USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 935 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 70 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 133 SER OG : rot -129:sc= -0.955! USER MOD Set 2.1: A 65 THR OG1 : rot 169:sc= -2.73! USER MOD Set 2.2: A 101 GLN : amide:sc= -0.865 X(o=-3.6,f=-3.9!) USER MOD Single : A 8 THR OG1 : rot 46:sc= -0.216! USER MOD Single : A 19 TYR OH : rot 30:sc= -0.116 USER MOD Single : A 21 THR OG1 : rot -19:sc= -1.78! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot -54:sc= 0.817 USER MOD Single : A 29 THR OG1 : rot 10:sc= -0.114 USER MOD Single : A 40 SER OG : rot 145:sc= 0.167! USER MOD Single : A 42 GLN : amide:sc= -9.03! C(o=-9!,f=-9.8!) USER MOD Single : A 43 TYR OH : rot -112:sc= -4.56! USER MOD Single : A 50 ASN : amide:sc= -0.109 K(o=-0.11,f=-2.9!) USER MOD Single : A 58 THR OG1 : rot 104:sc= 0.321 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0137 USER MOD Single : A 60 TYR OH : rot 30:sc= -1.66! USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.925 USER MOD Single : A 64 TYR OH : rot -15:sc= -2.21! USER MOD Single : A 67 THR OG1 : rot 150:sc= -1.02 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 81 ASN : amide:sc= -4.61! C(o=-4.6!,f=-8.7!) USER MOD Single : A 85 TYR OH : rot 60:sc= -0.175 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.21 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0123 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 66:sc= 1.18 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.105 USER MOD Single : A 112 TYR OH : rot 9:sc= -1.92! USER MOD Single : A 124 GLN : amide:sc= -0.501 K(o=-0.5,f=-9.8!) USER MOD Single : A 128 GLN : amide:sc= -0.853 K(o=-0.85,f=0) USER MOD Single : A 138 THR OG1 : rot -20:sc= -0.679! USER MOD Single : A 148 SER OG : rot -28:sc= 0.779! USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -9.751 7.211 7.782 1.00 0.00 N ATOM 25 CA PRO A 3 -8.746 6.500 6.961 1.00 0.00 C ATOM 26 C PRO A 3 -7.526 6.144 7.815 1.00 0.00 C ATOM 27 O PRO A 3 -7.612 6.035 9.022 1.00 0.00 O ATOM 28 CB PRO A 3 -8.386 7.517 5.880 1.00 0.00 C ATOM 29 CG PRO A 3 -8.688 8.853 6.480 1.00 0.00 C ATOM 30 CD PRO A 3 -9.768 8.651 7.511 1.00 0.00 C ATOM 0 HA PRO A 3 -9.109 5.560 6.545 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.335 7.439 5.601 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -8.969 7.352 4.974 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -7.795 9.279 6.938 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.017 9.553 5.712 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -9.567 9.227 8.414 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.740 8.973 7.137 1.00 0.00 H new ATOM 38 N ILE A 4 -6.391 5.963 7.200 1.00 0.00 N ATOM 39 CA ILE A 4 -5.168 5.614 7.978 1.00 0.00 C ATOM 40 C ILE A 4 -4.433 6.888 8.403 1.00 0.00 C ATOM 41 O ILE A 4 -3.225 6.980 8.312 1.00 0.00 O ATOM 42 CB ILE A 4 -4.306 4.795 7.017 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.828 5.690 5.871 1.00 0.00 C ATOM 44 CG2 ILE A 4 -5.131 3.640 6.447 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.004 4.861 4.885 1.00 0.00 C ATOM 0 H ILE A 4 -6.256 6.041 6.192 1.00 0.00 H new ATOM 0 HA ILE A 4 -5.401 5.061 8.888 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.445 4.397 7.554 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.683 6.135 5.362 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.227 6.511 6.263 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.516 3.057 5.762 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.473 3.001 7.261 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.993 4.038 5.911 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.664 5.499 4.069 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.141 4.437 5.398 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.619 4.056 4.484 1.00 0.00 H new ATOM 57 N GLY A 5 -5.153 7.873 8.866 1.00 0.00 N ATOM 58 CA GLY A 5 -4.495 9.139 9.295 1.00 0.00 C ATOM 59 C GLY A 5 -3.684 9.710 8.131 1.00 0.00 C ATOM 60 O GLY A 5 -2.481 9.854 8.212 1.00 0.00 O ATOM 0 H GLY A 5 -6.168 7.856 8.966 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -5.246 9.860 9.618 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -3.844 8.952 10.149 1.00 0.00 H new ATOM 64 N GLU A 6 -4.334 10.033 7.046 1.00 0.00 N ATOM 65 CA GLU A 6 -3.601 10.593 5.875 1.00 0.00 C ATOM 66 C GLU A 6 -2.506 9.622 5.423 1.00 0.00 C ATOM 67 O GLU A 6 -2.723 8.778 4.577 1.00 0.00 O ATOM 68 CB GLU A 6 -2.985 11.899 6.379 1.00 0.00 C ATOM 69 CG GLU A 6 -4.007 13.030 6.245 1.00 0.00 C ATOM 70 CD GLU A 6 -4.866 13.095 7.509 1.00 0.00 C ATOM 71 OE1 GLU A 6 -4.404 13.661 8.487 1.00 0.00 O ATOM 72 OE2 GLU A 6 -5.970 12.578 7.478 1.00 0.00 O ATOM 0 H GLU A 6 -5.341 9.933 6.920 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.255 10.756 5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.680 11.792 7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.088 12.135 5.807 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -3.495 13.980 6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -4.638 12.863 5.372 1.00 0.00 H new ATOM 79 N GLY A 7 -1.332 9.736 5.981 1.00 0.00 N ATOM 80 CA GLY A 7 -0.226 8.820 5.583 1.00 0.00 C ATOM 81 C GLY A 7 1.116 9.452 5.956 1.00 0.00 C ATOM 82 O GLY A 7 1.415 9.651 7.116 1.00 0.00 O ATOM 0 H GLY A 7 -1.091 10.423 6.695 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.339 7.858 6.082 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.265 8.629 4.511 1.00 0.00 H new ATOM 86 N THR A 8 1.926 9.767 4.981 1.00 0.00 N ATOM 87 CA THR A 8 3.245 10.383 5.271 1.00 0.00 C ATOM 88 C THR A 8 3.935 9.637 6.408 1.00 0.00 C ATOM 89 O THR A 8 3.685 9.880 7.572 1.00 0.00 O ATOM 90 CB THR A 8 2.941 11.829 5.668 1.00 0.00 C ATOM 91 OG1 THR A 8 1.790 11.864 6.500 1.00 0.00 O ATOM 92 CG2 THR A 8 2.688 12.654 4.406 1.00 0.00 C ATOM 0 H THR A 8 1.726 9.622 3.991 1.00 0.00 H new ATOM 0 HA THR A 8 3.917 10.340 4.414 1.00 0.00 H new ATOM 0 HB THR A 8 3.789 12.245 6.213 1.00 0.00 H new ATOM 0 HG1 THR A 8 1.860 11.166 7.185 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.471 13.686 4.683 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.573 12.628 3.771 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.839 12.238 3.863 1.00 0.00 H new ATOM 100 N PHE A 9 4.817 8.738 6.075 1.00 0.00 N ATOM 101 CA PHE A 9 5.543 7.979 7.128 1.00 0.00 C ATOM 102 C PHE A 9 6.647 8.853 7.725 1.00 0.00 C ATOM 103 O PHE A 9 7.457 8.397 8.507 1.00 0.00 O ATOM 104 CB PHE A 9 6.140 6.773 6.404 1.00 0.00 C ATOM 105 CG PHE A 9 5.026 5.859 5.955 1.00 0.00 C ATOM 106 CD1 PHE A 9 4.316 6.144 4.782 1.00 0.00 C ATOM 107 CD2 PHE A 9 4.700 4.730 6.713 1.00 0.00 C ATOM 108 CE1 PHE A 9 3.281 5.298 4.368 1.00 0.00 C ATOM 109 CE2 PHE A 9 3.666 3.884 6.299 1.00 0.00 C ATOM 110 CZ PHE A 9 2.956 4.168 5.126 1.00 0.00 C ATOM 0 H PHE A 9 5.067 8.496 5.116 1.00 0.00 H new ATOM 0 HA PHE A 9 4.895 7.675 7.950 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.724 7.103 5.545 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.821 6.238 7.066 1.00 0.00 H new ATOM 0 HD1 PHE A 9 4.567 7.016 4.197 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.247 4.511 7.618 1.00 0.00 H new ATOM 0 HE1 PHE A 9 2.733 5.517 3.463 1.00 0.00 H new ATOM 0 HE2 PHE A 9 3.415 3.012 6.884 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.158 3.515 4.806 1.00 0.00 H new ATOM 120 N ASP A 10 6.683 10.108 7.361 1.00 0.00 N ATOM 121 CA ASP A 10 7.734 11.012 7.911 1.00 0.00 C ATOM 122 C ASP A 10 7.297 11.561 9.273 1.00 0.00 C ATOM 123 O ASP A 10 7.431 12.736 9.549 1.00 0.00 O ATOM 124 CB ASP A 10 7.856 12.144 6.890 1.00 0.00 C ATOM 125 CG ASP A 10 8.807 13.215 7.427 1.00 0.00 C ATOM 126 OD1 ASP A 10 9.499 12.936 8.392 1.00 0.00 O ATOM 127 OD2 ASP A 10 8.828 14.297 6.863 1.00 0.00 O ATOM 0 H ASP A 10 6.032 10.545 6.708 1.00 0.00 H new ATOM 0 HA ASP A 10 8.683 10.499 8.065 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.228 11.755 5.942 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.876 12.578 6.694 1.00 0.00 H new ATOM 132 N ASP A 11 6.779 10.710 10.126 1.00 0.00 N ATOM 133 CA ASP A 11 6.324 11.156 11.481 1.00 0.00 C ATOM 134 C ASP A 11 5.371 10.116 12.079 1.00 0.00 C ATOM 135 O ASP A 11 4.414 10.451 12.750 1.00 0.00 O ATOM 136 CB ASP A 11 5.580 12.477 11.259 1.00 0.00 C ATOM 137 CG ASP A 11 6.409 13.631 11.825 1.00 0.00 C ATOM 138 OD1 ASP A 11 6.741 13.577 12.998 1.00 0.00 O ATOM 139 OD2 ASP A 11 6.699 14.550 11.076 1.00 0.00 O ATOM 0 H ASP A 11 6.651 9.715 9.939 1.00 0.00 H new ATOM 0 HA ASP A 11 7.162 11.275 12.168 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.401 12.631 10.195 1.00 0.00 H new ATOM 0 HB3 ASP A 11 4.605 12.443 11.745 1.00 0.00 H new ATOM 144 N GLY A 12 5.625 8.857 11.843 1.00 0.00 N ATOM 145 CA GLY A 12 4.733 7.800 12.400 1.00 0.00 C ATOM 146 C GLY A 12 4.097 7.004 11.256 1.00 0.00 C ATOM 147 O GLY A 12 3.283 7.525 10.518 1.00 0.00 O ATOM 0 H GLY A 12 6.411 8.515 11.289 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.303 7.133 13.046 1.00 0.00 H new ATOM 0 HA3 GLY A 12 3.956 8.254 13.016 1.00 0.00 H new ATOM 151 N PRO A 13 4.488 5.760 11.147 1.00 0.00 N ATOM 152 CA PRO A 13 3.946 4.879 10.083 1.00 0.00 C ATOM 153 C PRO A 13 2.533 4.396 10.438 1.00 0.00 C ATOM 154 O PRO A 13 1.984 3.537 9.780 1.00 0.00 O ATOM 155 CB PRO A 13 4.918 3.704 10.063 1.00 0.00 C ATOM 156 CG PRO A 13 5.517 3.666 11.434 1.00 0.00 C ATOM 157 CD PRO A 13 5.467 5.066 11.991 1.00 0.00 C ATOM 0 HA PRO A 13 3.862 5.385 9.121 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.403 2.771 9.832 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.686 3.841 9.302 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.964 2.979 12.075 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.545 3.306 11.393 1.00 0.00 H new ATOM 0 HD2 PRO A 13 5.161 5.067 13.037 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.444 5.547 11.944 1.00 0.00 H new ATOM 165 N GLU A 14 1.946 4.935 11.474 1.00 0.00 N ATOM 166 CA GLU A 14 0.573 4.504 11.874 1.00 0.00 C ATOM 167 C GLU A 14 0.563 3.014 12.236 1.00 0.00 C ATOM 168 O GLU A 14 0.760 2.647 13.377 1.00 0.00 O ATOM 169 CB GLU A 14 -0.316 4.780 10.657 1.00 0.00 C ATOM 170 CG GLU A 14 -1.752 4.356 10.970 1.00 0.00 C ATOM 171 CD GLU A 14 -2.295 5.202 12.123 1.00 0.00 C ATOM 172 OE1 GLU A 14 -2.030 6.393 12.133 1.00 0.00 O ATOM 173 OE2 GLU A 14 -2.966 4.645 12.976 1.00 0.00 O ATOM 0 H GLU A 14 2.360 5.658 12.063 1.00 0.00 H new ATOM 0 HA GLU A 14 0.219 5.040 12.754 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.285 5.840 10.403 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.055 4.234 9.790 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -2.379 4.480 10.087 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.781 3.299 11.236 1.00 0.00 H new ATOM 180 N GLY A 15 0.333 2.153 11.282 1.00 0.00 N ATOM 181 CA GLY A 15 0.311 0.695 11.593 1.00 0.00 C ATOM 182 C GLY A 15 0.790 -0.106 10.379 1.00 0.00 C ATOM 183 O GLY A 15 0.540 -1.289 10.269 1.00 0.00 O ATOM 0 H GLY A 15 0.160 2.394 10.306 1.00 0.00 H new ATOM 0 HA2 GLY A 15 0.950 0.488 12.451 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.699 0.388 11.866 1.00 0.00 H new ATOM 187 N TRP A 16 1.477 0.527 9.469 1.00 0.00 N ATOM 188 CA TRP A 16 1.971 -0.206 8.267 1.00 0.00 C ATOM 189 C TRP A 16 2.948 -1.308 8.681 1.00 0.00 C ATOM 190 O TRP A 16 3.930 -1.061 9.353 1.00 0.00 O ATOM 191 CB TRP A 16 2.685 0.849 7.423 1.00 0.00 C ATOM 192 CG TRP A 16 1.715 1.471 6.471 1.00 0.00 C ATOM 193 CD1 TRP A 16 0.940 2.546 6.742 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.406 1.077 5.102 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.175 2.837 5.628 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.425 1.960 4.591 1.00 0.00 C ATOM 197 CE3 TRP A 16 1.875 0.050 4.264 1.00 0.00 C ATOM 198 CZ2 TRP A 16 -0.072 1.828 3.293 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.378 -0.085 2.958 1.00 0.00 C ATOM 200 CH2 TRP A 16 0.406 0.802 2.474 1.00 0.00 C ATOM 0 H TRP A 16 1.718 1.518 9.504 1.00 0.00 H new ATOM 0 HA TRP A 16 1.161 -0.688 7.719 1.00 0.00 H new ATOM 0 HB2 TRP A 16 3.118 1.614 8.068 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.508 0.393 6.873 1.00 0.00 H new ATOM 0 HD1 TRP A 16 0.922 3.088 7.676 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -0.493 3.606 5.578 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.623 -0.640 4.627 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.820 2.514 2.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 1.746 -0.877 2.322 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.027 0.692 1.469 1.00 0.00 H new ATOM 211 N VAL A 17 2.692 -2.522 8.278 1.00 0.00 N ATOM 212 CA VAL A 17 3.607 -3.640 8.639 1.00 0.00 C ATOM 213 C VAL A 17 4.246 -4.202 7.363 1.00 0.00 C ATOM 214 O VAL A 17 3.767 -3.983 6.269 1.00 0.00 O ATOM 215 CB VAL A 17 2.731 -4.697 9.360 1.00 0.00 C ATOM 216 CG1 VAL A 17 1.247 -4.520 9.010 1.00 0.00 C ATOM 217 CG2 VAL A 17 3.162 -6.107 8.952 1.00 0.00 C ATOM 0 H VAL A 17 1.886 -2.788 7.713 1.00 0.00 H new ATOM 0 HA VAL A 17 4.422 -3.322 9.290 1.00 0.00 H new ATOM 0 HB VAL A 17 2.865 -4.558 10.433 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.658 -5.275 9.530 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.917 -3.527 9.317 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.111 -4.631 7.934 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.540 -6.840 9.465 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.048 -6.225 7.874 1.00 0.00 H new ATOM 0 HG23 VAL A 17 4.206 -6.262 9.226 1.00 0.00 H new ATOM 227 N ALA A 18 5.323 -4.923 7.499 1.00 0.00 N ATOM 228 CA ALA A 18 5.991 -5.495 6.295 1.00 0.00 C ATOM 229 C ALA A 18 6.625 -6.847 6.634 1.00 0.00 C ATOM 230 O ALA A 18 6.998 -7.104 7.761 1.00 0.00 O ATOM 231 CB ALA A 18 7.066 -4.476 5.919 1.00 0.00 C ATOM 0 H ALA A 18 5.770 -5.141 8.390 1.00 0.00 H new ATOM 0 HA ALA A 18 5.292 -5.670 5.477 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.605 -4.824 5.038 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.597 -3.516 5.701 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.763 -4.360 6.749 1.00 0.00 H new ATOM 237 N TYR A 19 6.748 -7.712 5.666 1.00 0.00 N ATOM 238 CA TYR A 19 7.357 -9.047 5.931 1.00 0.00 C ATOM 239 C TYR A 19 8.295 -9.439 4.786 1.00 0.00 C ATOM 240 O TYR A 19 7.870 -9.656 3.668 1.00 0.00 O ATOM 241 CB TYR A 19 6.175 -10.017 6.016 1.00 0.00 C ATOM 242 CG TYR A 19 5.188 -9.722 4.911 1.00 0.00 C ATOM 243 CD1 TYR A 19 5.366 -10.289 3.643 1.00 0.00 C ATOM 244 CD2 TYR A 19 4.092 -8.885 5.155 1.00 0.00 C ATOM 245 CE1 TYR A 19 4.450 -10.019 2.620 1.00 0.00 C ATOM 246 CE2 TYR A 19 3.176 -8.614 4.131 1.00 0.00 C ATOM 247 CZ TYR A 