Browse entries in the PDBbind-CN Database
HEADER 1NKI_COMPLEX COMPND 1NKI_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 134 MET LEU THR GLY LEU ASN HIS LEU THR LEU ALA VAL ALA SEQRES 2 A 134 ASP LEU PRO ALA SER ILE ALA PHE TYR ARG ASP LEU LEU SEQRES 3 A 134 GLY PHE ARG LEU GLU ALA ARG TRP ASP GLN GLY ALA TYR SEQRES 4 A 134 LEU GLU LEU GLY SER LEU TRP LEU CYS LEU SER ARG GLU SEQRES 5 A 134 PRO GLN TYR GLY GLY PRO ALA ALA ASP TYR THR HIS TYR SEQRES 6 A 134 ALA PHE GLY ILE ALA ALA ALA ASP PHE ALA ARG PHE ALA SEQRES 7 A 134 ALA GLN LEU ARG ALA HIS GLY VAL ARG GLU TRP LYS GLN SEQRES 8 A 134 ASN ARG SER GLU GLY ASP SER PHE TYR PHE LEU ASP PRO SEQRES 9 A 134 ASP GLY HIS ARG LEU GLU ALA HIS VAL GLY ASP LEU ARG SEQRES 10 A 134 SER ARG LEU ALA ALA CYS ARG GLN ALA PRO TYR ALA GLY SEQRES 11 A 134 MET ARG PHE ALA SEQRES 1 B 134 MET LEU THR GLY LEU ASN HIS LEU THR LEU ALA VAL ALA SEQRES 2 B 134 ASP LEU PRO ALA SER ILE ALA PHE TYR ARG ASP LEU LEU SEQRES 3 B 134 GLY PHE ARG LEU GLU ALA ARG TRP ASP GLN GLY ALA TYR SEQRES 4 B 134 LEU GLU LEU GLY SER LEU TRP LEU CYS LEU SER ARG GLU SEQRES 5 B 134 PRO GLN TYR GLY GLY PRO ALA ALA ASP TYR THR HIS TYR SEQRES 6 B 134 ALA PHE GLY ILE ALA ALA ALA ASP PHE ALA ARG PHE ALA SEQRES 7 B 134 ALA GLN LEU ARG ALA HIS GLY VAL ARG GLU TRP LYS GLN SEQRES 8 B 134 ASN ARG SER GLU GLY ASP SER PHE TYR PHE LEU ASP PRO SEQRES 9 B 134 ASP GLY HIS ARG LEU GLU ALA HIS VAL GLY ASP LEU ARG SEQRES 10 B 134 SER ARG LEU ALA ALA CYS ARG GLN ALA PRO TYR ALA GLY SEQRES 11 B 134 MET ARG PHE ALA HET MN A 1 1 HET MN A 2 1 HET PPF A 690 7 ATOM 1 N MET A 1 50.959 15.403 18.168 1.00 26.83 N ATOM 2 CA MET A 1 50.479 14.366 17.269 1.00 21.72 C ATOM 3 C MET A 1 49.399 14.787 16.288 1.00 17.80 C ATOM 4 O MET A 1 49.285 14.306 15.164 1.00 19.53 O ATOM 5 CB MET A 1 49.972 13.135 18.084 1.00 24.64 C ATOM 6 CG MET A 1 50.939 12.454 18.955 1.00 29.28 C ATOM 7 SD MET A 1 50.365 10.872 19.574 1.00 27.38 S ATOM 8 CE MET A 1 50.268 11.270 21.329 1.00 29.32 C ATOM 9 HA MET A 1 51.348 14.117 16.660 1.00 0.00 H ATOM 10 HB2 MET A 1 49.149 13.476 18.713 1.00 0.00 H ATOM 11 HB3 MET A 1 49.602 12.400 17.369 1.00 0.00 H ATOM 12 HG2 MET A 1 51.150 13.101 19.807 1.00 0.00 H ATOM 13 HG3 MET A 1 51.856 12.290 18.389 1.00 0.00 H ATOM 14 HE1 MET A 1 51.254 11.563 21.689 1.00 0.00 H ATOM 15 HE2 MET A 1 49.567 12.092 21.476 1.00 0.00 H ATOM 16 HE3 MET A 1 49.924 10.395 21.880 1.00 0.00 H ATOM 17 HN3 MET A 1 50.167 15.756 18.742 1.00 0.00 H ATOM 18 HN2 MET A 1 51.361 16.184 17.611 1.00 0.00 H ATOM 19 HN1 MET A 1 51.691 15.008 18.792 1.00 0.00 H ATOM 20 N LEU A 2 48.533 15.663 16.708 1.00 14.40 N ATOM 21 CA LEU A 2 47.461 16.115 15.818 1.00 12.65 C ATOM 22 C LEU A 2 48.038 17.086 14.816 1.00 13.13 C ATOM 23 O LEU A 2 48.980 17.803 15.126 1.00 17.06 O ATOM 24 CB LEU A 2 46.345 16.755 16.659 1.00 12.15 C ATOM 25 CG LEU A 2 45.695 15.896 17.725 1.00 13.19 C ATOM 26 CD1 LEU A 2 44.661 16.712 18.484 1.00 13.94 C ATOM 27 CD2 LEU A 2 45.080 14.651 17.100 1.00 13.45 C ATOM 28 HA LEU A 2 47.028 15.278 15.270 1.00 0.00 H ATOM 29 HB2 LEU A 2 46.769 17.628 17.156 1.00 0.00 H ATOM 30 HB3 LEU A 2 45.561 17.074 15.973 1.00 0.00 H ATOM 31 HG LEU A 2 46.452 15.565 18.436 1.00 0.00 H ATOM 32 HD21 LEU A 2 44.325 14.947 16.372 1.00 0.00 H ATOM 33 HD22 LEU A 2 45.859 14.073 16.603 1.00 0.00 H ATOM 34 HD23 LEU A 2 44.618 14.045 17.879 1.00 0.00 H ATOM 35 HD11 LEU A 2 45.148 17.565 18.956 1.00 0.00 H ATOM 36 HD12 LEU A 2 43.898 17.065 17.790 1.00 0.00 H ATOM 37 HD13 LEU A 2 44.198 16.088 19.249 1.00 0.00 H ATOM 38 H LEU A 2 48.602 16.042 17.674 1.00 0.00 H ATOM 39 N THR A 3 47.427 17.154 13.655 1.00 12.96 N ATOM 40 CA THR A 3 48.021 17.889 12.524 1.00 16.02 C ATOM 41 C THR A 3 47.281 19.139 12.110 1.00 15.82 C ATOM 42 O THR A 3 47.836 19.943 11.352 1.00 18.16 O ATOM 43 CB THR A 3 48.092 16.950 11.299 1.00 18.45 C ATOM 44 OG1 THR A 3 46.811 16.457 10.929 1.00 19.46 O ATOM 45 CG2 THR A 3 48.955 15.703 11.665 1.00 23.18 C ATOM 46 HA THR A 3 49.002 18.212 12.871 1.00 0.00 H ATOM 47 HB THR A 3 48.514 17.527 10.476 1.00 0.00 H ATOM 48 HG1 THR A 3 46.219 17.217 10.702 1.00 0.00 H ATOM 49 HG23 THR A 3 49.954 16.027 11.958 1.00 0.00 H ATOM 50 HG21 THR A 3 48.488 15.169 12.493 1.00 0.00 H ATOM 51 HG22 THR A 3 49.025 15.044 10.799 1.00 0.00 H ATOM 52 H THR A 3 46.509 16.681 13.532 1.00 0.00 H ATOM 53 N GLY A 4 46.066 19.341 12.559 1.00 13.44 N ATOM 54 CA GLY A 4 45.217 20.457 12.176 1.00 13.16 C ATOM 55 C GLY A 4 43.770 19.988 12.100 1.00 11.12 C ATOM 56 O GLY A 4 43.469 18.967 12.701 1.00 12.14 O ATOM 57 HA3 GLY A 4 45.529 20.834 11.202 1.00 0.00 H ATOM 58 HA2 GLY A 4 45.304 21.252 12.917 1.00 0.00 H ATOM 59 H GLY A 4 45.682 18.653 13.238 1.00 0.00 H ATOM 60 N LEU A 5 42.940 20.759 11.432 1.00 11.34 N ATOM 61 CA LEU A 5 41.511 20.384 11.323 1.00 11.10 C ATOM 62 C LEU A 5 41.371 19.423 10.165 1.00 11.64 C ATOM 63 O LEU A 5 41.764 19.674 9.043 1.00 16.20 O ATOM 64 CB LEU A 5 40.611 21.605 11.074 1.00 14.19 C ATOM 65 CG LEU A 5 39.112 21.286 11.385 1.00 15.54 C ATOM 66 CD1 LEU A 5 38.851 21.536 12.856 1.00 22.64 C ATOM 67 CD2 LEU A 5 38.044 21.872 10.508 1.00 29.95 C ATOM 68 HA LEU A 5 41.196 19.931 12.263 1.00 0.00 H ATOM 69 HB2 LEU A 5 40.939 22.424 11.714 1.00 0.00 H ATOM 70 HB3 LEU A 5 40.700 21.904 10.030 1.00 0.00 H ATOM 71 HG LEU A 5 39.008 20.233 11.124 1.00 0.00 H ATOM 72 HD21 LEU A 5 38.104 22.960 10.542 1.00 0.00 H ATOM 73 HD22 LEU A 5 38.189 21.530 9.483 1.00 0.00 H ATOM 74 HD23 LEU A 5 37.066 21.550 10.865 1.00 0.00 H ATOM 75 HD11 LEU A 5 39.497 20.892 13.453 1.00 0.00 H ATOM 76 HD12 LEU A 5 39.062 22.580 13.089 1.00 0.00 H ATOM 77 HD13 LEU A 5 37.807 21.316 13.081 1.00 0.00 H ATOM 78 H LEU A 5 43.286 21.630 10.981 1.00 0.00 H ATOM 79 N ASN A 6 40.662 18.327 10.444 1.00 9.41 N ATOM 80 CA ASN A 6 40.353 17.300 9.455 1.00 9.29 C ATOM 81 C ASN A 6 38.981 17.511 8.833 1.00 8.92 C ATOM 82 O ASN A 6 38.849 17.443 7.614 1.00 9.40 O ATOM 83 CB ASN A 6 40.492 15.929 10.098 1.00 9.90 C ATOM 84 CG ASN A 6 40.366 14.828 9.089 1.00 9.96 C ATOM 85 OD1 ASN A 6 39.286 14.308 8.831 1.00 10.70 O ATOM 86 ND2 ASN A 6 41.447 14.475 8.449 1.00 13.87 N ATOM 87 HA ASN A 6 41.065 17.370 8.633 1.00 0.00 H ATOM 88 HB2 ASN A 6 41.469 15.860 10.576 1.00 0.00 H ATOM 89 HB3 ASN A 6 39.712 15.810 10.850 1.00 0.00 H ATOM 90 HD22 ASN A 6 42.357 14.924 8.678 1.00 0.00 H ATOM 91 HD21 ASN A 6 41.399 13.745 7.710 1.00 0.00 H ATOM 92 H ASN A 6 40.312 18.199 11.415 1.00 0.00 H ATOM 93 N HIS A 7 37.962 17.736 9.663 1.00 8.72 N ATOM 94 CA HIS A 7 36.615 18.030 9.113 1.00 8.53 C ATOM 95 C HIS A 7 35.791 18.677 10.207 1.00 8.55 C ATOM 96 O HIS A 7 36.094 18.582 11.397 1.00 9.28 O ATOM 97 CB HIS A 7 35.919 16.785 8.552 1.00 8.86 C ATOM 98 CG HIS A 7 35.675 15.642 9.468 1.00 8.77 C ATOM 99 ND1 HIS A 7 36.585 14.621 9.658 1.00 8.88 N ATOM 100 CD2 HIS A 7 34.584 15.287 10.229 1.00 8.91 C ATOM 101 CE1 HIS A 7 36.034 13.728 10.477 1.00 9.09 C ATOM 102 NE2 HIS A 7 34.844 14.084 10.857 1.00 9.32 N ATOM 103 HA HIS A 7 36.721 18.709 8.267 1.00 0.00 H ATOM 104 HB2 HIS A 7 34.950 17.103 8.167 1.00 0.00 H ATOM 105 HB3 HIS A 7 36.532 16.415 7.730 1.00 0.00 H ATOM 106 HD2 HIS A 7 33.663 15.863 10.321 1.00 0.00 H ATOM 107 HE1 HIS A 7 36.524 12.806 10.792 1.00 0.00 H ATOM 108 H HIS A 7 38.110 17.706 10.692 1.00 0.00 H ATOM 109 N LEU A 8 34.760 19.380 9.735 1.00 8.46 N ATOM 110 CA LEU A 8 33.738 20.013 10.546 1.00 8.54 C ATOM 111 C LEU A 8 32.428 19.321 10.272 1.00 8.55 C ATOM 112 O LEU A 8 32.046 19.256 9.106 1.00 8.92 O ATOM 113 CB LEU A 8 33.631 21.495 10.171 1.00 8.97 C ATOM 114 CG LEU A 8 32.499 22.320 10.776 1.00 9.80 C ATOM 115 CD1 LEU A 8 32.583 22.376 12.276 1.00 11.30 C ATOM 116 CD2 LEU A 8 32.503 23.743 10.218 1.00 11.49 C ATOM 117 HA LEU A 8 33.990 19.937 11.604 1.00 0.00 H ATOM 118 HB2 LEU A 8 34.567 21.970 10.464 1.00 0.00 H ATOM 119 HB3 LEU A 8 33.523 21.546 9.088 1.00 0.00 H ATOM 120 HG LEU A 8 31.569 21.823 10.501 1.00 0.00 H ATOM 121 HD21 LEU A 8 33.453 24.222 10.456 1.00 0.00 H ATOM 122 HD22 LEU A 8 32.373 23.708 9.136 1.00 0.00 H ATOM 123 HD23 LEU A 8 31.686 24.310 10.665 1.00 0.00 H ATOM 124 HD11 LEU A 8 32.522 21.365 12.680 1.00 0.00 H ATOM 125 HD12 LEU A 8 33.530 22.829 12.569 1.00 0.00 H ATOM 126 HD13 LEU A 8 31.757 22.974 12.663 1.00 0.00 H ATOM 127 H LEU A 8 34.683 19.482 8.703 1.00 0.00 H ATOM 128 N THR A 9 31.732 18.818 11.310 1.00 8.19 N ATOM 129 CA THR A 9 30.427 18.205 11.134 1.00 8.34 C ATOM 130 C THR A 9 29.370 18.971 11.872 1.00 8.00 C ATOM 131 O THR A 9 29.525 19.253 13.053 1.00 8.65 O ATOM 132 CB THR A 9 30.480 16.735 11.630 1.00 8.79 C ATOM 133 OG1 THR A 9 31.432 16.088 10.775 1.00 9.54 O ATOM 134 CG2 THR A 9 29.133 16.077 11.533 1.00 9.38 C ATOM 135 HA THR A 9 30.169 18.221 10.075 1.00 0.00 H ATOM 136 HB THR A 9 30.766 16.673 12.680 1.00 0.00 H ATOM 137 HG1 THR A 9 31.517 15.137 11.037 1.00 0.00 H ATOM 138 HG23 THR A 9 28.432 16.589 12.192 1.00 0.00 H ATOM 139 HG21 THR A 9 28.775 16.134 10.505 1.00 0.00 H ATOM 140 HG22 THR A 9 29.218 15.032 11.832 1.00 0.00 H ATOM 141 H THR A 9 32.141 18.870 12.265 1.00 0.00 H ATOM 142 N LEU A 10 28.322 19.335 11.143 1.00 8.18 N ATOM 143 CA LEU A 10 27.204 20.098 11.668 1.00 8.35 C ATOM 144 C LEU A 10 25.930 19.256 11.645 1.00 8.43 C ATOM 145 O LEU A 10 25.568 18.718 10.625 1.00 9.21 O ATOM 146 CB LEU A 10 26.937 21.366 10.837 1.00 9.12 C ATOM 147 CG LEU A 10 28.130 22.336 10.725 1.00 10.07 C ATOM 148 CD1 LEU A 10 27.771 23.495 9.829 1.00 11.45 C ATOM 149 CD2 LEU A 10 28.607 22.783 12.079 1.00 11.43 C ATOM 150 HA LEU A 10 27.468 20.380 12.687 1.00 0.00 H ATOM 151 HB2 LEU A 10 26.656 21.058 9.830 1.00 0.00 H ATOM 152 HB3 LEU A 10 26.107 21.903 11.296 1.00 0.00 H ATOM 153 HG LEU A 10 28.968 21.810 10.268 1.00 0.00 H ATOM 154 HD21 LEU A 10 27.796 23.292 12.599 1.00 0.00 H ATOM 155 HD22 LEU A 10 28.922 21.914 12.657 1.00 0.00 H ATOM 156 HD23 LEU A 10 29.448 23.465 11.959 1.00 0.00 H ATOM 157 HD11 LEU A 10 27.518 23.121 8.837 1.00 0.00 H ATOM 158 HD12 LEU A 10 26.916 24.025 10.248 1.00 0.00 H ATOM 159 HD13 LEU A 10 28.621 24.174 9.757 1.00 0.00 H ATOM 160 H LEU A 10 28.301 19.058 10.141 1.00 0.00 H ATOM 161 N ALA A 11 25.217 19.251 12.793 1.00 8.75 N ATOM 162 CA ALA A 11 23.877 18.716 12.815 1.00 8.94 C ATOM 163 C ALA A 11 22.958 19.652 12.046 1.00 8.41 C ATOM 164 O ALA A 11 23.019 20.866 12.210 1.00 9.41 O ATOM 165 CB ALA A 11 23.376 18.590 14.255 1.00 10.14 C ATOM 166 HA ALA A 11 23.881 17.728 12.355 1.00 0.00 H ATOM 167 HB1 ALA A 11 24.034 17.922 14.810 1.00 0.00 H ATOM 168 HB2 ALA A 11 23.374 19.573 14.725 1.00 0.00 H ATOM 169 HB3 ALA A 11 22.364 18.185 14.252 1.00 0.00 H ATOM 170 H ALA A 11 25.636 19.634 13.664 1.00 0.00 H ATOM 171 N VAL A 12 22.068 19.083 11.222 1.00 8.88 N ATOM 172 CA VAL A 12 21.103 19.905 10.448 1.00 9.11 C ATOM 173 C VAL A 12 19.704 19.254 10.513 1.00 9.42 C ATOM 174 O VAL A 12 19.582 18.046 10.328 1.00 10.52 O ATOM 175 CB VAL A 12 21.549 20.110 8.975 1.00 9.57 C ATOM 176 CG1 VAL A 12 22.895 20.797 8.928 1.00 10.74 C ATOM 177 CG2 VAL A 12 21.582 18.838 8.155 1.00 11.30 C ATOM 178 HA VAL A 12 21.066 20.896 10.901 1.00 0.00 H ATOM 179 HB VAL A 12 20.788 20.741 8.517 1.00 0.00 H ATOM 180 HG11 VAL A 12 22.823 21.768 9.418 1.00 0.00 H ATOM 181 HG12 VAL A 12 23.633 20.182 9.443 1.00 0.00 H ATOM 182 HG13 VAL A 12 23.195 20.934 7.889 1.00 0.00 H ATOM 183 HG21 VAL A 12 22.281 18.134 8.607 1.00 0.00 H ATOM 184 HG22 VAL A 12 20.585 18.397 8.130 1.00 0.00 H ATOM 185 HG23 VAL A 12 21.904 19.070 7.140 1.00 0.00 H ATOM 186 H VAL A 12 22.053 18.048 11.123 1.00 0.00 H ATOM 187 N ALA A 13 18.690 20.055 10.733 1.00 9.55 N ATOM 188 CA ALA A 13 17.342 19.478 10.756 1.00 10.53 C ATOM 189 C ALA A 13 16.772 19.253 9.355 1.00 10.66 C ATOM 190 O ALA A 13 15.945 18.366 9.185 1.00 12.75 O ATOM 191 CB ALA A 13 16.397 20.391 11.538 1.00 12.09 C ATOM 192 HA ALA A 13 17.425 18.505 11.241 1.00 0.00 H ATOM 193 HB1 ALA A 13 16.760 20.498 12.560 1.00 0.00 H ATOM 194 HB2 ALA A 13 16.361 21.370 11.060 1.00 0.00 H ATOM 195 HB3 ALA A 13 15.398 19.954 11.549 1.00 0.00 H ATOM 196 H ALA A 13 18.838 21.073 10.887 1.00 0.00 H ATOM 197 N ASP A 14 17.132 20.104 8.402 1.00 10.98 N ATOM 198 CA ASP A 14 16.532 20.164 7.080 1.00 11.55 C ATOM 199 C ASP A 14 17.678 20.045 6.085 1.00 10.94 C ATOM 200 O ASP A 14 18.338 21.013 5.698 1.00 11.53 O ATOM 201 CB ASP A 14 15.789 21.470 6.926 1.00 14.28 C ATOM 202 CG ASP A 14 14.986 21.664 5.683 1.00 16.39 C ATOM 203 OD1 ASP A 14 15.257 20.908 4.707 1.00 16.88 O ATOM 204 OD2 ASP A 14 14.155 22.643 5.706 1.00 20.79 O ATOM 205 HA ASP A 14 15.809 19.365 6.915 1.00 0.00 H ATOM 206 HB2 ASP A 14 15.108 21.560 7.772 1.00 0.00 H ATOM 207 HB3 ASP A 14 16.526 22.272 6.967 1.00 0.00 H ATOM 208 H ASP A 14 17.897 20.775 8.617 1.00 0.00 H ATOM 209 N LEU A 15 17.972 18.831 5.710 1.00 11.54 N ATOM 210 CA LEU A 15 19.125 18.550 4.884 1.00 11.02 C ATOM 211 C LEU A 15 19.074 19.246 3.542 1.00 10.75 C ATOM 212 O LEU A 15 20.048 19.863 3.105 1.00 11.02 O ATOM 213 CB LEU A 15 19.362 17.043 4.803 1.00 11.78 C ATOM 214 CG LEU A 15 20.561 16.619 3.982 1.00 12.32 C ATOM 215 CD1 LEU A 15 21.886 17.120 4.576 1.00 13.32 C ATOM 216 CD2 LEU A 15 20.635 15.093 3.811 1.00 14.06 C ATOM 217 HA LEU A 15 20.004 18.981 5.364 1.00 0.00 H ATOM 218 HB2 LEU A 15 19.499 16.669 5.817 1.00 0.00 H ATOM 219 HB3 LEU A 15 18.475 16.586 4.365 1.00 0.00 H ATOM 220 HG LEU A 15 20.419 17.081 3.005 1.00 0.00 H ATOM 221 HD21 LEU A 15 20.710 14.622 4.791 1.00 0.00 H ATOM 222 HD22 LEU A 15 19.735 14.741 3.306 1.00 0.00 H ATOM 223 HD23 LEU A 15 21.511 14.837 3.215 1.00 0.00 H ATOM 224 HD11 LEU A 15 21.875 18.209 4.618 1.00 0.00 H ATOM 225 HD12 LEU A 15 22.007 16.717 5.582 1.00 0.00 H ATOM 226 HD13 LEU A 15 22.713 16.788 3.948 1.00 0.00 H ATOM 227 H LEU A 15 17.362 18.045 6.013 1.00 0.00 H ATOM 228 N PRO A 16 17.946 19.170 2.796 1.00 12.17 N ATOM 229 CA PRO A 16 17.883 19.938 1.537 1.00 12.02 C ATOM 230 C PRO A 16 18.138 21.421 1.724 1.00 11.12 C ATOM 231 O PRO A 16 18.876 22.021 0.885 1.00 11.84 O ATOM 232 CB PRO A 16 16.457 19.681 1.029 1.00 13.79 C ATOM 233 CG PRO A 16 16.108 18.357 1.625 1.00 13.14 C ATOM 234 CD PRO A 16 16.727 18.345 3.005 1.00 13.21 C ATOM 235 HA PRO A 16 18.659 19.624 0.839 1.00 0.00 H ATOM 236 HD3 PRO A 16 16.063 18.796 3.743 1.00 0.00 H ATOM 237 HD2 PRO A 16 16.981 17.332 3.318 1.00 0.00 H ATOM 238 HG3 PRO A 16 16.517 17.549 1.019 1.00 0.00 H ATOM 239 HG2 PRO A 16 15.026 18.246 1.694 1.00 0.00 H ATOM 240 HB2 PRO A 16 15.774 20.457 1.375 1.00 0.00 H ATOM 241 HB3 PRO A 16 16.433 19.637 -0.060 1.00 0.00 H ATOM 242 N ALA A 17 17.583 22.065 2.734 1.00 10.94 N ATOM 243 CA ALA A 17 17.771 23.497 2.930 1.00 11.33 C ATOM 244 C ALA A 17 19.260 23.760 3.221 1.00 10.51 C ATOM 245 O ALA A 17 19.827 24.750 2.747 1.00 10.96 O ATOM 246 CB ALA A 17 16.947 24.040 4.074 1.00 13.33 C ATOM 247 HA ALA A 17 17.444 24.003 2.022 1.00 0.00 H ATOM 248 HB1 ALA A 17 15.890 23.865 3.874 1.00 0.00 H ATOM 249 HB2 ALA A 17 17.232 23.535 4.997 1.00 0.00 H ATOM 250 HB3 ALA A 17 17.127 25.110 4.174 1.00 0.00 H ATOM 251 H ALA A 17 16.995 21.536 3.409 1.00 0.00 H ATOM 252 N SER A 18 19.889 22.914 4.050 1.00 9.69 N ATOM 253 CA SER A 18 21.289 23.154 4.391 1.00 9.32 C ATOM 254 C SER A 18 22.211 22.915 3.205 1.00 9.65 C ATOM 255 O SER A 18 23.170 23.679 3.006 1.00 9.73 O ATOM 256 CB SER A 18 21.669 22.285 5.566 1.00 9.56 C ATOM 257 OG SER A 18 20.911 22.642 6.703 1.00 11.03 O ATOM 258 HA SER A 18 21.407 24.202 4.666 1.00 0.00 H ATOM 259 HB2 SER A 18 22.729 22.417 5.784 1.00 0.00 H ATOM 260 HB3 SER A 18 21.477 21.241 5.319 1.00 0.00 H ATOM 261 HG SER A 18 21.086 23.590 6.930 1.00 0.00 H ATOM 262 H SER A 18 19.385 22.095 4.446 1.00 0.00 H ATOM 263 N ILE A 19 21.960 21.863 2.423 1.00 10.12 N ATOM 264 CA ILE A 19 22.804 21.681 1.228 1.00 10.61 C ATOM 265 C ILE A 19 22.698 22.897 0.341 1.00 10.46 C ATOM 266 O ILE A 19 23.702 23.402 -0.178 1.00 11.57 O ATOM 267 CB ILE A 19 22.359 20.390 0.466 1.00 11.12 C ATOM 268 CG1 ILE A 19 22.753 19.151 1.297 1.00 11.44 C ATOM 269 CG2 ILE A 19 22.969 20.347 -0.908 1.00 12.22 C ATOM 270 CD1 ILE A 19 22.213 17.857 0.766 1.00 12.79 C ATOM 271 HA ILE A 19 23.846 21.564 1.525 1.00 0.00 H ATOM 272 HB ILE A 19 21.277 20.397 0.338 1.00 0.00 H ATOM 273 HG12 ILE A 19 23.841 19.085 1.318 1.00 0.00 H ATOM 274 HG13 ILE A 19 22.379 19.287 2.312 1.00 0.00 H ATOM 275 HD11 ILE A 19 21.124 17.899 0.750 1.00 0.00 H ATOM 276 HD12 ILE A 19 22.587 17.696 -0.245 1.00 0.00 H ATOM 277 HD13 ILE A 19 22.537 17.038 1.409 1.00 0.00 H ATOM 278 HG21 ILE A 19 22.646 21.220 -1.475 1.00 0.00 H ATOM 279 HG22 ILE A 19 24.056 20.349 -0.822 1.00 0.00 H ATOM 280 HG23 ILE A 19 22.646 19.440 -1.420 1.00 0.00 H ATOM 281 H ILE A 19 21.196 21.195 2.649 1.00 0.00 H ATOM 282 N ALA A 20 21.475 23.379 0.073 1.00 10.59 N ATOM 283 CA ALA A 20 21.316 24.529 -0.806 1.00 11.61 C ATOM 284 C ALA A 20 22.045 25.756 -0.248 1.00 10.54 C ATOM 285 O ALA A 20 22.677 26.505 -1.007 1.00 11.70 O ATOM 286 CB ALA A 20 19.845 24.804 -1.016 1.00 13.23 C ATOM 287 HA ALA A 20 21.769 24.304 -1.772 1.00 0.00 H ATOM 288 HB1 ALA A 20 19.375 23.932 -1.470 1.00 0.00 H ATOM 289 HB2 ALA A 20 19.375 25.013 -0.055 1.00 0.00 H ATOM 290 HB3 ALA A 20 19.728 25.665 -1.674 1.00 0.00 H ATOM 291 H ALA A 20 20.637 22.930 0.495 1.00 0.00 H ATOM 292 N PHE A 21 21.970 25.981 1.054 1.00 10.21 N ATOM 293 CA PHE A 21 22.664 27.095 1.683 1.00 9.47 C ATOM 294 C PHE A 21 24.170 27.005 1.466 1.00 9.30 C ATOM 295 O PHE A 21 24.820 27.942 0.976 1.00 9.69 O ATOM 296 CB PHE A 21 22.270 27.142 3.152 1.00 10.02 C ATOM 297 CG PHE A 21 22.882 28.270 3.942 1.00 9.98 C ATOM 298 CD1 PHE A 21 22.254 29.482 4.041 1.00 11.65 C ATOM 299 CD2 PHE A 21 24.115 28.084 4.607 1.00 9.99 C ATOM 300 CE1 PHE A 21 22.803 30.513 4.824 1.00 13.01 C ATOM 301 CE2 PHE A 21 24.628 29.093 5.382 1.00 11.42 C ATOM 302 CZ PHE A 21 23.989 30.271 5.492 1.00 13.20 C ATOM 303 HA PHE A 21 22.365 28.035 1.220 1.00 0.00 H ATOM 304 HB2 PHE A 21 21.186 27.239 3.208 1.00 0.00 H ATOM 305 HB3 PHE A 21 22.574 26.202 3.614 1.00 0.00 H ATOM 306 HD2 PHE A 21 24.656 27.143 4.505 1.00 0.00 H ATOM 307 HE2 PHE A 21 25.566 28.938 5.916 1.00 0.00 H ATOM 308 HZ PHE A 21 24.415 31.052 6.121 1.00 0.00 H ATOM 309 HE1 PHE A 21 22.305 31.480 4.902 1.00 0.00 H ATOM 310 HD1 PHE A 21 21.319 29.650 3.507 1.00 0.00 H ATOM 311 H PHE A 21 21.399 25.343 1.645 1.00 0.00 H ATOM 312 N TYR A 22 24.778 25.911 1.905 1.00 9.58 N ATOM 313 CA TYR A 22 26.223 25.789 1.824 1.00 9.20 C ATOM 314 C TYR A 22 26.745 25.714 0.383 1.00 10.16 C ATOM 315 O TYR A 22 27.750 26.330 0.044 1.00 10.36 O ATOM 316 CB TYR A 22 26.755 24.569 2.643 1.00 9.45 C ATOM 317 CG TYR A 22 26.678 24.903 4.142 1.00 8.45 C ATOM 318 CD1 TYR A 22 25.632 24.516 4.935 1.00 9.31 C ATOM 319 CD2 TYR A 22 27.665 25.668 4.710 1.00 9.22 C ATOM 320 CE1 TYR A 22 25.560 24.853 6.282 1.00 8.56 C ATOM 321 CE2 TYR A 22 27.617 26.032 6.058 1.00 9.33 C ATOM 322 CZ TYR A 22 26.560 25.623 6.839 1.00 8.48 C ATOM 323 OH TYR A 22 26.544 26.024 8.153 1.00 9.00 O ATOM 324 HA TYR A 22 26.610 26.707 2.266 1.00 0.00 H ATOM 325 HB3 TYR A 22 27.789 24.365 2.366 1.00 0.00 H ATOM 326 HB2 TYR A 22 26.144 23.692 2.432 1.00 0.00 H ATOM 327 HD2 TYR A 22 28.504 25.999 4.097 1.00 0.00 H ATOM 328 HE2 TYR A 22 28.414 26.638 6.490 1.00 0.00 H ATOM 329 HE1 TYR A 22 24.723 24.513 6.891 1.00 0.00 H ATOM 330 HD1 TYR A 22 24.829 23.924 4.496 1.00 0.00 H ATOM 331 HH TYR A 22 25.736 25.663 8.597 1.00 0.00 H ATOM 332 H TYR A 22 24.216 25.135 2.310 1.00 0.00 H ATOM 333 N ARG A 23 26.019 24.978 -0.468 1.00 11.03 N ATOM 334 CA ARG A 23 26.424 24.874 -1.880 1.00 12.17 C ATOM 335 C ARG A 23 26.205 26.165 -2.626 1.00 12.20 C ATOM 336 O ARG A 23 27.121 26.729 -3.248 1.00 14.43 O ATOM 337 CB ARG A 23 25.605 23.758 -2.519 1.00 14.96 C ATOM 338 CG ARG A 23 26.039 23.527 -3.997 1.00 17.58 C ATOM 339 CD ARG A 23 25.200 22.405 -4.627 1.00 22.72 C ATOM 340 NE ARG A 23 23.834 22.924 -4.680 1.00 22.21 N ATOM 341 CZ ARG A 23 22.660 22.329 -4.604 1.00 24.93 C ATOM 342 NH1 ARG A 23 22.650 21.015 -4.540 1.00 31.63 N ATOM 343 NH2 ARG A 23 21.568 23.073 -4.622 1.00 27.72 N ATOM 344 HA ARG A 23 27.491 24.656 -1.930 1.00 0.00 H ATOM 345 HB2 ARG A 23 25.754 22.837 -1.955 1.00 0.00 H ATOM 346 HB3 ARG A 23 24.550 24.030 -2.495 1.00 0.00 H ATOM 347 HG2 ARG A 23 25.894 24.447 -4.563 1.00 0.00 H ATOM 348 HG3 ARG A 23 27.092 23.248 -4.024 1.00 0.00 H ATOM 349 HD2 ARG A 23 25.243 21.506 -4.013 1.00 0.00 H ATOM 350 HD3 ARG A 23 25.560 22.176 -5.630 1.00 0.00 H ATOM 351 HE ARG A 23 23.778 23.956 -4.800 1.00 0.00 H ATOM 352 HH12 ARG A 23 21.746 20.504 -4.479 1.00 0.00 H ATOM 353 HH11 ARG A 23 23.546 20.487 -4.550 1.00 0.00 H ATOM 354 HH22 ARG A 23 20.632 22.624 -4.563 1.00 0.00 H ATOM 355 HH21 ARG A 23 21.645 24.108 -4.695 1.00 0.00 H ATOM 356 H ARG A 23 25.170 24.480 -0.132 1.00 0.00 H ATOM 357 N ASP A 24 25.009 26.681 -2.608 1.00 13.01 N ATOM 358 CA ASP A 24 24.637 27.774 -3.537 1.00 15.09 C ATOM 359 C ASP A 24 24.943 29.152 -2.953 1.00 15.78 C ATOM 360 O ASP A 24 25.384 30.066 -3.662 1.00 19.71 O ATOM 361 CB ASP A 24 23.177 27.628 -3.932 1.00 19.37 C ATOM 362 CG ASP A 24 22.905 26.285 -4.601 1.00 23.29 C ATOM 363 OD1 ASP A 24 23.801 25.800 -5.300 1.00 20.82 O ATOM 364 OD2 ASP A 24 21.856 25.660 -4.390 1.00 26.63 O ATOM 365 HA ASP A 24 25.248 27.692 -4.436 1.00 0.00 H ATOM 366 HB2 ASP A 24 22.559 27.709 -3.038 1.00 0.00 H ATOM 367 HB3 ASP A 24 22.917 28.428 -4.626 1.00 0.00 H ATOM 368 H ASP A 24 24.305 26.321 -1.932 1.00 0.00 H ATOM 369 N LEU A 25 24.745 29.458 -1.675 1.00 15.19 N ATOM 370 CA LEU A 25 25.088 30.764 -1.116 1.00 15.76 C ATOM 371 C LEU A 25 26.550 30.851 -0.708 1.00 14.50 C ATOM 372 O LEU A 25 27.201 31.879 -0.869 1.00 17.27 O ATOM 373 CB LEU A 25 24.205 31.135 0.082 1.00 15.64 C ATOM 374 CG LEU A 25 22.821 31.671 -0.237 1.00 16.63 C ATOM 375 CD1 LEU A 25 22.010 31.941 1.027 1.00 15.24 C ATOM 376 CD2 LEU A 25 22.857 32.939 -1.092 1.00 18.18 C ATOM 377 HA LEU A 25 24.906 31.479 -1.918 1.00 0.00 H ATOM 378 HB2 LEU A 25 24.081 30.240 0.692 1.00 0.00 H ATOM 379 HB3 LEU A 25 24.731 31.897 0.658 1.00 0.00 H ATOM 380 HG LEU A 25 22.335 30.885 -0.815 1.00 0.00 H ATOM 381 HD21 LEU A 25 23.402 33.719 -0.560 1.00 0.00 H ATOM 382 HD22 LEU A 25 23.357 32.725 -2.037 1.00 0.00 H ATOM 383 HD23 LEU A 25 21.838 33.274 -1.286 1.00 0.00 H ATOM 384 HD11 LEU A 25 21.896 31.014 1.589 1.00 0.00 H ATOM 385 HD12 LEU A 25 22.529 32.678 1.640 1.00 0.00 H ATOM 386 HD13 LEU A 25 21.027 32.323 0.752 1.00 0.00 H ATOM 387 H LEU A 25 24.330 28.740 -1.048 1.00 0.00 H ATOM 388 N LEU A 26 27.091 29.747 -0.163 1.00 12.46 N ATOM 389 CA LEU A 26 28.467 29.831 0.346 1.00 12.56 C ATOM 390 C LEU A 26 29.489 29.230 -0.627 1.00 12.61 C ATOM 391 O LEU A 26 30.710 29.368 -0.390 1.00 14.43 O ATOM 392 CB LEU A 26 28.618 29.219 1.732 1.00 11.85 C ATOM 393 CG LEU A 26 28.228 30.144 2.878 1.00 11.16 C ATOM 394 CD1 LEU A 26 26.787 30.628 2.755 1.00 12.89 C ATOM 395 CD2 LEU A 26 28.437 29.416 4.198 1.00 10.59 C ATOM 396 HA LEU A 26 28.681 30.896 0.434 1.00 0.00 H ATOM 397 HB2 LEU A 26 27.989 28.330 1.782 1.00 0.00 H ATOM 398 HB3 LEU A 26 29.661 28.932 1.866 1.00 0.00 H ATOM 399 HG LEU A 26 28.863 31.029 2.838 1.00 0.00 H ATOM 400 HD21 LEU A 26 27.815 28.521 4.220 1.00 0.00 H ATOM 401 HD22 LEU A 26 29.486 29.134 4.294 1.00 0.00 H ATOM 402 HD23 LEU A 26 28.159 30.073 5.022 1.00 0.00 H ATOM 403 HD11 LEU A 26 26.667 31.174 1.819 1.00 0.00 H ATOM 404 HD12 LEU A 26 26.115 29.770 2.765 1.00 0.00 H ATOM 405 HD13 LEU A 26 26.553 31.284 3.593 1.00 0.00 H ATOM 406 H LEU A 26 26.551 28.860 -0.104 1.00 0.00 H ATOM 407 N GLY A 27 29.057 28.569 -1.697 1.00 11.74 N ATOM 408 CA GLY A 27 29.968 28.106 -2.723 1.00 11.99 C ATOM 409 C GLY A 27 30.710 26.817 -2.407 1.00 11.69 C ATOM 410 O GLY A 27 31.713 26.540 -3.053 1.00 13.83 O ATOM 411 HA3 GLY A 27 30.709 28.887 -2.892 1.00 0.00 H ATOM 412 HA2 GLY A 27 29.394 27.948 -3.636 1.00 0.00 H ATOM 413 H GLY A 27 28.039 28.380 -1.799 1.00 0.00 H ATOM 414 N PHE A 28 30.259 26.063 -1.427 1.00 10.90 N ATOM 415 CA PHE A 28 30.822 24.733 -1.221 1.00 11.09 C ATOM 416 C PHE A 28 30.493 23.837 -2.414 1.00 11.15 C ATOM 417 O PHE A 28 29.436 23.972 -3.030 1.00 12.89 O ATOM 418 CB PHE A 28 30.282 24.097 0.054 1.00 10.93 C ATOM 419 CG PHE A 28 30.849 24.585 1.363 1.00 10.84 C ATOM 420 CD1 PHE A 28 30.582 25.860 1.847 1.00 11.33 C ATOM 421 CD2 PHE A 28 31.669 23.750 2.111 1.00 11.68 C ATOM 422 CE1 PHE A 28 31.139 26.265 3.056 1.00 12.23 C ATOM 423 CE2 PHE A 28 32.225 24.170 3.308 1.00 12.99 C ATOM 424 CZ PHE A 28 31.944 25.438 3.776 1.00 12.37 C ATOM 425 HA PHE A 28 31.903 24.837 -1.125 1.00 0.00 H ATOM 426 HB2 PHE A 28 29.206 24.271 0.077 1.00 0.00 H ATOM 427 HB3 PHE A 28 30.474 23.026 -0.007 1.00 0.00 H ATOM 428 HD2 PHE A 28 31.879 22.744 1.749 1.00 0.00 H ATOM 429 HE2 PHE A 28 32.878 23.506 3.875 1.00 0.00 H ATOM 430 HZ PHE A 28 32.367 25.776 4.722 1.00 0.00 H ATOM 431 HE1 PHE A 28 30.926 27.265 3.434 1.00 0.00 H ATOM 432 HD1 PHE A 28 29.941 26.538 1.284 1.00 0.00 H ATOM 433 H PHE A 28 29.505 26.414 -0.802 1.00 0.00 H ATOM 434 N ARG A 29 31.403 22.886 -2.688 1.00 11.45 N ATOM 435 CA ARG A 29 31.124 21.864 -3.688 1.00 11.94 C ATOM 436 C ARG A 29 30.511 20.656 -2.996 1.00 10.94 C ATOM 437 O ARG A 29 31.067 20.140 -2.024 1.00 11.69 O ATOM 438 CB ARG A 29 32.409 21.444 -4.379 1.00 13.42 C ATOM 439 CG ARG A 29 32.236 20.372 -5.449 1.00 18.32 C ATOM 440 CD ARG A 29 33.393 20.254 -6.407 1.00 26.85 C ATOM 441 NE ARG A 29 33.112 19.484 -7.642 1.00 37.38 N ATOM 442 CZ ARG A 29 33.146 18.223 -7.912 1.00 36.63 C ATOM 443 NH1 ARG A 29 33.500 17.434 -6.890 1.00 43.33 N ATOM 444 NH2 ARG A 29 32.884 17.589 -9.019 1.00 35.58 N ATOM 445 HA ARG A 29 30.436 22.264 -4.432 1.00 0.00 H ATOM 446 HB2 ARG A 29 32.846 22.325 -4.848 1.00 0.00 H ATOM 447 HB3 ARG A 29 33.093 21.061 -3.621 1.00 0.00 H ATOM 448 HG2 ARG A 29 32.106 19.411 -4.951 1.00 0.00 H ATOM 449 HG3 ARG A 29 31.340 20.606 -6.024 1.00 0.00 H ATOM 450 HD2 ARG A 29 34.216 19.766 -5.885 1.00 0.00 H ATOM 451 HD3 ARG A 29 33.695 21.260 -6.698 1.00 0.00 H ATOM 452 HE ARG A 29 32.833 20.077 -8.450 1.00 0.00 H ATOM 453 HH12 ARG A 29 33.552 16.404 -7.022 1.00 0.00 H ATOM 454 HH11 ARG A 29 33.723 17.851 -5.964 1.00 0.00 H ATOM 455 HH22 ARG A 29 32.965 16.553 -9.056 1.00 0.00 H ATOM 456 HH21 ARG A 29 32.594 18.119 -9.866 1.00 0.00 H ATOM 457 H ARG A 29 32.312 22.880 -2.183 1.00 0.00 H ATOM 458 N LEU A 30 29.352 20.195 -3.448 1.00 11.89 N ATOM 459 CA LEU A 30 28.732 18.997 -2.951 1.00 11.20 C ATOM 460 C LEU A 30 29.451 17.759 -3.526 1.00 11.37 C ATOM 461 O LEU A 30 29.428 17.553 -4.766 1.00 14.32 O ATOM 462 CB LEU A 30 27.253 18.977 -3.302 1.00 12.40 C ATOM 463 CG LEU A 30 26.487 17.756 -2.825 1.00 13.30 C ATOM 464 CD1 LEU A 30 26.444 17.665 -1.322 1.00 13.39 C ATOM 465 CD2 LEU A 30 25.103 17.747 -3.434 1.00 15.29 C ATOM 466 HA LEU A 30 28.818 18.977 -1.865 1.00 0.00 H ATOM 467 HB2 LEU A 30 26.790 19.859 -2.859 1.00 0.00 H ATOM 468 HB3 LEU A 30 27.164 19.027 -4.387 1.00 0.00 H ATOM 469 HG LEU A 30 27.017 16.866 -3.164 1.00 0.00 H ATOM 470 HD21 LEU A 30 24.569 18.648 -3.132 1.00 0.00 H ATOM 471 HD22 LEU A 30 25.186 17.719 -4.520 1.00 0.00 H ATOM 472 HD23 LEU A 30 24.560 16.868 -3.087 1.00 0.00 H ATOM 473 HD11 LEU A 30 27.461 17.602 -0.934 1.00 0.00 H ATOM 474 HD12 LEU A 30 25.955 18.552 -0.919 1.00 0.00 H ATOM 475 HD13 LEU A 30 25.886 16.776 -1.029 1.00 0.00 H ATOM 476 H LEU A 30 28.868 20.727 -4.199 1.00 0.00 H ATOM 477 N GLU A 31 30.095 16.979 -2.706 1.00 11.38 N ATOM 478 CA GLU A 31 30.837 15.786 -3.124 1.00 11.70 C ATOM 479 C GLU A 31 30.042 14.494 -2.967 1.00 12.27 C ATOM 480 O GLU A 31 30.226 13.591 -3.809 1.00 14.10 O ATOM 481 CB GLU A 31 32.159 15.694 -2.371 1.00 12.57 C ATOM 482 CG GLU A 31 33.115 16.815 -2.732 1.00 13.66 C ATOM 483 CD GLU A 31 33.814 16.620 -4.049 1.00 18.34 C ATOM 484 OE1 GLU A 31 33.729 15.497 -4.639 1.00 19.99 O ATOM 485 OE2 GLU A 31 34.501 17.604 -4.494 1.00 19.13 O ATOM 486 HA GLU A 31 31.031 15.899 -4.191 1.00 0.00 H ATOM 487 HB2 GLU A 31 31.956 15.739 -1.301 1.00 0.00 H ATOM 488 HB3 GLU A 31 32.632 14.741 -2.610 1.00 0.00 H ATOM 489 HG2 GLU A 31 32.551 17.746 -2.777 1.00 0.00 H ATOM 490 HG3 GLU A 31 33.871 16.887 -1.950 1.00 0.00 H ATOM 491 H GLU A 31 30.082 17.217 -1.694 1.00 0.00 H ATOM 492 N ALA A 32 29.176 14.418 -1.999 1.00 12.42 N ATOM 493 CA ALA A 32 28.346 13.224 -1.842 1.00 12.96 C ATOM 494 C ALA A 32 27.137 13.593 -0.999 1.00 12.16 C ATOM 495 O ALA A 32 27.179 14.506 -0.166 1.00 11.65 O ATOM 496 CB ALA A 32 29.085 12.084 -1.222 1.00 14.90 C ATOM 497 HA ALA A 32 28.040 12.885 -2.832 1.00 0.00 H ATOM 498 HB1 ALA A 32 29.935 11.819 -1.850 1.00 0.00 H ATOM 499 HB2 ALA A 32 29.439 12.377 -0.234 1.00 0.00 H ATOM 500 HB3 ALA A 32 28.418 11.227 -1.131 1.00 0.00 H ATOM 501 H ALA A 32 29.073 15.210 -1.333 1.00 0.00 H ATOM 502 N ARG A 33 26.040 12.892 -1.212 1.00 13.45 N ATOM 503 CA ARG A 33 24.804 13.101 -0.488 1.00 13.48 C ATOM 504 C ARG A 33 24.174 11.744 -0.240 1.00 13.66 C ATOM 505 O ARG A 33 24.266 10.869 -1.083 1.00 15.95 O ATOM 506 CB ARG A 33 23.945 14.013 -1.322 1.00 16.90 C ATOM 507 CG ARG A 33 22.601 14.346 -0.782 1.00 18.58 C ATOM 508 CD ARG A 33 21.840 15.207 -1.822 1.00 19.55 C ATOM 509 NE ARG A 33 20.607 15.621 -1.201 1.00 18.47 N ATOM 510 CZ ARG A 33 19.927 16.712 -1.525 1.00 17.33 C ATOM 511 NH1 ARG A 33 20.280 17.524 -2.517 1.00 20.89 N ATOM 512 NH2 ARG A 33 18.819 16.978 -0.831 1.00 20.71 N ATOM 513 HA ARG A 33 24.948 13.574 0.484 1.00 0.00 H ATOM 514 HB2 ARG A 33 24.489 14.948 -1.455 1.00 0.00 H ATOM 515 HB3 ARG A 33 23.802 13.536 -2.292 1.00 0.00 H ATOM 516 HG2 ARG A 33 22.046 13.428 -0.590 1.00 0.00 H ATOM 517 HG3 ARG A 33 22.708 14.905 0.148 1.00 0.00 H ATOM 518 HD2 ARG A 33 21.631 14.618 -2.715 1.00 0.00 H ATOM 519 HD3 ARG A 33 22.434 16.079 -2.094 1.00 0.00 H ATOM 520 HE ARG A 33 20.223 15.020 -0.444 1.00 0.00 H ATOM 521 HH12 ARG A 33 19.709 18.367 -2.727 1.00 0.00 H ATOM 522 HH11 ARG A 33 21.128 17.316 -3.083 1.00 0.00 H ATOM 523 HH22 ARG A 33 18.257 17.824 -1.053 1.00 0.00 H ATOM 524 HH21 ARG A 33 18.518 16.339 -0.068 1.00 0.00 H ATOM 525 H ARG A 33 26.064 12.149 -1.939 1.00 0.00 H ATOM 526 N TRP A 34 23.522 11.575 0.882 1.00 13.48 N ATOM 527 CA TRP A 34 22.818 10.313 1.166 1.00 13.47 C ATOM 528 C TRP A 34 21.596 10.679 2.003 1.00 13.14 C ATOM 529 O TRP A 34 21.347 11.831 2.324 1.00 13.23 O ATOM 530 CB TRP A 34 23.725 9.316 1.800 