.414 3.498 1.00 0.00 C ATOM 402 C SER A 58 -16.575 -0.764 3.436 1.00 0.00 C ATOM 403 O SER A 58 -16.136 -1.577 2.617 1.00 0.00 O ATOM 404 CB SER A 58 -18.932 -1.618 3.949 1.00 0.00 C ATOM 405 OG SER A 58 -18.937 -2.679 2.997 1.00 0.00 O ATOM 0 H SER A 58 -19.063 -0.540 1.625 1.00 0.00 H new ATOM 0 HA SER A 58 -18.200 0.364 4.252 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.550 -1.991 4.899 1.00 0.00 H new ATOM 0 HB3 SER A 58 -19.956 -1.289 4.125 1.00 0.00 H new ATOM 0 HG SER A 58 -18.095 -2.673 2.496 1.00 0.00 H new ATOM 411 N ARG A 59 -15.808 -0.118 4.324 1.00 0.00 N ATOM 412 CA ARG A 59 -14.323 -0.225 4.347 1.00 0.00 C ATOM 413 C ARG A 59 -13.843 -1.528 5.092 1.00 0.00 C ATOM 414 O ARG A 59 -14.215 -1.694 6.261 1.00 0.00 O ATOM 415 CB ARG A 59 -13.724 1.053 4.997 1.00 0.00 C ATOM 416 CG ARG A 59 -13.830 2.341 4.142 1.00 0.00 C ATOM 417 CD ARG A 59 -13.234 3.569 4.850 1.00 0.00 C ATOM 418 NE ARG A 59 -13.268 4.729 3.918 1.00 0.00 N ATOM 419 CZ ARG A 59 -12.521 5.829 4.007 1.00 0.00 C ATOM 420 NH1 ARG A 59 -11.670 6.047 4.977 1.00 0.00 N ATOM 421 NH2 ARG A 59 -12.644 6.745 3.091 1.00 0.00 N ATOM 0 H ARG A 59 -16.186 0.493 5.048 1.00 0.00 H new ATOM 0 HA ARG A 59 -13.963 -0.304 3.321 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -14.226 1.226 5.949 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -12.673 0.869 5.219 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -13.315 2.187 3.194 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -14.877 2.533 3.909 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -13.801 3.795 5.753 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -12.209 3.365 5.160 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.924 4.677 3.139 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -11.552 5.355 5.717 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -11.125 6.909 4.993 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -13.303 6.614 2.324 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -12.082 7.595 3.141 1.00 0.00 H new ATOM 435 N PRO A 60 -13.026 -2.450 4.496 1.00 0.00 N ATOM 436 CA PRO A 60 -12.680 -3.756 5.123 1.00 0.00 C ATOM 437 C PRO A 60 -11.752 -3.677 6.376 1.00 0.00 C ATOM 438 O PRO A 60 -10.882 -2.807 6.483 1.00 0.00 O ATOM 439 CB PRO A 60 -12.038 -4.530 3.951 1.00 0.00 C ATOM 440 CG PRO A 60 -11.524 -3.469 2.980 1.00 0.00 C ATOM 441 CD PRO A 60 -12.525 -2.327 3.112 1.00 0.00 C ATOM 0 HA PRO A 60 -13.560 -4.238 5.550 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -11.225 -5.165 4.302 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -12.766 -5.182 3.468 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.515 -3.147 3.239 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -11.485 -3.849 1.959 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -12.052 -1.360 2.943 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -13.332 -2.418 2.386 1.00 0.00 H new ATOM 449 N VAL A 61 -11.958 -4.629 7.304 1.00 0.00 N ATOM 450 CA VAL A 61 -11.145 -4.773 8.551 1.00 0.00 C ATOM 451 C VAL A 61 -9.766 -5.456 8.271 1.00 0.00 C ATOM 452 O VAL A 61 -9.627 -6.242 7.325 1.00 0.00 O ATOM 453 CB VAL A 61 -11.950 -5.497 9.689 1.00 0.00 C ATOM 454 CG1 VAL A 61 -13.152 -4.668 10.193 1.00 0.00 C ATOM 455 CG2 VAL A 61 -12.405 -6.944 9.370 1.00 0.00 C ATOM 0 H VAL A 61 -12.694 -5.330 7.220 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.926 -3.768 8.913 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.212 -5.582 10.486 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.670 -5.219 10.978 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.797 -3.717 10.590 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.838 -4.483 9.367 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.951 -7.350 10.222 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.053 -6.937 8.493 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -11.531 -7.564 9.170 1.00 0.00 H new ATOM 465 N LYS A 62 -8.752 -5.149 9.113 1.00 0.00 N ATOM 466 CA LYS A 62 -7.344 -5.592 8.891 1.00 0.00 C ATOM 467 C LYS A 62 -7.163 -7.149 8.937 1.00 0.00 C ATOM 468 O LYS A 62 -7.429 -7.799 9.954 1.00 0.00 O ATOM 469 CB LYS A 62 -6.423 -4.853 9.906 1.00 0.00 C ATOM 470 CG LYS A 62 -4.915 -4.918 9.553 1.00 0.00 C ATOM 471 CD LYS A 62 -3.994 -4.252 10.596 1.00 0.00 C ATOM 472 CE LYS A 62 -2.508 -4.408 10.214 1.00 0.00 C ATOM 473 NZ LYS A 62 -1.633 -3.758 11.225 1.00 0.00 N ATOM 0 H LYS A 62 -8.878 -4.593 9.959 1.00 0.00 H new ATOM 0 HA LYS A 62 -7.055 -5.321 7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -6.727 -3.808 9.963 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -6.573 -5.283 10.896 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -4.624 -5.962 9.441 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.758 -4.438 8.587 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.241 -3.194 10.679 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.168 -4.698 11.575 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -2.257 -5.466 10.135 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -2.331 -3.965 9.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -0.637 -3.875 10.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.860 -2.745 11.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -1.789 -4.199 12.154 1.00 0.00 H new ATOM 487 N GLY A 63 -6.714 -7.699 7.800 1.00 0.00 N ATOM 488 CA GLY A 63 -6.672 -9.158 7.548 1.00 0.00 C ATOM 489 C GLY A 63 -7.734 -9.617 6.527 1.00 0.00 C ATOM 490 O GLY A 63 -8.584 -10.448 6.861 1.00 0.00 O ATOM 0 H GLY A 63 -6.365 -7.144 7.018 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.682 -9.431 7.184 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.824 -9.689 8.488 1.00 0.00 H new ATOM 494 N GLN A 64 -7.664 -9.088 5.290 1.00 0.00 N ATOM 495 CA GLN A 64 -8.589 -9.446 4.182 1.00 0.00 C ATOM 496 C GLN A 64 -7.806 -9.374 2.841 1.00 0.00 C ATOM 497 O GLN A 64 -6.936 -8.523 2.628 1.00 0.00 O ATOM 498 CB GLN A 64 -9.852 -8.532 4.136 1.00 0.00 C ATOM 499 CG GLN A 64 -10.967 -8.940 5.126 1.00 0.00 C ATOM 500 CD GLN A 64 -12.282 -8.163 4.954 1.00 0.00 C ATOM 501 OE1 GLN A 64 -12.585 -7.247 5.715 1.00 0.00 O ATOM 502 NE2 GLN A 64 -13.100 -8.523 3.975 1.00 0.00 N ATOM 0 H GLN A 64 -6.963 -8.396 5.024 1.00 0.00 H new ATOM 0 HA GLN A 64 -8.955 -10.458 4.353 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -9.552 -7.506 4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -10.258 -8.543 3.124 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -11.170 -10.004 5.008 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -10.604 -8.796 6.144 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -12.841 -9.284 3.348 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -13.989 -8.039 3.849 1.00 0.00 H new ATOM 511 N VAL A 65 -8.174 -10.272 1.912 1.00 0.00 N ATOM 512 CA VAL A 65 -7.539 -10.393 0.569 1.00 0.00 C ATOM 513 C VAL A 65 -8.087 -9.237 -0.333 1.00 0.00 C ATOM 514 O VAL A 65 -9.218 -9.288 -0.823 1.00 0.00 O ATOM 515 CB VAL A 65 -7.785 -11.841 0.011 1.00 0.00 C ATOM 516 CG1 VAL A 65 -7.244 -12.067 -1.417 1.00 0.00 C ATOM 517 CG2 VAL A 65 -7.168 -12.943 0.909 1.00 0.00 C ATOM 0 H VAL A 65 -8.926 -10.944 2.064 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.456 -10.275 0.604 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.872 -11.918 -0.000 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.454 -13.090 -1.728 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.728 -11.373 -2.104 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.167 -11.898 -1.429 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.369 -13.922 0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.091 -12.793 0.981 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.609 -12.891 1.904 1.00 0.00 H new ATOM 527 N VAL A 66 -7.266 -8.185 -0.492 1.00 0.00 N ATOM 528 CA VAL A 66 -7.668 -6.895 -1.120 1.00 0.00 C ATOM 529 C VAL A 66 -6.784 -6.674 -2.383 1.00 0.00 C ATOM 530 O VAL A 66 -5.550 -6.706 -2.311 1.00 0.00 O ATOM 531 CB VAL A 66 -7.622 -5.687 -0.115 1.00 0.00 C ATOM 532 CG1 VAL A 66 -8.744 -5.760 0.946 1.00 0.00 C ATOM 533 CG2 VAL A 66 -6.263 -5.430 0.581 1.00 0.00 C ATOM 0 H VAL A 66 -6.292 -8.197 -0.188 1.00 0.00 H new ATOM 0 HA VAL A 66 -8.714 -6.949 -1.422 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.784 -4.831 -0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -8.668 -4.903 1.615 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.715 -5.748 0.450 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.641 -6.680 1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.353 -4.574 1.250 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.976 -6.311 1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.502 -5.224 -0.172 1.00 0.00 H new ATOM 543 N THR A 67 -7.436 -6.457 -3.541 1.00 0.00 N ATOM 544 CA THR A 67 -6.749 -6.330 -4.857 1.00 0.00 C ATOM 545 C THR A 67 -6.784 -4.844 -5.314 1.00 0.00 C ATOM 546 O THR A 67 -7.792 -4.145 -5.158 1.00 0.00 O ATOM 547 CB THR A 67 -7.388 -7.283 -5.913 1.00 0.00 C ATOM 548 OG1 THR A 67 -7.543 -8.595 -5.382 1.00 0.00 O ATOM 549 CG2 THR A 67 -6.553 -7.432 -7.195 1.00 0.00 C ATOM 0 H THR A 67 -8.450 -6.364 -3.599 1.00 0.00 H new ATOM 0 HA THR A 67 -5.707 -6.632 -4.755 1.00 0.00 H new ATOM 0 HB THR A 67 -8.345 -6.821 -6.158 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.947 -9.177 -6.060 1.00 0.00 H new ATOM 0 HG21 THR A 67 -7.060 -8.109 -7.883 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.435 -6.457 -7.667 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.572 -7.836 -6.945 1.00 0.00 H new ATOM 557 N VAL A 68 -5.661 -4.395 -5.897 1.00 0.00 N ATOM 558 CA VAL A 68 -5.488 -3.005 -6.400 1.00 0.00 C ATOM 559 C VAL A 68 -4.893 -3.056 -7.838 1.00 0.00 C ATOM 560 O VAL A 68 -3.957 -3.814 -8.121 1.00 0.00 O ATOM 561 CB VAL A 68 -4.610 -2.114 -5.448 1.00 0.00 C ATOM 562 CG1 VAL A 68 -5.309 -1.810 -4.105 1.00 0.00 C ATOM 563 CG2 VAL A 68 -3.176 -2.641 -5.197 1.00 0.00 C ATOM 0 H VAL A 68 -4.838 -4.982 -6.038 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.468 -2.529 -6.424 1.00 0.00 H new ATOM 0 HB VAL A 68 -4.499 -1.184 -6.006 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.657 -1.192 -3.487 