19 3.355 -9.181 2.864 1.00 0.00 C ATOM 248 OH TYR A 19 2.451 -8.915 1.856 1.00 0.00 O ATOM 0 H TYR A 19 6.453 -7.553 4.703 1.00 0.00 H new ATOM 0 HA TYR A 19 7.953 -9.053 6.844 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.530 -11.044 5.934 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.687 -9.925 6.986 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.211 -10.935 3.454 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.953 -8.448 6.133 1.00 0.00 H new ATOM 0 HE1 TYR A 19 4.588 -10.457 1.642 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.332 -7.968 4.319 1.00 0.00 H new ATOM 0 HH TYR A 19 2.406 -9.681 1.246 1.00 0.00 H new ATOM 258 N GLY A 20 9.568 -9.531 5.057 1.00 0.00 N ATOM 259 CA GLY A 20 10.535 -9.908 3.987 1.00 0.00 C ATOM 260 C GLY A 20 11.920 -10.113 4.602 1.00 0.00 C ATOM 261 O GLY A 20 12.903 -9.572 4.137 1.00 0.00 O ATOM 0 H GLY A 20 9.981 -9.361 5.974 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.207 -10.821 3.491 1.00 0.00 H new ATOM 0 HA3 GLY A 20 10.575 -9.128 3.226 1.00 0.00 H new ATOM 265 N THR A 21 12.002 -10.886 5.650 1.00 0.00 N ATOM 266 CA THR A 21 13.320 -11.128 6.309 1.00 0.00 C ATOM 267 C THR A 21 14.026 -9.800 6.599 1.00 0.00 C ATOM 268 O THR A 21 15.222 -9.756 6.809 1.00 0.00 O ATOM 269 CB THR A 21 14.128 -11.959 5.308 1.00 0.00 C ATOM 270 OG1 THR A 21 14.639 -11.110 4.291 1.00 0.00 O ATOM 271 CG2 THR A 21 13.232 -13.030 4.681 1.00 0.00 C ATOM 0 H THR A 21 11.210 -11.363 6.081 1.00 0.00 H new ATOM 0 HA THR A 21 13.208 -11.641 7.264 1.00 0.00 H new ATOM 0 HB THR A 21 14.955 -12.443 5.827 1.00 0.00 H new ATOM 0 HG1 THR A 21 14.128 -10.274 4.275 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.812 -13.618 3.970 1.00 0.00 H new ATOM 0 HG22 THR A 21 12.845 -13.684 5.463 1.00 0.00 H new ATOM 0 HG23 THR A 21 12.400 -12.551 4.164 1.00 0.00 H new ATOM 279 N ASP A 22 13.297 -8.717 6.618 1.00 0.00 N ATOM 280 CA ASP A 22 13.925 -7.398 6.900 1.00 0.00 C ATOM 281 C ASP A 22 13.635 -6.972 8.341 1.00 0.00 C ATOM 282 O ASP A 22 13.402 -5.813 8.620 1.00 0.00 O ATOM 283 CB ASP A 22 13.262 -6.434 5.920 1.00 0.00 C ATOM 284 CG ASP A 22 11.741 -6.546 6.040 1.00 0.00 C ATOM 285 OD1 ASP A 22 11.218 -6.153 7.070 1.00 0.00 O ATOM 286 OD2 ASP A 22 11.126 -7.024 5.101 1.00 0.00 O ATOM 0 H ASP A 22 12.291 -8.691 6.450 1.00 0.00 H new ATOM 0 HA ASP A 22 15.009 -7.422 6.786 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.579 -5.412 6.129 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.574 -6.663 4.901 1.00 0.00 H new ATOM 291 N GLY A 23 13.641 -7.901 9.256 1.00 0.00 N ATOM 292 CA GLY A 23 13.359 -7.545 10.676 1.00 0.00 C ATOM 293 C GLY A 23 12.160 -6.597 10.730 1.00 0.00 C ATOM 294 O GLY A 23 11.317 -6.612 9.856 1.00 0.00 O ATOM 0 H GLY A 23 13.828 -8.889 9.083 1.00 0.00 H new ATOM 0 HA2 GLY A 23 13.152 -8.445 11.255 1.00 0.00 H new ATOM 0 HA3 GLY A 23 14.232 -7.072 11.125 1.00 0.00 H new ATOM 298 N PRO A 24 12.127 -5.797 11.760 1.00 0.00 N ATOM 299 CA PRO A 24 11.020 -4.825 11.933 1.00 0.00 C ATOM 300 C PRO A 24 11.168 -3.667 10.942 1.00 0.00 C ATOM 301 O PRO A 24 12.196 -3.024 10.874 1.00 0.00 O ATOM 302 CB PRO A 24 11.195 -4.338 13.369 1.00 0.00 C ATOM 303 CG PRO A 24 12.642 -4.554 13.680 1.00 0.00 C ATOM 304 CD PRO A 24 13.106 -5.724 12.850 1.00 0.00 C ATOM 0 HA PRO A 24 10.036 -5.257 11.751 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.924 -3.287 13.465 1.00 0.00 H new ATOM 0 HB3 PRO A 24 10.557 -4.895 14.055 1.00 0.00 H new ATOM 0 HG2 PRO A 24 13.223 -3.662 13.446 1.00 0.00 H new ATOM 0 HG3 PRO A 24 12.781 -4.756 14.742 1.00 0.00 H new ATOM 0 HD2 PRO A 24 14.116 -5.568 12.470 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.124 -6.645 13.433 1.00 0.00 H new ATOM 312 N LEU A 25 10.149 -3.398 10.171 1.00 0.00 N ATOM 313 CA LEU A 25 10.234 -2.282 9.185 1.00 0.00 C ATOM 314 C LEU A 25 10.903 -1.063 9.826 1.00 0.00 C ATOM 315 O LEU A 25 11.061 -0.991 11.029 1.00 0.00 O ATOM 316 CB LEU A 25 8.783 -1.969 8.814 1.00 0.00 C ATOM 317 CG LEU A 25 8.007 -1.569 10.070 1.00 0.00 C ATOM 318 CD1 LEU A 25 6.950 -0.526 9.705 1.00 0.00 C ATOM 319 CD2 LEU A 25 7.321 -2.804 10.659 1.00 0.00 C ATOM 0 H LEU A 25 9.262 -3.902 10.181 1.00 0.00 H new ATOM 0 HA LEU A 25 10.828 -2.546 8.310 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.750 -1.162 8.082 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.320 -2.840 8.350 1.00 0.00 H new ATOM 0 HG LEU A 25 8.694 -1.149 10.804 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.397 -0.240 10.600 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.437 0.353 9.283 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.262 -0.946 8.971 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.768 -2.521 11.554 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.633 -3.223 9.925 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.073 -3.549 10.918 1.00 0.00 H new ATOM 331 N ASP A 26 11.301 -0.105 9.034 1.00 0.00 N ATOM 332 CA ASP A 26 11.963 1.105 9.602 1.00 0.00 C ATOM 333 C ASP A 26 11.242 2.372 9.136 1.00 0.00 C ATOM 334 O ASP A 26 10.674 2.416 8.064 1.00 0.00 O ATOM 335 CB ASP A 26 13.390 1.069 9.056 1.00 0.00 C ATOM 336 CG ASP A 26 14.299 0.338 10.047 1.00 0.00 C ATOM 337 OD1 ASP A 26 14.193 -0.874 10.134 1.00 0.00 O ATOM 338 OD2 ASP A 26 15.084 1.003 10.702 1.00 0.00 O ATOM 0 H ASP A 26 11.197 -0.107 8.019 1.00 0.00 H new ATOM 0 HA ASP A 26 11.943 1.112 10.692 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.408 0.565 8.090 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.754 2.083 8.893 1.00 0.00 H new ATOM 343 N THR A 27 11.259 3.403 9.936 1.00 0.00 N ATOM 344 CA THR A 27 10.575 4.664 9.540 1.00 0.00 C ATOM 345 C THR A 27 11.520 5.857 9.714 1.00 0.00 C ATOM 346 O THR A 27 11.603 6.723 8.866 1.00 0.00 O ATOM 347 CB THR A 27 9.388 4.775 10.495 1.00 0.00 C ATOM 348 OG1 THR A 27 9.717 4.152 11.729 1.00 0.00 O ATOM 349 CG2 THR A 27 8.171 4.085 9.879 1.00 0.00 C ATOM 0 H THR A 27 11.718 3.425 10.847 1.00 0.00 H new ATOM 0 HA THR A 27 10.264 4.660 8.495 1.00 0.00 H new ATOM 0 HB THR A 27 9.156 5.826 10.669 1.00 0.00 H new ATOM 0 HG1 THR A 27 8.958 4.223 12.344 1.00 0.00 H new ATOM 0 HG21 THR A 27 7.324 4.164 10.561 1.00 0.00 H new ATOM 0 HG22 THR A 27 7.921 4.564 8.933 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.399 3.034 9.704 1.00 0.00 H new ATOM 357 N SER A 28 12.232 5.907 10.806 1.00 0.00 N ATOM 358 CA SER A 28 13.171 7.043 11.034 1.00 0.00 C ATOM 359 C SER A 28 12.421 8.376 10.957 1.00 0.00 C ATOM 360 O SER A 28 12.940 9.363 10.474 1.00 0.00 O ATOM 361 CB SER A 28 14.200 6.940 9.909 1.00 0.00 C ATOM 362 OG SER A 28 14.847 8.195 9.748 1.00 0.00 O ATOM 0 H SER A 28 12.205 5.211 11.551 1.00 0.00 H new ATOM 0 HA SER A 28 13.638 7.000 12.018 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.933 6.167 10.141 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.712 6.648 8.979 1.00 0.00 H new ATOM 0 HG SER A 28 14.174 8.896 9.620 1.00 0.00 H new ATOM 368 N THR A 29 11.205 8.412 11.430 1.00 0.00 N ATOM 369 CA THR A 29 10.423 9.682 11.384 1.00 0.00 C ATOM 370 C THR A 29 10.616 10.376 10.033 1.00 0.00 C ATOM 371 O THR A 29 10.616 11.588 9.942 1.00 0.00 O ATOM 372 CB THR A 29 10.994 10.540 12.514 1.00 0.00 C ATOM 373 OG1 THR A 29 12.316 10.940 12.181 1.00 0.00 O ATOM 374 CG2 THR A 29 11.015 9.730 13.812 1.00 0.00 C ATOM 0 H THR A 29 10.719 7.618 11.846 1.00 0.00 H new ATOM 0 HA THR A 29 9.353 9.511 11.502 1.00 0.00 H new ATOM 0 HB THR A 29 10.370 11.424 12.650 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.501 10.711 11.246 1.00 0.00 H new ATOM 0 HG21 THR A 29 11.422 10.342 14.617 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.000 9.424 14.067 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.638 8.845 13.679 1.00 0.00 H new ATOM 382 N GLY A 30 10.780 9.618 8.984 1.00 0.00 N ATOM 383 CA GLY A 30 10.973 10.235 7.641 1.00 0.00 C ATOM 384 C GLY A 30 10.210 9.423 6.593 1.00 0.00 C ATOM 385 O GLY A 30 9.288 9.909 5.968 1.00 0.00 O ATOM 0 H GLY A 30 10.789 8.598 8.999 1.00 0.00 H new ATOM 0 HA2 GLY A 30 10.618 11.265 7.648 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.034 10.265 7.392 1.00 0.00 H new ATOM 389 N ALA A 31 10.586 8.190 6.397 1.00 0.00 N ATOM 390 CA ALA A 31 9.882 7.346 5.390 1.00 0.00 C ATOM 391 C ALA A 31 9.931 5.875 5.810 1.00 0.00 C ATOM 392 O ALA A 31 10.872 5.430 6.436 1.00 0.00 O ATOM 393 CB ALA A 31 10.655 7.558 4.088 1.00 0.00 C ATOM 0 H ALA A 31 11.351 7.730 6.891 1.00 0.00 H new ATOM 0 HA ALA A 31 8.830 7.613 5.288 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.198 6.968 3.293 1.00 0.00 H new ATOM 0 HB2 ALA A 31 10.629 8.614 3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.690 7.244 4.224 1.00 0.00 H new ATOM 399 N LEU A 32 8.928 5.113 5.467 1.00 0.00 N ATOM 400 CA LEU A 32 8.928 3.672 5.847 1.00 0.00 C ATOM 401 C LEU A 32 9.632 2.850 4.767 1.00 0.00 C ATOM 402 O LEU A 32 9.183 2.774 3.641 1.00 0.00 O ATOM 403 CB LEU A 32 7.453 3.283 5.941 1.00 0.00 C ATOM 404 CG LEU A 32 7.327 1.927 6.636 1.00 0.00 C ATOM 405 CD1 LEU A 32 6.278 2.017 7.746 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.902 0.869 5.613 1.00 0.00 C ATOM 0 H LEU A 32 8.111 5.425 4.942 1.00 0.00 H new ATOM 0 HA LEU A 32 9.454 3.490 6.784 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.901 4.041 6.496 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.014 3.235 4.944 1.00 0.00 H new ATOM 0 HG LEU A 32 8.288 1.649 7.069 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.188 1.050 8.241 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.581 2.770 8.473 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.316 2.295 7.316 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.812 -0.099 6.107 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.941 1.147 5.180 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.651 0.805 4.823 1.00 0.00 H new ATOM 418 N CYS A 33 10.738 2.241 5.096 1.00 0.00 N ATOM 419 CA CYS A 33 11.467 1.435 4.077 1.00 0.00 C ATOM 420 C CYS A 33 11.615 -0.017 4.538 1.00 0.00 C ATOM 421 O CYS A 33 11.925 -0.290 5.681 1.00 0.00 O ATOM 422 CB CYS A 33 12.840 2.098 3.958 1.00 0.00 C ATOM 423 SG CYS A 33 12.647 3.791 3.346 1.00 0.00 S ATOM 0 H CYS A 33 11.166 2.266 6.021 1.00 0.00 H new ATOM 0 HA CYS A 33 10.937 1.408 3.125 1.00 0.00 H new ATOM 0 HB2 CYS A 33 13.336 2.106 4.928 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.474 1.526 3.280 1.00 0.00 H new ATOM 428 N VAL A 34 11.413 -0.949 3.647 1.00 0.00 N ATOM 429 CA VAL A 34 11.559 -2.387 4.018 1.00 0.00 C ATOM 430 C VAL A 34 12.790 -2.965 3.318 1.00 0.00 C ATOM 431 O VAL A 34 13.103 -2.605 2.202 1.00 0.00 O ATOM 432 CB VAL A 34 10.278 -3.075 3.536 1.00 0.00 C ATOM 433 CG1 VAL A 34 9.152 -2.807 4.536 1.00 0.00 C ATOM 434 CG2 VAL A 34 9.876 -2.529 2.162 1.00 0.00 C ATOM 0 H VAL A 34 11.153 -0.777 2.676 1.00 0.00 H new ATOM 0 HA VAL A 34 11.695 -2.530 5.090 1.00 0.00 H new ATOM 0 HB VAL A 34 10.455 -4.148 3.458 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.239 -3.295 4.195 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.432 -3.201 5.513 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.982 -1.733 4.613 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.964 -3.023 1.827 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.701 -1.456 2.234 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.676 -2.719 1.447 1.00 0.00 H new ATOM 444 N ALA A 35 13.504 -3.841 3.970 1.00 0.00 N ATOM 445 CA ALA A 35 14.732 -4.416 3.346 1.00 0.00 C ATOM 446 C ALA A 35 14.412 -5.677 2.538 1.00 0.00 C ATOM 447 O ALA A 35 14.460 -6.779 3.045 1.00 0.00 O ATOM 448 CB ALA A 35 15.640 -4.762 4.526 1.00 0.00 C ATOM 0 H ALA A 35 13.292 -4.184 4.907 1.00 0.00 H new ATOM 0 HA ALA A 35 15.193 -3.716 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.570 -5.193 4.155 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.860 -3.858 5.093 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.139 -5.483 5.172 1.00 0.00 H new ATOM 454 N VAL A 36 14.111 -5.529 1.277 1.00 0.00 N ATOM 455 CA VAL A 36 13.818 -6.730 0.444 1.00 0.00 C ATOM 456 C VAL A 36 15.124 -7.489 0.177 1.00 0.00 C ATOM 457 O VAL A 36 16.045 -6.948 -0.403 1.00 0.00 O ATOM 458 CB VAL A 36 13.230 -6.183 -0.857 1.00 0.00 C ATOM 459 CG1 VAL A 36 13.006 -7.335 -1.836 1.00 0.00 C ATOM 460 CG2 VAL A 36 11.891 -5.497 -0.565 1.00 0.00 C ATOM 0 H VAL A 36 14.055 -4.635 0.790 1.00 0.00 H new ATOM 0 HA VAL A 36 13.130 -7.423 0.928 1.00 0.00 H new ATOM 0 HB VAL A 36 13.921 -5.461 -1.293 1.00 0.00 H new ATOM 0 HG11 VAL A 36 12.587 -6.947 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 36 13.957 -7.826 -2.044 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.314 -8.055 -1.399 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.472 -5.107 -1.493 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.200 -6.219 -0.130 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.048 -4.677 0.135 1.00 0.00 H new ATOM 470 N PRO A 37 15.165 -8.714 0.628 1.00 0.00 N ATOM 471 CA PRO A 37 16.382 -9.554 0.457 1.00 0.00 C ATOM 472 C PRO A 37 16.614 -9.910 -1.016 1.00 0.00 C ATOM 473 O PRO A 37 15.689 -10.008 -1.797 1.00 0.00 O ATOM 474 CB PRO A 37 16.070 -10.803 1.280 1.00 0.00 C ATOM 475 CG PRO A 37 14.578 -10.861 1.333 1.00 0.00 C ATOM 476 CD PRO A 37 14.094 -9.436 1.328 1.00 0.00 C ATOM 0 HA PRO A 37 17.292 -9.047 0.778 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.485 -11.697 0.815 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.499 -10.736 2.280 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.181 -11.409 0.478 1.00 0.00 H new ATOM 0 HG3 PRO A 37 14.242 -11.382 2.230 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.139 -9.338 0.811 1.00 0.00 H new ATOM 0 HD3 PRO A 37 13.949 -9.057 2.340 1.00 0.00 H new ATOM 484 N ALA A 38 17.851 -10.109 -1.393 1.00 0.00 N ATOM 485 CA ALA A 38 18.159 -10.465 -2.810 1.00 0.00 C ATOM 486 C ALA A 38 17.160 -11.503 -3.318 1.00 0.00 C ATOM 487 O ALA A 38 16.724 -12.368 -2.585 1.00 0.00 O ATOM 488 CB ALA A 38 19.570 -11.052 -2.774 1.00 0.00 C ATOM 0 H ALA A 38 18.662 -10.040 -0.779 1.00 0.00 H new ATOM 0 HA ALA A 38 18.094 -9.605 -3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 38 19.870 -11.339 -3.782 1.00 0.00 H new ATOM 0 HB2 ALA A 38 20.265 -10.306 -2.387 1.00 0.00 H new ATOM 0 HB3 ALA A 38 19.583 -11.930 -2.128 1.00 0.00 H new ATOM 494 N GLY A 39 16.789 -11.422 -4.566 1.00 0.00 N ATOM 495 CA GLY A 39 15.813 -12.403 -5.113 1.00 0.00 C ATOM 496 C GLY A 39 14.676 -12.583 -4.109 1.00 0.00 C ATOM 497 O GLY A 39 14.625 -13.555 -3.382 1.00 0.00 O ATOM 0 H GLY A 39 17.119 -10.720 -5.229 1.00 0.00 H new ATOM 0 HA2 GLY A 39 15.421 -12.052 -6.068 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.304 -13.358 -5.302 1.00 