1.00 14.45 C ATOM 531 CG TRP A 34 24.249 9.567 3.191 1.00 14.50 C ATOM 532 CD1 TRP A 34 23.765 9.000 4.348 1.00 15.78 C ATOM 533 CD2 TRP A 34 25.345 10.426 3.593 1.00 14.77 C ATOM 534 NE1 TRP A 34 24.444 9.405 5.444 1.00 17.52 N ATOM 535 CE2 TRP A 34 25.414 10.262 5.007 1.00 15.87 C ATOM 536 CE3 TRP A 34 26.244 11.215 2.921 1.00 15.59 C ATOM 537 CZ2 TRP A 34 26.358 10.915 5.763 1.00 17.93 C ATOM 538 CZ3 TRP A 34 27.226 11.908 3.685 1.00 16.38 C ATOM 539 CH2 TRP A 34 27.211 11.710 5.062 1.00 16.92 C ATOM 540 HA TRP A 34 22.485 9.815 0.256 1.00 0.00 H ATOM 541 HB2 TRP A 34 23.184 8.370 1.831 1.00 0.00 H ATOM 542 HB3 TRP A 34 24.592 9.216 1.148 1.00 0.00 H ATOM 543 HE1 TRP A 34 24.263 9.120 6.428 1.00 0.00 H ATOM 544 HD1 TRP A 34 22.928 8.303 4.377 1.00 0.00 H ATOM 545 HZ2 TRP A 34 26.419 10.804 6.846 1.00 0.00 H ATOM 546 HH2 TRP A 34 27.962 12.249 5.640 1.00 0.00 H ATOM 547 HZ3 TRP A 34 27.957 12.564 3.212 1.00 0.00 H ATOM 548 HE3 TRP A 34 26.208 11.309 1.836 1.00 0.00 H ATOM 549 H TRP A 34 23.501 12.343 1.583 1.00 0.00 H ATOM 550 N ASP A 35 20.818 9.675 2.337 1.00 15.31 N ATOM 551 CA ASP A 35 19.588 9.926 3.023 1.00 16.06 C ATOM 552 C ASP A 35 19.750 10.640 4.369 1.00 14.01 C ATOM 553 O ASP A 35 18.797 11.312 4.797 1.00 16.41 O ATOM 554 CB ASP A 35 18.782 8.635 3.151 1.00 16.64 C ATOM 555 CG ASP A 35 18.279 8.089 1.841 1.00 20.87 C ATOM 556 OD1 ASP A 35 18.337 8.731 0.746 1.00 24.60 O ATOM 557 OD2 ASP A 35 17.778 6.962 1.901 1.00 30.07 O ATOM 558 HA ASP A 35 19.030 10.633 2.408 1.00 0.00 H ATOM 559 HB2 ASP A 35 19.417 7.880 3.615 1.00 0.00 H ATOM 560 HB3 ASP A 35 17.923 8.830 3.793 1.00 0.00 H ATOM 561 H ASP A 35 21.095 8.700 2.103 1.00 0.00 H ATOM 562 N GLN A 36 20.871 10.501 5.004 1.00 13.31 N ATOM 563 CA GLN A 36 21.073 11.110 6.318 1.00 13.57 C ATOM 564 C GLN A 36 22.225 12.106 6.347 1.00 11.66 C ATOM 565 O GLN A 36 22.674 12.464 7.458 1.00 12.19 O ATOM 566 CB GLN A 36 21.312 10.035 7.382 1.00 18.21 C ATOM 567 CG GLN A 36 20.101 9.111 7.598 1.00 22.42 C ATOM 568 CD GLN A 36 18.733 9.688 7.387 1.00 30.75 C ATOM 569 OE1 GLN A 36 18.374 10.847 7.279 1.00 43.19 O ATOM 570 NE2 GLN A 36 17.786 8.754 7.337 1.00 40.90 N ATOM 571 HA GLN A 36 20.157 11.659 6.536 1.00 0.00 H ATOM 572 HB2 GLN A 36 22.162 9.426 7.074 1.00 0.00 H ATOM 573 HB3 GLN A 36 21.544 10.528 8.326 1.00 0.00 H ATOM 574 HG2 GLN A 36 20.208 8.269 6.914 1.00 0.00 H ATOM 575 HG3 GLN A 36 20.147 8.750 8.625 1.00 0.00 H ATOM 576 HE22 GLN A 36 18.041 7.750 7.424 1.00 0.00 H ATOM 577 HE21 GLN A 36 16.791 9.029 7.211 1.00 0.00 H ATOM 578 H GLN A 36 21.639 9.948 4.573 1.00 0.00 H ATOM 579 N GLY A 37 22.737 12.561 5.196 1.00 12.15 N ATOM 580 CA GLY A 37 23.808 13.549 5.311 1.00 11.60 C ATOM 581 C GLY A 37 24.382 13.957 3.988 1.00 11.11 C ATOM 582 O GLY A 37 23.891 13.599 2.905 1.00 11.50 O ATOM 583 HA3 GLY A 37 24.607 13.125 5.919 1.00 0.00 H ATOM 584 HA2 GLY A 37 23.410 14.436 5.804 1.00 0.00 H ATOM 585 H GLY A 37 22.392 12.230 4.272 1.00 0.00 H ATOM 586 N ALA A 38 25.433 14.751 4.076 1.00 10.53 N ATOM 587 CA ALA A 38 26.154 15.186 2.870 1.00 10.11 C ATOM 588 C ALA A 38 27.580 15.516 3.241 1.00 9.98 C ATOM 589 O ALA A 38 27.906 15.917 4.347 1.00 10.96 O ATOM 590 CB ALA A 38 25.510 16.391 2.236 1.00 11.79 C ATOM 591 HA ALA A 38 26.124 14.373 2.145 1.00 0.00 H ATOM 592 HB1 ALA A 38 24.486 16.148 1.953 1.00 0.00 H ATOM 593 HB2 ALA A 38 25.505 17.216 2.948 1.00 0.00 H ATOM 594 HB3 ALA A 38 26.074 16.678 1.349 1.00 0.00 H ATOM 595 H ALA A 38 25.756 15.073 5.011 1.00 0.00 H ATOM 596 N TYR A 39 28.486 15.395 2.247 1.00 9.38 N ATOM 597 CA TYR A 39 29.852 15.822 2.312 1.00 9.49 C ATOM 598 C TYR A 39 30.115 16.921 1.299 1.00 9.69 C ATOM 599 O TYR A 39 29.757 16.737 0.109 1.00 10.51 O ATOM 600 CB TYR A 39 30.833 14.697 2.026 1.00 9.99 C ATOM 601 CG TYR A 39 30.839 13.537 2.985 1.00 9.90 C ATOM 602 CD1 TYR A 39 31.004 12.234 2.512 1.00 11.37 C ATOM 603 CD2 TYR A 39 30.677 13.691 4.350 1.00 10.94 C ATOM 604 CE1 TYR A 39 31.034 11.134 3.343 1.00 11.62 C ATOM 605 CE2 TYR A 39 30.730 12.597 5.198 1.00 11.25 C ATOM 606 CZ TYR A 39 30.878 11.328 4.702 1.00 11.24 C ATOM 607 OH TYR A 39 30.897 10.222 5.541 1.00 12.55 O ATOM 608 HA TYR A 39 30.004 16.177 3.331 1.00 0.00 H ATOM 609 HB3 TYR A 39 31.835 15.127 2.022 1.00 0.00 H ATOM 610 HB2 TYR A 39 30.604 14.304 1.035 1.00 0.00 H ATOM 611 HD2 TYR A 39 30.506 14.685 4.763 1.00 0.00 H ATOM 612 HE2 TYR A 39 30.653 12.748 6.275 1.00 0.00 H ATOM 613 HE1 TYR A 39 31.178 10.133 2.936 1.00 0.00 H ATOM 614 HD1 TYR A 39 31.114 12.079 1.439 1.00 0.00 H ATOM 615 HH TYR A 39 30.043 10.173 6.040 1.00 0.00 H ATOM 616 H TYR A 39 28.166 14.955 1.361 1.00 0.00 H ATOM 617 N LEU A 40 30.674 18.031 1.734 1.00 9.78 N ATOM 618 CA LEU A 40 30.992 19.181 0.905 1.00 9.70 C ATOM 619 C LEU A 40 32.424 19.608 1.147 1.00 9.45 C ATOM 620 O LEU A 40 32.992 19.297 2.184 1.00 10.32 O ATOM 621 CB LEU A 40 30.013 20.349 1.139 1.00 10.33 C ATOM 622 CG LEU A 40 28.510 20.017 1.020 1.00 10.66 C ATOM 623 CD1 LEU A 40 27.884 19.633 2.347 1.00 12.55 C ATOM 624 CD2 LEU A 40 27.771 21.140 0.355 1.00 12.30 C ATOM 625 HA LEU A 40 30.883 18.887 -0.139 1.00 0.00 H ATOM 626 HB2 LEU A 40 30.190 20.734 2.143 1.00 0.00 H ATOM 627 HB3 LEU A 40 30.241 21.125 0.408 1.00 0.00 H ATOM 628 HG LEU A 40 28.425 19.133 0.387 1.00 0.00 H ATOM 629 HD21 LEU A 40 27.886 22.049 0.945 1.00 0.00 H ATOM 630 HD22 LEU A 40 28.178 21.300 -0.644 1.00 0.00 H ATOM 631 HD23 LEU A 40 26.714 20.885 0.282 1.00 0.00 H ATOM 632 HD11 LEU A 40 28.389 18.752 2.744 1.00 0.00 H ATOM 633 HD12 LEU A 40 27.988 20.460 3.049 1.00 0.00 H ATOM 634 HD13 LEU A 40 26.827 19.411 2.198 1.00 0.00 H ATOM 635 H LEU A 40 30.905 18.089 2.746 1.00 0.00 H ATOM 636 N GLU A 41 32.949 20.373 0.193 1.00 9.56 N ATOM 637 CA GLU A 41 34.325 20.826 0.290 1.00 9.62 C ATOM 638 C GLU A 41 34.427 22.289 -0.134 1.00 10.23 C ATOM 639 O GLU A 41 33.818 22.685 -1.147 1.00 11.28 O ATOM 640 CB GLU A 41 35.275 19.961 -0.541 1.00 10.78 C ATOM 641 CG GLU A 41 36.752 20.257 -0.251 1.00 11.36 C ATOM 642 CD GLU A 41 37.736 19.339 -0.947 1.00 12.49 C ATOM 643 OE1 GLU A 41 37.569 19.085 -2.151 1.00 15.18 O ATOM 644 OE2 GLU A 41 38.682 18.891 -0.276 1.00 13.76 O ATOM 645 HA GLU A 41 34.630 20.731 1.332 1.00 0.00 H ATOM 646 HB2 GLU A 41 35.079 18.913 -0.317 1.00 0.00 H ATOM 647 HB3 GLU A 41 35.083 20.147 -1.598 1.00 0.00 H ATOM 648 HG2 GLU A 41 36.961 21.279 -0.567 1.00 0.00 H ATOM 649 HG3 GLU A 41 36.910 20.170 0.824 1.00 0.00 H ATOM 650 H GLU A 41 32.371 20.648 -0.626 1.00 0.00 H ATOM 651 N LEU A 42 35.195 23.048 0.601 1.00 10.43 N ATOM 652 CA LEU A 42 35.474 24.458 0.321 1.00 11.77 C ATOM 653 C LEU A 42 36.973 24.634 0.516 1.00 11.30 C ATOM 654 O LEU A 42 37.409 24.595 1.658 1.00 11.61 O ATOM 655 CB LEU A 42 34.700 25.389 1.289 1.00 11.93 C ATOM 656 CG LEU A 42 34.972 26.884 1.074 1.00 12.18 C ATOM 657 CD1 LEU A 42 34.284 27.360 -0.194 1.00 15.63 C ATOM 658 CD2 LEU A 42 34.582 27.680 2.296 1.00 12.98 C ATOM 659 HA LEU A 42 35.158 24.722 -0.688 1.00 0.00 H ATOM 660 HB2 LEU A 42 33.633 25.212 1.154 1.00 0.00 H ATOM 661 HB3 LEU A 42 34.983 25.133 2.310 1.00 0.00 H ATOM 662 HG LEU A 42 36.041 27.045 0.936 1.00 0.00 H ATOM 663 HD21 LEU A 42 33.520 27.540 2.495 1.00 0.00 H ATOM 664 HD22 LEU A 42 35.162 27.336 3.152 1.00 0.00 H ATOM 665 HD23 LEU A 42 34.784 28.736 2.120 1.00 0.00 H ATOM 666 HD11 LEU A 42 34.667 26.799 -1.046 1.00 0.00 H ATOM 667 HD12 LEU A 42 33.210 27.199 -0.105 1.00 0.00 H ATOM 668 HD13 LEU A 42 34.483 28.422 -0.337 1.00 0.00 H ATOM 669 H LEU A 42 35.638 22.623 1.441 1.00 0.00 H ATOM 670 N GLY A 43 37.781 24.850 -0.517 1.00 13.52 N ATOM 671 CA GLY A 43 39.214 24.896 -0.289 1.00 14.04 C ATOM 672 C GLY A 43 39.628 23.526 0.267 1.00 14.76 C ATOM 673 O GLY A 43 39.284 22.468 -0.274 1.00 18.08 O ATOM 674 HA3 GLY A 43 39.453 25.679 0.430 1.00 0.00 H ATOM 675 HA2 GLY A 43 39.736 25.093 -1.226 1.00 0.00 H ATOM 676 H GLY A 43 37.393 24.984 -1.473 1.00 0.00 H ATOM 677 N SER A 44 40.396 23.545 1.363 1.00 14.58 N ATOM 678 CA SER A 44 40.765 22.297 2.001 1.00 14.73 C ATOM 679 C SER A 44 39.760 21.860 3.075 1.00 12.91 C ATOM 680 O SER A 44 39.995 20.818 3.695 1.00 13.02 O ATOM 681 CB SER A 44 42.180 22.462 2.599 1.00 17.95 C ATOM 682 OG SER A 44 42.088 23.444 3.621 1.00 18.47 O ATOM 683 HA SER A 44 40.758 21.506 1.252 1.00 0.00 H ATOM 684 HB2 SER A 44 42.877 22.789 1.827 1.00 0.00 H ATOM 685 HB3 SER A 44 42.522 21.516 3.018 1.00 0.00 H ATOM 686 HG SER A 44 41.772 24.297 3.230 1.00 0.00 H ATOM 687 H SER A 44 40.726 24.450 1.755 1.00 0.00 H ATOM 688 N LEU A 45 38.711 22.637 3.306 1.00 11.16 N ATOM 689 CA LEU A 45 37.736 22.295 4.338 1.00 9.99 C ATOM 690 C LEU A 45 36.781 21.218 3.881 1.00 9.42 C ATOM 691 O LEU A 45 36.057 21.387 2.911 1.00 10.32 O ATOM 692 CB LEU A 45 36.936 23.533 4.771 1.00 10.06 C ATOM 693 CG LEU A 45 35.854 23.266 5.795 1.00 10.28 C ATOM 694 CD1 LEU A 45 36.384 22.746 7.114 1.00 11.38 C ATOM 695 CD2 LEU A 45 35.042 24.541 5.996 1.00 12.05 C ATOM 696 HA LEU A 45 38.303 21.913 5.187 1.00 0.00 H ATOM 697 HB2 LEU A 45 37.633 24.256 5.195 1.00 0.00 H ATOM 698 HB3 LEU A 45 36.466 23.960 3.885 1.00 0.00 H ATOM 699 HG LEU A 45 35.220 22.469 5.406 1.00 0.00 H ATOM 700 HD21 LEU A 45 35.698 25.336 6.350 1.00 0.00 H ATOM 701 HD22 LEU A 45 34.590 24.836 5.049 1.00 0.00 H ATOM 702 HD23 LEU A 45 34.259 24.359 6.732 1.00 0.00 H ATOM 703 HD11 LEU A 45 36.914 21.808 6.947 1.00 0.00 H ATOM 704 HD12 LEU A 45 37.067 23.479 7.544 1.00 0.00 H ATOM 705 HD13 LEU A 45 35.552 22.578 7.798 1.00 0.00 H ATOM 706 H LEU A 45 38.581 23.502 2.744 1.00 0.00 H ATOM 707 N TRP A 46 36.749 20.142 4.673 1.00 9.36 N ATOM 708 CA TRP A 46 35.743 19.067 4.545 1.00 8.91 C ATOM 709 C TRP A 46 34.629 19.384 5.549 1.00 8.68 C ATOM 710 O TRP A 46 34.853 19.368 6.757 1.00 8.88 O ATOM 711 CB TRP A 46 36.399 17.717 4.806 1.00 9.21 C ATOM 712 CG TRP A 46 35.487 16.540 4.860 1.00 8.99 C ATOM 713 CD1 TRP A 46 34.181 16.421 4.479 1.00 9.85 C ATOM 714 CD2 TRP A 46 35.876 15.234 5.331 1.00 9.14 C ATOM 715 NE1 TRP A 46 33.710 15.160 4.703 1.00 10.59 N ATOM 716 CE2 TRP A 46 34.746 14.407 5.239 1.00 10.02 C ATOM 717 CE3 TRP A 46 37.062 14.700 5.849 1.00 9.35 C ATOM 718 CZ2 TRP A 46 34.761 13.069 5.646 1.00 11.16 C ATOM 719 CZ3 TRP A 46 37.113 13.372 6.256 1.00 10.07 C ATOM 720 CH2 TRP A 46 35.945 12.599 6.152 1.00 10.69 C ATOM 721 HA TRP A 46 35.320 19.014 3.542 1.00 0.00 H ATOM 722 HB2 TRP A 46 37.123 17.540 4.011 1.00 0.00 H ATOM 723 HB3 TRP A 46 36.919 17.779 5.762 1.00 0.00 H ATOM 724 HE1 TRP A 46 32.746 14.823 4.507 1.00 0.00 H ATOM 725 HD1 TRP A 46 33.590 17.230 4.050 1.00 0.00 H ATOM 726 HZ2 TRP A 46 33.879 12.434 5.565 1.00 0.00 H ATOM 727 HH2 TRP A 46 35.982 11.565 6.494 1.00 0.00 H ATOM 728 HZ3 TRP A 46 38.035 12.942 6.646 1.00 0.00 H ATOM 729 HE3 TRP A 46 37.949 15.328 5.933 1.00 0.00 H ATOM 730 H TRP A 46 37.469 20.057 5.418 1.00 0.00 H ATOM 731 N LEU A 47 33.447 19.660 5.015 1.00 8.64 N ATOM 732 CA LEU A 47 32.235 19.853 5.783 1.00 8.65 C ATOM 733 C LEU A 47 31.341 18.635 5.661 1.00 8.85 C ATOM 734 O LEU A 47 31.037 18.173 4.560 1.00 9.83 O ATOM 735 CB LEU A 47 31.479 21.082 5.274 1.00 8.94 C ATOM 736 CG LEU A 47 30.143 21.411 5.928 1.00 9.68 C ATOM 737 CD1 LEU A 47 30.306 21.749 7.398 1.00 11.23 C ATOM 738 CD2 LEU A 47 29.454 22.551 5.187 1.00 10.88 C ATOM 739 HA LEU A 47 32.508 20.001 6.828 1.00 0.00 H ATOM 740 HB2 LEU A 47 32.130 21.945 5.411 1.00 0.00 H ATOM 741 HB3 LEU A 47 31.293 20.933 4.210 1.00 0.00 H ATOM 742 HG LEU A 47 29.516 20.522 5.865 1.00 0.00 H ATOM 743 HD21 LEU A 47 30.090 23.436 5.213 1.00 0.00 H ATOM 744 HD22 LEU A 47 29.280 22.257 4.152 1.00 0.00 H ATOM 745 HD23 LEU A 47 28.501 22.772 5.668 1.00 0.00 H ATOM 746 HD11 LEU A 47 30.743 20.897 7.919 1.00 0.00 H ATOM 747 HD12 LEU A 47 30.961 22.614 7.500 1.00 0.00 H ATOM 748 HD13 LEU A 47 29.330 21.977 7.827 1.00 0.00 H ATOM 749 H LEU A 47 33.387 19.743 3.980 1.00 0.00 H ATOM 750 N CYS A 48 30.851 18.126 6.782 1.00 8.73 N ATOM 751 CA CYS A 48 29.876 17.075 6.867 1.00 9.16 C ATOM 752 C CYS A 48 28.564 17.663 7.425 1.00 8.95 C ATOM 753 O CYS A 48 28.602 18.318 8.463 1.00 9.74 O ATOM 754 CB CYS A 48 30.419 15.972 7.778 1.00 9.65 C ATOM 755 SG CYS A 48 32.042 15.308 7.367 1.00 11.62 S ATOM 756 HA CYS A 48 29.676 16.646 5.885 1.00 0.00 H ATOM 757 HB2 CYS A 48 29.709 15.146 7.756 1.00 0.00 H ATOM 758 HB3 CYS A 48 30.473 16.376 8.789 1.00 0.00 H ATOM 759 HG CYS A 48 32.382 14.330 8.280 1.00 0.00 H ATOM 760 H CYS A 48 31.203 18.522 7.677 1.00 0.00 H ATOM 761 N LEU A 49 27.450 17.431 6.748 1.00 9.80 N ATOM 762 CA LEU A 49 26.125 17.750 7.287 1.00 10.27 C ATOM 763 C LEU A 49 25.496 16.447 7.719 1.00 11.11 C ATOM 764 O LEU A 49 25.429 15.492 6.954 1.00 14.37 O ATOM 765 CB LEU A 49 25.261 18.425 6.213 1.00 11.34 C ATOM 766 CG LEU A 49 25.864 19.708 5.603 1.00 11.10 C ATOM 767 CD1 LEU A 49 24.906 20.264 4.548 1.00 12.49 C ATOM 768 CD2 LEU A 49 26.201 20.749 6.668 1.00 11.15 C ATOM 769 HA LEU A 49 26.206 18.439 8.128 1.00 0.00 H ATOM 770 HB2 LEU A 49 25.103 17.709 5.407 1.00 0.00 H ATOM 771 HB3 LEU A 49 24.302 18.682 6.662 1.00 0.00 H ATOM 772 HG LEU A 49 26.810 19.454 5.124 1.00 0.00 H ATOM 773 HD21 LEU A 49 25.294 21.023 7.206 1.00 0.00 H ATOM 774 HD22 LEU A 49 26.927 20.331 7.366 1.00 0.00 H ATOM 775 HD23 LEU A 49 26.622 21.633 6.190 1.00 0.00 H ATOM 776 HD11 LEU A 49 24.759 19.521 3.765 1.00 0.00 H ATOM 777 HD12 LEU A 49 23.949 20.496 5.015 1.00 0.00 H ATOM 778 HD13 LEU A 49 25.330 21.170 4.116 1.00 0.00 H ATOM 779 H LEU A 49 27.518 17.008 5.801 1.00 0.00 H ATOM 780 N SER A 50 25.037 16.403 8.963 1.00 9.96 N ATOM 781 CA SER A 50 24.440 15.193 9.545 1.00 10.58 C ATOM 782 C SER A 50 22.995 15.463 9.879 1.00 9.82 C ATOM 783 O SER A 50 22.682 16.278 10.730 1.00 10.27 O ATOM 784 CB SER A 50 25.255 14.817 10.800 1.00 12.24 C ATOM 785 OG SER A 50 24.781 13.638 11.393 1.00 16.65 O ATOM 786 HA SER A 50 24.466 14.359 8.843 1.00 0.00 H ATOM 787 HB2 SER A 50 25.185 15.629 11.523 1.00 0.00 H ATOM 788 HB3 SER A 50 26.297 14.675 10.515 1.00 0.00 H ATOM 789 HG SER A 50 24.847 12.894 10.744 1.00 0.00 H ATOM 790 H SER A 50 25.102 17.259 9.550 1.00 0.00 H ATOM 791 N ARG A 51 22.097 14.758 9.197 1.00 10.72 N ATOM 792 CA ARG A 51 20.677 15.012 9.338 1.00 10.91 C ATOM 793 C ARG A 51 20.177 14.548 10.685 1.00 12.06 C ATOM 794 O ARG A 51 20.398 13.415 11.042 1.00 16.99 O ATOM 795 CB ARG A 51 19.922 14.264 8.223 1.00 14.05 C ATOM 796 CG ARG A 51 18.416 14.505 8.245 1.00 14.32 C ATOM 797 CD ARG A 51 17.791 13.695 7.148 1.00 18.25 C ATOM 798 NE ARG A 51 16.371 13.771 7.138 1.00 21.44 N ATOM 799 CZ ARG A 51 15.625 12.807 6.600 1.00 24.15 C ATOM 800 NH1 ARG A 51 16.121 11.715 6.017 1.00 28.00 N ATOM 801 NH2 ARG A 51 14.303 12.979 6.657 1.00 30.32 N ATOM 802 HA ARG A 51 20.501 16.085 9.259 1.00 0.00 H ATOM 803 HB2 ARG A 51 20.311 14.594 7.260 1.00 0.00 H ATOM 804 HB3 ARG A 51 20.103 13.195 8.339 1.00 0.00 H ATOM 805 HG2 ARG A 51 18.008 14.198 9.208 1.00 0.00 H ATOM 806 HG3 ARG A 51 18.210 15.563 8.085 1.00 0.00 H ATOM 807 HD2 ARG A 51 18.082 12.653 7.277 1.00 0.00 H ATOM 808 HD3 ARG A 51 18.165 14.059 6.191 1.00 0.00 H ATOM 809 HE ARG A 51 15.904 14.599 7.561 1.00 0.00 H ATOM 810 HH12 ARG A 51 15.479 11.002 5.617 1.00 0.00 H ATOM 811 HH11 ARG A 51 17.150 11.577 5.962 1.00 0.00 H ATOM 812 HH22 ARG A 51 13.667 12.261 6.254 1.00 0.00 H ATOM 813 HH21 ARG A 51 13.908 13.831 7.104 1.00 0.00 H ATOM 814 H ARG A 51 22.420 14.010 8.550 1.00 0.00 H ATOM 815 N GLU A 52 19.532 15.469 11.406 1.00 12.13 N ATOM 816 CA GLU A 52 18.980 15.251 12.712 1.00 14.65 C ATOM 817 C GLU A 52 17.633 15.972 12.750 1.00 13.91 C ATOM 818 O GLU A 52 17.569 17.144 13.097 1.00 13.76 O ATOM 819 CB GLU A 52 19.944 15.804 13.733 1.00 19.73 C ATOM 820 CG GLU A 52 20.996 14.698 14.027 1.00 27.10 C ATOM 821 CD GLU A 52 21.529 15.024 15.410 1.00 27.61 C ATOM 822 OE1 GLU A 52 20.981 14.740 16.483 1.00 38.54 O ATOM 823 OE2 GLU A 52 22.607 15.562 15.297 1.00 24.49 O ATOM 824 HA GLU A 52 18.828 14.195 12.935 1.00 0.00 H ATOM 825 HB2 GLU A 52 20.437 16.692 13.337 1.00 0.00 H ATOM 826 HB3 GLU A 52 19.410 16.063 14.647 1.00 0.00 H ATOM 827 HG2 GLU A 52 20.530 13.713 14.018 1.00 0.00 H ATOM 828 HG3 GLU A 52 21.799 14.726 13.290 1.00 0.00 H ATOM 829 H GLU A 52 19.422 16.415 10.989 1.00 0.00 H ATOM 830 N PRO A 53 16.539 15.362 12.245 1.00 15.52 N ATOM 831 CA PRO A 53 15.309 16.135 11.995 1.00 16.08 C ATOM 832 C PRO A 53 14.731 16.883 13.213 1.00 16.30 C ATOM 833 O PRO A 53 14.047 17.911 13.035 1.00 20.73 O ATOM 834 CB PRO A 53 14.322 15.102 11.461 1.00 20.02 C ATOM 835 CG PRO A 53 15.214 14.057 10.874 1.00 21.94 C ATOM 836 CD PRO A 53 16.385 14.000 11.784 1.00 17.19 C ATOM 837 HA PRO A 53 15.522 16.949 11.302 1.00 0.00 H ATOM 838 HD3 PRO A 53 16.194 13.327 12.620 1.00 0.00 H ATOM 839 HD2 PRO A 53 17.275 13.669 11.249 1.00 0.00 H ATOM 840 HG3 PRO A 53 15.523 14.338 9.867 1.00 0.00 H ATOM 841 HG2 PRO A 53 14.706 13.093 10.841 1.00 0.00 H ATOM 842 HB2 PRO A 53 13.712 14.690 12.265 1.00 0.00 H ATOM 843 HB3 PRO A 53 13.673 15.536 10.700 1.00 0.00 H ATOM 844 N GLN A 54 15.004 16.444 14.453 1.00 18.26 N ATOM 845 CA GLN A 54 14.472 17.232 15.572 1.00 20.67 C ATOM 846 C GLN A 54 15.402 18.308 16.118 1.00 21.28 C ATOM 847 O GLN A 54 15.158 18.994 17.135 1.00 24.82 O ATOM 848 CB GLN A 54 14.072 16.252 16.694 1.00 23.12 C ATOM 849 CG GLN A 54 13.054 15.180 16.276 1.00 25.59 C ATOM 850 CD GLN A 54 11.812 15.907 15.786 1.00 27.03 C ATOM 851 OE1 GLN A 54 11.501 16.970 16.335 1.00 30.29 O ATOM 852 NE2 GLN A 54 11.146 15.351 14.808 1.00 29.84 N ATOM 853 HA GLN A 54 13.619 17.789 15.185 1.00 0.00 H ATOM 854 HB2 GLN A 54 14.973 15.748 17.042 1.00 0.00 H ATOM 855 HB3 GLN A 54 13.641 16.829 17.512 1.00 0.00 H ATOM 856 HG2 GLN A 54 13.466 14.564 15.477 1.00 0.00 H ATOM 857 HG3 GLN A 54 12.805 14.548 17.129 1.00 0.00 H ATOM 858 HE22 GLN A 54 11.475 14.453 14.399 1.00 0.00 H ATOM 859 HE21 GLN A 54 10.287 15.807 14.439 1.00 0.00 H ATOM 860 H GLN A 54 15.567 15.584 14.613 1.00 0.00 H ATOM 861 N TYR A 55 16.529 18.467 15.464 1.00 18.09 N ATOM 862 CA TYR A 55 17.558 19.417 15.946 1.00 16.21 C ATOM 863 C TYR A 55 17.027 20.836 15.934 1.00 15.14 C ATOM 864 O TYR A 55 16.472 21.305 14.935 1.00 16.47 O ATOM 865 CB TYR A 55 18.785 19.346 15.074 1.00 14.92 C ATOM 866 CG TYR A 55 19.918 20.248 15.469 1.00 13.47 C ATOM 867 CD1 TYR A 55 20.441 20.154 16.734 1.00 13.99 C ATOM 868 CD2 TYR A 55 20.464 21.173 14.585 1.00 13.18 C ATOM 869 CE1 TYR A 55 21.491 20.984 17.097 1.00 13.44 C ATOM 870 CE2 TYR A 55 21.513 21.980 14.968 1.00 13.04 C ATOM 871 CZ TYR A 55 22.016 21.864 16.222 1.00 12.63 C ATOM 872 OH TYR A 55 23.060 22.701 16.612 1.00 14.33 O ATOM 873 HA TYR A 55 17.817 19.139 16.968 1.00 0.00 H ATOM 874 HB3 TYR A 55 18.489 19.605 14.057 1.00 0.00 H ATOM 875 HB2 TYR A 55 19.151 18.320 15.094 1.00 0.00 H ATOM 876 HD2 TYR A 55 20.057 21.260 13.578 1.00 0.00 H ATOM 877 HE2 TYR A 55 21.934 22.704 14.270 1.00 0.00 H ATOM 878 HE1 TYR A 55 21.898 20.924 18.106 1.00 0.00 H ATOM 879 HD1 TYR A 55 20.036 19.435 17.446 1.00 0.00 H ATOM 880 HH TYR A 55 23.314 22.496 17.547 1.00 0.00 H ATOM 881 H TYR A 55 16.701 17.919 14.597 1.00 0.00 H ATOM 882 N GLY A 56 17.233 21.591 17.025 1.00 16.34 N ATOM 883 CA GLY A 56 16.766 22.950 17.177 1.00 19.57 C ATOM 884 C GLY A 56 17.816 24.031 17.033 1.00 17.40 C ATOM 885 O GLY A 56 17.525 25.221 17.187 1.00 21.25 O ATOM 886 HA3 GLY A 56 16.325 23.043 18.170 1.00 0.00 H ATOM 887 HA2 GLY A 56 15.999 23.126 16.422 1.00 0.00 H ATOM 888 H GLY A 56 17.764 21.169 17.813 1.00 0.00 H ATOM 889 N GLY A 57 19.037 23.673 16.699 1.00 14.36 N ATOM 890 CA GLY A 57 20.121 24.632 16.632 1.00 14.28 C ATOM 891 C GLY A 57 20.791 24.838 17.978 1.00 12.12 C ATOM 892 O GLY A 57 20.246 24.380 19.005 1.00 13.24 O ATOM 893 HA3 GLY A 57 19.724 25.587 16.288 1.00 0.00 H ATOM 894 HA2 GLY A 57 20.865 24.272 15.921 1.00 0.00 H ATOM 895 H GLY A 57 19.229 22.675 16.477 1.00 0.00 H ATOM 896 N PRO A 58 21.920 25.515 18.010 1.00 12.23 N ATOM 897 CA PRO A 58 22.632 25.733 19.290 1.00 12.23 C ATOM 898 C PRO A 58 21.915 26.810 20.114 1.00 11.53 C ATOM 899 O PRO A 58 21.139 27.605 19.622 1.00 12.97 O ATOM 900 CB PRO A 58 24.009 26.192 18.869 1.00 13.46 C ATOM 901 CG PRO A 58 23.718 26.928 17.602 1.00 14.66 C ATOM 902 CD PRO A 58 22.675 26.111 16.863 1.00 14.18 C ATOM 903 HA PRO A 58 22.670 24.843 19.918 1.00 0.00 H ATOM 904 HD3 PRO A 58 22.035 26.741 16.245 1.00 0.00 H ATOM 905 HD2 PRO A 58 23.134 25.342 16.242 1.00 0.00 H ATOM 906 HG3 PRO A 58 24.623 27.017 17.001 1.00 0.00 H ATOM 907 HG2 PRO A 58 23.331 27.923 17.824 1.00 0.00 H ATOM 908 HB2 PRO A 58 24.453 26.850 19.616 1.00 0.00 H ATOM 909 HB3 PRO A 58 24.672 25.345 18.692 1.00 0.00 H ATOM 910 N ALA A 59 22.224 26.788 21.404 1.00 13.42 N ATOM 911 CA ALA A 59 21.828 27.867 22.267 1.00 13.26 C ATOM 912 C ALA A 59 22.737 29.066 22.069 1.00 11.26 C ATOM 913 O ALA A 59 23.715 29.008 21.243 1.00 11.46 O ATOM 914 CB ALA A 59 21.812 27.396 23.711 1.00 17.54 C ATOM 915 HA ALA A 59 20.817 28.184 22.010 1.00 0.00 H ATOM 916 HB1 ALA A 59 21.105 26.573 23.816 1.00 0.00 H ATOM 917 HB2 ALA A 59 22.809 27.057 23.992 1.00 0.00 H ATOM 918 HB3 ALA A 59 21.511 28.220 24.357 1.00 0.00 H ATOM 919 H ALA A 59 22.757 25.984 21.794 1.00 0.00 H ATOM 920 N ALA A 60 22.480 30.170 22.715 1.00 13.40 N ATOM 921 CA ALA A 60 23.161 31.412 22.481 1.00 12.75 C ATOM 922 C ALA A 60 24.481 31.435 23.270 1.00 12.41 C ATOM 923 O ALA A 60 24.486 31.438 24.516 1.00 16.45 O ATOM 924 CB ALA A 60 22.296 32.614 22.829 1.00 17.12 C ATOM 925 HA ALA A 60 23.379 31.483 21.415 1.00 0.00 H ATOM 926 HB1 ALA A 60 21.394 32.600 22.217 1.00 0.00 H ATOM 927 HB2 ALA A 60 22.022 32.570 23.883 1.00 0.00 H ATOM 928 HB3 ALA A 60 22.854 33.530 22.635 1.00 0.00 H ATOM 929 H ALA A 60 21.737 30.149 23.443 1.00 0.00 H ATOM 930 N ASP A 61 25.583 31.379 22.588 1.00 12.21 N ATOM 931 CA ASP A 61 26.926 31.470 23.132 1.00 11.71 C ATOM 932 C ASP A 61 27.841 31.875 21.973 1.00 10.80 C ATOM 933 O ASP A 61 27.357 32.141 20.866 1.00 11.70 O ATOM 934 CB ASP A 61 27.390 30.178 23.776 1.00 12.67 C ATOM 935 CG ASP A 61 27.349 29.038 22.848 1.00 12.37 C ATOM 936 OD1 ASP A 61 28.179 28.964 21.911 1.00 12.75 O ATOM 937 OD2 ASP A 61 26.429 28.186 22.985 1.00 14.96 O ATOM 938 HA ASP A 61 26.950 32.208 23.934 1.00 0.00 H ATOM 939 HB2 ASP A 61 28.415 30.309 24.124 1.00 0.00 H ATOM 940 HB3 ASP A 61 26.744 29.960 24.627 1.00 0.00 H ATOM 941 H ASP A 61 25.497 31.258 21.559 1.00 0.00 H ATOM 942 N TYR A 62 29.132 32.034 22.215 1.00 11.00 N ATOM 943 CA TYR A 62 30.026 32.616 21.200 1.00 10.84 C ATOM 944 C TYR A 62 30.607 31.539 20.281 1.00 9.62 C ATOM 945 O TYR A 62 31.440 31.874 19.440 1.00 11.24 O ATOM 946 CB TYR A 62 31.109 33.484 21.821 1.00 12.43 C ATOM 947 CG TYR A 62 31.638 34.558 20.853 1.00 12.08 C ATOM 948 CD1 TYR A 62 30.759 35.479 20.313 1.00 13.42 C ATOM 949 CD2 TYR A 62 32.964 34.655 20.517 1.00 12.36 C ATOM 950 CE1 TYR A 62 31.199 36.489 19.445 1.00 14.06 C ATOM 951 CE2 TYR A 62 33.406 35.643 19.648 1.00 13.04 C ATOM 952 CZ TYR A 62 32.523 36.548 19.096 1.00 13.12 C ATOM 953 OH TYR A 62 32.903 37.554 18.208 1.00 14.89 O ATOM 954 HA TYR A 62 29.420 33.276 20.579 1.00 0.00 H ATOM 955 HB3 TYR A 62 31.939 32.845 22.121 1.00 0.00 H ATOM 956 HB2 TYR A 62 30.698 33.979 22.701 1.00 0.00 H ATOM 957 HD2 TYR A 62 33.679 33.948 20.937 1.00 0.00 H ATOM 958 HE2 TYR A 62 34.465 35.705 19.398 1.00 0.00 H ATOM 959 HE1 TYR A 62 30.494 37.221 19.051 1.00 0.00 H ATOM 960 HD1 TYR A 62 29.701 35.419 20.568 1.00 0.00 H ATOM 961 HH TYR A 62 33.561 38.149 18.647 1.00 0.00 H ATOM 962 H TYR A 62 29.521 31.744 23.135 1.00 0.00 H ATOM 963 N THR A 63 30.237 30.262 20.427 1.00 8.84 N ATOM 964 CA THR A 63 30.831 29.241 19.521 1.00 8.44 C ATOM 965 C THR A 63 30.439 29.565 18.084 1.00 8.11 C ATOM 966 O THR A 63 29.267 29.753 17.787 1.00 9.06 O ATOM 967 CB THR A 63 30.286 27.857 19.885 1.00 8.60 C ATOM 968 OG1 THR A 63 30.639 27.582 21.273 1.00 9.23 O ATOM 969 CG2 THR A 63 30.861 26.771 19.022 1.00 9.61 C ATOM 970 HA THR A 63 31.916 29.247 19.624 1.00 0.00 H ATOM 971 HB THR A 63 29.207 27.866 19.732 1.00 0.00 H ATOM 972 HG1 THR A 63 30.237 28.272 21.858 1.00 0.00 H ATOM 973 HG23 THR A 63 30.605 26.963 17.980 1.00 0.00 H ATOM 974 HG21 THR A 63 31.945 26.755 19.134 1.00 0.00 H ATOM 975 HG22 THR A 63 30.449 25.809 19.327 1.00 0.00 H ATOM 976 H THR A 63 29.549 29.988 21.158 1.00 0.00 H ATOM 977 N HIS A 64 31.426 29.573 17.187 1.00 8.13 N ATOM 978 CA HIS A 64 31.142 29.911 15.781 1.00 8.15 C ATOM 979 C HIS A 64 32.264 29.423 14.904 1.00 7.84 C ATOM 980 O HIS A 64 33.377 29.105 15.345 1.00 8.52 O ATOM 981 CB HIS A 64 30.859 31.404 15.588 1.00 8.64 C ATOM 982 CG HIS A 64 32.015 32.301 15.770 1.00 8.50 C ATOM 983 ND1 HIS A 64 32.382 32.800 16.996 1.00 8.63 N ATOM 984 CD2 HIS A 64 32.899 32.883 14.895 1.00 9.13 C ATOM 985 CE1 HIS A 64 33.428 33.609 16.823 1.00 8.77 C ATOM 986 NE2 HIS A 64 33.787 33.687 15.560 1.00 8.78 N ATOM 987 HA HIS A 64 30.227 29.399 15.483 1.00 0.00 H ATOM 988 HB2 HIS A 64 30.481 31.546 14.576 1.00 0.00 H ATOM 989 HB3 HIS A 64 30.092 31.696 16.305 1.00 0.00 H ATOM 990 HD2 HIS A 64 32.895 32.726 13.816 1.00 0.00 H ATOM 991 HE1 HIS A 64 33.926 34.142 17.632 1.00 0.00 H ATOM 992 H HIS A 64 32.396 29.341 17.480 1.00 0.00 H ATOM 993 N TYR A 65 31.953 29.426 13.589 1.00 7.99 N ATOM 994 CA TYR A 65 32.820 28.871 12.564 1.00 8.19 C ATOM 995 C TYR A 65 33.097 29.934 11.536 1.00 8.35 C ATOM 996 O TYR A 65 32.150 30.442 10.914 1.00 9.21 O ATOM 997 CB TYR A 65 32.196 27.596 11.886 1.00 9.01 C ATOM 998 CG TYR A 65 31.512 26.746 12.932 1.00 8.54 C ATOM 999 CD1 TYR A 65 30.137 26.494 12.920 1.00 9.24 C ATOM 1000 CD2 TYR A 65 32.249 26.216 14.009 1.00 9.68 C ATOM 1001 CE1 TYR A 65 29.535 25.749 13.893 1.00 10.02 C ATOM 1002 CE2 TYR A 65 31.644 25.504 14.987 1.00 9.99 C ATOM 1003 CZ TYR A 65 30.287 25.263 14.945 1.00 8.99 C ATOM 1004 OH TYR A 65 29.673 24.525 15.935 1.00 10.21 O ATOM 1005 HA TYR A 65 33.750 28.551 13.034 1.00 0.00 H ATOM 1006 HB3 TYR A 65 32.986 27.017 11.407 1.00 0.00 H ATOM 1007 HB2 TYR A 65 31.468 27.904 11.136 1.00 0.00 H ATOM 1008 HD2 TYR A 65 33.325 26.382 14.055 1.00 0.00 H ATOM 1009 HE2 TYR A 65 32.235 25.117 15.817 1.00 0.00 H ATOM 1010 HE1 TYR A 65 28.467 25.539 13.840 1.00 0.00 H ATOM 1011 HD1 TYR A 65 29.530 26.903 12.113 1.00 0.00 H ATOM 1012 HH TYR A 65 28.705 24.455 15.741 1.00 0.00 H ATOM 1013 H TYR A 65 31.048 29.847 13.296 1.00 0.00 H ATOM 1014 N ALA A 66 34.356 30.307 11.347 1.00 8.57 N ATOM 1015 CA ALA A 66 34.708 31.388 10.425 1.00 8.32 C ATOM 1016 C ALA A 66 35.378 30.827 9.182 1.00 8.78 C ATOM 1017 O ALA A 66 36.297 30.032 9.276 1.00 9.56 O ATOM 1018 CB ALA A 66 35.639 32.361 11.092 1.00 8.89 C ATOM 1019 HA ALA A 66 33.791 31.903 10.139 1.00 0.00 H ATOM 1020 HB1 ALA A 66 35.151 32.786 11.969 1.00 0.00 H ATOM 1021 HB2 ALA A 66 36.548 31.842 11.396 1.00 0.00 H ATOM 1022 HB3 ALA A 66 35.891 33.158 10.393 1.00 0.00 H ATOM 1023 H ALA A 66 35.113 29.819 11.867 1.00 0.00 H ATOM 1024 N PHE A 67 34.904 31.296 8.019 1.00 8.71 N ATOM 1025 CA PHE A 67 35.466 31.000 6.722 1.00 8.90 C ATOM 1026 C PHE A 67 36.232 32.201 6.242 1.00 9.36 C ATOM 1027 O PHE A 67 35.883 33.353 6.500 1.00 10.41 O ATOM 1028 CB PHE A 67 34.357 30.680 5.724 1.00 9.68 C ATOM 1029 CG PHE A 67 33.409 29.615 6.213 1.00 10.02 C ATOM 1030 CD1 PHE A 67 32.060 29.912 6.460 1.00 13.21 C ATOM 1031 CD2 PHE A 67 33.828 28.348 6.455 1.00 11.64 C ATOM 1032 CE1 PHE A 67 31.197 28.957 6.953 1.00 13.59 C ATOM 1033 CE2 PHE A 67 32.963 27.380 6.960 1.00 13.27 C ATOM 1034 CZ PHE A 67 31.639 27.679 7.213 1.00 12.51 C ATOM 1035 HA PHE A 67 36.126 30.136 6.804 1.00 0.00 H ATOM 1036 HB2 PHE A 67 33.788 31.590 5.534 1.00 0.00 H ATOM 1037 HB3 PHE A 67 34.814 30.338 4.795 1.00 0.00 H ATOM 1038 HD2 PHE A 67 34.865 28.081 6.250 1.00 0.00 H ATOM 1039 HE2 PHE A 67 33.336 26.375 7.158 1.00 0.00 H ATOM 1040 HZ PHE A 67 30.961 26.923 7.608 1.00 0.00 H ATOM 1041 HE1 PHE A 67 30.155 29.216 7.139 1.00 0.00 H ATOM 1042 HD1 PHE A 67 31.688 30.916 6.258 1.00 0.00 H ATOM 1043 H PHE A 67 34.071 31.918 8.053 1.00 0.00 H ATOM 1044 N GLY A 68 37.336 31.952 5.507 1.00 8.94 N ATOM 1045 CA GLY A 68 38.099 33.047 4.990 1.00 9.87 C ATOM 1046 C GLY A 68 37.512 33.632 3.718 1.00 9.60 C ATOM 1047 O GLY A 68 36.810 32.980 2.961 1.00 10.13 O ATOM 1048 HA3 GLY A 68 39.109 32.697 4.778 1.00 0.00 H ATOM 1049 HA2 GLY A 68 38.139 33.831 5.747 1.00 0.00 H ATOM 1050 H GLY A 68 37.630 30.973 5.318 1.00 0.00 H ATOM 1051 N ILE A 69 37.847 34.896 3.475 1.00 9.66 N ATOM 1052 CA ILE A 69 37.468 35.601 2.274 1.00 9.73 C ATOM 1053 C ILE A 69 38.490 36.693 2.039 1.00 10.06 C ATOM 1054 O ILE A 69 39.026 37.276 2.975 1.00 10.38 O ATOM 1055 CB ILE A 69 36.028 36.179 2.396 1.00 9.73 C ATOM 1056 CG1 ILE A 69 35.529 36.705 1.060 1.00 11.37 C ATOM 1057 CG2 ILE A 69 35.910 37.221 3.483 1.00 11.17 C ATOM 1058 CD1 ILE A 69 34.042 36.995 0.990 1.00 11.83 C ATOM 1059 HA ILE A 69 37.454 34.920 1.423 1.00 0.00 H ATOM 1060 HB ILE A 69 35.382 35.352 2.692 1.00 0.00 H ATOM 1061 HG12 ILE A 69 36.063 37.630 0.842 1.00 0.00 H ATOM 1062 HG13 ILE A 69 35.764 35.963 0.297 1.00 0.00 H ATOM 1063 HD11 ILE A 69 33.485 36.080 1.190 1.00 0.00 H ATOM 1064 HD12 ILE A 69 33.785 37.748 1.735 1.00 0.00 H ATOM 1065 HD13 ILE A 69 33.792 37.365 -0.004 1.00 0.00 H ATOM 1066 HG21 ILE A 69 36.175 36.775 4.442 1.00 0.00 H ATOM 1067 HG22 ILE A 69 36.586 38.048 3.266 1.00 0.00 H ATOM 1068 HG23 ILE A 69 34.885 37.589 3.522 1.00 0.00 H ATOM 1069 H ILE A 69 38.411 35.402 4.187 1.00 0.00 H ATOM 1070 N ALA A 70 38.771 36.971 0.761 1.00 11.20 N ATOM 1071 CA ALA A 70 39.667 38.062 0.425 1.00 11.53 C ATOM 1072 C ALA A 70 39.008 39.423 0.600 1.00 10.65 C ATOM 1073 O ALA A 70 37.814 39.564 0.390 1.00 11.00 O ATOM 1074 CB ALA A 70 40.133 37.860 -1.028 1.00 13.38 C ATOM 1075 HA ALA A 70 40.518 38.049 1.105 1.00 0.00 H ATOM 1076 HB1 ALA A 70 40.652 36.905 -1.112 1.00 0.00 H ATOM 1077 HB2 ALA A 70 39.267 37.864 -1.690 1.00 0.00 H ATOM 1078 HB3 ALA A 70 40.809 38.668 -1.307 1.00 0.00 H ATOM 1079 H ALA A 70 38.344 36.401 0.003 1.00 0.00 H ATOM 1080 N ALA A 71 39.807 40.407 0.919 1.00 11.58 N ATOM 1081 CA ALA A 71 39.354 41.763 1.079 1.00 12.28 C ATOM 1082 C ALA A 71 38.456 42.211 -0.066 1.00 11.49 C ATOM 1083 O ALA A 71 37.394 42.783 0.136 1.00 12.84 O ATOM 1084 CB ALA A 71 40.537 42.718 1.270 1.00 13.27 C ATOM 1085 HA ALA A 71 38.746 41.794 1.983 1.00 0.00 H ATOM 1086 HB1 