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.242 -1.279 -4.293 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.521 -2.744 -3.586 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.650 -1.959 -4.529 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.226 -3.629 -4.740 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.641 -2.706 -6.145 1.00 0.00 H new ATOM 573 N HIS A 69 -5.376 -2.148 -8.707 1.00 0.00 N ATOM 574 CA HIS A 69 -4.641 -1.735 -9.928 1.00 0.00 C ATOM 575 C HIS A 69 -3.641 -0.630 -9.496 1.00 0.00 C ATOM 576 O HIS A 69 -4.016 0.537 -9.329 1.00 0.00 O ATOM 577 CB HIS A 69 -5.639 -1.274 -11.032 1.00 0.00 C ATOM 578 CG HIS A 69 -5.087 -0.630 -12.320 1.00 0.00 C ATOM 579 ND1 HIS A 69 -5.788 0.319 -13.045 1.00 0.00 N ATOM 580 CD2 HIS A 69 -3.853 -0.881 -12.960 1.00 0.00 C ATOM 581 CE1 HIS A 69 -4.905 0.550 -14.065 1.00 0.00 C ATOM 582 NE2 HIS A 69 -3.709 -0.119 -14.109 1.00 0.00 N ATOM 0 H HIS A 69 -6.276 -1.682 -8.589 1.00 0.00 H new ATOM 0 HA HIS A 69 -4.085 -2.561 -10.372 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -6.229 -2.143 -11.325 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -6.326 -0.561 -10.577 1.00 0.00 H new ATOM 0 HD1 HIS A 69 -6.705 0.730 -12.869 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -3.113 -1.580 -12.599 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -5.151 1.262 -14.839 1.00 0.00 H new ATOM 590 N LEU A 70 -2.365 -1.026 -9.343 1.00 0.00 N ATOM 591 CA LEU A 70 -1.250 -0.075 -9.133 1.00 0.00 C ATOM 592 C LEU A 70 -0.756 0.387 -10.530 1.00 0.00 C ATOM 593 O LEU A 70 -0.012 -0.321 -11.216 1.00 0.00 O ATOM 594 CB LEU A 70 -0.143 -0.763 -8.278 1.00 0.00 C ATOM 595 CG LEU A 70 1.154 0.058 -8.022 1.00 0.00 C ATOM 596 CD1 LEU A 70 0.888 1.350 -7.228 1.00 0.00 C ATOM 597 CD2 LEU A 70 2.224 -0.789 -7.310 1.00 0.00 C ATOM 0 H LEU A 70 -2.075 -2.004 -9.361 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.560 0.810 -8.577 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -0.574 -1.028 -7.313 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.136 -1.695 -8.769 1.00 0.00 H new ATOM 0 HG LEU A 70 1.529 0.346 -9.004 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.826 1.884 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.195 1.982 -7.784 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.454 1.099 -6.260 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.117 -0.185 -7.147 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.837 -1.132 -6.350 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.477 -1.650 -7.928 1.00 0.00 H new ATOM 609 N GLN A 71 -1.191 1.587 -10.931 1.00 0.00 N ATOM 610 CA GLN A 71 -0.844 2.171 -12.247 1.00 0.00 C ATOM 611 C GLN A 71 0.408 3.066 -12.054 1.00 0.00 C ATOM 612 O GLN A 71 0.313 4.196 -11.564 1.00 0.00 O ATOM 613 CB GLN A 71 -2.080 2.959 -12.736 1.00 0.00 C ATOM 614 CG GLN A 71 -1.999 3.472 -14.188 1.00 0.00 C ATOM 615 CD GLN A 71 -2.982 4.621 -14.451 1.00 0.00 C ATOM 616 OE1 GLN A 71 -4.189 4.414 -14.561 1.00 0.00 O ATOM 617 NE2 GLN A 71 -2.490 5.847 -14.548 1.00 0.00 N ATOM 0 H GLN A 71 -1.791 2.184 -10.361 1.00 0.00 H new ATOM 0 HA GLN A 71 -0.599 1.422 -13.000 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.959 2.321 -12.641 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.233 3.812 -12.074 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.984 3.809 -14.397 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -2.209 2.652 -14.874 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.486 6.003 -14.454 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.115 6.635 -14.716 1.00 0.00 H new ATOM 626 N THR A 72 1.582 2.539 -12.438 1.00 0.00 N ATOM 627 CA THR A 72 2.881 3.230 -12.227 1.00 0.00 C ATOM 628 C THR A 72 3.066 4.284 -13.359 1.00 0.00 C ATOM 629 O THR A 72 3.110 3.935 -14.542 1.00 0.00 O ATOM 630 CB THR A 72 4.048 2.196 -12.172 1.00 0.00 C ATOM 631 OG1 THR A 72 3.760 1.151 -11.244 1.00 0.00 O ATOM 632 CG2 THR A 72 5.403 2.803 -11.768 1.00 0.00 C ATOM 0 H THR A 72 1.666 1.633 -12.899 1.00 0.00 H new ATOM 0 HA THR A 72 2.889 3.749 -11.268 1.00 0.00 H new ATOM 0 HB THR A 72 4.128 1.819 -13.191 1.00 0.00 H new ATOM 0 HG1 THR A 72 4.318 0.371 -11.446 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.162 2.021 -11.753 1.00 0.00 H new ATOM 0 HG22 THR A 72 5.687 3.570 -12.488 1.00 0.00 H new ATOM 0 HG23 THR A 72 5.321 3.248 -10.776 1.00 0.00 H new ATOM 640 N SER A 73 3.138 5.565 -12.966 1.00 0.00 N ATOM 641 CA SER A 73 3.301 6.709 -13.906 1.00 0.00 C ATOM 642 C SER A 73 4.234 7.779 -13.268 1.00 0.00 C ATOM 643 O SER A 73 4.357 7.879 -12.042 1.00 0.00 O ATOM 644 CB SER A 73 1.921 7.306 -14.287 1.00 0.00 C ATOM 645 OG SER A 73 1.114 6.349 -14.965 1.00 0.00 O ATOM 0 H SER A 73 3.086 5.848 -11.987 1.00 0.00 H new ATOM 0 HA SER A 73 3.764 6.356 -14.828 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.408 7.646 -13.387 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.063 8.180 -14.922 1.00 0.00 H new ATOM 0 HG SER A 73 0.250 6.752 -15.192 1.00 0.00 H new ATOM 651 N LEU A 74 4.904 8.579 -14.119 1.00 0.00 N ATOM 652 CA LEU A 74 5.899 9.588 -13.665 1.00 0.00 C ATOM 653 C LEU A 74 5.484 11.017 -14.095 1.00 0.00 C ATOM 654 O LEU A 74 5.078 11.263 -15.237 1.00 0.00 O ATOM 655 CB LEU A 74 7.303 9.267 -14.249 1.00 0.00 C ATOM 656 CG LEU A 74 8.021 8.007 -13.706 1.00 0.00 C ATOM 657 CD1 LEU A 74 9.234 7.676 -14.590 1.00 0.00 C ATOM 658 CD2 LEU A 74 8.458 8.144 -12.238 1.00 0.00 C ATOM 0 H LEU A 74 4.778 8.551 -15.131 1.00 0.00 H new ATOM 0 HA LEU A 74 5.937 9.545 -12.577 1.00 0.00 H new ATOM 0 HB2 LEU A 74 7.204 9.161 -15.329 1.00 0.00 H new ATOM 0 HB3 LEU A 74 7.948 10.127 -14.071 1.00 0.00 H new ATOM 0 HG LEU A 74 7.298 7.192 -13.740 1.00 0.00 H new ATOM 0 HD11 LEU A 74 9.735 6.789 -14.203 1.00 0.00 H new ATOM 0 HD12 LEU A 74 8.900 7.488 -15.610 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.928 8.516 -14.584 1.00 0.00 H new ATOM 0 HD21 LEU A 74 8.955 7.228 -11.919 1.00 0.00 H new ATOM 0 HD22 LEU A 74 9.147 8.983 -12.140 1.00 0.00 H new ATOM 0 HD23 LEU A 74 7.583 8.319 -11.613 1.00 0.00 H new ATOM 670 N GLU A 75 5.733 11.979 -13.189 1.00 0.00 N ATOM 671 CA GLU A 75 5.872 13.426 -13.521 1.00 0.00 C ATOM 672 C GLU A 75 6.998 13.740 -14.570 1.00 0.00 C ATOM 673 O GLU A 75 6.759 14.498 -15.518 1.00 0.00 O ATOM 674 CB GLU A 75 6.100 14.256 -12.215 1.00 0.00 C ATOM 675 CG GLU A 75 5.107 14.069 -11.029 1.00 0.00 C ATOM 676 CD GLU A 75 5.425 12.958 -10.026 1.00 0.00 C ATOM 677 OE1 GLU A 75 5.945 11.894 -10.421 1.00 0.00 O ATOM 678 OE2 GLU A 75 5.120 13.147 -8.831 1.00 0.00 O ATOM 0 H GLU A 75 5.846 11.782 -12.195 1.00 0.00 H new ATOM 0 HA GLU A 75 4.935 13.718 -13.996 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.101 14.027 -11.848 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.094 15.311 -12.488 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.049 15.011 -10.484 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.117 13.879 -11.443 1.00 0.00 H new ATOM 685 N ASN A 76 8.198 13.141 -14.400 1.00 0.00 N ATOM 686 CA ASN A 76 9.329 13.250 -15.360 1.00 0.00 C ATOM 687 C ASN A 76 9.125 12.481 -16.707 1.00 0.00 C ATOM 688 O ASN A 76 9.185 13.128 -17.757 1.00 0.00 O ATOM 689 CB ASN A 76 10.691 12.970 -14.655 1.00 0.00 C ATOM 690 CG ASN A 76 10.948 11.573 -14.041 1.00 0.00 C ATOM 691 OD1 ASN A 76 11.544 10.697 -14.666 1.00 0.00 O ATOM 692 ND2 ASN A 76 10.527 11.342 -12.806 1.00 0.00 N ATOM 0 H ASN A 76 8.414 12.563 -13.588 1.00 0.00 H new ATOM 0 HA ASN A 76 9.353 14.289 -15.690 1.00 0.00 H new ATOM 0 HB2 ASN A 76 11.482 13.160 -15.381 1.00 0.00 H new ATOM 0 HB3 ASN A 76 10.806 13.705 -13.858 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.697 10.435 -12.370 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.033 12.071 -12.291 1.00 0.00 H new ATOM 699 N GLY A 77 8.896 11.149 -16.693 1.00 0.00 N ATOM 700 CA GLY A 77 8.767 10.341 -17.935 1.00 0.00 C ATOM 701 C GLY A 77 7.476 9.505 -18.095 1.00 0.00 C ATOM 702 O GLY A 77 7.561 8.308 -18.383 1.00 0.00 O ATOM 0 H GLY A 77 8.796 10.606 -15.835 1.00 0.00 H new ATOM 0 HA2 GLY A 77 8.842 11.016 -18.788 1.00 0.00 H new ATOM 0 HA3 GLY A 77 9.619 9.663 -17.989 1.00 0.00 H new ATOM 706 N THR A 78 6.300 10.156 -17.981 1.00 0.00 N ATOM 707 CA THR A 78 4.974 9.635 -18.438 1.00 0.00 C ATOM 708 C THR A 78 4.551 8.192 -17.976 1.00 0.00 C ATOM 709 O THR A 78 5.007 7.724 -16.932 1.00 0.00 O ATOM 710 CB THR A 78 4.730 10.090 -19.916 1.00 0.00 C ATOM 711 OG1 THR A 78 3.337 10.062 -20.216 1.00 0.00 O ATOM 712 CG2 THR A 78 5.478 9.307 -21.012 1.00 0.00 C ATOM 0 H THR A 78 6.233 11.082 -17.559 1.00 0.00 H new ATOM 0 HA THR A 78 4.188 10.109 -17.850 1.00 0.00 H new ATOM 0 HB THR A 78 5.144 11.098 -19.943 1.00 0.00 H new ATOM 0 HG1 THR A 78 3.196 10.350 -21.142 1.00 0.00 H new ATOM 0 HG21 THR A 78 5.225 9.718 -21.989 1.00 0.00 H new ATOM 0 HG22 THR A 78 6.553 9.391 -20.850 1.00 0.00 H new ATOM 0 HG23 THR A 78 5.186 8.258 -20.973 1.00 0.00 H new ATOM 720 N ARG A 79 3.639 7.523 -18.707 1.00 0.00 N ATOM 721 CA ARG A 79 2.934 6.294 -18.246 1.00 0.00 C ATOM 722 C ARG A 79 3.822 5.015 -18.405 1.00 0.00 C ATOM 723 O ARG A 79 4.075 4.543 -19.521 1.00 0.00 O ATOM 724 CB ARG A 79 1.604 6.249 -19.051 1.00 0.00 C ATOM 725 CG ARG A 79 0.501 5.317 -18.494 1.00 0.00 C ATOM 726 CD ARG A 79 -0.761 5.357 -19.378 1.00 0.00 C ATOM 727 NE ARG A 79 -1.862 4.547 -18.790 1.00 0.00 N ATOM 728 CZ ARG A 79 -2.950 5.009 -18.171 1.00 0.00 C ATOM 729 NH1 ARG A 79 -3.154 6.276 -17.917 1.00 0.00 N ATOM 730 NH2 ARG A 79 -3.851 4.156 -17.776 1.00 0.00 N ATOM 0 H ARG A 79 3.363 7.817 -19.644 1.00 0.00 H new ATOM 0 HA ARG A 79 2.721 6.318 -17.177 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.202 7.261 -19.106 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.831 5.940 -20.071 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.878 4.296 -18.439 1.00 0.00 H new ATOM 0 HG3 ARG A 79 0.246 5.618 -17.478 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.091 6.389 -19.498 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -0.522 4.981 -20.373 1.00 0.00 H new ATOM 0 HE ARG A 79 -1.776 3.534 -18.868 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -2.461 6.970 -18.196 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -4.006 