0.00 H new ATOM 501 N SER A 40 13.765 -11.650 -4.056 1.00 0.00 N ATOM 502 CA SER A 40 12.635 -11.768 -3.091 1.00 0.00 C ATOM 503 C SER A 40 11.486 -12.564 -3.711 1.00 0.00 C ATOM 504 O SER A 40 10.339 -12.419 -3.339 1.00 0.00 O ATOM 505 CB SER A 40 12.212 -10.328 -2.801 1.00 0.00 C ATOM 506 OG SER A 40 10.941 -10.081 -3.386 1.00 0.00 O ATOM 0 H SER A 40 13.754 -10.812 -4.638 1.00 0.00 H new ATOM 0 HA SER A 40 12.920 -12.296 -2.181 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.168 -10.160 -1.725 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.950 -9.633 -3.202 1.00 0.00 H new ATOM 0 HG SER A 40 10.431 -9.470 -2.814 1.00 0.00 H new ATOM 512 N ALA A 41 11.797 -13.413 -4.644 1.00 0.00 N ATOM 513 CA ALA A 41 10.740 -14.241 -5.293 1.00 0.00 C ATOM 514 C ALA A 41 10.617 -15.575 -4.566 1.00 0.00 C ATOM 515 O ALA A 41 10.095 -16.543 -5.080 1.00 0.00 O ATOM 516 CB ALA A 41 11.220 -14.451 -6.726 1.00 0.00 C ATOM 0 H ALA A 41 12.743 -13.573 -4.990 1.00 0.00 H new ATOM 0 HA ALA A 41 9.760 -13.765 -5.265 1.00 0.00 H new ATOM 0 HB1 ALA A 41 10.492 -15.054 -7.269 1.00 0.00 H new ATOM 0 HB2 ALA A 41 11.330 -13.485 -7.218 1.00 0.00 H new ATOM 0 HB3 ALA A 41 12.181 -14.965 -6.716 1.00 0.00 H new ATOM 522 N GLN A 42 11.092 -15.609 -3.363 1.00 0.00 N ATOM 523 CA GLN A 42 11.017 -16.854 -2.547 1.00 0.00 C ATOM 524 C GLN A 42 9.713 -16.864 -1.756 1.00 0.00 C ATOM 525 O GLN A 42 8.653 -16.630 -2.303 1.00 0.00 O ATOM 526 CB GLN A 42 12.238 -16.796 -1.623 1.00 0.00 C ATOM 527 CG GLN A 42 12.177 -15.540 -0.752 1.00 0.00 C ATOM 528 CD GLN A 42 13.261 -15.618 0.324 1.00 0.00 C ATOM 529 OE1 GLN A 42 13.416 -16.633 0.974 1.00 0.00 O ATOM 530 NE2 GLN A 42 14.023 -14.581 0.542 1.00 0.00 N ATOM 0 H GLN A 42 11.537 -14.818 -2.897 1.00 0.00 H new ATOM 0 HA GLN A 42 11.025 -17.763 -3.149 1.00 0.00 H new ATOM 0 HB2 GLN A 42 12.269 -17.684 -0.992 1.00 0.00 H new ATOM 0 HB3 GLN A 42 13.153 -16.793 -2.216 1.00 0.00 H new ATOM 0 HG2 GLN A 42 12.321 -14.651 -1.366 1.00 0.00 H new ATOM 0 HG3 GLN A 42 11.194 -15.452 -0.289 1.00 0.00 H new ATOM 0 HE21 GLN A 42 13.893 -13.729 -0.003 1.00 0.00 H new ATOM 0 HE22 GLN A 42 14.748 -14.623 1.258 1.00 0.00 H new ATOM 539 N TYR A 43 9.779 -17.135 -0.484 1.00 0.00 N ATOM 540 CA TYR A 43 8.536 -17.158 0.347 1.00 0.00 C ATOM 541 C TYR A 43 7.577 -16.049 -0.103 1.00 0.00 C ATOM 542 O TYR A 43 6.374 -16.174 0.005 1.00 0.00 O ATOM 543 CB TYR A 43 9.002 -16.924 1.785 1.00 0.00 C ATOM 544 CG TYR A 43 9.661 -15.572 1.896 1.00 0.00 C ATOM 545 CD1 TYR A 43 8.886 -14.408 1.848 1.00 0.00 C ATOM 546 CD2 TYR A 43 11.048 -15.484 2.052 1.00 0.00 C ATOM 547 CE1 TYR A 43 9.499 -13.154 1.953 1.00 0.00 C ATOM 548 CE2 TYR A 43 11.662 -14.230 2.158 1.00 0.00 C ATOM 549 CZ TYR A 43 10.888 -13.065 2.108 1.00 0.00 C ATOM 550 OH TYR A 43 11.495 -11.830 2.210 1.00 0.00 O ATOM 0 H TYR A 43 10.641 -17.343 0.021 1.00 0.00 H new ATOM 0 HA TYR A 43 7.996 -18.100 0.251 1.00 0.00 H new ATOM 0 HB2 TYR A 43 8.153 -16.982 2.466 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.702 -17.705 2.082 1.00 0.00 H new ATOM 0 HD1 TYR A 43 7.815 -14.477 1.730 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.645 -16.383 2.091 1.00 0.00 H new ATOM 0 HE1 TYR A 43 8.901 -12.255 1.914 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.733 -14.162 2.278 1.00 0.00 H new ATOM 0 HH TYR A 43 12.042 -11.667 1.413 1.00 0.00 H new ATOM 560 N GLY A 44 8.102 -14.971 -0.626 1.00 0.00 N ATOM 561 CA GLY A 44 7.221 -13.868 -1.102 1.00 0.00 C ATOM 562 C GLY A 44 7.269 -12.695 -0.124 1.00 0.00 C ATOM 563 O GLY A 44 6.773 -12.776 0.982 1.00 0.00 O ATOM 0 H GLY A 44 9.102 -14.809 -0.743 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.540 -13.539 -2.091 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.197 -14.227 -1.200 1.00 0.00 H new ATOM 567 N VAL A 45 7.845 -11.594 -0.528 1.00 0.00 N ATOM 568 CA VAL A 45 7.900 -10.411 0.375 1.00 0.00 C ATOM 569 C VAL A 45 6.652 -9.560 0.138 1.00 0.00 C ATOM 570 O VAL A 45 5.901 -9.806 -0.784 1.00 0.00 O ATOM 571 CB VAL A 45 9.167 -9.643 -0.028 1.00 0.00 C ATOM 572 CG1 VAL A 45 9.637 -8.788 1.149 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.280 -10.627 -0.417 1.00 0.00 C ATOM 0 H VAL A 45 8.278 -11.464 -1.442 1.00 0.00 H new ATOM 0 HA VAL A 45 7.929 -10.682 1.431 1.00 0.00 H new ATOM 0 HB VAL A 45 8.940 -9.005 -0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.537 -8.242 0.865 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.853 -8.081 1.421 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.857 -9.431 2.001 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.174 -10.072 -0.701 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.508 -11.272 0.431 1.00 0.00 H new ATOM 0 HG23 VAL A 45 9.949 -11.237 -1.258 1.00 0.00 H new ATOM 583 N GLY A 46 6.411 -8.566 0.948 1.00 0.00 N ATOM 584 CA GLY A 46 5.197 -7.730 0.726 1.00 0.00 C ATOM 585 C GLY A 46 4.837 -6.961 1.998 1.00 0.00 C ATOM 586 O GLY A 46 5.171 -7.359 3.096 1.00 0.00 O ATOM 0 H GLY A 46 6.992 -8.299 1.743 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.374 -7.031 -0.091 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.361 -8.363 0.428 1.00 0.00 H new ATOM 590 N VAL A 47 4.147 -5.862 1.852 1.00 0.00 N ATOM 591 CA VAL A 47 3.745 -5.058 3.041 1.00 0.00 C ATOM 592 C VAL A 47 2.218 -4.949 3.097 1.00 0.00 C ATOM 593 O VAL A 47 1.572 -4.673 2.106 1.00 0.00 O ATOM 594 CB VAL A 47 4.375 -3.682 2.818 1.00 0.00 C ATOM 595 CG1 VAL A 47 4.082 -2.783 4.020 1.00 0.00 C ATOM 596 CG2 VAL A 47 5.889 -3.836 2.656 1.00 0.00 C ATOM 0 H VAL A 47 3.843 -5.485 0.954 1.00 0.00 H new ATOM 0 HA VAL A 47 4.071 -5.505 3.980 1.00 0.00 H new ATOM 0 HB VAL A 47 3.955 -3.233 1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.532 -1.803 3.860 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.004 -2.673 4.138 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.501 -3.231 4.921 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.339 -2.856 2.497 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.307 -4.286 3.556 1.00 0.00 H new ATOM 0 HG23 VAL A 47 6.100 -4.476 1.799 1.00 0.00 H new ATOM 606 N VAL A 48 1.634 -5.169 4.241 1.00 0.00 N ATOM 607 CA VAL A 48 0.148 -5.082 4.342 1.00 0.00 C ATOM 608 C VAL A 48 -0.259 -4.008 5.353 1.00 0.00 C ATOM 609 O VAL A 48 0.472 -3.698 6.272 1.00 0.00 O ATOM 610 CB VAL A 48 -0.295 -6.465 4.821 1.00 0.00 C ATOM 611 CG1 VAL A 48 0.026 -7.505 3.747 1.00 0.00 C ATOM 612 CG2 VAL A 48 0.448 -6.819 6.111 1.00 0.00 C ATOM 0 H VAL A 48 2.117 -5.404 5.108 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.313 -4.809 3.393 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.369 -6.457 5.009 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.290 -8.491 4.089 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.502 -7.253 2.827 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.099 -7.513 3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.133 -7.805 6.454 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.522 -6.826 5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.219 -6.078 6.877 1.00 0.00 H new ATOM 622 N LEU A 49 -1.423 -3.440 5.191 1.00 0.00 N ATOM 623 CA LEU A 49 -1.878 -2.389 6.147 1.00 0.00 C ATOM 624 C LEU A 49 -3.371 -2.552 6.440 1.00 0.00 C ATOM 625 O LEU A 49 -4.209 -1.958 5.790 1.00 0.00 O ATOM 626 CB LEU A 49 -1.617 -1.060 5.439 1.00 0.00 C ATOM 627 CG LEU A 49 -2.232 0.079 6.254 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.303 0.434 7.416 1.00 0.00 C ATOM 629 CD2 LEU A 49 -2.419 1.305 5.358 1.00 0.00 C ATOM 0 H LEU A 49 -2.078 -3.657 4.440 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.355 -2.450 7.101 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.545 -0.901 5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.047 -1.078 4.437 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.199 -0.236 6.645 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.741 1.246 7.997 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.170 -0.439 8.055 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.335 0.749 7.025 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.857 2.117 5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.452 1.620 4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -3.081 1.053 4.530 1.00 0.00 H new ATOM 641 N ASN A 50 -3.710 -3.352 7.413 1.00 0.00 N ATOM 642 CA ASN A 50 -5.150 -3.552 7.747 1.00 0.00 C ATOM 643 C ASN A 50 -5.742 -2.266 8.331 1.00 0.00 C ATOM 644 O ASN A 50 -5.506 -1.926 9.473 1.00 0.00 O ATOM 645 CB ASN A 50 -5.163 -4.670 8.789 1.00 0.00 C ATOM 646 CG ASN A 50 -5.309 -6.021 8.086 1.00 0.00 C ATOM 647 OD1 ASN A 50 -5.996 -6.129 7.090 1.00 0.00 O ATOM 648 ND2 ASN A 50 -4.688 -7.063 8.566 1.00 0.00 N ATOM 0 H ASN A 50 -3.053 -3.876 7.991 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.746 -3.805 6.870 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.242 -4.649 9.372 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -5.986 -4.521 9.488 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.779 -7.968 8.105 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.111 -6.972 9.402 1.00 0.00 H new ATOM 655 N GLY A 51 -6.512 -1.550 7.557 1.00 0.00 N ATOM 656 CA GLY A 51 -7.118 -0.289 8.073 1.00 0.00 C ATOM 657 C GLY A 51 -7.412 0.658 6.907 1.00 0.00 C ATOM 658 O GLY A 51 -6.726 1.641 6.707 1.00 0.00 O ATOM 0 H GLY A 51 -6.747 -1.783 6.592 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.038 -0.511 8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.440 0.189 8.780 1.00 0.00 H new ATOM 662 N VAL A 52 -8.429 0.374 6.140 1.00 0.00 N ATOM 663 CA VAL A 52 -8.768 1.264 4.991 1.00 0.00 C ATOM 664 C VAL A 52 -10.193 1.804 5.151 1.00 0.00 C ATOM 665 O VAL A 52 -10.920 1.401 6.036 1.00 0.00 O ATOM 666 CB VAL A 52 -8.661 0.371 3.755 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.362 1.044 2.574 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.187 0.154 3.410 1.00 0.00 C ATOM 0 H VAL A 52 -9.040 -0.434 6.258 1.00 0.00 H new ATOM 0 HA VAL A 52 -8.107 2.128 4.922 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.135 -0.589 3.961 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.285 0.406 1.694 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.413 1.202 2.817 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.889 2.004 2.369 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.110 -0.483 2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.716 1.115 3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.684 -0.326 4.249 1.00 0.00 H new ATOM 678 N ALA A 53 -10.597 2.719 4.310 1.00 0.00 N ATOM 679 CA ALA A 53 -11.974 3.280 4.433 1.00 0.00 C ATOM 680 C ALA A 53 -12.663 3.346 3.065 1.00 0.00 C ATOM 681 O ALA A 53 -12.772 4.397 2.466 1.00 0.00 O ATOM 682 CB ALA A 53 -11.776 4.686 4.999 1.00 0.00 C ATOM 0 H ALA A 53 -10.037 3.100 3.548 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.608 2.663 5.069 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.745 5.169 5.120 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -11.279 4.622 5.967 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.162 5.271 4.314 1.00 0.00 H new ATOM 688 N ILE A 54 -13.142 2.235 2.574 1.00 0.00 N ATOM 689 CA ILE A 54 -13.838 2.240 1.254 1.00 0.00 C ATOM 690 C ILE A 54 -15.287 1.774 1.435 1.00 0.00 C ATOM 691 O ILE A 54 -15.645 1.225 2.458 1.00 0.00 O ATOM 692 CB ILE A 54 -13.059 1.258 0.376 1.00 0.00 C ATOM 693 CG1 ILE A 54 -11.627 1.761 0.194 1.00 0.00 C ATOM 694 CG2 ILE A 54 -13.730 1.154 -0.993 1.00 0.00 C ATOM 695 CD1 ILE A 54 -11.658 3.228 -0.228 1.00 0.00 C ATOM 0 H ILE A 54 -13.082 1.324 3.029 1.00 0.00 H new ATOM 0 HA ILE A 54 -13.870 3.233 0.805 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.047 0.279 0.855 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.069 1.650 1.124 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.113 1.165 -0.560 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.175 0.455 -1.618 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -14.753 0.798 -0.871 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -13.741 2.135 -1.468 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -10.638 3.591 -0.359 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.201 3.325 -1.168 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.157 3.817 0.541 1.00 0.00 H new ATOM 707 N GLU A 55 -16.127 1.991 0.459 1.00 0.00 N ATOM 708 CA GLU A 55 -17.548 1.558 0.599 1.00 0.00 C ATOM 709 C GLU A 55 -18.213 1.417 -0.772 1.00 0.00 C ATOM 710 O GLU A 55 -18.203 2.329 -1.575 1.00 0.00 O ATOM 711 CB GLU A 55 -18.220 2.668 1.407 1.00 0.00 C ATOM 712 CG GLU A 55 -18.383 2.216 2.860 1.00 0.00 C ATOM 713 CD GLU A 55 -19.871 2.155 3.211 1.00 0.00 C ATOM 714 OE1 GLU A 55 -20.422 3.188 3.551 1.00 0.00 O ATOM 715 OE2 GLU A 55 -20.433 1.075 3.135 1.00 0.00 O ATOM 0 H GLU A 55 -15.894 2.446 -0.423 1.00 0.00 H new ATOM 0 HA GLU A 55 -17.630 0.585 1.084 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.621 3.578 1.363 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.193 2.906 0.978 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.925 1.237 3.001 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.869 2.908 3.527 1.00 0.00 H new ATOM 722 N GLU A 56 -18.799 0.277 -1.035 1.00 0.00 N ATOM 723 CA GLU A 56 -19.483 0.055 -2.344 1.00 0.00 C ATOM 724 C GLU A 56 -18.712 0.723 -3.486 1.00 0.00 C ATOM 725 O GLU A 56 -17.519 0.936 -3.403 1.00 0.00 O ATOM 726 CB GLU A 56 -20.861 0.692 -2.180 1.00 0.00 C ATOM 727 CG GLU A 56 -20.712 2.210 -2.130 1.00 0.00 C ATOM 728 CD GLU A 56 -22.089 2.865 -2.253 1.00 0.00 C ATOM 729 OE1 GLU A 56 -23.048 2.275 -1.784 1.00 0.00 O ATOM 730 OE2 GLU A 56 -22.161 3.946 -2.814 1.00 0.00 O ATOM 0 H GLU A 56 -18.833 -0.515 -0.394 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.545 -1.004 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.508 0.406 -3.009 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.335 0.331 -1.267 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.238 2.508 -1.195 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -20.063 2.549 -2.938 1.00 0.00 H new ATOM 737 N GLY A 57 -19.390 1.052 -4.553 1.00 0.00 N ATOM 738 CA GLY A 57 -18.703 1.704 -5.704 1.00 0.00 C ATOM 739 C GLY A 57 -18.548 3.200 -5.428 1.00 0.00 C ATOM 740 O GLY A 57 -19.326 4.011 -5.891 1.00 0.00 O ATOM 0 H GLY A 57 -20.391 0.897 -4.677 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -17.725 1.250 -5.862 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -19.277 1.550 -6.618 1.00 0.00 H new ATOM 744 N THR A 58 -17.549 3.574 -4.677 1.00 0.00 N ATOM 745 CA THR A 58 -17.343 5.019 -4.372 1.00 0.00 C ATOM 746 C THR A 58 -16.059 5.518 -5.046 1.00 0.00 C ATOM 747 O THR A 58 -15.298 4.750 -5.600 1.00 0.00 O ATOM 