ALA A 71 41.096 42.428 2.160 1.00 0.00 H ATOM 1087 HB2 ALA A 71 41.188 42.667 0.397 1.00 0.00 H ATOM 1088 HB3 ALA A 71 40.165 43.736 1.388 1.00 0.00 H ATOM 1089 H ALA A 71 40.816 40.200 1.064 1.00 0.00 H ATOM 1090 N ALA A 72 38.898 41.956 -1.309 1.00 11.29 N ATOM 1091 CA ALA A 72 38.163 42.505 -2.429 1.00 11.83 C ATOM 1092 C ALA A 72 36.830 41.857 -2.671 1.00 11.56 C ATOM 1093 O ALA A 72 35.999 42.415 -3.401 1.00 12.85 O ATOM 1094 CB ALA A 72 39.051 42.377 -3.707 1.00 13.61 C ATOM 1095 HA ALA A 72 37.943 43.545 -2.189 1.00 0.00 H ATOM 1096 HB1 ALA A 72 39.979 42.930 -3.560 1.00 0.00 H ATOM 1097 HB2 ALA A 72 39.278 41.326 -3.887 1.00 0.00 H ATOM 1098 HB3 ALA A 72 38.514 42.786 -4.563 1.00 0.00 H ATOM 1099 H ALA A 72 39.748 41.378 -1.463 1.00 0.00 H ATOM 1100 N ASP A 73 36.629 40.653 -2.110 1.00 10.93 N ATOM 1101 CA ASP A 73 35.361 39.950 -2.269 1.00 11.46 C ATOM 1102 C ASP A 73 34.376 40.230 -1.115 1.00 11.03 C ATOM 1103 O ASP A 73 33.203 39.853 -1.196 1.00 11.45 O ATOM 1104 CB ASP A 73 35.617 38.439 -2.334 1.00 11.50 C ATOM 1105 CG ASP A 73 36.263 37.992 -3.652 1.00 12.07 C ATOM 1106 OD1 ASP A 73 35.839 38.457 -4.726 1.00 13.89 O ATOM 1107 OD2 ASP A 73 37.145 37.111 -3.597 1.00 13.86 O ATOM 1108 HA ASP A 73 34.910 40.314 -3.192 1.00 0.00 H ATOM 1109 HB2 ASP A 73 36.279 38.164 -1.513 1.00 0.00 H ATOM 1110 HB3 ASP A 73 34.665 37.921 -2.221 1.00 0.00 H ATOM 1111 H ASP A 73 37.390 40.215 -1.553 1.00 0.00 H ATOM 1112 N PHE A 74 34.859 40.834 -0.016 1.00 10.94 N ATOM 1113 CA PHE A 74 34.041 40.906 1.196 1.00 10.53 C ATOM 1114 C PHE A 74 32.747 41.671 1.009 1.00 10.88 C ATOM 1115 O PHE A 74 31.674 41.197 1.410 1.00 11.57 O ATOM 1116 CB PHE A 74 34.920 41.554 2.294 1.00 10.96 C ATOM 1117 CG PHE A 74 34.120 41.665 3.583 1.00 10.33 C ATOM 1118 CD1 PHE A 74 34.030 40.591 4.439 1.00 9.98 C ATOM 1119 CD2 PHE A 74 33.490 42.862 3.932 1.00 10.91 C ATOM 1120 CE1 PHE A 74 33.278 40.669 5.587 1.00 10.46 C ATOM 1121 CE2 PHE A 74 32.700 42.930 5.068 1.00 12.15 C ATOM 1122 CZ PHE A 74 32.635 41.821 5.893 1.00 11.72 C ATOM 1123 HA PHE A 74 33.728 39.900 1.475 1.00 0.00 H ATOM 1124 HB2 PHE A 74 35.802 40.937 2.465 1.00 0.00 H ATOM 1125 HB3 PHE A 74 35.231 42.548 1.972 1.00 0.00 H ATOM 1126 HD2 PHE A 74 33.621 43.746 3.308 1.00 0.00 H ATOM 1127 HE2 PHE A 74 32.143 43.836 5.306 1.00 0.00 H ATOM 1128 HZ PHE A 74 32.052 41.876 6.812 1.00 0.00 H ATOM 1129 HE1 PHE A 74 33.199 39.807 6.249 1.00 0.00 H ATOM 1130 HD1 PHE A 74 34.561 39.668 4.204 1.00 0.00 H ATOM 1131 H PHE A 74 35.812 41.250 -0.026 1.00 0.00 H ATOM 1132 N ALA A 75 32.824 42.896 0.471 1.00 11.70 N ATOM 1133 CA ALA A 75 31.608 43.701 0.379 1.00 12.84 C ATOM 1134 C ALA A 75 30.556 43.007 -0.451 1.00 12.46 C ATOM 1135 O ALA A 75 29.362 43.015 -0.111 1.00 12.89 O ATOM 1136 CB ALA A 75 31.889 45.115 -0.155 1.00 15.22 C ATOM 1137 HA ALA A 75 31.222 43.812 1.392 1.00 0.00 H ATOM 1138 HB1 ALA A 75 32.583 45.623 0.514 1.00 0.00 H ATOM 1139 HB2 ALA A 75 32.327 45.046 -1.151 1.00 0.00 H ATOM 1140 HB3 ALA A 75 30.955 45.675 -0.206 1.00 0.00 H ATOM 1141 H ALA A 75 33.732 43.267 0.125 1.00 0.00 H ATOM 1142 N ARG A 76 30.937 42.405 -1.566 1.00 12.08 N ATOM 1143 CA ARG A 76 29.985 41.729 -2.400 1.00 12.63 C ATOM 1144 C ARG A 76 29.326 40.556 -1.681 1.00 12.31 C ATOM 1145 O ARG A 76 28.124 40.322 -1.816 1.00 12.61 O ATOM 1146 CB ARG A 76 30.640 41.211 -3.686 1.00 14.05 C ATOM 1147 CG ARG A 76 30.445 42.071 -4.897 1.00 19.70 C ATOM 1148 CD ARG A 76 31.085 41.378 -6.098 1.00 22.73 C ATOM 1149 NE ARG A 76 30.815 42.017 -7.349 1.00 23.82 N ATOM 1150 CZ ARG A 76 29.837 41.687 -8.207 1.00 22.24 C ATOM 1151 NH1 ARG A 76 28.950 40.738 -7.988 1.00 29.30 N ATOM 1152 NH2 ARG A 76 29.742 42.366 -9.320 1.00 23.62 N ATOM 1153 HA ARG A 76 29.221 42.466 -2.648 1.00 0.00 H ATOM 1154 HB2 ARG A 76 31.711 41.121 -3.506 1.00 0.00 H ATOM 1155 HB3 ARG A 76 30.225 40.226 -3.902 1.00 0.00 H ATOM 1156 HG2 ARG A 76 29.380 42.212 -5.079 1.00 0.00 H ATOM 1157 HG3 ARG A 76 30.917 43.041 -4.738 1.00 0.00 H ATOM 1158 HD2 ARG A 76 30.708 40.356 -6.146 1.00 0.00 H ATOM 1159 HD3 ARG A 76 32.164 41.359 -5.948 1.00 0.00 H ATOM 1160 HE ARG A 76 31.433 42.809 -7.618 1.00 0.00 H ATOM 1161 HH12 ARG A 76 28.218 40.536 -8.699 1.00 0.00 H ATOM 1162 HH11 ARG A 76 28.981 40.191 -7.104 1.00 0.00 H ATOM 1163 HH22 ARG A 76 28.996 42.137 -10.007 1.00 0.00 H ATOM 1164 HH21 ARG A 76 30.413 43.136 -9.518 1.00 0.00 H ATOM 1165 H ARG A 76 31.940 42.422 -1.842 1.00 0.00 H ATOM 1166 N PHE A 77 30.131 39.784 -0.907 1.00 11.66 N ATOM 1167 CA PHE A 77 29.564 38.645 -0.161 1.00 11.54 C ATOM 1168 C PHE A 77 28.536 39.108 0.865 1.00 11.55 C ATOM 1169 O PHE A 77 27.450 38.556 0.958 1.00 11.91 O ATOM 1170 CB PHE A 77 30.714 37.898 0.513 1.00 12.40 C ATOM 1171 CG PHE A 77 30.237 36.671 1.279 1.00 12.02 C ATOM 1172 CD1 PHE A 77 30.050 35.471 0.598 1.00 13.24 C ATOM 1173 CD2 PHE A 77 29.996 36.696 2.632 1.00 12.39 C ATOM 1174 CE1 PHE A 77 29.648 34.310 1.272 1.00 13.32 C ATOM 1175 CE2 PHE A 77 29.598 35.543 3.292 1.00 12.69 C ATOM 1176 CZ PHE A 77 29.447 34.391 2.628 1.00 13.10 C ATOM 1177 HA PHE A 77 29.041 37.981 -0.849 1.00 0.00 H ATOM 1178 HB2 PHE A 77 31.422 37.580 -0.252 1.00 0.00 H ATOM 1179 HB3 PHE A 77 31.212 38.574 1.208 1.00 0.00 H ATOM 1180 HD2 PHE A 77 30.118 37.625 3.188 1.00 0.00 H ATOM 1181 HE2 PHE A 77 29.406 35.576 4.364 1.00 0.00 H ATOM 1182 HZ PHE A 77 29.157 33.495 3.177 1.00 0.00 H ATOM 1183 HE1 PHE A 77 29.500 33.372 0.737 1.00 0.00 H ATOM 1184 HD1 PHE A 77 30.219 35.434 -0.478 1.00 0.00 H ATOM 1185 H PHE A 77 31.147 39.996 -0.840 1.00 0.00 H ATOM 1186 N ALA A 78 28.903 40.106 1.674 1.00 11.09 N ATOM 1187 CA ALA A 78 27.993 40.607 2.686 1.00 11.55 C ATOM 1188 C ALA A 78 26.710 41.100 2.011 1.00 11.69 C ATOM 1189 O ALA A 78 25.604 40.827 2.497 1.00 12.09 O ATOM 1190 CB ALA A 78 28.669 41.726 3.477 1.00 11.60 C ATOM 1191 HA ALA A 78 27.732 39.811 3.383 1.00 0.00 H ATOM 1192 HB1 ALA A 78 29.567 41.338 3.958 1.00 0.00 H ATOM 1193 HB2 ALA A 78 28.939 42.536 2.800 1.00 0.00 H ATOM 1194 HB3 ALA A 78 27.981 42.099 4.236 1.00 0.00 H ATOM 1195 H ALA A 78 29.849 40.527 1.577 1.00 0.00 H ATOM 1196 N ALA A 79 26.846 41.891 0.949 1.00 12.13 N ATOM 1197 CA ALA A 79 25.681 42.413 0.273 1.00 12.99 C ATOM 1198 C ALA A 79 24.821 41.278 -0.303 1.00 13.11 C ATOM 1199 O ALA A 79 23.571 41.358 -0.247 1.00 13.87 O ATOM 1200 CB ALA A 79 26.039 43.391 -0.843 1.00 14.90 C ATOM 1201 HA ALA A 79 25.112 42.956 1.027 1.00 0.00 H ATOM 1202 HB1 ALA A 79 26.589 44.233 -0.424 1.00 0.00 H ATOM 1203 HB2 ALA A 79 26.658 42.884 -1.584 1.00 0.00 H ATOM 1204 HB3 ALA A 79 25.125 43.751 -1.316 1.00 0.00 H ATOM 1205 H ALA A 79 27.796 42.135 0.604 1.00 0.00 H ATOM 1206 N GLN A 80 25.434 40.268 -0.890 1.00 13.05 N ATOM 1207 CA GLN A 80 24.686 39.171 -1.450 1.00 13.62 C ATOM 1208 C GLN A 80 23.892 38.433 -0.381 1.00 12.85 C ATOM 1209 O GLN A 80 22.702 38.096 -0.539 1.00 14.03 O ATOM 1210 CB GLN A 80 25.660 38.183 -2.111 1.00 15.60 C ATOM 1211 CG GLN A 80 25.040 36.931 -2.681 1.00 16.65 C ATOM 1212 CD GLN A 80 26.033 35.894 -3.134 1.00 17.14 C ATOM 1213 OE1 GLN A 80 27.218 35.954 -2.789 1.00 19.57 O ATOM 1214 NE2 GLN A 80 25.530 34.910 -3.848 1.00 30.81 N ATOM 1215 HA GLN A 80 23.987 39.577 -2.181 1.00 0.00 H ATOM 1216 HB2 GLN A 80 26.167 38.705 -2.923 1.00 0.00 H ATOM 1217 HB3 GLN A 80 26.392 37.883 -1.361 1.00 0.00 H ATOM 1218 HG2 GLN A 80 24.407 36.485 -1.914 1.00 0.00 H ATOM 1219 HG3 GLN A 80 24.427 37.213 -3.537 1.00 0.00 H ATOM 1220 HE22 GLN A 80 24.523 34.917 -4.107 1.00 0.00 H ATOM 1221 HE21 GLN A 80 26.140 34.125 -4.154 1.00 0.00 H ATOM 1222 H GLN A 80 26.472 40.263 -0.949 1.00 0.00 H ATOM 1223 N LEU A 81 24.512 38.112 0.749 1.00 12.32 N ATOM 1224 CA LEU A 81 23.768 37.371 1.770 1.00 12.25 C ATOM 1225 C LEU A 81 22.695 38.250 2.405 1.00 12.47 C ATOM 1226 O LEU A 81 21.608 37.721 2.692 1.00 13.14 O ATOM 1227 CB LEU A 81 24.725 36.755 2.787 1.00 11.91 C ATOM 1228 CG LEU A 81 25.208 35.354 2.393 1.00 13.35 C ATOM 1229 CD1 LEU A 81 26.058 35.345 1.152 1.00 13.83 C ATOM 1230 CD2 LEU A 81 25.937 34.700 3.546 1.00 14.76 C ATOM 1231 HA LEU A 81 23.240 36.542 1.299 1.00 0.00 H ATOM 1232 HB2 LEU A 81 25.594 37.406 2.884 1.00 0.00 H ATOM 1233 HB3 LEU A 81 24.214 36.688 3.747 1.00 0.00 H ATOM 1234 HG LEU A 81 24.316 34.774 2.156 1.00 0.00 H ATOM 1235 HD21 LEU A 81 26.799 35.308 3.821 1.00 0.00 H ATOM 1236 HD22 LEU A 81 25.264 34.616 4.399 1.00 0.00 H ATOM 1237 HD23 LEU A 81 26.272 33.707 3.246 1.00 0.00 H ATOM 1238 HD11 LEU A 81 25.482 35.742 0.316 1.00 0.00 H ATOM 1239 HD12 LEU A 81 26.941 35.964 1.313 1.00 0.00 H ATOM 1240 HD13 LEU A 81 26.365 34.323 0.931 1.00 0.00 H ATOM 1241 H LEU A 81 25.504 38.381 0.905 1.00 0.00 H ATOM 1242 N ARG A 82 22.991 39.528 2.606 1.00 12.11 N ATOM 1243 CA ARG A 82 21.942 40.431 3.101 1.00 12.99 C ATOM 1244 C ARG A 82 20.738 40.446 2.168 1.00 13.33 C ATOM 1245 O ARG A 82 19.590 40.377 2.584 1.00 14.83 O ATOM 1246 CB ARG A 82 22.529 41.812 3.340 1.00 12.87 C ATOM 1247 CG ARG A 82 23.399 41.862 4.601 1.00 12.54 C ATOM 1248 CD ARG A 82 24.185 43.179 4.705 1.00 12.48 C ATOM 1249 NE ARG A 82 24.864 43.274 5.989 1.00 11.83 N ATOM 1250 CZ ARG A 82 25.981 43.893 6.258 1.00 11.93 C ATOM 1251 NH1 ARG A 82 26.615 44.594 5.326 1.00 13.85 N ATOM 1252 NH2 ARG A 82 26.479 43.809 7.459 1.00 12.42 N ATOM 1253 HA ARG A 82 21.568 40.064 4.057 1.00 0.00 H ATOM 1254 HB2 ARG A 82 23.140 42.087 2.481 1.00 0.00 H ATOM 1255 HB3 ARG A 82 21.713 42.527 3.448 1.00 0.00 H ATOM 1256 HG2 ARG A 82 22.757 41.765 5.476 1.00 0.00 H ATOM 1257 HG3 ARG A 82 24.105 41.032 4.576 1.00 0.00 H ATOM 1258 HD2 ARG A 82 23.495 44.017 4.602 1.00 0.00 H ATOM 1259 HD3 ARG A 82 24.925 43.219 3.905 1.00 0.00 H ATOM 1260 HE ARG A 82 24.404 42.791 6.787 1.00 0.00 H ATOM 1261 HH12 ARG A 82 27.504 45.081 5.557 1.00 0.00 H ATOM 1262 HH11 ARG A 82 26.222 44.656 4.365 1.00 0.00 H ATOM 1263 HH22 ARG A 82 27.368 44.297 7.688 1.00 0.00 H ATOM 1264 HH21 ARG A 82 25.987 43.254 8.188 1.00 0.00 H ATOM 1265 H ARG A 82 23.949 39.885 2.416 1.00 0.00 H ATOM 1266 N ALA A 83 21.003 40.504 0.849 1.00 14.15 N ATOM 1267 CA ALA A 83 19.913 40.588 -0.128 1.00 16.59 C ATOM 1268 C ALA A 83 19.121 39.305 -0.182 1.00 16.46 C ATOM 1269 O ALA A 83 17.924 39.278 -0.507 1.00 20.54 O ATOM 1270 CB ALA A 83 20.538 40.948 -1.479 1.00 17.96 C ATOM 1271 HA ALA A 83 19.196 41.357 0.160 1.00 0.00 H ATOM 1272 HB1 ALA A 83 21.053 41.905 -1.396 1.00 0.00 H ATOM 1273 HB2 ALA A 83 21.251 40.175 -1.766 1.00 0.00 H ATOM 1274 HB3 ALA A 83 19.754 41.019 -2.233 1.00 0.00 H ATOM 1275 H ALA A 83 21.990 40.489 0.520 1.00 0.00 H ATOM 1276 N HIS A 84 19.724 38.184 0.166 1.00 16.13 N ATOM 1277 CA HIS A 84 19.087 36.898 0.294 1.00 16.96 C ATOM 1278 C HIS A 84 18.326 36.696 1.584 1.00 17.18 C ATOM 1279 O HIS A 84 17.624 35.686 1.761 1.00 25.76 O ATOM 1280 CB HIS A 84 20.146 35.775 0.112 1.00 19.13 C ATOM 1281 CG HIS A 84 20.289 35.388 -1.313 1.00 26.35 C ATOM 1282 ND1 HIS A 84 21.145 36.026 -2.169 1.00 31.36 N ATOM 1283 CD2 HIS A 84 19.637 34.466 -2.067 1.00 28.39 C ATOM 1284 CE1 HIS A 84 21.076 35.507 -3.392 1.00 32.14 C ATOM 1285 NE2 HIS A 84 20.148 34.547 -3.320 1.00 31.19 N ATOM 1286 HA HIS A 84 18.334 36.854 -0.493 1.00 0.00 H ATOM 1287 HB2 HIS A 84 21.108 36.132 0.481 1.00 0.00 H ATOM 1288 HB3 HIS A 84 19.839 34.902 0.687 1.00 0.00 H ATOM 1289 HD2 HIS A 84 18.852 33.789 -1.729 1.00 0.00 H ATOM 1290 HE1 HIS A 84 21.654 35.802 -4.268 1.00 0.00 H ATOM 1291 H HIS A 84 20.744 38.233 0.364 1.00 0.00 H ATOM 1292 N GLY A 85 18.379 37.632 2.493 1.00 14.61 N ATOM 1293 CA GLY A 85 17.589 37.500 3.711 1.00 14.69 C ATOM 1294 C GLY A 85 18.304 36.804 4.850 1.00 13.27 C ATOM 1295 O GLY A 85 17.665 36.447 5.805 1.00 15.57 O ATOM 1296 HA3 GLY A 85 16.690 36.931 3.474 1.00 0.00 H ATOM 1297 HA2 GLY A 85 17.308 38.499 4.045 1.00 0.00 H ATOM 1298 H GLY A 85 18.982 38.467 2.349 1.00 0.00 H ATOM 1299 N VAL A 86 19.603 36.588 4.788 1.00 12.30 N ATOM 1300 CA VAL A 86 20.360 35.919 5.832 1.00 12.35 C ATOM 1301 C VAL A 86 20.420 36.846 7.026 1.00 11.92 C ATOM 1302 O VAL A 86 20.617 38.027 6.910 1.00 14.41 O ATOM 1303 CB VAL A 86 21.744 35.541 5.311 1.00 13.48 C ATOM 1304 CG1 VAL A 86 22.499 34.849 6.406 1.00 16.54 C ATOM 1305 CG2 VAL A 86 21.666 34.600 4.140 1.00 14.74 C ATOM 1306 HA VAL A 86 19.881 34.989 6.137 1.00 0.00 H ATOM 1307 HB VAL A 86 22.241 36.457 4.991 1.00 0.00 H ATOM 1308 HG11 VAL A 86 22.595 35.520 7.260 1.00 0.00 H ATOM 1309 HG12 VAL A 86 21.959 33.951 6.707 1.00 0.00 H ATOM 1310 HG13 VAL A 86 23.490 34.574 6.045 1.00 0.00 H ATOM 1311 HG21 VAL A 86 21.154 33.687 4.443 1.00 0.00 H ATOM 1312 HG22 VAL A 86 21.114 35.076 3.329 1.00 0.00 H ATOM 1313 HG23 VAL A 86 22.674 34.358 3.802 1.00 0.00 H ATOM 1314 H VAL A 86 20.115 36.915 3.944 1.00 0.00 H ATOM 1315 N ARG A 87 20.226 36.223 8.212 1.00 11.22 N ATOM 1316 CA ARG A 87 20.227 36.909 9.475 1.00 11.23 C ATOM 1317 C ARG A 87 21.634 37.049 10.056 1.00 10.03 C ATOM 1318 O ARG A 87 22.373 36.064 9.999 1.00 11.15 O ATOM 1319 CB ARG A 87 19.313 36.156 10.466 1.00 12.18 C ATOM 1320 CG ARG A 87 19.047 36.947 11.718 1.00 12.59 C ATOM 1321 CD ARG A 87 18.337 36.271 12.835 1.00 17.95 C ATOM 1322 NE ARG A 87 17.149 35.727 12.420 1.00 24.94 N ATOM 1323 CZ ARG A 87 16.724 34.754 13.363 1.00 28.60 C ATOM 1324 NH1 ARG A 87 17.248 34.255 14.569 1.00 26.57 N ATOM 1325 NH2 ARG A 87 15.593 34.308 12.932 1.00 22.37 N ATOM 1326 HA ARG A 87 19.848 37.918 9.310 1.00 0.00 H ATOM 1327 HB2 ARG A 87 18.362 35.947 9.976 1.00 0.00 H ATOM 1328 HB3 ARG A 87 19.793 35.217 10.741 1.00 0.00 H ATOM 1329 HG2 ARG A 87 20.011 37.280 12.102 1.00 0.00 H ATOM 1330 HG3 ARG A 87 18.451 37.814 11.433 1.00 0.00 H ATOM 1331 HD2 ARG A 87 18.138 37.000 13.621 1.00 0.00 H ATOM 1332 HD3 ARG A 87 18.972 35.477 13.230 1.00 0.00 H ATOM 1333 HE ARG A 87 16.639 35.986 11.551 1.00 0.00 H ATOM 1334 HH12 ARG A 87 16.734 33.519 15.094 1.00 0.00 H ATOM 1335 HH11 ARG A 87 18.150 34.622 14.935 1.00 0.00 H ATOM 1336 HH22 ARG A 87 15.085 33.576 13.468 1.00 0.00 H ATOM 1337 HH21 ARG A 87 15.190 34.681 12.049 1.00 0.00 H ATOM 1338 H ARG A 87 20.068 35.195 8.209 1.00 0.00 H ATOM 1339 N GLU A 88 21.960 38.219 10.588 1.00 9.86 N ATOM 1340 CA GLU A 88 23.228 38.449 11.236 1.00 9.29 C ATOM 1341 C GLU A 88 23.052 38.293 12.732 1.00 9.59 C ATOM 1342 O GLU A 88 22.015 38.512 13.306 1.00 11.47 O ATOM 1343 CB GLU A 88 23.774 39.843 10.847 1.00 9.30 C ATOM 1344 CG GLU A 88 24.207 39.830 9.401 1.00 10.67 C ATOM 1345 CD GLU A 88 24.460 41.238 8.871 1.00 10.06 C ATOM 1346 OE1 GLU A 88 25.458 41.867 9.327 1.00 10.24 O ATOM 1347 OE2 GLU A 88 23.668 41.739 8.030 1.00 10.63 O ATOM 1348 HA GLU A 88 23.965 37.716 10.907 1.00 0.00 H ATOM 1349 HB2 GLU A 88 22.993 40.591 10.986 1.00 0.00 H ATOM 1350 HB3 GLU A 88 24.627 40.089 11.480 1.00 0.00 H ATOM 1351 HG2 GLU A 88 25.125 39.250 9.313 1.00 0.00 H ATOM 1352 HG3 GLU A 88 23.425 39.363 8.803 1.00 0.00 H ATOM 1353 H GLU A 88 21.276 39.000 10.536 1.00 0.00 H ATOM 1354 N TRP A 89 24.178 37.880 13.348 1.00 9.24 N ATOM 1355 CA TRP A 89 24.218 37.641 14.793 1.00 9.09 C ATOM 1356 C TRP A 89 25.248 38.500 15.526 1.00 9.31 C ATOM 1357 O TRP A 89 25.277 38.459 16.759 1.00 9.66 O ATOM 1358 CB TRP A 89 24.412 36.157 15.103 1.00 8.98 C ATOM 1359 CG TRP A 89 25.741 35.575 14.739 1.00 8.49 C ATOM 1360 CD1 TRP A 89 26.084 35.046 13.529 1.00 9.02 C ATOM 1361 CD2 TRP A 89 26.897 35.435 15.581 1.00 8.84 C ATOM 1362 NE1 TRP A 89 27.364 34.590 13.551 1.00 9.19 N ATOM 1363 CE2 TRP A 89 27.898 34.819 14.811 1.00 8.81 C ATOM 1364 CE3 TRP A 89 27.139 35.755 16.918 1.00 9.17 C ATOM 1365 CZ2 TRP A 89 29.147 34.537 15.343 1.00 9.87 C ATOM 1366 CZ3 TRP A 89 28.385 35.485 17.432 1.00 10.47 C ATOM 1367 CH2 TRP A 89 29.356 34.895 16.652 1.00 10.29 C ATOM 1368 HA TRP A 89 23.245 37.950 15.175 1.00 0.00 H ATOM 1369 HB2 TRP A 89 24.271 36.020 16.175 1.00 0.00 H ATOM 1370 HB3 TRP A 89 23.646 35.601 14.563 1.00 0.00 H ATOM 1371 HE1 TRP A 89 27.861 34.143 12.755 1.00 0.00 H ATOM 1372 HD1 TRP A 89 25.423 34.996 12.664 1.00 0.00 H ATOM 1373 HZ2 TRP A 89 29.925 34.055 14.751 1.00 0.00 H ATOM 1374 HH2 TRP A 89 30.334 34.704 17.094 1.00 0.00 H ATOM 1375 HZ3 TRP A 89 28.608 35.740 18.468 1.00 0.00 H ATOM 1376 HE3 TRP A 89 26.363 36.206 17.536 1.00 0.00 H ATOM 1377 H TRP A 89 25.038 37.727 12.784 1.00 0.00 H ATOM 1378 N LYS A 90 26.060 39.276 14.803 1.00 9.72 N ATOM 1379 CA LYS A 90 27.035 40.145 15.413 1.00 10.10 C ATOM 1380 C LYS A 90 27.476 41.188 14.390 1.00 9.95 C ATOM 1381 O LYS A 90 27.587 40.864 13.230 1.00 10.95 O ATOM 1382 CB LYS A 90 28.244 39.340 15.875 1.00 10.71 C ATOM 1383 CG LYS A 90 29.250 40.235 16.534 1.00 14.47 C ATOM 1384 CD LYS A 90 30.204 39.581 17.417 1.00 15.98 C ATOM 1385 CE LYS A 90 31.162 40.643 18.037 1.00 16.61 C ATOM 1386 NZ LYS A 90 31.995 39.966 19.023 1.00 20.65 N ATOM 1387 HA LYS A 90 26.590 40.635 16.279 1.00 0.00 H ATOM 1388 HB2 LYS A 90 27.919 38.580 16.586 1.00 0.00 H ATOM 1389 HB3 LYS A 90 28.704 38.856 15.013 1.00 0.00 H ATOM 1390 HG2 LYS A 90 29.813 40.739 15.749 1.00 0.00 H ATOM 1391 HG3 LYS A 90 28.705 40.975 17.121 1.00 0.00 H ATOM 1392 HD2 LYS A 90 29.667 39.068 18.215 1.00 0.00 H ATOM 1393 HD3 LYS A 90 30.786 38.856 16.848 1.00 0.00 H ATOM 1394 HE2 LYS A 90 30.582 41.431 18.518 1.00 0.00 H ATOM 1395 HE3 LYS A 90 31.788 41.079 17.258 1.00 0.00 H ATOM 1396 HZ1 LYS A 90 31.390 39.550 19.759 1.00 0.00 H ATOM 1397 HZ2 LYS A 90 32.541 39.214 18.556 1.00 0.00 H ATOM 1398 HZ3 LYS A 90 32.646 40.652 19.455 1.00 0.00 H ATOM 1399 H LYS A 90 25.986 39.252 13.766 1.00 0.00 H ATOM 1400 N GLN A 91 27.678 42.400 14.811 1.00 12.51 N ATOM 1401 CA GLN A 91 28.334 43.439 14.060 1.00 11.50 C ATOM 1402 C GLN A 91 29.823 43.433 14.371 1.00 11.37 C ATOM 1403 O GLN A 91 30.231 43.472 15.502 1.00 12.35 O ATOM 1404 CB GLN A 91 27.707 44.786 14.382 1.00 11.89 C ATOM 1405 CG GLN A 91 28.391 45.960 13.753 1.00 11.69 C ATOM 1406 CD GLN A 91 27.681 47.245 14.055 1.00 10.50 C ATOM 1407 OE1 GLN A 91 27.795 47.842 15.131 1.00 12.09 O ATOM 1408 NE2 GLN A 91 26.869 47.667 13.103 1.00 11.71 N ATOM 1409 HA GLN A 91 28.208 43.256 12.993 1.00 0.00 H ATOM 1410 HB2 GLN A 91 26.673 44.771 14.038 1.00 0.00 H ATOM 1411 HB3 GLN A 91 27.727 44.920 15.464 1.00 0.00 H ATOM 1412 HG2 GLN A 91 29.410 46.021 14.135 1.00 0.00 H ATOM 1413 HG3 GLN A 91 28.417 45.816 12.673 1.00 0.00 H ATOM 1414 HE22 GLN A 91 26.797 47.140 12.209 1.00 0.00 H ATOM 1415 HE21 GLN A 91 26.301 48.526 13.247 1.00 0.00 H ATOM 1416 H GLN A 91 27.340 42.639 15.765 1.00 0.00 H ATOM 1417 N ASN A 92 30.644 43.477 13.317 1.00 10.94 N ATOM 1418 CA ASN A 92 32.092 43.345 13.492 1.00 10.96 C ATOM 1419 C ASN A 92 32.664 44.433 14.382 1.00 11.89 C ATOM 1420 O ASN A 92 32.372 45.619 14.224 1.00 13.49 O ATOM 1421 CB ASN A 92 32.796 43.464 12.149 1.00 10.97 C ATOM 1422 CG ASN A 92 34.282 43.136 12.281 1.00 11.47 C ATOM 1423 OD1 ASN A 92 34.640 42.141 12.900 1.00 12.91 O ATOM 1424 ND2 ASN A 92 35.064 43.952 11.680 1.00 17.05 N ATOM 1425 HA ASN A 92 32.256 42.370 13.950 1.00 0.00 H ATOM 1426 HB2 ASN A 92 32.339 42.771 11.443 1.00 0.00 H ATOM 1427 HB3 ASN A 92 32.687 44.483 11.778 1.00 0.00 H ATOM 1428 HD22 ASN A 92 34.672 44.774 11.177 1.00 0.00 H ATOM 1429 HD21 ASN A 92 36.092 43.793 11.694 1.00 0.00 H ATOM 1430 H ASN A 92 30.250 43.606 12.363 1.00 0.00 H ATOM 1431 N ARG A 93 33.540 43.975 15.271 1.00 12.83 N ATOM 1432 CA ARG A 93 34.302 44.859 16.145 1.00 15.29 C ATOM 1433 C ARG A 93 35.798 44.555 16.128 1.00 15.54 C ATOM 1434 O ARG A 93 36.568 45.457 16.400 1.00 22.44 O ATOM 1435 CB ARG A 93 33.884 44.810 17.608 1.00 21.89 C ATOM 1436 CG ARG A 93 32.522 45.444 17.865 1.00 28.10 C ATOM 1437 CD ARG A 93 32.418 46.005 19.303 1.00 36.02 C ATOM 1438 NE ARG A 93 31.086 46.559 19.325 1.00 42.64 N ATOM 1439 CZ ARG A 93 30.030 45.944 19.851 1.00 47.40 C ATOM 1440 NH1 ARG A 93 30.014 44.746 20.424 1.00 55.74 N ATOM 1441 NH2 ARG A 93 28.906 46.621 19.740 1.00 58.44 N ATOM 1442 HA ARG A 93 34.087 45.845 15.733 1.00 0.00 H ATOM 1443 HB2 ARG A 93 33.846 43.767 17.923 1.00 0.00 H ATOM 1444 HB3 ARG A 93 34.630 45.340 18.200 1.00 0.00 H ATOM 1445 HG2 ARG A 93 32.371 46.258 17.156 1.00 0.00 H ATOM 1446 HG3 ARG A 93 31.748 44.690 17.722 1.00 0.00 H ATOM 1447 HD2 ARG A 93 33.169 46.775 19.481 1.00 0.00 H ATOM 1448 HD3 ARG A 93 32.528 45.213 20.044 1.00 0.00 H ATOM 1449 HE ARG A 93 30.942 47.499 18.903 1.00 0.00 H ATOM 1450 HH12 ARG A 93 29.125 44.363 20.803 1.00 0.00 H ATOM 1451 HH11 ARG A 93 30.891 44.191 20.494 1.00 0.00 H ATOM 1452 HH22 ARG A 93 28.022 46.227 20.120 1.00 0.00 H ATOM 1453 HH21 ARG A 93 28.903 47.550 19.273 1.00 0.00 H ATOM 1454 H ARG A 93 33.687 42.948 15.346 1.00 0.00 H ATOM 1455 N SER A 94 36.255 43.350 15.832 1.00 13.91 N ATOM 1456 CA SER A 94 37.661 42.976 15.917 1.00 13.80 C ATOM 1457 C SER A 94 38.374 43.235 14.591 1.00 12.95 C ATOM 1458 O SER A 94 37.766 43.484 13.544 1.00 13.22 O ATOM 1459 CB SER A 94 37.782 41.565 16.401 1.00 13.92 C ATOM 1460 OG SER A 94 37.193 40.693 15.434 1.00 12.50 O ATOM 1461 HA SER A 94 38.168 43.604 16.650 1.00 0.00 H ATOM 1462 HB2 SER A 94 37.264 41.459 17.354 1.00 0.00 H ATOM 1463 HB3 SER A 94 38.834 41.311 16.531 1.00 0.00 H ATOM 1464 HG SER A 94 37.269 39.757 15.746 1.00 0.00 H ATOM 1465 H SER A 94 35.573 42.629 15.521 1.00 0.00 H ATOM 1466 N GLU A 95 39.711 43.138 14.600 1.00 13.73 N ATOM 1467 CA GLU A 95 40.525 43.394 13.420 1.00 13.39 C ATOM 1468 C GLU A 95 40.032 42.531 12.258 1.00 11.95 C ATOM 1469 O GLU A 95 39.731 41.369 12.356 1.00 11.64 O ATOM 1470 CB GLU A 95 41.998 43.097 13.777 1.00 13.64 C ATOM 1471 CG GLU A 95 42.961 42.972 12.593 1.00 13.49 C ATOM 1472 CD GLU A 95 43.124 41.604 12.032 1.00 13.14 C ATOM 1473 OE1 GLU A 95 42.781 40.621 12.686 1.00 13.14 O ATOM 1474 OE2 GLU A 95 43.625 41.479 10.871 1.00 13.11 O ATOM 1475 HA GLU A 95 40.444 44.435 13.106 1.00 0.00 H ATOM 1476 HB2 GLU A 95 42.356 43.904 14.416 1.00 0.00 H ATOM 1477 HB3 GLU A 95 42.025 42.158 14.330 1.00 0.00 H ATOM 1478 HG2 GLU A 95 42.597 43.619 11.795 1.00 0.00 H ATOM 1479 HG3 GLU A 95 43.941 43.318 12.921 1.00 0.00 H ATOM 1480 H GLU A 95 40.186 42.869 15.485 1.00 0.00 H ATOM 1481 N GLY A 96 40.069 43.170 11.087 1.00 11.53 N ATOM 1482 CA GLY A 96 39.703 42.531 9.832 1.00 11.43 C ATOM 1483 C GLY A 96 38.238 42.519 9.591 1.00 11.04 C ATOM 1484 O GLY A 96 37.436 42.187 10.490 1.00 11.89 O ATOM 1485 HA3 GLY A 96 40.061 41.501 9.849 1.00 0.00 H ATOM 1486 HA2 GLY A 96 40.185 43.068 9.015 1.00 0.00 H ATOM 1487 H GLY A 96 40.372 44.165 11.071 1.00 0.00 H ATOM 1488 N ASP A 97 37.797 42.833 8.393 1.00 11.50 N ATOM 1489 CA ASP A 97 36.384 42.767 8.040 1.00 10.91 C ATOM 1490 C ASP A 97 35.841 41.375 8.399 1.00 9.56 C ATOM 1491 O ASP A 97 36.460 40.362 8.166 1.00 10.27 O ATOM 1492 CB ASP A 97 36.141 43.015 6.562 1.00 12.26 C ATOM 1493 CG ASP A 97 35.934 44.443 6.124 1.00 15.62 C ATOM 1494 OD1 ASP A 97 35.300 45.203 6.907 1.00 18.74 O ATOM 1495 OD2 ASP A 97 36.318 44.861 5.033 1.00 17.98 O ATOM 1496 HA ASP A 97 35.872 43.550 8.599 1.00 0.00 H ATOM 1497 HB2 ASP A 97 37.003 42.628 6.019 1.00 0.00 H ATOM 1498 HB3 ASP A 97 35.251 42.453 6.278 1.00 0.00 H ATOM 1499 H ASP A 97 38.480 43.139 7.671 1.00 0.00 H ATOM 1500 N SER A 98 34.652 41.385 8.980 1.00 9.52 N ATOM 1501 CA SER A 98 33.922 40.170 9.258 1.00 9.39 C ATOM 1502 C SER A 98 32.424 40.397 9.113 1.00 9.44 C ATOM 1503 O SER A 98 31.885 41.432 9.496 1.00 10.53 O ATOM 1504 CB SER A 98 34.161 39.687 10.702 1.00 9.88 C ATOM 1505 OG SER A 98 35.452 39.175 10.883 1.00 10.65 O ATOM 1506 HA SER A 98 34.278 39.426 8.545 1.00 0.00 H ATOM 1507 HB2 SER A 98 33.438 38.906 10.935 1.00 0.00 H ATOM 1508 HB3 SER A 98 34.018 40.527 11.381 1.00 0.00 H ATOM 1509 HG SER A 98 35.560 38.878 11.821 1.00 0.00 H ATOM 1510 H SER A 98 34.229 42.298 9.245 1.00 0.00 H ATOM 1511 N PHE A 99 31.770 39.368 8.574 1.00 9.31 N ATOM 1512 CA PHE A 99 30.333 39.319 8.398 1.00 8.92 C ATOM 1513 C PHE A 99 29.845 38.095 9.176 1.00 8.50 C ATOM 1514 O PHE A 99 30.316 36.994 8.890 1.00 9.04 O ATOM 1515 CB PHE A 99 30.031 39.197 6.891 1.00 9.63 C ATOM 1516 CG PHE A 99 28.543 39.099 6.560 1.00 9.51 C ATOM 1517 CD1 PHE A 99 27.707 40.186 6.720 1.00 10.42 C ATOM 1518 CD2 PHE A 99 28.033 37.921 6.102 1.00 10.98 C ATOM 1519 CE1 PHE A 99 26.352 40.056 6.391 1.00 11.32 C ATOM 1520 CE2 PHE A 99 26.705 37.771 5.771 1.00 12.60 C ATOM 1521 CZ PHE A 99 25.896 38.869 5.926 1.00 12.00 C ATOM 1522 HA PHE A 99 29.828 40.213 8.765 1.00 0.00 H ATOM 1523 HB2 PHE A 99 30.437 40.075 6.388 1.00 0.00 H ATOM 1524 HB3 PHE A 99 30.526 38.302 6.514 1.00 0.00 H ATOM 1525 HD2 PHE A 99 28.701 37.066 5.994 1.00 0.00 H ATOM 1526 HE2 PHE A 99 26.314 36.823 5.402 1.00 0.00 H ATOM 1527 HZ PHE A 99 24.842 38.782 5.664 1.00 0.00 H ATOM 1528 HE1 PHE A 99 25.673 40.900 6.508 1.00 0.00 H ATOM 1529 HD1 PHE A 99 28.096 41.132 7.097 1.00 0.00 H ATOM 1530 H PHE A 99 32.327 38.548 8.260 1.00 0.00 H ATOM 1531 N TYR A 100 28.968 38.287 10.166 1.00 8.59 N ATOM 1532 CA TYR A 100 28.578 37.271 11.137 1.00 8.40 C ATOM 1533 C TYR A 100 27.135 36.888 10.856 1.00 8.56 C ATOM 1534 O TYR A 100 26.237 37.703 11.099 1.00 9.26 O ATOM 1535 CB TYR A 100 28.752 37.781 12.545 1.00 8.69 C ATOM 1536 CG TYR A 100 30.160 38.052 12.986 1.00 8.89 C ATOM 1537 CD1 TYR A 100 30.720 39.305 12.858 1.00 8.88 C ATOM 1538 CD2 TYR A 100 30.941 37.068 13.589 1.00 9.29 C ATOM 1539 CE1 TYR A 100 32.020 39.566 13.285 1.00 9.67 C ATOM 1540 CE2 TYR A 100 32.222 37.291 14.055 1.00 9.64 C ATOM 1541 CZ TYR A 100 32.763 38.544 13.877 1.00 9.45 C ATOM 1542 OH TYR A 100 34.023 38.838 14.319 1.00 10.82 O ATOM 1543 HA TYR A 100 29.215 36.392 11.044 1.00 0.00 H ATOM 1544 HB3 TYR A 100 28.329 37.039 13.222 1.00 0.00 H ATOM 1545 HB2 TYR A 100 28.192 38.712 12.633 1.00 0.00 H ATOM 1546 HD2 TYR A 100 30.519 36.069 13.699 1.00 0.00 H ATOM 1547 HE2 TYR A 100 32.787 36.500 14.548 1.00 0.00 H ATOM 1548 HE1 TYR A 100 32.452 40.558 13.158 1.00 0.00 H ATOM 1549 HD1 TYR A 100 30.133 40.109 12.413 1.00 0.00 H ATOM 1550 HH TYR A 100 34.675 38.240 13.874 1.00 0.00 H ATOM 1551 H TYR A 100 28.533 39.228 10.250 1.00 0.00 H ATOM 1552 N PHE A 101 26.906 35.671 10.368 1.00 8.50 N ATOM 1553 CA PHE A 101 25.606 35.277 9.872 1.00 8.70 C ATOM 1554 C PHE A 101 25.236 33.886 10.329 1.00 8.71 C ATOM 1555 O PHE A 101 26.073 33.077 10.662 1.00 9.06 O ATOM 1556 CB PHE A 101 25.591 35.392 8.332 1.00 9.52 C ATOM 1557 CG PHE A 101 26.566 34.507 7.615 1.00 8.95 C ATOM 1558 CD1 PHE A 101 26.125 33.330 7.008 1.00 9.50 C ATOM 1559 CD2 PHE A 101 27.898 34.818 7.557 1.00 9.61 C ATOM 1560 CE1 PHE A 101 27.007 32.533 6.296 1.00 9.75 C ATOM 1561 CE2 PHE A 101 28.771 34.010 6.859 1.00 10.14 C ATOM 1562 CZ PHE A 101 28.336 32.863 6.221 1.00 9.94 C ATOM 1563 HA PHE A 101 24.852 35.949 10.283 1.00 0.00 H ATOM 1564 HB2 PHE A 101 24.589 35.141 7.985 1.00 0.00 H ATOM 1565 HB3 PHE A 101 25.817 36.425 8.069 1.00 0.00 H ATOM 1566 HD2 PHE A 101 28.270 35.708 8.065 1.00 0.00 H ATOM 1567 HE2 PHE A 101 29.826 34.281 6.809 1.00 0.00 H ATOM 1568 HZ PHE A 101 29.035 32.234 5.670 1.00 0.00 H ATOM 1569 HE1 PHE A 101 26.642 31.638 5.792 1.00 0.00 H ATOM 1570 HD1 PHE A 101 25.079 33.036 7.095 1.00 0.00 H ATOM 1571 H PHE A 101 27.685 34.983 10.343 1.00 0.00 H ATOM 1572 N LEU A 102 23.940 33.611 10.329 1.00 9.17 N ATOM 1573 CA LEU A 102 23.398 32.321 10.760 1.00 9.28 C ATOM 1574 C LEU A 102 23.103 31.418 9.606 1.00 8.90 C ATOM 1575 O LEU A 102 22.634 31.873 8.553 1.00 10.55 O ATOM 1576 CB LEU A 102 22.114 32.572 11.555 1.00 9.48 C ATOM 1577 CG LEU A 102 22.297 33.357 12.837 1.00 9.69 C ATOM 1578 CD1 LEU A 102 20.922 33.584 13.485 1.00 15.87 C ATOM 1579 CD2 LEU A 102 23.209 32.677 13.830 1.00 10.05 C ATOM 1580 HA LEU A 102 24.148 31.825 11.376 1.00 0.00 H ATOM 1581 HB2 LEU A 102 21.423 33.123 10.917 1.00 0.00 H ATOM 1582 HB3 LEU A 102 21.679 31.605 11.809 1.00 0.00 H ATOM 1583 HG LEU A 102 22.770 34.302 12.569 1.00 0.00 H ATOM 1584 HD21 LEU A 102 22.794 31.705 14.096 1.00 0.00 H ATOM 1585 HD22 LEU A 102 24.194 32.543 13.384 1.00 0.00 H ATOM 1586 HD23 LEU A 102 23.295 33.294 14.724 1.00 0.00 H ATOM 1587 HD11 LEU A 102 20.286 34.143 12.799 1.00 0.00 H ATOM 1588 HD12 LEU A 102 20.462 32.621 13.706 1.00 0.00 H ATOM 1589 HD13 LEU A 102 21.046 34.149 14.409 1.00 0.00 H ATOM 1590 H LEU A 102 23.277 34.345 10.008 1.00 0.00 H ATOM 1591 N ASP A 103 23.349 30.121 9.796 1.00 8.93 N ATOM 1592 CA ASP A 103 22.913 29.109 8.827 1.00 9.04 C ATOM 1593 C ASP A 103 21.452 28.742 9.099 1.00 8.89 C ATOM 1594 O ASP A 103 20.830 29.249 10.066 1.00 9.39 O ATOM 1595 CB ASP A 103 23.891 27.948 8.798 1.00 9.39 C ATOM 1596 CG ASP A 103 23.597 26.768 9.663 1.00 8.50 C ATOM 1597 OD1 ASP A 103 22.735 26.885 10.574 1.00 9.05 O ATOM 1598 OD2 ASP A 103 24.233 25.690 9.430 1.00 9.55 O ATOM 1599 HA ASP A 103 22.929 29.500 7.810 1.00 0.00 H ATOM 1600 HB2 ASP A 103 23.943 27.592 7.769 1.00 0.00 H ATOM 1601 HB3 ASP A 103 24.865 28.336 9.097 1.00 0.00 H ATOM 1602 H ASP A 103 23.861 29.820 10.650 1.00 0.00 H ATOM 1603 N PRO A 104 20.871 27.866 8.292 1.00 9.50 N ATOM 1604 CA PRO A 104 19.433 27.527 8.447 1.00 10.17 C ATOM 1605 C PRO A 104 19.046 26.970 9.787 1.00 10.00 C ATOM 1606 O PRO A 104 17.889 27.155 10.199 1.00 14.28 O ATOM 1607 CB PRO A 104 19.207 26.514 7.316 1.00 10.82 C ATOM 1608 CG PRO A 104 20.147 26.982 6.242 1.00 11.13 C ATOM 1609 CD PRO A 104 21.396 27.338 6.986 1.00 9.95 C ATOM 1610 HA PRO A 104 18.808 28.418 8.390 1.00 0.00 H ATOM 1611 HD3 PRO A 104 22.024 26.461 7.141 1.00 0.00 H ATOM 1612 HD2 PRO A 104 21.965 28.101 6.455 1.00 0.00 H ATOM 1613 HG3 PRO A 104 19.742 27.852 5.724 1.00 0.00 H ATOM 1614 HG2 PRO A 104 20.338 26.188 5.520 1.00 0.00 H ATOM 1615 HB2 PRO A 104 19.456 25.504 7.640 1.00 0.00 H ATOM 1616 HB3 PRO A 104 18.174 26.539 6.969 1.00 0.00 H ATOM 1617 N ASP A 105 19.946 26.316 10.493 1.00 9.57 N ATOM 1618 CA ASP A 105 19.672 25.803 11.841 1.00 10.28 C ATOM 1619 C ASP A 105 19.997 26.776 12.939 1.00 10.02 C ATOM 1620 O ASP A 105 19.654 26.525 14.093 1.00 13.03 O ATOM 1621 CB ASP A 105 20.434 24.499 12.113 1.00 10.31 C ATOM 1622 CG ASP A 105 19.933 23.385 11.253 1.00 10.22 C ATOM 1623 OD1 ASP A 105 20.485 23.106 10.181 1.00 11.00 O ATOM 1624 OD2 ASP A 105 18.941 22.724 11.677 1.00 11.63 O ATOM 1625 HA ASP A 105 18.596 25.627 11.853 1.00 0.00 H ATOM 1626 HB2 ASP A 105 21.493 24.657 11.908 1.00 0.00 H ATOM 1627 HB3 ASP A 105 20.305 24.225 13.160 1.00 0.00 H ATOM 1628 H ASP A 105 20.887 26.157 10.079 1.00 0.00 H ATOM 1629 N GLY A 106 