6.570 -17.440 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -3.717 3.159 -17.942 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -4.691 4.485 -17.301 1.00 0.00 H new ATOM 744 N VAL A 80 4.309 4.489 -17.267 1.00 0.00 N ATOM 745 CA VAL A 80 5.413 3.484 -17.233 1.00 0.00 C ATOM 746 C VAL A 80 4.860 2.031 -17.370 1.00 0.00 C ATOM 747 O VAL A 80 5.110 1.387 -18.393 1.00 0.00 O ATOM 748 CB VAL A 80 6.360 3.718 -15.993 1.00 0.00 C ATOM 749 CG1 VAL A 80 7.559 2.746 -15.946 1.00 0.00 C ATOM 750 CG2 VAL A 80 6.935 5.147 -15.887 1.00 0.00 C ATOM 0 H VAL A 80 3.957 4.740 -16.343 1.00 0.00 H new ATOM 0 HA VAL A 80 6.051 3.626 -18.106 1.00 0.00 H new ATOM 0 HB VAL A 80 5.689 3.537 -15.153 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.169 2.962 -15.069 1.00 0.00 H new ATOM 0 HG12 VAL A 80 7.194 1.720 -15.890 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.162 2.868 -16.846 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.574 5.218 -15.007 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.520 5.371 -16.779 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.117 5.863 -15.800 1.00 0.00 H new ATOM 760 N GLN A 81 4.183 1.507 -16.329 1.00 0.00 N ATOM 761 CA GLN A 81 3.920 0.049 -16.182 1.00 0.00 C ATOM 762 C GLN A 81 2.571 -0.126 -15.436 1.00 0.00 C ATOM 763 O GLN A 81 2.461 0.164 -14.241 1.00 0.00 O ATOM 764 CB GLN A 81 5.132 -0.604 -15.454 1.00 0.00 C ATOM 765 CG GLN A 81 5.163 -2.148 -15.376 1.00 0.00 C ATOM 766 CD GLN A 81 4.306 -2.761 -14.256 1.00 0.00 C ATOM 767 OE1 GLN A 81 3.217 -3.279 -14.503 1.00 0.00 O ATOM 768 NE2 GLN A 81 4.774 -2.716 -13.015 1.00 0.00 N ATOM 0 H GLN A 81 3.803 2.071 -15.569 1.00 0.00 H new ATOM 0 HA GLN A 81 3.823 -0.457 -17.143 1.00 0.00 H new ATOM 0 HB2 GLN A 81 6.043 -0.273 -15.952 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.165 -0.214 -14.437 1.00 0.00 H new ATOM 0 HG2 GLN A 81 4.828 -2.552 -16.331 1.00 0.00 H new ATOM 0 HG3 GLN A 81 6.196 -2.469 -15.239 1.00 0.00 H new ATOM 0 HE21 GLN A 81 5.678 -2.283 -12.826 1.00 0.00 H new ATOM 0 HE22 GLN A 81 4.230 -3.114 -12.250 1.00 0.00 H new ATOM 777 N GLU A 82 1.551 -0.627 -16.155 1.00 0.00 N ATOM 778 CA GLU A 82 0.171 -0.787 -15.611 1.00 0.00 C ATOM 779 C GLU A 82 -0.029 -2.219 -15.024 1.00 0.00 C ATOM 780 O GLU A 82 -0.005 -3.211 -15.760 1.00 0.00 O ATOM 781 CB GLU A 82 -0.867 -0.448 -16.717 1.00 0.00 C ATOM 782 CG GLU A 82 -0.813 1.023 -17.196 1.00 0.00 C ATOM 783 CD GLU A 82 -1.986 1.489 -18.026 1.00 0.00 C ATOM 784 OE1 GLU A 82 -3.107 1.603 -17.492 1.00 0.00 O ATOM 785 OE2 GLU A 82 -1.775 1.906 -19.181 1.00 0.00 O ATOM 0 H GLU A 82 1.648 -0.933 -17.123 1.00 0.00 H new ATOM 0 HA GLU A 82 0.019 -0.090 -14.787 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.701 -1.105 -17.571 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -1.868 -0.661 -16.341 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.733 1.667 -16.321 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.098 1.162 -17.778 1.00 0.00 H new ATOM 792 N GLU A 83 -0.203 -2.316 -13.693 1.00 0.00 N ATOM 793 CA GLU A 83 -0.170 -3.612 -12.961 1.00 0.00 C ATOM 794 C GLU A 83 -1.601 -3.967 -12.402 1.00 0.00 C ATOM 795 O GLU A 83 -1.921 -3.518 -11.293 1.00 0.00 O ATOM 796 CB GLU A 83 0.953 -3.465 -11.893 1.00 0.00 C ATOM 797 CG GLU A 83 1.377 -4.768 -11.176 1.00 0.00 C ATOM 798 CD GLU A 83 2.624 -4.596 -10.322 1.00 0.00 C ATOM 799 OE1 GLU A 83 2.524 -4.033 -9.214 1.00 0.00 O ATOM 800 OE2 GLU A 83 3.711 -5.037 -10.754 1.00 0.00 O ATOM 0 H GLU A 83 -0.370 -1.509 -13.091 1.00 0.00 H new ATOM 0 HA GLU A 83 0.070 -4.466 -13.595 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.832 -3.035 -12.374 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.621 -2.750 -11.140 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.557 -5.114 -10.547 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.557 -5.544 -11.920 1.00 0.00 H new ATOM 807 N PRO A 84 -2.499 -4.726 -13.109 1.00 0.00 N ATOM 808 CA PRO A 84 -3.925 -4.897 -12.706 1.00 0.00 C ATOM 809 C PRO A 84 -4.178 -5.769 -11.443 1.00 0.00 C ATOM 810 O PRO A 84 -4.723 -5.243 -10.470 1.00 0.00 O ATOM 811 CB PRO A 84 -4.600 -5.409 -13.997 1.00 0.00 C ATOM 812 CG PRO A 84 -3.484 -6.094 -14.783 1.00 0.00 C ATOM 813 CD PRO A 84 -2.245 -5.257 -14.465 1.00 0.00 C ATOM 0 HA PRO A 84 -4.354 -3.960 -12.351 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.408 -6.105 -13.770 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -5.037 -4.588 -14.566 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.356 -7.131 -14.474 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.696 -6.104 -15.852 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -1.339 -5.862 -14.492 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.112 -4.453 -15.188 1.00 0.00 H new ATOM 821 N GLU A 85 -3.797 -7.064 -11.438 1.00 0.00 N ATOM 822 CA GLU A 85 -3.969 -7.952 -10.255 1.00 0.00 C ATOM 823 C GLU A 85 -2.685 -7.935 -9.362 1.00 0.00 C ATOM 824 O GLU A 85 -1.809 -8.799 -9.481 1.00 0.00 O ATOM 825 CB GLU A 85 -4.414 -9.378 -10.732 1.00 0.00 C ATOM 826 CG GLU A 85 -5.899 -9.758 -10.477 1.00 0.00 C ATOM 827 CD GLU A 85 -6.940 -8.842 -11.093 1.00 0.00 C ATOM 828 OE1 GLU A 85 -7.173 -8.897 -12.316 1.00 0.00 O ATOM 829 OE2 GLU A 85 -7.513 -8.000 -10.370 1.00 0.00 O ATOM 0 H GLU A 85 -3.366 -7.524 -12.240 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.767 -7.583 -9.610 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.220 -9.457 -11.802 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -3.782 -10.116 -10.238 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -6.064 -10.767 -10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -6.065 -9.790 -9.400 1.00 0.00 H new ATOM 836 N LEU A 86 -2.619 -6.950 -8.443 1.00 0.00 N ATOM 837 CA LEU A 86 -1.656 -6.955 -7.310 1.00 0.00 C ATOM 838 C LEU A 86 -2.486 -7.267 -6.033 1.00 0.00 C ATOM 839 O LEU A 86 -3.045 -6.365 -5.400 1.00 0.00 O ATOM 840 CB LEU A 86 -0.878 -5.606 -7.264 1.00 0.00 C ATOM 841 CG LEU A 86 0.108 -5.399 -6.075 1.00 0.00 C ATOM 842 CD1 LEU A 86 1.253 -6.431 -6.024 1.00 0.00 C ATOM 843 CD2 LEU A 86 0.680 -3.972 -6.091 1.00 0.00 C ATOM 0 H LEU A 86 -3.226 -6.130 -8.460 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.881 -7.715 -7.411 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.315 -5.508 -8.192 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.606 -4.795 -7.245 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.481 -5.553 -5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.896 -6.220 -5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.836 -7.433 -5.925 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.838 -6.371 -6.942 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.366 -3.846 -5.254 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.214 -3.805 -7.026 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.134 -3.253 -6.004 1.00 0.00 H new ATOM 855 N VAL A 87 -2.564 -8.566 -5.687 1.00 0.00 N ATOM 856 CA VAL A 87 -3.370 -9.064 -4.540 1.00 0.00 C ATOM 857 C VAL A 87 -2.476 -9.205 -3.267 1.00 0.00 C ATOM 858 O VAL A 87 -1.318 -9.635 -3.334 1.00 0.00 O ATOM 859 CB VAL A 87 -4.153 -10.348 -4.969 1.00 0.00 C ATOM 860 CG1 VAL A 87 -3.288 -11.611 -5.186 1.00 0.00 C ATOM 861 CG2 VAL A 87 -5.302 -10.664 -3.994 1.00 0.00 C ATOM 0 H VAL A 87 -2.073 -9.305 -6.190 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.136 -8.344 -4.252 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.554 -10.091 -5.949 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.927 -12.443 -5.481 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.556 -11.420 -5.971 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.770 -11.861 -4.260 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.823 -11.563 -4.325 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.897 -10.826 -2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.000 -9.827 -3.971 1.00 0.00 H new ATOM 871 N PHE A 88 -3.039 -8.814 -2.110 1.00 0.00 N ATOM 872 CA PHE A 88 -2.286 -8.722 -0.828 1.00 0.00 C ATOM 873 C PHE A 88 -3.237 -8.749 0.402 1.00 0.00 C ATOM 874 O PHE A 88 -4.386 -8.303 0.339 1.00 0.00 O ATOM 875 CB PHE A 88 -1.327 -7.487 -0.809 1.00 0.00 C ATOM 876 CG PHE A 88 -1.942 -6.075 -0.676 1.00 0.00 C ATOM 877 CD1 PHE A 88 -2.572 -5.451 -1.759 1.00 0.00 C ATOM 878 CD2 PHE A 88 -1.837 -5.391 0.539 1.00 0.00 C ATOM 879 CE1 PHE A 88 -3.104 -4.172 -1.620 1.00 0.00 C ATOM 880 CE2 PHE A 88 -2.372 -4.115 0.677 1.00 0.00 C ATOM 881 CZ PHE A 88 -3.001 -3.504 -0.403 1.00 0.00 C ATOM 0 H PHE A 88 -4.022 -8.553 -2.028 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.657 -9.609 -0.756 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.628 -7.623 0.017 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.742 -7.508 -1.728 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -2.646 -5.964 -2.707 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.337 -5.857 1.376 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.597 -3.698 -2.456 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -2.299 -3.598 1.623 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.410 -2.510 -0.297 1.00 0.00 H new ATOM 891 N THR A 89 -2.700 -9.196 1.554 1.00 0.00 N ATOM 892 CA THR A 89 -3.401 -9.111 2.867 1.00 0.00 C ATOM 893 C THR A 89 -3.370 -7.637 3.384 1.00 0.00 C ATOM 894 O THR A 89 -2.320 -6.989 3.374 1.00 0.00 O ATOM 895 CB THR A 89 -2.755 -10.107 3.878 1.00 0.00 C ATOM 896 OG1 THR A 89 -2.736 -11.425 3.335 1.00 0.00 O ATOM 897 CG2 THR A 89 -3.487 -10.204 5.228 1.00 0.00 C ATOM 0 H THR A 89 -1.776 -9.624 1.610 1.00 0.00 H new ATOM 0 HA THR A 89 -4.447 -9.397 2.753 1.00 0.00 H new ATOM 0 HB THR A 89 -1.755 -9.709 4.051 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.326 -12.039 3.980 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.972 -10.918 5.871 1.00 0.00 H new ATOM 0 HG22 THR A 89 -3.497 -9.225 5.708 1.00 0.00 H new ATOM 0 HG23 THR A 89 -4.512 -10.538 5.063 1.00 0.00 H new ATOM 905 N LEU A 90 -4.535 -7.134 3.841 1.00 0.00 N ATOM 906 CA LEU A 90 -4.739 -5.706 4.218 1.00 0.00 C ATOM 907 C LEU A 90 -3.836 -5.301 5.418 1.00 0.00 C ATOM 908 O LEU A 90 -4.018 -5.795 6.536 1.00 0.00 O ATOM 909 CB LEU A 90 -6.254 -5.507 4.532 1.00 0.00 