748 CB THR A 58 -17.233 5.083 -2.843 1.00 0.00 C ATOM 749 OG1 THR A 58 -18.536 5.177 -2.284 1.00 0.00 O ATOM 750 CG2 THR A 58 -16.411 6.305 -2.421 1.00 0.00 C ATOM 0 H THR A 58 -16.866 2.941 -4.261 1.00 0.00 H new ATOM 0 HA THR A 58 -18.151 5.650 -4.742 1.00 0.00 H new ATOM 0 HB THR A 58 -16.737 4.181 -2.484 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.794 4.310 -1.908 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.341 6.338 -1.334 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.410 6.235 -2.847 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.896 7.212 -2.781 1.00 0.00 H new ATOM 758 N THR A 59 -15.817 6.800 -5.003 1.00 0.00 N ATOM 759 CA THR A 59 -14.586 7.348 -5.642 1.00 0.00 C ATOM 760 C THR A 59 -13.431 7.365 -4.637 1.00 0.00 C ATOM 761 O THR A 59 -13.637 7.425 -3.442 1.00 0.00 O ATOM 762 CB THR A 59 -14.956 8.774 -6.053 1.00 0.00 C ATOM 763 OG1 THR A 59 -16.345 8.835 -6.344 1.00 0.00 O ATOM 764 CG2 THR A 59 -14.155 9.174 -7.293 1.00 0.00 C ATOM 0 H THR A 59 -16.418 7.491 -4.554 1.00 0.00 H new ATOM 0 HA THR A 59 -14.260 6.748 -6.492 1.00 0.00 H new ATOM 0 HB THR A 59 -14.724 9.459 -5.238 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.585 9.748 -6.606 1.00 0.00 H new ATOM 0 HG21 THR A 59 -14.420 10.190 -7.585 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.089 9.127 -7.069 1.00 0.00 H new ATOM 0 HG23 THR A 59 -14.384 8.490 -8.110 1.00 0.00 H new ATOM 772 N TYR A 60 -12.217 7.313 -5.114 1.00 0.00 N ATOM 773 CA TYR A 60 -11.049 7.328 -4.187 1.00 0.00 C ATOM 774 C TYR A 60 -9.786 7.761 -4.934 1.00 0.00 C ATOM 775 O TYR A 60 -9.789 7.921 -6.139 1.00 0.00 O ATOM 776 CB TYR A 60 -10.908 5.887 -3.698 1.00 0.00 C ATOM 777 CG TYR A 60 -12.007 5.579 -2.712 1.00 0.00 C ATOM 778 CD1 TYR A 60 -11.951 6.099 -1.414 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.082 4.771 -3.096 1.00 0.00 C ATOM 780 CE1 TYR A 60 -12.972 5.811 -0.501 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.102 4.482 -2.184 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.048 5.002 -0.886 1.00 0.00 C ATOM 783 OH TYR A 60 -15.055 4.718 0.014 1.00 0.00 O ATOM 0 H TYR A 60 -11.983 7.261 -6.105 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.189 8.027 -3.363 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.959 5.199 -4.542 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.934 5.745 -3.229 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -11.120 6.722 -1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -13.124 4.370 -4.098 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -12.930 6.213 0.501 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -14.931 3.857 -2.481 1.00 0.00 H new ATOM 0 HH TYR A 60 -15.151 5.463 0.643 1.00 0.00 H new ATOM 793 N THR A 61 -8.706 7.949 -4.229 1.00 0.00 N ATOM 794 CA THR A 61 -7.442 8.369 -4.897 1.00 0.00 C ATOM 795 C THR A 61 -6.235 7.834 -4.122 1.00 0.00 C ATOM 796 O THR A 61 -5.989 8.219 -2.996 1.00 0.00 O ATOM 797 CB THR A 61 -7.464 9.898 -4.868 1.00 0.00 C ATOM 798 OG1 THR A 61 -8.695 10.362 -5.404 1.00 0.00 O ATOM 799 CG2 THR A 61 -6.304 10.443 -5.702 1.00 0.00 C ATOM 0 H THR A 61 -8.643 7.830 -3.218 1.00 0.00 H new ATOM 0 HA THR A 61 -7.364 7.984 -5.914 1.00 0.00 H new ATOM 0 HB THR A 61 -7.362 10.244 -3.839 1.00 0.00 H new ATOM 0 HG1 THR A 61 -8.712 11.342 -5.385 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.321 11.533 -5.681 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.360 10.086 -5.289 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.403 10.099 -6.732 1.00 0.00 H new ATOM 807 N LEU A 62 -5.479 6.951 -4.715 1.00 0.00 N ATOM 808 CA LEU A 62 -4.290 6.397 -4.007 1.00 0.00 C ATOM 809 C LEU A 62 -3.064 7.266 -4.290 1.00 0.00 C ATOM 810 O LEU A 62 -2.666 7.445 -5.424 1.00 0.00 O ATOM 811 CB LEU A 62 -4.098 4.994 -4.586 1.00 0.00 C ATOM 812 CG LEU A 62 -2.761 4.423 -4.108 1.00 0.00 C ATOM 813 CD1 LEU A 62 -2.901 3.925 -2.669 1.00 0.00 C ATOM 814 CD2 LEU A 62 -2.353 3.258 -5.012 1.00 0.00 C ATOM 0 H LEU A 62 -5.632 6.590 -5.657 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.425 6.373 -2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.916 4.345 -4.273 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.121 5.032 -5.675 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.999 5.202 -4.149 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.948 3.519 -2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.192 4.754 -2.024 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.663 3.147 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.401 2.850 -4.673 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.116 2.481 -4.970 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.251 3.612 -6.038 1.00 0.00 H new ATOM 826 N ARG A 63 -2.463 7.810 -3.269 1.00 0.00 N ATOM 827 CA ARG A 63 -1.265 8.668 -3.484 1.00 0.00 C ATOM 828 C ARG A 63 -0.136 8.255 -2.537 1.00 0.00 C ATOM 829 O ARG A 63 -0.325 8.149 -1.343 1.00 0.00 O ATOM 830 CB ARG A 63 -1.735 10.089 -3.171 1.00 0.00 C ATOM 831 CG ARG A 63 -0.522 11.005 -3.001 1.00 0.00 C ATOM 832 CD ARG A 63 -0.981 12.370 -2.483 1.00 0.00 C ATOM 833 NE ARG A 63 0.025 12.748 -1.452 1.00 0.00 N ATOM 834 CZ ARG A 63 -0.291 13.596 -0.512 1.00 0.00 C ATOM 835 NH1 ARG A 63 -1.000 14.654 -0.800 1.00 0.00 N ATOM 836 NH2 ARG A 63 0.100 13.386 0.715 1.00 0.00 N ATOM 0 H ARG A 63 -2.749 7.698 -2.296 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.873 8.581 -4.497 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.372 10.458 -3.975 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.336 10.092 -2.262 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.188 10.560 -2.304 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.004 11.121 -3.953 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.018 13.105 -3.287 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.982 12.314 -2.056 1.00 0.00 H new ATOM 0 HE ARG A 63 0.961 12.344 -1.481 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.306 14.817 -1.759 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.248 15.317 -0.066 1.00 0.00 H new ATOM 0 HH21 ARG A 63 0.653 12.559 0.940 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -0.147 14.049 1.450 1.00 0.00 H new ATOM 850 N TYR A 64 1.035 8.024 -3.063 1.00 0.00 N ATOM 851 CA TYR A 64 2.179 7.621 -2.194 1.00 0.00 C ATOM 852 C TYR A 64 3.497 7.769 -2.962 1.00 0.00 C ATOM 853 O TYR A 64 3.526 7.737 -4.176 1.00 0.00 O ATOM 854 CB TYR A 64 1.914 6.153 -1.838 1.00 0.00 C ATOM 855 CG TYR A 64 2.296 5.265 -3.000 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.642 4.959 -3.236 1.00 0.00 C ATOM 857 CD2 TYR A 64 1.304 4.757 -3.846 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.994 4.145 -4.319 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.656 3.941 -4.927 1.00 0.00 C ATOM 860 CZ TYR A 64 3.001 3.636 -5.164 1.00 0.00 C ATOM 861 OH TYR A 64 3.349 2.835 -6.232 1.00 0.00 O ATOM 0 H TYR A 64 1.250 8.097 -4.057 1.00 0.00 H new ATOM 0 HA TYR A 64 2.262 8.240 -1.301 1.00 0.00 H new ATOM 0 HB2 TYR A 64 2.487 5.875 -0.953 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.861 6.013 -1.593 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.408 5.351 -2.583 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.266 4.995 -3.665 1.00 0.00 H new ATOM 0 HE1 TYR A 64 5.032 3.910 -4.503 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.890 3.547 -5.578 1.00 0.00 H new ATOM 0 HH TYR A 64 4.311 2.915 -6.401 1.00 0.00 H new ATOM 871 N THR A 65 4.587 7.929 -2.265 1.00 0.00 N ATOM 872 CA THR A 65 5.899 8.075 -2.958 1.00 0.00 C ATOM 873 C THR A 65 6.842 6.949 -2.531 1.00 0.00 C ATOM 874 O THR A 65 7.444 6.996 -1.477 1.00 0.00 O ATOM 875 CB THR A 65 6.438 9.433 -2.505 1.00 0.00 C ATOM 876 OG1 THR A 65 5.620 10.466 -3.036 1.00 0.00 O ATOM 877 CG2 THR A 65 7.873 9.607 -3.006 1.00 0.00 C ATOM 0 H THR A 65 4.627 7.965 -1.246 1.00 0.00 H new ATOM 0 HA THR A 65 5.806 8.019 -4.043 1.00 0.00 H new ATOM 0 HB THR A 65 6.427 9.484 -1.416 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.855 11.319 -2.614 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.256 10.575 -2.683 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.500 8.814 -2.598 1.00 0.00 H new ATOM 0 HG23 THR A 65 7.887 9.556 -4.095 1.00 0.00 H new ATOM 885 N ALA A 66 6.971 5.933 -3.340 1.00 0.00 N ATOM 886 CA ALA A 66 7.870 4.801 -2.977 1.00 0.00 C ATOM 887 C ALA A 66 9.204 4.918 -3.718 1.00 0.00 C ATOM 888 O ALA A 66 9.290 5.509 -4.777 1.00 0.00 O ATOM 889 CB ALA A 66 7.122 3.543 -3.420 1.00 0.00 C ATOM 0 H ALA A 66 6.493 5.838 -4.236 1.00 0.00 H new ATOM 0 HA ALA A 66 8.101 4.787 -1.912 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.721 2.663 -3.186 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.168 3.483 -2.895 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.943 3.585 -4.494 1.00 0.00 H new ATOM 895 N THR A 67 10.244 4.354 -3.169 1.00 0.00 N ATOM 896 CA THR A 67 11.575 4.422 -3.839 1.00 0.00 C ATOM 897 C THR A 67 12.405 3.185 -3.489 1.00 0.00 C ATOM 898 O THR A 67 12.445 2.754 -2.353 1.00 0.00 O ATOM 899 CB THR A 67 12.239 5.685 -3.289 1.00 0.00 C ATOM 900 OG1 THR A 67 11.430 6.814 -3.590 1.00 0.00 O ATOM 901 CG2 THR A 67 13.619 5.858 -3.929 1.00 0.00 C ATOM 0 H THR A 67 10.230 3.848 -2.284 1.00 0.00 H new ATOM 0 HA THR A 67 11.487 4.451 -4.925 1.00 0.00 H new ATOM 0 HB THR A 67 12.350 5.596 -2.208 1.00 0.00 H new ATOM 0 HG1 THR A 67 11.546 7.494 -2.894 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.092 6.758 -3.537 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.239 4.992 -3.697 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.510 5.947 -5.010 1.00 0.00 H new ATOM 909 N ALA A 68 13.069 2.611 -4.454 1.00 0.00 N ATOM 910 CA ALA A 68 13.897 1.404 -4.172 1.00 0.00 C ATOM 911 C ALA A 68 15.306 1.593 -4.736 1.00 0.00 C ATOM 912 O ALA A 68 15.480 1.905 -5.897 1.00 0.00 O ATOM 913 CB ALA A 68 13.184 0.251 -4.886 1.00 0.00 C ATOM 0 H ALA A 68 13.074 2.925 -5.425 1.00 0.00 H new ATOM 0 HA ALA A 68 14.001 1.215 -3.103 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.736 -0.675 -4.724 1.00 0.00 H new ATOM 0 HB2 ALA A 68 12.175 0.146 -4.489 1.00 0.00 H new ATOM 0 HB3 ALA A 68 13.133 0.461 -5.954 1.00 0.00 H new ATOM 919 N SER A 69 16.314 1.403 -3.927 1.00 0.00 N ATOM 920 CA SER A 69 17.709 1.570 -4.427 1.00 0.00 C ATOM 921 C SER A 69 17.843 0.920 -5.805 1.00 0.00 C ATOM 922 O SER A 69 18.664 1.308 -6.612 1.00 0.00 O ATOM 923 CB SER A 69 18.587 0.850 -3.405 1.00 0.00 C ATOM 924 OG SER A 69 19.321 1.810 -2.657 1.00 0.00 O ATOM 0 H SER A 69 16.232 1.140 -2.945 1.00 0.00 H new ATOM 0 HA SER A 69 17.993 2.617 -4.534 1.00 0.00 H new ATOM 0 HB2 SER A 69 17.970 0.247 -2.739 1.00 0.00 H new ATOM 0 HB3 SER A 69 19.269 0.167 -3.911 1.00 0.00 H new ATOM 0 HG SER A 69 19.884 1.351 -1.999 1.00 0.00 H new ATOM 930 N THR A 70 17.034 -0.065 -6.077 1.00 0.00 N ATOM 931 CA THR A 70 17.097 -0.747 -7.398 1.00 0.00 C ATOM 932 C THR A 70 15.843 -0.417 -8.217 1.00 0.00 C ATOM 933 O THR A 70 14.851 0.041 -7.687 1.00 0.00 O ATOM 934 CB THR A 70 17.143 -2.242 -7.059 1.00 0.00 C ATOM 935 OG1 THR A 70 17.661 -2.962 -8.169 1.00 0.00 O ATOM 936 CG2 THR A 70 15.731 -2.746 -6.736 1.00 0.00 C ATOM 0 H THR A 70 16.328 -0.429 -5.437 1.00 0.00 H new ATOM 0 HA THR A 70 17.956 -0.435 -7.993 1.00 0.00 H new ATOM 0 HB THR A 70 17.785 -2.395 -6.192 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.693 -3.917 -7.953 1.00 0.00 H new ATOM 0 HG21 THR A 70 15.770 -3.809 -6.496 1.00 0.00 H new ATOM 0 HG22 THR A 70 15.335 -2.196 -5.883 1.00 0.00 H new ATOM 0 HG23 THR A 70 15.084 -2.593 -7.599 1.00 0.00 H new ATOM 944 N ASP A 71 15.872 -0.662 -9.498 1.00 0.00 N ATOM 945 CA ASP A 71 14.670 -0.381 -10.333 1.00 0.00 C ATOM 946 C ASP A 71 13.699 -1.558 -10.222 1.00 0.00 C ATOM 947 O ASP A 71 13.549 -2.342 -11.138 1.00 0.00 O ATOM 948 CB ASP A 71 15.197 -0.246 -11.762 1.00 0.00 C ATOM 949 CG ASP A 71 14.134 0.421 -12.638 1.00 0.00 C ATOM 950 OD1 ASP A 71 13.310 1.136 -12.093 1.00 0.00 O ATOM 951 OD2 ASP A 71 14.163 0.204 -13.838 1.00 0.00 O ATOM 0 H ASP A 71 16.673 -1.043 -10.001 1.00 0.00 H new ATOM 0 HA ASP A 71 14.137 0.517 -10.021 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.112 0.346 -11.769 1.00 0.00 H new ATOM 0 HB3 ASP A 71 15.449 -1.228 -12.162 1.00 0.00 H new ATOM 956 N VAL A 72 13.058 -1.702 -9.093 1.00 0.00 N ATOM 957 CA VAL A 72 12.119 -2.843 -8.908 1.00 0.00 C ATOM 958 C VAL A 72 10.683 -2.447 -9.261 1.00 0.00 C ATOM 959 O VAL A 72 10.200 -1.399 -8.881 1.00 0.00 O ATOM 960 CB VAL A 72 12.227 -3.201 -7.422 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.417 -2.206 -6.585 1.00 0.00 C ATOM 962 CG2 VAL A 72 11.678 -4.609 -7.196 1.00 0.00 C ATOM 0 H VAL A 72 13.145 -1.078 -8.291 1.00 0.00 H new ATOM 0 HA VAL A 72 12.370 -3.681 -9.559 1.00 0.00 H new ATOM 0 HB VAL A 72 13.274 -3.159 -7.121 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.499 -2.467 -5.530 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.805 -1.199 -6.741 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.371 -2.243 -6.888 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.755 -4.864 -6.139 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.633 -4.646 -7.503 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.254 -5.323 -7.784 1.00 0.00 H new ATOM 972 N THR A 73 9.993 -3.297 -9.968 1.00 0.00 N ATOM 973 CA THR A 73 8.580 -3.004 -10.333 1.00 0.00 C ATOM 974 C THR A 73 7.685 -4.099 -9.752 1.00 0.00 C ATOM 975 O THR A 73 7.413 -5.095 -10.392 1.00 0.00 O ATOM 976 CB THR A 73 8.542 -3.028 -11.862 1.00 0.00 C ATOM 977 OG1 THR A 73 9.184 -1.866 -12.368 1.00 0.00 O ATOM 978 CG2 THR A 73 7.089 -3.060 -12.337 1.00 0.00 C ATOM 0 H THR A 73 10.350 -4.189 -10.311 1.00 0.00 H new ATOM 0 HA THR A 73 8.230 -2.046 -9.947 1.00 0.00 H new ATOM 0 HB THR A 73 9.059 -3.916 -12.226 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.162 -1.881 -13.348 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.063 -3.077 -13.427 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.599 -3.952 -11.948 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.568 -2.173 -11.975 1.00 0.00 H new ATOM 986 N VAL A 74 7.244 -3.935 -8.536 1.00 0.00 N ATOM 987 CA VAL A 74 6.389 -4.983 -7.912 1.00 0.00 C ATOM 988 C VAL A 74 4.912 -4.723 -8.206 1.00 0.00 C ATOM 989 O VAL A 74 4.564 -4.132 -9.208 1.00 0.00 O ATOM 990 CB VAL A 74 6.677 -4.888 -6.413 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.189 -4.960 -6.177 1.00 0.00 C ATOM 992 CG2 VAL A 74 6.142 -3.562 -5.874 1.00 0.00 C ATOM 0 H VAL A 74 7.438 -3.124 -7.949 1.00 0.00 H new ATOM 0 HA VAL A 74 6.606 -5.977 -8.304 1.00 0.00 H new ATOM 0 HB VAL A 74 6.188 -5.715 -5.897 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.394 -4.892 -5.109 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.573 -5.905 -6.561 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.678 -4.134 -6.693 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.347 -3.494 -4.806 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.630 -2.736 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.066 -3.509 -6.041 1.00 0.00 H new ATOM 1002 N ARG A 75 4.041 -5.177 -7.349 1.00 0.00 N ATOM 1003 CA ARG A 75 2.585 -4.972 -7.587 1.00 0.00 C ATOM 1004 C ARG A 75 1.924 -4.345 -6.356 1.00 0.00 C ATOM 1005 O ARG A 75 2.163 -4.751 -5.236 1.00 0.00 O ATOM 1006 CB ARG A 75 2.035 -6.375 -7.841 1.00 0.00 C ATOM 1007 CG ARG A 75 2.101 -6.688 -9.337 1.00 0.00 C ATOM 1008 CD ARG A 75 0.704 -7.052 -9.845 1.00 0.00 C ATOM 1009 NE ARG A 75 -0.048 -5.767 -9.855 1.00 0.00 N ATOM 1010 CZ ARG A 75 -1.030 -5.592 -10.696 1.00 0.00 C ATOM 1011 NH1 ARG A 75 -0.915 -6.002 -11.929 1.00 0.00 N ATOM 1012 NH2 ARG A 75 -2.129 -5.008 -10.303 1.00 0.00 N ATOM 0 H ARG A 75 4.274 -5.681 -6.494 1.00 0.00 H new ATOM 0 HA ARG A 75 2.391 -4.297 -8.420 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.612 -7.110 -7.279 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.005 -6.442 -7.490 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.485 -5.826 -9.883 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.791 -7.512 -9.517 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.748 -7.491 -10.842 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.226 -7.784 -9.195 1.00 0.00 H new ATOM 0 HE ARG A 75 0.205 -5.023 -9.204 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -0.057 -6.460 -12.236 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -1.683 -5.865 -12.586 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -2.220 -4.689 -9.339 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.897 -4.871 -10.960 1.00 0.00 H new ATOM 1026 N ALA A 76 1.091 -3.360 -6.557 1.00 0.00 N ATOM 1027 CA ALA A 76 0.409 -2.709 -5.402 1.00 0.00 C ATOM 1028 C ALA A 76 -1.067 -2.474 -5.731 1.00 0.00 C ATOM 1029 O ALA A 76 -1.446 -2.369 -6.882 1.00 0.00 O ATOM 1030 CB ALA A 76 1.134 -1.377 -5.205 1.00 0.00 C ATOM 0 H ALA A 76 0.853 -2.978 -7.472 1.00 0.00 H new ATOM 0 HA ALA A 76 0.443 -3.323 -4.502 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.686 -0.839 -4.369 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.187 -1.564 -4.994 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.046 -0.777 -6.111 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.902 -2.395 -4.731 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.353 -2.173 -4.985 1.00 0.00 C ATOM 1038 C LEU A 77 -4.121 -2.138 -3.658 1.00 0.00 C ATOM 1039 O LEU A 77 -3.598 -1.734 -2.638 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.790 -3.374 -5.829 1.00 0.00 C ATOM 1041 CG LEU A 77 -3.453 -4.670 -5.089 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -4.628 -5.070 -4.196 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -3.189 -5.782 -6.107 1.00 0.00 C ATOM 0 H LEU A 77 -1.641 -2.475 -3.748 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.548 -1.226 -5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.861 -3.323 -6.025 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.287 -3.354 -6.796 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.566 -4.517 -4.475 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.387 -5.993 -3.669 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.820 -4.279 -3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.516 -5.224 -4.810 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.949 -6.706 -5.582 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.078 -5.933 -6.719 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.352 -5.499 -6.746 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.355 -2.560 -3.665 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.160 -2.558 -2.409 1.00 0.00 C ATOM 1057 C VAL A 78 -7.145 -3.728 -2.436 1.00 0.00 C ATOM 1058 O VAL A 78 -7.216 -4.462 -3.401 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.906 -1.223 -2.417 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.466 -0.940 -1.022 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.943 -0.102 -2.814 1.00 0.00 C ATOM 0 H VAL A 78 -5.844 -2.908 -4.490 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.547 -2.668 -1.514 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.725 -1.272 -3.134 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.997 0.012 -1.029 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.153 -1.737 -0.737 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.647 -0.893 -0.304 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.475 0.849 -2.820 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.123 -0.055 -2.097 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.544 -0.300 -3.809 1.00 0.00 H new ATOM 1071 N GLY A 79 -7.906 -3.915 -1.394 1.00 0.00 N ATOM 1072 CA GLY A 79 -8.873 -5.047 -1.394 1.00 0.00 C ATOM 1073 C GLY A 79 -9.693 -5.039 -0.105 1.00 0.00 C ATOM 1074 O GLY A 79 -9.564 -4.160 0.724 1.00 0.00 O ATOM 0 H GLY A 79 -7.901 -3.340 -0.551 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.536 -4.969 -2.256 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.338 -5.992 -1.488 1.00 0.00 H new ATOM 1078 N GLN A 80 -10.538 -6.018 0.068 1.00 0.00 N ATOM 1079 CA GLN A 80 -11.373 -6.080 1.300 1.00 0.00 C ATOM 1080 C GLN A 80 -10.741 -7.030 2.319 1.00 0.00 C ATOM 1081 O GLN A 80 -9.541 -7.222 2.346 1.00 0.00 O ATOM 1082 CB GLN A 80 -12.724 -6.624 0.833 1.00 0.00 C ATOM 1083 CG GLN A 80 -13.848 -5.972 1.640 1.00 0.00 C ATOM 1084 CD GLN A 80 -15.154 -6.733 1.408 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -15.512 -7.020 0.282 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -15.888 -7.074 2.432 1.00 0.00 N ATOM 0 H GLN A 80 -10.686 -6.780 -0.593 1.00 0.00 H new ATOM 0 HA GLN A 80 -11.467 -5.108 1.785 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -12.861 -6.422 -0.229 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.754 -7.706 0.958 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -13.597 -5.975 2.701 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.965 -4.930 1.343 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -15.588 -6.834 3.377 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -16.761 -7.581 2.287 1.00 0.00 H new ATOM 1095 N ASN A 81 -11.543 -7.627 3.154 1.00 0.00 N ATOM 1096 CA ASN A 81 -11.003 -8.569 4.172 1.00 0.00 C ATOM 1097 C ASN A 81 -12.127 -9.466 4.691 1.00 0.00 C ATOM 1098 O ASN A 81 -12.458 -9.451 5.860 1.00 0.00 O ATOM 1099 CB ASN A 81 -10.461 -7.682 5.293 1.00 0.00 C ATOM 1100 CG ASN A 81 -9.077 -7.157 4.905 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -8.820 -5.973 4.982 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -8.169 -7.996 4.487 1.00 0.00 N ATOM 0 H ASN A 81 -12.555 -7.502 3.175 1.00 0.00 H new ATOM 0 HA ASN A 81 -10.229 -9.221 3.767 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.140 -6.849 5.473 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.399 -8.249 6.222 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -7.243 -7.657 4.225 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -8.385 -8.991 4.422 1.00 0.00 H new ATOM 1109 N GLY A 82 -12.720 -10.239 3.822 1.00 0.00 N ATOM 1110 CA GLY A 82 -13.829 -11.138 4.248 1.00 0.00 C ATOM 1111 C GLY A 82 -14.654 -11.535 3.022 1.00 0.00 C ATOM 1112 O GLY A 82 -15.083 -10.696 2.256 1.00 0.00 O ATOM 0 H GLY A 82 -12.482 -10.286 2.831 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.426 -12.027 4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.461 -10.634 4.979 1.00 0.00 H new ATOM 1116 N ALA A 83 -14.876 -12.807 2.829 1.00 0.00 N ATOM 1117 CA ALA A 83 -15.670 -13.257 1.649 1.00 0.00 C ATOM 1118 C ALA A 83 -16.877 -12.336 1.435 1.00 0.00 C ATOM 1119 O ALA A 83 -17.387 -11.761 2.377 1.00 0.00 O ATOM 1120 CB ALA A 83 -16.131 -14.672 1.999 1.00 0.00 C ATOM 0 H ALA A 83 -14.542 -13.554 3.437 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.088 -13.233 0.728 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.724 -15.075 1.178 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.261 -15.308 2.165 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -16.737 -14.644 2.904 1.00 0.00 H new ATOM 1126 N PRO A 84 -17.302 -12.224 0.199 1.00 0.00 N ATOM 1127 CA PRO A 84 -16.645 -12.949 -0.920 1.00 0.00 C ATOM 1128 C PRO A 84 -15.361 -12.230 -1.355 1.00 0.00 C ATOM 1129 O PRO A 84 -14.777 -12.552 -2.370 1.00 0.00 O ATOM 1130 CB PRO A 84 -17.685 -12.904 -2.032 1.00 0.00 C ATOM 1131 CG PRO A 84 -18.528 -11.700 -1.742 1.00 0.00 C ATOM 1132 CD PRO A 84 -18.437 -11.418 -0.261 1.00 0.00 C ATOM 0 HA PRO A 84 -16.349 -13.963 -0.652 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -17.211 -12.825 -3.010 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -18.288 -13.812 -2.043 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.179 -10.842 -2.316 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -19.563 -11.879 -2.034 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -18.274 -10.358 -0.069 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -19.356 -11.698 0.253 1.00 0.00 H new ATOM 1140 N TYR A 85 -14.923 -11.258 -0.601 1.00 0.00 N ATOM 1141 CA TYR A 85 -13.681 -10.516 -0.975 1.00 0.00 C ATOM 1142 C TYR A 85 -13.920 -9.692 -2.243 1.00 0.00 C ATOM 1143 O TYR A 85 -14.794 -9.989 -3.033 1.00 0.00 O ATOM 1144 CB TYR A 85 -12.617 -11.588 -1.231 1.00 0.00 C ATOM 1145 CG TYR A 85 -12.713 -12.670 -0.181 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -12.297 -12.412 1.131 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -13.214 -13.933 -0.521 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -12.383 -13.416 2.103 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -13.300 -14.936 0.451 1.00 0.00 C ATOM 1150 CZ TYR A 85 -12.885 -14.678 1.763 1.00 0.00 C ATOM 1151 OH TYR A 85 -12.969 -15.668 2.720 1.00 0.00 O ATOM 0 H TYR A 85 -15.371 -10.944 0.260 1.00 0.00 H new ATOM 0 HA TYR A 85 -13.373 -9.824 -0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.754 -12.019 -2.223 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.624 -11.139 -1.213 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -11.910 -11.438 1.393 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.534 -14.133 -1.533 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -12.062 -13.217 3.115 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.687 -15.910 0.189 1.00 0.00 H new ATOM 0 HH TYR A 85 -13.552 -15.370 3.449 1.00 0.00 H new ATOM 1161 N GLY A 86 -13.148 -8.658 -2.444 1.00 0.00 N ATOM 1162 CA GLY A 86 -13.330 -7.817 -3.661 1.00 0.00 C ATOM 1163 C GLY A 86 -12.182 -6.811 -3.764 1.00 0.00 C ATOM 1164 O GLY A 86 -11.915 -6.063 -2.844 1.00 0.00 O ATOM 0 H GLY A 86 -12.400 -8.360 -1.818 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.356 -8.447 -4.550 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.284 -7.292 -3.614 1.00 0.00 H new ATOM 1168 N THR A 87 -11.501 -6.785 -4.877 1.00 0.00 N ATOM 1169 CA THR A 87 -10.371 -5.825 -5.037 1.00 0.00 C ATOM 1170 C THR A 87 -10.829 -4.596 -5.826 1.00 0.00 C ATOM 1171 O THR A 87 -11.737 -4.665 -6.630 1.00 0.00 O ATOM 1172 CB THR A 87 -9.300 -6.592 -5.815 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.924 -7.546 -6.663 1.00 0.00 O ATOM 1174 CG2 THR A 87 -8.369 -7.308 -4.836 1.00 0.00 C ATOM 0 H THR A 87 -11.678 -7.386 -5.682 1.00 0.00 H new ATOM 0 HA THR A 87 -9.997 -5.467 -4.078 1.00 0.00 H new ATOM 0 HB THR A 87 -8.720 -5.894 -6.419 1.00 0.00 H new ATOM 0 HG1 THR A 87 -9.239 -8.037 -7.163 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.607 -7.854 -5.392 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.890 -6.575 -4.187 1.00 0.00 H new ATOM 0 HG23 THR A 87 -8.946 -8.006 -4.230 1.00 0.00 H new ATOM 1182 N VAL A 88 -10.207 -3.471 -5.601 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.606 -2.238 -6.338 1.00 0.00 C ATOM 1184 C VAL A 88 -9.403 -1.656 -7.085 1.00 0.00 C ATOM 1185 O VAL A 88 -9.549 -0.961 -8.071 1.00 0.00 O ATOM 1186 CB VAL A 88 -11.087 -1.270 -5.258 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.409 -1.773 -4.673 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -10.039 -1.188 -4.147 1.00 0.00 C ATOM 0 H VAL A 88 -9.440 -3.352 -4.939 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.377 -2.433 -7.083 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.235 -0.282 -5.695 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.752 -1.082 -3.903 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.157 -1.835 -5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.261 -2.760 -4.235 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.380 -0.498 -3.375 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.893 -2.176 -3.711 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.096 -0.831 -4.562 1.00 0.00 H new ATOM 1198 N LEU A 89 -8.215 -1.935 -6.624 1.00 0.00 N ATOM 1199 CA LEU A 89 -7.003 -1.399 -7.308 1.00 0.00 C ATOM 1200 C LEU A 89 -6.244 -2.515 -8.028 1.00 0.00 C ATOM 1201 O LEU A 89 -6.182 -3.637 -7.567 1.00 0.00 O ATOM 1202 CB LEU A 89 -6.150 -0.803 -6.200 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.503 0.671 -6.054 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.751 0.816 -5.185 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.333 1.400 -5.405 1.00 0.00 C ATOM 0 H LEU A 89 -8.030 -2.511 -5.803 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.262 -0.661 -8.067 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.327 -1.329 -5.262 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.092 -0.917 -6.435 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.702 1.102 -7.035 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.002 1.872 -5.082 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.583 0.289 -5.652 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.560 0.391 -4.200 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.578 2.457 -5.297 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.136 0.971 -4.423 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.447 1.295 -6.031 1.00 0.00 H new ATOM 1217 N ASP A 90 -5.664 -2.212 -9.155 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.902 -3.251 -9.905 1.00 0.00 C ATOM 1219 C ASP A 90 -3.785 -2.595 -10.724 1.00 0.00 C ATOM 1220 O ASP A 90 -3.928 -2.367 -11.909 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.928 -3.909 -10.827 1.00 0.00 C ATOM 1222 CG ASP A 90 -6.450 -2.877 -11.830 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -6.261 -1.697 -11.587 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -7.031 -3.286 -12.822 1.00 0.00 O ATOM 0 H