20.688 27.860 12.621 1.00 8.83 N ATOM 1630 CA GLY A 106 21.209 28.762 13.622 1.00 9.35 C ATOM 1631 C GLY A 106 22.635 28.506 14.029 1.00 8.66 C ATOM 1632 O GLY A 106 23.129 29.147 14.982 1.00 9.49 O ATOM 1633 HA3 GLY A 106 20.583 28.679 14.511 1.00 0.00 H ATOM 1634 HA2 GLY A 106 21.146 29.777 13.229 1.00 0.00 H ATOM 1635 H GLY A 106 20.861 28.069 11.617 1.00 0.00 H ATOM 1636 N HIS A 107 23.363 27.644 13.331 1.00 8.40 N ATOM 1637 CA HIS A 107 24.822 27.643 13.558 1.00 8.18 C ATOM 1638 C HIS A 107 25.362 29.020 13.226 1.00 8.17 C ATOM 1639 O HIS A 107 24.957 29.648 12.227 1.00 8.81 O ATOM 1640 CB HIS A 107 25.531 26.588 12.707 1.00 8.57 C ATOM 1641 CG HIS A 107 25.186 25.171 13.057 1.00 8.27 C ATOM 1642 ND1 HIS A 107 25.553 24.578 14.238 1.00 9.31 N ATOM 1643 CD2 HIS A 107 24.502 24.254 12.334 1.00 8.72 C ATOM 1644 CE1 HIS A 107 25.106 23.364 14.210 1.00 9.59 C ATOM 1645 NE2 HIS A 107 24.434 23.124 13.061 1.00 9.02 N ATOM 1646 HA HIS A 107 25.011 27.396 14.603 1.00 0.00 H ATOM 1647 HB2 HIS A 107 25.264 26.756 11.664 1.00 0.00 H ATOM 1648 HB3 HIS A 107 26.606 26.717 12.830 1.00 0.00 H ATOM 1649 HD2 HIS A 107 24.081 24.404 11.340 1.00 0.00 H ATOM 1650 HE1 HIS A 107 25.251 22.633 15.005 1.00 0.00 H ATOM 1651 H HIS A 107 22.923 26.993 12.650 1.00 0.00 H ATOM 1652 N ARG A 108 26.290 29.483 14.026 1.00 7.88 N ATOM 1653 CA ARG A 108 26.890 30.791 13.873 1.00 7.76 C ATOM 1654 C ARG A 108 28.117 30.697 12.998 1.00 7.87 C ATOM 1655 O ARG A 108 29.078 29.994 13.289 1.00 8.39 O ATOM 1656 CB ARG A 108 27.268 31.345 15.251 1.00 8.34 C ATOM 1657 CG ARG A 108 26.078 31.820 16.048 1.00 8.59 C ATOM 1658 CD ARG A 108 26.466 32.150 17.461 1.00 9.13 C ATOM 1659 NE ARG A 108 26.706 30.945 18.270 1.00 9.16 N ATOM 1660 CZ ARG A 108 25.778 30.303 18.969 1.00 9.75 C ATOM 1661 NH1 ARG A 108 24.503 30.689 18.972 1.00 10.88 N ATOM 1662 NH2 ARG A 108 26.115 29.228 19.667 1.00 10.75 N ATOM 1663 HA ARG A 108 26.174 31.463 13.400 1.00 0.00 H ATOM 1664 HB2 ARG A 108 27.771 30.559 15.814 1.00 0.00 H ATOM 1665 HB3 ARG A 108 27.950 32.184 15.112 1.00 0.00 H ATOM 1666 HG2 ARG A 108 25.666 32.711 15.575 1.00 0.00 H ATOM 1667 HG3 ARG A 108 25.322 31.035 16.061 1.00 0.00 H ATOM 1668 HD2 ARG A 108 25.663 32.726 17.920 1.00 0.00 H ATOM 1669 HD3 ARG A 108 27.377 32.748 17.444 1.00 0.00 H ATOM 1670 HE ARG A 108 27.675 30.568 18.296 1.00 0.00 H ATOM 1671 HH12 ARG A 108 23.802 30.163 19.531 1.00 0.00 H ATOM 1672 HH11 ARG A 108 24.209 31.517 18.415 1.00 0.00 H ATOM 1673 HH22 ARG A 108 25.395 28.719 20.218 1.00 0.00 H ATOM 1674 HH21 ARG A 108 27.100 28.894 19.664 1.00 0.00 H ATOM 1675 H ARG A 108 26.612 28.881 14.810 1.00 0.00 H ATOM 1676 N LEU A 109 28.053 31.471 11.891 1.00 7.92 N ATOM 1677 CA LEU A 109 29.087 31.518 10.874 1.00 7.99 C ATOM 1678 C LEU A 109 29.662 32.915 10.784 1.00 8.04 C ATOM 1679 O LEU A 109 29.096 33.921 11.244 1.00 8.23 O ATOM 1680 CB LEU A 109 28.520 31.094 9.513 1.00 7.95 C ATOM 1681 CG LEU A 109 27.825 29.736 9.505 1.00 8.29 C ATOM 1682 CD1 LEU A 109 27.243 29.466 8.105 1.00 9.23 C ATOM 1683 CD2 LEU A 109 28.690 28.611 9.989 1.00 9.48 C ATOM 1684 HA LEU A 109 29.880 30.824 11.152 1.00 0.00 H ATOM 1685 HB2 LEU A 109 27.798 31.847 9.197 1.00 0.00 H ATOM 1686 HB3 LEU A 109 29.343 31.059 8.799 1.00 0.00 H ATOM 1687 HG LEU A 109 27.010 29.780 10.228 1.00 0.00 H ATOM 1688 HD21 LEU A 109 29.569 28.529 9.350 1.00 0.00 H ATOM 1689 HD22 LEU A 109 29.002 28.810 11.014 1.00 0.00 H ATOM 1690 HD23 LEU A 109 28.126 27.679 9.954 1.00 0.00 H ATOM 1691 HD11 LEU A 109 26.523 30.245 7.856 1.00 0.00 H ATOM 1692 HD12 LEU A 109 28.049 29.467 7.371 1.00 0.00 H ATOM 1693 HD13 LEU A 109 26.747 28.496 8.100 1.00 0.00 H ATOM 1694 H LEU A 109 27.212 32.069 11.761 1.00 0.00 H ATOM 1695 N GLU A 110 30.821 32.987 10.141 1.00 8.16 N ATOM 1696 CA GLU A 110 31.499 34.253 9.928 1.00 8.36 C ATOM 1697 C GLU A 110 32.268 34.135 8.594 1.00 8.37 C ATOM 1698 O GLU A 110 32.806 33.056 8.290 1.00 8.96 O ATOM 1699 CB GLU A 110 32.494 34.500 11.078 1.00 8.84 C ATOM 1700 CG GLU A 110 33.366 35.748 10.952 1.00 8.72 C ATOM 1701 CD GLU A 110 34.430 35.851 12.020 1.00 8.75 C ATOM 1702 OE1 GLU A 110 34.353 35.052 13.008 1.00 9.33 O ATOM 1703 OE2 GLU A 110 35.323 36.709 11.880 1.00 9.39 O ATOM 1704 HA GLU A 110 30.789 35.080 9.897 1.00 0.00 H ATOM 1705 HB2 GLU A 110 31.922 34.584 12.002 1.00 0.00 H ATOM 1706 HB3 GLU A 110 33.155 33.636 11.139 1.00 0.00 H ATOM 1707 HG2 GLU A 110 33.855 35.730 9.978 1.00 0.00 H ATOM 1708 HG3 GLU A 110 32.724 36.626 11.019 1.00 0.00 H ATOM 1709 H GLU A 110 31.255 32.113 9.780 1.00 0.00 H ATOM 1710 N ALA A 111 32.319 35.214 7.840 1.00 8.16 N ATOM 1711 CA ALA A 111 33.259 35.376 6.722 1.00 8.77 C ATOM 1712 C ALA A 111 34.240 36.465 7.153 1.00 8.53 C ATOM 1713 O ALA A 111 33.805 37.553 7.495 1.00 9.20 O ATOM 1714 CB ALA A 111 32.540 35.762 5.454 1.00 9.38 C ATOM 1715 HA ALA A 111 33.775 34.442 6.502 1.00 0.00 H ATOM 1716 HB1 ALA A 111 31.822 34.985 5.194 1.00 0.00 H ATOM 1717 HB2 ALA A 111 32.017 36.706 5.608 1.00 0.00 H ATOM 1718 HB3 ALA A 111 33.264 35.874 4.647 1.00 0.00 H ATOM 1719 H ALA A 111 31.660 35.991 8.047 1.00 0.00 H ATOM 1720 N HIS A 112 35.522 36.133 7.158 1.00 8.69 N ATOM 1721 CA HIS A 112 36.564 37.000 7.736 1.00 9.05 C ATOM 1722 C HIS A 112 37.727 37.261 6.803 1.00 8.77 C ATOM 1723 O HIS A 112 38.238 36.309 6.199 1.00 9.11 O ATOM 1724 CB HIS A 112 37.071 36.320 9.013 1.00 9.26 C ATOM 1725 CG HIS A 112 38.183 37.102 9.702 1.00 9.06 C ATOM 1726 ND1 HIS A 112 38.005 38.427 10.090 1.00 9.69 N ATOM 1727 CD2 HIS A 112 39.433 36.757 10.053 1.00 9.63 C ATOM 1728 CE1 HIS A 112 39.130 38.839 10.669 1.00 10.42 C ATOM 1729 NE2 HIS A 112 40.004 37.848 10.674 1.00 10.14 N ATOM 1730 HA HIS A 112 36.119 37.975 7.935 1.00 0.00 H ATOM 1731 HB2 HIS A 112 36.237 36.217 9.707 1.00 0.00 H ATOM 1732 HB3 HIS A 112 37.450 35.332 8.754 1.00 0.00 H ATOM 1733 HD2 HIS A 112 39.909 35.792 9.879 1.00 0.00 H ATOM 1734 HE1 HIS A 112 39.303 39.836 11.075 1.00 0.00 H ATOM 1735 H HIS A 112 35.804 35.225 6.737 1.00 0.00 H ATOM 1736 N VAL A 113 38.145 38.511 6.772 1.00 8.78 N ATOM 1737 CA VAL A 113 39.363 38.957 6.069 1.00 9.49 C ATOM 1738 C VAL A 113 40.508 39.040 7.080 1.00 9.67 C ATOM 1739 O VAL A 113 40.417 39.819 8.034 1.00 11.13 O ATOM 1740 CB VAL A 113 39.127 40.333 5.425 1.00 10.16 C ATOM 1741 CG1 VAL A 113 40.417 40.788 4.725 1.00 11.65 C ATOM 1742 CG2 VAL A 113 37.971 40.325 4.463 1.00 10.50 C ATOM 1743 HA VAL A 113 39.616 38.248 5.281 1.00 0.00 H ATOM 1744 HB VAL A 113 38.865 41.038 6.214 1.00 0.00 H ATOM 1745 HG11 VAL A 113 41.221 40.858 5.458 1.00 0.00 H ATOM 1746 HG12 VAL A 113 40.686 40.064 3.956 1.00 0.00 H ATOM 1747 HG13 VAL A 113 40.255 41.764 4.266 1.00 0.00 H ATOM 1748 HG21 VAL A 113 38.169 39.609 3.665 1.00 0.00 H ATOM 1749 HG22 VAL A 113 37.062 40.040 4.992 1.00 0.00 H ATOM 1750 HG23 VAL A 113 37.848 41.321 4.037 1.00 0.00 H ATOM 1751 H VAL A 113 37.582 39.227 7.274 1.00 0.00 H ATOM 1752 N GLY A 114 41.544 38.249 6.888 1.00 10.92 N ATOM 1753 CA GLY A 114 42.653 38.186 7.774 1.00 12.10 C ATOM 1754 C GLY A 114 42.921 36.787 8.261 1.00 10.55 C ATOM 1755 O GLY A 114 42.283 35.828 7.843 1.00 12.44 O ATOM 1756 HA3 GLY A 114 42.450 38.824 8.635 1.00 0.00 H ATOM 1757 HA2 GLY A 114 43.538 38.551 7.253 1.00 0.00 H ATOM 1758 H GLY A 114 41.550 37.640 6.045 1.00 0.00 H ATOM 1759 N ASP A 115 43.899 36.662 9.142 1.00 11.41 N ATOM 1760 CA ASP A 115 44.296 35.345 9.679 1.00 11.34 C ATOM 1761 C ASP A 115 44.918 35.520 11.040 1.00 10.67 C ATOM 1762 O ASP A 115 44.862 36.620 11.629 1.00 11.08 O ATOM 1763 CB ASP A 115 45.191 34.669 8.667 1.00 13.16 C ATOM 1764 CG ASP A 115 46.485 35.332 8.330 1.00 15.14 C ATOM 1765 OD1 ASP A 115 46.880 36.305 9.053 1.00 14.37 O ATOM 1766 OD2 ASP A 115 47.052 34.833 7.331 1.00 20.84 O ATOM 1767 HA ASP A 115 43.437 34.691 9.831 1.00 0.00 H ATOM 1768 HB2 ASP A 115 45.424 33.676 9.051 1.00 0.00 H ATOM 1769 HB3 ASP A 115 44.623 34.575 7.742 1.00 0.00 H ATOM 1770 H ASP A 115 44.402 37.513 9.465 1.00 0.00 H ATOM 1771 N LEU A 116 45.445 34.448 11.615 1.00 10.68 N ATOM 1772 CA LEU A 116 45.952 34.531 12.974 1.00 11.65 C ATOM 1773 C LEU A 116 47.121 35.512 13.032 1.00 12.29 C ATOM 1774 O LEU A 116 47.243 36.294 13.959 1.00 12.77 O ATOM 1775 CB LEU A 116 46.356 33.159 13.454 1.00 12.06 C ATOM 1776 CG LEU A 116 47.024 33.151 14.852 1.00 12.92 C ATOM 1777 CD1 LEU A 116 46.161 33.784 15.915 1.00 13.27 C ATOM 1778 CD2 LEU A 116 47.390 31.710 15.174 1.00 15.97 C ATOM 1779 HA LEU A 116 45.170 34.902 13.636 1.00 0.00 H ATOM 1780 HB2 LEU A 116 45.464 32.534 13.497 1.00 0.00 H ATOM 1781 HB3 LEU A 116 47.059 32.738 12.736 1.00 0.00 H ATOM 1782 HG LEU A 116 47.923 33.767 14.835 1.00 0.00 H ATOM 1783 HD21 LEU A 116 46.487 31.099 15.179 1.00 0.00 H ATOM 1784 HD22 LEU A 116 48.080 31.334 14.419 1.00 0.00 H ATOM 1785 HD23 LEU A 116 47.864 31.667 16.155 1.00 0.00 H ATOM 1786 HD11 LEU A 116 45.959 34.821 15.647 1.00 0.00 H ATOM 1787 HD12 LEU A 116 45.221 33.238 15.991 1.00 0.00 H ATOM 1788 HD13 LEU A 116 46.681 33.749 16.872 1.00 0.00 H ATOM 1789 H LEU A 116 45.495 33.549 11.094 1.00 0.00 H ATOM 1790 N ARG A 117 47.969 35.492 11.982 1.00 12.83 N ATOM 1791 CA ARG A 117 49.101 36.429 12.003 1.00 14.25 C ATOM 1792 C ARG A 117 48.688 37.843 11.948 1.00 13.03 C ATOM 1793 O ARG A 117 49.279 38.683 12.670 1.00 14.17 O ATOM 1794 CB ARG A 117 50.095 35.960 10.902 1.00 19.83 C ATOM 1795 CG ARG A 117 50.847 34.676 11.239 1.00 27.23 C ATOM 1796 CD ARG A 117 51.225 34.101 12.622 1.00 32.33 C ATOM 1797 NE ARG A 117 51.171 32.953 13.354 1.00 34.53 N ATOM 1798 CZ ARG A 117 51.648 32.715 14.559 1.00 36.74 C ATOM 1799 NH1 ARG A 117 52.255 33.678 15.242 1.00 42.78 N ATOM 1800 NH2 ARG A 117 51.495 31.511 15.081 1.00 40.28 N ATOM 1801 HA ARG A 117 49.620 36.404 12.961 1.00 0.00 H ATOM 1802 HB2 ARG A 117 49.533 35.795 9.983 1.00 0.00 H ATOM 1803 HB3 ARG A 117 50.826 36.752 10.742 1.00 0.00 H ATOM 1804 HG2 ARG A 117 50.259 33.887 10.770 1.00 0.00 H ATOM 1805 HG3 ARG A 117 51.799 34.776 10.718 1.00 0.00 H ATOM 1806 HD2 ARG A 117 50.702 34.792 13.283 1.00 0.00 H ATOM 1807 HD3 ARG A 117 52.294 34.313 12.649 1.00 0.00 H ATOM 1808 HE ARG A 117 50.686 32.154 12.898 1.00 0.00 H ATOM 1809 HH12 ARG A 117 52.630 33.484 16.193 1.00 0.00 H ATOM 1810 HH11 ARG A 117 52.356 34.626 14.826 1.00 0.00 H ATOM 1811 HH22 ARG A 117 51.865 31.305 16.031 1.00 0.00 H ATOM 1812 HH21 ARG A 117 51.004 30.769 14.542 1.00 0.00 H ATOM 1813 H ARG A 117 47.826 34.837 11.187 1.00 0.00 H ATOM 1814 N SER A 118 47.692 38.219 11.157 1.00 12.31 N ATOM 1815 CA SER A 118 47.276 39.607 11.132 1.00 12.90 C ATOM 1816 C SER A 118 46.602 39.981 12.432 1.00 12.17 C ATOM 1817 O SER A 118 46.758 41.098 12.946 1.00 13.02 O ATOM 1818 CB SER A 118 46.401 39.872 9.916 1.00 12.58 C ATOM 1819 OG SER A 118 45.099 39.291 9.994 1.00 12.64 O ATOM 1820 HA SER A 118 48.153 40.248 11.039 1.00 0.00 H ATOM 1821 HB2 SER A 118 46.904 39.467 9.038 1.00 0.00 H ATOM 1822 HB3 SER A 118 46.288 40.950 9.804 1.00 0.00 H ATOM 1823 HG SER A 118 44.622 39.657 10.781 1.00 0.00 H ATOM 1824 H SER A 118 47.211 37.520 10.556 1.00 0.00 H ATOM 1825 N ARG A 119 45.885 39.044 13.073 1.00 11.63 N ATOM 1826 CA ARG A 119 45.287 39.326 14.372 1.00 11.72 C ATOM 1827 C ARG A 119 46.367 39.564 15.407 1.00 12.43 C ATOM 1828 O ARG A 119 46.276 40.518 16.212 1.00 13.33 O ATOM 1829 CB ARG A 119 44.381 38.161 14.795 1.00 11.18 C ATOM 1830 CG ARG A 119 43.746 38.301 16.155 1.00 12.07 C ATOM 1831 CD ARG A 119 42.859 39.536 16.282 1.00 12.92 C ATOM 1832 NE ARG A 119 41.857 39.618 15.223 1.00 12.54 N ATOM 1833 CZ ARG A 119 40.682 38.980 15.221 1.00 11.88 C ATOM 1834 NH1 ARG A 119 40.289 38.217 16.231 1.00 12.16 N ATOM 1835 NH2 ARG A 119 39.899 39.141 14.177 1.00 12.70 N ATOM 1836 HA ARG A 119 44.681 40.229 14.295 1.00 0.00 H ATOM 1837 HB2 ARG A 119 43.583 38.070 14.058 1.00 0.00 H ATOM 1838 HB3 ARG A 119 44.980 37.250 14.795 1.00 0.00 H ATOM 1839 HG2 ARG A 119 43.138 37.417 16.346 1.00 0.00 H ATOM 1840 HG3 ARG A 119 44.537 38.365 16.902 1.00 0.00 H ATOM 1841 HD2 ARG A 119 43.489 40.425 16.237 1.00 0.00 H ATOM 1842 HD3 ARG A 119 42.348 39.502 17.244 1.00 0.00 H ATOM 1843 HE ARG A 119 42.075 40.221 14.404 1.00 0.00 H ATOM 1844 HH12 ARG A 119 39.367 37.737 16.192 1.00 0.00 H ATOM 1845 HH11 ARG A 119 40.902 38.098 17.062 1.00 0.00 H ATOM 1846 HH22 ARG A 119 38.977 38.661 14.139 1.00 0.00 H ATOM 1847 HH21 ARG A 119 40.201 39.749 13.389 1.00 0.00 H ATOM 1848 H ARG A 119 45.755 38.108 12.638 1.00 0.00 H ATOM 1849 N LEU A 120 47.359 38.672 15.458 1.00 13.09 N ATOM 1850 CA LEU A 120 48.413 38.851 16.480 1.00 13.94 C ATOM 1851 C LEU A 120 49.154 40.131 16.274 1.00 15.44 C ATOM 1852 O LEU A 120 49.514 40.800 17.239 1.00 18.13 O ATOM 1853 CB LEU A 120 49.349 37.667 16.454 1.00 14.92 C ATOM 1854 CG LEU A 120 48.758 36.352 16.941 1.00 14.83 C ATOM 1855 CD1 LEU A 120 49.700 35.189 16.612 1.00 16.43 C ATOM 1856 CD2 LEU A 120 48.400 36.413 18.412 1.00 16.31 C ATOM 1857 HA LEU A 120 47.944 38.907 17.463 1.00 0.00 H ATOM 1858 HB2 LEU A 120 49.682 37.525 15.426 1.00 0.00 H ATOM 1859 HB3 LEU A 120 50.207 37.903 17.084 1.00 0.00 H ATOM 1860 HG LEU A 120 47.823 36.175 16.409 1.00 0.00 H ATOM 1861 HD21 LEU A 120 49.297 36.625 18.994 1.00 0.00 H ATOM 1862 HD22 LEU A 120 47.666 37.202 18.573 1.00 0.00 H ATOM 1863 HD23 LEU A 120 47.981 35.456 18.723 1.00 0.00 H ATOM 1864 HD11 LEU A 120 49.846 35.135 15.533 1.00 0.00 H ATOM 1865 HD12 LEU A 120 50.660 35.351 17.102 1.00 0.00 H ATOM 1866 HD13 LEU A 120 49.262 34.256 16.967 1.00 0.00 H ATOM 1867 H LEU A 120 47.390 37.871 14.795 1.00 0.00 H ATOM 1868 N ALA A 121 49.397 40.531 15.006 1.00 14.24 N ATOM 1869 CA ALA A 121 50.119 41.764 14.809 1.00 16.88 C ATOM 1870 C ALA A 121 49.308 42.955 15.273 1.00 16.64 C ATOM 1871 O ALA A 121 49.875 43.877 15.899 1.00 18.96 O ATOM 1872 CB ALA A 121 50.413 41.957 13.316 1.00 17.94 C ATOM 1873 HA ALA A 121 51.041 41.701 15.388 1.00 0.00 H ATOM 1874 HB1 ALA A 121 51.015 41.123 12.955 1.00 0.00 H ATOM 1875 HB2 ALA A 121 49.474 41.995 12.764 1.00 0.00 H ATOM 1876 HB3 ALA A 121 50.958 42.890 13.172 1.00 0.00 H ATOM 1877 H ALA A 121 49.073 39.966 14.195 1.00 0.00 H ATOM 1878 N ALA A 122 48.010 42.966 15.043 1.00 15.42 N ATOM 1879 CA ALA A 122 47.151 44.044 15.483 1.00 16.10 C ATOM 1880 C ALA A 122 47.078 44.052 17.016 1.00 18.47 C ATOM 1881 O ALA A 122 47.126 45.098 17.684 1.00 21.58 O ATOM 1882 CB ALA A 122 45.782 43.937 14.852 1.00 16.75 C ATOM 1883 HA ALA A 122 47.573 44.995 15.158 1.00 0.00 H ATOM 1884 HB1 ALA A 122 45.878 43.986 13.767 1.00 0.00 H ATOM 1885 HB2 ALA A 122 45.326 42.988 15.135 1.00 0.00 H ATOM 1886 HB3 ALA A 122 45.157 44.760 15.200 1.00 0.00 H ATOM 1887 H ALA A 122 47.587 42.169 14.525 1.00 0.00 H ATOM 1888 N CYS A 123 46.986 42.895 17.641 1.00 19.58 N ATOM 1889 CA CYS A 123 47.012 42.778 19.094 1.00 21.18 C ATOM 1890 C CYS A 123 48.330 43.196 19.703 1.00 23.22 C ATOM 1891 O CYS A 123 48.316 43.743 20.833 1.00 27.19 O ATOM 1892 CB CYS A 123 46.720 41.299 19.474 1.00 21.72 C ATOM 1893 SG CYS A 123 44.992 40.821 19.130 1.00 23.80 S ATOM 1894 HA CYS A 123 46.254 43.454 19.491 1.00 0.00 H ATOM 1895 HB2 CYS A 123 46.915 41.165 20.538 1.00 0.00 H ATOM 1896 HB3 CYS A 123 47.383 40.652 18.900 1.00 0.00 H ATOM 1897 HG CYS A 123 44.733 40.975 17.783 1.00 0.00 H ATOM 1898 H CYS A 123 46.891 42.029 17.073 1.00 0.00 H ATOM 1899 N ARG A 124 49.459 42.923 19.069 1.00 21.82 N ATOM 1900 CA ARG A 124 50.774 43.393 19.601 1.00 24.06 C ATOM 1901 C ARG A 124 50.740 44.899 19.705 1.00 25.79 C ATOM 1902 O ARG A 124 51.271 45.488 20.656 1.00 31.95 O ATOM 1903 CB ARG A 124 51.949 42.859 18.796 1.00 26.69 C ATOM 1904 CG ARG A 124 52.451 41.423 18.907 1.00 25.67 C ATOM 1905 CD ARG A 124 53.214 40.950 20.095 1.00 22.34 C ATOM 1906 NE ARG A 124 53.786 39.623 19.922 1.00 21.71 N ATOM 1907 CZ ARG A 124 54.767 39.149 20.700 1.00 20.37 C ATOM 1908 NH1 ARG A 124 55.307 39.813 21.694 1.00 23.89 N ATOM 1909 NH2 ARG A 124 55.161 37.902 20.368 1.00 28.74 N ATOM 1910 HA ARG A 124 50.933 42.987 20.600 1.00 0.00 H ATOM 1911 HB2 ARG A 124 51.686 43.005 17.748 1.00 0.00 H ATOM 1912 HB3 ARG A 124 52.798 43.494 19.048 1.00 0.00 H ATOM 1913 HG2 ARG A 124 51.571 40.784 18.833 1.00 0.00 H ATOM 1914 HG3 ARG A 124 53.094 41.255 18.043 1.00 0.00 H ATOM 1915 HD2 ARG A 124 52.541 40.928 20.952 1.00 0.00 H ATOM 1916 HD3 ARG A 124 54.024 41.653 20.289 1.00 0.00 H ATOM 1917 HE ARG A 124 53.417 39.017 19.162 1.00 0.00 H ATOM 1918 HH12 ARG A 124 56.067 39.380 22.257 1.00 0.00 H ATOM 1919 HH11 ARG A 124 54.975 40.772 21.920 1.00 0.00 H ATOM 1920 HH22 ARG A 124 55.918 37.435 20.907 1.00 0.00 H ATOM 1921 HH21 ARG A 124 54.708 37.408 19.573 1.00 0.00 H ATOM 1922 H ARG A 124 49.431 42.373 18.187 1.00 0.00 H ATOM 1923 N GLN A 125 50.134 45.600 18.742 1.00 25.30 N ATOM 1924 CA GLN A 125 50.182 47.046 18.641 1.00 25.50 C ATOM 1925 C GLN A 125 49.169 47.565 19.648 1.00 26.22 C ATOM 1926 O GLN A 125 49.319 48.656 20.147 1.00 34.41 O ATOM 1927 CB GLN A 125 49.758 47.600 17.288 1.00 27.69 C ATOM 1928 CG GLN A 125 50.648 47.370 16.104 1.00 34.90 C ATOM 1929 CD GLN A 125 50.021 47.658 14.764 1.00 37.50 C ATOM 1930 OE1 GLN A 125 48.964 48.270 14.588 1.00 50.70 O ATOM 1931 NE2 GLN A 125 50.680 47.240 13.669 1.00 48.92 N ATOM 1932 HA GLN A 125 51.215 47.354 18.806 1.00 0.00 H ATOM 1933 HB2 GLN A 125 48.789 47.161 17.051 1.00 0.00 H ATOM 1934 HB3 GLN A 125 49.649 48.678 17.403 1.00 0.00 H ATOM 1935 HG2 GLN A 125 51.524 48.010 16.211 1.00 0.00 H ATOM 1936 HG3 GLN A 125 50.959 46.325 16.114 1.00 0.00 H ATOM 1937 HE22 GLN A 125 51.575 46.720 13.768 1.00 0.00 H ATOM 1938 HE21 GLN A 125 50.294 47.437 12.723 1.00 0.00 H ATOM 1939 H GLN A 125 49.596 45.077 18.022 1.00 0.00 H ATOM 1940 N ALA A 126 48.183 46.774 19.989 1.00 26.13 N ATOM 1941 CA ALA A 126 47.134 47.180 20.891 1.00 29.37 C ATOM 1942 C ALA A 126 46.621 45.972 21.643 1.00 27.46 C ATOM 1943 O ALA A 126 45.558 45.490 21.316 1.00 27.15 O ATOM 1944 CB ALA A 126 45.990 47.809 20.126 1.00 27.87 C ATOM 1945 HA ALA A 126 47.539 47.912 21.590 1.00 0.00 H ATOM 1946 HB1 ALA A 126 46.353 48.684 19.587 1.00 0.00 H ATOM 1947 HB2 ALA A 126 45.587 47.086 19.417 1.00 0.00 H ATOM 1948 HB3 ALA A 126 45.209 48.109 20.825 1.00 0.00 H ATOM 1949 H ALA A 126 48.155 45.813 19.593 1.00 0.00 H ATOM 1950 N PRO A 127 47.418 45.476 22.583 1.00 29.27 N ATOM 1951 CA PRO A 127 46.964 44.253 23.258 1.00 27.40 C ATOM 1952 C PRO A 127 45.645 44.355 23.998 1.00 27.76 C ATOM 1953 O PRO A 127 45.345 45.375 24.590 1.00 30.77 O ATOM 1954 CB PRO A 127 48.081 44.028 24.280 1.00 27.58 C ATOM 1955 CG PRO A 127 49.244 44.843 23.794 1.00 30.72 C ATOM 1956 CD PRO A 127 48.729 46.014 22.999 1.00 29.93 C ATOM 1957 HA PRO A 127 46.787 43.463 22.528 1.00 0.00 H ATOM 1958 HD3 PRO A 127 48.624 46.908 23.614 1.00 0.00 H ATOM 1959 HD2 PRO A 127 49.367 46.236 22.143 1.00 0.00 H ATOM 1960 HG3 PRO A 127 49.884 44.226 23.163 1.00 0.00 H ATOM 1961 HG2 PRO A 127 49.818 45.205 24.647 1.00 0.00 H ATOM 1962 HB2 PRO A 127 47.767 44.365 25.268 1.00 0.00 H ATOM 1963 HB3 PRO A 127 48.348 42.972 24.325 1.00 0.00 H ATOM 1964 N TYR A 128 44.852 43.276 24.058 1.00 26.96 N ATOM 1965 CA TYR A 128 43.592 43.172 24.779 1.00 24.34 C ATOM 1966 C TYR A 128 43.846 43.226 26.294 1.00 24.29 C ATOM 1967 O TYR A 128 44.998 43.053 26.723 1.00 27.29 O ATOM 1968 CB TYR A 128 42.843 41.863 24.502 1.00 24.93 C ATOM 1969 CG TYR A 128 42.374 41.663 23.066 1.00 24.83 C ATOM 1970 CD1 TYR A 128 41.944 40.398 22.682 1.00 24.09 C ATOM 1971 CD2 TYR A 128 42.367 42.629 22.079 1.00 26.02 C ATOM 1972 CE1 TYR A 128 41.509 40.081 21.420 1.00 25.81 C ATOM 1973 CE2 TYR A 128 41.928 42.334 20.809 1.00 25.57 C ATOM 1974 CZ TYR A 128 41.498 41.060 20.456 1.00 25.78 C ATOM 1975 OH TYR A 128 41.031 40.717 19.197 1.00 31.28 O ATOM 1976 HA TYR A 128 42.985 44.008 24.432 1.00 0.00 H ATOM 1977 HB3 TYR A 128 41.966 41.835 25.148 1.00 0.00 H ATOM 1978 HB2 TYR A 128 43.507 41.037 24.756 1.00 0.00 H ATOM 1979 HD2 TYR A 128 42.713 43.637 22.309 1.00 0.00 H ATOM 1980 HE2 TYR A 128 41.917 43.123 20.057 1.00 0.00 H ATOM 1981 HE1 TYR A 128 41.178 39.069 21.186 1.00 0.00 H ATOM 1982 HD1 TYR A 128 41.953 39.607 23.432 1.00 0.00 H ATOM 1983 HH TYR A 128 40.785 39.758 19.188 1.00 0.00 H ATOM 1984 H TYR A 128 45.168 42.432 23.539 1.00 0.00 H ATOM 1985 N ALA A 129 42.798 43.392 27.107 1.00 24.04 N ATOM 1986 CA ALA A 129 42.924 43.465 28.553 1.00 23.60 C ATOM 1987 C ALA A 129 43.583 42.216 29.097 1.00 21.24 C ATOM 1988 O ALA A 129 43.068 41.109 28.841 1.00 20.04 O ATOM 1989 CB ALA A 129 41.586 43.625 29.296 1.00 25.34 C ATOM 1990 HA ALA A 129 43.526 44.357 28.729 1.00 0.00 H ATOM 1991 HB1 ALA A 129 41.099 44.544 28.970 1.00 0.00 H ATOM 1992 HB2 ALA A 129 40.944 42.773 29.073 1.00 0.00 H ATOM 1993 HB3 ALA A 129 41.771 43.671 30.369 1.00 0.00 H ATOM 1994 H ALA A 129 41.850 43.472 26.686 1.00 0.00 H ATOM 1995 N GLY A 130 44.697 42.324 29.823 1.00 19.80 N ATOM 1996 CA GLY A 130 45.434 41.208 30.335 1.00 18.98 C ATOM 1997 C GLY A 130 46.239 40.388 29.356 1.00 18.39 C ATOM 1998 O GLY A 130 46.784 39.317 29.688 1.00 20.44 O ATOM 1999 HA3 GLY A 130 44.719 40.537 30.811 1.00 0.00 H ATOM 2000 HA2 GLY A 130 46.126 41.591 31.085 1.00 0.00 H ATOM 2001 H GLY A 130 45.053 43.279 30.030 1.00 0.00 H ATOM 2002 N MET A 131 46.274 40.920 28.115 1.00 19.51 N ATOM 2003 CA MET A 131 46.872 40.058 27.074 1.00 18.92 C ATOM 2004 C MET A 131 48.372 39.884 27.236 1.00 21.08 C ATOM 2005 O MET A 131 49.060 40.852 27.611 1.00 22.88 O ATOM 2006 CB MET A 131 46.546 40.631 25.714 1.00 20.65 C ATOM 2007 CG MET A 131 46.981 39.753 24.557 1.00 23.90 C ATOM 2008 SD MET A 131 46.122 40.316 23.085 1.00 30.68 S ATOM 2009 CE MET A 131 45.317 38.868 22.604 1.00 40.81 C ATOM 2010 HA MET A 131 46.441 39.062 27.178 1.00 0.00 H ATOM 2011 HB2 MET A 131 45.467 40.773 25.651 1.00 0.00 H ATOM 2012 HB3 MET A 131 47.044 41.596 25.619 1.00 0.00 H ATOM 2013 HG2 MET A 131 46.723 38.714 24.762 1.00 0.00 H ATOM 2014 HG3 MET A 131 48.058 39.837 24.413 1.00 0.00 H ATOM 2015 HE1 MET A 131 46.056 38.091 22.408 1.00 0.00 H ATOM 2016 HE2 MET A 131 44.649 38.543 23.402 1.00 0.00 H ATOM 2017 HE3 MET A 131 44.739 39.058 21.700 1.00 0.00 H ATOM 2018 H MET A 131 45.906 41.870 27.906 1.00 0.00 H ATOM 2019 N ARG A 132 48.816 38.660 27.014 1.00 19.23 N ATOM 2020 CA ARG A 132 50.180 38.182 26.977 1.00 21.38 C ATOM 2021 C ARG A 132 50.362 37.285 25.744 1.00 19.89 C ATOM 2022 O ARG A 132 49.452 36.554 25.397 1.00 19.30 O ATOM 2023 CB ARG A 132 50.482 37.442 28.292 1.00 28.38 C ATOM 2024 CG ARG A 132 51.136 38.295 29.343 1.00 34.87 C ATOM 2025 CD ARG A 132 50.629 38.527 30.728 1.00 38.96 C ATOM 2026 NE ARG A 132 51.419 37.775 31.699 1.00 44.91 N ATOM 2027 CZ ARG A 132 51.077 36.781 32.487 1.00 46.89 C ATOM 2028 NH1 ARG A 132 49.846 36.290 32.535 1.00 56.23 N ATOM 2029 NH2 ARG A 132 51.971 36.223 33.312 1.00 56.59 N ATOM 2030 HA ARG A 132 50.887 39.007 26.890 1.00 0.00 H ATOM 2031 HB2 ARG A 132 49.543 37.063 28.695 1.00 0.00 H ATOM 2032 HB3 ARG A 132 51.144 36.605 28.069 1.00 0.00 H ATOM 2033 HG2 ARG A 132 52.134 37.876 29.471 1.00 0.00 H ATOM 2034 HG3 ARG A 132 51.214 39.287 28.898 1.00 0.00 H ATOM 2035 HD2 ARG A 132 49.589 38.206 30.787 1.00 0.00 H ATOM 2036 HD3 ARG A 132 50.694 39.590 30.960 1.00 0.00 H ATOM 2037 HE ARG A 132 52.412 38.074 31.780 1.00 0.00 H ATOM 2038 HH12 ARG A 132 49.625 35.502 33.176 1.00 0.00 H ATOM 2039 HH11 ARG A 132 49.101 36.693 31.931 1.00 0.00 H ATOM 2040 HH22 ARG A 132 51.688 35.437 33.931 1.00 0.00 H ATOM 2041 HH21 ARG A 132 52.949 36.576 33.334 1.00 0.00 H ATOM 2042 H ARG A 132 48.084 37.941 26.842 1.00 0.00 H ATOM 2043 N PHE A 133 51.524 37.329 25.114 1.00 22.44 N ATOM 2044 CA PHE A 133 51.831 36.543 23.904 1.00 22.73 C ATOM 2045 C PHE A 133 52.719 35.324 24.145 1.00 27.33 C ATOM 2046 O PHE A 133 53.284 35.232 25.270 1.00 39.35 O ATOM 2047 CB PHE A 133 52.462 37.493 22.879 1.00 24.81 C ATOM 2048 CG PHE A 133 51.510 38.624 22.534 1.00 23.59 C ATOM 2049 CD1 PHE A 133 51.496 39.788 23.246 1.00 25.24 C ATOM 2050 CD2 PHE A 133 50.584 38.454 21.496 1.00 24.65 C ATOM 2051 CE1 PHE A 133 50.588 40.777 22.969 1.00 26.38 C ATOM 2052 CE2 PHE A 133 49.681 39.468 21.239 1.00 25.27 C ATOM 2053 CZ PHE A 133 49.656 40.633 21.968 1.00 26.34 C ATOM 2054 HA PHE A 133 50.896 36.121 23.535 1.00 0.00 H ATOM 2055 HB2 PHE A 133 53.378 37.911 23.296 1.00 0.00 H ATOM 2056 HB3 PHE A 133 52.698 36.935 21.973 1.00 0.00 H ATOM 2057 HD2 PHE A 133 50.576 37.540 20.903 1.00 0.00 H ATOM 2058 HE2 PHE A 133 48.963 39.339 20.429 1.00 0.00 H ATOM 2059 HZ PHE A 133 48.924 41.414 21.760 1.00 0.00 H ATOM 2060 HE1 PHE A 133 50.605 41.696 23.554 1.00 0.00 H ATOM 2061 HD1 PHE A 133 52.219 39.934 24.049 1.00 0.00 H ATOM 2062 H PHE A 133 52.264 37.954 25.493 1.00 0.00 H ATOM 2063 N ALA A 134 52.937 34.402 23.204 1.00 26.86 N ATOM 2064 CA ALA A 134 53.702 33.168 23.480 1.00 29.26 C ATOM 2065 C ALA A 134 55.144 33.426 23.956 1.00 40.47 C ATOM 2066 O ALA A 134 55.722 34.706 22.528 1.00 28.64 O ATOM 2067 CB ALA A 134 53.738 32.242 22.279 1.00 27.96 C ATOM 2068 HA ALA A 134 53.162 32.689 24.297 1.00 0.00 H ATOM 2069 HB1 ALA A 134 52.720 31.960 22.009 1.00 0.00 H ATOM 2070 HB2 ALA A 134 54.209 32.755 21.440 1.00 0.00 H ATOM 2071 HB3 ALA A 134 54.311 31.348 22.528 1.00 0.00 H ATOM 2072 H ALA A 134 52.557 34.557 22.248 1.00 0.00 H TER 2073 ALA A 134 ATOM 2074 N MET B 1 33.341 35.231 -2.187 1.00 27.85 N ATOM 2075 CA MET B 1 34.060 33.946 -2.422 1.00 25.04 C ATOM 2076 C MET B 1 34.996 33.341 -1.412 1.00 20.53 C ATOM 2077 O MET B 1 36.119 33.797 -1.085 1.00 23.61 O ATOM 2078 CB MET B 1 35.072 34.204 -3.585 1.00 28.64 C ATOM 2079 CG MET B 1 35.275 32.875 -4.364 1.00 39.23 C ATOM 2080 SD MET B 1 36.894 32.114 -4.311 1.00128.03 S ATOM 2081 CE MET B 1 36.403 30.390 -4.127 1.00 84.96 C ATOM 2082 HA MET B 1 33.209 33.271 -2.514 1.00 0.00 H ATOM 2083 HB2 MET B 1 34.676 34.967 -4.255 1.00 0.00 H ATOM 2084 HB3 MET B 1 36.025 34.540 -3.176 1.00 0.00 H ATOM 2085 HG2 MET B 1 35.043 33.073 -5.410 1.00 0.00 H ATOM 2086 HG3 MET B 1 34.563 32.152 -3.965 1.00 0.00 H ATOM 2087 HE1 MET B 1 35.823 30.274 -3.211 1.00 0.00 H ATOM 2088 HE2 MET B 1 35.796 30.093 -4.982 1.00 0.00 H ATOM 2089 HE3 MET B 1 37.293 29.763 -4.077 1.00 0.00 H ATOM 2090 HN3 MET B 1 34.034 35.992 -2.037 1.00 0.00 H ATOM 2091 HN2 MET B 1 32.737 35.140 -1.345 1.00 0.00 H ATOM 2092 HN1 MET B 1 32.753 35.454 -3.015 1.00 0.00 H ATOM 2093 N LEU B 2 34.557 32.299 -0.752 1.00 14.16 N ATOM 2094 CA LEU B 2 35.157 31.875 0.504 1.00 12.16 C ATOM 2095 C LEU B 2 36.292 30.926 0.208 1.00 12.43 C ATOM 2096 O LEU B 2 36.272 30.225 -0.813 1.00 14.89 O ATOM 2097 CB LEU B 2 34.072 31.206 1.366 1.00 12.09 C ATOM 2098 CG LEU B 2 32.874 32.048 1.736 1.00 12.07 C ATOM 2099 CD1 LEU B 2 31.936 31.190 2.569 1.00 13.36 C ATOM 2100 CD2 LEU B 2 33.279 33.332 2.417 1.00 13.24 C ATOM 2101 HA LEU B 2 35.559 32.726 1.054 1.00 0.00 H ATOM 2102 HB2 LEU B 2 33.707 30.337 0.819 1.00 0.00 H ATOM 2103 HB3 LEU B 2 34.543 30.879 2.293 1.00 0.00 H ATOM 2104 HG LEU B 2 32.345 32.370 0.839 1.00 0.00 H ATOM 2105 HD21 LEU B 2 33.829 33.100 3.329 1.00 0.00 H ATOM 2106 HD22 LEU B 2 33.912 33.913 1.747 1.00 0.00 H ATOM 2107 HD23 LEU B 2 32.387 33.907 2.666 1.00 0.00 H ATOM 2108 HD11 LEU B 2 31.623 30.324 1.985 1.00 0.00 H ATOM 2109 HD12 LEU B 2 32.454 30.855 3.468 1.00 0.00 H ATOM 2110 HD13 LEU B 2 31.061 31.777 2.849 1.00 0.00 H ATOM 2111 H LEU B 2 33.756 31.759 -1.137 1.00 0.00 H ATOM 2112 N THR B 3 37.272 30.883 1.111 1.00 12.24 N ATOM 2113 CA THR B 3 38.526 30.215 0.827 1.00 13.70 C ATOM 2114 C THR B 3 38.757 28.920 1.579 1.00 13.03 C ATOM 2115 O THR B 3 39.681 28.151 1.274 1.00 18.79 O ATOM 2116 CB THR B 3 39.710 31.188 1.086 1.00 14.64 C ATOM 2117 OG1 THR B 3 39.680 31.617 2.424 1.00 14.73 O ATOM 2118 CG2 THR B 3 39.568 32.429 0.174 1.00 16.06 C ATOM 2119 HA THR B 3 38.466 29.931 -0.224 1.00 0.00 H ATOM 2120 HB THR B 3 40.647 30.672 0.876 1.00 0.00 H ATOM 2121 HG1 THR B 3 40.435 32.237 2.588 1.00 0.00 H ATOM 2122 HG23 THR B 3 39.589 32.116 -0.870 1.00 0.00 H ATOM 2123 HG21 THR B 3 38.622 32.928 0.386 1.00 0.00 H ATOM 2124 HG22 THR B 3 40.393 33.115 0.365 1.00 0.00 H ATOM 2125 H THR B 3 37.134 31.337 2.036 1.00 0.00 H ATOM 2126 N GLY B 4 37.954 28.636 2.587 1.00 11.96 N ATOM 2127 CA GLY B 4 38.180 27.532 3.494 1.00 11.62 C ATOM 2128 C GLY B 4 37.873 27.978 4.926 1.00 10.66 C ATOM 2129 O GLY B 4 37.209 29.001 5.095 1.00 11.20 O ATOM 2130 HA3 GLY B 4 39.220 27.213 3.427 1.00 0.00 H ATOM 2131 HA2 GLY B 4 37.529 26.701 3.224 1.00 0.00 H ATOM 2132 H GLY B 4 37.117 29.235 2.737 1.00 0.00 H ATOM 2133 N LEU B 5 38.340 27.202 5.892 1.00 11.54 N ATOM 2134 CA LEU B 5 38.144 27.541 7.280 1.00 11.58 C ATOM 2135 C LEU B 5 39.211 28.556 7.701 1.00 11.46 C ATOM 2136 O LEU B 5 40.400 28.332 7.543 1.00 17.58 O ATOM 2137 CB LEU B 5 38.188 26.339 8.205 1.00 14.80 C ATOM 2138 CG LEU B 5 37.648 26.647 9.653 1.00 18.16 C ATOM 2139 CD1 LEU B 5 36.157 26.537 9.614 1.00 21.51 C ATOM 2140 CD2 LEU B 5 38.424 25.817 10.645 1.00 31.73 C ATOM 2141 HA LEU B 5 37.144 27.964 7.371 1.00 0.00 H ATOM 2142 HB2 LEU B 5 37.580 25.545 7.770 1.00 0.00 H ATOM 2143 HB3 LEU B 5 39.221 26.001 8.285 1.00 0.00 H ATOM 2144 HG LEU B 5 37.821 27.663 10.009 1.00 0.00 H ATOM 2145 HD21 LEU B 5 38.290 24.760 10.416 1.00 0.00 H ATOM 2146 HD22 LEU B 5 39.482 26.072 10.582 1.00 0.00 H ATOM 2147 HD23 LEU B 5 38.059 26.021 11.652 1.00 0.00 H ATOM 2148 HD11 LEU B 5 35.759 27.257 8.899 1.00 0.00 H ATOM 2149 HD12 LEU B 5 35.876 25.529 9.310 1.00 0.00 H ATOM 2150 HD13 LEU B 5 35.753 26.745 10.605 1.00 0.00 H ATOM 2151 H LEU B 5 38.857 26.334 5.646 1.00 0.00 H ATOM 2152 N ASN B 6 38.771 29.634 8.289 1.00 9.22 N ATOM 2153 CA ASN B 6 39.671 30.651 8.813 1.00 9.17 C ATOM 2154 C ASN B 6 39.968 30.452 10.295 1.00 9.04 C ATOM 2155 O ASN B 6 41.126 30.540 10.697 1.00 10.08 O ATOM 2156 CB ASN B 6 39.046 32.031 8.574 1.00 9.81 C ATOM 2157 CG ASN B 6 39.987 33.134 8.943 1.00 10.24 C ATOM 2158 OD1 ASN B 6 39.994 33.659 10.039 1.00 10.73 O ATOM 2159 ND2 ASN B 6 40.803 33.515 7.980 1.00 14.49 N ATOM 2160 HA ASN B 6 40.624 30.570 8.290 1.00 0.00 H ATOM 2161 HB2 ASN B 6 38.787 32.124 7.519 1.00 0.00 H ATOM 2162 HB3 ASN B 6 38.143 32.120 9.178 1.00 0.00 H ATOM 2163 HD22 ASN B 6 40.770 33.044 7.054 1.00 0.00 H ATOM 2164 HD21 ASN B 6 41.480 34.287 8.147 1.00 0.00 H ATOM 2165 H ASN B 6 37.745 29.771 8.387 1.00 0.00 H ATOM 2166 N HIS B 7 38.932 30.214 11.120 1.00 