C ATOM 910 CG LEU A 90 -6.832 -4.063 4.523 1.00 0.00 C ATOM 911 CD1 LEU A 90 -8.341 -4.109 4.809 1.00 0.00 C ATOM 912 CD2 LEU A 90 -6.181 -3.058 5.498 1.00 0.00 C ATOM 0 H LEU A 90 -5.371 -7.705 3.962 1.00 0.00 H new ATOM 0 HA LEU A 90 -4.449 -5.054 3.394 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -6.822 -6.095 3.811 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -6.447 -5.935 5.516 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.603 -3.690 3.525 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.744 -3.096 4.802 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.839 -4.703 4.042 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.513 -4.561 5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.668 -2.088 5.400 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.293 -3.418 6.521 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.121 -2.957 5.263 1.00 0.00 H new ATOM 924 N GLY A 91 -2.841 -4.434 5.148 1.00 0.00 N ATOM 925 CA GLY A 91 -1.829 -4.030 6.150 1.00 0.00 C ATOM 926 C GLY A 91 -0.873 -5.178 6.539 1.00 0.00 C ATOM 927 O GLY A 91 -1.080 -5.826 7.567 1.00 0.00 O ATOM 0 H GLY A 91 -2.714 -3.995 4.236 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -1.247 -3.198 5.755 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.336 -3.668 7.044 1.00 0.00 H new ATOM 931 N ASP A 92 0.112 -5.467 5.670 1.00 0.00 N ATOM 932 CA ASP A 92 0.990 -6.665 5.805 1.00 0.00 C ATOM 933 C ASP A 92 2.310 -6.498 4.975 1.00 0.00 C ATOM 934 O ASP A 92 2.388 -5.734 4.002 1.00 0.00 O ATOM 935 CB ASP A 92 0.196 -7.950 5.416 1.00 0.00 C ATOM 936 CG ASP A 92 0.644 -9.195 6.173 1.00 0.00 C ATOM 937 OD1 ASP A 92 0.237 -9.359 7.343 1.00 0.00 O ATOM 938 OD2 ASP A 92 1.412 -10.001 5.611 1.00 0.00 O ATOM 0 H ASP A 92 0.328 -4.889 4.858 1.00 0.00 H new ATOM 0 HA ASP A 92 1.297 -6.768 6.846 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.865 -7.783 5.604 1.00 0.00 H new ATOM 0 HB3 ASP A 92 0.307 -8.126 4.346 1.00 0.00 H new ATOM 943 N CYS A 93 3.352 -7.258 5.369 1.00 0.00 N ATOM 944 CA CYS A 93 4.694 -7.208 4.729 1.00 0.00 C ATOM 945 C CYS A 93 4.724 -7.956 3.360 1.00 0.00 C ATOM 946 O CYS A 93 5.093 -9.131 3.258 1.00 0.00 O ATOM 947 CB CYS A 93 5.737 -7.761 5.726 1.00 0.00 C ATOM 948 SG CYS A 93 5.805 -6.742 7.241 1.00 0.00 S ATOM 0 H CYS A 93 3.293 -7.925 6.139 1.00 0.00 H new ATOM 0 HA CYS A 93 4.941 -6.173 4.494 1.00 0.00 H new ATOM 0 HB2 CYS A 93 5.486 -8.789 5.987 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.719 -7.783 5.254 1.00 0.00 H new ATOM 0 HG CYS A 93 6.689 -7.236 8.057 1.00 0.00 H new ATOM 954 N ASP A 94 4.293 -7.228 2.317 1.00 0.00 N ATOM 955 CA ASP A 94 4.113 -7.767 0.938 1.00 0.00 C ATOM 956 C ASP A 94 4.322 -6.613 -0.101 1.00 0.00 C ATOM 957 O ASP A 94 5.299 -6.626 -0.861 1.00 0.00 O ATOM 958 CB ASP A 94 2.741 -8.505 0.860 1.00 0.00 C ATOM 959 CG ASP A 94 2.457 -9.183 -0.474 1.00 0.00 C ATOM 960 OD1 ASP A 94 2.817 -10.368 -0.640 1.00 0.00 O ATOM 961 OD2 ASP A 94 1.882 -8.527 -1.369 1.00 0.00 O ATOM 0 H ASP A 94 4.055 -6.239 2.397 1.00 0.00 H new ATOM 0 HA ASP A 94 4.863 -8.516 0.684 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.703 -9.256 1.649 1.00 0.00 H new ATOM 0 HB3 ASP A 94 1.946 -7.788 1.064 1.00 0.00 H new ATOM 966 N VAL A 95 3.415 -5.617 -0.102 1.00 0.00 N ATOM 967 CA VAL A 95 3.427 -4.470 -1.053 1.00 0.00 C ATOM 968 C VAL A 95 4.414 -3.330 -0.640 1.00 0.00 C ATOM 969 O VAL A 95 4.914 -3.256 0.487 1.00 0.00 O ATOM 970 CB VAL A 95 1.964 -3.933 -1.264 1.00 0.00 C ATOM 971 CG1 VAL A 95 1.082 -4.912 -2.061 1.00 0.00 C ATOM 972 CG2 VAL A 95 1.245 -3.450 0.021 1.00 0.00 C ATOM 0 H VAL A 95 2.642 -5.579 0.562 1.00 0.00 H new ATOM 0 HA VAL A 95 3.807 -4.842 -2.004 1.00 0.00 H new ATOM 0 HB VAL A 95 2.108 -3.035 -1.865 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.083 -4.491 -2.177 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.521 -5.080 -3.044 1.00 0.00 H new ATOM 0 HG13 VAL A 95 1.016 -5.860 -1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.244 -3.100 -0.232 1.00 0.00 H new ATOM 0 HG22 VAL A 95 1.172 -4.275 0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.812 -2.635 0.471 1.00 0.00 H new ATOM 982 N ILE A 96 4.612 -2.401 -1.594 1.00 0.00 N ATOM 983 CA ILE A 96 5.273 -1.078 -1.381 1.00 0.00 C ATOM 984 C ILE A 96 4.666 -0.243 -0.201 1.00 0.00 C ATOM 985 O ILE A 96 3.476 -0.353 0.113 1.00 0.00 O ATOM 986 CB ILE A 96 5.266 -0.253 -2.724 1.00 0.00 C ATOM 987 CG1 ILE A 96 3.850 0.007 -3.330 1.00 0.00 C ATOM 988 CG2 ILE A 96 6.210 -0.882 -3.781 1.00 0.00 C ATOM 989 CD1 ILE A 96 3.751 1.172 -4.324 1.00 0.00 C ATOM 0 H ILE A 96 4.314 -2.542 -2.559 1.00 0.00 H new ATOM 0 HA ILE A 96 6.300 -1.288 -1.083 1.00 0.00 H new ATOM 0 HB ILE A 96 5.644 0.730 -2.443 1.00 0.00 H new ATOM 0 HG12 ILE A 96 3.518 -0.902 -3.831 1.00 0.00 H new ATOM 0 HG13 ILE A 96 3.154 0.192 -2.512 1.00 0.00 H new ATOM 0 HG21 ILE A 96 6.181 -0.288 -4.694 1.00 0.00 H new ATOM 0 HG22 ILE A 96 7.229 -0.902 -3.393 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.885 -1.899 -3.999 1.00 0.00 H new ATOM 0 HD11 ILE A 96 2.725 1.260 -4.680 1.00 0.00 H new ATOM 0 HD12 ILE A 96 4.044 2.098 -3.830 1.00 0.00 H new ATOM 0 HD13 ILE A 96 4.414 0.986 -5.169 1.00 0.00 H new ATOM 1001 N GLN A 97 5.506 0.600 0.427 1.00 0.00 N ATOM 1002 CA GLN A 97 5.100 1.470 1.566 1.00 0.00 C ATOM 1003 C GLN A 97 3.969 2.512 1.269 1.00 0.00 C ATOM 1004 O GLN A 97 3.123 2.727 2.140 1.00 0.00 O ATOM 1005 CB GLN A 97 6.386 2.138 2.121 1.00 0.00 C ATOM 1006 CG GLN A 97 6.238 2.715 3.543 1.00 0.00 C ATOM 1007 CD GLN A 97 7.477 3.456 4.079 1.00 0.00 C ATOM 1008 OE1 GLN A 97 8.356 3.909 3.343 1.00 0.00 O ATOM 1009 NE2 GLN A 97 7.551 3.626 5.388 1.00 0.00 N ATOM 0 H GLN A 97 6.487 0.703 0.166 1.00 0.00 H new ATOM 0 HA GLN A 97 4.626 0.831 2.311 1.00 0.00 H new ATOM 0 HB2 GLN A 97 7.192 1.404 2.121 1.00 0.00 H new ATOM 0 HB3 GLN A 97 6.686 2.939 1.446 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.391 3.401 3.554 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.997 1.900 4.226 1.00 0.00 H new ATOM 0 HE21 GLN A 97 6.821 3.249 5.993 1.00 0.00 H new ATOM 0 HE22 GLN A 97 8.338 4.134 5.793 1.00 0.00 H new ATOM 1018 N ALA A 98 3.930 3.121 0.063 1.00 0.00 N ATOM 1019 CA ALA A 98 2.804 3.991 -0.379 1.00 0.00 C ATOM 1020 C ALA A 98 1.391 3.325 -0.418 1.00 0.00 C ATOM 1021 O ALA A 98 0.426 3.962 0.015 1.00 0.00 O ATOM 1022 CB ALA A 98 3.163 4.604 -1.745 1.00 0.00 C ATOM 0 H ALA A 98 4.671 3.028 -0.632 1.00 0.00 H new ATOM 0 HA ALA A 98 2.698 4.756 0.390 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.348 5.244 -2.082 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.073 5.196 -1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.322 3.807 -2.471 1.00 0.00 H new ATOM 1028 N LEU A 99 1.274 2.054 -0.869 1.00 0.00 N ATOM 1029 CA LEU A 99 0.051 1.227 -0.657 1.00 0.00 C ATOM 1030 C LEU A 99 -0.217 0.897 0.841 1.00 0.00 C ATOM 1031 O LEU A 99 -1.295 1.257 1.317 1.00 0.00 O ATOM 1032 CB LEU A 99 0.077 -0.083 -1.497 1.00 0.00 C ATOM 1033 CG LEU A 99 -0.098 0.049 -3.032 1.00 0.00 C ATOM 1034 CD1 LEU A 99 0.193 -1.297 -3.717 1.00 0.00 C ATOM 1035 CD2 LEU A 99 -1.505 0.530 -3.430 1.00 0.00 C ATOM 0 H LEU A 99 2.011 1.573 -1.384 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.775 1.847 -1.005 1.00 0.00 H new ATOM 0 HB2 LEU A 99 1.026 -0.585 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.710 -0.738 -1.124 1.00 0.00 H new ATOM 0 HG LEU A 99 0.615 0.803 -3.365 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.067 -1.192 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.217 -1.602 -3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -0.498 -2.053 -3.343 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.571 0.604 -4.515 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.248 -0.181 -3.069 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.694 1.508 -2.987 1.00 0.00 H new ATOM 1047 N ASP A 100 0.723 0.248 1.569 1.00 0.00 N ATOM 1048 CA ASP A 100 0.526 -0.190 2.987 1.00 0.00 C ATOM 1049 C ASP A 100 0.040 0.896 4.018 1.00 0.00 C ATOM 1050 O ASP A 100 -0.836 0.617 4.845 1.00 0.00 O ATOM 1051 CB ASP A 100 1.831 -0.907 3.427 1.00 0.00 C ATOM 1052 CG ASP A 100 1.665 -1.770 4.676 1.00 0.00 C ATOM 1053 OD1 ASP A 100 1.059 -2.858 4.573 1.00 0.00 O ATOM 1054 OD2 ASP A 100 2.121 -1.353 5.762 1.00 0.00 O ATOM 0 H ASP A 100 1.642 0.010 1.197 1.00 0.00 H new ATOM 0 HA ASP A 100 -0.331 -0.863 2.998 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.185 -1.533 2.608 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.602 -0.159 3.613 1.00 0.00 H new ATOM 1059 N LEU A 101 0.564 2.133 3.918 1.00 0.00 N ATOM 1060 CA LEU A 101 0.052 3.311 4.674 1.00 0.00 C ATOM 1061 C LEU A 101 -1.425 3.703 4.339 1.00 0.00 C ATOM 1062 O LEU A 101 -2.224 3.840 5.269 1.00 0.00 O ATOM 1063 CB LEU A 101 1.021 4.513 4.484 1.00 0.00 C ATOM 1064 CG LEU A 101 2.442 4.359 5.104 1.00 0.00 C ATOM 1065 CD1 LEU A 101 3.413 5.379 4.492 1.00 0.00 C ATOM 1066 CD2 LEU A 101 2.442 4.490 6.641 1.00 0.00 C ATOM 0 H LEU A 101 1.355 2.352 3.312 1.00 0.00 H new ATOM 0 HA LEU A 101 0.024 3.021 5.724 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.132 4.697 3.415 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.555 5.400 4.914 1.00 0.00 H new ATOM 0 HG LEU A 101 2.775 3.349 4.866 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.400 5.255 4.938 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.479 5.219 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.051 6.388 4.687 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.459 4.374 7.016 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.061 5.472 6.922 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.806 3.717 7.072 1.00 0.00 H new ATOM 1078 N SER A 102 -1.782 3.866 3.044 1.00 0.00 N ATOM 1079 CA SER A 102 -3.166 4.219 2.616 1.00 0.00 C ATOM 1080 C SER A 102 -3.964 3.019 2.010 1.00 0.00 C ATOM 1081 O SER A 102 -4.418 3.072 0.863 1.00 0.00 O ATOM 1082 CB SER A 102 -3.076 5.457 1.690 1.00 0.00 C ATOM 1083 OG SER A 102 -2.357 5.185 0.488 1.00 0.00 O ATOM 0 H SER A 102 -1.129 3.759 2.268 1.00 0.00 H new ATOM 0 HA SER A 102 -3.762 4.476 3.491 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.082 5.795 1.440 1.00 