ASP A 90 -5.684 -1.290 -9.590 1.00 0.00 H new ATOM 0 HA ASP A 90 -4.429 -3.976 -9.243 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -5.473 -4.747 -11.355 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -6.754 -4.312 -10.241 1.00 0.00 H new ATOM 1229 N THR A 91 -2.675 -2.282 -10.108 1.00 0.00 N ATOM 1230 CA THR A 91 -1.566 -1.636 -10.871 1.00 0.00 C ATOM 1231 C THR A 91 -0.205 -2.125 -10.368 1.00 0.00 C ATOM 1232 O THR A 91 -0.109 -2.813 -9.371 1.00 0.00 O ATOM 1233 CB THR A 91 -1.727 -0.139 -10.607 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.464 0.129 -9.237 1.00 0.00 O ATOM 1235 CG2 THR A 91 -3.154 0.292 -10.949 1.00 0.00 C ATOM 0 H THR A 91 -2.489 -2.444 -9.118 1.00 0.00 H new ATOM 0 HA THR A 91 -1.609 -1.875 -11.934 1.00 0.00 H new ATOM 0 HB THR A 91 -1.025 0.417 -11.228 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.565 1.089 -9.066 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.267 1.360 -10.760 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.354 0.086 -12.001 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.860 -0.262 -10.330 1.00 0.00 H new ATOM 1243 N SER A 92 0.848 -1.770 -11.053 1.00 0.00 N ATOM 1244 CA SER A 92 2.207 -2.207 -10.621 1.00 0.00 C ATOM 1245 C SER A 92 3.083 -0.984 -10.328 1.00 0.00 C ATOM 1246 O SER A 92 3.387 -0.212 -11.216 1.00 0.00 O ATOM 1247 CB SER A 92 2.767 -2.993 -11.806 1.00 0.00 C ATOM 1248 OG SER A 92 1.697 -3.621 -12.500 1.00 0.00 O ATOM 0 H SER A 92 0.826 -1.195 -11.895 1.00 0.00 H new ATOM 0 HA SER A 92 2.179 -2.807 -9.712 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.309 -2.326 -12.476 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.479 -3.741 -11.457 1.00 0.00 H new ATOM 0 HG SER A 92 2.052 -4.125 -13.262 1.00 0.00 H new ATOM 1254 N PRO A 93 3.456 -0.848 -9.084 1.00 0.00 N ATOM 1255 CA PRO A 93 4.303 0.296 -8.660 1.00 0.00 C ATOM 1256 C PRO A 93 5.724 0.160 -9.211 1.00 0.00 C ATOM 1257 O PRO A 93 6.194 -0.925 -9.493 1.00 0.00 O ATOM 1258 CB PRO A 93 4.305 0.191 -7.137 1.00 0.00 C ATOM 1259 CG PRO A 93 4.018 -1.246 -6.853 1.00 0.00 C ATOM 1260 CD PRO A 93 3.129 -1.734 -7.963 1.00 0.00 C ATOM 0 HA PRO A 93 3.932 1.254 -9.024 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.267 0.492 -6.721 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.549 0.840 -6.695 1.00 0.00 H new ATOM 0 HG2 PRO A 93 4.941 -1.825 -6.813 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.528 -1.360 -5.886 1.00 0.00 H new ATOM 0 HD2 PRO A 93 3.328 -2.778 -8.206 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.075 -1.665 -7.692 1.00 0.00 H new ATOM 1268 N ALA A 94 6.413 1.258 -9.357 1.00 0.00 N ATOM 1269 CA ALA A 94 7.808 1.208 -9.879 1.00 0.00 C ATOM 1270 C ALA A 94 8.730 2.009 -8.956 1.00 0.00 C ATOM 1271 O ALA A 94 8.335 3.010 -8.390 1.00 0.00 O ATOM 1272 CB ALA A 94 7.740 1.852 -11.264 1.00 0.00 C ATOM 0 H ALA A 94 6.068 2.192 -9.136 1.00 0.00 H new ATOM 0 HA ALA A 94 8.201 0.192 -9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.733 1.852 -11.714 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.055 1.286 -11.895 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.383 2.878 -11.171 1.00 0.00 H new ATOM 1278 N LEU A 95 9.950 1.579 -8.790 1.00 0.00 N ATOM 1279 CA LEU A 95 10.880 2.323 -7.893 1.00 0.00 C ATOM 1280 C LEU A 95 12.246 2.501 -8.559 1.00 0.00 C ATOM 1281 O LEU A 95 12.512 1.960 -9.613 1.00 0.00 O ATOM 1282 CB LEU A 95 11.004 1.451 -6.645 1.00 0.00 C ATOM 1283 CG LEU A 95 9.611 1.056 -6.157 1.00 0.00 C ATOM 1284 CD1 LEU A 95 9.739 0.146 -4.935 1.00 0.00 C ATOM 1285 CD2 LEU A 95 8.831 2.316 -5.775 1.00 0.00 C ATOM 0 H LEU A 95 10.343 0.749 -9.234 1.00 0.00 H new ATOM 0 HA LEU A 95 10.513 3.323 -7.662 1.00 0.00 H new ATOM 0 HB2 LEU A 95 11.589 0.559 -6.869 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.535 1.992 -5.862 1.00 0.00 H new ATOM 0 HG LEU A 95 9.083 0.527 -6.950 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.746 -0.136 -4.586 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.297 -0.750 -5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.266 0.675 -4.141 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.837 2.037 -5.427 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.359 2.844 -4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.741 2.966 -6.645 1.00 0.00 H new ATOM 1297 N THR A 96 13.115 3.257 -7.944 1.00 0.00 N ATOM 1298 CA THR A 96 14.469 3.475 -8.529 1.00 0.00 C ATOM 1299 C THR A 96 15.355 4.222 -7.529 1.00 0.00 C ATOM 1300 O THR A 96 15.141 4.167 -6.334 1.00 0.00 O ATOM 1301 CB THR A 96 14.231 4.323 -9.782 1.00 0.00 C ATOM 1302 OG1 THR A 96 15.387 4.283 -10.607 1.00 0.00 O ATOM 1303 CG2 THR A 96 13.936 5.769 -9.380 1.00 0.00 C ATOM 0 H THR A 96 12.945 3.734 -7.059 1.00 0.00 H new ATOM 0 HA THR A 96 14.975 2.539 -8.767 1.00 0.00 H new ATOM 0 HB THR A 96 13.378 3.924 -10.331 1.00 0.00 H new ATOM 0 HG1 THR A 96 15.235 4.824 -11.410 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.767 6.368 -10.275 1.00 0.00 H new ATOM 0 HG22 THR A 96 13.046 5.798 -8.751 1.00 0.00 H new ATOM 0 HG23 THR A 96 14.784 6.173 -8.827 1.00 0.00 H new ATOM 1311 N SER A 97 16.345 4.922 -8.006 1.00 0.00 N ATOM 1312 CA SER A 97 17.239 5.672 -7.077 1.00 0.00 C ATOM 1313 C SER A 97 16.702 7.087 -6.857 1.00 0.00 C ATOM 1314 O SER A 97 17.445 8.011 -6.590 1.00 0.00 O ATOM 1315 CB SER A 97 18.596 5.714 -7.779 1.00 0.00 C ATOM 1316 OG SER A 97 19.572 5.095 -6.951 1.00 0.00 O ATOM 0 H SER A 97 16.575 5.008 -8.996 1.00 0.00 H new ATOM 0 HA SER A 97 17.304 5.202 -6.096 1.00 0.00 H new ATOM 0 HB2 SER A 97 18.538 5.201 -8.739 1.00 0.00 H new ATOM 0 HB3 SER A 97 18.880 6.746 -7.986 1.00 0.00 H new ATOM 0 HG SER A 97 20.443 5.119 -7.399 1.00 0.00 H new ATOM 1322 N GLU A 98 15.414 7.262 -6.964 1.00 0.00 N ATOM 1323 CA GLU A 98 14.825 8.615 -6.759 1.00 0.00 C ATOM 1324 C GLU A 98 13.405 8.488 -6.202 1.00 0.00 C ATOM 1325 O GLU A 98 12.874 7.400 -6.097 1.00 0.00 O ATOM 1326 CB GLU A 98 14.802 9.253 -8.148 1.00 0.00 C ATOM 1327 CG GLU A 98 15.815 10.399 -8.201 1.00 0.00 C ATOM 1328 CD GLU A 98 16.937 10.045 -9.177 1.00 0.00 C ATOM 1329 OE1 GLU A 98 16.659 9.952 -10.362 1.00 0.00 O ATOM 1330 OE2 GLU A 98 18.057 9.872 -8.725 1.00 0.00 O ATOM 0 H GLU A 98 14.743 6.526 -7.185 1.00 0.00 H new ATOM 0 HA GLU A 98 15.395 9.213 -6.048 1.00 0.00 H new ATOM 0 HB2 GLU A 98 15.041 8.507 -8.906 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.803 9.626 -8.372 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.323 11.319 -8.515 1.00 0.00 H new ATOM 0 HG3 GLU A 98 16.226 10.581 -7.208 1.00 0.00 H new ATOM 1337 N PRO A 99 12.836 9.612 -5.864 1.00 0.00 N ATOM 1338 CA PRO A 99 11.461 9.632 -5.312 1.00 0.00 C ATOM 1339 C PRO A 99 10.440 9.335 -6.414 1.00 0.00 C ATOM 1340 O PRO A 99 10.470 9.925 -7.476 1.00 0.00 O ATOM 1341 CB PRO A 99 11.304 11.059 -4.794 1.00 0.00 C ATOM 1342 CG PRO A 99 12.273 11.870 -5.594 1.00 0.00 C ATOM 1343 CD PRO A 99 13.413 10.957 -5.964 1.00 0.00 C ATOM 0 HA PRO A 99 11.298 8.883 -4.537 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.284 11.418 -4.929 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.525 11.119 -3.728 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.795 12.271 -6.488 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.633 12.721 -5.016 1.00 0.00 H new ATOM 0 HD2 PRO A 99 13.778 11.161 -6.971 1.00 0.00 H new ATOM 0 HD3 PRO A 99 14.259 11.080 -5.288 1.00 0.00 H new ATOM 1351 N ARG A 100 9.537 8.425 -6.171 1.00 0.00 N ATOM 1352 CA ARG A 100 8.518 8.094 -7.207 1.00 0.00 C ATOM 1353 C ARG A 100 7.113 8.374 -6.669 1.00 0.00 C ATOM 1354 O ARG A 100 6.461 7.506 -6.123 1.00 0.00 O ATOM 1355 CB ARG A 100 8.702 6.601 -7.482 1.00 0.00 C ATOM 1356 CG ARG A 100 9.252 6.406 -8.897 1.00 0.00 C ATOM 1357 CD ARG A 100 8.485 5.279 -9.593 1.00 0.00 C ATOM 1358 NE ARG A 100 8.062 5.853 -10.900 1.00 0.00 N ATOM 1359 CZ ARG A 100 8.834 5.733 -11.946 1.00 0.00 C ATOM 1360 NH1 ARG A 100 9.279 4.558 -12.297 1.00 0.00 N ATOM 1361 NH2 ARG A 100 9.162 6.789 -12.639 1.00 0.00 N ATOM 0 H ARG A 100 9.461 7.897 -5.302 1.00 0.00 H new ATOM 0 HA ARG A 100 8.637 8.690 -8.112 1.00 0.00 H new ATOM 0 HB2 ARG A 100 9.385 6.168 -6.752 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.750 6.081 -7.376 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.156 7.331 -9.466 1.00 0.00 H new ATOM 0 HG3 ARG A 100 10.314 6.166 -8.856 1.00 0.00 H new ATOM 0 HD2 ARG A 100 9.115 4.400 -9.733 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.624 4.964 -9.003 1.00 0.00 H new ATOM 0 HE ARG A 100 7.169 6.340 -10.978 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.024 3.733 -11.754 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.882 4.464 -13.114 1.00 0.00 H new ATOM 0 HH21 ARG A 100 8.815 7.708 -12.363 1.00 0.00 H new ATOM 0 HH22 ARG A 100 9.765 6.696 -13.456 1.00 0.00 H new ATOM 1375 N GLN A 101 6.644 9.583 -6.819 1.00 0.00 N ATOM 1376 CA GLN A 101 5.283 9.924 -6.316 1.00 0.00 C ATOM 1377 C GLN A 101 4.217 9.199 -7.140 1.00 0.00 C ATOM 1378 O GLN A 101 4.412 8.899 -8.301 1.00 0.00 O ATOM 1379 CB GLN A 101 5.163 11.437 -6.496 1.00 0.00 C ATOM 1380 CG GLN A 101 5.924 12.148 -5.376 1.00 0.00 C ATOM 1381 CD GLN A 101 4.948 12.980 -4.542 1.00 0.00 C ATOM 1382 OE1 GLN A 101 4.560 12.580 -3.462 1.00 0.00 O ATOM 1383 NE2 GLN A 101 4.532 14.128 -5.001 1.00 0.00 N ATOM 0 H GLN A 101 7.145 10.350 -7.268 1.00 0.00 H new ATOM 0 HA GLN A 101 5.139 9.624 -5.278 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.564 11.731 -7.466 1.00 0.00 H new ATOM 0 HB3 GLN A 101 4.114 11.733 -6.482 1.00 0.00 H new ATOM 0 HG2 GLN A 101 6.427 11.417 -4.743 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.697 12.790 -5.798 1.00 0.00 H new ATOM 0 HE21 GLN A 101 4.858 14.463 -5.908 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.881 14.690 -4.453 1.00 0.00 H new ATOM 1392 N VAL A 102 3.089 8.915 -6.548 1.00 0.00 N ATOM 1393 CA VAL A 102 2.010 8.211 -7.297 1.00 0.00 C ATOM 1394 C VAL A 102 0.675 8.934 -7.096 1.00 0.00 C ATOM 1395 O VAL A 102 0.335 9.333 -6.001 1.00 0.00 O ATOM 1396 CB VAL A 102 1.959 6.809 -6.690 1.00 0.00 C ATOM 1397 CG1 VAL A 102 0.871 5.989 -7.385 1.00 0.00 C ATOM 1398 CG2 VAL A 102 3.313 6.123 -6.881 1.00 0.00 C ATOM 0 H VAL A 102 2.868 9.140 -5.578 1.00 0.00 H new ATOM 0 HA VAL A 102 2.198 8.183 -8.370 1.00 0.00 H new ATOM 0 HB VAL A 102 1.733 6.882 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.836 4.990 -6.951 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.094 6.477 -7.251 1.00 0.00 H new ATOM 0 HG13 VAL A 102 1.095 5.915 -8.449 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.278 5.123 -6.449 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.537 6.051 -7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.089 6.706 -6.385 1.00 0.00 H new ATOM 1408 N THR A 103 -0.081 9.108 -8.145 1.00 0.00 N ATOM 1409 CA THR A 103 -1.392 9.807 -8.010 1.00 0.00 C ATOM 1410 C THR A 103 -2.380 9.283 -9.056 1.00 0.00 C ATOM 1411 O THR A 103 -2.300 9.617 -10.221 1.00 0.00 O ATOM 1412 CB THR A 103 -1.086 11.287 -8.255 1.00 0.00 C ATOM 1413 OG1 THR A 103 0.245 11.426 -8.735 1.00 0.00 O ATOM 1414 CG2 THR A 103 -1.242 12.065 -6.947 1.00 0.00 C ATOM 0 H THR A 103 0.151 8.797 -9.088 1.00 0.00 H new ATOM 0 HA THR A 103 -1.846 9.644 -7.033 1.00 0.00 H new ATOM 0 HB THR A 103 -1.781 11.682 -8.997 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.439 12.374 -8.893 1.00 0.00 H new ATOM 0 HG21 THR A 103 -1.024 13.119 -7.122 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.264 11.962 -6.582 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.549 11.670 -6.204 1.00 0.00 H new ATOM 1422 N GLU A 104 -3.311 8.464 -8.648 1.00 0.00 N ATOM 1423 CA GLU A 104 -4.302 7.919 -9.621 1.00 0.00 C ATOM 1424 C GLU A 104 -5.666 7.749 -8.946 1.00 0.00 C ATOM 1425 O GLU A 104 -5.769 7.216 -7.859 1.00 0.00 O ATOM 1426 CB GLU A 104 -3.738 6.561 -10.041 1.00 0.00 C ATOM 1427 CG GLU A 104 -2.764 6.751 -11.205 1.00 0.00 C ATOM 1428 CD GLU A 104 -1.548 5.843 -11.007 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -1.718 4.774 -10.443 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -0.469 6.232 -11.422 1.00 0.00 O ATOM 0 H GLU A 104 -3.429 8.149 -7.685 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.450 8.580 -10.475 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.229 6.091 -9.200 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.548 5.894 -10.336 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.257 6.515 -12.148 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -2.448 7.793 -11.262 1.00 0.00 H new ATOM 1437 N THR A 105 -6.713 8.197 -9.583 1.00 0.00 N ATOM 1438 CA THR A 105 -8.069 8.059 -8.978 1.00 0.00 C ATOM 1439 C THR A 105 -8.703 6.733 -9.404 1.00 0.00 C ATOM 1440 O THR A 105 -8.201 6.045 -10.271 1.00 0.00 O ATOM 1441 CB THR A 105 -8.871 9.239 -9.530 1.00 0.00 C ATOM 1442 OG1 THR A 105 -7.992 10.319 -9.807 1.00 0.00 O ATOM 1443 CG2 THR A 105 -9.914 9.677 -8.500 1.00 0.00 C ATOM 0 H THR A 105 -6.689 8.652 -10.495 1.00 0.00 H new ATOM 0 HA THR A 105 -8.039 8.062 -7.888 1.00 0.00 H new ATOM 0 HB THR A 105 -9.376 8.937 -10.448 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.504 11.075 -10.162 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.484 10.518 -8.895 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.589 8.847 -8.290 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.413 9.979 -7.580 1.00 0.00 H new ATOM 1451 N PHE A 106 -9.801 6.367 -8.801 1.00 0.00 N ATOM 1452 CA PHE A 106 -10.462 5.084 -9.174 1.00 0.00 C ATOM 1453 C PHE A 106 -11.759 4.905 -8.381 1.00 0.00 C ATOM 1454 O PHE A 106 -11.890 5.379 -7.270 1.00 0.00 O ATOM 1455 CB PHE A 106 -9.453 3.997 -8.800 1.00 0.00 C ATOM 1456 CG PHE A 106 -9.359 3.895 -7.297 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -8.469 4.715 -6.594 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -10.163 2.979 -6.606 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -8.383 4.621 -5.199 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -10.076 2.885 -5.212 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.186 3.706 -4.508 1.00 0.00 C ATOM 0 H PHE A 106 -10.268 6.900 -8.067 1.00 0.00 H new ATOM 0 HA PHE A 106 -10.729 5.050 -10.230 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.760 3.040 -9.222 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.476 4.232 -9.221 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.849 5.420 -7.127 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -10.849 2.346 -7.148 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.697 5.255 -4.656 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -10.696 2.179 -4.679 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.119 3.633 -3.433 1.00 