8.79 N ATOM 2167 CA HIS B 7 39.164 29.903 12.524 1.00 8.63 C ATOM 2168 C HIS B 7 37.937 29.214 13.089 1.00 8.47 C ATOM 2169 O HIS B 7 36.846 29.309 12.536 1.00 8.85 O ATOM 2170 CB HIS B 7 39.554 31.138 13.344 1.00 9.31 C ATOM 2171 CG HIS B 7 38.603 32.271 13.381 1.00 8.62 C ATOM 2172 ND1 HIS B 7 38.592 33.312 12.484 1.00 9.04 N ATOM 2173 CD2 HIS B 7 37.643 32.644 14.276 1.00 9.29 C ATOM 2174 CE1 HIS B 7 37.682 34.228 12.826 1.00 9.33 C ATOM 2175 NE2 HIS B 7 37.043 33.833 13.910 1.00 9.46 N ATOM 2176 HA HIS B 7 40.017 29.228 12.591 1.00 0.00 H ATOM 2177 HB2 HIS B 7 39.709 30.810 14.372 1.00 0.00 H ATOM 2178 HB3 HIS B 7 40.493 31.515 12.938 1.00 0.00 H ATOM 2179 HD2 HIS B 7 37.382 32.075 15.168 1.00 0.00 H ATOM 2180 HE1 HIS B 7 37.496 35.159 12.291 1.00 0.00 H ATOM 2181 H HIS B 7 37.960 30.252 10.753 1.00 0.00 H ATOM 2182 N LEU B 8 38.171 28.527 14.209 1.00 8.43 N ATOM 2183 CA LEU B 8 37.132 27.878 15.007 1.00 8.44 C ATOM 2184 C LEU B 8 37.144 28.557 16.360 1.00 8.40 C ATOM 2185 O LEU B 8 38.191 28.628 16.991 1.00 9.31 O ATOM 2186 CB LEU B 8 37.508 26.414 15.166 1.00 9.20 C ATOM 2187 CG LEU B 8 36.709 25.547 16.177 1.00 9.84 C ATOM 2188 CD1 LEU B 8 35.238 25.544 15.765 1.00 10.73 C ATOM 2189 CD2 LEU B 8 37.261 24.150 16.231 1.00 11.26 C ATOM 2190 HA LEU B 8 36.147 27.950 14.546 1.00 0.00 H ATOM 2191 HB2 LEU B 8 37.402 25.947 14.187 1.00 0.00 H ATOM 2192 HB3 LEU B 8 38.554 26.382 15.471 1.00 0.00 H ATOM 2193 HG LEU B 8 36.801 25.969 17.178 1.00 0.00 H ATOM 2194 HD21 LEU B 8 37.191 23.695 15.243 1.00 0.00 H ATOM 2195 HD22 LEU B 8 38.305 24.185 16.543 1.00 0.00 H ATOM 2196 HD23 LEU B 8 36.686 23.561 16.945 1.00 0.00 H ATOM 2197 HD11 LEU B 8 34.858 26.566 15.771 1.00 0.00 H ATOM 2198 HD12 LEU B 8 35.144 25.126 14.763 1.00 0.00 H ATOM 2199 HD13 LEU B 8 34.666 24.938 16.468 1.00 0.00 H ATOM 2200 H LEU B 8 39.155 28.448 14.535 1.00 0.00 H ATOM 2201 N THR B 9 35.957 29.034 16.801 1.00 8.48 N ATOM 2202 CA THR B 9 35.870 29.687 18.109 1.00 8.37 C ATOM 2203 C THR B 9 34.917 28.872 18.969 1.00 8.08 C ATOM 2204 O THR B 9 33.786 28.600 18.577 1.00 8.52 O ATOM 2205 CB THR B 9 35.390 31.121 17.984 1.00 8.45 C ATOM 2206 OG1 THR B 9 36.411 31.805 17.231 1.00 9.94 O ATOM 2207 CG2 THR B 9 35.177 31.747 19.345 1.00 9.54 C ATOM 2208 HA THR B 9 36.858 29.728 18.567 1.00 0.00 H ATOM 2209 HB THR B 9 34.424 31.183 17.482 1.00 0.00 H ATOM 2210 HG1 THR B 9 36.154 32.754 17.115 1.00 0.00 H ATOM 2211 HG23 THR B 9 34.399 31.200 19.878 1.00 0.00 H ATOM 2212 HG21 THR B 9 36.107 31.704 19.913 1.00 0.00 H ATOM 2213 HG22 THR B 9 34.872 32.786 19.222 1.00 0.00 H ATOM 2214 H THR B 9 35.106 28.937 16.211 1.00 0.00 H ATOM 2215 N LEU B 10 35.389 28.503 20.172 1.00 8.57 N ATOM 2216 CA LEU B 10 34.632 27.734 21.125 1.00 8.23 C ATOM 2217 C LEU B 10 34.359 28.543 22.380 1.00 8.49 C ATOM 2218 O LEU B 10 35.245 29.129 22.979 1.00 9.63 O ATOM 2219 CB LEU B 10 35.407 26.493 21.574 1.00 9.32 C ATOM 2220 CG LEU B 10 35.794 25.546 20.457 1.00 9.55 C ATOM 2221 CD1 LEU B 10 36.556 24.368 21.029 1.00 11.10 C ATOM 2222 CD2 LEU B 10 34.587 25.033 19.648 1.00 10.34 C ATOM 2223 HA LEU B 10 33.704 27.455 20.626 1.00 0.00 H ATOM 2224 HB2 LEU B 10 36.320 26.824 22.070 1.00 0.00 H ATOM 2225 HB3 LEU B 10 34.788 25.945 22.284 1.00 0.00 H ATOM 2226 HG LEU B 10 36.420 26.113 19.768 1.00 0.00 H ATOM 2227 HD21 LEU B 10 33.907 24.499 20.312 1.00 0.00 H ATOM 2228 HD22 LEU B 10 34.067 25.879 19.197 1.00 0.00 H ATOM 2229 HD23 LEU B 10 34.936 24.360 18.865 1.00 0.00 H ATOM 2230 HD11 LEU B 10 37.456 24.727 21.528 1.00 0.00 H ATOM 2231 HD12 LEU B 10 35.926 23.843 21.747 1.00 0.00 H ATOM 2232 HD13 LEU B 10 36.832 23.689 20.222 1.00 0.00 H ATOM 2233 H LEU B 10 36.355 28.789 20.429 1.00 0.00 H ATOM 2234 N ALA B 11 33.076 28.566 22.802 1.00 8.88 N ATOM 2235 CA ALA B 11 32.734 29.081 24.117 1.00 8.78 C ATOM 2236 C ALA B 11 33.256 28.131 25.199 1.00 9.01 C ATOM 2237 O ALA B 11 33.127 26.915 25.085 1.00 9.42 O ATOM 2238 CB ALA B 11 31.208 29.155 24.239 1.00 9.93 C ATOM 2239 HA ALA B 11 33.181 30.067 24.244 1.00 0.00 H ATOM 2240 HB1 ALA B 11 30.815 29.819 23.469 1.00 0.00 H ATOM 2241 HB2 ALA B 11 30.786 28.158 24.112 1.00 0.00 H ATOM 2242 HB3 ALA B 11 30.942 29.541 25.223 1.00 0.00 H ATOM 2243 H ALA B 11 32.324 28.211 22.178 1.00 0.00 H ATOM 2244 N VAL B 12 33.851 28.698 26.248 1.00 9.00 N ATOM 2245 CA VAL B 12 34.409 27.889 27.339 1.00 9.51 C ATOM 2246 C VAL B 12 34.012 28.507 28.676 1.00 9.60 C ATOM 2247 O VAL B 12 34.150 29.714 28.885 1.00 10.91 O ATOM 2248 CB VAL B 12 35.947 27.721 27.234 1.00 10.10 C ATOM 2249 CG1 VAL B 12 36.274 27.015 25.907 1.00 10.98 C ATOM 2250 CG2 VAL B 12 36.719 29.026 27.362 1.00 11.01 C ATOM 2251 HA VAL B 12 33.993 26.885 27.261 1.00 0.00 H ATOM 2252 HB VAL B 12 36.271 27.117 28.081 1.00 0.00 H ATOM 2253 HG11 VAL B 12 35.791 26.038 25.888 1.00 0.00 H ATOM 2254 HG12 VAL B 12 35.908 27.618 25.076 1.00 0.00 H ATOM 2255 HG13 VAL B 12 37.353 26.890 25.820 1.00 0.00 H ATOM 2256 HG21 VAL B 12 36.413 29.707 26.568 1.00 0.00 H ATOM 2257 HG22 VAL B 12 36.508 29.478 28.331 1.00 0.00 H ATOM 2258 HG23 VAL B 12 37.787 28.825 27.278 1.00 0.00 H ATOM 2259 H VAL B 12 33.922 29.735 26.295 1.00 0.00 H ATOM 2260 N ALA B 13 33.586 27.666 29.621 1.00 10.40 N ATOM 2261 CA ALA B 13 33.253 28.192 30.954 1.00 11.12 C ATOM 2262 C ALA B 13 34.455 28.413 31.818 1.00 11.16 C ATOM 2263 O ALA B 13 34.433 29.289 32.682 1.00 14.63 O ATOM 2264 CB ALA B 13 32.319 27.158 31.648 1.00 14.28 C ATOM 2265 HA ALA B 13 32.776 29.163 30.824 1.00 0.00 H ATOM 2266 HB1 ALA B 13 31.415 27.030 31.053 1.00 0.00 H ATOM 2267 HB2 ALA B 13 32.837 26.203 31.734 1.00 0.00 H ATOM 2268 HB3 ALA B 13 32.053 27.520 32.641 1.00 0.00 H ATOM 2269 H ALA B 13 33.491 26.651 29.417 1.00 0.00 H ATOM 2270 N ASP B 14 35.492 27.585 31.659 1.00 11.27 N ATOM 2271 CA ASP B 14 36.678 27.562 32.472 1.00 11.82 C ATOM 2272 C ASP B 14 37.876 27.745 31.525 1.00 11.13 C ATOM 2273 O ASP B 14 38.398 26.761 30.997 1.00 11.21 O ATOM 2274 CB ASP B 14 36.755 26.276 33.278 1.00 13.82 C ATOM 2275 CG ASP B 14 37.882 26.149 34.247 1.00 16.46 C ATOM 2276 OD1 ASP B 14 38.891 26.824 34.162 1.00 15.85 O ATOM 2277 OD2 ASP B 14 37.739 25.263 35.155 1.00 20.51 O ATOM 2278 HA ASP B 14 36.672 28.366 33.208 1.00 0.00 H ATOM 2279 HB2 ASP B 14 35.826 26.184 33.840 1.00 0.00 H ATOM 2280 HB3 ASP B 14 36.834 25.449 32.572 1.00 0.00 H ATOM 2281 H ASP B 14 35.436 26.898 30.880 1.00 0.00 H ATOM 2282 N LEU B 15 38.212 28.990 31.244 1.00 11.14 N ATOM 2283 CA LEU B 15 39.252 29.276 30.284 1.00 10.99 C ATOM 2284 C LEU B 15 40.584 28.626 30.675 1.00 10.95 C ATOM 2285 O LEU B 15 41.220 28.012 29.801 1.00 11.17 O ATOM 2286 CB LEU B 15 39.343 30.772 30.040 1.00 12.25 C ATOM 2287 CG LEU B 15 40.492 31.246 29.150 1.00 12.58 C ATOM 2288 CD1 LEU B 15 40.271 30.713 27.734 1.00 12.73 C ATOM 2289 CD2 LEU B 15 40.566 32.775 29.128 1.00 14.48 C ATOM 2290 HA LEU B 15 38.990 28.820 29.330 1.00 0.00 H ATOM 2291 HB2 LEU B 15 38.410 31.090 29.575 1.00 0.00 H ATOM 2292 HB3 LEU B 15 39.450 31.261 31.009 1.00 0.00 H ATOM 2293 HG LEU B 15 41.434 30.868 29.548 1.00 0.00 H ATOM 2294 HD21 LEU B 15 39.630 33.177 28.740 1.00 0.00 H ATOM 2295 HD22 LEU B 15 40.729 33.144 30.141 1.00 0.00 H ATOM 2296 HD23 LEU B 15 41.391 33.088 28.488 1.00 0.00 H ATOM 2297 HD11 LEU B 15 40.246 29.624 27.757 1.00 0.00 H ATOM 2298 HD12 LEU B 15 39.324 31.091 27.348 1.00 0.00 H ATOM 2299 HD13 LEU B 15 41.086 31.046 27.091 1.00 0.00 H ATOM 2300 H LEU B 15 37.722 29.774 31.720 1.00 0.00 H ATOM 2301 N PRO B 16 41.039 28.693 31.932 1.00 11.58 N ATOM 2302 CA PRO B 16 42.270 27.981 32.289 1.00 12.33 C ATOM 2303 C PRO B 16 42.255 26.491 31.963 1.00 11.07 C ATOM 2304 O PRO B 16 43.213 25.925 31.450 1.00 11.42 O ATOM 2305 CB PRO B 16 42.383 28.252 33.820 1.00 12.91 C ATOM 2306 CG PRO B 16 41.687 29.560 33.980 1.00 12.80 C ATOM 2307 CD PRO B 16 40.511 29.479 33.061 1.00 13.02 C ATOM 2308 HA PRO B 16 43.126 28.330 31.711 1.00 0.00 H ATOM 2309 HD3 PRO B 16 39.673 28.970 33.537 1.00 0.00 H ATOM 2310 HD2 PRO B 16 40.195 30.471 32.737 1.00 0.00 H ATOM 2311 HG3 PRO B 16 42.343 30.382 33.694 1.00 0.00 H ATOM 2312 HG2 PRO B 16 41.361 29.699 35.011 1.00 0.00 H ATOM 2313 HB2 PRO B 16 41.886 27.470 34.394 1.00 0.00 H ATOM 2314 HB3 PRO B 16 43.426 28.322 34.130 1.00 0.00 H ATOM 2315 N ALA B 17 41.158 25.824 32.302 1.00 10.54 N ATOM 2316 CA ALA B 17 41.022 24.398 32.037 1.00 10.64 C ATOM 2317 C ALA B 17 41.068 24.084 30.556 1.00 10.50 C ATOM 2318 O ALA B 17 41.662 23.102 30.118 1.00 11.02 O ATOM 2319 CB ALA B 17 39.769 23.823 32.666 1.00 11.96 C ATOM 2320 HA ALA B 17 41.883 23.918 32.503 1.00 0.00 H ATOM 2321 HB1 ALA B 17 39.807 23.968 33.746 1.00 0.00 H ATOM 2322 HB2 ALA B 17 38.894 24.331 32.260 1.00 0.00 H ATOM 2323 HB3 ALA B 17 39.708 22.758 32.443 1.00 0.00 H ATOM 2324 H ALA B 17 40.378 26.331 32.767 1.00 0.00 H ATOM 2325 N SER B 18 40.408 24.923 29.771 1.00 9.93 N ATOM 2326 CA SER B 18 40.393 24.708 28.335 1.00 9.88 C ATOM 2327 C SER B 18 41.736 24.957 27.700 1.00 9.97 C ATOM 2328 O SER B 18 42.167 24.178 26.849 1.00 10.19 O ATOM 2329 CB SER B 18 39.311 25.584 27.699 1.00 9.99 C ATOM 2330 OG SER B 18 38.065 25.191 28.191 1.00 11.75 O ATOM 2331 HA SER B 18 40.162 23.658 28.155 1.00 0.00 H ATOM 2332 HB2 SER B 18 39.332 25.463 26.616 1.00 0.00 H ATOM 2333 HB3 SER B 18 39.491 26.629 27.950 1.00 0.00 H ATOM 2334 HG SER B 18 37.905 24.241 27.962 1.00 0.00 H ATOM 2335 H SER B 18 39.902 25.733 30.182 1.00 0.00 H ATOM 2336 N ILE B 19 42.446 26.008 28.137 1.00 10.78 N ATOM 2337 CA ILE B 19 43.808 26.204 27.614 1.00 11.20 C ATOM 2338 C ILE B 19 44.638 24.995 27.937 1.00 11.50 C ATOM 2339 O ILE B 19 45.390 24.487 27.082 1.00 12.26 O ATOM 2340 CB ILE B 19 44.393 27.494 28.193 1.00 11.83 C ATOM 2341 CG1 ILE B 19 43.651 28.725 27.662 1.00 12.71 C ATOM 2342 CG2 ILE B 19 45.862 27.585 27.880 1.00 12.89 C ATOM 2343 CD1 ILE B 19 44.035 30.013 28.384 1.00 13.87 C ATOM 2344 HA ILE B 19 43.797 26.313 26.530 1.00 0.00 H ATOM 2345 HB ILE B 19 44.266 27.470 29.275 1.00 0.00 H ATOM 2346 HG12 ILE B 19 43.881 28.839 26.603 1.00 0.00 H ATOM 2347 HG13 ILE B 19 42.580 28.564 27.785 1.00 0.00 H ATOM 2348 HD11 ILE B 19 43.801 29.917 29.444 1.00 0.00 H ATOM 2349 HD12 ILE B 19 45.103 30.192 28.261 1.00 0.00 H ATOM 2350 HD13 ILE B 19 43.474 30.846 27.960 1.00 0.00 H ATOM 2351 HG21 ILE B 19 46.379 26.731 28.317 1.00 0.00 H ATOM 2352 HG22 ILE B 19 46.003 27.582 26.799 1.00 0.00 H ATOM 2353 HG23 ILE B 19 46.265 28.508 28.298 1.00 0.00 H ATOM 2354 H ILE B 19 42.043 26.670 28.830 1.00 0.00 H ATOM 2355 N ALA B 20 44.577 24.510 29.189 1.00 11.35 N ATOM 2356 CA ALA B 20 45.424 23.383 29.570 1.00 11.43 C ATOM 2357 C ALA B 20 45.136 22.183 28.704 1.00 10.98 C ATOM 2358 O ALA B 20 46.010 21.407 28.326 1.00 12.66 O ATOM 2359 CB ALA B 20 45.300 23.046 31.030 1.00 13.12 C ATOM 2360 HA ALA B 20 46.459 23.684 29.405 1.00 0.00 H ATOM 2361 HB1 ALA B 20 45.595 23.909 31.627 1.00 0.00 H ATOM 2362 HB2 ALA B 20 44.266 22.784 31.255 1.00 0.00 H ATOM 2363 HB3 ALA B 20 45.949 22.202 31.263 1.00 0.00 H ATOM 2364 H ALA B 20 43.930 24.935 29.883 1.00 0.00 H ATOM 2365 N PHE B 21 43.840 21.913 28.445 1.00 10.92 N ATOM 2366 CA PHE B 21 43.449 20.786 27.635 1.00 10.43 C ATOM 2367 C PHE B 21 43.990 20.893 26.202 1.00 9.82 C ATOM 2368 O PHE B 21 44.651 19.974 25.698 1.00 10.94 O ATOM 2369 CB PHE B 21 41.916 20.725 27.634 1.00 10.19 C ATOM 2370 CG PHE B 21 41.333 19.571 26.853 1.00 10.30 C ATOM 2371 CD1 PHE B 21 41.156 18.356 27.451 1.00 12.42 C ATOM 2372 CD2 PHE B 21 40.955 19.726 25.534 1.00 11.04 C ATOM 2373 CE1 PHE B 21 40.528 17.314 26.763 1.00 13.24 C ATOM 2374 CE2 PHE B 21 40.332 18.732 24.837 1.00 11.75 C ATOM 2375 CZ PHE B 21 40.146 17.511 25.450 1.00 12.95 C ATOM 2376 HA PHE B 21 43.872 19.873 28.054 1.00 0.00 H ATOM 2377 HB2 PHE B 21 41.578 20.642 28.667 1.00 0.00 H ATOM 2378 HB3 PHE B 21 41.539 21.652 27.203 1.00 0.00 H ATOM 2379 HD2 PHE B 21 41.161 20.672 25.034 1.00 0.00 H ATOM 2380 HE2 PHE B 21 39.988 18.900 23.816 1.00 0.00 H ATOM 2381 HZ PHE B 21 39.692 16.692 24.892 1.00 0.00 H ATOM 2382 HE1 PHE B 21 40.342 16.359 27.255 1.00 0.00 H ATOM 2383 HD1 PHE B 21 41.507 18.198 28.471 1.00 0.00 H ATOM 2384 H PHE B 21 43.104 22.533 28.839 1.00 0.00 H ATOM 2385 N TYR B 22 43.700 22.003 25.538 1.00 9.92 N ATOM 2386 CA TYR B 22 44.129 22.118 24.129 1.00 10.27 C ATOM 2387 C TYR B 22 45.629 22.239 24.001 1.00 11.03 C ATOM 2388 O TYR B 22 46.211 21.642 23.084 1.00 12.11 O ATOM 2389 CB TYR B 22 43.419 23.311 23.456 1.00 10.32 C ATOM 2390 CG TYR B 22 41.953 22.950 23.180 1.00 9.30 C ATOM 2391 CD1 TYR B 22 40.927 23.329 23.996 1.00 10.15 C ATOM 2392 CD2 TYR B 22 41.640 22.171 22.068 1.00 10.09 C ATOM 2393 CE1 TYR B 22 39.592 22.998 23.757 1.00 9.76 C ATOM 2394 CE2 TYR B 22 40.323 21.786 21.824 1.00 9.87 C ATOM 2395 CZ TYR B 22 39.307 22.198 22.664 1.00 9.17 C ATOM 2396 OH TYR B 22 38.040 21.787 22.380 1.00 9.49 O ATOM 2397 HA TYR B 22 43.842 21.200 23.617 1.00 0.00 H ATOM 2398 HB3 TYR B 22 43.918 23.547 22.516 1.00 0.00 H ATOM 2399 HB2 TYR B 22 43.461 24.178 24.116 1.00 0.00 H ATOM 2400 HD2 TYR B 22 42.430 21.861 21.384 1.00 0.00 H ATOM 2401 HE2 TYR B 22 40.093 21.156 20.965 1.00 0.00 H ATOM 2402 HE1 TYR B 22 38.798 23.359 24.411 1.00 0.00 H ATOM 2403 HD1 TYR B 22 41.162 23.921 24.881 1.00 0.00 H ATOM 2404 HH TYR B 22 37.416 22.152 23.057 1.00 0.00 H ATOM 2405 H TYR B 22 43.181 22.777 26.000 1.00 0.00 H ATOM 2406 N ARG B 23 46.278 22.978 24.898 1.00 12.12 N ATOM 2407 CA ARG B 23 47.744 23.144 24.805 1.00 14.13 C ATOM 2408 C ARG B 23 48.432 21.912 25.282 1.00 14.75 C ATOM 2409 O ARG B 23 49.237 21.290 24.581 1.00 19.11 O ATOM 2410 CB ARG B 23 48.117 24.405 25.603 1.00 16.17 C ATOM 2411 CG ARG B 23 49.624 24.687 25.578 1.00 20.55 C ATOM 2412 CD ARG B 23 50.064 25.595 26.673 1.00 26.31 C ATOM 2413 NE ARG B 23 49.527 25.295 27.967 1.00 33.80 N ATOM 2414 CZ ARG B 23 49.375 26.043 29.033 1.00 36.64 C ATOM 2415 NH1 ARG B 23 49.802 27.320 29.040 1.00 41.29 N ATOM 2416 NH2 ARG B 23 48.795 25.444 30.071 1.00 42.17 N ATOM 2417 HA ARG B 23 48.072 23.281 23.775 1.00 0.00 H ATOM 2418 HB2 ARG B 23 47.593 25.259 25.174 1.00 0.00 H ATOM 2419 HB3 ARG B 23 47.803 24.271 26.638 1.00 0.00 H ATOM 2420 HG2 ARG B 23 50.156 23.741 25.676 1.00 0.00 H ATOM 2421 HG3 ARG B 23 49.876 25.147 24.622 1.00 0.00 H ATOM 2422 HD2 ARG B 23 49.765 26.610 26.411 1.00 0.00 H ATOM 2423 HD3 ARG B 23 51.151 25.543 26.738 1.00 0.00 H ATOM 2424 HE ARG B 23 49.201 24.314 28.080 1.00 0.00 H ATOM 2425 HH12 ARG B 23 49.677 27.905 29.890 1.00 0.00 H ATOM 2426 HH11 ARG B 23 50.257 27.721 28.195 1.00 0.00 H ATOM 2427 HH22 ARG B 23 48.639 25.970 30.954 1.00 0.00 H ATOM 2428 HH21 ARG B 23 48.498 24.450 29.999 1.00 0.00 H ATOM 2429 H ARG B 23 45.752 23.440 25.667 1.00 0.00 H ATOM 2430 N ASP B 24 48.244 21.566 26.550 1.00 15.25 N ATOM 2431 CA ASP B 24 49.133 20.598 27.186 1.00 17.63 C ATOM 2432 C ASP B 24 48.678 19.222 26.825 1.00 17.04 C ATOM 2433 O ASP B 24 49.569 18.352 26.680 1.00 24.31 O ATOM 2434 CB ASP B 24 49.174 20.816 28.699 1.00 20.90 C ATOM 2435 CG ASP B 24 49.761 22.181 29.049 1.00 23.98 C ATOM 2436 OD1 ASP B 24 50.565 22.699 28.251 1.00 24.89 O ATOM 2437 OD2 ASP B 24 49.359 22.688 30.132 1.00 30.03 O ATOM 2438 HA ASP B 24 50.153 20.731 26.827 1.00 0.00 H ATOM 2439 HB2 ASP B 24 48.160 20.754 29.094 1.00 0.00 H ATOM 2440 HB3 ASP B 24 49.788 20.038 29.153 1.00 0.00 H ATOM 2441 H ASP B 24 47.462 21.986 27.092 1.00 0.00 H ATOM 2442 N LEU B 25 47.411 18.911 26.656 1.00 15.99 N ATOM 2443 CA LEU B 25 47.033 17.551 26.308 1.00 17.29 C ATOM 2444 C LEU B 25 47.018 17.316 24.804 1.00 17.01 C ATOM 2445 O LEU B 25 47.480 16.290 24.301 1.00 23.38 O ATOM 2446 CB LEU B 25 45.710 17.175 26.916 1.00 16.77 C ATOM 2447 CG LEU B 25 45.198 15.757 26.836 1.00 19.51 C ATOM 2448 CD1 LEU B 25 46.138 14.741 27.492 1.00 19.30 C ATOM 2449 CD2 LEU B 25 43.862 15.786 27.588 1.00 24.63 C ATOM 2450 HA LEU B 25 47.802 16.903 26.728 1.00 0.00 H ATOM 2451 HB2 LEU B 25 45.772 17.424 27.975 1.00 0.00 H ATOM 2452 HB3 LEU B 25 44.958 17.805 26.440 1.00 0.00 H ATOM 2453 HG LEU B 25 45.111 15.442 25.796 1.00 0.00 H ATOM 2454 HD21 LEU B 25 44.033 16.099 28.618 1.00 0.00 H ATOM 2455 HD22 LEU B 25 43.187 16.490 27.101 1.00 0.00 H ATOM 2456 HD23 LEU B 25 43.419 14.790 27.578 1.00 0.00 H ATOM 2457 HD11 LEU B 25 47.108 14.771 26.995 1.00 0.00 H ATOM 2458 HD12 LEU B 25 46.261 14.989 28.546 1.00 0.00 H ATOM 2459 HD13 LEU B 25 45.712 13.742 27.400 1.00 0.00 H ATOM 2460 H LEU B 25 46.678 19.640 26.772 1.00 0.00 H ATOM 2461 N LEU B 26 46.456 18.259 24.049 1.00 13.77 N ATOM 2462 CA LEU B 26 46.305 18.078 22.620 1.00 13.93 C ATOM 2463 C LEU B 26 47.416 18.681 21.751 1.00 14.61 C ATOM 2464 O LEU B 26 47.459 18.415 20.543 1.00 19.81 O ATOM 2465 CB LEU B 26 44.994 18.649 22.090 1.00 13.83 C ATOM 2466 CG LEU B 26 43.700 18.001 22.619 1.00 16.80 C ATOM 2467 CD1 LEU B 26 42.526 18.466 21.774 1.00 13.25 C ATOM 2468 CD2 LEU B 26 43.776 16.502 22.775 1.00 18.99 C ATOM 2469 HA LEU B 26 46.343 16.992 22.532 1.00 0.00 H ATOM 2470 HB2 LEU B 26 44.965 19.708 22.348 1.00 0.00 H ATOM 2471 HB3 LEU B 26 45.000 18.541 21.005 1.00 0.00 H ATOM 2472 HG LEU B 26 43.549 18.344 23.643 1.00 0.00 H ATOM 2473 HD21 LEU B 26 43.989 16.048 21.807 1.00 0.00 H ATOM 2474 HD22 LEU B 26 44.570 16.251 23.478 1.00 0.00 H ATOM 2475 HD23 LEU B 26 42.824 16.128 23.152 1.00 0.00 H ATOM 2476 HD11 LEU B 26 42.443 19.551 21.835 1.00 0.00 H ATOM 2477 HD12 LEU B 26 42.686 18.170 20.737 1.00 0.00 H ATOM 2478 HD13 LEU B 26 41.609 18.009 22.146 1.00 0.00 H ATOM 2479 H LEU B 26 46.121 19.138 24.492 1.00 0.00 H ATOM 2480 N GLY B 27 48.309 19.455 22.315 1.00 13.80 N ATOM 2481 CA GLY B 27 49.470 19.917 21.583 1.00 14.38 C ATOM 2482 C GLY B 27 49.293 21.142 20.790 1.00 13.82 C ATOM 2483 O GLY B 27 50.130 21.464 19.948 1.00 15.47 O ATOM 2484 HA3 GLY B 27 49.773 19.121 20.903 1.00 0.00 H ATOM 2485 HA2 GLY B 27 50.267 20.100 22.304 1.00 0.00 H ATOM 2486 H GLY B 27 48.182 19.743 23.306 1.00 0.00 H ATOM 2487 N PHE B 28 48.198 21.902 20.949 1.00 12.73 N ATOM 2488 CA PHE B 28 48.090 23.210 20.358 1.00 12.23 C ATOM 2489 C PHE B 28 49.162 24.148 20.936 1.00 12.73 C ATOM 2490 O PHE B 28 49.511 24.029 22.121 1.00 14.60 O ATOM 2491 CB PHE B 28 46.715 23.817 20.576 1.00 11.36 C ATOM 2492 CG PHE B 28 45.558 23.257 19.760 1.00 11.75 C ATOM 2493 CD1 PHE B 28 45.099 21.978 19.919 1.00 12.75 C ATOM 2494 CD2 PHE B 28 44.924 24.083 18.861 1.00 13.05 C ATOM 2495 CE1 PHE B 28 44.036 21.524 19.149 1.00 13.68 C ATOM 2496 CE2 PHE B 28 43.882 23.652 18.066 1.00 14.60 C ATOM 2497 CZ PHE B 28 43.455 22.377 18.241 1.00 13.56 C ATOM 2498 HA PHE B 28 48.243 23.093 19.285 1.00 0.00 H ATOM 2499 HB2 PHE B 28 46.464 23.687 21.629 1.00 0.00 H ATOM 2500 HB3 PHE B 28 46.789 24.881 20.350 1.00 0.00 H ATOM 2501 HD2 PHE B 28 45.257 25.117 18.773 1.00 0.00 H ATOM 2502 HE2 PHE B 28 43.421 24.309 17.328 1.00 0.00 H ATOM 2503 HZ PHE B 28 42.621 22.015 17.640 1.00 0.00 H ATOM 2504 HE1 PHE B 28 43.667 20.505 19.263 1.00 0.00 H ATOM 2505 HD1 PHE B 28 45.567 21.317 20.648 1.00 0.00 H ATOM 2506 H PHE B 28 47.406 21.536 21.515 1.00 0.00 H ATOM 2507 N ARG B 29 49.624 25.090 20.165 1.00 12.64 N ATOM 2508 CA ARG B 29 50.497 26.130 20.640 1.00 13.26 C ATOM 2509 C ARG B 29 49.671 27.309 21.102 1.00 13.19 C ATOM 2510 O ARG B 29 48.883 27.842 20.343 1.00 14.10 O ATOM 2511 CB ARG B 29 51.502 26.527 19.533 1.00 17.53 C ATOM 2512 CG ARG B 29 52.593 27.440 20.076 1.00 25.43 C ATOM 2513 CD ARG B 29 53.627 27.687 18.983 1.00 28.38 C ATOM 2514 NE ARG B 29 53.974 29.060 18.811 1.00 38.01 N ATOM 2515 CZ ARG B 29 54.730 29.775 18.016 1.00 43.84 C ATOM 2516 NH1 ARG B 29 55.506 29.309 17.030 1.00 53.17 N ATOM 2517 NH2 ARG B 29 54.743 31.112 18.206 1.00 54.14 N ATOM 2518 HA ARG B 29 51.076 25.770 21.491 1.00 0.00 H ATOM 2519 HB2 ARG B 29 51.962 25.624 19.131 1.00 0.00 H ATOM 2520 HB3 ARG B 29 50.967 27.046 18.738 1.00 0.00 H ATOM 2521 HG2 ARG B 29 52.155 28.389 20.385 1.00 0.00 H ATOM 2522 HG3 ARG B 29 53.073 26.966 20.932 1.00 0.00 H ATOM 2523 HD2 ARG B 29 53.226 27.314 18.041 1.00 0.00 H ATOM 2524 HD3 ARG B 29 54.532 27.134 19.235 1.00 0.00 H ATOM 2525 HE ARG B 29 53.493 29.660 19.512 1.00 0.00 H ATOM 2526 HH12 ARG B 29 56.069 29.968 16.456 1.00 0.00 H ATOM 2527 HH11 ARG B 29 55.546 28.288 16.838 1.00 0.00 H ATOM 2528 HH22 ARG B 29 55.329 31.718 17.597 1.00 0.00 H ATOM 2529 HH21 ARG B 29 54.167 31.536 18.961 1.00 0.00 H ATOM 2530 H ARG B 29 49.350 25.091 19.162 1.00 0.00 H ATOM 2531 N LEU B 30 49.911 27.760 22.334 1.00 14.04 N ATOM 2532 CA LEU B 30 49.259 28.958 22.856 1.00 14.02 C ATOM 2533 C LEU B 30 49.961 30.192 22.298 1.00 13.48 C ATOM 2534 O LEU B 30 51.119 30.416 22.562 1.00 17.44 O ATOM 2535 CB LEU B 30 49.247 28.932 24.397 1.00 14.20 C ATOM 2536 CG LEU B 30 48.643 30.152 25.046 1.00 16.11 C ATOM 2537 CD1 LEU B 30 47.140 30.318 24.814 1.00 14.61 C ATOM 2538 CD2 LEU B 30 48.893 30.080 26.587 1.00 17.47 C ATOM 2539 HA LEU B 30 48.218 28.991 22.536 1.00 0.00 H ATOM 2540 HB2 LEU B 30 48.677 28.060 24.717 1.00 0.00 H ATOM 2541 HB3 LEU B 30 50.276 28.838 24.743 1.00 0.00 H ATOM 2542 HG LEU B 30 49.128 31.010 24.581 1.00 0.00 H ATOM 2543 HD21 LEU B 30 48.427 29.180 26.988 1.00 0.00 H ATOM 2544 HD22 LEU B 30 49.966 30.052 26.779 1.00 0.00 H ATOM 2545 HD23 LEU B 30 48.460 30.958 27.066 1.00 0.00 H ATOM 2546 HD11 LEU B 30 46.945 30.399 23.745 1.00 0.00 H ATOM 2547 HD12 LEU B 30 46.614 29.452 25.216 1.00 0.00 H ATOM 2548 HD13 LEU B 30 46.794 31.221 25.317 1.00 0.00 H ATOM 2549 H LEU B 30 50.581 27.244 22.940 1.00 0.00 H ATOM 2550 N GLU B 31 49.256 30.969 21.513 1.00 13.73 N ATOM 2551 CA GLU B 31 49.847 32.163 20.898 1.00 13.86 C ATOM 2552 C GLU B 31 49.548 33.427 21.672 1.00 14.57 C ATOM 2553 O GLU B 31 50.372 34.348 21.701 1.00 17.92 O ATOM 2554 CB GLU B 31 49.389 32.310 19.430 1.00 15.10 C ATOM 2555 CG GLU B 31 49.960 31.175 18.598 1.00 18.36 C ATOM 2556 CD GLU B 31 51.421 31.388 18.222 1.00 23.38 C ATOM 2557 OE1 GLU B 31 51.953 32.496 18.461 1.00 26.85 O ATOM 2558 OE2 GLU B 31 52.042 30.455 17.667 1.00 31.12 O ATOM 2559 HA GLU B 31 50.928 32.022 20.921 1.00 0.00 H ATOM 2560 HB2 GLU B 31 48.300 32.280 19.385 1.00 0.00 H ATOM 2561 HB3 GLU B 31 49.741 33.262 19.034 1.00 0.00 H ATOM 2562 HG2 GLU B 31 49.880 30.250 19.170 1.00 0.00 H ATOM 2563 HG3 GLU B 31 49.375 31.087 17.683 1.00 0.00 H ATOM 2564 H GLU B 31 48.261 30.735 21.323 1.00 0.00 H ATOM 2565 N ALA B 32 48.381 33.512 22.310 1.00 13.97 N ATOM 2566 CA ALA B 32 48.042 34.698 23.083 1.00 14.31 C ATOM 2567 C ALA B 32 46.952 34.294 24.085 1.00 13.28 C ATOM 2568 O ALA B 32 46.126 33.397 23.819 1.00 12.69 O ATOM 2569 CB ALA B 32 47.538 35.847 22.226 1.00 16.07 C ATOM 2570 HA ALA B 32 48.945 35.057 23.577 1.00 0.00 H ATOM 2571 HB1 ALA B 32 48.309 36.130 21.509 1.00 0.00 H ATOM 2572 HB2 ALA B 32 46.641 35.534 21.692 1.00 0.00 H ATOM 2573 HB3 ALA B 32 47.304 36.699 22.864 1.00 0.00 H ATOM 2574 H ALA B 32 47.706 32.723 22.255 1.00 0.00 H ATOM 2575 N ARG B 33 46.952 34.960 25.250 1.00 13.41 N ATOM 2576 CA ARG B 33 45.995 34.700 26.293 1.00 13.11 C ATOM 2577 C ARG B 33 45.611 36.055 26.848 1.00 13.05 C ATOM 2578 O ARG B 33 46.505 36.885 27.024 1.00 15.84 O ATOM 2579 CB ARG B 33 46.598 33.815 27.374 1.00 14.22 C ATOM 2580 CG ARG B 33 45.615 33.526 28.500 1.00 13.20 C ATOM 2581 CD ARG B 33 46.241 32.636 29.573 1.00 14.10 C ATOM 2582 NE ARG B 33 45.298 32.325 30.610 1.00 13.49 N ATOM 2583 CZ ARG B 33 45.443 31.373 31.516 1.00 13.98 C ATOM 2584 NH1 ARG B 33 46.498 30.597 31.522 1.00 15.74 N ATOM 2585 NH2 ARG B 33 44.507 31.169 32.404 1.00 15.83 N ATOM 2586 HA ARG B 33 45.124 34.167 25.913 1.00 0.00 H ATOM 2587 HB2 ARG B 33 46.903 32.870 26.924 1.00 0.00 H ATOM 2588 HB3 ARG B 33 47.471 34.316 27.791 1.00 0.00 H ATOM 2589 HG2 ARG B 33 45.309 34.468 28.955 1.00 0.00 H ATOM 2590 HG3 ARG B 33 44.741 33.023 28.087 1.00 0.00 H ATOM 2591 HD2 ARG B 33 47.093 33.155 30.012 1.00 0.00 H ATOM 2592 HD3 ARG B 33 46.580 31.709 29.112 1.00 0.00 H ATOM 2593 HE ARG B 33 44.429 32.895 30.652 1.00 0.00 H ATOM 2594 HH12 ARG B 33 46.593 29.854 32.243 1.00 0.00 H ATOM 2595 HH11 ARG B 33 47.241 30.724 30.805 1.00 0.00 H ATOM 2596 HH22 ARG B 33 44.621 30.420 33.117 1.00 0.00 H ATOM 2597 HH21 ARG B 33 43.648 31.755 32.398 1.00 0.00 H ATOM 2598 H ARG B 33 47.673 35.694 25.405 1.00 0.00 H ATOM 2599 N TRP B 34 44.383 36.297 27.151 1.00 12.63 N ATOM 2600 CA TRP B 34 43.927 37.534 27.754 1.00 13.44 C ATOM 2601 C TRP B 34 42.819 37.225 28.719 1.00 12.90 C ATOM 2602 O TRP B 34 42.402 36.038 28.895 1.00 13.35 O ATOM 2603 CB TRP B 34 43.547 38.574 26.704 1.00 15.50 C ATOM 2604 CG TRP B 34 42.306 38.335 25.908 1.00 14.37 C ATOM 2605 CD1 TRP B 34 41.107 38.900 26.126 1.00 16.52 C ATOM 2606 CD2 TRP B 34 42.122 37.496 24.753 1.00 15.79 C ATOM 2607 NE1 TRP B 34 40.186 38.473 25.206 1.00 18.36 N ATOM 2608 CE2 TRP B 34 40.802 37.615 24.352 1.00 17.07 C ATOM 2609 CE3 TRP B 34 42.972 36.668 24.021 1.00 17.65 C ATOM 2610 CZ2 TRP B 34 40.259 36.933 23.255 1.00 18.67 C ATOM 2611 CZ3 TRP B 34 42.460 35.979 22.913 1.00 17.90 C ATOM 2612 CH2 TRP B 34 41.126 36.163 22.593 1.00 19.65 C ATOM 2613 HA TRP B 34 44.743 37.992 28.314 1.00 0.00 H ATOM 2614 HB2 TRP B 34 43.426 39.527 27.218 1.00 0.00 H ATOM 2615 HB3 TRP B 34 44.377 38.645 26.001 1.00 0.00 H ATOM 2616 HE1 TRP B 34 39.186 38.757 25.168 1.00 0.00 H ATOM 2617 HD1 TRP B 34 40.895 39.606 26.929 1.00 0.00 H ATOM 2618 HZ2 TRP B 34 39.212 37.024 22.965 1.00 0.00 H ATOM 2619 HH2 TRP B 34 40.748 35.630 21.720 1.00 0.00 H ATOM 2620 HZ3 TRP B 34 43.093 35.318 22.321 1.00 0.00 H ATOM 2621 HE3 TRP B 34 44.018 36.558 24.306 1.00 0.00 H ATOM 2622 H TRP B 34 43.676 35.561 26.951 1.00 0.00 H ATOM 2623 N ASP B 35 42.247 38.234 29.371 1.00 13.92 N ATOM 2624 CA ASP B 35 41.325 37.947 30.449 1.00 14.67 C ATOM 2625 C ASP B 35 40.064 37.229 29.985 1.00 13.34 C ATOM 2626 O ASP B 35 39.443 36.528 30.787 1.00 16.30 O ATOM 2627 CB ASP B 35 40.958 39.206 31.220 1.00 17.72 C ATOM 2628 CG ASP B 35 42.114 39.873 31.948 1.00 21.32 C ATOM 2629 OD1 ASP B 35 43.151 39.162 32.124 1.00 21.58 O ATOM 2630 OD2 ASP B 35 41.929 41.033 32.298 1.00 28.21 O ATOM 2631 HA ASP B 35 41.855 37.266 31.115 1.00 0.00 H ATOM 2632 HB2 ASP B 35 40.542 39.925 30.515 1.00 0.00 H ATOM 2633 HB3 ASP B 35 40.200 38.942 31.958 1.00 0.00 H ATOM 2634 H ASP B 35 42.460 39.218 29.109 1.00 0.00 H ATOM 2635 N GLN B 36 39.704 37.372 28.722 1.00 12.78 N ATOM 2636 CA GLN B 36 38.467 36.782 28.240 1.00 12.48 C ATOM 2637 C GLN B 36 38.681 35.760 27.143 1.00 11.43 C ATOM 2638 O GLN B 36 37.679 35.357 26.526 1.00 11.94 O ATOM 2639 CB GLN B 36 37.464 37.864 27.782 1.00 14.08 C ATOM 2640 CG GLN B 36 37.039 38.786 28.952 1.00 13.36 C ATOM 2641 CD GLN B 36 35.876 39.663 28.582 1.00 16.74 C ATOM 2642 OE1 GLN B 36 36.398 40.728 27.869 1.00 21.63 O ATOM 2643 NE2 GLN B 36 34.697 39.172 29.015 1.00 21.05 N ATOM 2644 HA GLN B 36 38.043 36.249 29.091 1.00 0.00 H ATOM 2645 HB2 GLN B 36 37.929 38.471 27.005 1.00 0.00 H ATOM 2646 HB3 GLN B 36 36.578 37.375 27.377 1.00 0.00 H ATOM 2647 HG2 GLN B 36 36.757 38.167 29.804 1.00 0.00 H ATOM 2648 HG3 GLN B 36 37.883 39.418 29.227 1.00 0.00 H ATOM 2649 HE22 GLN B 36 34.671 38.288 29.562 1.00 0.00 H ATOM 2650 HE21 GLN B 36 33.813 39.678 28.802 1.00 0.00 H ATOM 2651 H GLN B 36 40.309 37.910 28.069 1.00 0.00 H ATOM 2652 N GLY B 37 39.895 35.303 26.873 1.00 10.81 N ATOM 2653 CA GLY B 37 40.060 34.300 25.830 1.00 11.09 C ATOM 2654 C GLY B 37 41.485 33.883 25.615 1.00 10.65 C ATOM 2655 O GLY B 37 42.430 34.271 26.314 1.00 11.23 O ATOM 2656 HA3 GLY B 37 39.676 34.709 24.895 1.00 0.00 H ATOM 2657 HA2 GLY B 37 39.481 33.419 26.105 1.00 0.00 H ATOM 2658 H GLY B 37 40.720 35.656 27.399 1.00 0.00 H ATOM 2659 N ALA B 38 41.664 33.092 24.549 1.00 10.53 N ATOM 2660 CA ALA B 38 42.967 32.667 24.120 1.00 10.78 C ATOM 2661 C ALA B 38 42.937 32.336 22.641 1.00 10.57 C ATOM 2662 O ALA B 38 41.908 31.923 22.114 1.00 10.92 O ATOM 2663 CB ALA B 38 43.472 31.469 24.896 1.00 11.54 C ATOM 2664 HA ALA B 38 43.653 33.492 24.310 1.00 0.00 H ATOM 2665 HB1 ALA B 38 43.533 31.723 25.954 1.00 0.00 H ATOM 2666 HB2 ALA B 38 42.785 30.634 24.760 1.00 0.00 H ATOM 2667 HB3 ALA B 38 44.460 31.191 24.530 1.00 0.00 H ATOM 2668 H ALA B 38 40.831 32.775 24.014 1.00 0.00 H ATOM 2669 N TYR B 39 44.099 32.504 21.997 1.00 10.30 N ATOM 2670 CA TYR B 39 44.313 32.073 20.618 1.00 10.59 C ATOM 2671 C TYR B 39 45.365 30.996 20.627 1.00 11.16 C ATOM 2672 O TYR B 39 46.419 31.151 21.214 1.00 12.21 O ATOM 2673 CB TYR B 39 44.802 33.233 19.736 1.00 11.26 C ATOM 2674 CG TYR B 39 43.882 34.400 19.529 1.00 11.09 C ATOM 2675 CD1 TYR B 39 44.383 35.683 19.472 1.00 12.51 C ATOM 2676 CD2 TYR B 39 42.511 34.234 19.388 1.00 11.36 C ATOM 2677 CE1 TYR B 39 43.583 36.788 19.273 1.00 13.25 C ATOM 2678 CE2 TYR B 39 41.715 35.316 19.183 1.00 11.86 C ATOM 2679 CZ TYR B 39 42.231 36.607 19.120 1.00 13.06 C ATOM 2680 OH TYR B 39 41.423 37.698 18.923 1.00 14.09 O ATOM 2681 HA TYR B 39 43.369 31.710 20.210 1.00 0.00 H ATOM 2682 HB3 TYR B 39 45.027 32.820 18.753 1.00 0.00 H ATOM 2683 HB2 TYR B 39 45.717 33.618 20.185 1.00 0.00 H ATOM 2684 HD2 TYR B 39 42.074 33.237 19.442 1.00 0.00 H ATOM 2685 HE2 TYR B 39 40.642 35.169 19.064 1.00 0.00 H ATOM 2686 HE1 TYR B 39 44.016 37.788 19.238 1.00 0.00 H ATOM 2687 HD1 TYR B 39 45.457 35.830 19.589 1.00 0.00 H ATOM 2688 HH TYR B 39 40.763 37.756 19.659 1.00 0.00 H ATOM 2689 H TYR B 39 44.885 32.962 22.502 1.00 0.00 H ATOM 2690 N LEU B 40 45.039 29.879 19.946 1.00 10.98 N ATOM 2691 CA LEU B 40 45.950 28.756 19.825 1.00 10.92 C ATOM 2692 C LEU B 40 46.030 28.357 18.363 1.00 10.72 C ATOM 2693 O LEU B 40 45.153 28.632 17.572 1.00 11.19 O ATOM 2694 CB LEU B 40 45.529 27.580 20.697 1.00 11.82 C ATOM 2695 CG LEU B 40 45.297 27.887 22.166 1.00 11.96 C ATOM 2696 CD1 LEU B 40 43.895 28.261 22.557 1.00 13.44 C ATOM 2697 CD2 LEU B 40 45.815 26.725 23.043 1.00 13.73 C ATOM 2698 HA LEU B 40 46.935 29.058 20.181 1.00 0.00 H ATOM 2699 HB2 LEU B 40 44.601 27.178 20.290 1.00 0.00 H ATOM 2700 HB3 LEU B 40 46.310 26.822 20.634 1.00 0.00 H ATOM 2701 HG LEU B 40 45.871 28.796 22.346 1.00 0.00 H ATOM 2702 HD21 LEU B 40 45.284 25.810 22.781 1.00 0.00 H ATOM 2703 HD22 LEU B 40 46.883 26.590 22.871 1.00 0.00 H ATOM 2704 HD23 LEU B 40 45.642 26.959 24.093 1.00 0.00 H ATOM 2705 HD11 LEU B 40 43.594 29.156 22.013 1.00 0.00 H ATOM 2706 HD12 LEU B 40 43.220 27.441 22.312 1.00 0.00 H ATOM 2707 HD13 LEU B 40 43.858 28.456 