0.00 H new ATOM 0 HB3 SER A 102 -2.590 6.273 2.225 1.00 0.00 H new ATOM 0 HG SER A 102 -1.438 4.926 0.708 1.00 0.00 H new ATOM 1089 N VAL A 103 -4.185 1.960 2.819 1.00 0.00 N ATOM 1090 CA VAL A 103 -5.132 0.846 2.495 1.00 0.00 C ATOM 1091 C VAL A 103 -6.524 1.147 3.163 1.00 0.00 C ATOM 1092 O VAL A 103 -7.472 1.285 2.381 1.00 0.00 O ATOM 1093 CB VAL A 103 -4.625 -0.614 2.784 1.00 0.00 C ATOM 1094 CG1 VAL A 103 -5.429 -1.664 1.985 1.00 0.00 C ATOM 1095 CG2 VAL A 103 -3.132 -0.879 2.529 1.00 0.00 C ATOM 0 H VAL A 103 -3.717 1.844 3.718 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.224 0.837 1.409 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.784 -0.709 3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.050 -2.661 2.210 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.481 -1.604 2.262 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.323 -1.468 0.918 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -2.902 -1.918 2.763 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.901 -0.684 1.482 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.533 -0.223 3.161 1.00 0.00 H new ATOM 1105 N PRO A 104 -6.737 1.284 4.516 1.00 0.00 N ATOM 1106 CA PRO A 104 -8.044 1.713 5.092 1.00 0.00 C ATOM 1107 C PRO A 104 -8.537 3.161 4.767 1.00 0.00 C ATOM 1108 O PRO A 104 -9.751 3.377 4.754 1.00 0.00 O ATOM 1109 CB PRO A 104 -7.849 1.474 6.600 1.00 0.00 C ATOM 1110 CG PRO A 104 -6.348 1.635 6.837 1.00 0.00 C ATOM 1111 CD PRO A 104 -5.707 1.087 5.562 1.00 0.00 C ATOM 0 HA PRO A 104 -8.855 1.144 4.637 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -8.420 2.191 7.190 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -8.189 0.480 6.889 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -6.080 2.679 7.001 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -6.022 1.081 7.717 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.788 1.620 5.319 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -5.446 0.034 5.669 1.00 0.00 H new ATOM 1119 N LEU A 105 -7.639 4.120 4.454 1.00 0.00 N ATOM 1120 CA LEU A 105 -8.016 5.445 3.878 1.00 0.00 C ATOM 1121 C LEU A 105 -8.689 5.436 2.453 1.00 0.00 C ATOM 1122 O LEU A 105 -9.138 6.498 2.011 1.00 0.00 O ATOM 1123 CB LEU A 105 -6.756 6.374 3.881 1.00 0.00 C ATOM 1124 CG LEU A 105 -6.189 6.921 5.227 1.00 0.00 C ATOM 1125 CD1 LEU A 105 -7.216 7.746 6.029 1.00 0.00 C ATOM 1126 CD2 LEU A 105 -5.509 5.868 6.125 1.00 0.00 C ATOM 0 H LEU A 105 -6.635 4.006 4.590 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.807 5.821 4.526 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -5.951 5.828 3.389 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -6.988 7.235 3.254 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.395 7.594 4.904 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -6.758 8.097 6.954 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.538 8.602 5.436 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -8.079 7.123 6.265 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.148 6.345 7.036 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -6.228 5.091 6.383 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.669 5.423 5.592 1.00 0.00 H new ATOM 1138 N MET A 106 -8.784 4.278 1.758 1.00 0.00 N ATOM 1139 CA MET A 106 -9.388 4.164 0.406 1.00 0.00 C ATOM 1140 C MET A 106 -10.673 3.294 0.497 1.00 0.00 C ATOM 1141 O MET A 106 -10.628 2.110 0.850 1.00 0.00 O ATOM 1142 CB MET A 106 -8.366 3.565 -0.597 1.00 0.00 C ATOM 1143 CG MET A 106 -7.155 4.474 -0.874 1.00 0.00 C ATOM 1144 SD MET A 106 -5.985 3.646 -1.963 1.00 0.00 S ATOM 1145 CE MET A 106 -4.675 4.887 -2.014 1.00 0.00 C ATOM 0 H MET A 106 -8.441 3.389 2.121 1.00 0.00 H new ATOM 0 HA MET A 106 -9.660 5.154 0.038 1.00 0.00 H new ATOM 0 HB2 MET A 106 -8.010 2.610 -0.210 1.00 0.00 H new ATOM 0 HB3 MET A 106 -8.875 3.358 -1.538 1.00 0.00 H new ATOM 0 HG2 MET A 106 -7.489 5.406 -1.330 1.00 0.00 H new ATOM 0 HG3 MET A 106 -6.666 4.735 0.065 1.00 0.00 H new ATOM 0 HE1 MET A 106 -4.597 5.293 -3.023 1.00 0.00 H new ATOM 0 HE2 MET A 106 -4.909 5.691 -1.317 1.00 0.00 H new ATOM 0 HE3 MET A 106 -3.727 4.427 -1.734 1.00 0.00 H new ATOM 1155 N ASP A 107 -11.811 3.902 0.121 1.00 0.00 N ATOM 1156 CA ASP A 107 -13.122 3.205 -0.046 1.00 0.00 C ATOM 1157 C ASP A 107 -13.148 2.136 -1.189 1.00 0.00 C ATOM 1158 O ASP A 107 -12.288 2.110 -2.080 1.00 0.00 O ATOM 1159 CB ASP A 107 -14.211 4.293 -0.290 1.00 0.00 C ATOM 1160 CG ASP A 107 -14.523 5.159 0.922 1.00 0.00 C ATOM 1161 OD1 ASP A 107 -15.051 4.633 1.921 1.00 0.00 O ATOM 1162 OD2 ASP A 107 -14.146 6.348 0.938 1.00 0.00 O ATOM 0 H ASP A 107 -11.859 4.901 -0.080 1.00 0.00 H new ATOM 0 HA ASP A 107 -13.313 2.639 0.866 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.886 4.937 -1.107 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -15.129 3.803 -0.616 1.00 0.00 H new ATOM 1167 N VAL A 108 -14.171 1.253 -1.148 1.00 0.00 N ATOM 1168 CA VAL A 108 -14.332 0.144 -2.133 1.00 0.00 C ATOM 1169 C VAL A 108 -14.881 0.756 -3.461 1.00 0.00 C ATOM 1170 O VAL A 108 -16.074 1.055 -3.580 1.00 0.00 O ATOM 1171 CB VAL A 108 -15.209 -1.018 -1.547 1.00 0.00 C ATOM 1172 CG1 VAL A 108 -15.388 -2.203 -2.528 1.00 0.00 C ATOM 1173 CG2 VAL A 108 -14.655 -1.599 -0.223 1.00 0.00 C ATOM 0 H VAL A 108 -14.905 1.282 -0.441 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.374 -0.327 -2.352 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.171 -0.538 -1.365 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.004 -2.972 -2.061 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.874 -1.852 -3.438 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.412 -2.621 -2.776 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -15.310 -2.398 0.126 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -13.654 -1.997 -0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -14.610 -0.812 0.529 1.00 0.00 H new ATOM 1183 N GLY A 109 -13.964 0.972 -4.418 1.00 0.00 N ATOM 1184 CA GLY A 109 -14.240 1.748 -5.647 1.00 0.00 C ATOM 1185 C GLY A 109 -13.941 3.267 -5.580 1.00 0.00 C ATOM 1186 O GLY A 109 -14.776 4.054 -6.032 1.00 0.00 O ATOM 0 H GLY A 109 -13.010 0.616 -4.365 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -13.655 1.320 -6.461 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -15.291 1.617 -5.906 1.00 0.00 H new ATOM 1190 N GLU A 110 -12.742 3.664 -5.103 1.00 0.00 N ATOM 1191 CA GLU A 110 -12.192 5.036 -5.307 1.00 0.00 C ATOM 1192 C GLU A 110 -10.782 4.973 -5.983 1.00 0.00 C ATOM 1193 O GLU A 110 -9.923 4.146 -5.647 1.00 0.00 O ATOM 1194 CB GLU A 110 -12.244 5.886 -4.004 1.00 0.00 C ATOM 1195 CG GLU A 110 -11.191 5.622 -2.893 1.00 0.00 C ATOM 1196 CD GLU A 110 -10.043 6.618 -2.753 1.00 0.00 C ATOM 1197 OE1 GLU A 110 -9.379 6.972 -3.745 1.00 0.00 O ATOM 1198 OE2 GLU A 110 -9.797 7.076 -1.615 1.00 0.00 O ATOM 0 H GLU A 110 -12.126 3.052 -4.568 1.00 0.00 H new ATOM 0 HA GLU A 110 -12.836 5.570 -6.006 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -12.164 6.934 -4.291 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -13.231 5.751 -3.561 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -11.715 5.577 -1.938 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -10.760 4.636 -3.067 1.00 0.00 H new ATOM 1205 N THR A 111 -10.580 5.886 -6.945 1.00 0.00 N ATOM 1206 CA THR A 111 -9.271 6.110 -7.617 1.00 0.00 C ATOM 1207 C THR A 111 -8.522 7.252 -6.862 1.00 0.00 C ATOM 1208 O THR A 111 -9.147 8.216 -6.408 1.00 0.00 O ATOM 1209 CB THR A 111 -9.532 6.431 -9.119 1.00 0.00 C ATOM 1210 OG1 THR A 111 -10.308 5.397 -9.722 1.00 0.00 O ATOM 1211 CG2 THR A 111 -8.268 6.575 -9.979 1.00 0.00 C ATOM 0 H THR A 111 -11.320 6.499 -7.288 1.00 0.00 H new ATOM 0 HA THR A 111 -8.634 5.226 -7.585 1.00 0.00 H new ATOM 0 HB THR A 111 -10.045 7.392 -9.098 1.00 0.00 H new ATOM 0 HG1 THR A 111 -10.465 5.613 -10.665 1.00 0.00 H new ATOM 0 HG21 THR A 111 -8.551 6.798 -11.008 1.00 0.00 H new ATOM 0 HG22 THR A 111 -7.653 7.385 -9.588 1.00 0.00 H new ATOM 0 HG23 THR A 111 -7.702 5.644 -9.952 1.00 0.00 H new ATOM 1219 N ALA A 112 -7.190 7.134 -6.722 1.00 0.00 N ATOM 1220 CA ALA A 112 -6.369 8.128 -5.985 1.00 0.00 C ATOM 1221 C ALA A 112 -5.007 8.328 -6.675 1.00 0.00 C ATOM 1222 O ALA A 112 -4.220 7.382 -6.777 1.00 0.00 O ATOM 1223 CB ALA A 112 -6.109 7.658 -4.541 1.00 0.00 C ATOM 0 H ALA A 112 -6.651 6.359 -7.109 1.00 0.00 H new ATOM 0 HA ALA A 112 -6.925 9.066 -5.977 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -5.506 8.401 -4.020 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -7.060 7.533 -4.022 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -5.577 6.707 -4.558 1.00 0.00 H new ATOM 1229 N MET A 113 -4.682 9.580 -7.051 1.00 0.00 N ATOM 1230 CA MET A 113 -3.309 9.941 -7.487 1.00 0.00 C ATOM 1231 C MET A 113 -2.453 10.240 -6.220 1.00 0.00 C ATOM 1232 O MET A 113 -2.578 11.306 -5.615 1.00 0.00 O ATOM 1233 CB MET A 113 -3.353 11.139 -8.481 1.00 0.00 C ATOM 1234 CG MET A 113 -2.200 11.131 -9.497 1.00 0.00 C ATOM 1235 SD MET A 113 -2.577 9.890 -10.755 1.00 0.00 S ATOM 1236 CE MET A 113 -1.155 10.000 -11.856 1.00 0.00 C ATOM 0 H MET A 113 -5.343 10.357 -7.064 1.00 0.00 H new ATOM 0 HA MET A 113 -2.845 9.115 -8.026 1.00 0.00 H new ATOM 0 HB2 MET A 113 -4.301 11.121 -9.018 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.324 12.071 -7.917 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.087 12.114 -9.953 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.257 10.898 -9.002 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.348 9.420 -12.758 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.982 11.042 -12.124 1.00 0.00 H new ATOM 0 HE3 MET A 113 -0.273 9.604 -11.352 1.00 0.00 H new ATOM 1246 N VAL A 114 -1.614 9.270 -5.820 1.00 0.00 N ATOM 1247 CA VAL A 114 -0.708 9.395 -4.640 1.00 0.00 C ATOM 1248 C VAL A 114 0.669 9.860 -5.205 1.00 0.00 C ATOM 1249 O VAL A 114 1.223 9.208 -6.093 1.00 0.00 O ATOM 1250 CB VAL A 114 -0.590 8.064 -3.808 1.00 0.00 C ATOM 1251 CG1 VAL A 114 0.275 8.244 -2.537 1.00 0.00 C ATOM 1252 CG2 VAL A 114 -1.921 7.389 -3.392 1.00 0.00 C ATOM 0 H VAL A 114 -1.536 8.372 -6.298 1.00 0.00 H new ATOM 0 HA VAL A 114 -1.109 10.116 -3.927 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.112 7.394 -4.523 