0.00 H new ATOM 1471 N THR A 107 -12.719 4.222 -8.943 1.00 0.00 N ATOM 1472 CA THR A 107 -14.005 4.010 -8.220 1.00 0.00 C ATOM 1473 C THR A 107 -13.948 2.707 -7.418 1.00 0.00 C ATOM 1474 O THR A 107 -14.256 1.644 -7.920 1.00 0.00 O ATOM 1475 CB THR A 107 -15.066 3.919 -9.318 1.00 0.00 C ATOM 1476 OG1 THR A 107 -14.844 4.946 -10.275 1.00 0.00 O ATOM 1477 CG2 THR A 107 -16.456 4.085 -8.703 1.00 0.00 C ATOM 0 H THR A 107 -12.668 3.802 -9.871 1.00 0.00 H new ATOM 0 HA THR A 107 -14.220 4.811 -7.512 1.00 0.00 H new ATOM 0 HB THR A 107 -15.001 2.946 -9.806 1.00 0.00 H new ATOM 0 HG1 THR A 107 -15.522 4.888 -10.980 1.00 0.00 H new ATOM 0 HG21 THR A 107 -17.211 4.020 -9.487 1.00 0.00 H new ATOM 0 HG22 THR A 107 -16.626 3.297 -7.969 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.524 5.057 -8.214 1.00 0.00 H new ATOM 1485 N ALA A 108 -13.554 2.781 -6.176 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.475 1.546 -5.345 1.00 0.00 C ATOM 1487 C ALA A 108 -14.789 0.767 -5.429 1.00 0.00 C ATOM 1488 O ALA A 108 -15.820 1.219 -4.973 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.238 2.043 -3.920 1.00 0.00 C ATOM 0 H ALA A 108 -13.284 3.642 -5.701 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.685 0.873 -5.679 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.168 1.191 -3.244 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.309 2.613 -3.883 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.067 2.681 -3.614 1.00 0.00 H new ATOM 1495 N SER A 109 -14.761 -0.402 -6.008 1.00 0.00 N ATOM 1496 CA SER A 109 -16.011 -1.209 -6.120 1.00 0.00 C ATOM 1497 C SER A 109 -16.086 -2.228 -4.980 1.00 0.00 C ATOM 1498 O SER A 109 -16.294 -3.405 -5.198 1.00 0.00 O ATOM 1499 CB SER A 109 -15.902 -1.920 -7.468 1.00 0.00 C ATOM 1500 OG SER A 109 -15.081 -3.072 -7.326 1.00 0.00 O ATOM 0 H SER A 109 -13.928 -0.834 -6.408 1.00 0.00 H new ATOM 0 HA SER A 109 -16.908 -0.593 -6.055 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.892 -2.206 -7.822 1.00 0.00 H new ATOM 0 HB3 SER A 109 -15.479 -1.247 -8.214 1.00 0.00 H new ATOM 0 HG SER A 109 -15.522 -3.717 -6.734 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.920 -1.784 -3.763 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.983 -2.729 -2.610 1.00 0.00 C ATOM 1508 C ALA A 110 -16.184 -1.956 -1.304 1.00 0.00 C ATOM 1509 O ALA A 110 -16.509 -0.785 -1.308 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.630 -3.443 -2.609 1.00 0.00 C ATOM 0 H ALA A 110 -15.744 -0.810 -3.517 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.813 -3.430 -2.695 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.597 -4.158 -1.787 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -14.496 -3.970 -3.554 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.832 -2.711 -2.486 1.00 0.00 H new ATOM 1516 N THR A 111 -15.993 -2.601 -0.186 1.00 0.00 N ATOM 1517 CA THR A 111 -16.174 -1.901 1.119 1.00 0.00 C ATOM 1518 C THR A 111 -15.010 -2.222 2.060 1.00 0.00 C ATOM 1519 O THR A 111 -14.855 -3.338 2.513 1.00 0.00 O ATOM 1520 CB THR A 111 -17.485 -2.448 1.684 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.480 -2.429 0.670 1.00 0.00 O ATOM 1522 CG2 THR A 111 -17.935 -1.580 2.860 1.00 0.00 C ATOM 0 H THR A 111 -15.720 -3.581 -0.119 1.00 0.00 H new ATOM 0 HA THR A 111 -16.199 -0.817 1.004 1.00 0.00 H new ATOM 0 HB THR A 111 -17.336 -3.472 2.027 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.321 -2.781 1.030 1.00 0.00 H new ATOM 0 HG21 THR A 111 -18.870 -1.970 3.263 1.00 0.00 H new ATOM 0 HG22 THR A 111 -17.171 -1.595 3.637 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.086 -0.556 2.519 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.194 -1.248 2.360 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.042 -1.493 3.275 1.00 0.00 C ATOM 1532 C TYR A 112 -13.241 -0.725 4.585 1.00 0.00 C ATOM 1533 O TYR A 112 -12.561 0.248 4.843 1.00 0.00 O ATOM 1534 CB TYR A 112 -11.812 -0.963 2.530 1.00 0.00 C ATOM 1535 CG TYR A 112 -11.641 -1.695 1.216 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.278 -2.924 1.002 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -10.841 -1.139 0.209 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -12.117 -3.593 -0.218 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.679 -1.810 -1.009 1.00 0.00 C ATOM 1540 CZ TYR A 112 -11.318 -3.036 -1.222 1.00 0.00 C ATOM 1541 OH TYR A 112 -11.165 -3.692 -2.426 1.00 0.00 O ATOM 0 H TYR A 112 -14.275 -0.293 2.011 1.00 0.00 H new ATOM 0 HA TYR A 112 -12.938 -2.548 3.530 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -11.921 0.106 2.348 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -10.922 -1.092 3.145 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -12.893 -3.356 1.778 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.349 -0.192 0.373 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.610 -4.539 -0.384 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.061 -1.381 -1.784 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.786 -4.449 -2.468 1.00 0.00 H new ATOM 1551 N PRO A 113 -14.173 -1.191 5.370 1.00 0.00 N ATOM 1552 CA PRO A 113 -14.471 -0.539 6.669 1.00 0.00 C ATOM 1553 C PRO A 113 -13.345 -0.809 7.672 1.00 0.00 C ATOM 1554 O PRO A 113 -12.282 -1.276 7.315 1.00 0.00 O ATOM 1555 CB PRO A 113 -15.772 -1.203 7.113 1.00 0.00 C ATOM 1556 CG PRO A 113 -15.788 -2.527 6.417 1.00 0.00 C ATOM 1557 CD PRO A 113 -15.030 -2.356 5.126 1.00 0.00 C ATOM 0 HA PRO A 113 -14.557 0.545 6.597 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -15.803 -1.326 8.196 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -16.637 -0.601 6.836 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.325 -3.294 7.037 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -16.811 -2.849 6.224 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.441 -3.242 4.888 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.704 -2.187 4.286 1.00 0.00 H new ATOM 1565 N ALA A 114 -13.569 -0.517 8.925 1.00 0.00 N ATOM 1566 CA ALA A 114 -12.509 -0.756 9.946 1.00 0.00 C ATOM 1567 C ALA A 114 -13.111 -1.411 11.193 1.00 0.00 C ATOM 1568 O ALA A 114 -13.103 -0.845 12.268 1.00 0.00 O ATOM 1569 CB ALA A 114 -11.963 0.632 10.281 1.00 0.00 C ATOM 0 H ALA A 114 -14.439 -0.124 9.285 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.729 -1.425 9.582 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -11.175 0.542 11.029 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -11.557 1.091 9.379 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -12.767 1.254 10.674 1.00 0.00 H new ATOM 1661 N GLU A 122 -13.347 -6.237 6.759 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.944 -4.828 6.473 1.00 0.00 C ATOM 1663 C GLU A 122 -12.128 -4.756 5.178 1.00 0.00 C ATOM 1664 O GLU A 122 -12.302 -5.553 4.279 1.00 0.00 O ATOM 1665 CB GLU A 122 -12.095 -4.404 7.675 1.00 0.00 C ATOM 1666 CG GLU A 122 -10.700 -5.026 7.570 1.00 0.00 C ATOM 1667 CD GLU A 122 -10.135 -5.250 8.974 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -10.423 -4.443 9.843 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -9.423 -6.224 9.156 1.00 0.00 O ATOM 0 HA GLU A 122 -13.805 -4.175 6.335 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -12.017 -3.317 7.711 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -12.575 -4.720 8.601 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.752 -5.972 7.032 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.040 -4.371 7.001 1.00 0.00 H new ATOM 1676 N GLY A 123 -11.239 -3.806 5.077 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.413 -3.685 3.840 1.00 0.00 C ATOM 1678 C GLY A 123 -9.035 -3.128 4.203 1.00 0.00 C ATOM 1679 O GLY A 123 -8.867 -2.473 5.212 1.00 0.00 O ATOM 0 H GLY A 123 -11.048 -3.108 5.796 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.310 -4.659 3.362 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.906 -3.028 3.123 1.00 0.00 H new ATOM 1683 N GLN A 124 -8.044 -3.388 3.393 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.678 -2.875 3.705 1.00 0.00 C ATOM 1685 C GLN A 124 -5.884 -2.630 2.418 1.00 0.00 C ATOM 1686 O GLN A 124 -6.441 -2.484 1.346 1.00 0.00 O ATOM 1687 CB GLN A 124 -6.029 -3.987 4.530 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.800 -5.215 3.646 1.00 0.00 C ATOM 1689 CD GLN A 124 -4.357 -5.697 3.807 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -3.579 -5.096 4.521 1.00 0.00 O ATOM 1691 NE2 GLN A 124 -3.963 -6.765 3.169 1.00 0.00 N ATOM 0 H GLN A 124 -8.120 -3.931 2.533 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.706 -1.924 4.237 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -5.081 -3.642 4.943 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.668 -4.248 5.374 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.493 -6.010 3.922 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.998 -4.968 2.603 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -4.615 -7.270 2.569 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.003 -7.094 3.270 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.581 -2.599 2.520 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.734 -2.377 1.311 1.00 0.00 C ATOM 1702 C ILE A 125 -2.843 -3.598 1.093 1.00 0.00 C ATOM 1703 O ILE A 125 -2.479 -4.286 2.028 1.00 0.00 O ATOM 1704 CB ILE A 125 -2.887 -1.137 1.629 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.693 0.123 1.305 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.600 -1.147 0.788 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -2.952 1.353 1.832 1.00 0.00 C ATOM 0 H ILE A 125 -4.065 -2.718 3.392 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.322 -2.232 0.405 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.623 -1.147 2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.839 0.207 0.228 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.683 0.060 1.757 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.006 -0.263 1.021 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.023 -2.043 1.017 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.857 -1.142 -0.271 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.526 2.250 1.601 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.829 1.269 2.912 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.972 1.418 1.359 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.496 -3.880 -0.129 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.640 -5.065 -0.393 1.00 0.00 C ATOM 1721 C ALA A 126 -0.421 -4.685 -1.235 1.00 0.00 C ATOM 1722 O ALA A 126 -0.539 -4.187 -2.336 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.537 -6.034 -1.163 1.00 0.00 C ATOM 0 H ALA A 126 -2.767 -3.344 -0.953 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.255 -5.499 0.530 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.977 -6.940 -1.398 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.403 -6.290 -0.553 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.871 -5.564 -2.088 1.00 0.00 H new ATOM 1729 N PHE A 127 0.750 -4.950 -0.729 1.00 0.00 N ATOM 1730 CA PHE A 127 1.991 -4.645 -1.493 1.00 0.00 C ATOM 1731 C PHE A 127 2.726 -5.964 -1.727 1.00 0.00 C ATOM 1732 O PHE A 127 3.347 -6.507 -0.836 1.00 0.00 O ATOM 1733 CB PHE A 127 2.807 -3.710 -0.594 1.00 0.00 C ATOM 1734 CG PHE A 127 2.437 -2.272 -0.885 1.00 0.00 C ATOM 1735 CD1 PHE A 127 1.098 -1.863 -0.816 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.432 -1.345 -1.225 1.00 0.00 C ATOM 1737 CE1 PHE A 127 0.756 -0.533 -1.087 1.00 0.00 C ATOM 1738 CE2 PHE A 127 3.089 -0.015 -1.496 1.00 0.00 C ATOM 1739 CZ PHE A 127 1.751 0.390 -1.427 1.00 0.00 C ATOM 0 H PHE A 127 0.902 -5.368 0.189 1.00 0.00 H new ATOM 0 HA PHE A 127 1.807 -4.177 -2.460 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.616 -3.940 0.454 1.00 0.00 H new ATOM 0 HB3 PHE A 127 3.872 -3.863 -0.765 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.329 -2.575 -0.553 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.465 -1.657 -1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.276 -0.219 -1.034 1.00 0.00 H new ATOM 0 HE2 PHE A 127 3.856 0.698 -1.758 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.486 1.416 -1.636 1.00 0.00 H new ATOM 1749 N GLN A 128 2.621 -6.508 -2.907 1.00 0.00 N ATOM 1750 CA GLN A 128 3.271 -7.820 -3.177 1.00 0.00 C ATOM 1751 C GLN A 128 4.708 -7.655 -3.670 1.00 0.00 C ATOM 1752 O GLN A 128 4.954 -7.380 -4.827 1.00 0.00 O ATOM 1753 CB GLN A 128 2.410 -8.465 -4.262 1.00 0.00 C ATOM 1754 CG GLN A 128 1.135 -9.033 -3.634 1.00 0.00 C ATOM 1755 CD GLN A 128 1.326 -10.523 -3.348 1.00 0.00 C ATOM 1756 OE1 GLN A 128 0.465 -11.326 -3.649 1.00 0.00 O ATOM 1757 NE2 GLN A 128 2.426 -10.930 -2.776 1.00 0.00 N ATOM 0 H GLN A 128 2.115 -6.102 -3.694 1.00 0.00 H new ATOM 0 HA GLN A 128 3.335 -8.423 -2.271 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.155 -7.729 -5.024 1.00 0.00 H new ATOM 0 HB3 GLN A 128 2.968 -9.259 -4.759 1.00 0.00 H new ATOM 0 HG2 GLN A 128 0.904 -8.502 -2.711 1.00 0.00 H new ATOM 0 HG3 GLN A 128 0.290 -8.887 -4.306 1.00 0.00 H new ATOM 0 HE21 GLN A 128 3.149 -10.256 -2.523 1.00 0.00 H new ATOM 0 HE22 GLN A 128 2.563 -11.922 -2.582 1.00 0.00 H new ATOM 1766 N LEU A 129 5.658 -7.858 -2.801 1.00 0.00 N ATOM 1767 CA LEU A 129 7.085 -7.759 -3.212 1.00 0.00 C ATOM 1768 C LEU A 129 7.659 -9.175 -3.327 1.00 0.00 C ATOM 1769 O LEU A 129 8.755 -9.457 -2.885 1.00 0.00 O ATOM 1770 CB LEU A 129 7.790 -6.985 -2.092 1.00 0.00 C ATOM 1771 CG LEU A 129 7.078 -5.652 -1.821 1.00 0.00 C ATOM 1772 CD1 LEU A 129 8.047 -4.703 -1.113 1.00 0.00 C ATOM 1773 CD2 LEU A 129 6.620 -5.015 -3.137 1.00 0.00 C ATOM 0 H LEU A 129 5.506 -8.089 -1.819 1.00 0.00 H new ATOM 0 HA LEU A 129 7.213 -7.259 -4.172 1.00 0.00 H new ATOM 0 HB2 LEU A 129 7.806 -7.586 -1.183 1.00 0.00 H new ATOM 0 HB3 LEU A 129 8.828 -6.799 -2.369 1.00 0.00 H new ATOM 0 HG LEU A 129 6.205 -5.836 -1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.549 -3.754 -0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.367 -5.146 -0.170 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.917 -4.532 -1.747 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.117 -4.071 -2.928 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.486 -4.832 -3.773 1.00 0.00 H new ATOM 0 HD23 LEU A 129 5.931 -5.688 -3.647 1.00 0.00 H new ATOM 1785 N GLY A 130 6.911 -10.077 -3.900 1.00 0.00 N ATOM 1786 CA GLY A 130 7.398 -11.481 -4.027 1.00 0.00 C ATOM 1787 C GLY A 130 7.996 -11.711 -5.417 1.00 0.00 C ATOM 1788 O GLY A 130 7.324 -12.155 -6.327 1.00 0.00 O ATOM 0 H GLY A 130 5.983 -9.903 -4.286 1.00 0.00 H new ATOM 0 HA2 GLY A 130 8.148 -11.684 -3.263 1.00 0.00 H new ATOM 0 HA3 GLY A 130 6.575 -12.175 -3.858 1.00 0.00 H new ATOM 1792 N GLY A 131 9.258 -11.425 -5.583 1.00 0.00 