23.629 1.00 0.00 H ATOM 2708 H LEU B 40 44.105 29.820 19.493 1.00 0.00 H ATOM 2709 N GLU B 41 47.109 27.606 18.039 1.00 11.19 N ATOM 2710 CA GLU B 41 47.291 27.162 16.663 1.00 11.24 C ATOM 2711 C GLU B 41 47.755 25.710 16.655 1.00 11.15 C ATOM 2712 O GLU B 41 48.593 25.306 17.446 1.00 12.86 O ATOM 2713 CB GLU B 41 48.308 28.059 15.961 1.00 12.88 C ATOM 2714 CG GLU B 41 48.381 27.805 14.453 1.00 14.76 C ATOM 2715 CD GLU B 41 49.264 28.762 13.705 1.00 16.44 C ATOM 2716 OE1 GLU B 41 50.389 29.042 14.122 1.00 21.87 O ATOM 2717 OE2 GLU B 41 48.875 29.279 12.659 1.00 17.48 O ATOM 2718 HA GLU B 41 46.345 27.230 16.127 1.00 0.00 H ATOM 2719 HB2 GLU B 41 48.028 29.099 16.126 1.00 0.00 H ATOM 2720 HB3 GLU B 41 49.292 27.876 16.393 1.00 0.00 H ATOM 2721 HG2 GLU B 41 48.761 26.796 14.295 1.00 0.00 H ATOM 2722 HG3 GLU B 41 47.373 27.881 14.045 1.00 0.00 H ATOM 2723 H GLU B 41 47.804 27.347 18.768 1.00 0.00 H ATOM 2724 N LEU B 42 47.222 24.940 15.715 1.00 11.60 N ATOM 2725 CA LEU B 42 47.543 23.573 15.466 1.00 12.25 C ATOM 2726 C LEU B 42 47.679 23.406 13.963 1.00 12.43 C ATOM 2727 O LEU B 42 46.706 23.448 13.256 1.00 11.99 O ATOM 2728 CB LEU B 42 46.446 22.615 15.984 1.00 12.64 C ATOM 2729 CG LEU B 42 46.767 21.135 15.778 1.00 12.76 C ATOM 2730 CD1 LEU B 42 47.819 20.688 16.795 1.00 16.70 C ATOM 2731 CD2 LEU B 42 45.489 20.307 15.862 1.00 14.21 C ATOM 2732 HA LEU B 42 48.466 23.323 15.990 1.00 0.00 H ATOM 2733 HB2 LEU B 42 46.312 22.792 17.051 1.00 0.00 H ATOM 2734 HB3 LEU B 42 45.517 22.841 15.460 1.00 0.00 H ATOM 2735 HG LEU B 42 47.186 20.980 14.784 1.00 0.00 H ATOM 2736 HD21 LEU B 42 45.034 20.442 16.843 1.00 0.00 H ATOM 2737 HD22 LEU B 42 44.794 20.635 15.089 1.00 0.00 H ATOM 2738 HD23 LEU B 42 45.729 19.254 15.714 1.00 0.00 H ATOM 2739 HD11 LEU B 42 48.726 21.277 16.660 1.00 0.00 H ATOM 2740 HD12 LEU B 42 47.434 20.837 17.804 1.00 0.00 H ATOM 2741 HD13 LEU B 42 48.044 19.632 16.643 1.00 0.00 H ATOM 2742 H LEU B 42 46.503 25.374 15.102 1.00 0.00 H ATOM 2743 N GLY B 43 48.902 23.254 13.475 1.00 14.56 N ATOM 2744 CA GLY B 43 49.060 23.289 12.022 1.00 15.67 C ATOM 2745 C GLY B 43 48.599 24.629 11.478 1.00 15.52 C ATOM 2746 O GLY B 43 48.978 25.706 11.956 1.00 17.46 O ATOM 2747 HA3 GLY B 43 48.463 22.494 11.575 1.00 0.00 H ATOM 2748 HA2 GLY B 43 50.110 23.139 11.770 1.00 0.00 H ATOM 2749 H GLY B 43 49.719 23.115 14.103 1.00 0.00 H ATOM 2750 N SER B 44 47.687 24.582 10.520 1.00 14.66 N ATOM 2751 CA SER B 44 47.092 25.795 9.995 1.00 15.11 C ATOM 2752 C SER B 44 45.839 26.217 10.774 1.00 13.15 C ATOM 2753 O SER B 44 45.276 27.289 10.470 1.00 13.56 O ATOM 2754 CB SER B 44 46.688 25.625 8.507 1.00 18.09 C ATOM 2755 OG SER B 44 45.673 24.599 8.394 1.00 22.02 O ATOM 2756 HA SER B 44 47.856 26.565 10.098 1.00 0.00 H ATOM 2757 HB2 SER B 44 47.563 25.336 7.924 1.00 0.00 H ATOM 2758 HB3 SER B 44 46.295 26.568 8.127 1.00 0.00 H ATOM 2759 HG SER B 44 46.031 23.743 8.738 1.00 0.00 H ATOM 2760 H SER B 44 47.393 23.661 10.138 1.00 0.00 H ATOM 2761 N LEU B 45 45.350 25.408 11.708 1.00 11.53 N ATOM 2762 CA LEU B 45 44.111 25.739 12.420 1.00 10.31 C ATOM 2763 C LEU B 45 44.341 26.800 13.484 1.00 10.40 C ATOM 2764 O LEU B 45 45.170 26.618 14.391 1.00 11.53 O ATOM 2765 CB LEU B 45 43.573 24.475 13.089 1.00 11.18 C ATOM 2766 CG LEU B 45 42.337 24.690 13.960 1.00 10.38 C ATOM 2767 CD1 LEU B 45 41.131 25.200 13.163 1.00 11.97 C ATOM 2768 CD2 LEU B 45 42.006 23.375 14.650 1.00 12.84 C ATOM 2769 HA LEU B 45 43.397 26.133 11.697 1.00 0.00 H ATOM 2770 HB2 LEU B 45 43.318 23.759 12.307 1.00 0.00 H ATOM 2771 HB3 LEU B 45 44.362 24.060 13.716 1.00 0.00 H ATOM 2772 HG LEU B 45 42.562 25.464 14.693 1.00 0.00 H ATOM 2773 HD21 LEU B 45 41.806 22.612 13.898 1.00 0.00 H ATOM 2774 HD22 LEU B 45 42.850 23.067 15.267 1.00 0.00 H ATOM 2775 HD23 LEU B 45 41.125 23.507 15.278 1.00 0.00 H ATOM 2776 HD11 LEU B 45 41.381 26.153 12.698 1.00 0.00 H ATOM 2777 HD12 LEU B 45 40.874 24.474 12.392 1.00 0.00 H ATOM 2778 HD13 LEU B 45 40.283 25.334 13.835 1.00 0.00 H ATOM 2779 H LEU B 45 45.853 24.527 11.938 1.00 0.00 H ATOM 2780 N TRP B 46 43.569 27.883 13.370 1.00 9.90 N ATOM 2781 CA TRP B 46 43.457 28.918 14.364 1.00 9.70 C ATOM 2782 C TRP B 46 42.235 28.579 15.257 1.00 9.19 C ATOM 2783 O TRP B 46 41.103 28.581 14.749 1.00 9.37 O ATOM 2784 CB TRP B 46 43.332 30.288 13.678 1.00 9.99 C ATOM 2785 CG TRP B 46 43.055 31.450 14.565 1.00 9.88 C ATOM 2786 CD1 TRP B 46 43.111 31.567 15.927 1.00 10.87 C ATOM 2787 CD2 TRP B 46 42.656 32.738 14.101 1.00 10.13 C ATOM 2788 NE1 TRP B 46 42.757 32.786 16.341 1.00 11.75 N ATOM 2789 CE2 TRP B 46 42.477 33.562 15.239 1.00 10.91 C ATOM 2790 CE3 TRP B 46 42.420 33.282 12.832 1.00 10.02 C ATOM 2791 CZ2 TRP B 46 42.077 34.883 15.120 1.00 11.96 C ATOM 2792 CZ3 TRP B 46 42.014 34.610 12.730 1.00 10.65 C ATOM 2793 CH2 TRP B 46 41.847 35.387 13.888 1.00 11.67 C ATOM 2794 HA TRP B 46 44.345 28.970 14.994 1.00 0.00 H ATOM 2795 HB2 TRP B 46 44.269 30.485 13.156 1.00 0.00 H ATOM 2796 HB3 TRP B 46 42.521 30.223 12.953 1.00 0.00 H ATOM 2797 HE1 TRP B 46 42.702 33.098 17.332 1.00 0.00 H ATOM 2798 HD1 TRP B 46 43.410 30.760 16.596 1.00 0.00 H ATOM 2799 HZ2 TRP B 46 41.950 35.505 16.006 1.00 0.00 H ATOM 2800 HH2 TRP B 46 41.524 36.423 13.790 1.00 0.00 H ATOM 2801 HZ3 TRP B 46 41.825 35.047 11.750 1.00 0.00 H ATOM 2802 HE3 TRP B 46 42.552 32.674 11.937 1.00 0.00 H ATOM 2803 H TRP B 46 43.008 27.986 12.500 1.00 0.00 H ATOM 2804 N LEU B 47 42.492 28.318 16.515 1.00 9.54 N ATOM 2805 CA LEU B 47 41.474 28.078 17.523 1.00 9.07 C ATOM 2806 C LEU B 47 41.397 29.284 18.441 1.00 9.20 C ATOM 2807 O LEU B 47 42.403 29.745 18.965 1.00 10.20 O ATOM 2808 CB LEU B 47 41.852 26.828 18.345 1.00 9.43 C ATOM 2809 CG LEU B 47 40.892 26.483 19.507 1.00 9.72 C ATOM 2810 CD1 LEU B 47 39.519 26.149 19.048 1.00 11.31 C ATOM 2811 CD2 LEU B 47 41.501 25.358 20.350 1.00 11.86 C ATOM 2812 HA LEU B 47 40.508 27.916 17.044 1.00 0.00 H ATOM 2813 HB2 LEU B 47 41.880 25.975 17.667 1.00 0.00 H ATOM 2814 HB3 LEU B 47 42.845 26.989 18.765 1.00 0.00 H ATOM 2815 HG LEU B 47 40.778 27.374 20.125 1.00 0.00 H ATOM 2816 HD21 LEU B 47 41.650 24.477 19.725 1.00 0.00 H ATOM 2817 HD22 LEU B 47 42.459 25.686 20.753 1.00 0.00 H ATOM 2818 HD23 LEU B 47 40.825 25.113 21.170 1.00 0.00 H ATOM 2819 HD11 LEU B 47 39.099 27.001 18.513 1.00 0.00 H ATOM 2820 HD12 LEU B 47 39.559 25.285 18.384 1.00 0.00 H ATOM 2821 HD13 LEU B 47 38.895 25.917 19.911 1.00 0.00 H ATOM 2822 H LEU B 47 43.488 28.280 16.811 1.00 0.00 H ATOM 2823 N CYS B 48 40.184 29.762 18.650 1.00 9.17 N ATOM 2824 CA CYS B 48 39.874 30.809 19.604 1.00 9.50 C ATOM 2825 C CYS B 48 39.045 30.205 20.741 1.00 9.17 C ATOM 2826 O CYS B 48 38.039 29.546 20.473 1.00 9.43 O ATOM 2827 CB CYS B 48 39.085 31.925 18.917 1.00 9.85 C ATOM 2828 SG CYS B 48 39.864 32.628 17.447 1.00 12.38 S ATOM 2829 HA CYS B 48 40.796 31.232 20.003 1.00 0.00 H ATOM 2830 HB2 CYS B 48 38.940 32.729 19.639 1.00 0.00 H ATOM 2831 HB3 CYS B 48 38.116 31.522 18.625 1.00 0.00 H ATOM 2832 HG CYS B 48 39.054 33.617 16.928 1.00 0.00 H ATOM 2833 H CYS B 48 39.401 29.362 18.095 1.00 0.00 H ATOM 2834 N LEU B 49 39.455 30.417 21.993 1.00 10.06 N ATOM 2835 CA LEU B 49 38.678 30.043 23.178 1.00 10.21 C ATOM 2836 C LEU B 49 38.113 31.360 23.715 1.00 10.81 C ATOM 2837 O LEU B 49 38.847 32.294 23.991 1.00 13.43 O ATOM 2838 CB LEU B 49 39.520 29.327 24.204 1.00 10.59 C ATOM 2839 CG LEU B 49 40.236 28.081 23.696 1.00 11.02 C ATOM 2840 CD1 LEU B 49 41.106 27.499 24.837 1.00 12.68 C ATOM 2841 CD2 LEU B 49 39.273 27.065 23.162 1.00 11.05 C ATOM 2842 HA LEU B 49 37.885 29.336 22.933 1.00 0.00 H ATOM 2843 HB2 LEU B 49 40.274 30.025 24.569 1.00 0.00 H ATOM 2844 HB3 LEU B 49 38.870 29.031 25.028 1.00 0.00 H ATOM 2845 HG LEU B 49 40.880 28.358 22.861 1.00 0.00 H ATOM 2846 HD21 LEU B 49 38.585 26.767 23.953 1.00 0.00 H ATOM 2847 HD22 LEU B 49 38.711 27.499 22.335 1.00 0.00 H ATOM 2848 HD23 LEU B 49 39.825 26.193 22.810 1.00 0.00 H ATOM 2849 HD11 LEU B 49 41.839 28.243 25.149 1.00 0.00 H ATOM 2850 HD12 LEU B 49 40.468 27.239 25.682 1.00 0.00 H ATOM 2851 HD13 LEU B 49 41.621 26.607 24.480 1.00 0.00 H ATOM 2852 H LEU B 49 40.378 30.874 22.136 1.00 0.00 H ATOM 2853 N SER B 50 36.792 31.413 23.893 1.00 9.99 N ATOM 2854 CA SER B 50 36.102 32.612 24.322 1.00 10.49 C ATOM 2855 C SER B 50 35.428 32.346 25.667 1.00 9.70 C ATOM 2856 O SER B 50 34.529 31.514 25.759 1.00 10.07 O ATOM 2857 CB SER B 50 35.074 33.021 23.286 1.00 11.63 C ATOM 2858 OG SER B 50 34.467 34.234 23.601 1.00 15.15 O ATOM 2859 HA SER B 50 36.818 33.427 24.433 1.00 0.00 H ATOM 2860 HB2 SER B 50 34.307 32.249 23.227 1.00 0.00 H ATOM 2861 HB3 SER B 50 35.568 33.115 22.319 1.00 0.00 H ATOM 2862 HG SER B 50 34.010 34.156 24.476 1.00 0.00 H ATOM 2863 H SER B 50 36.232 30.555 23.716 1.00 0.00 H ATOM 2864 N ARG B 51 35.887 33.026 26.732 1.00 10.73 N ATOM 2865 CA ARG B 51 35.325 32.810 28.051 1.00 11.31 C ATOM 2866 C ARG B 51 33.844 33.164 28.092 1.00 11.81 C ATOM 2867 O ARG B 51 33.455 34.259 27.669 1.00 14.27 O ATOM 2868 CB ARG B 51 36.130 33.634 29.059 1.00 14.29 C ATOM 2869 CG ARG B 51 35.666 33.418 30.500 1.00 17.74 C ATOM 2870 CD ARG B 51 36.536 34.262 31.440 1.00 24.24 C ATOM 2871 NE ARG B 51 36.046 34.086 32.799 1.00 28.86 N ATOM 2872 CZ ARG B 51 36.582 34.852 33.738 1.00 34.88 C ATOM 2873 NH1 ARG B 51 37.529 35.762 33.524 1.00 35.90 N ATOM 2874 NH2 ARG B 51 36.156 34.713 34.987 1.00 47.39 N ATOM 2875 HA ARG B 51 35.393 31.753 28.309 1.00 0.00 H ATOM 2876 HB2 ARG B 51 37.180 33.350 28.984 1.00 0.00 H ATOM 2877 HB3 ARG B 51 36.022 34.690 28.812 1.00 0.00 H ATOM 2878 HG2 ARG B 51 34.623 33.721 30.597 1.00 0.00 H ATOM 2879 HG3 ARG B 51 35.763 32.364 30.761 1.00 0.00 H ATOM 2880 HD2 ARG B 51 36.471 35.313 31.158 1.00 0.00 H ATOM 2881 HD3 ARG B 51 37.573 33.933 31.377 1.00 0.00 H ATOM 2882 HE ARG B 51 35.307 33.389 33.023 1.00 0.00 H ATOM 2883 HH12 ARG B 51 37.898 36.324 34.317 1.00 0.00 H ATOM 2884 HH11 ARG B 51 37.900 35.911 32.564 1.00 0.00 H ATOM 2885 HH22 ARG B 51 36.560 35.302 35.743 1.00 0.00 H ATOM 2886 HH21 ARG B 51 35.418 34.015 35.210 1.00 0.00 H ATOM 2887 H ARG B 51 36.655 33.716 26.608 1.00 0.00 H ATOM 2888 N GLU B 52 33.048 32.254 28.611 1.00 12.37 N ATOM 2889 CA GLU B 52 31.582 32.311 28.605 1.00 15.23 C ATOM 2890 C GLU B 52 31.100 31.869 29.991 1.00 17.03 C ATOM 2891 O GLU B 52 30.923 30.663 30.197 1.00 15.40 O ATOM 2892 CB GLU B 52 31.001 31.383 27.499 1.00 17.82 C ATOM 2893 CG GLU B 52 29.560 31.522 27.087 1.00 21.49 C ATOM 2894 CD GLU B 52 29.230 32.366 25.888 1.00 21.01 C ATOM 2895 OE1 GLU B 52 30.016 32.420 24.890 1.00 17.73 O ATOM 2896 OE2 GLU B 52 28.160 33.082 25.890 1.00 26.42 O ATOM 2897 HA GLU B 52 31.241 33.323 28.388 1.00 0.00 H ATOM 2898 HB2 GLU B 52 31.602 31.543 26.604 1.00 0.00 H ATOM 2899 HB3 GLU B 52 31.133 30.358 27.845 1.00 0.00 H ATOM 2900 HG2 GLU B 52 29.185 30.518 26.886 1.00 0.00 H ATOM 2901 HG3 GLU B 52 29.023 31.946 27.936 1.00 0.00 H ATOM 2902 H GLU B 52 33.493 31.429 29.061 1.00 0.00 H ATOM 2903 N PRO B 53 30.886 32.791 30.895 1.00 24.27 N ATOM 2904 CA PRO B 53 30.329 32.465 32.202 1.00 24.01 C ATOM 2905 C PRO B 53 29.128 31.551 32.188 1.00 21.36 C ATOM 2906 O PRO B 53 28.174 31.793 31.438 1.00 25.91 O ATOM 2907 CB PRO B 53 29.833 33.826 32.721 1.00 28.92 C ATOM 2908 CG PRO B 53 30.888 34.736 32.167 1.00 28.58 C ATOM 2909 CD PRO B 53 31.173 34.231 30.793 1.00 26.14 C ATOM 2910 HA PRO B 53 31.088 31.947 32.788 1.00 0.00 H ATOM 2911 HD3 PRO B 53 30.524 34.708 30.059 1.00 0.00 H ATOM 2912 HD2 PRO B 53 32.214 34.404 30.521 1.00 0.00 H ATOM 2913 HG3 PRO B 53 31.787 34.695 32.782 1.00 0.00 H ATOM 2914 HG2 PRO B 53 30.523 35.762 32.127 1.00 0.00 H ATOM 2915 HB2 PRO B 53 28.846 34.070 32.329 1.00 0.00 H ATOM 2916 HB3 PRO B 53 29.808 33.856 33.810 1.00 0.00 H ATOM 2917 N GLN B 54 29.121 30.564 33.021 1.00 24.62 N ATOM 2918 CA GLN B 54 27.987 29.664 33.228 1.00 22.30 C ATOM 2919 C GLN B 54 27.727 28.911 31.938 1.00 22.38 C ATOM 2920 O GLN B 54 26.672 28.267 31.883 1.00 27.56 O ATOM 2921 CB GLN B 54 26.732 30.389 33.738 1.00 27.47 C ATOM 2922 CG GLN B 54 26.751 30.917 35.183 1.00 26.30 C ATOM 2923 CD GLN B 54 27.155 32.379 35.069 1.00 27.84 C ATOM 2924 OE1 GLN B 54 26.759 32.951 34.067 1.00 26.32 O ATOM 2925 NE2 GLN B 54 27.886 32.875 36.076 1.00 30.13 N ATOM 2926 HA GLN B 54 28.242 28.958 34.018 1.00 0.00 H ATOM 2927 HB2 GLN B 54 26.558 31.242 33.081 1.00 0.00 H ATOM 2928 HB3 GLN B 54 25.897 29.693 33.656 1.00 0.00 H ATOM 2929 HG2 GLN B 54 25.764 30.827 35.636 1.00 0.00 H ATOM 2930 HG3 GLN B 54 27.476 30.366 35.782 1.00 0.00 H ATOM 2931 HE22 GLN B 54 28.153 32.264 36.874 1.00 0.00 H ATOM 2932 HE21 GLN B 54 28.186 33.871 36.059 1.00 0.00 H ATOM 2933 H GLN B 54 29.980 30.398 33.583 1.00 0.00 H ATOM 2934 N TYR B 55 28.563 28.881 30.907 1.00 18.04 N ATOM 2935 CA TYR B 55 28.324 28.053 29.766 1.00 17.02 C ATOM 2936 C TYR B 55 28.270 26.597 30.183 1.00 16.48 C ATOM 2937 O TYR B 55 29.116 26.105 30.951 1.00 16.79 O ATOM 2938 CB TYR B 55 29.425 28.271 28.706 1.00 15.68 C ATOM 2939 CG TYR B 55 29.310 27.442 27.472 1.00 13.89 C ATOM 2940 CD1 TYR B 55 28.188 27.534 26.663 1.00 14.85 C ATOM 2941 CD2 TYR B 55 30.290 26.557 27.076 1.00 13.99 C ATOM 2942 CE1 TYR B 55 28.054 26.771 25.531 1.00 14.18 C ATOM 2943 CE2 TYR B 55 30.178 25.785 25.956 1.00 14.24 C ATOM 2944 CZ TYR B 55 29.055 25.909 25.173 1.00 14.13 C ATOM 2945 OH TYR B 55 28.959 25.110 24.054 1.00 16.38 O ATOM 2946 HA TYR B 55 27.364 28.326 29.327 1.00 0.00 H ATOM 2947 HB3 TYR B 55 30.386 28.049 29.170 1.00 0.00 H ATOM 2948 HB2 TYR B 55 29.401 29.319 28.409 1.00 0.00 H ATOM 2949 HD2 TYR B 55 31.192 26.470 27.682 1.00 0.00 H ATOM 2950 HE2 TYR B 55 30.966 25.082 25.687 1.00 0.00 H ATOM 2951 HE1 TYR B 55 27.155 26.851 24.920 1.00 0.00 H ATOM 2952 HD1 TYR B 55 27.393 28.229 26.933 1.00 0.00 H ATOM 2953 HH TYR B 55 28.108 25.301 23.586 1.00 0.00 H ATOM 2954 H TYR B 55 29.415 29.476 30.930 1.00 0.00 H ATOM 2955 N GLY B 56 27.271 25.895 29.686 1.00 17.56 N ATOM 2956 CA GLY B 56 27.178 24.510 30.092 1.00 19.23 C ATOM 2957 C GLY B 56 27.533 23.508 29.022 1.00 15.36 C ATOM 2958 O GLY B 56 27.350 22.296 29.249 1.00 20.13 O ATOM 2959 HA3 GLY B 56 26.153 24.318 30.409 1.00 0.00 H ATOM 2960 HA2 GLY B 56 27.852 24.358 30.935 1.00 0.00 H ATOM 2961 H GLY B 56 26.582 26.318 29.032 1.00 0.00 H ATOM 2962 N GLY B 57 28.027 23.921 27.885 1.00 14.19 N ATOM 2963 CA GLY B 57 28.344 22.985 26.829 1.00 13.57 C ATOM 2964 C GLY B 57 27.215 22.858 25.888 1.00 11.77 C ATOM 2965 O GLY B 57 26.084 23.297 26.186 1.00 12.73 O ATOM 2966 HA3 GLY B 57 28.557 22.010 27.267 1.00 0.00 H ATOM 2967 HA2 GLY B 57 29.222 23.339 26.289 1.00 0.00 H ATOM 2968 H GLY B 57 28.195 24.937 27.737 1.00 0.00 H ATOM 2969 N PRO B 58 27.409 22.202 24.743 1.00 12.33 N ATOM 2970 CA PRO B 58 26.358 22.032 23.741 1.00 12.35 C ATOM 2971 C PRO B 58 25.381 20.953 24.275 1.00 12.55 C ATOM 2972 O PRO B 58 25.721 20.148 25.131 1.00 13.68 O ATOM 2973 CB PRO B 58 27.086 21.584 22.488 1.00 14.13 C ATOM 2974 CG PRO B 58 28.234 20.843 23.051 1.00 14.69 C ATOM 2975 CD PRO B 58 28.669 21.609 24.268 1.00 14.97 C ATOM 2976 HA PRO B 58 25.775 22.929 23.532 1.00 0.00 H ATOM 2977 HD3 PRO B 58 29.099 20.945 25.018 1.00 0.00 H ATOM 2978 HD2 PRO B 58 29.394 22.381 24.009 1.00 0.00 H ATOM 2979 HG3 PRO B 58 29.045 20.794 22.325 1.00 0.00 H ATOM 2980 HG2 PRO B 58 27.933 19.832 23.327 1.00 0.00 H ATOM 2981 HB2 PRO B 58 26.459 20.937 21.874 1.00 0.00 H ATOM 2982 HB3 PRO B 58 27.416 22.437 21.895 1.00 0.00 H ATOM 2983 N ALA B 59 24.215 20.945 23.688 1.00 14.14 N ATOM 2984 CA ALA B 59 23.259 19.862 23.900 1.00 13.12 C ATOM 2985 C ALA B 59 23.695 18.688 23.014 1.00 11.97 C ATOM 2986 O ALA B 59 24.684 18.759 22.261 1.00 11.76 O ATOM 2987 CB ALA B 59 21.839 20.335 23.588 1.00 17.20 C ATOM 2988 HA ALA B 59 23.248 19.541 24.942 1.00 0.00 H ATOM 2989 HB1 ALA B 59 21.583 21.168 24.242 1.00 0.00 H ATOM 2990 HB2 ALA B 59 21.785 20.658 22.548 1.00 0.00 H ATOM 2991 HB3 ALA B 59 21.140 19.515 23.752 1.00 0.00 H ATOM 2992 H ALA B 59 23.961 21.729 23.054 1.00 0.00 H ATOM 2993 N ALA B 60 22.995 17.596 23.136 1.00 13.18 N ATOM 2994 CA ALA B 60 23.399 16.363 22.494 1.00 14.51 C ATOM 2995 C ALA B 60 22.876 16.315 21.059 1.00 12.99 C ATOM 2996 O ALA B 60 21.705 16.254 20.756 1.00 16.88 O ATOM 2997 CB ALA B 60 22.904 15.140 23.260 1.00 20.23 C ATOM 2998 HA ALA B 60 24.489 16.341 22.487 1.00 0.00 H ATOM 2999 HB1 ALA B 60 23.316 15.153 24.269 1.00 0.00 H ATOM 3000 HB2 ALA B 60 21.815 15.161 23.311 1.00 0.00 H ATOM 3001 HB3 ALA B 60 23.228 14.235 22.746 1.00 0.00 H ATOM 3002 H ALA B 60 22.126 17.610 23.708 1.00 0.00 H ATOM 3003 N ASP B 61 23.798 16.341 20.137 1.00 11.85 N ATOM 3004 CA ASP B 61 23.584 16.286 18.709 1.00 11.47 C ATOM 3005 C ASP B 61 24.925 15.866 18.105 1.00 10.68 C ATOM 3006 O ASP B 61 25.895 15.625 18.835 1.00 11.34 O ATOM 3007 CB ASP B 61 23.037 17.566 18.126 1.00 12.77 C ATOM 3008 CG ASP B 61 23.950 18.735 18.360 1.00 11.61 C ATOM 3009 OD1 ASP B 61 25.035 18.791 17.741 1.00 12.58 O ATOM 3010 OD2 ASP B 61 23.616 19.562 19.228 1.00 14.03 O ATOM 3011 HA ASP B 61 22.804 15.565 18.465 1.00 0.00 H ATOM 3012 HB2 ASP B 61 22.904 17.434 17.052 1.00 0.00 H ATOM 3013 HB3 ASP B 61 22.072 17.777 18.587 1.00 0.00 H ATOM 3014 H ASP B 61 24.784 16.408 20.461 1.00 0.00 H ATOM 3015 N TYR B 62 24.980 15.729 16.768 1.00 9.98 N ATOM 3016 CA TYR B 62 26.196 15.183 16.162 1.00 9.96 C ATOM 3017 C TYR B 62 27.194 16.251 15.777 1.00 9.28 C ATOM 3018 O TYR B 62 28.210 15.916 15.152 1.00 10.78 O ATOM 3019 CB TYR B 62 25.827 14.309 14.950 1.00 11.71 C ATOM 3020 CG TYR B 62 26.860 13.254 14.633 1.00 12.59 C ATOM 3021 CD1 TYR B 62 27.199 12.293 15.581 1.00 13.23 C ATOM 3022 CD2 TYR B 62 27.496 13.180 13.420 1.00 12.88 C ATOM 3023 CE1 TYR B 62 28.133 11.320 15.360 1.00 14.21 C ATOM 3024 CE2 TYR B 62 28.453 12.187 13.160 1.00 12.94 C ATOM 3025 CZ TYR B 62 28.758 11.254 14.153 1.00 13.16 C ATOM 3026 OH TYR B 62 29.699 10.242 13.972 1.00 14.53 O ATOM 3027 HA TYR B 62 26.688 14.569 16.916 1.00 0.00 H ATOM 3028 HB3 TYR B 62 25.715 14.955 14.079 1.00 0.00 H ATOM 3029 HB2 TYR B 62 24.879 13.813 15.158 1.00 0.00 H ATOM 3030 HD2 TYR B 62 27.254 13.906 12.644 1.00 0.00 H ATOM 3031 HE2 TYR B 62 28.953 12.145 12.192 1.00 0.00 H ATOM 3032 HE1 TYR B 62 28.375 10.603 16.144 1.00 0.00 H ATOM 3033 HD1 TYR B 62 26.695 12.318 16.547 1.00 0.00 H ATOM 3034 HH TYR B 62 29.423 9.668 13.215 1.00 0.00 H ATOM 3035 H TYR B 62 24.172 16.006 16.175 1.00 0.00 H ATOM 3036 N THR B 63 26.983 17.527 16.104 1.00 8.86 N ATOM 3037 CA THR B 63 27.953 18.556 15.734 1.00 8.44 C ATOM 3038 C THR B 63 29.289 18.257 16.424 1.00 8.42 C ATOM 3039 O THR B 63 29.309 18.045 17.644 1.00 8.78 O ATOM 3040 CB THR B 63 27.464 19.938 16.173 1.00 8.52 C ATOM 3041 OG1 THR B 63 26.194 20.207 15.554 1.00 9.08 O ATOM 3042 CG2 THR B 63 28.442 21.055 15.795 1.00 9.50 C ATOM 3043 HA THR B 63 28.075 18.552 14.651 1.00 0.00 H ATOM 3044 HB THR B 63 27.380 19.923 17.260 1.00 0.00 H ATOM 3045 HG1 THR B 63 25.540 19.518 15.832 1.00 0.00 H ATOM 3046 HG23 THR B 63 29.409 20.862 16.259 1.00 0.00 H ATOM 3047 HG21 THR B 63 28.557 21.084 14.711 1.00 0.00 H ATOM 3048 HG22 THR B 63 28.053 22.011 16.147 1.00 0.00 H ATOM 3049 H THR B 63 26.123 17.791 16.625 1.00 0.00 H ATOM 3050 N HIS B 64 30.376 18.252 15.666 1.00 8.15 N ATOM 3051 CA HIS B 64 31.685 17.928 16.258 1.00 8.14 C ATOM 3052 C HIS B 64 32.796 18.421 15.333 1.00 8.08 C ATOM 3053 O HIS B 64 32.594 18.740 14.157 1.00 8.43 O ATOM 3054 CB HIS B 64 31.836 16.442 16.560 1.00 8.59 C ATOM 3055 CG HIS B 64 31.910 15.534 15.381 1.00 8.66 C ATOM 3056 ND1 HIS B 64 30.795 15.032 14.743 1.00 8.58 N ATOM 3057 CD2 HIS B 64 32.975 14.986 14.726 1.00 9.00 C ATOM 3058 CE1 HIS B 64 31.199 14.228 13.774 1.00 8.63 C ATOM 3059 NE2 HIS B 64 32.523 14.178 13.695 1.00 9.03 N ATOM 3060 HA HIS B 64 31.759 18.440 17.217 1.00 0.00 H ATOM 3061 HB2 HIS B 64 32.751 16.311 17.138 1.00 0.00 H ATOM 3062 HB3 HIS B 64 30.980 16.136 17.162 1.00 0.00 H ATOM 3063 HD2 HIS B 64 34.022 15.158 14.976 1.00 0.00 H ATOM 3064 HE1 HIS B 64 30.526 13.674 13.120 1.00 0.00 H ATOM 3065 H HIS B 64 30.305 18.477 14.653 1.00 0.00 H ATOM 3066 N TYR B 65 33.997 18.416 15.924 1.00 8.32 N ATOM 3067 CA TYR B 65 35.183 18.997 15.297 1.00 8.39 C ATOM 3068 C TYR B 65 36.271 17.939 15.275 1.00 8.23 C ATOM 3069 O TYR B 65 36.645 17.432 16.322 1.00 9.01 O ATOM 3070 CB TYR B 65 35.671 20.234 16.109 1.00 8.97 C ATOM 3071 CG TYR B 65 34.491 21.087 16.560 1.00 8.76 C ATOM 3072 CD1 TYR B 65 34.202 21.312 17.871 1.00 9.66 C ATOM 3073 CD2 TYR B 65 33.584 21.612 15.612 1.00 9.78 C ATOM 3074 CE1 TYR B 65 33.105 22.040 18.265 1.00 9.87 C ATOM 3075 CE2 TYR B 65 32.460 22.321 15.981 1.00 10.04 C ATOM 3076 CZ TYR B 65 32.246 22.544 17.318 1.00 8.82 C ATOM 3077 OH TYR B 65 31.120 23.259 17.712 1.00 9.57 O ATOM 3078 HA TYR B 65 34.946 19.322 14.284 1.00 0.00 H ATOM 3079 HB3 TYR B 65 36.328 20.836 15.482 1.00 0.00 H ATOM 3080 HB2 TYR B 65 36.220 19.892 16.986 1.00 0.00 H ATOM 3081 HD2 TYR B 65 33.780 21.451 14.552 1.00 0.00 H ATOM 3082 HE2 TYR B 65 31.761 22.694 15.232 1.00 0.00 H ATOM 3083 HE1 TYR B 65 32.917 22.217 19.324 1.00 0.00 H ATOM 3084 HD1 TYR B 65 34.863 20.901 18.634 1.00 0.00 H ATOM 3085 HH TYR B 65 31.107 23.335 18.699 1.00 0.00 H ATOM 3086 H TYR B 65 34.090 17.982 16.865 1.00 0.00 H ATOM 3087 N ALA B 66 36.736 17.596 14.080 1.00 8.31 N ATOM 3088 CA ALA B 66 37.725 16.501 13.948 1.00 8.75 C ATOM 3089 C ALA B 66 39.072 17.073 13.557 1.00 9.10 C ATOM 3090 O ALA B 66 39.177 17.894 12.623 1.00 9.84 O ATOM 3091 CB ALA B 66 37.281 15.533 12.873 1.00 9.54 C ATOM 3092 HA ALA B 66 37.803 15.983 14.904 1.00 0.00 H ATOM 3093 HB1 ALA B 66 36.312 15.113 13.142 1.00 0.00 H ATOM 3094 HB2 ALA B 66 37.198 16.060 11.923 1.00 0.00 H ATOM 3095 HB3 ALA B 66 38.014 14.731 12.783 1.00 0.00 H ATOM 3096 H ALA B 66 36.404 18.099 13.232 1.00 0.00 H ATOM 3097 N PHE B 67 40.114 16.607 14.246 1.00 9.32 N ATOM 3098 CA PHE B 67 41.503 16.920 14.009 1.00 9.39 C ATOM 3099 C PHE B 67 42.171 15.751 13.339 1.00 9.68 C ATOM 3100 O PHE B 67 41.844 14.585 13.593 1.00 11.04 O ATOM 3101 CB PHE B 67 42.224 17.227 15.338 1.00 10.46 C ATOM 3102 CG PHE B 67 41.483 18.280 16.151 1.00 10.47 C ATOM 3103 CD1 PHE B 67 40.990 17.951 17.405 1.00 12.89 C ATOM 3104 CD2 PHE B 67 41.285 19.523 15.674 1.00 12.37 C ATOM 3105 CE1 PHE B 67 40.275 18.898 18.126 1.00 14.16 C ATOM 3106 CE2 PHE B 67 40.570 20.492 16.390 1.00 13.31 C ATOM 3107 CZ PHE B 67 40.085 20.167 17.647 1.00 13.32 C ATOM 3108 HA PHE B 67 41.559 17.799 13.367 1.00 0.00 H ATOM 3109 HB2 PHE B 67 42.291 16.310 15.924 1.00 0.00 H ATOM 3110 HB3 PHE B 67 43.228 17.591 15.120 1.00 0.00 H ATOM 3111 HD2 PHE B 67 41.695 19.784 14.698 1.00 0.00 H ATOM 3112 HE2 PHE B 67 40.399 21.482 15.967 1.00 0.00 H ATOM 3113 HZ PHE B 67 39.560 20.911 18.246 1.00 0.00 H ATOM 3114 HE1 PHE B 67 39.856 18.626 19.095 1.00 0.00 H ATOM 3115 HD1 PHE B 67 41.162 16.958 17.821 1.00 0.00 H ATOM 3116 H PHE B 67 39.906 15.955 15.029 1.00 0.00 H ATOM 3117 N GLY B 68 43.144 16.013 12.449 1.00 9.94 N ATOM 3118 CA GLY B 68 43.838 14.944 11.797 1.00 10.65 C ATOM 3119 C GLY B 68 44.964 14.389 12.659 1.00 10.60 C ATOM 3120 O GLY B 68 45.510 15.053 13.538 1.00 11.29 O ATOM 3121 HA3 GLY B 68 44.259 15.315 10.863 1.00 0.00 H ATOM 3122 HA2 GLY B 68 43.130 14.143 11.582 1.00 0.00 H ATOM 3123 H GLY B 68 43.394 16.999 12.233 1.00 0.00 H ATOM 3124 N ILE B 69 45.306 13.147 12.342 1.00 10.87 N ATOM 3125 CA ILE B 69 46.437 12.463 13.009 1.00 11.46 C ATOM 3126 C ILE B 69 46.920 11.400 12.010 1.00 12.28 C ATOM 3127 O ILE B 69 46.141 10.822 11.241 1.00 12.47 O ATOM 3128 CB ILE B 69 45.987 11.842 14.340 1.00 11.56 C ATOM 3129 CG1 ILE B 69 47.173 11.283 15.124 1.00 13.07 C ATOM 3130 CG2 ILE B 69 44.913 10.740 14.185 1.00 12.25 C ATOM 3131 CD1 ILE B 69 46.868 11.012 16.564 1.00 14.10 C ATOM 3132 HA ILE B 69 47.243 13.151 13.263 1.00 0.00 H ATOM 3133 HB ILE B 69 45.530 12.663 14.892 1.00 0.00 H ATOM 3134 HG12 ILE B 69 47.486 10.349 14.656 1.00 0.00 H ATOM 3135 HG13 ILE B 69 47.989 12.004 15.074 1.00 0.00 H ATOM 3136 HD11 ILE B 69 46.564 11.939 17.050 1.00 0.00 H ATOM 3137 HD12 ILE B 69 46.060 10.283 16.632 1.00 0.00 H ATOM 3138 HD13 ILE B 69 47.758 10.617 17.054 1.00 0.00 H ATOM 3139 HG21 ILE B 69 44.028 11.162 13.709 1.00 0.00 H ATOM 3140 HG22 ILE B 69 45.309 9.933 13.569 1.00 0.00 H ATOM 3141 HG23 ILE B 69 44.648 10.352 15.168 1.00 0.00 H ATOM 3142 H ILE B 69 44.768 12.643 11.609 1.00 0.00 H ATOM 3143 N ALA B 70 48.219 11.119 12.045 1.00 12.89 N ATOM 3144 CA ALA B 70 48.812 10.078 11.238 1.00 13.97 C ATOM 3145 C ALA B 70 48.432 8.707 11.784 1.00 13.89 C ATOM 3146 O ALA B 70 48.336 8.514 12.999 1.00 13.94 O ATOM 3147 CB ALA B 70 50.330 10.203 11.241 1.00 16.59 C ATOM 3148 HA ALA B 70 48.439 10.185 10.220 1.00 0.00 H ATOM 3149 HB1 ALA B 70 50.614 11.173 10.834 1.00 0.00 H ATOM 3150 HB2 ALA B 70 50.699 10.114 12.263 1.00 0.00 H ATOM 3151 HB3 ALA B 70 50.760 9.411 10.628 1.00 0.00 H ATOM 3152 H ALA B 70 48.832 11.670 12.678 1.00 0.00 H ATOM 3153 N ALA B 71 48.321 7.720 10.899 1.00 15.08 N ATOM 3154 CA ALA B 71 48.036 6.363 11.304 1.00 15.37 C ATOM 3155 C ALA B 71 48.987 5.867 12.391 1.00 15.45 C ATOM 3156 O ALA B 71 48.584 5.209 13.364 1.00 16.51 O ATOM 3157 CB ALA B 71 48.095 5.387 10.110 1.00 17.66 C ATOM 3158 HA ALA B 71 47.024 6.384 11.708 1.00 0.00 H ATOM 3159 HB1 ALA B 71 47.359 5.684 9.363 1.00 0.00 H ATOM 3160 HB2 ALA B 71 49.092 5.412 9.671 1.00 0.00 H ATOM 3161 HB3 ALA B 71 47.875 4.377 10.457 1.00 0.00 H ATOM 3162 H ALA B 71 48.443 7.931 9.888 1.00 0.00 H ATOM 3163 N ALA B 72 50.274 6.146 12.221 1.00 16.52 N ATOM 3164 CA ALA B 72 51.280 5.649 13.145 1.00 16.82 C ATOM 3165 C ALA B 72 51.174 6.260 14.542 1.00 14.86 C ATOM 3166 O ALA B 72 51.746 5.702 15.475 1.00 17.71 O ATOM 3167 CB ALA B 72 52.691 5.948 12.620 1.00 22.66 C ATOM 3168 HA ALA B 72 51.099 4.577 13.218 1.00 0.00 H ATOM 3169 HB1 ALA B 72 52.828 5.463 11.654 1.00 0.00 H ATOM 3170 HB2 ALA B 72 52.815 7.025 12.508 1.00 0.00 H ATOM 3171 HB3 ALA B 72 53.428 5.568 13.327 1.00 0.00 H ATOM 3172 H ALA B 72 50.567 6.730 11.412 1.00 0.00 H ATOM 3173 N ASP B 73 50.433 7.365 14.694 1.00 14.88 N ATOM 3174 CA ASP B 73 50.275 7.988 16.015 1.00 14.60 C ATOM 3175 C ASP B 73 48.943 7.716 16.670 1.00 13.78 C ATOM 3176 O ASP B 73 48.717 8.048 17.810 1.00 13.20 O ATOM 3177 CB ASP B 73 50.495 9.495 15.924 1.00 15.64 C ATOM 3178 CG ASP B 73 51.909 9.900 15.567 1.00 17.60 C ATOM 3179 OD1 ASP B 73 52.880 9.268 16.093 1.00 17.83 O ATOM 3180 OD2 ASP B 73 52.105 10.805 14.729 1.00 18.48 O ATOM 3181 HA ASP B 73 51.034 7.527 16.647 1.00 0.00 H ATOM 3182 HB2 ASP B 73 49.824 9.892 15.163 1.00 0.00 H ATOM 3183 HB3 ASP B 73 50.248 9.935 16.890 1.00 0.00 H ATOM 3184 H ASP B 73 49.964 7.787 13.867 1.00 0.00 H ATOM 3185 N PHE B 74 47.989 7.163 15.931 1.00 13.15 N ATOM 3186 CA PHE B 74 46.609 7.047 16.378 1.00 13.00 C ATOM 3187 C PHE B 74 46.536 6.279 17.710 1.00 12.94 C ATOM 3188 O PHE B 74 45.881 6.684 18.675 1.00 13.38 O ATOM 3189 CB PHE B 74 45.736 6.398 15.303 1.00 13.12 C ATOM 3190 CG PHE B 74 44.321 6.236 15.799 1.00 12.14 C ATOM 3191 CD1 PHE B 74 43.447 7.345 15.737 1.00 11.58 C ATOM 3192 CD2 PHE B 74 43.878 5.058 16.323 1.00 12.71 C ATOM 3193 CE1 PHE B 74 42.180 7.224 16.241 1.00 11.19 C ATOM 3194 CE2 PHE B 74 42.607 4.972 16.848 1.00 12.98 C ATOM 3195 CZ PHE B 74 41.760 6.059 16.801 1.00 12.06 C ATOM 3196 HA PHE B 74 46.217 8.049 16.550 1.00 0.00 H ATOM 3197 HB2 PHE B 74 45.735 7.027 14.413 1.00 0.00 H ATOM 3198 HB3 PHE B 74 46.143 5.418 15.053 1.00 0.00 H ATOM 3199 HD2 PHE B 74 44.529 4.184 16.327 1.00 0.00 H ATOM 3200 HE2 PHE B 74 42.270 4.041 17.303 1.00 0.00 H ATOM 3201 HZ PHE B 74 40.754 5.984 17.213 1.00 0.00 H ATOM 3202 HE1 PHE B 74 41.499 8.073 16.193 1.00 0.00 H ATOM 3203 HD1 PHE B 74 43.777 8.284 15.294 1.00 0.00 H ATOM 3204 H PHE B 74 48.239 6.796 14.990 1.00 0.00 H ATOM 3205 N ALA B 75 47.110 5.070 17.740 1.00 13.86 N ATOM 3206 CA ALA B 75 46.906 4.194 18.897 1.00 14.77 C ATOM 3207 C ALA B 75 47.490 4.858 20.131 1.00 13.82 C ATOM 3208 O ALA B 75 46.885 4.805 21.210 1.00 14.37 O ATOM 3209 CB ALA B 75 47.410 2.773 18.665 1.00 16.15 C ATOM 3210 HA ALA B 75 45.836 4.064 19.058 1.00 0.00 H ATOM 3211 HB1 ALA B 75 46.880 2.334 17.819 1.00 0.00 H ATOM 3212 HB2 ALA B 75 48.479 2.798 18.452 1.00 0.00 H ATOM 3213 HB3 ALA B 75 47.230 2.175 19.558 1.00 0.00 H ATOM 3214 H ALA B 75 47.699 4.753 16.944 1.00 0.00 H ATOM 3215 N ARG B 76 48.678 5.448 20.002 1.00 14.63 N ATOM 3216 CA ARG B 76 49.294 6.043 21.181 1.00 15.03 C ATOM 3217 C ARG B 76 48.527 7.272 21.629 1.00 13.74 C ATOM 3218 O ARG B 76 48.492 7.509 22.844 1.00 15.41 O ATOM 3219 CB ARG B 76 50.767 6.357 20.989 1.00 17.49 C ATOM 3220 CG ARG B 76 51.188 7.474 20.129 1.00 18.18 C ATOM 3221 CD ARG B 76 52.715 7.232 19.751 1.00 23.54 C ATOM 3222 NE ARG B 76 53.091 8.405 18.963 1.00 21.69 N ATOM 3223 CZ ARG B 76 53.671 9.511 19.448 1.00 21.94 C ATOM 3224 NH1 ARG B 76 53.977 9.672 20.738 1.00 28.94 N ATOM 3225 NH2 ARG B 76 53.915 10.436 18.516 1.00 28.83 N ATOM 3226 HA ARG B 76 49.243 5.293 21.970 1.00 0.00 H ATOM 3227 HB2 ARG B 76 51.176 6.555 21.980 1.00 0.00 H ATOM 3228 HB3 ARG B 76 51.227 5.458 20.580 1.00 0.00 H ATOM 3229 HG2 ARG B 76 50.579 7.499 19.225 1.00 0.00 H ATOM 3230 HG3 ARG B 76 51.081 8.418 20.664 1.00 0.00 H ATOM 3231 HD2 ARG B 76 52.826 6.321 19.163 1.00 0.00 H ATOM 3232 HD3 ARG B 76 53.327 7.160 20.650 1.00 0.00 H ATOM 3233 HE ARG B 76 52.892 8.379 17.943 1.00 0.00 H ATOM 3234 HH12 ARG B 76 54.427 10.553 21.060 1.00 0.00 H ATOM 3235 HH11 ARG B 76 53.765 8.917 21.421 1.00 0.00 H ATOM 3236 HH22 ARG B 76 54.364 11.336 18.781 1.00 0.00 H ATOM 3237 HH21 ARG B 76 53.656 10.256 17.525 1.00 0.00 H ATOM 3238 H ARG B 76 49.156 5.483 19.079 1.00 0.00 H ATOM 3239 N PHE B 77 47.918 8.026 20.718 1.00 14.21 N ATOM 3240 CA PHE B 77 47.098 9.193 21.109 1.00 13.65 C ATOM 3241 C PHE B 77 45.901 8.722 21.882 1.00 13.30 C ATOM 3242 O PHE B 77 45.557 9.231 22.932 1.00 13.31 O ATOM 3243 CB PHE B 77 46.709 9.982 19.861 1.00 13.97 C ATOM 3244 CG PHE B 77 45.811 11.165 20.131 1.00 13.99 C ATOM 3245 CD1 PHE B 77 46.407 12.384 20.481 1.00 14.92 C ATOM 3246 CD2 PHE B 77 44.436 11.029 20.053 1.00 14.32 C ATOM 3247 CE1 PHE B 77 45.596 13.501 20.747 1.00 15.44 C ATOM 3248 CE2 PHE B 77 43.661 12.157 20.317 1.00 14.94 C ATOM 3249 CZ PHE B 77 44.218 13.363 20.670 1.00 15.27 C ATOM 3250 HA PHE