1.00 0.00 H new ATOM 0 HG11 VAL A 114 0.327 7.299 -1.996 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.280 8.555 -2.822 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -0.172 9.004 -1.897 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -1.708 6.483 -2.825 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -2.500 8.076 -2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.493 7.133 -4.284 1.00 0.00 H new ATOM 1262 N THR A 115 1.217 10.972 -4.682 1.00 0.00 N ATOM 1263 CA THR A 115 2.564 11.475 -5.078 1.00 0.00 C ATOM 1264 C THR A 115 3.572 11.194 -3.931 1.00 0.00 C ATOM 1265 O THR A 115 3.718 11.976 -2.985 1.00 0.00 O ATOM 1266 CB THR A 115 2.570 12.969 -5.519 1.00 0.00 C ATOM 1267 OG1 THR A 115 1.866 13.792 -4.592 1.00 0.00 O ATOM 1268 CG2 THR A 115 2.005 13.186 -6.932 1.00 0.00 C ATOM 0 H THR A 115 0.752 11.548 -3.980 1.00 0.00 H new ATOM 0 HA THR A 115 2.873 10.930 -5.970 1.00 0.00 H new ATOM 0 HB THR A 115 3.620 13.261 -5.536 1.00 0.00 H new ATOM 0 HG1 THR A 115 0.961 13.962 -4.927 1.00 0.00 H new ATOM 0 HG21 THR A 115 2.038 14.247 -7.178 1.00 0.00 H new ATOM 0 HG22 THR A 115 2.603 12.628 -7.653 1.00 0.00 H new ATOM 0 HG23 THR A 115 0.973 12.837 -6.969 1.00 0.00 H new ATOM 1276 N ALA A 116 4.292 10.071 -4.085 1.00 0.00 N ATOM 1277 CA ALA A 116 5.514 9.768 -3.301 1.00 0.00 C ATOM 1278 C ALA A 116 6.787 10.407 -3.935 1.00 0.00 C ATOM 1279 O ALA A 116 6.779 10.849 -5.090 1.00 0.00 O ATOM 1280 CB ALA A 116 5.649 8.231 -3.277 1.00 0.00 C ATOM 0 H ALA A 116 4.048 9.343 -4.756 1.00 0.00 H new ATOM 0 HA ALA A 116 5.427 10.185 -2.298 1.00 0.00 H new ATOM 0 HB1 ALA A 116 6.537 7.953 -2.710 1.00 0.00 H new ATOM 0 HB2 ALA A 116 4.767 7.796 -2.807 1.00 0.00 H new ATOM 0 HB3 ALA A 116 5.738 7.858 -4.297 1.00 0.00 H new ATOM 1286 N ASP A 117 7.900 10.413 -3.178 1.00 0.00 N ATOM 1287 CA ASP A 117 9.221 10.904 -3.685 1.00 0.00 C ATOM 1288 C ASP A 117 10.140 9.799 -4.332 1.00 0.00 C ATOM 1289 O ASP A 117 11.350 9.742 -4.091 1.00 0.00 O ATOM 1290 CB ASP A 117 9.825 11.649 -2.461 1.00 0.00 C ATOM 1291 CG ASP A 117 11.026 12.552 -2.744 1.00 0.00 C ATOM 1292 OD1 ASP A 117 11.038 13.258 -3.773 1.00 0.00 O ATOM 1293 OD2 ASP A 117 11.952 12.589 -1.906 1.00 0.00 O ATOM 0 H ASP A 117 7.924 10.086 -2.212 1.00 0.00 H new ATOM 0 HA ASP A 117 9.113 11.565 -4.545 1.00 0.00 H new ATOM 0 HB2 ASP A 117 9.040 12.255 -2.008 1.00 0.00 H new ATOM 0 HB3 ASP A 117 10.122 10.906 -1.721 1.00 0.00 H new ATOM 1298 N SER A 118 9.543 8.910 -5.156 1.00 0.00 N ATOM 1299 CA SER A 118 10.127 7.590 -5.576 1.00 0.00 C ATOM 1300 C SER A 118 10.986 6.819 -4.510 1.00 0.00 C ATOM 1301 O SER A 118 12.162 6.507 -4.708 1.00 0.00 O ATOM 1302 CB SER A 118 10.807 7.743 -6.956 1.00 0.00 C ATOM 1303 OG SER A 118 12.005 8.497 -6.862 1.00 0.00 O ATOM 0 H SER A 118 8.623 9.081 -5.563 1.00 0.00 H new ATOM 0 HA SER A 118 9.284 6.905 -5.668 1.00 0.00 H new ATOM 0 HB2 SER A 118 11.027 6.757 -7.366 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.122 8.231 -7.649 1.00 0.00 H new ATOM 0 HG SER A 118 12.011 8.997 -6.019 1.00 0.00 H new ATOM 1309 N LYS A 119 10.362 6.597 -3.346 1.00 0.00 N ATOM 1310 CA LYS A 119 11.056 6.303 -2.051 1.00 0.00 C ATOM 1311 C LYS A 119 10.113 5.437 -1.160 1.00 0.00 C ATOM 1312 O LYS A 119 10.448 4.303 -0.814 1.00 0.00 O ATOM 1313 CB LYS A 119 11.514 7.627 -1.353 1.00 0.00 C ATOM 1314 CG LYS A 119 12.968 8.063 -1.656 1.00 0.00 C ATOM 1315 CD LYS A 119 13.267 9.554 -1.392 1.00 0.00 C ATOM 1316 CE LYS A 119 13.047 10.084 0.038 1.00 0.00 C ATOM 1317 NZ LYS A 119 13.286 11.551 0.018 1.00 0.00 N ATOM 0 H LYS A 119 9.346 6.613 -3.259 1.00 0.00 H new ATOM 0 HA LYS A 119 11.966 5.731 -2.231 1.00 0.00 H new ATOM 0 HB2 LYS A 119 10.841 8.429 -1.654 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.405 7.507 -0.275 1.00 0.00 H new ATOM 0 HG2 LYS A 119 13.646 7.459 -1.053 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.188 7.843 -2.701 1.00 0.00 H new ATOM 0 HD2 LYS A 119 14.306 9.741 -1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 119 12.649 10.145 -2.068 1.00 0.00 H new ATOM 0 HE2 LYS A 119 12.034 9.866 0.375 1.00 0.00 H new ATOM 0 HE3 LYS A 119 13.727 9.595 0.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 12.749 12.001 0.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.301 11.739 0.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.976 11.941 -0.895 1.00 0.00 H new ATOM 1331 N TYR A 120 8.915 5.965 -0.851 1.00 0.00 N ATOM 1332 CA TYR A 120 7.729 5.156 -0.451 1.00 0.00 C ATOM 1333 C TYR A 120 7.244 4.164 -1.563 1.00 0.00 C ATOM 1334 O TYR A 120 6.987 2.995 -1.260 1.00 0.00 O ATOM 1335 CB TYR A 120 6.576 6.119 -0.029 1.00 0.00 C ATOM 1336 CG TYR A 120 6.858 7.023 1.186 1.00 0.00 C ATOM 1337 CD1 TYR A 120 7.493 8.262 1.045 1.00 0.00 C ATOM 1338 CD2 TYR A 120 6.555 6.547 2.465 1.00 0.00 C ATOM 1339 CE1 TYR A 120 7.877 8.986 2.172 1.00 0.00 C ATOM 1340 CE2 TYR A 120 6.939 7.271 3.589 1.00 0.00 C ATOM 1341 CZ TYR A 120 7.611 8.477 3.445 1.00 0.00 C ATOM 1342 OH TYR A 120 8.047 9.153 4.553 1.00 0.00 O ATOM 0 H TYR A 120 8.732 6.968 -0.869 1.00 0.00 H new ATOM 0 HA TYR A 120 8.029 4.530 0.389 1.00 0.00 H new ATOM 0 HB2 TYR A 120 6.331 6.755 -0.880 1.00 0.00 H new ATOM 0 HB3 TYR A 120 5.691 5.521 0.187 1.00 0.00 H new ATOM 0 HD1 TYR A 120 7.686 8.659 0.059 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.022 5.615 2.581 1.00 0.00 H new ATOM 0 HE1 TYR A 120 8.378 9.936 2.062 1.00 0.00 H new ATOM 0 HE2 TYR A 120 6.714 6.894 4.576 1.00 0.00 H new ATOM 0 HH TYR A 120 7.779 8.666 5.360 1.00 0.00 H new ATOM 1352 N CYS A 121 7.142 4.626 -2.831 1.00 0.00 N ATOM 1353 CA CYS A 121 6.780 3.779 -3.990 1.00 0.00 C ATOM 1354 C CYS A 121 8.043 3.178 -4.661 1.00 0.00 C ATOM 1355 O CYS A 121 8.873 3.897 -5.229 1.00 0.00 O ATOM 1356 CB CYS A 121 5.983 4.646 -4.981 1.00 0.00 C ATOM 1357 SG CYS A 121 5.154 3.582 -6.205 1.00 0.00 S ATOM 0 H CYS A 121 7.309 5.601 -3.079 1.00 0.00 H new ATOM 0 HA CYS A 121 6.171 2.937 -3.660 1.00 0.00 H new ATOM 0 HB2 CYS A 121 5.245 5.242 -4.445 1.00 0.00 H new ATOM 0 HB3 CYS A 121 6.651 5.344 -5.486 1.00 0.00 H new ATOM 0 HG CYS A 121 6.029 2.797 -6.761 1.00 0.00 H new ATOM 1363 N TYR A 122 8.167 1.840 -4.569 1.00 0.00 N ATOM 1364 CA TYR A 122 9.314 1.050 -5.125 1.00 0.00 C ATOM 1365 C TYR A 122 10.737 1.287 -4.505 1.00 0.00 C ATOM 1366 O TYR A 122 11.733 0.838 -5.084 1.00 0.00 O ATOM 1367 CB TYR A 122 9.324 1.034 -6.690 1.00 0.00 C ATOM 1368 CG TYR A 122 8.115 0.371 -7.380 1.00 0.00 C ATOM 1369 CD1 TYR A 122 7.943 -1.019 -7.351 1.00 0.00 C ATOM 1370 CD2 TYR A 122 7.188 1.158 -8.068 1.00 0.00 C ATOM 1371 CE1 TYR A 122 6.851 -1.607 -7.988 1.00 0.00 C ATOM 1372 CE2 TYR A 122 6.094 0.572 -8.697 1.00 0.00 C ATOM 1373 CZ TYR A 122 5.927 -0.811 -8.662 1.00 0.00 C ATOM 1374 OH TYR A 122 4.865 -1.393 -9.307 1.00 0.00 O ATOM 0 H TYR A 122 7.471 1.258 -4.103 1.00 0.00 H new ATOM 0 HA TYR A 122 9.091 0.043 -4.772 1.00 0.00 H new ATOM 0 HB2 TYR A 122 9.395 2.064 -7.041 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.228 0.522 -7.020 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.660 -1.638 -6.833 1.00 0.00 H new ATOM 0 HD2 TYR A 122 7.322 2.229 -8.112 1.00 0.00 H new ATOM 0 HE1 TYR A 122 6.721 -2.679 -7.959 1.00 0.00 H new ATOM 0 HE2 TYR A 122 5.374 1.190 -9.213 1.00 0.00 H new ATOM 0 HH TYR A 122 4.316 -0.698 -9.726 1.00 0.00 H new ATOM 1384 N GLY A 123 10.855 1.944 -3.331 1.00 0.00 N ATOM 1385 CA GLY A 123 12.156 2.193 -2.667 1.00 0.00 C ATOM 1386 C GLY A 123 13.103 3.223 -3.355 1.00 0.00 C ATOM 1387 O GLY A 123 12.770 3.717 -4.438 1.00 0.00 O ATOM 0 H GLY A 123 10.056 2.316 -2.818 1.00 0.00 H new ATOM 0 HA2 GLY A 123 11.960 2.535 -1.651 1.00 0.00 H new ATOM 0 HA3 GLY A 123 12.685 1.244 -2.587 1.00 0.00 H new ATOM 1391 N PRO A 124 14.314 3.527 -2.802 1.00 0.00 N ATOM 1392 CA PRO A 124 15.346 4.336 -3.508 1.00 0.00 C ATOM 1393 C PRO A 124 16.232 3.495 -4.490 1.00 0.00 C ATOM 1394 O PRO A 124 17.452 3.381 -4.330 1.00 0.00 O ATOM 1395 CB PRO A 124 16.097 4.944 -2.307 1.00 0.00 C ATOM 1396 CG PRO A 124 16.045 3.872 -1.215 1.00 0.00 C ATOM 1397 CD PRO A 124 14.692 3.183 -1.416 1.00 0.00 C ATOM 0 HA PRO A 124 14.952 5.086 -4.194 1.00 0.00 H new ATOM 0 HB2 PRO A 124 17.126 5.189 -2.569 1.00 0.00 H new ATOM 0 HB3 PRO A 124 15.624 5.868 -1.974 1.00 0.00 H new ATOM 0 HG2 PRO A 124 16.869 3.165 -1.314 1.00 0.00 H new ATOM 0 HG3 PRO A 124 16.121 4.314 -0.221 1.00 0.00 H new ATOM 0 HD2 PRO A 124 14.770 2.104 -1.280 1.00 0.00 H new ATOM 0 HD3 PRO A 124 13.952 3.542 -0.700 1.00 0.00 H new ATOM 1405 N GLN A 125 15.582 2.916 -5.514 1.00 0.00 N ATOM 1406 CA GLN A 125 16.221 2.047 -6.536 1.00 0.00 C ATOM 1407 C GLN A 125 15.267 2.009 -7.765 1.00 0.00 C ATOM 1408 O GLN A 125 15.611 2.574 -8.807 1.00 0.00 O ATOM 1409 CB GLN A 125 16.606 0.647 -5.965 1.00 0.00 C ATOM 1410 CG GLN A 125 17.364 -0.267 -6.953 1.00 0.00 C ATOM 1411 CD GLN A 125 17.698 -1.643 -6.354 1.00 0.00 C ATOM 1412 OE1 GLN A 125 18.649 -1.791 -5.587 1.00 0.00 O ATOM 1413 NE2 GLN A 125 16.927 -2.669 -6.681 1.00 0.00 N ATOM 0 H GLN A 125 14.580 3.036 -5.664 1.00 0.00 H new ATOM 0 HA GLN A 125 17.181 2.453 -6.854 1.00 0.00 H new ATOM 0 HB2 GLN A 125 17.222 0.789 -5.077 1.00 0.00 H new ATOM 0 HB3 GLN A 125 15.697 0.138 -5.645 1.00 0.00 H new ATOM 0 HG2 GLN A 125 16.761 -0.403 -7.851 1.00 0.00 H new ATOM 0 HG3 GLN A 125 18.287 0.224 -7.260 1.00 0.00 H new ATOM 0 HE21 GLN A 125 16.142 -2.534 -7.318 1.00 0.00 H new ATOM 0 HE22 GLN A 125 17.119 -3.594 -6.296 1.00 0.00 H new ATOM 1422 N GLY A 126 14.100 1.336 -7.648 1.00 0.00 N ATOM 1423 CA GLY A 126 13.165 1.145 -8.773 1.00 0.00 C ATOM 1424 C GLY A 126 13.234 -0.281 -9.345 1.00 0.00 C ATOM 1425 O GLY A 126 14.325 -0.811 -9.588 1.00 0.00 O ATOM 0 H GLY A 126 13.784 0.913 -6.775 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.149 1.352 -8.439 1.00 0.00 H new ATOM 0 HA3 GLY A 126 13.394 1.863 -9.561 1.00 0.00 H new ATOM 1429 N ARG A 127 12.055 -0.890 -9.548 1.00 0.00 N ATOM 1430 CA ARG A 127 11.947 -2.330 -9.937 1.00 0.00 C ATOM 1431 C ARG A 127 11.425 -2.560 -11.398 1.00 0.00 C ATOM 1432 O ARG A 127 10.516 -3.369 -11.617 1.00 0.00 O ATOM 1433 CB ARG A 127 11.085 -3.054 -8.852 1.00 0.00 C ATOM 1434 CG ARG A 127 11.720 -3.373 -7.470 1.00 0.00 C