N ATOM 1793 CA GLY A 131 9.903 -11.640 -6.909 1.00 0.00 C ATOM 1794 C GLY A 131 9.656 -10.429 -7.809 1.00 0.00 C ATOM 1795 O GLY A 131 8.560 -10.209 -8.283 1.00 0.00 O ATOM 0 H GLY A 131 9.870 -11.052 -4.858 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.974 -11.797 -6.781 1.00 0.00 H new ATOM 0 HA3 GLY A 131 9.503 -12.540 -7.377 1.00 0.00 H new ATOM 1799 N PHE A 132 10.670 -9.643 -8.050 1.00 0.00 N ATOM 1800 CA PHE A 132 10.498 -8.447 -8.924 1.00 0.00 C ATOM 1801 C PHE A 132 11.865 -7.875 -9.308 1.00 0.00 C ATOM 1802 O PHE A 132 12.228 -7.839 -10.467 1.00 0.00 O ATOM 1803 CB PHE A 132 9.708 -7.449 -8.080 1.00 0.00 C ATOM 1804 CG PHE A 132 8.230 -7.660 -8.311 1.00 0.00 C ATOM 1805 CD1 PHE A 132 7.703 -7.560 -9.605 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.385 -7.954 -7.233 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.333 -7.754 -9.821 1.00 0.00 C ATOM 1808 CE2 PHE A 132 6.015 -8.148 -7.450 1.00 0.00 C ATOM 1809 CZ PHE A 132 5.490 -8.048 -8.743 1.00 0.00 C ATOM 0 H PHE A 132 11.611 -9.777 -7.679 1.00 0.00 H new ATOM 0 HA PHE A 132 9.983 -8.683 -9.855 1.00 0.00 H new ATOM 0 HB2 PHE A 132 9.945 -7.580 -7.024 1.00 0.00 H new ATOM 0 HB3 PHE A 132 9.987 -6.429 -8.345 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.354 -7.333 -10.437 1.00 0.00 H new ATOM 0 HD2 PHE A 132 7.790 -8.031 -6.235 1.00 0.00 H new ATOM 0 HE1 PHE A 132 5.927 -7.677 -10.819 1.00 0.00 H new ATOM 0 HE2 PHE A 132 5.364 -8.375 -6.619 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.433 -8.198 -8.909 1.00 0.00 H new ATOM 1819 N SER A 133 12.632 -7.433 -8.347 1.00 0.00 N ATOM 1820 CA SER A 133 13.976 -6.873 -8.671 1.00 0.00 C ATOM 1821 C SER A 133 15.024 -7.990 -8.656 1.00 0.00 C ATOM 1822 O SER A 133 14.709 -9.143 -8.436 1.00 0.00 O ATOM 1823 CB SER A 133 14.257 -5.851 -7.571 1.00 0.00 C ATOM 1824 OG SER A 133 15.659 -5.779 -7.343 1.00 0.00 O ATOM 0 H SER A 133 12.388 -7.435 -7.357 1.00 0.00 H new ATOM 0 HA SER A 133 14.010 -6.418 -9.661 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.873 -4.873 -7.861 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.742 -6.136 -6.654 1.00 0.00 H new ATOM 0 HG SER A 133 15.840 -5.873 -6.384 1.00 0.00 H new ATOM 1830 N ALA A 134 16.264 -7.664 -8.898 1.00 0.00 N ATOM 1831 CA ALA A 134 17.321 -8.717 -8.905 1.00 0.00 C ATOM 1832 C ALA A 134 18.102 -8.710 -7.585 1.00 0.00 C ATOM 1833 O ALA A 134 17.699 -9.319 -6.614 1.00 0.00 O ATOM 1834 CB ALA A 134 18.233 -8.352 -10.078 1.00 0.00 C ATOM 0 H ALA A 134 16.591 -6.717 -9.091 1.00 0.00 H new ATOM 0 HA ALA A 134 16.902 -9.718 -9.009 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.040 -9.081 -10.152 1.00 0.00 H new ATOM 0 HB2 ALA A 134 17.656 -8.355 -11.002 1.00 0.00 H new ATOM 0 HB3 ALA A 134 18.654 -7.360 -9.916 1.00 0.00 H new ATOM 1840 N ASP A 135 19.220 -8.035 -7.542 1.00 0.00 N ATOM 1841 CA ASP A 135 20.024 -8.002 -6.285 1.00 0.00 C ATOM 1842 C ASP A 135 19.173 -7.501 -5.115 1.00 0.00 C ATOM 1843 O ASP A 135 18.221 -6.768 -5.296 1.00 0.00 O ATOM 1844 CB ASP A 135 21.166 -7.027 -6.572 1.00 0.00 C ATOM 1845 CG ASP A 135 22.289 -7.758 -7.309 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.130 -8.008 -8.493 1.00 0.00 O ATOM 1847 OD2 ASP A 135 23.290 -8.055 -6.678 1.00 0.00 O ATOM 0 H ASP A 135 19.611 -7.506 -8.321 1.00 0.00 H new ATOM 0 HA ASP A 135 20.388 -8.991 -6.006 1.00 0.00 H new ATOM 0 HB2 ASP A 135 20.804 -6.194 -7.174 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.542 -6.607 -5.639 1.00 0.00 H new ATOM 1852 N ALA A 136 19.513 -7.890 -3.916 1.00 0.00 N ATOM 1853 CA ALA A 136 18.729 -7.435 -2.733 1.00 0.00 C ATOM 1854 C ALA A 136 18.501 -5.926 -2.801 1.00 0.00 C ATOM 1855 O ALA A 136 19.433 -5.148 -2.853 1.00 0.00 O ATOM 1856 CB ALA A 136 19.593 -7.794 -1.523 1.00 0.00 C ATOM 0 H ALA A 136 20.300 -8.503 -3.705 1.00 0.00 H new ATOM 0 HA ALA A 136 17.746 -7.903 -2.684 1.00 0.00 H new ATOM 0 HB1 ALA A 136 19.083 -7.490 -0.609 1.00 0.00 H new ATOM 0 HB2 ALA A 136 19.762 -8.871 -1.503 1.00 0.00 H new ATOM 0 HB3 ALA A 136 20.550 -7.278 -1.593 1.00 0.00 H new ATOM 1862 N TRP A 137 17.267 -5.505 -2.796 1.00 0.00 N ATOM 1863 CA TRP A 137 16.982 -4.046 -2.857 1.00 0.00 C ATOM 1864 C TRP A 137 16.085 -3.640 -1.694 1.00 0.00 C ATOM 1865 O TRP A 137 16.040 -4.299 -0.673 1.00 0.00 O ATOM 1866 CB TRP A 137 16.284 -3.823 -4.197 1.00 0.00 C ATOM 1867 CG TRP A 137 14.882 -4.343 -4.145 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.796 -3.611 -3.805 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.391 -5.683 -4.448 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.673 -4.414 -3.881 1.00 0.00 N ATOM 1871 CE2 TRP A 137 12.987 -5.698 -4.272 1.00 0.00 C ATOM 1872 CE3 TRP A 137 15.020 -6.876 -4.854 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 12.233 -6.850 -4.490 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.261 -8.039 -5.075 1.00 0.00 C ATOM 1875 CH2 TRP A 137 12.870 -8.024 -4.893 1.00 0.00 C ATOM 0 H TRP A 137 16.445 -6.108 -2.752 1.00 0.00 H new ATOM 0 HA TRP A 137 17.887 -3.444 -2.779 1.00 0.00 H new ATOM 0 HB2 TRP A 137 16.276 -2.760 -4.438 1.00 0.00 H new ATOM 0 HB3 TRP A 137 16.836 -4.326 -4.991 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.805 -2.569 -3.521 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.727 -4.095 -3.673 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.090 -6.898 -4.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 11.163 -6.834 -4.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.752 -8.949 -5.387 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.293 -8.921 -5.065 1.00 0.00 H new ATOM 1886 N THR A 138 15.386 -2.551 -1.822 1.00 0.00 N ATOM 1887 CA THR A 138 14.520 -2.109 -0.700 1.00 0.00 C ATOM 1888 C THR A 138 13.447 -1.133 -1.198 1.00 0.00 C ATOM 1889 O THR A 138 13.493 -0.658 -2.314 1.00 0.00 O ATOM 1890 CB THR A 138 15.511 -1.442 0.272 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.191 -1.814 1.603 1.00 0.00 O ATOM 1892 CG2 THR A 138 15.464 0.087 0.146 1.00 0.00 C ATOM 0 H THR A 138 15.376 -1.952 -2.648 1.00 0.00 H new ATOM 0 HA THR A 138 13.966 -2.920 -0.228 1.00 0.00 H new ATOM 0 HB THR A 138 16.517 -1.778 0.020 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.266 -2.134 1.640 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.174 0.532 0.844 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.726 0.376 -0.872 1.00 0.00 H new ATOM 0 HG23 THR A 138 14.459 0.440 0.376 1.00 0.00 H new ATOM 1900 N LEU A 139 12.489 -0.825 -0.369 1.00 0.00 N ATOM 1901 CA LEU A 139 11.419 0.128 -0.778 1.00 0.00 C ATOM 1902 C LEU A 139 11.397 1.310 0.191 1.00 0.00 C ATOM 1903 O LEU A 139 11.893 1.219 1.295 1.00 0.00 O ATOM 1904 CB LEU A 139 10.115 -0.666 -0.687 1.00 0.00 C ATOM 1905 CG LEU A 139 9.831 -1.337 -2.030 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.471 -2.726 -2.054 1.00 0.00 C ATOM 1907 CD2 LEU A 139 8.318 -1.468 -2.222 1.00 0.00 C ATOM 0 H LEU A 139 12.401 -1.194 0.578 1.00 0.00 H new ATOM 0 HA LEU A 139 11.573 0.527 -1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 139 10.189 -1.418 0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 139 9.292 -0.004 -0.418 1.00 0.00 H new ATOM 0 HG LEU A 139 10.250 -0.732 -2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.268 -3.204 -3.012 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.548 -2.633 -1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 139 10.054 -3.333 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.113 -1.946 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.900 -2.073 -1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.862 -0.478 -2.206 1.00 0.00 H new ATOM 1919 N CYS A 140 10.838 2.418 -0.205 1.00 0.00 N ATOM 1920 CA CYS A 140 10.805 3.589 0.716 1.00 0.00 C ATOM 1921 C CYS A 140 9.580 4.465 0.443 1.00 0.00 C ATOM 1922 O CYS A 140 9.619 5.366 -0.371 1.00 0.00 O ATOM 1923 CB CYS A 140 12.092 4.360 0.424 1.00 0.00 C ATOM 1924 SG CYS A 140 13.423 3.735 1.481 1.00 0.00 S ATOM 0 H CYS A 140 10.406 2.564 -1.117 1.00 0.00 H new ATOM 0 HA CYS A 140 10.738 3.282 1.760 1.00 0.00 H new ATOM 0 HB2 CYS A 140 12.364 4.250 -0.626 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.940 5.424 0.604 1.00 0.00 H new ATOM 1929 N LEU A 141 8.498 4.221 1.131 1.00 0.00 N ATOM 1930 CA LEU A 141 7.283 5.056 0.921 1.00 0.00 C ATOM 1931 C LEU A 141 7.318 6.251 1.878 1.00 0.00 C ATOM 1932 O LEU A 141 8.253 6.419 2.634 1.00 0.00 O ATOM 1933 CB LEU A 141 6.099 4.144 1.246 1.00 0.00 C ATOM 1934 CG LEU A 141 6.192 2.860 0.418 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.951 1.658 1.329 1.00 0.00 C ATOM 1936 CD2 LEU A 141 5.132 2.877 -0.688 1.00 0.00 C ATOM 0 H LEU A 141 8.404 3.482 1.827 1.00 0.00 H new ATOM 0 HA LEU A 141 7.216 5.447 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 141 6.095 3.903 2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 141 5.162 4.659 1.032 1.00 0.00 H new ATOM 0 HG LEU A 141 7.182 2.792 -0.034 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.016 0.740 0.745 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.705 1.641 2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.960 1.734 1.777 1.00 0.00 H new ATOM 0 HD21 LEU A 141 5.203 1.961 -1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.140 2.946 -0.241 1.00 0.00 H new ATOM 0 HD23 LEU A 141 5.297 3.737 -1.337 1.00 0.00 H new ATOM 1948 N ASP A 142 6.309 7.077 1.855 1.00 0.00 N ATOM 1949 CA ASP A 142 6.290 8.262 2.770 1.00 0.00 C ATOM 1950 C ASP A 142 5.191 9.242 2.352 1.00 0.00 C ATOM 1951 O ASP A 142 5.416 10.432 2.245 1.00 0.00 O ATOM 1952 CB ASP A 142 7.668 8.923 2.630 1.00 0.00 C ATOM 1953 CG ASP A 142 8.129 8.866 1.171 1.00 0.00 C ATOM 1954 OD1 ASP A 142 7.286 8.678 0.310 1.00 0.00 O ATOM 1955 OD2 ASP A 142 9.318 9.012 0.941 1.00 0.00 O ATOM 0 H ASP A 142 5.497 6.986 1.245 1.00 0.00 H new ATOM 0 HA ASP A 142 6.087 7.967 3.799 1.00 0.00 H new ATOM 0 HB2 ASP A 142 7.619 9.959 2.965 1.00 0.00 H new ATOM 0 HB3 ASP A 142 8.391 8.415 3.269 1.00 0.00 H new ATOM 1960 N ASP A 143 4.004 8.753 2.115 1.00 0.00 N ATOM 1961 CA ASP A 143 2.885 9.652 1.704 1.00 0.00 C ATOM 1962 C ASP A 143 1.717 8.818 1.173 1.00 0.00 C ATOM 1963 O ASP A 143 1.084 9.171 0.199 1.00 0.00 O ATOM 1964 CB ASP A 143 3.457 10.532 0.590 1.00 0.00 C ATOM 1965 CG ASP A 143 3.660 11.954 1.116 1.00 0.00 C ATOM 1966 OD1 ASP A 143 2.679 12.566 1.505 1.00 0.00 O ATOM 1967 OD2 ASP A 143 4.793 12.407 1.120 1.00 0.00 O ATOM 0 H ASP A 143 3.759 7.766 2.188 1.00 0.00 H new ATOM 0 HA ASP A 143 2.510 10.248 2.536 1.00 0.00 H new ATOM 0 HB2 ASP A 143 4.405 10.124 0.240 1.00 0.00 H new ATOM 0 HB3 ASP A 143 2.780 10.542 -0.264 1.00 0.00 H new ATOM 1972 N VAL A 144 1.430 7.712 1.804 1.00 0.00 N ATOM 1973 CA VAL A 144 0.306 6.855 1.329 1.00 0.00 C ATOM 1974 C VAL A 144 -1.004 7.282 1.995 1.00 0.00 C ATOM 1975 O VAL A 144 -1.193 7.114 3.184 1.00 0.00 O ATOM 1976 CB VAL A 144 0.686 5.435 1.751 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -0.322 4.444 1.169 1.00 0.00 C ATOM 1978 CG2 VAL A 144 2.084 5.103 1.224 1.00 0.00 C ATOM 0 H VAL A 144 1.924 7.365 2.626 1.00 0.00 H new ATOM 0 HA VAL A 144 0.153 6.933 0.253 1.00 0.00 H new ATOM 0 HB VAL A 144 0.680 5.366 2.839 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.052 3.432 1.469 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.319 4.679 1.541 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.315 4.514 0.081 1.00 0.00 H new ATOM 0 HG21 VAL A 144 2.355 4.091 1.525 1.00 0.00 H new ATOM 0 HG22 VAL A 144 2.089 5.172 0.136 1.00 0.00 H new ATOM 0 HG23 VAL A 144 2.805 5.809 1.635 1.00 0.00 H new ATOM 1988 N ALA A 145 -1.910 7.835 1.235 1.00 0.00 N ATOM 1989 CA ALA A 145 -3.209 8.275 1.820 1.00 0.00 C ATOM 1990 C ALA A 145 -4.364 7.891 0.893 1.00 0.00 C ATOM 1991 O ALA A 145 -4.164 7.552 -0.257 1.00 0.00 O ATOM 1992 CB ALA A 145 -3.095 9.796 1.932 1.00 0.00 C ATOM 0 H ALA A 145 -1.807 8.001 0.234 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.408 7.807 2.784 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -4.015 10.200 2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.255 10.051 2.578 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.934 10.223 0.942 1.00 0.00 H new ATOM 1998 N LEU A 146 -5.573 7.941 1.384 1.00 0.00 N ATOM 1999 CA LEU A 146 -6.741 7.579 0.532 1.00 0.00 C ATOM 2000 C LEU A 146 -7.990 8.332 1.000 1.00 0.00 C ATOM 2001 O LEU A 146 -8.228 8.483 2.182 1.00 0.00 O ATOM 2002 CB LEU A 146 -6.919 6.073 0.724 1.00 0.00 C ATOM 2003 CG LEU A 146 -8.074 5.579 -0.149 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -7.563 5.303 -1.564 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -8.645 4.289 0.446 1.00 0.00 C ATOM 0 H LEU A 146 -5.802 8.217 2.339 1.00 0.00 H new ATOM 0 HA LEU A 146 -6.586 7.841 -0.515 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.000 5.551 0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.121 5.851 1.772 1.00 0.00 H new ATOM 0 HG LEU A 146 -8.853 6.340 -0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.386 4.951 -2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -7.154 6.220 -1.988 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.784 4.541 -1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -9.468 3.935 -0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.865 3.529 0.482 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.009 4.484 1.455 1.00 0.00 H new ATOM 2017 N ASP A 147 -8.789 8.806 0.084 1.00 0.00 N ATOM 2018 CA ASP A 147 -10.020 9.549 0.480 1.00 0.00 C ATOM 2019 C ASP A 147 -11.070 9.466 -0.631 1.00 0.00 C ATOM 2020 O ASP A 147 -10.748 9.318 -1.793 1.00 0.00 O ATOM 2021 CB ASP A 147 -9.563 10.995 0.679 1.00 0.00 C ATOM 2022 CG ASP A 147 -9.822 11.418 2.126 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -10.981 11.552 2.484 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -8.858 11.601 2.851 1.00 0.00 O ATOM 0 H ASP A 147 -8.643 8.711 -0.921 1.00 0.00 H new ATOM 0 HA ASP A 147 -10.478 9.138 1.380 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -8.502 11.087 0.446 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -10.098 11.654 -0.005 1.00 0.00 H new ATOM 2029 N SER A 148 -12.324 9.562 -0.282 1.00 0.00 N ATOM 2030 CA SER A 148 -13.395 9.490 -1.318 1.00 0.00 C ATOM 2031 C SER A 148 -13.914 10.894 -1.640 1.00 0.00 C ATOM 2032 O SER A 148 -14.416 11.593 -0.783 1.00 0.00 O ATOM 2033 CB SER A 148 -14.498 8.642 -0.688 1.00 0.00 C ATOM 2034 OG SER A 148 -15.409 9.490 -0.002 1.00 0.00 O ATOM 0 H SER A 148 -12.654 9.687 0.675 1.00 0.00 H new ATOM 0 HA SER A 148 -13.037 9.062 -2.254 1.00 0.00 H new ATOM 0 HB2 SER A 148 -15.021 8.075 -1.458 1.00 0.00 H new ATOM 0 HB3 SER A 148 -14.066 7.918 0.003 1.00 0.00 H new ATOM 0 HG SER A 148 -14.941 10.296 0.300 1.00 0.00 H new