B 77 47.666 9.862 21.756 1.00 0.00 H ATOM 3251 HB2 PHE B 77 47.621 10.346 19.388 1.00 0.00 H ATOM 3252 HB3 PHE B 77 46.191 9.308 19.178 1.00 0.00 H ATOM 3253 HD2 PHE B 77 43.976 10.075 19.795 1.00 0.00 H ATOM 3254 HE2 PHE B 77 42.576 12.080 20.241 1.00 0.00 H ATOM 3255 HZ PHE B 77 43.574 14.214 20.890 1.00 0.00 H ATOM 3256 HE1 PHE B 77 46.043 14.460 21.009 1.00 0.00 H ATOM 3257 HD1 PHE B 77 47.492 12.466 20.547 1.00 0.00 H ATOM 3258 H PHE B 77 48.021 7.790 19.710 1.00 0.00 H ATOM 3259 N ALA B 78 45.144 7.735 21.342 1.00 12.75 N ATOM 3260 CA ALA B 78 43.971 7.224 22.011 1.00 13.09 C ATOM 3261 C ALA B 78 44.333 6.705 23.398 1.00 14.27 C ATOM 3262 O ALA B 78 43.630 6.959 24.364 1.00 14.38 O ATOM 3263 CB ALA B 78 43.327 6.169 21.131 1.00 14.09 C ATOM 3264 HA ALA B 78 43.242 8.019 22.167 1.00 0.00 H ATOM 3265 HB1 ALA B 78 43.044 6.616 20.178 1.00 0.00 H ATOM 3266 HB2 ALA B 78 44.036 5.360 20.958 1.00 0.00 H ATOM 3267 HB3 ALA B 78 42.440 5.776 21.627 1.00 0.00 H ATOM 3268 H ALA B 78 45.416 7.335 20.421 1.00 0.00 H ATOM 3269 N ALA B 79 45.416 5.930 23.491 1.00 14.20 N ATOM 3270 CA ALA B 79 45.833 5.378 24.773 1.00 14.29 C ATOM 3271 C ALA B 79 46.157 6.509 25.722 1.00 14.11 C ATOM 3272 O ALA B 79 45.852 6.419 26.935 1.00 15.35 O ATOM 3273 CB ALA B 79 46.994 4.396 24.575 1.00 16.46 C ATOM 3274 HA ALA B 79 45.024 4.803 25.223 1.00 0.00 H ATOM 3275 HB1 ALA B 79 46.674 3.583 23.923 1.00 0.00 H ATOM 3276 HB2 ALA B 79 47.836 4.918 24.120 1.00 0.00 H ATOM 3277 HB3 ALA B 79 47.295 3.992 25.541 1.00 0.00 H ATOM 3278 H ALA B 79 45.970 5.717 22.637 1.00 0.00 H ATOM 3279 N GLN B 80 46.842 7.566 25.259 1.00 14.54 N ATOM 3280 CA GLN B 80 47.248 8.659 26.137 1.00 15.11 C ATOM 3281 C GLN B 80 46.039 9.327 26.724 1.00 13.87 C ATOM 3282 O GLN B 80 45.951 9.602 27.938 1.00 15.51 O ATOM 3283 CB GLN B 80 48.137 9.665 25.392 1.00 17.98 C ATOM 3284 CG GLN B 80 48.519 10.883 26.175 1.00 19.87 C ATOM 3285 CD GLN B 80 49.198 11.962 25.346 1.00 25.93 C ATOM 3286 OE1 GLN B 80 49.170 12.014 24.108 1.00 26.26 O ATOM 3287 NE2 GLN B 80 49.802 12.918 26.040 1.00 35.91 N ATOM 3288 HA GLN B 80 47.840 8.246 26.954 1.00 0.00 H ATOM 3289 HB2 GLN B 80 49.053 9.152 25.098 1.00 0.00 H ATOM 3290 HB3 GLN B 80 47.602 9.992 24.500 1.00 0.00 H ATOM 3291 HG2 GLN B 80 47.616 11.306 26.615 1.00 0.00 H ATOM 3292 HG3 GLN B 80 49.201 10.580 26.969 1.00 0.00 H ATOM 3293 HE22 GLN B 80 49.824 12.872 27.079 1.00 0.00 H ATOM 3294 HE21 GLN B 80 50.253 13.714 25.545 1.00 0.00 H ATOM 3295 H GLN B 80 47.090 7.607 24.250 1.00 0.00 H ATOM 3296 N LEU B 81 45.053 9.682 25.868 1.00 13.47 N ATOM 3297 CA LEU B 81 43.908 10.402 26.388 1.00 13.29 C ATOM 3298 C LEU B 81 43.040 9.528 27.252 1.00 13.14 C ATOM 3299 O LEU B 81 42.502 9.978 28.257 1.00 13.83 O ATOM 3300 CB LEU B 81 43.109 10.986 25.229 1.00 13.40 C ATOM 3301 CG LEU B 81 43.565 12.409 24.861 1.00 14.51 C ATOM 3302 CD1 LEU B 81 44.991 12.494 24.357 1.00 16.20 C ATOM 3303 CD2 LEU B 81 42.611 13.014 23.809 1.00 16.62 C ATOM 3304 HA LEU B 81 44.270 11.211 27.023 1.00 0.00 H ATOM 3305 HB2 LEU B 81 43.233 10.342 24.358 1.00 0.00 H ATOM 3306 HB3 LEU B 81 42.056 11.017 25.510 1.00 0.00 H ATOM 3307 HG LEU B 81 43.533 12.980 25.789 1.00 0.00 H ATOM 3308 HD21 LEU B 81 42.618 12.392 22.914 1.00 0.00 H ATOM 3309 HD22 LEU B 81 41.601 13.055 24.217 1.00 0.00 H ATOM 3310 HD23 LEU B 81 42.943 14.021 23.556 1.00 0.00 H ATOM 3311 HD11 LEU B 81 45.670 12.130 25.128 1.00 0.00 H ATOM 3312 HD12 LEU B 81 45.095 11.883 23.461 1.00 0.00 H ATOM 3313 HD13 LEU B 81 45.230 13.531 24.121 1.00 0.00 H ATOM 3314 H LEU B 81 45.116 9.443 24.858 1.00 0.00 H ATOM 3315 N ARG B 82 42.934 8.200 26.922 1.00 13.21 N ATOM 3316 CA ARG B 82 42.197 7.313 27.814 1.00 13.20 C ATOM 3317 C ARG B 82 42.856 7.288 29.188 1.00 14.97 C ATOM 3318 O ARG B 82 42.184 7.293 30.210 1.00 15.89 O ATOM 3319 CB ARG B 82 42.105 5.933 27.208 1.00 13.43 C ATOM 3320 CG ARG B 82 41.093 5.891 26.061 1.00 13.00 C ATOM 3321 CD ARG B 82 41.156 4.576 25.282 1.00 13.09 C ATOM 3322 NE ARG B 82 40.030 4.505 24.374 1.00 12.71 N ATOM 3323 CZ ARG B 82 39.992 3.888 23.217 1.00 13.33 C ATOM 3324 NH1 ARG B 82 41.048 3.190 22.766 1.00 15.35 N ATOM 3325 NH2 ARG B 82 38.906 3.934 22.467 1.00 12.90 N ATOM 3326 HA ARG B 82 41.181 7.686 27.943 1.00 0.00 H ATOM 3327 HB2 ARG B 82 43.085 5.647 26.827 1.00 0.00 H ATOM 3328 HB3 ARG B 82 41.797 5.227 27.979 1.00 0.00 H ATOM 3329 HG2 ARG B 82 40.090 6.008 26.473 1.00 0.00 H ATOM 3330 HG3 ARG B 82 41.302 6.714 25.378 1.00 0.00 H ATOM 3331 HD2 ARG B 82 41.117 3.738 25.978 1.00 0.00 H ATOM 3332 HD3 ARG B 82 42.086 4.533 24.714 1.00 0.00 H ATOM 3333 HE ARG B 82 39.161 4.994 24.670 1.00 0.00 H ATOM 3334 HH12 ARG B 82 40.998 2.708 21.846 1.00 0.00 H ATOM 3335 HH11 ARG B 82 41.915 3.132 23.337 1.00 0.00 H ATOM 3336 HH22 ARG B 82 38.885 3.442 21.551 1.00 0.00 H ATOM 3337 HH21 ARG B 82 38.071 4.463 22.792 1.00 0.00 H ATOM 3338 H ARG B 82 43.371 7.833 26.052 1.00 0.00 H ATOM 3339 N ALA B 83 44.188 7.208 29.243 1.00 16.66 N ATOM 3340 CA ALA B 83 44.950 7.133 30.495 1.00 18.54 C ATOM 3341 C ALA B 83 44.743 8.418 31.306 1.00 18.26 C ATOM 3342 O ALA B 83 44.815 8.358 32.525 1.00 22.38 O ATOM 3343 CB ALA B 83 46.372 6.866 30.208 1.00 20.64 C ATOM 3344 HA ALA B 83 44.587 6.304 31.103 1.00 0.00 H ATOM 3345 HB1 ALA B 83 46.462 5.919 29.676 1.00 0.00 H ATOM 3346 HB2 ALA B 83 46.774 7.670 29.592 1.00 0.00 H ATOM 3347 HB3 ALA B 83 46.927 6.813 31.145 1.00 0.00 H ATOM 3348 H ALA B 83 44.716 7.198 28.347 1.00 0.00 H ATOM 3349 N HIS B 84 44.549 9.532 30.628 1.00 17.74 N ATOM 3350 CA HIS B 84 44.380 10.822 31.273 1.00 18.32 C ATOM 3351 C HIS B 84 42.953 10.987 31.755 1.00 18.38 C ATOM 3352 O HIS B 84 42.680 11.952 32.444 1.00 27.54 O ATOM 3353 CB HIS B 84 44.712 11.968 30.321 1.00 21.89 C ATOM 3354 CG HIS B 84 44.874 13.345 30.832 1.00 31.31 C ATOM 3355 ND1 HIS B 84 43.866 14.302 30.788 1.00 35.75 N ATOM 3356 CD2 HIS B 84 45.943 13.957 31.391 1.00 35.87 C ATOM 3357 CE1 HIS B 84 44.292 15.431 31.298 1.00 38.84 C ATOM 3358 NE2 HIS B 84 45.542 15.243 31.665 1.00 39.71 N ATOM 3359 HA HIS B 84 45.066 10.854 32.119 1.00 0.00 H ATOM 3360 HB2 HIS B 84 45.649 11.705 29.830 1.00 0.00 H ATOM 3361 HB3 HIS B 84 43.912 12.001 29.581 1.00 0.00 H ATOM 3362 HD2 HIS B 84 46.922 13.520 31.585 1.00 0.00 H ATOM 3363 HE1 HIS B 84 43.719 16.353 31.399 1.00 0.00 H ATOM 3364 H HIS B 84 44.516 9.485 29.590 1.00 0.00 H ATOM 3365 N GLY B 85 42.046 10.076 31.444 1.00 15.61 N ATOM 3366 CA GLY B 85 40.671 10.085 31.927 1.00 16.84 C ATOM 3367 C GLY B 85 39.721 10.882 31.016 1.00 14.01 C ATOM 3368 O GLY B 85 38.608 11.229 31.431 1.00 15.56 O ATOM 3369 HA3 GLY B 85 40.654 10.530 32.922 1.00 0.00 H ATOM 3370 HA2 GLY B 85 40.316 9.056 31.985 1.00 0.00 H ATOM 3371 H GLY B 85 42.333 9.301 30.812 1.00 0.00 H ATOM 3372 N VAL B 86 40.087 11.144 29.768 1.00 13.51 N ATOM 3373 CA VAL B 86 39.162 11.810 28.831 1.00 12.74 C ATOM 3374 C VAL B 86 38.001 10.894 28.558 1.00 12.88 C ATOM 3375 O VAL B 86 38.182 9.693 28.380 1.00 14.40 O ATOM 3376 CB VAL B 86 39.981 12.158 27.587 1.00 13.80 C ATOM 3377 CG1 VAL B 86 39.144 12.813 26.518 1.00 19.01 C ATOM 3378 CG2 VAL B 86 41.125 13.131 27.946 1.00 15.87 C ATOM 3379 HA VAL B 86 38.731 12.729 29.228 1.00 0.00 H ATOM 3380 HB VAL B 86 40.375 11.215 27.208 1.00 0.00 H ATOM 3381 HG11 VAL B 86 38.344 12.136 26.219 1.00 0.00 H ATOM 3382 HG12 VAL B 86 38.714 13.735 26.909 1.00 0.00 H ATOM 3383 HG13 VAL B 86 39.771 13.040 25.656 1.00 0.00 H ATOM 3384 HG21 VAL B 86 40.704 14.047 28.361 1.00 0.00 H ATOM 3385 HG22 VAL B 86 41.780 12.664 28.682 1.00 0.00 H ATOM 3386 HG23 VAL B 86 41.696 13.366 27.048 1.00 0.00 H ATOM 3387 H VAL B 86 41.039 10.876 29.446 1.00 0.00 H ATOM 3388 N ARG B 87 36.814 11.518 28.464 1.00 11.42 N ATOM 3389 CA ARG B 87 35.582 10.827 28.203 1.00 11.00 C ATOM 3390 C ARG B 87 35.307 10.728 26.696 1.00 10.45 C ATOM 3391 O ARG B 87 35.495 11.693 25.974 1.00 11.03 O ATOM 3392 CB ARG B 87 34.447 11.584 28.863 1.00 11.79 C ATOM 3393 CG ARG B 87 33.164 10.834 28.920 1.00 12.02 C ATOM 3394 CD ARG B 87 32.141 11.607 29.784 1.00 14.60 C ATOM 3395 NE ARG B 87 32.670 11.645 31.160 1.00 16.35 N ATOM 3396 CZ ARG B 87 32.311 12.452 32.130 1.00 17.51 C ATOM 3397 NH1 ARG B 87 31.317 13.337 31.968 1.00 18.81 N ATOM 3398 NH2 ARG B 87 32.880 12.426 33.339 1.00 21.16 N ATOM 3399 HA ARG B 87 35.660 9.817 28.605 1.00 0.00 H ATOM 3400 HB2 ARG B 87 34.746 11.828 29.882 1.00 0.00 H ATOM 3401 HB3 ARG B 87 34.280 12.505 28.304 1.00 0.00 H ATOM 3402 HG2 ARG B 87 32.769 10.715 27.911 1.00 0.00 H ATOM 3403 HG3 ARG B 87 33.338 9.851 29.358 1.00 0.00 H ATOM 3404 HD2 ARG B 87 31.178 11.097 29.768 1.00 0.00 H ATOM 3405 HD3 ARG B 87 32.020 12.621 29.402 1.00 0.00 H ATOM 3406 HE ARG B 87 33.412 10.953 31.387 1.00 0.00 H ATOM 3407 HH12 ARG B 87 31.049 13.967 32.751 1.00 0.00 H ATOM 3408 HH11 ARG B 87 30.814 13.393 31.060 1.00 0.00 H ATOM 3409 HH22 ARG B 87 32.562 13.086 34.078 1.00 0.00 H ATOM 3410 HH21 ARG B 87 33.641 11.746 33.541 1.00 0.00 H ATOM 3411 H ARG B 87 36.786 12.550 28.586 1.00 0.00 H ATOM 3412 N GLU B 88 34.874 9.539 26.287 1.00 9.85 N ATOM 3413 CA GLU B 88 34.519 9.298 24.894 1.00 9.55 C ATOM 3414 C GLU B 88 33.009 9.471 24.709 1.00 9.69 C ATOM 3415 O GLU B 88 32.245 9.249 25.615 1.00 11.21 O ATOM 3416 CB GLU B 88 35.023 7.918 24.465 1.00 9.79 C ATOM 3417 CG GLU B 88 36.541 7.923 24.312 1.00 10.12 C ATOM 3418 CD GLU B 88 37.077 6.536 24.162 1.00 9.91 C ATOM 3419 OE1 GLU B 88 36.855 5.901 23.079 1.00 10.33 O ATOM 3420 OE2 GLU B 88 37.747 6.034 25.087 1.00 10.75 O ATOM 3421 HA GLU B 88 35.003 10.028 24.245 1.00 0.00 H ATOM 3422 HB2 GLU B 88 34.741 7.183 25.219 1.00 0.00 H ATOM 3423 HB3 GLU B 88 34.568 7.651 23.511 1.00 0.00 H ATOM 3424 HG2 GLU B 88 36.807 8.504 23.429 1.00 0.00 H ATOM 3425 HG3 GLU B 88 36.986 8.382 25.195 1.00 0.00 H ATOM 3426 H GLU B 88 34.787 8.765 26.976 1.00 0.00 H ATOM 3427 N TRP B 89 32.643 9.886 23.476 1.00 9.47 N ATOM 3428 CA TRP B 89 31.248 10.098 23.125 1.00 9.17 C ATOM 3429 C TRP B 89 30.742 9.260 21.984 1.00 9.47 C ATOM 3430 O TRP B 89 29.571 9.293 21.680 1.00 10.01 O ATOM 3431 CB TRP B 89 30.954 11.590 22.897 1.00 9.13 C ATOM 3432 CG TRP B 89 31.620 12.192 21.694 1.00 8.74 C ATOM 3433 CD1 TRP B 89 32.865 12.743 21.620 1.00 8.93 C ATOM 3434 CD2 TRP B 89 31.034 12.335 20.412 1.00 8.81 C ATOM 3435 NE1 TRP B 89 33.099 13.208 20.357 1.00 9.49 N ATOM 3436 CE2 TRP B 89 31.983 12.973 19.581 1.00 8.94 C ATOM 3437 CE3 TRP B 89 29.755 11.987 19.866 1.00 9.58 C ATOM 3438 CZ2 TRP B 89 31.716 13.262 18.249 1.00 10.06 C ATOM 3439 CZ3 TRP B 89 29.539 12.288 18.531 1.00 10.38 C ATOM 3440 CH2 TRP B 89 30.492 12.908 17.744 1.00 10.58 C ATOM 3441 HA TRP B 89 30.686 9.750 23.992 1.00 0.00 H ATOM 3442 HB2 TRP B 89 29.877 11.709 22.782 1.00 0.00 H ATOM 3443 HB3 TRP B 89 31.287 12.139 23.778 1.00 0.00 H ATOM 3444 HE1 TRP B 89 33.976 13.665 20.033 1.00 0.00 H ATOM 3445 HD1 TRP B 89 33.571 12.804 22.448 1.00 0.00 H ATOM 3446 HZ2 TRP B 89 32.459 13.756 17.623 1.00 0.00 H ATOM 3447 HH2 TRP B 89 30.265 13.120 16.699 1.00 0.00 H ATOM 3448 HZ3 TRP B 89 28.580 12.026 18.084 1.00 0.00 H ATOM 3449 HE3 TRP B 89 28.987 11.507 20.473 1.00 0.00 H ATOM 3450 H TRP B 89 33.378 10.058 22.760 1.00 0.00 H ATOM 3451 N LYS B 90 31.636 8.479 21.361 1.00 9.45 N ATOM 3452 CA LYS B 90 31.265 7.620 20.267 1.00 9.68 C ATOM 3453 C LYS B 90 32.363 6.585 20.046 1.00 10.02 C ATOM 3454 O LYS B 90 33.517 6.896 20.173 1.00 10.57 O ATOM 3455 CB LYS B 90 31.066 8.417 18.968 1.00 10.03 C ATOM 3456 CG LYS B 90 30.628 7.527 17.827 1.00 13.55 C ATOM 3457 CD LYS B 90 30.011 8.189 16.682 1.00 15.73 C ATOM 3458 CE LYS B 90 29.557 7.114 15.685 1.00 17.41 C ATOM 3459 NZ LYS B 90 28.707 7.765 14.716 1.00 22.18 N ATOM 3460 HA LYS B 90 30.323 7.135 20.523 1.00 0.00 H ATOM 3461 HB2 LYS B 90 30.305 9.179 19.134 1.00 0.00 H ATOM 3462 HB3 LYS B 90 32.007 8.897 18.700 1.00 0.00 H ATOM 3463 HG2 LYS B 90 31.508 6.994 17.467 1.00 0.00 H ATOM 3464 HG3 LYS B 90 29.908 6.811 18.223 1.00 0.00 H ATOM 3465 HD2 LYS B 90 29.151 8.771 17.013 1.00 0.00 H ATOM 3466 HD3 LYS B 90 30.734 8.851 16.206 1.00 0.00 H ATOM 3467 HE2 LYS B 90 29.002 6.333 16.204 1.00 0.00 H ATOM 3468 HE3 LYS B 90 30.422 6.675 15.189 1.00 0.00 H ATOM 3469 HZ1 LYS B 90 27.889 8.185 15.201 1.00 0.00 H ATOM 3470 HZ2 LYS B 90 29.245 8.512 14.231 1.00 0.00 H ATOM 3471 HZ3 LYS B 90 28.378 7.066 14.020 1.00 0.00 H ATOM 3472 H LYS B 90 32.627 8.494 21.677 1.00 0.00 H ATOM 3473 N GLN B 91 31.959 5.362 19.746 1.00 12.81 N ATOM 3474 CA GLN B 91 32.862 4.310 19.304 1.00 11.44 C ATOM 3475 C GLN B 91 32.907 4.311 17.793 1.00 11.30 C ATOM 3476 O GLN B 91 31.875 4.250 17.125 1.00 12.76 O ATOM 3477 CB GLN B 91 32.382 2.968 19.847 1.00 11.26 C ATOM 3478 CG GLN B 91 33.164 1.782 19.363 1.00 11.98 C ATOM 3479 CD GLN B 91 32.668 0.524 20.031 1.00 11.03 C ATOM 3480 OE1 GLN B 91 31.643 -0.075 19.689 1.00 11.94 O ATOM 3481 NE2 GLN B 91 33.407 0.101 21.038 1.00 11.69 N ATOM 3482 HA GLN B 91 33.869 4.484 19.682 1.00 0.00 H ATOM 3483 HB2 GLN B 91 32.448 2.998 20.935 1.00 0.00 H ATOM 3484 HB3 GLN B 91 31.342 2.834 19.551 1.00 0.00 H ATOM 3485 HG2 GLN B 91 33.045 1.688 18.284 1.00 0.00 H ATOM 3486 HG3 GLN B 91 34.218 1.924 19.600 1.00 0.00 H ATOM 3487 HE22 GLN B 91 34.266 0.622 21.308 1.00 0.00 H ATOM 3488 HE21 GLN B 91 33.131 -0.754 21.563 1.00 0.00 H ATOM 3489 H GLN B 91 30.946 5.141 19.830 1.00 0.00 H ATOM 3490 N ASN B 92 34.079 4.311 17.187 1.00 10.92 N ATOM 3491 CA ASN B 92 34.208 4.464 15.773 1.00 10.92 C ATOM 3492 C ASN B 92 33.491 3.407 14.979 1.00 11.16 C ATOM 3493 O ASN B 92 33.611 2.212 15.264 1.00 12.97 O ATOM 3494 CB ASN B 92 35.716 4.393 15.367 1.00 11.62 C ATOM 3495 CG ASN B 92 35.875 4.742 13.900 1.00 12.06 C ATOM 3496 OD1 ASN B 92 35.312 5.695 13.418 1.00 12.54 O ATOM 3497 ND2 ASN B 92 36.687 3.971 13.226 1.00 17.52 N ATOM 3498 HA ASN B 92 33.759 5.430 15.544 1.00 0.00 H ATOM 3499 HB2 ASN B 92 36.286 5.099 15.970 1.00 0.00 H ATOM 3500 HB3 ASN B 92 36.090 3.384 15.541 1.00 0.00 H ATOM 3501 HD22 ASN B 92 37.145 3.163 13.694 1.00 0.00 H ATOM 3502 HD21 ASN B 92 36.875 4.166 12.222 1.00 0.00 H ATOM 3503 H ASN B 92 34.940 4.195 17.759 1.00 0.00 H ATOM 3504 N ARG B 93 32.811 3.854 13.935 1.00 12.83 N ATOM 3505 CA ARG B 93 32.140 2.970 12.978 1.00 15.56 C ATOM 3506 C ARG B 93 32.450 3.340 11.518 1.00 14.30 C ATOM 3507 O ARG B 93 32.377 2.398 10.708 1.00 21.91 O ATOM 3508 CB ARG B 93 30.627 2.914 13.148 1.00 22.49 C ATOM 3509 CG ARG B 93 30.133 2.557 14.531 1.00 26.39 C ATOM 3510 CD ARG B 93 28.926 1.688 14.625 1.00 33.51 C ATOM 3511 NE ARG B 93 27.687 2.307 14.223 1.00 38.86 N ATOM 3512 CZ ARG B 93 26.988 3.180 14.940 1.00 42.99 C ATOM 3513 NH1 ARG B 93 27.476 3.547 16.120 1.00 47.14 N ATOM 3514 NH2 ARG B 93 25.841 3.760 14.608 1.00 45.63 N ATOM 3515 HA ARG B 93 32.547 1.984 13.204 1.00 0.00 H ATOM 3516 HB2 ARG B 93 30.225 3.894 12.892 1.00 0.00 H ATOM 3517 HB3 ARG B 93 30.239 2.170 12.452 1.00 0.00 H ATOM 3518 HG2 ARG B 93 30.946 2.045 15.047 1.00 0.00 H ATOM 3519 HG3 ARG B 93 29.906 3.489 15.048 1.00 0.00 H ATOM 3520 HD2 ARG B 93 28.822 1.367 15.662 1.00 0.00 H ATOM 3521 HD3 ARG B 93 29.088 0.816 13.991 1.00 0.00 H ATOM 3522 HE ARG B 93 27.308 2.047 13.290 1.00 0.00 H ATOM 3523 HH12 ARG B 93 26.956 4.229 16.709 1.00 0.00 H ATOM 3524 HH11 ARG B 93 28.378 3.153 16.455 1.00 0.00 H ATOM 3525 HH22 ARG B 93 25.390 4.431 15.261 1.00 0.00 H ATOM 3526 HH21 ARG B 93 25.394 3.543 13.694 1.00 0.00 H ATOM 3527 H ARG B 93 32.750 4.882 13.787 1.00 0.00 H ATOM 3528 N SER B 94 32.802 4.527 11.150 1.00 13.45 N ATOM 3529 CA SER B 94 33.034 4.925 9.767 1.00 13.04 C ATOM 3530 C SER B 94 34.473 4.711 9.383 1.00 12.18 C ATOM 3531 O SER B 94 35.392 4.467 10.192 1.00 13.06 O ATOM 3532 CB SER B 94 32.627 6.394 9.535 1.00 12.78 C ATOM 3533 OG SER B 94 33.397 7.229 10.353 1.00 11.85 O ATOM 3534 HA SER B 94 32.410 4.296 9.132 1.00 0.00 H ATOM 3535 HB2 SER B 94 31.572 6.521 9.777 1.00 0.00 H ATOM 3536 HB3 SER B 94 32.793 6.656 8.490 1.00 0.00 H ATOM 3537 HG SER B 94 33.245 6.991 11.302 1.00 0.00 H ATOM 3538 H SER B 94 32.928 5.247 11.890 1.00 0.00 H ATOM 3539 N GLU B 95 34.741 4.818 8.068 1.00 12.59 N ATOM 3540 CA GLU B 95 36.101 4.573 7.538 1.00 11.61 C ATOM 3541 C GLU B 95 37.138 5.428 8.257 1.00 11.11 C ATOM 3542 O GLU B 95 36.932 6.608 8.543 1.00 11.56 O ATOM 3543 CB GLU B 95 36.078 4.864 6.028 1.00 12.48 C ATOM 3544 CG GLU B 95 37.418 5.008 5.347 1.00 12.22 C ATOM 3545 CD GLU B 95 38.028 6.390 5.290 1.00 11.76 C ATOM 3546 OE1 GLU B 95 37.304 7.375 5.507 1.00 11.42 O ATOM 3547 OE2 GLU B 95 39.269 6.488 5.012 1.00 12.99 O ATOM 3548 HA GLU B 95 36.388 3.536 7.710 1.00 0.00 H ATOM 3549 HB2 GLU B 95 35.546 4.047 5.541 1.00 0.00 H ATOM 3550 HB3 GLU B 95 35.529 5.794 5.878 1.00 0.00 H ATOM 3551 HG2 GLU B 95 38.122 4.362 5.871 1.00 0.00 H ATOM 3552 HG3 GLU B 95 37.302 4.660 4.321 1.00 0.00 H ATOM 3553 H GLU B 95 33.977 5.078 7.412 1.00 0.00 H ATOM 3554 N GLY B 96 38.280 4.795 8.446 1.00 12.04 N ATOM 3555 CA GLY B 96 39.442 5.428 9.040 1.00 11.98 C ATOM 3556 C GLY B 96 39.366 5.438 10.564 1.00 11.87 C ATOM 3557 O GLY B 96 38.323 5.749 11.136 1.00 12.16 O ATOM 3558 HA3 GLY B 96 39.505 6.456 8.683 1.00 0.00 H ATOM 3559 HA2 GLY B 96 40.335 4.883 8.735 1.00 0.00 H ATOM 3560 H GLY B 96 38.350 3.799 8.156 1.00 0.00 H ATOM 3561 N ASP B 97 40.490 5.132 11.221 1.00 12.23 N ATOM 3562 CA ASP B 97 40.530 5.207 12.663 1.00 11.74 C ATOM 3563 C ASP B 97 40.038 6.571 13.139 1.00 10.77 C ATOM 3564 O ASP B 97 40.432 7.632 12.626 1.00 10.66 O ATOM 3565 CB ASP B 97 41.949 4.964 13.233 1.00 13.31 C ATOM 3566 CG ASP B 97 42.282 3.517 13.461 1.00 17.57 C ATOM 3567 OD1 ASP B 97 41.385 2.723 13.859 1.00 21.09 O ATOM 3568 OD2 ASP B 97 43.446 3.118 13.231 1.00 19.52 O ATOM 3569 HA ASP B 97 39.876 4.416 13.030 1.00 0.00 H ATOM 3570 HB2 ASP B 97 42.675 5.376 12.531 1.00 0.00 H ATOM 3571 HB3 ASP B 97 42.029 5.488 14.186 1.00 0.00 H ATOM 3572 H ASP B 97 41.337 4.840 10.693 1.00 0.00 H ATOM 3573 N SER B 98 39.229 6.535 14.207 1.00 9.89 N ATOM 3574 CA SER B 98 38.764 7.746 14.866 1.00 9.82 C ATOM 3575 C SER B 98 38.582 7.479 16.367 1.00 9.45 C ATOM 3576 O SER B 98 38.152 6.419 16.751 1.00 11.19 O ATOM 3577 CB SER B 98 37.400 8.223 14.348 1.00 10.07 C ATOM 3578 OG SER B 98 37.487 8.734 13.023 1.00 10.85 O ATOM 3579 HA SER B 98 39.517 8.507 14.661 1.00 0.00 H ATOM 3580 HB2 SER B 98 37.028 9.008 15.006 1.00 0.00 H ATOM 3581 HB3 SER B 98 36.705 7.383 14.358 1.00 0.00 H ATOM 3582 HG SER B 98 36.591 9.030 12.725 1.00 0.00 H ATOM 3583 H SER B 98 38.924 5.612 14.576 1.00 0.00 H ATOM 3584 N PHE B 99 38.941 8.496 17.107 1.00 9.70 N ATOM 3585 CA PHE B 99 38.800 8.522 18.560 1.00 9.65 C ATOM 3586 C PHE B 99 37.946 9.753 18.860 1.00 8.76 C ATOM 3587 O PHE B 99 38.315 10.868 18.485 1.00 9.39 O ATOM 3588 CB PHE B 99 40.190 8.640 19.190 1.00 10.43 C ATOM 3589 CG PHE B 99 40.192 8.744 20.692 1.00 9.78 C ATOM 3590 CD1 PHE B 99 39.891 7.619 21.450 1.00 11.17 C ATOM 3591 CD2 PHE B 99 40.531 9.906 21.335 1.00 11.62 C ATOM 3592 CE1 PHE B 99 39.935 7.665 22.834 1.00 12.41 C ATOM 3593 CE2 PHE B 99 40.520 9.965 22.722 1.00 12.56 C ATOM 3594 CZ PHE B 99 40.232 8.860 23.451 1.00 12.35 C ATOM 3595 HA PHE B 99 38.336 7.622 18.963 1.00 0.00 H ATOM 3596 HB2 PHE B 99 40.766 7.758 18.909 1.00 0.00 H ATOM 3597 HB3 PHE B 99 40.672 9.531 18.787 1.00 0.00 H ATOM 3598 HD2 PHE B 99 40.810 10.786 20.756 1.00 0.00 H ATOM 3599 HE2 PHE B 99 40.744 10.905 23.227 1.00 0.00 H ATOM 3600 HZ PHE B 99 40.235 8.917 24.539 1.00 0.00 H ATOM 3601 HE1 PHE B 99 39.738 6.770 23.425 1.00 0.00 H ATOM 3602 HD1 PHE B 99 39.617 6.690 20.950 1.00 0.00 H ATOM 3603 H PHE B 99 39.348 9.329 16.636 1.00 0.00 H ATOM 3604 N TYR B 100 36.790 9.531 19.498 1.00 8.95 N ATOM 3605 CA TYR B 100 35.763 10.561 19.684 1.00 8.90 C ATOM 3606 C TYR B 100 35.700 10.918 21.152 1.00 8.70 C ATOM 3607 O TYR B 100 35.290 10.086 21.968 1.00 9.56 O ATOM 3608 CB TYR B 100 34.426 10.014 19.229 1.00 8.81 C ATOM 3609 CG TYR B 100 34.282 9.775 17.754 1.00 9.24 C ATOM 3610 CD1 TYR B 100 34.539 8.525 17.195 1.00 9.20 C ATOM 3611 CD2 TYR B 100 33.850 10.783 16.890 1.00 9.35 C ATOM 3612 CE1 TYR B 100 34.386 8.292 15.839 1.00 9.66 C ATOM 3613 CE2 TYR B 100 33.685 10.547 15.541 1.00 9.86 C ATOM 3614 CZ TYR B 100 33.966 9.310 15.024 1.00 9.48 C ATOM 3615 OH TYR B 100 33.816 9.019 13.664 1.00 10.72 O ATOM 3616 HA TYR B 100 36.004 11.450 19.100 1.00 0.00 H ATOM 3617 HB3 TYR B 100 33.655 10.724 19.529 1.00 0.00 H ATOM 3618 HB2 TYR B 100 34.263 9.065 19.739 1.00 0.00 H ATOM 3619 HD2 TYR B 100 33.639 11.775 17.289 1.00 0.00 H ATOM 3620 HE2 TYR B 100 33.331 11.344 14.887 1.00 0.00 H ATOM 3621 HE1 TYR B 100 34.598 7.307 15.423 1.00 0.00 H ATOM 3622 HD1 TYR B 100 34.868 7.711 17.841 1.00 0.00 H ATOM 3623 HH TYR B 100 34.070 8.076 13.499 1.00 0.00 H ATOM 3624 H TYR B 100 36.612 8.581 19.881 1.00 0.00 H ATOM 3625 N PHE B 101 36.111 12.124 21.500 1.00 8.63 N ATOM 3626 CA PHE B 101 36.323 12.520 22.883 1.00 9.33 C ATOM 3627 C PHE B 101 35.766 13.917 23.155 1.00 8.60 C ATOM 3628 O PHE B 101 35.600 14.715 22.233 1.00 9.07 O ATOM 3629 CB PHE B 101 37.799 12.427 23.235 1.00 9.85 C ATOM 3630 CG PHE B 101 38.712 13.321 22.449 1.00 9.69 C ATOM 3631 CD1 PHE B 101 39.244 14.481 23.028 1.00 10.56 C ATOM 3632 CD2 PHE B 101 39.079 13.021 21.143 1.00 10.22 C ATOM 3633 CE1 PHE B 101 40.106 15.308 22.337 1.00 10.92 C ATOM 3634 CE2 PHE B 101 39.953 13.869 20.443 1.00 10.46 C ATOM 3635 CZ PHE B 101 40.475 14.982 21.043 1.00 10.68 C ATOM 3636 HA PHE B 101 35.776 11.831 23.526 1.00 0.00 H ATOM 3637 HB2 PHE B 101 37.909 12.679 24.290 1.00 0.00 H ATOM 3638 HB3 PHE B 101 38.118 11.397 23.074 1.00 0.00 H ATOM 3639 HD2 PHE B 101 38.688 12.125 20.660 1.00 0.00 H ATOM 3640 HE2 PHE B 101 40.218 13.638 19.411 1.00 0.00 H ATOM 3641 HZ PHE B 101 41.181 15.612 20.502 1.00 0.00 H ATOM 3642 HE1 PHE B 101 40.494 16.212 22.807 1.00 0.00 H ATOM 3643 HD1 PHE B 101 38.970 14.737 24.051 1.00 0.00 H ATOM 3644 H PHE B 101 36.291 12.822 20.751 1.00 0.00 H ATOM 3645 N LEU B 102 35.501 14.184 24.433 1.00 9.15 N ATOM 3646 CA LEU B 102 34.931 15.445 24.848 1.00 9.15 C ATOM 3647 C LEU B 102 36.006 16.357 25.425 1.00 9.32 C ATOM 3648 O LEU B 102 36.917 15.936 26.109 1.00 10.42 O ATOM 3649 CB LEU B 102 33.862 15.205 25.924 1.00 9.78 C ATOM 3650 CG LEU B 102 32.663 14.389 25.475 1.00 9.96 C ATOM 3651 CD1 LEU B 102 31.751 14.097 26.654 1.00 15.56 C ATOM 3652 CD2 LEU B 102 31.874 15.078 24.399 1.00 10.19 C ATOM 3653 HA LEU B 102 34.485 15.920 23.974 1.00 0.00 H ATOM 3654 HB2 LEU B 102 34.333 14.682 26.757 1.00 0.00 H ATOM 3655 HB3 LEU B 102 33.501 16.176 26.263 1.00 0.00 H ATOM 3656 HG LEU B 102 33.052 13.458 25.063 1.00 0.00 H ATOM 3657 HD21 LEU B 102 31.510 16.035 24.773 1.00 0.00 H ATOM 3658 HD22 LEU B 102 32.513 15.245 23.532 1.00 0.00 H ATOM 3659 HD23 LEU B 102 31.028 14.453 24.114 1.00 0.00 H ATOM 3660 HD11 LEU B 102 32.302 13.535 27.408 1.00 0.00 H ATOM 3661 HD12 LEU B 102 31.402 15.036 27.083 1.00 0.00 H ATOM 3662 HD13 LEU B 102 30.897 13.511 26.315 1.00 0.00 H ATOM 3663 H LEU B 102 35.711 13.464 25.153 1.00 0.00 H ATOM 3664 N ASP B 103 35.828 17.662 25.154 1.00 9.35 N ATOM 3665 CA ASP B 103 36.663 18.680 25.797 1.00 9.58 C ATOM 3666 C ASP B 103 36.067 19.034 27.169 1.00 9.51 C ATOM 3667 O ASP B 103 34.990 18.510 27.567 1.00 10.01 O ATOM 3668 CB ASP B 103 36.865 19.833 24.830 1.00 9.93 C ATOM 3669 CG ASP B 103 35.927 21.013 24.939 1.00 9.11 C ATOM 3670 OD1 ASP B 103 34.868 20.879 25.578 1.00 9.39 O ATOM 3671 OD2 ASP B 103 36.278 22.074 24.354 1.00 9.68 O ATOM 3672 HA ASP B 103 37.668 18.321 26.020 1.00 0.00 H ATOM 3673 HB2 ASP B 103 37.878 20.207 24.976 1.00 0.00 H ATOM 3674 HB3 ASP B 103 36.769 19.433 23.821 1.00 0.00 H ATOM 3675 H ASP B 103 35.090 17.952 24.481 1.00 0.00 H ATOM 3676 N PRO B 104 36.697 19.924 27.923 1.00 9.99 N ATOM 3677 CA PRO B 104 36.193 20.242 29.264 1.00 10.70 C ATOM 3678 C PRO B 104 34.803 20.797 29.375 1.00 10.76 C ATOM 3679 O PRO B 104 34.188 20.639 30.434 1.00 15.14 O ATOM 3680 CB PRO B 104 37.267 21.233 29.809 1.00 12.09 C ATOM 3681 CG PRO B 104 38.522 20.796 29.104 1.00 11.91 C ATOM 3682 CD PRO B 104 38.058 20.483 27.694 1.00 10.91 C ATOM 3683 HA PRO B 104 36.069 19.322 29.836 1.00 0.00 H ATOM 3684 HD3 PRO B 104 38.017 21.384 27.083 1.00 0.00 H ATOM 3685 HD2 PRO B 104 38.710 19.751 27.217 1.00 0.00 H ATOM 3686 HG3 PRO B 104 38.946 19.911 29.579 1.00 0.00 H ATOM 3687 HG2 PRO B 104 39.263 21.595 29.100 1.00 0.00 H ATOM 3688 HB2 PRO B 104 37.014 22.263 29.556 1.00 0.00 H ATOM 3689 HB3 PRO B 104 37.372 21.141 30.890 1.00 0.00 H ATOM 3690 N ASP B 105 34.296 21.422 28.338 1.00 10.38 N ATOM 3691 CA ASP B 105 32.947 21.906 28.333 1.00 10.39 C ATOM 3692 C ASP B 105 31.935 20.916 27.768 1.00 10.56 C ATOM 3693 O ASP B 105 30.719 21.111 27.856 1.00 12.67 O ATOM 3694 CB ASP B 105 32.775 23.204 27.523 1.00 10.81 C ATOM 3695 CG ASP B 105 33.458 24.348 28.233 1.00 11.12 C ATOM 3696 OD1 ASP B 105 32.827 24.977 29.119 1.00 12.26 O ATOM 3697 OD2 ASP B 105 34.618 24.630 27.906 1.00 11.57 O ATOM 3698 HA ASP B 105 32.751 22.077 29.391 1.00 0.00 H ATOM 3699 HB2 ASP B 105 33.218 23.075 26.535 1.00 0.00 H ATOM 3700 HB3 ASP B 105 31.713 23.426 27.417 1.00 0.00 H ATOM 3701 H ASP B 105 34.890 21.570 27.497 1.00 0.00 H ATOM 3702 N GLY B 106 32.426 19.863 27.132 1.00 9.70 N ATOM 3703 CA GLY B 106 31.583 18.968 26.394 1.00 9.74 C ATOM 3704 C GLY B 106 31.490 19.230 24.921 1.00 9.55 C ATOM 3705 O GLY B 106 30.692 18.567 24.245 1.00 9.90 O ATOM 3706 HA3 GLY B 106 30.578 19.034 26.810 1.00 0.00 H ATOM 3707 HA2 GLY B 106 31.966 17.957 26.531 1.00 0.00 H ATOM 3708 H GLY B 106 33.449 19.681 27.169 1.00 0.00 H ATOM 3709 N HIS B 107 32.321 20.111 24.368 1.00 9.00 N ATOM 3710 CA HIS B 107 32.437 20.138 22.904 1.00 8.77 C ATOM 3711 C HIS B 107 32.908 18.767 22.444 1.00 8.10 C ATOM 3712 O HIS B 107 33.786 18.149 23.053 1.00 9.10 O ATOM 3713 CB HIS B 107 33.373 21.228 22.420 1.00 8.99 C ATOM 3714 CG HIS B 107 32.918 22.613 22.718 1.00 8.64 C ATOM 3715 ND1 HIS B 107 31.819 23.198 22.105 1.00 9.43 N ATOM 3716 CD2 HIS B 107 33.478 23.545 23.584 1.00 8.90 C ATOM 3717 CE1 HIS B 107 31.719 24.429 22.576 1.00 9.88 C ATOM 3718 NE2 HIS B 107 32.680 24.670 23.483 1.00 10.05 N ATOM 3719 HA HIS B 107 31.463 20.369 22.473 1.00 0.00 H ATOM 3720 HB2 HIS B 107 34.343 21.079 22.895 1.00 0.00 H ATOM 3721 HB3 HIS B 107 33.480 21.130 21.340 1.00 0.00 H ATOM 3722 HD2 HIS B 107 34.360 23.416 24.211 1.00 0.00 H ATOM 3723 HE1 HIS B 107 30.961 25.150 22.270 1.00 0.00 H ATOM 3724 H HIS B 107 32.875 20.764 24.958 1.00 0.00 H ATOM 3725 N ARG B 108 32.329 18.311 21.334 1.00 8.20 N ATOM 3726 CA ARG B 108 32.629 17.017 20.797 1.00 8.00 C ATOM 3727 C ARG B 108 33.766 17.114 19.784 1.00 8.21 C ATOM 3728 O ARG B 108 33.686 17.818 18.784 1.00 8.47 O ATOM 3729 CB ARG B 108 31.384 16.435 20.114 1.00 8.10 C ATOM 3730 CG ARG B 108 30.326 15.956 21.102 1.00 8.51 C ATOM 3731 CD ARG B 108 29.024 15.615 20.415 1.00 9.18 C ATOM 3732 NE ARG B 108 28.306 16.818 20.014 1.00 9.37 N ATOM 3733 CZ ARG B 108 27.407 17.457 20.755 1.00 9.83 C ATOM 3734 NH1 ARG B 108 27.136 17.033 22.008 1.00 10.91 N ATOM 3735 NH2 ARG B 108 26.770 18.529 20.268 1.00 11.63 N ATOM 3736 HA ARG B 108 32.935 16.363 21.614 1.00 0.00 H ATOM 3737 HB2 ARG B 108 30.944 17.205 19.481 1.00 0.00 H ATOM 3738 HB3 ARG B 108 31.690 15.590 19.497 1.00 0.00 H ATOM 3739 HG2 ARG B 108 30.698 15.068 21.613 1.00 0.00 H ATOM 3740 HG3 ARG B 108 30.143 16.744 21.832 1.00 0.00 H ATOM 3741 HD2 ARG B 108 28.400 15.041 21.100 1.00 0.00 H ATOM 3742 HD3 ARG B 108 29.236 15.016 19.529 1.00 0.00 H ATOM 3743 HE ARG B 108 28.514 17.208 19.072 1.00 0.00 H ATOM 3744 HH12 ARG B 108 26.432 17.535 22.586 1.00 0.00 H ATOM 3745 HH11 ARG B 108 27.631 16.205 22.395 1.00 0.00 H ATOM 3746 HH22 ARG B 108 26.067 19.026 20.852 1.00 0.00 H ATOM 3747 HH21 ARG B 108 26.978 18.865 19.306 1.00 0.00 H ATOM 3748 H ARG B 108 31.638 18.913 20.842 1.00 0.00 H ATOM 3749 N LEU B 109 34.813 16.354 20.080 1.00 8.01 N ATOM 3750 CA LEU B 109 36.040 16.322 19.279 1.00 8.16 C ATOM 3751 C LEU B 109 36.257 14.935 18.733 1.00 8.35 C ATOM 3752 O LEU B 109 35.691 13.914 19.183 1.00 8.70 O ATOM 3753 CB LEU B 109 37.244 16.738 20.132 1.00 8.51 C ATOM 3754 CG LEU B 109 37.090 18.065 20.896 1.00 8.58 C ATOM 3755 CD1 LEU B 109 38.314 18.349 21.716 1.00 9.08 C ATOM 3756 CD2 LEU B 109 36.811 19.220 19.907 1.00 9.31 C ATOM 3757 HA LEU B 109 35.937 17.024 18.451 1.00 0.00 H ATOM 3758 HB2 LEU B 109 37.427 15.949 20.862 1.00 0.00 H ATOM 3759 HB3 LEU B 109 38.107 16.828 19.473 1.00 0.00 H ATOM 3760 HG LEU B 109 36.242 17.980 21.576 1.00 0.00 H ATOM 3761 HD21 LEU B 109 37.641 19.305 19.206 1.00 0.00 H ATOM 3762 HD22 LEU B 109 35.891 19.014 19.359 1.00 0.00 H ATOM 3763 HD23 LEU B 109 36.704 20.153 20.461 1.00 0.00 H ATOM 3764 HD11 LEU B 109 38.463 17.543 22.434 1.00 0.00 H ATOM 3765 HD12 LEU B 109 39.182 18.418 21.060 1.00 0.00 H ATOM 3766 HD13 LEU B 109 38.183 19.292 22.247 1.00 0.00 H ATOM 3767 H LEU B 109 34.760 15.749 20.925 1.00 0.00 H ATOM 3768 N GLU B 110 37.156 14.850 17.757 1.00 8.51 N ATOM 3769 CA GLU B 110 37.535 13.619 17.111 1.00 8.56 C ATOM 3770 C GLU B 110 38.978 13.752 16.668 1.00 8.47 C ATOM 3771 O GLU B 110 39.391 14.813 16.219 1.00 9.32 O ATOM 3772 CB GLU B 110 36.622 13.344 15.905 1.00 8.48 C ATOM 3773 CG GLU B 110 36.958 12.124 15.072 1.00 9.07 C ATOM 3774 CD GLU B 110 36.108 12.032 13.800 1.00 8.70 C ATOM 3775 OE1 GLU B 110 35.128 12.793 13.661 1.00 9.28 O ATOM 3776 OE2 GLU B 110 36.485 11.177 12.939 1.00 9.63 O ATOM 3777 HA GLU B 110 37.430 12.781 17.801 1.00 0.00 H ATOM 3778 HB2 GLU B 110 35.606 13.221 16.279 1.00 0.00 H ATOM 3779 HB3 GLU B 110 36.664 14.215 15.251 1.00 0.00 H ATOM 3780 HG2 GLU B 110 38.009 12.173 14.788 1.00 0.00 H ATOM 3781 HG3 GLU B 110 36.786 11.231 15.673 1.00 0.00 H ATOM 3782 H GLU B 110 37.615 15.728 17.440 1.00 0.00 H ATOM 3783 N ALA B 111 39.738 12.666 16.781 1.00 8.85 N ATOM 3784 CA ALA B 111 41.063 12.524 16.120 1.00 8.93 C ATOM 3785 C ALA B 111 40.868 11.482 15.046 1.00 9.14 C ATOM 3786 O ALA B 111 40.385 10.362 15.351 1.00 10.21 O ATOM 3787 CB ALA B 111 42.129 12.135 17.094 1.00 10.24 C ATOM 3788 HA ALA B 111 41.402 13.469 15.696 1.00 0.00 H ATOM 3789 HB1 ALA B 111 42.211 12.900 17.866 1.00 0.00 H ATOM 3790 HB2 ALA B 111 41.870 11.181 17.552 1.00 0.00 H ATOM 3791 HB3 ALA B 111 43.081 12.042 16.571 1.00 0.00 H ATOM 3792 H ALA B 111 39.388 11.877 17.361 1.00 0.00 H ATOM 3793 N HIS