ATOM 1435 CD ARG A 127 11.899 -2.168 -6.522 1.00 0.00 C ATOM 1436 NE ARG A 127 12.125 -2.585 -5.108 1.00 0.00 N ATOM 1437 CZ ARG A 127 11.167 -2.853 -4.214 1.00 0.00 C ATOM 1438 NH1 ARG A 127 9.889 -2.842 -4.498 1.00 0.00 N ATOM 1439 NH2 ARG A 127 11.520 -3.153 -2.999 1.00 0.00 N ATOM 0 H ARG A 127 11.155 -0.419 -9.452 1.00 0.00 H new ATOM 0 HA ARG A 127 12.946 -2.765 -9.965 1.00 0.00 H new ATOM 0 HB2 ARG A 127 10.200 -2.443 -8.674 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.741 -3.995 -9.280 1.00 0.00 H new ATOM 0 HG2 ARG A 127 11.101 -4.117 -6.969 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.696 -3.830 -7.636 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.743 -1.566 -6.860 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.014 -1.534 -6.574 1.00 0.00 H new ATOM 0 HE ARG A 127 13.092 -2.673 -4.796 1.00 0.00 H new ATOM 0 HH11 ARG A 127 9.579 -2.620 -5.444 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.204 -3.055 -3.773 1.00 0.00 H new ATOM 0 HH21 ARG A 127 12.508 -3.180 -2.747 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.809 -3.362 -2.298 1.00 0.00 H new ATOM 1453 N SER A 128 12.063 -1.906 -12.396 1.00 0.00 N ATOM 1454 CA SER A 128 11.849 -2.158 -13.857 1.00 0.00 C ATOM 1455 C SER A 128 10.422 -1.804 -14.421 1.00 0.00 C ATOM 1456 O SER A 128 9.433 -2.041 -13.719 1.00 0.00 O ATOM 1457 CB SER A 128 12.291 -3.586 -14.281 1.00 0.00 C ATOM 1458 OG SER A 128 13.657 -3.824 -13.952 1.00 0.00 O ATOM 0 H SER A 128 12.753 -1.176 -12.216 1.00 0.00 H new ATOM 0 HA SER A 128 12.509 -1.433 -14.332 1.00 0.00 H new ATOM 0 HB2 SER A 128 11.661 -4.326 -13.787 1.00 0.00 H new ATOM 0 HB3 SER A 128 12.146 -3.710 -15.354 1.00 0.00 H new ATOM 0 HG SER A 128 13.907 -4.730 -14.229 1.00 0.00 H new ATOM 1464 N PRO A 129 10.230 -1.283 -15.672 1.00 0.00 N ATOM 1465 CA PRO A 129 11.311 -0.960 -16.643 1.00 0.00 C ATOM 1466 C PRO A 129 12.018 0.422 -16.464 1.00 0.00 C ATOM 1467 O PRO A 129 13.234 0.488 -16.663 1.00 0.00 O ATOM 1468 CB PRO A 129 10.574 -1.086 -17.993 1.00 0.00 C ATOM 1469 CG PRO A 129 9.123 -0.691 -17.707 1.00 0.00 C ATOM 1470 CD PRO A 129 8.885 -1.148 -16.267 1.00 0.00 C ATOM 0 HA PRO A 129 12.165 -1.626 -16.520 1.00 0.00 H new ATOM 0 HB2 PRO A 129 11.017 -0.433 -18.744 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.635 -2.103 -18.379 1.00 0.00 H new ATOM 0 HG2 PRO A 129 8.975 0.384 -17.813 1.00 0.00 H new ATOM 0 HG3 PRO A 129 8.434 -1.178 -18.398 1.00 0.00 H new ATOM 0 HD2 PRO A 129 8.284 -0.423 -15.719 1.00 0.00 H new ATOM 0 HD3 PRO A 129 8.346 -2.095 -16.239 1.00 0.00 H new ATOM 1478 N TYR A 130 11.274 1.505 -16.147 1.00 0.00 N ATOM 1479 CA TYR A 130 11.821 2.889 -16.093 1.00 0.00 C ATOM 1480 C TYR A 130 11.339 3.554 -14.768 1.00 0.00 C ATOM 1481 O TYR A 130 10.536 4.494 -14.789 1.00 0.00 O ATOM 1482 CB TYR A 130 11.407 3.709 -17.360 1.00 0.00 C ATOM 1483 CG TYR A 130 11.711 3.103 -18.746 1.00 0.00 C ATOM 1484 CD1 TYR A 130 13.016 3.076 -19.247 1.00 0.00 C ATOM 1485 CD2 TYR A 130 10.674 2.537 -19.500 1.00 0.00 C ATOM 1486 CE1 TYR A 130 13.282 2.482 -20.479 1.00 0.00 C ATOM 1487 CE2 TYR A 130 10.943 1.943 -20.731 1.00 0.00 C ATOM 1488 CZ TYR A 130 12.247 1.914 -21.218 1.00 0.00 C ATOM 1489 OH TYR A 130 12.513 1.318 -22.425 1.00 0.00 O ATOM 0 H TYR A 130 10.281 1.450 -15.921 1.00 0.00 H new ATOM 0 HA TYR A 130 12.911 2.864 -16.098 1.00 0.00 H new ATOM 0 HB2 TYR A 130 10.334 3.892 -17.304 1.00 0.00 H new ATOM 0 HB3 TYR A 130 11.899 4.680 -17.305 1.00 0.00 H new ATOM 0 HD1 TYR A 130 13.821 3.517 -18.677 1.00 0.00 H new ATOM 0 HD2 TYR A 130 9.662 2.561 -19.125 1.00 0.00 H new ATOM 0 HE1 TYR A 130 14.292 2.462 -20.861 1.00 0.00 H new ATOM 0 HE2 TYR A 130 10.141 1.505 -21.307 1.00 0.00 H new ATOM 0 HH TYR A 130 11.681 0.971 -22.809 1.00 0.00 H new ATOM 1499 N ILE A 131 11.824 3.054 -13.611 1.00 0.00 N ATOM 1500 CA ILE A 131 11.373 3.523 -12.267 1.00 0.00 C ATOM 1501 C ILE A 131 12.636 4.182 -11.590 1.00 0.00 C ATOM 1502 O ILE A 131 13.632 3.474 -11.406 1.00 0.00 O ATOM 1503 CB ILE A 131 10.697 2.360 -11.456 1.00 0.00 C ATOM 1504 CG1 ILE A 131 9.439 1.771 -12.179 1.00 0.00 C ATOM 1505 CG2 ILE A 131 10.298 2.817 -10.029 1.00 0.00 C ATOM 1506 CD1 ILE A 131 8.868 0.472 -11.596 1.00 0.00 C ATOM 0 H ILE A 131 12.532 2.321 -13.573 1.00 0.00 H new ATOM 0 HA ILE A 131 10.582 4.272 -12.320 1.00 0.00 H new ATOM 0 HB ILE A 131 11.449 1.574 -11.387 1.00 0.00 H new ATOM 0 HG12 ILE A 131 8.653 2.526 -12.168 1.00 0.00 H new ATOM 0 HG13 ILE A 131 9.696 1.594 -13.223 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.833 1.986 -9.498 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.187 3.141 -9.489 1.00 0.00 H new ATOM 0 HG23 ILE A 131 9.592 3.645 -10.096 1.00 0.00 H new ATOM 0 HD11 ILE A 131 8.001 0.162 -12.179 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.628 -0.308 -11.633 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.569 0.638 -10.561 1.00 0.00 H new ATOM 1518 N PRO A 132 12.658 5.495 -11.206 1.00 0.00 N ATOM 1519 CA PRO A 132 13.880 6.173 -10.694 1.00 0.00 C ATOM 1520 C PRO A 132 14.144 6.003 -9.154 1.00 0.00 C ATOM 1521 O PRO A 132 13.190 5.749 -8.411 1.00 0.00 O ATOM 1522 CB PRO A 132 13.588 7.645 -11.052 1.00 0.00 C ATOM 1523 CG PRO A 132 12.069 7.791 -10.953 1.00 0.00 C ATOM 1524 CD PRO A 132 11.546 6.438 -11.434 1.00 0.00 C ATOM 0 HA PRO A 132 14.787 5.753 -11.129 1.00 0.00 H new ATOM 0 HB2 PRO A 132 14.094 8.324 -10.366 1.00 0.00 H new ATOM 0 HB3 PRO A 132 13.941 7.883 -12.055 1.00 0.00 H new ATOM 0 HG2 PRO A 132 11.752 8.003 -9.932 1.00 0.00 H new ATOM 0 HG3 PRO A 132 11.703 8.607 -11.576 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.656 6.140 -10.880 1.00 0.00 H new ATOM 0 HD3 PRO A 132 11.269 6.474 -12.488 1.00 0.00 H new ATOM 1532 N PRO A 133 15.387 6.202 -8.626 1.00 0.00 N ATOM 1533 CA PRO A 133 15.647 6.245 -7.162 1.00 0.00 C ATOM 1534 C PRO A 133 15.235 7.545 -6.399 1.00 0.00 C ATOM 1535 O PRO A 133 14.789 7.443 -5.254 1.00 0.00 O ATOM 1536 CB PRO A 133 17.162 5.970 -7.104 1.00 0.00 C ATOM 1537 CG PRO A 133 17.728 6.560 -8.399 1.00 0.00 C ATOM 1538 CD PRO A 133 16.618 6.342 -9.432 1.00 0.00 C ATOM 0 HA PRO A 133 15.020 5.526 -6.635 1.00 0.00 H new ATOM 0 HB2 PRO A 133 17.614 6.437 -6.229 1.00 0.00 H new ATOM 0 HB3 PRO A 133 17.366 4.901 -7.036 1.00 0.00 H new ATOM 0 HG2 PRO A 133 17.962 7.618 -8.285 1.00 0.00 H new ATOM 0 HG3 PRO A 133 18.650 6.059 -8.694 1.00 0.00 H new ATOM 0 HD2 PRO A 133 16.547 7.182 -10.122 1.00 0.00 H new ATOM 0 HD3 PRO A 133 16.803 5.451 -10.032 1.00 0.00 H new ATOM 1546 N HIS A 134 15.439 8.741 -6.987 1.00 0.00 N ATOM 1547 CA HIS A 134 15.220 10.045 -6.294 1.00 0.00 C ATOM 1548 C HIS A 134 14.747 11.105 -7.340 1.00 0.00 C ATOM 1549 O HIS A 134 15.504 12.008 -7.714 1.00 0.00 O ATOM 1550 CB HIS A 134 16.501 10.522 -5.529 1.00 0.00 C ATOM 1551 CG HIS A 134 17.067 9.606 -4.435 1.00 0.00 C ATOM 1552 ND1 HIS A 134 16.528 9.440 -3.174 1.00 0.00 N ATOM 1553 CD2 HIS A 134 18.181 8.760 -4.586 1.00 0.00 C ATOM 1554 CE1 HIS A 134 17.363 8.473 -2.682 1.00 0.00 C ATOM 1555 NE2 HIS A 134 18.397 7.997 -3.448 1.00 0.00 N ATOM 0 H HIS A 134 15.759 8.840 -7.951 1.00 0.00 H new ATOM 0 HA HIS A 134 14.445 9.917 -5.538 1.00 0.00 H new ATOM 0 HB2 HIS A 134 17.287 10.689 -6.265 1.00 0.00 H new ATOM 0 HB3 HIS A 134 16.279 11.488 -5.075 1.00 0.00 H new ATOM 0 HD2 HIS A 134 18.791 8.711 -5.476 1.00 0.00 H new ATOM 0 HE1 HIS A 134 17.207 8.083 -1.687 1.00 0.00 H new ATOM 0 HE2 HIS A 134 19.108 7.295 -3.243 1.00 0.00 H new ATOM 1563 N ALA A 135 13.488 10.992 -7.824 1.00 0.00 N ATOM 1564 CA ALA A 135 12.911 11.941 -8.828 1.00 0.00 C ATOM 1565 C ALA A 135 11.347 12.018 -8.896 1.00 0.00 C ATOM 1566 O ALA A 135 10.814 12.508 -9.897 1.00 0.00 O ATOM 1567 CB ALA A 135 13.509 11.628 -10.225 1.00 0.00 C ATOM 0 H ALA A 135 12.844 10.254 -7.540 1.00 0.00 H new ATOM 0 HA ALA A 135 13.198 12.934 -8.483 1.00 0.00 H new ATOM 0 HB1 ALA A 135 13.093 12.316 -10.961 1.00 0.00 H new ATOM 0 HB2 ALA A 135 14.592 11.744 -10.191 1.00 0.00 H new ATOM 0 HB3 ALA A 135 13.263 10.604 -10.505 1.00 0.00 H new ATOM 1573 N ALA A 136 10.606 11.614 -7.837 1.00 0.00 N ATOM 1574 CA ALA A 136 9.119 11.724 -7.743 1.00 0.00 C ATOM 1575 C ALA A 136 8.337 10.721 -8.641 1.00 0.00 C ATOM 1576 O ALA A 136 8.660 10.545 -9.821 1.00 0.00 O ATOM 1577 CB ALA A 136 8.587 13.171 -7.879 1.00 0.00 C ATOM 0 H ALA A 136 11.025 11.195 -7.007 1.00 0.00 H new ATOM 0 HA ALA A 136 8.909 11.418 -6.718 1.00 0.00 H new ATOM 0 HB1 ALA A 136 7.500 13.168 -7.800 1.00 0.00 H new ATOM 0 HB2 ALA A 136 9.007 13.789 -7.085 1.00 0.00 H new ATOM 0 HB3 ALA A 136 8.879 13.577 -8.848 1.00 0.00 H new ATOM 1583 N LEU A 137 7.295 10.083 -8.069 1.00 0.00 N ATOM 1584 CA LEU A 137 6.464 9.070 -8.776 1.00 0.00 C ATOM 1585 C LEU A 137 4.971 9.298 -8.411 1.00 0.00 C ATOM 1586 O LEU A 137 4.590 9.255 -7.237 1.00 0.00 O ATOM 1587 CB LEU A 137 6.987 7.641 -8.442 1.00 0.00 C ATOM 1588 CG LEU A 137 6.496 6.472 -9.346 1.00 0.00 C ATOM 1589 CD1 LEU A 137 7.502 5.308 -9.303 1.00 0.00 C ATOM 1590 CD2 LEU A 137 5.092 5.961 -8.979 1.00 0.00 C ATOM 0 H LEU A 137 7.002 10.251 -7.107 1.00 0.00 H new ATOM 0 HA LEU A 137 6.542 9.175 -9.858 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.076 7.663 -8.480 1.00 0.00 H new ATOM 0 HB3 LEU A 137 6.709 7.412 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 137 6.429 6.875 -10.357 1.00 0.00 H new ATOM 0 HD11 LEU A 137 7.147 4.497 -9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 137 8.472 5.652 -9.661 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.600 4.949 -8.278 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.814 5.147 -9.649 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.094 5.600 -7.951 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.372 6.773 -9.077 1.00 0.00 H new ATOM 1602 N CYS A 138 4.140 9.497 -9.454 1.00 0.00 N ATOM 1603 CA CYS A 138 2.669 9.643 -9.319 1.00 0.00 C ATOM 1604 C CYS A 138 1.964 8.298 -9.657 1.00 0.00 C ATOM 1605 O CYS A 138 1.740 7.954 -10.821 1.00 0.00 O ATOM 1606 CB CYS A 138 2.191 10.821 -10.194 1.00 0.00 C ATOM 1607 SG CYS A 138 2.548 10.556 -11.965 1.00 0.00 S ATOM 0 H CYS A 138 4.467 9.562 -10.418 1.00 0.00 H new ATOM 0 HA CYS A 138 2.401 9.878 -8.289 1.00 0.00 H new ATOM 0 HB2 CYS A 138 1.118 10.960 -10.058 1.00 0.00 H new ATOM 0 HB3 CYS A 138 2.676 11.739 -9.861 1.00 0.00 H new ATOM 0 HG CYS A 138 2.278 9.325 -12.283 1.00 0.00 H new ATOM 1613 N LEU A 139 1.639 7.536 -8.604 1.00 0.00 N ATOM 1614 CA LEU A 139 0.991 6.202 -8.704 1.00 0.00 C ATOM 1615 C LEU A 139 -0.550 6.359 -8.567 1.00 0.00 C ATOM 1616 O LEU A 139 -1.036 6.934 -7.588 1.00 0.00 O ATOM 1617 CB LEU A 139 1.584 5.192 -7.673 1.00 0.00 C ATOM 1618 CG LEU A 139 1.575 5.560 -6.155 1.00 0.00 C ATOM 1619 CD1 LEU A 139 1.496 4.324 -5.242 1.00 0.00 C ATOM 1620 CD2 LEU A 139 2.786 6.416 -5.727 1.00 0.00 C ATOM 0 H LEU A 139 1.817 7.824 -7.642 1.00 0.00 H new ATOM 0 HA LEU A 139 1.202 5.779 -9.686 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.044 4.252 -7.786 1.00 0.00 H new ATOM 0 HB3 LEU A 139 2.619 5.001 -7.958 1.00 0.00 H new ATOM 0 HG LEU A 139 0.669 6.154 -6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 139 1.493 4.641 -4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 139 0.581 3.772 -5.456 1.00 0.00 H new ATOM 0 HD13 LEU A 139 2.358 3.682 -5.423 1.00 0.00 H new ATOM 0 HD21 LEU A 139 2.718 6.636 -4.662 1.00 0.00 H new ATOM 0 HD22 LEU A 139 3.707 5.868 -5.926 1.00 0.00 H new ATOM 0 HD23 LEU A 139 2.789 7.349 -6.291 1.00 0.00 H new ATOM 1632 N GLU A 140 -1.312 5.842 -9.547 1.00 0.00 N ATOM 1633 CA GLU A 140 -2.802 5.917 -9.528 1.00 0.00 C ATOM 1634 C GLU A 140 -3.407 4.572 -9.001 1.00 0.00 C ATOM 1635 O GLU A 140 -3.445 3.554 -9.702 1.00 0.00 O ATOM 1636 CB GLU A 140 -3.309 6.379 -10.915 1.00 0.00 C ATOM 1637 CG GLU A 140 -4.806 6.769 -10.963 1.00 0.00 C ATOM 1638 CD GLU A 140 -5.276 7.222 -12.335 1.00 0.00 C ATOM 1639 OE1 GLU A 140 -5.055 8.401 -12.681 1.00 0.00 O ATOM 1640 OE2 GLU A 140 -5.876 6.409 -13.067 1.00 0.00 O ATOM 0 H GLU A 140 -0.931 5.367 -10.365 1.00 0.00 H new ATOM 0 HA GLU A 140 -3.153 6.670 -8.822 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -2.715 7.234 -11.237 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -3.133 5.580 -11.635 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -5.405 5.915 -10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.987 7.568 -10.244 1.00 0.00 H new ATOM 1647 N VAL A 141 -3.856 4.600 -7.732 1.00 0.00 N ATOM 1648 CA VAL A 141 -4.309 3.396 -6.981 1.00 0.00 C ATOM 1649 C VAL A 141 -5.856 3.306 -7.129 1.00 0.00 C ATOM 1650 O VAL A 141 -6.587 4.094 -6.521 1.00 0.00 O ATOM 1651 CB VAL A 141 -3.861 3.462 -5.476 1.00 0.00 C ATOM 1652 CG1 VAL A 141 -4.326 2.231 -4.654 1.00 0.00 C ATOM 1653 CG2 VAL A 141 -2.333 3.619 -5.284 1.00 0.00 C ATOM 0 H VAL A 141 -3.918 5.461 -7.188 1.00 0.00 H new ATOM 0 HA VAL A 141 -3.849 2.496 -7.388 1.00 0.00 H new ATOM 0 HB VAL A 141 -4.354 4.360 -5.104 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -3.987 2.333 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -5.414 2.170 -4.674 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -3.904 1.324 -5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -2.102 3.657 -4.219 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -1.820 2.770 -5.736 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.999 4.541 -5.761 1.00 0.00 H new ATOM 1663 N THR A 142 -6.329 2.313 -7.901 1.00 0.00 N ATOM 1664 CA THR A 142 -7.786 2.022 -8.044 1.00 0.00 C ATOM 1665 C THR A 142 -8.090 0.739 -7.220 1.00 0.00 C ATOM 1666 O THR A 142 -7.521 -0.324 -7.490 1.00 0.00 O ATOM 1667 CB THR A 142 -8.183 1.896 -9.545 1.00 0.00 C ATOM 1668 OG1 THR A 142 -7.796 3.070 -10.254 1.00 0.00 O ATOM 1669 CG2 THR A 142 -9.692 1.695 -9.789 1.00 0.00 C ATOM 0 H THR A 142 -5.729 1.690 -8.442 1.00 0.00 H new ATOM 0 HA THR A 142 -8.391 2.841 -7.655 1.00 0.00 H new ATOM 0 HB THR A 142 -7.663 1.006 -9.899 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.048 2.981 -11.197 1.00 0.00 H new ATOM 0 HG21 THR A 142 -9.880 1.617 -10.860 1.00 0.00 H new ATOM 0 HG22 THR A 142 -10.022 0.781 -9.295 1.00 0.00 H new ATOM 0 HG23 THR A 142 -10.242 2.545 -9.385 1.00 0.00 H new ATOM 1677 N LEU A 143 -9.011 0.839 -6.239 1.00 0.00 N ATOM 1678 CA LEU A 143 -9.416 -0.313 -5.384 1.00 0.00 C ATOM 1679 C LEU A 143 -10.380 -1.236 -6.189 1.00 0.00 C ATOM 1680 O LEU A 143 -11.546 -0.889 -6.409 1.00 0.00 O ATOM 1681 CB LEU A 143 -10.041 0.233 -4.060 1.00 0.00 C ATOM 1682 CG LEU A 143 -10.170 -0.710 -2.826 1.00 0.00 C ATOM 1683 CD1 LEU A 143 -11.026 -1.971 -3.064 1.00 0.00 C ATOM 1684 CD2 LEU A 143 -8.810 -1.071 -2.198 1.00 0.00 C ATOM 0 H LEU A 143 -9.495 1.708 -6.013 1.00 0.00 H new ATOM 0 HA LEU A 143 -8.557 -0.923 -5.105 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -9.450 1.096 -3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -11.040 0.599 -4.297 1.00 0.00 H new ATOM 0 HG LEU A 143 -10.722 -0.110 -2.102 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -11.059 -2.566 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -12.038 -1.677 -3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -10.587 -2.563 -3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -8.967 -1.729 -1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -8.191 -1.578 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -8.309 -0.161 -1.868 1.00 0.00 H new ATOM 1696 N LYS A 144 -9.870 -2.402 -6.631 1.00 0.00 N ATOM 1697 CA LYS A 144 -10.643 -3.355 -7.480 1.00 0.00 C ATOM 1698 C LYS A 144 -11.689 -4.189 -6.672 1.00 0.00 C ATOM 1699 O LYS A 144 -12.890 -4.027 -6.904 1.00 0.00 O ATOM 1700 CB LYS A 144 -9.689 -4.256 -8.319 1.00 0.00 C ATOM 1701 CG LYS A 144 -8.776 -3.538 -9.341 1.00 0.00 C ATOM 1702 CD LYS A 144 -7.963 -4.523 -10.208 1.00 0.00 C ATOM 1703 CE LYS A 144 -8.710 -5.026 -11.458 1.00 0.00 C ATOM 1704 NZ LYS A 144 -7.879 -6.059 -12.122 1.00 0.00 N ATOM 0 H LYS A 144 -8.923 -2.715 -6.418 1.00 0.00 H new ATOM 0 HA LYS A 144 -11.229 -2.754 -8.175 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -9.055 -4.815 -7.630 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -10.295 -4.985 -8.857 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -9.387 -2.909 -9.989 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -8.091 -2.878 -8.809 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -7.039 -4.037 -10.521 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -7.681 -5.380 -9.597 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -9.678 -5.442 -11.178 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.903 -4.199 -12.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -8.495 -6.732 -12.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -7.239 -5.604 -12.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -7.319 -6.566 -11.407 1.00 0.00 H new ATOM 1718 N THR A 145 -11.228 -5.083 -5.771 1.00 0.00 N ATOM 1719 CA THR A 145 -12.109 -6.019 -5.019 1.00 0.00 C ATOM 1720 C THR A 145 -11.687 -6.029 -3.525 1.00 0.00 C ATOM 1721 O THR A 145 -10.501 -6.141 -3.198 1.00 0.00 O ATOM 1722 CB THR A 145 -12.090 -7.470 -5.593 1.00 0.00 C ATOM 1723 OG1 THR A 145 -10.768 -8.004 -5.620 1.00 0.00 O ATOM 1724 CG2 THR A 145 -12.705 -7.617 -6.995 1.00 0.00 C ATOM 0 H THR A 145 -10.239 -5.181 -5.541 1.00 0.00 H new ATOM 0 HA THR A 145 -13.133 -5.659 -5.124 1.00 0.00 H new ATOM 0 HB THR A 145 -12.720 -8.033 -4.904 1.00 0.00 H new ATOM 0 HG1 THR A 145 -10.790 -8.914 -5.983 1.00 0.00 H new ATOM 0 HG21 THR A 145 -12.647 -8.659 -7.310 1.00 0.00 H new ATOM 0 HG22 THR A 145 -13.749 -7.303 -6.969 1.00 0.00 H new ATOM 0 HG23 THR A 145 -12.156 -6.993 -7.700 1.00 0.00 H new ATOM 1732 N ALA A 146 -12.688 -5.969 -2.631 1.00 0.00 N ATOM 1733 CA ALA A 146 -12.489 -6.176 -1.175 1.00 0.00 C ATOM 1734 C ALA A 146 -13.223 -7.474 -0.760 1.00 0.00 C ATOM 1735 O ALA A 146 -14.456 -7.507 -0.674 1.00 0.00 O ATOM 1736 CB ALA A 146 -12.994 -4.944 -0.408 1.00 0.00 C ATOM 0 H ALA A 146 -13.656 -5.777 -2.889 1.00 0.00 H new ATOM 0 HA ALA A 146 -11.432 -6.292 -0.934 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -12.848 -5.096 0.661 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -12.438 -4.063 -0.729 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -14.055 -4.798 -0.612 1.00 0.00 H new ATOM 1742 N VAL A 147 -12.443 -8.549 -0.545 1.00 0.00 N ATOM 1743 CA VAL A 147 -12.978 -9.919 -0.283 1.00 0.00 C ATOM 1744 C VAL A 147 -12.226 -10.561 0.920 1.00 0.00 C ATOM 1745 O VAL A 147 -11.062 -10.257 1.195 1.00 0.00 O ATOM 1746 CB VAL A 147 -12.959 -10.841 -1.559 1.00 0.00 C ATOM 1747 CG1 VAL A 147 -13.971 -10.391 -2.635 1.00 0.00 C ATOM 1748 CG2 VAL A 147 -11.571 -11.075 -2.204 1.00 0.00 C ATOM 0 H VAL A 147 -11.424 -8.504 -0.546 1.00 0.00 H new ATOM 0 HA VAL A 147 -14.031 -9.819 -0.020 1.00 0.00 H new ATOM 0 HB VAL A 147 -13.264 -11.807 -1.156 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -13.914 -11.063 -3.492 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -14.979 -10.417 -2.220 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -13.736 -9.376 -2.954 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -11.678 -11.724 -3.073 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -11.148 -10.119 -2.514 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -10.908 -11.547 -1.479 1.00 0.00 H new ATOM 1758 N ASP A 148 -12.890 -11.506 1.608 1.00 0.00 N ATOM 1759 CA ASP A 148 -12.246 -12.381 2.632 1.00 0.00 C ATOM 1760 C ASP A 148 -11.321 -13.510 2.028 1.00 0.00 C ATOM 1761 O ASP A 148 -10.968 -13.486 0.841 1.00 0.00 O ATOM 1762 CB ASP A 148 -13.377 -12.829 3.605 1.00 0.00 C ATOM 1763 CG ASP A 148 -14.420 -13.799 3.044 1.00 0.00 C ATOM 1764 OD1 ASP A 148 -15.426 -13.332 2.469 1.00 0.00 O ATOM 1765 OD2 ASP A 148 -14.223 -15.026 3.170 1.00 0.00 O ATOM 0 H ASP A 148 -13.884 -11.693 1.479 1.00 0.00 H new ATOM 0 HA ASP A 148 -11.499 -11.838 3.211 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -12.913 -13.293 4.475 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -13.896 -11.938 3.958 1.00 0.00 H new ATOM 1770 N GLY A 149 -10.871 -14.462 2.870 1.00 0.00 N ATOM 1771 CA GLY A 149 -9.883 -15.492 2.470 1.00 0.00 C ATOM 1772 C GLY A 149 -10.473 -16.702 1.690 1.00 0.00 C ATOM 1773 O GLY A 149 -11.270 -17.423 2.298 1.00 0.00 O ATOM 0 H GLY A 149 -11.177 -14.541 3.840 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -9.118 -15.020 1.854 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -9.386 -15.864 3.366 1.00 0.00 H new