B 112 41.172 11.803 13.789 1.00 8.90 N ATOM 3794 CA HIS B 112 40.828 10.969 12.659 1.00 9.85 C ATOM 3795 C HIS B 112 41.983 10.744 11.713 1.00 9.52 C ATOM 3796 O HIS B 112 42.669 11.687 11.342 1.00 10.17 O ATOM 3797 CB HIS B 112 39.669 11.617 11.875 1.00 9.74 C ATOM 3798 CG HIS B 112 39.237 10.847 10.673 1.00 9.37 C ATOM 3799 ND1 HIS B 112 38.816 9.536 10.732 1.00 10.15 N ATOM 3800 CD2 HIS B 112 39.160 11.202 9.365 1.00 9.76 C ATOM 3801 CE1 HIS B 112 38.480 9.127 9.521 1.00 10.40 C ATOM 3802 NE2 HIS B 112 38.703 10.126 8.669 1.00 9.80 N ATOM 3803 HA HIS B 112 40.540 9.999 13.064 1.00 0.00 H ATOM 3804 HB2 HIS B 112 38.815 11.713 12.545 1.00 0.00 H ATOM 3805 HB3 HIS B 112 39.988 12.608 11.550 1.00 0.00 H ATOM 3806 HD2 HIS B 112 39.418 12.175 8.947 1.00 0.00 H ATOM 3807 HE1 HIS B 112 38.088 8.143 9.264 1.00 0.00 H ATOM 3808 H HIS B 112 41.680 12.693 13.613 1.00 0.00 H ATOM 3809 N VAL B 113 42.109 9.487 11.270 1.00 10.15 N ATOM 3810 CA VAL B 113 43.063 9.065 10.225 1.00 10.64 C ATOM 3811 C VAL B 113 42.289 8.991 8.903 1.00 10.54 C ATOM 3812 O VAL B 113 41.344 8.199 8.788 1.00 11.69 O ATOM 3813 CB VAL B 113 43.651 7.706 10.535 1.00 11.57 C ATOM 3814 CG1 VAL B 113 44.650 7.284 9.432 1.00 14.78 C ATOM 3815 CG2 VAL B 113 44.405 7.706 11.875 1.00 13.21 C ATOM 3816 HA VAL B 113 43.886 9.778 10.170 1.00 0.00 H ATOM 3817 HB VAL B 113 42.816 7.007 10.587 1.00 0.00 H ATOM 3818 HG11 VAL B 113 44.133 7.237 8.474 1.00 0.00 H ATOM 3819 HG12 VAL B 113 45.457 8.015 9.375 1.00 0.00 H ATOM 3820 HG13 VAL B 113 45.062 6.304 9.673 1.00 0.00 H ATOM 3821 HG21 VAL B 113 45.218 8.431 11.833 1.00 0.00 H ATOM 3822 HG22 VAL B 113 43.718 7.975 12.677 1.00 0.00 H ATOM 3823 HG23 VAL B 113 44.812 6.712 12.061 1.00 0.00 H ATOM 3824 H VAL B 113 41.495 8.760 11.689 1.00 0.00 H ATOM 3825 N GLY B 114 42.695 9.761 7.920 1.00 11.58 N ATOM 3826 CA GLY B 114 42.010 9.789 6.630 1.00 11.96 C ATOM 3827 C GLY B 114 41.594 11.188 6.248 1.00 10.08 C ATOM 3828 O GLY B 114 41.880 12.161 6.979 1.00 12.49 O ATOM 3829 HA3 GLY B 114 41.122 9.160 6.688 1.00 0.00 H ATOM 3830 HA2 GLY B 114 42.681 9.399 5.865 1.00 0.00 H ATOM 3831 H GLY B 114 43.527 10.368 8.064 1.00 0.00 H ATOM 3832 N ASP B 115 40.969 11.308 5.109 1.00 10.31 N ATOM 3833 CA ASP B 115 40.562 12.620 4.587 1.00 10.52 C ATOM 3834 C ASP B 115 39.325 12.450 3.750 1.00 9.74 C ATOM 3835 O ASP B 115 38.751 11.351 3.700 1.00 10.07 O ATOM 3836 CB ASP B 115 41.715 13.291 3.842 1.00 12.28 C ATOM 3837 CG ASP B 115 42.219 12.522 2.690 1.00 14.47 C ATOM 3838 OD1 ASP B 115 43.409 12.853 2.363 1.00 21.24 O ATOM 3839 OD2 ASP B 115 41.653 11.584 2.158 1.00 15.06 O ATOM 3840 HA ASP B 115 40.314 13.294 5.407 1.00 0.00 H ATOM 3841 HB2 ASP B 115 41.371 14.261 3.482 1.00 0.00 H ATOM 3842 HB3 ASP B 115 42.537 13.436 4.543 1.00 0.00 H ATOM 3843 H ASP B 115 40.753 10.454 4.557 1.00 0.00 H ATOM 3844 N LEU B 116 38.869 13.525 3.118 1.00 9.61 N ATOM 3845 CA LEU B 116 37.631 13.437 2.369 1.00 10.10 C ATOM 3846 C LEU B 116 37.788 12.454 1.217 1.00 9.70 C ATOM 3847 O LEU B 116 36.857 11.700 0.921 1.00 10.58 O ATOM 3848 CB LEU B 116 37.283 14.837 1.820 1.00 10.61 C ATOM 3849 CG LEU B 116 36.091 14.905 0.853 1.00 11.56 C ATOM 3850 CD1 LEU B 116 34.793 14.319 1.448 1.00 12.62 C ATOM 3851 CD2 LEU B 116 35.869 16.340 0.410 1.00 15.84 C ATOM 3852 HA LEU B 116 36.831 13.085 3.020 1.00 0.00 H ATOM 3853 HB2 LEU B 116 37.061 15.483 2.670 1.00 0.00 H ATOM 3854 HB3 LEU B 116 38.160 15.217 1.296 1.00 0.00 H ATOM 3855 HG LEU B 116 36.342 14.285 -0.007 1.00 0.00 H ATOM 3856 HD21 LEU B 116 35.662 16.960 1.282 1.00 0.00 H ATOM 3857 HD22 LEU B 116 36.764 16.706 -0.094 1.00 0.00 H ATOM 3858 HD23 LEU B 116 35.022 16.380 -0.275 1.00 0.00 H ATOM 3859 HD11 LEU B 116 34.952 13.271 1.703 1.00 0.00 H ATOM 3860 HD12 LEU B 116 34.523 14.875 2.345 1.00 0.00 H ATOM 3861 HD13 LEU B 116 33.991 14.398 0.714 1.00 0.00 H ATOM 3862 H LEU B 116 39.395 14.421 3.160 1.00 0.00 H ATOM 3863 N ARG B 117 38.915 12.454 0.561 1.00 10.36 N ATOM 3864 CA ARG B 117 39.088 11.541 -0.583 1.00 10.88 C ATOM 3865 C ARG B 117 39.089 10.085 -0.134 1.00 10.69 C ATOM 3866 O ARG B 117 38.501 9.229 -0.806 1.00 11.51 O ATOM 3867 CB ARG B 117 40.275 11.925 -1.466 1.00 11.26 C ATOM 3868 CG ARG B 117 40.196 13.343 -2.031 1.00 13.31 C ATOM 3869 CD ARG B 117 39.011 13.519 -3.004 1.00 13.74 C ATOM 3870 NE ARG B 117 38.575 14.910 -2.971 1.00 14.10 N ATOM 3871 CZ ARG B 117 37.483 15.325 -3.621 1.00 14.78 C ATOM 3872 NH1 ARG B 117 36.732 14.544 -4.349 1.00 15.79 N ATOM 3873 NH2 ARG B 117 37.118 16.614 -3.544 1.00 16.91 N ATOM 3874 HA ARG B 117 38.219 11.653 -1.232 1.00 0.00 H ATOM 3875 HB2 ARG B 117 41.185 11.842 -0.872 1.00 0.00 H ATOM 3876 HB3 ARG B 117 40.322 11.225 -2.300 1.00 0.00 H ATOM 3877 HG2 ARG B 117 40.079 14.044 -1.205 1.00 0.00 H ATOM 3878 HG3 ARG B 117 41.122 13.561 -2.563 1.00 0.00 H ATOM 3879 HD2 ARG B 117 38.189 12.870 -2.701 1.00 0.00 H ATOM 3880 HD3 ARG B 117 39.325 13.258 -4.015 1.00 0.00 H ATOM 3881 HE ARG B 117 39.130 15.600 -2.426 1.00 0.00 H ATOM 3882 HH12 ARG B 117 35.894 14.929 -4.830 1.00 0.00 H ATOM 3883 HH11 ARG B 117 36.971 13.537 -4.448 1.00 0.00 H ATOM 3884 HH22 ARG B 117 36.270 16.945 -4.047 1.00 0.00 H ATOM 3885 HH21 ARG B 117 37.683 17.282 -2.982 1.00 0.00 H ATOM 3886 H ARG B 117 39.686 13.093 0.843 1.00 0.00 H ATOM 3887 N SER B 118 39.740 9.759 0.974 1.00 11.08 N ATOM 3888 CA SER B 118 39.766 8.376 1.428 1.00 10.97 C ATOM 3889 C SER B 118 38.342 7.957 1.814 1.00 10.60 C ATOM 3890 O SER B 118 37.920 6.822 1.562 1.00 11.42 O ATOM 3891 CB SER B 118 40.798 8.115 2.529 1.00 12.17 C ATOM 3892 OG SER B 118 40.422 8.705 3.759 1.00 11.61 O ATOM 3893 HA SER B 118 40.106 7.745 0.607 1.00 0.00 H ATOM 3894 HB2 SER B 118 41.757 8.529 2.218 1.00 0.00 H ATOM 3895 HB3 SER B 118 40.897 7.039 2.670 1.00 0.00 H ATOM 3896 HG SER B 118 39.554 8.329 4.052 1.00 0.00 H ATOM 3897 H SER B 118 40.234 10.493 1.520 1.00 0.00 H ATOM 3898 N ARG B 119 37.575 8.864 2.401 1.00 10.03 N ATOM 3899 CA ARG B 119 36.181 8.586 2.741 1.00 10.44 C ATOM 3900 C ARG B 119 35.364 8.339 1.481 1.00 10.33 C ATOM 3901 O ARG B 119 34.591 7.371 1.425 1.00 11.40 O ATOM 3902 CB ARG B 119 35.599 9.757 3.530 1.00 10.36 C ATOM 3903 CG ARG B 119 34.147 9.609 3.892 1.00 10.83 C ATOM 3904 CD ARG B 119 33.805 8.360 4.711 1.00 11.01 C ATOM 3905 NE ARG B 119 34.627 8.330 5.899 1.00 10.86 N ATOM 3906 CZ ARG B 119 34.363 8.977 7.035 1.00 10.73 C ATOM 3907 NH1 ARG B 119 33.316 9.719 7.182 1.00 11.84 N ATOM 3908 NH2 ARG B 119 35.245 8.861 8.017 1.00 12.27 N ATOM 3909 HA ARG B 119 36.140 7.687 3.356 1.00 0.00 H ATOM 3910 HB2 ARG B 119 36.170 9.863 4.452 1.00 0.00 H ATOM 3911 HB3 ARG B 119 35.709 10.660 2.930 1.00 0.00 H ATOM 3912 HG2 ARG B 119 33.852 10.484 4.471 1.00 0.00 H ATOM 3913 HG3 ARG B 119 33.570 9.575 2.968 1.00 0.00 H ATOM 3914 HD2 ARG B 119 33.995 7.469 4.113 1.00 0.00 H ATOM 3915 HD3 ARG B 119 32.753 8.387 4.996 1.00 0.00 H ATOM 3916 HE ARG B 119 35.495 7.758 5.866 1.00 0.00 H ATOM 3917 HH12 ARG B 119 33.147 10.207 8.085 1.00 0.00 H ATOM 3918 HH11 ARG B 119 32.642 9.829 6.398 1.00 0.00 H ATOM 3919 HH22 ARG B 119 35.083 9.347 8.922 1.00 0.00 H ATOM 3920 HH21 ARG B 119 36.100 8.284 7.883 1.00 0.00 H ATOM 3921 H ARG B 119 37.975 9.797 2.626 1.00 0.00 H ATOM 3922 N LEU B 120 35.456 9.228 0.474 1.00 10.45 N ATOM 3923 CA LEU B 120 34.659 9.040 -0.711 1.00 10.83 C ATOM 3924 C LEU B 120 35.009 7.726 -1.383 1.00 11.02 C ATOM 3925 O LEU B 120 34.080 7.037 -1.885 1.00 12.69 O ATOM 3926 CB LEU B 120 34.874 10.236 -1.667 1.00 11.22 C ATOM 3927 CG LEU B 120 34.293 11.559 -1.170 1.00 11.01 C ATOM 3928 CD1 LEU B 120 34.826 12.709 -2.009 1.00 12.21 C ATOM 3929 CD2 LEU B 120 32.784 11.552 -1.185 1.00 12.72 C ATOM 3930 HA LEU B 120 33.605 8.997 -0.438 1.00 0.00 H ATOM 3931 HB2 LEU B 120 35.946 10.368 -1.811 1.00 0.00 H ATOM 3932 HB3 LEU B 120 34.407 9.997 -2.622 1.00 0.00 H ATOM 3933 HG LEU B 120 34.607 11.692 -0.135 1.00 0.00 H ATOM 3934 HD21 LEU B 120 32.433 11.385 -2.203 1.00 0.00 H ATOM 3935 HD22 LEU B 120 32.419 10.754 -0.538 1.00 0.00 H ATOM 3936 HD23 LEU B 120 32.414 12.512 -0.824 1.00 0.00 H ATOM 3937 HD11 LEU B 120 35.913 12.742 -1.930 1.00 0.00 H ATOM 3938 HD12 LEU B 120 34.541 12.560 -3.050 1.00 0.00 H ATOM 3939 HD13 LEU B 120 34.406 13.647 -1.646 1.00 0.00 H ATOM 3940 H LEU B 120 36.097 10.043 0.551 1.00 0.00 H ATOM 3941 N ALA B 121 36.285 7.375 -1.453 1.00 11.30 N ATOM 3942 CA ALA B 121 36.678 6.131 -2.109 1.00 12.30 C ATOM 3943 C ALA B 121 36.057 4.943 -1.381 1.00 12.77 C ATOM 3944 O ALA B 121 35.577 3.982 -2.003 1.00 13.71 O ATOM 3945 CB ALA B 121 38.176 6.023 -2.218 1.00 13.58 C ATOM 3946 HA ALA B 121 36.297 6.129 -3.130 1.00 0.00 H ATOM 3947 HB1 ALA B 121 38.558 6.861 -2.802 1.00 0.00 H ATOM 3948 HB2 ALA B 121 38.614 6.044 -1.220 1.00 0.00 H ATOM 3949 HB3 ALA B 121 38.437 5.086 -2.711 1.00 0.00 H ATOM 3950 H ALA B 121 37.013 7.991 -1.037 1.00 0.00 H ATOM 3951 N ALA B 122 36.104 4.943 -0.056 1.00 12.09 N ATOM 3952 CA ALA B 122 35.541 3.848 0.718 1.00 12.97 C ATOM 3953 C ALA B 122 34.017 3.787 0.560 1.00 12.82 C ATOM 3954 O ALA B 122 33.452 2.701 0.442 1.00 14.71 O ATOM 3955 CB ALA B 122 35.937 3.982 2.173 1.00 13.24 C ATOM 3956 HA ALA B 122 35.945 2.910 0.337 1.00 0.00 H ATOM 3957 HB1 ALA B 122 37.024 3.958 2.256 1.00 0.00 H ATOM 3958 HB2 ALA B 122 35.562 4.928 2.565 1.00 0.00 H ATOM 3959 HB3 ALA B 122 35.510 3.156 2.742 1.00 0.00 H ATOM 3960 H ALA B 122 36.552 5.741 0.439 1.00 0.00 H ATOM 3961 N CYS B 123 33.379 4.932 0.521 1.00 12.83 N ATOM 3962 CA CYS B 123 31.926 5.000 0.366 1.00 13.64 C ATOM 3963 C CYS B 123 31.490 4.537 -0.995 1.00 14.76 C ATOM 3964 O CYS B 123 30.451 3.885 -1.160 1.00 18.23 O ATOM 3965 CB CYS B 123 31.421 6.399 0.620 1.00 14.73 C ATOM 3966 SG CYS B 123 31.497 6.921 2.346 1.00 16.40 S ATOM 3967 HA CYS B 123 31.494 4.328 1.107 1.00 0.00 H ATOM 3968 HB2 CYS B 123 30.382 6.451 0.294 1.00 0.00 H ATOM 3969 HB3 CYS B 123 32.021 7.090 0.028 1.00 0.00 H ATOM 3970 HG CYS B 123 32.807 6.882 2.780 1.00 0.00 H ATOM 3971 H CYS B 123 33.921 5.816 0.602 1.00 0.00 H ATOM 3972 N ARG B 124 32.304 4.734 -2.067 1.00 14.46 N ATOM 3973 CA ARG B 124 31.887 4.215 -3.331 1.00 16.91 C ATOM 3974 C ARG B 124 31.854 2.710 -3.295 1.00 18.82 C ATOM 3975 O ARG B 124 31.075 2.097 -4.047 1.00 23.82 O ATOM 3976 CB ARG B 124 32.868 4.693 -4.410 1.00 17.63 C ATOM 3977 CG ARG B 124 32.651 6.149 -4.746 1.00 18.34 C ATOM 3978 CD ARG B 124 33.586 6.548 -5.868 1.00 20.06 C ATOM 3979 NE ARG B 124 33.481 7.963 -6.235 1.00 21.48 N ATOM 3980 CZ ARG B 124 32.584 8.374 -7.142 1.00 24.71 C ATOM 3981 NH1 ARG B 124 31.699 7.585 -7.770 1.00 25.74 N ATOM 3982 NH2 ARG B 124 32.508 9.676 -7.459 1.00 26.79 N ATOM 3983 HA ARG B 124 30.883 4.574 -3.558 1.00 0.00 H ATOM 3984 HB2 ARG B 124 33.887 4.561 -4.047 1.00 0.00 H ATOM 3985 HB3 ARG B 124 32.724 4.096 -5.310 1.00 0.00 H ATOM 3986 HG2 ARG B 124 31.618 6.300 -5.061 1.00 0.00 H ATOM 3987 HG3 ARG B 124 32.855 6.760 -3.867 1.00 0.00 H ATOM 3988 HD2 ARG B 124 33.352 5.945 -6.745 1.00 0.00 H ATOM 3989 HD3 ARG B 124 34.610 6.347 -5.553 1.00 0.00 H ATOM 3990 HE ARG B 124 34.111 8.658 -5.785 1.00 0.00 H ATOM 3991 HH12 ARG B 124 31.038 7.993 -8.462 1.00 0.00 H ATOM 3992 HH11 ARG B 124 31.674 6.566 -7.565 1.00 0.00 H ATOM 3993 HH22 ARG B 124 31.814 10.000 -8.162 1.00 0.00 H ATOM 3994 HH21 ARG B 124 33.143 10.361 -7.001 1.00 0.00 H ATOM 3995 H ARG B 124 33.203 5.247 -1.969 1.00 0.00 H ATOM 3996 N GLN B 125 32.712 2.054 -2.520 1.00 18.69 N ATOM 3997 CA GLN B 125 32.728 0.612 -2.375 1.00 20.62 C ATOM 3998 C GLN B 125 31.682 0.097 -1.400 1.00 23.30 C ATOM 3999 O GLN B 125 31.272 -1.076 -1.582 1.00 30.93 O ATOM 4000 CB GLN B 125 34.100 0.102 -1.885 1.00 21.03 C ATOM 4001 CG GLN B 125 35.255 0.447 -2.829 1.00 26.28 C ATOM 4002 CD GLN B 125 35.188 -0.043 -4.246 1.00 34.36 C ATOM 4003 OE1 GLN B 125 35.233 0.662 -5.270 1.00 42.25 O ATOM 4004 NE2 GLN B 125 35.083 -1.369 -4.295 1.00 45.61 N ATOM 4005 HA GLN B 125 32.508 0.234 -3.373 1.00 0.00 H ATOM 4006 HB2 GLN B 125 34.306 0.547 -0.911 1.00 0.00 H ATOM 4007 HB3 GLN B 125 34.049 -0.982 -1.784 1.00 0.00 H ATOM 4008 HG2 GLN B 125 35.328 1.534 -2.866 1.00 0.00 H ATOM 4009 HG3 GLN B 125 36.165 0.038 -2.389 1.00 0.00 H ATOM 4010 HE22 GLN B 125 35.049 -1.921 -3.414 1.00 0.00 H ATOM 4011 HE21 GLN B 125 35.035 -1.853 -5.214 1.00 0.00 H ATOM 4012 H GLN B 125 33.412 2.608 -1.987 1.00 0.00 H ATOM 4013 N ALA B 126 31.222 0.905 -0.474 1.00 23.54 N ATOM 4014 CA ALA B 126 30.302 0.486 0.591 1.00 27.18 C ATOM 4015 C ALA B 126 29.442 1.682 0.959 1.00 26.81 C ATOM 4016 O ALA B 126 29.668 2.379 1.974 1.00 25.73 O ATOM 4017 CB ALA B 126 31.138 -0.073 1.715 1.00 28.49 C ATOM 4018 HA ALA B 126 29.611 -0.304 0.296 1.00 0.00 H ATOM 4019 HB1 ALA B 126 31.713 -0.924 1.350 1.00 0.00 H ATOM 4020 HB2 ALA B 126 31.818 0.698 2.078 1.00 0.00 H ATOM 4021 HB3 ALA B 126 30.485 -0.395 2.526 1.00 0.00 H ATOM 4022 H ALA B 126 31.526 1.899 -0.496 1.00 0.00 H ATOM 4023 N PRO B 127 28.486 1.974 0.079 1.00 27.75 N ATOM 4024 CA PRO B 127 27.754 3.256 0.183 1.00 28.99 C ATOM 4025 C PRO B 127 26.707 3.276 1.287 1.00 27.59 C ATOM 4026 O PRO B 127 26.077 2.260 1.556 1.00 31.27 O ATOM 4027 CB PRO B 127 27.073 3.395 -1.198 1.00 28.82 C ATOM 4028 CG PRO B 127 26.792 1.928 -1.507 1.00 31.18 C ATOM 4029 CD PRO B 127 28.056 1.188 -1.087 1.00 30.66 C ATOM 4030 HA PRO B 127 28.431 4.071 0.437 1.00 0.00 H ATOM 4031 HD3 PRO B 127 27.840 0.155 -0.813 1.00 0.00 H ATOM 4032 HD2 PRO B 127 28.807 1.204 -1.877 1.00 0.00 H ATOM 4033 HG3 PRO B 127 26.602 1.790 -2.571 1.00 0.00 H ATOM 4034 HG2 PRO B 127 25.933 1.574 -0.937 1.00 0.00 H ATOM 4035 HB2 PRO B 127 26.155 3.979 -1.139 1.00 0.00 H ATOM 4036 HB3 PRO B 127 27.740 3.843 -1.935 1.00 0.00 H ATOM 4037 N TYR B 128 26.533 4.399 1.940 1.00 25.73 N ATOM 4038 CA TYR B 128 25.438 4.679 2.840 1.00 24.36 C ATOM 4039 C TYR B 128 24.096 4.600 2.123 1.00 25.57 C ATOM 4040 O TYR B 128 24.114 4.658 0.884 1.00 25.12 O ATOM 4041 CB TYR B 128 25.646 6.086 3.337 1.00 25.17 C ATOM 4042 CG TYR B 128 26.979 6.367 3.987 1.00 24.97 C ATOM 4043 CD1 TYR B 128 27.412 7.653 4.095 1.00 22.80 C ATOM 4044 CD2 TYR B 128 27.788 5.358 4.488 1.00 27.07 C ATOM 4045 CE1 TYR B 128 28.609 8.016 4.669 1.00 24.50 C ATOM 4046 CE2 TYR B 128 28.999 5.665 5.088 1.00 27.00 C ATOM 4047 CZ TYR B 128 29.402 7.001 5.168 1.00 25.26 C ATOM 4048 OH TYR B 128 30.600 7.325 5.765 1.00 26.23 O ATOM 4049 HA TYR B 128 25.422 3.949 3.650 1.00 0.00 H ATOM 4050 HB3 TYR B 128 24.866 6.301 4.068 1.00 0.00 H ATOM 4051 HB2 TYR B 128 25.541 6.760 2.487 1.00 0.00 H ATOM 4052 HD2 TYR B 128 27.470 4.318 4.409 1.00 0.00 H ATOM 4053 HE2 TYR B 128 29.630 4.874 5.493 1.00 0.00 H ATOM 4054 HE1 TYR B 128 28.918 9.060 4.727 1.00 0.00 H ATOM 4055 HD1 TYR B 128 26.772 8.443 3.703 1.00 0.00 H ATOM 4056 HH TYR B 128 30.727 8.306 5.735 1.00 0.00 H ATOM 4057 H TYR B 128 27.240 5.149 1.799 1.00 0.00 H ATOM 4058 N ALA B 129 22.977 4.511 2.807 1.00 24.61 N ATOM 4059 CA ALA B 129 21.647 4.450 2.200 1.00 22.68 C ATOM 4060 C ALA B 129 21.377 5.680 1.320 1.00 19.31 C ATOM 4061 O ALA B 129 21.536 6.803 1.732 1.00 19.39 O ATOM 4062 CB ALA B 129 20.655 4.275 3.320 1.00 31.73 C ATOM 4063 HA ALA B 129 21.560 3.604 1.518 1.00 0.00 H ATOM 4064 HB1 ALA B 129 20.875 3.353 3.858 1.00 0.00 H ATOM 4065 HB2 ALA B 129 20.727 5.121 4.003 1.00 0.00 H ATOM 4066 HB3 ALA B 129 19.648 4.225 2.907 1.00 0.00 H ATOM 4067 H ALA B 129 23.041 4.482 3.845 1.00 0.00 H ATOM 4068 N GLY B 130 20.999 5.450 0.037 1.00 21.97 N ATOM 4069 CA GLY B 130 20.735 6.462 -0.934 1.00 22.11 C ATOM 4070 C GLY B 130 21.883 7.316 -1.402 1.00 21.09 C ATOM 4071 O GLY B 130 21.713 8.441 -1.918 1.00 22.48 O ATOM 4072 HA3 GLY B 130 19.987 7.131 -0.509 1.00 0.00 H ATOM 4073 HA2 GLY B 130 20.321 5.967 -1.812 1.00 0.00 H ATOM 4074 H GLY B 130 20.894 4.459 -0.262 1.00 0.00 H ATOM 4075 N MET B 131 23.120 6.861 -1.262 1.00 21.68 N ATOM 4076 CA MET B 131 24.275 7.693 -1.488 1.00 19.91 C ATOM 4077 C MET B 131 24.462 7.953 -2.986 1.00 19.79 C ATOM 4078 O MET B 131 24.324 7.024 -3.769 1.00 23.46 O ATOM 4079 CB MET B 131 25.532 7.089 -0.910 1.00 20.59 C ATOM 4080 CG MET B 131 26.690 8.047 -0.744 1.00 19.49 C ATOM 4081 SD MET B 131 27.812 7.476 0.527 1.00 20.27 S ATOM 4082 CE MET B 131 28.719 8.942 0.958 1.00 26.68 C ATOM 4083 HA MET B 131 24.096 8.638 -0.975 1.00 0.00 H ATOM 4084 HB2 MET B 131 25.290 6.680 0.071 1.00 0.00 H ATOM 4085 HB3 MET B 131 25.853 6.283 -1.570 1.00 0.00 H ATOM 4086 HG2 MET B 131 26.305 9.028 -0.466 1.00 0.00 H ATOM 4087 HG3 MET B 131 27.229 8.123 -1.688 1.00 0.00 H ATOM 4088 HE1 MET B 131 29.241 9.317 0.078 1.00 0.00 H ATOM 4089 HE2 MET B 131 28.027 9.702 1.322 1.00 0.00 H ATOM 4090 HE3 MET B 131 29.443 8.704 1.738 1.00 0.00 H ATOM 4091 H MET B 131 23.262 5.870 -0.980 1.00 0.00 H ATOM 4092 N ARG B 132 24.787 9.171 -3.318 1.00 18.60 N ATOM 4093 CA ARG B 132 25.076 9.695 -4.646 1.00 20.64 C ATOM 4094 C ARG B 132 26.337 10.556 -4.611 1.00 19.44 C ATOM 4095 O ARG B 132 26.528 11.262 -3.599 1.00 20.11 O ATOM 4096 CB ARG B 132 23.938 10.562 -5.149 1.00 23.95 C ATOM 4097 CG ARG B 132 22.518 10.080 -4.984 1.00 28.50 C ATOM 4098 CD ARG B 132 22.277 8.860 -5.844 1.00 34.81 C ATOM 4099 NE ARG B 132 20.918 8.393 -5.563 1.00 37.95 N ATOM 4100 CZ ARG B 132 20.441 7.309 -4.996 1.00 40.50 C ATOM 4101 NH1 ARG B 132 21.285 6.385 -4.532 1.00 42.72 N ATOM 4102 NH2 ARG B 132 19.128 7.132 -4.881 1.00 45.70 N ATOM 4103 HA ARG B 132 25.212 8.841 -5.310 1.00 0.00 H ATOM 4104 HB2 ARG B 132 24.012 11.518 -4.631 1.00 0.00 H ATOM 4105 HB3 ARG B 132 24.101 10.715 -6.216 1.00 0.00 H ATOM 4106 HG2 ARG B 132 22.343 9.824 -3.939 1.00 0.00 H ATOM 4107 HG3 ARG B 132 21.832 10.872 -5.282 1.00 0.00 H ATOM 4108 HD2 ARG B 132 22.998 8.081 -5.598 1.00 0.00 H ATOM 4109 HD3 ARG B 132 22.372 9.121 -6.898 1.00 0.00 H ATOM 4110 HE ARG B 132 20.180 9.055 -5.877 1.00 0.00 H ATOM 4111 HH12 ARG B 132 20.916 5.523 -4.081 1.00 0.00 H ATOM 4112 HH11 ARG B 132 22.311 6.527 -4.621 1.00 0.00 H ATOM 4113 HH22 ARG B 132 18.757 6.271 -4.431 1.00 0.00 H ATOM 4114 HH21 ARG B 132 18.472 7.854 -5.241 1.00 0.00 H ATOM 4115 H ARG B 132 24.848 9.854 -2.536 1.00 0.00 H ATOM 4116 N PHE B 133 27.142 10.456 -5.630 1.00 17.18 N ATOM 4117 CA PHE B 133 28.413 11.111 -5.703 1.00 18.31 C ATOM 4118 C PHE B 133 28.469 12.125 -6.809 1.00 20.34 C ATOM 4119 O PHE B 133 27.799 11.868 -7.837 1.00 24.55 O ATOM 4120 CB PHE B 133 29.504 10.067 -5.944 1.00 19.20 C ATOM 4121 CG PHE B 133 29.602 9.039 -4.793 1.00 18.32 C ATOM 4122 CD1 PHE B 133 28.881 7.868 -4.818 1.00 18.59 C ATOM 4123 CD2 PHE B 133 30.449 9.275 -3.729 1.00 19.18 C ATOM 4124 CE1 PHE B 133 28.917 6.905 -3.833 1.00 20.19 C ATOM 4125 CE2 PHE B 133 30.475 8.330 -2.726 1.00 20.95 C ATOM 4126 CZ PHE B 133 29.767 7.167 -2.758 1.00 19.70 C ATOM 4127 HA PHE B 133 28.567 11.632 -4.758 1.00 0.00 H ATOM 4128 HB2 PHE B 133 29.282 9.536 -6.870 1.00 0.00 H ATOM 4129 HB3 PHE B 133 30.462 10.578 -6.040 1.00 0.00 H ATOM 4130 HD2 PHE B 133 31.070 10.170 -3.684 1.00 0.00 H ATOM 4131 HE2 PHE B 133 31.100 8.525 -1.855 1.00 0.00 H ATOM 4132 HZ PHE B 133 29.864 6.444 -1.948 1.00 0.00 H ATOM 4133 HE1 PHE B 133 28.319 5.996 -3.890 1.00 0.00 H ATOM 4134 HD1 PHE B 133 28.235 7.689 -5.678 1.00 0.00 H ATOM 4135 H PHE B 133 26.845 9.868 -6.435 1.00 0.00 H ATOM 4136 N ALA B 134 29.259 13.164 -6.634 1.00 20.08 N ATOM 4137 CA ALA B 134 29.431 14.149 -7.685 1.00 23.23 C ATOM 4138 C ALA B 134 30.298 15.287 -7.147 1.00 26.00 C ATOM 4139 O ALA B 134 30.204 16.392 -7.694 1.00 47.84 O ATOM 4140 CB ALA B 134 28.071 14.608 -8.229 1.00 38.82 C ATOM 4141 HA ALA B 134 29.949 13.717 -8.541 1.00 0.00 H ATOM 4142 HB1 ALA B 134 27.535 13.750 -8.635 1.00 0.00 H ATOM 4143 HB2 ALA B 134 27.489 15.053 -7.421 1.00 0.00 H ATOM 4144 HB3 ALA B 134 28.226 15.346 -9.016 1.00 0.00 H ATOM 4145 H ALA B 134 29.765 13.280 -5.733 1.00 0.00 H TER 4146 ALA B 134 HETATM 4147 MN MN A 1 33.610 13.051 12.252 1.00 8.91 MN HETATM 4148 MN MN A 2 35.417 34.832 14.814 1.00 8.95 MN HETATM 4149 O HOH 3 21.624 30.756 16.580 1.00 11.48 O HETATM 4150 O HOH 4 27.733 40.939 10.492 1.00 9.91 O HETATM 4151 O HOH 5 27.220 28.013 16.382 1.00 10.60 O HETATM 4152 O HOH 6 21.203 40.708 7.720 1.00 11.64 O HETATM 4153 O HOH 7 25.200 43.474 11.639 1.00 12.29 O HETATM 4154 O HOH 8 18.632 22.525 8.353 1.00 11.61 O HETATM 4155 O HOH 9 27.106 25.146 16.447 1.00 11.61 O HETATM 4156 O HOH 10 21.557 30.343 19.298 1.00 11.69 O HETATM 4157 O HOH 11 22.075 24.302 8.430 1.00 11.48 O HETATM 4158 O HOH 12 31.485 46.896 11.999 1.00 16.58 O HETATM 4159 O HOH 13 28.503 45.180 1.421 1.00 14.81 O HETATM 4160 O HOH 14 29.735 42.794 10.582 1.00 12.79 O HETATM 4161 O HOH 15 39.989 16.705 -1.178 1.00 15.16 O HETATM 4162 O HOH 16 34.062 41.257 15.906 1.00 13.17 O HETATM 4163 O HOH 17 45.589 31.753 10.441 1.00 13.87 O HETATM 4164 O HOH 18 29.103 47.077 17.397 1.00 16.40 O HETATM 4165 O HOH 19 50.357 12.507 13.533 1.00 16.83 O HETATM 4166 O HOH 20 35.299 44.394 0.011 1.00 17.79 O HETATM 4167 O HOH 21 39.655 44.058 6.514 1.00 19.12 O HETATM 4168 O HOH 22 29.588 10.551 7.762 1.00 18.11 O HETATM 4169 O HOH 23 42.608 41.518 8.293 1.00 15.25 O HETATM 4170 O HOH 24 26.321 45.852 10.794 1.00 14.79 O HETATM 4171 O HOH 25 47.458 43.290 11.382 1.00 17.04 O HETATM 4172 O HOH 26 40.928 16.956 5.751 1.00 16.20 O HETATM 4173 O HOH 27 38.934 37.355 19.711 1.00 16.75 O HETATM 4174 O HOH 28 17.002 26.117 14.510 1.00 17.64 O HETATM 4175 O HOH 29 36.296 45.094 -4.184 1.00 16.83 O HETATM 4176 O HOH 30 19.479 31.893 20.295 1.00 16.61 O HETATM 4177 O HOH 31 38.717 18.486 2.390 1.00 13.70 O HETATM 4178 O HOH 32 33.326 43.085 -2.955 1.00 17.27 O HETATM 4179 O HOH 33 17.109 23.535 13.423 1.00 16.72 O HETATM 4180 O HOH 34 22.436 43.851 -0.109 1.00 18.54 O HETATM 4181 O HOH 35 28.342 21.182 -5.975 1.00 18.49 O HETATM 4182 O HOH 36 45.228 43.614 9.907 1.00 18.74 O HETATM 4183 O HOH 37 35.465 46.342 -1.882 1.00 19.79 O HETATM 4184 O HOH 38 41.671 41.146 -2.030 1.00 17.26 O HETATM 4185 O HOH 39 38.830 20.115 6.717 1.00 19.79 O HETATM 4186 O HOH 40 33.397 44.272 8.743 1.00 17.00 O HETATM 4187 O HOH 41 36.525 40.286 -6.631 1.00 20.09 O HETATM 4188 O HOH 42 38.491 43.906 3.780 1.00 20.78 O HETATM 4189 O HOH 43 28.052 24.609 20.143 1.00 21.45 O HETATM 4190 O HOH 44 41.003 42.895 17.243 1.00 21.20 O HETATM 4191 O HOH 45 32.520 30.724 -1.956 1.00 18.43 O HETATM 4192 O HOH 46 26.691 38.602 19.117 1.00 22.52 O HETATM 4193 O HOH 47 20.170 33.311 8.252 1.00 18.98 O HETATM 4194 O HOH 48 40.794 35.482 5.394 1.00 18.30 O HETATM 4195 O HOH 49 16.605 24.330 9.056 1.00 18.71 O HETATM 4196 O HOH 50 23.041 24.712 -7.750 1.00 21.24 O HETATM 4197 O HOH 51 35.804 19.825 -4.000 1.00 19.72 O HETATM 4198 O HOH 52 26.833 25.788 22.341 1.00 16.91 O HETATM 4199 O HOH 53 26.631 41.448 -3.943 1.00 18.69 O HETATM 4200 O HOH 54 41.431 17.321 -3.447 1.00 18.17 O HETATM 4201 O HOH 55 19.738 13.479 0.614 1.00 19.70 O HETATM 4202 O HOH 56 32.598 13.097 -5.155 1.00 21.04 O HETATM 4203 O HOH 57 48.133 33.021 10.144 1.00 17.49 O HETATM 4204 O HOH 58 15.997 16.781 6.463 1.00 22.77 O HETATM 4205 O HOH 59 20.451 42.976 6.312 1.00 18.72 O HETATM 4206 O HOH 60 34.774 40.448 18.284 1.00 17.09 O HETATM 4207 O HOH 61 18.412 26.931 1.817 1.00 18.30 O HETATM 4208 O HOH 62 31.963 45.337 -3.824 1.00 20.67 O HETATM 4209 O HOH 63 44.608 41.015 6.395 1.00 21.78 O HETATM 4210 O HOH 64 51.861 38.333 13.585 1.00 20.22 O HETATM 4211 O HOH 65 38.834 45.969 -4.405 1.00 19.92 O HETATM 4212 O HOH 66 18.847 31.163 10.572 1.00 26.81 O HETATM 4213 O HOH 67 28.417 46.798 -0.786 1.00 26.96 O HETATM 4214 O HOH 68 23.917 26.453 -9.637 1.00 22.43 O HETATM 4215 O HOH 69 20.934 22.799 21.045 1.00 22.50 O HETATM 4216 O HOH 70 49.891 31.654 11.682 1.00 25.60 O HETATM 4217 O HOH 71 28.910 25.534 -5.345 1.00 22.12 O HETATM 4218 O HOH 72 41.942 19.409 4.827 1.00 22.76 O HETATM 4219 O HOH 73 19.830 43.942 1.027 1.00 28.76 O HETATM 4220 O HOH 74 35.657 37.887 20.556 1.00 25.93 O HETATM 4221 O HOH 75 42.530 39.801 1.891 1.00 20.20 O HETATM 4222 O HOH 76 23.898 45.779 0.934 1.00 21.69 O HETATM 4223 O HOH 77 24.266 25.051 22.513 1.00 16.61 O HETATM 4224 O HOH 78 27.122 43.966 -4.386 1.00 27.00 O HETATM 4225 O HOH 79 19.106 39.880 5.306 1.00 24.17 O HETATM 4226 O HOH 80 17.655 15.310 1.230 1.00 23.72 O HETATM 4227 O HOH 81 15.437 24.007 11.245 1.00 26.10 O HETATM 4228 O HOH 82 19.003 30.678 15.858 1.00 27.11 O HETATM 4229 O HOH 83 41.145 15.308 0.933 1.00 26.28 O HETATM 4230 O HOH 84 26.767 23.138 18.431 1.00 20.75 O HETATM 4231 O HOH 85 33.101 38.739 -5.345 1.00 26.88 O HETATM 4232 O HOH 86 32.925 47.655 -2.592 1.00 30.80 O HETATM 4233 O HOH 87 42.409 44.273 -1.945 1.00 40.39 O HETATM 4234 O HOH 88 42.194 43.833 6.919 1.00 23.58 O HETATM 4235 O HOH 89 39.625 19.401 -3.943 1.00 29.02 O HETATM 4236 O HOH 90 43.868 18.527 -3.629 1.00 22.11 O HETATM 4237 O HOH 91 13.935 20.427 14.234 1.00 28.36 O HETATM 4238 O HOH 92 39.551 46.134 2.505 1.00 29.95 O HETATM 4239 O HOH 93 46.110 47.336 16.505 1.00 28.63 O HETATM 4240 O HOH 94 20.003 28.726 0.403 1.00 24.72 O HETATM 4241 O HOH 95 49.307 42.440 9.539 1.00 29.45 O HETATM 4242 O HOH 96 22.668 44.100 -2.846 1.00 31.05 O HETATM 4243 O HOH 97 29.225 45.178 -2.974 1.00 24.53 O HETATM 4244 O HOH 98 47.167 21.945 9.395 1.00 24.63 O HETATM 4245 O HOH 99 50.143 39.678 9.132 1.00 32.20 O HETATM 4246 O HOH 100 35.681 22.635 -3.561 1.00 22.94 O HETATM 4247 O HOH 101 25.777 19.847 -6.735 1.00 30.57 O HETATM 4248 O HOH 102 33.132 28.783 -4.142 1.00 26.84 O HETATM 4249 O HOH 103 35.099 45.835 2.607 1.00 20.36 O HETATM 4250 O HOH 104 19.834 26.776 -3.977 1.00 30.36 O HETATM 4251 O HOH 105 32.692 46.613 3.377 1.00 22.62 O HETATM 4252 O HOH 106 28.636 45.177 9.498 1.00 24.86 O HETATM 4253 O HOH 107 46.268 43.004 7.245 1.00 25.02 O HETATM 4254 O HOH 108 33.490 46.963 5.973 1.00 26.56 O HETATM 4255 O HOH 109 43.702 41.652 3.632 1.00 26.98 O HETATM 4256 O HOH 110 52.500 44.407 15.344 1.00 27.66 O HETATM 4257 O HOH 111 17.951 43.511 5.081 1.00 29.33 O HETATM 4258 O HOH 112 19.980 29.949 24.257 1.00 31.79 O HETATM 4259 O HOH 113 19.014 27.695 17.854 1.00 31.47 O HETATM 4260 O HOH 114 52.735 37.582 18.120 1.00 39.09 O HETATM 4261 O HOH 115 13.931 18.296 5.217 1.00 23.87 O HETATM 4262 O HOH 116 50.096 33.674 25.979 1.00 27.56 O HETATM 4263 O HOH 117 26.275 26.476 -6.586 1.00 26.56 O HETATM 4264 O HOH 118 17.922 31.776 18.191 1.00 39.75 O HETATM 4265 O HOH 119 29.312 45.458 5.979 1.00 24.31 O HETATM 4266 O HOH 120 23.938 41.788 -3.776 1.00 27.24 O HETATM 4267 O HOH 121 48.665 45.445 12.525 1.00 26.43 O HETATM 4268 O HOH 122 33.969 24.899 -3.456 1.00 27.45 O HETATM 4269 O HOH 123 28.502 33.561 -2.282 1.00 26.35 O HETATM 4270 O HOH 124 29.351 37.359 -3.692 1.00 24.87 O HETATM 4271 O HOH 125 30.138 45.420 3.506 1.00 32.66 O HETATM 4272 O HOH 126 16.630 27.773 12.481 1.00 23.80 O HETATM 4273 O HOH 127 25.311 46.950 -1.350 1.00 29.61 O HETATM 4274 O HOH 128 24.803 28.387 25.164 1.00 30.92 O HETATM 4275 O HOH 129 43.304 43.931 4.418 1.00 28.36 O HETATM 4276 O HOH 130 22.430 39.737 -4.623 1.00 33.21 O HETATM 4277 O HOH 131 49.834 33.109 28.661 1.00 32.49 O HETATM 4278 O HOH 132 45.671 44.719 5.119 1.00 36.93 O HETATM 4279 O HOH 133 16.762 14.353 15.414 1.00 32.04 O HETATM 4280 O HOH 134 39.872 45.262 -2.014 1.00 26.68 O HETATM 4281 O HOH 135 16.654 40.688 5.958 1.00 31.26 O HETATM 4282 O HOH 136 53.581 39.014 26.190 1.00 33.23 O HETATM 4283 O HOH 137 15.503 14.888 -0.491 1.00 31.42 O HETATM 4284 O HOH 138 24.238 11.223 9.353 1.00 26.82 O HETATM 4285 O HOH 139 43.081 20.997 7.282 1.00 29.57 O HETATM 4286 O HOH 140 36.529 25.676 -2.982 1.00 21.52 O HETATM 4287 O HOH 141 40.760 45.891 10.697 1.00 26.65 O HETATM 4288 O HOH 142 41.786 37.559 3.701 1.00 25.35 O HETATM 4289 O HOH 143 52.164 43.603 10.513 1.00 33.02 O HETATM 4290 O HOH 144 36.631 48.383 -0.855 1.00 36.94 O HETATM 4291 O HOH 145 17.209 11.140 9.787 1.00 31.60 O HETATM 4292 O HOH 146 22.007 17.084 -4.849 1.00 25.46 O HETATM 4293 O HOH 147 24.483 22.423 -8.222 1.00 43.84 O HETATM 4294 O HOH 148 15.768 28.180 8.691 1.00 34.86 O HETATM 4295 O HOH 149 24.908 10.108 13.469 1.00 49.94 O HETATM 4296 O HOH 150 22.889 14.615 -4.961 1.00 34.34 O HETATM 4297 O HOH 151 34.480 45.951 -6.217 1.00 36.39 O HETATM 4298 O HOH 152 31.263 37.970 -6.760 1.00 47.52 O HETATM 4299 O HOH 153 23.580 26.861 26.773 1.00 32.89 O HETATM 4300 O HOH 154 17.632 28.071 15.612 1.00 41.01 O HETATM 4301 O HOH 155 53.922 41.424 25.448 1.00 28.45 O HETATM 4302 O HOH 156 46.298 32.693 6.110 1.00 36.61 O HETATM 4303 O HOH 157 38.165 39.761 18.667 1.00 36.36 O HETATM 4304 O HOH 158 52.686 36.026 14.536 1.00 40.09 O HETATM 4305 O HOH 159 22.816 33.033 26.498 1.00 37.77 O HETATM 4306 O HOH 160 42.933 22.238 -1.166 1.00 40.97 O HETATM 4307 O HOH 161 16.749 41.489 -1.636 1.00 49.66 O HETATM 4308 O HOH 162 51.927 13.551 11.497 1.00 35.48 O HETATM 4309 O HOH 163 44.311 21.058 -3.158 1.00 30.44 O HETATM 4310 O HOH 164 24.949 45.837 -3.601 1.00 34.11 O HETATM 4311 O HOH 165 17.028 5.595 3.885 1.00 32.66 O HETATM 4312 O HOH 166 34.629 15.242 -7.237 1.00 37.85 O HETATM 4313 O HOH 167 28.965 23.565 -6.985 1.00 30.21 O HETATM 4314 O HOH 168 13.329 18.788 9.062 1.00 41.27 O HETATM 4315 O HOH 169 29.238 18.910 -7.069 1.00 42.99 O HETATM 4316 O HOH 170 37.459 27.205 -4.369 1.00 26.20 O HETATM 4317 O HOH 171 24.046 29.068 -8.393 1.00 37.31 O HETATM 4318 O HOH 172 46.915 36.478 30.137 1.00 30.82 O HETATM 4319 O HOH 173 39.957 43.703 26.230 1.00 32.33 O HETATM 4320 O HOH 174 38.706 48.763 -4.086 1.00 42.54 O HETATM 4321 O HOH 175 27.971 39.462 -5.487 1.00 26.85 O HETATM 4322 O HOH 176 55.999 43.733 25.723 1.00 35.23 O HETATM 4323 O HOH 177 15.710 33.186 17.133 1.00 36.56 O HETATM 4324 O HOH 178 17.933 40.543 -4.547 1.00 44.42 O HETATM 4325 O HOH 179 18.506 30.387 22.200 1.00 33.29 O HETATM 4326 O HOH 180 15.041 25.098 7.124 1.00 33.23 O HETATM 4327 O HOH 181 19.333 43.652 -5.352 1.00 64.13 O HETATM 4328 O HOH 182 45.776 14.181 8.679 1.00 30.65 O HETATM 4329 O HOH 183 32.894 42.263 20.633 1.00 33.27 O HETATM 4330 O HOH 184 26.175 25.919 -9.382 1.00 39.62 O HETATM 4331 O HOH 185 25.963 47.770 3.593 1.00 43.18 O HETATM 4332 O HOH 186 44.721 17.990 9.772 1.00 27.39 O HETATM 4333 O HOH 187 22.326 47.551 2.655 1.00 28.69 O HETATM 4334 O HOH 188 13.291 22.285 10.643 1.00 46.70 O HETATM 4335 O HOH 189 33.723 46.470 10.539 1.00 28.56 O HETATM 4336 O HOH 190 29.025 44.284 17.864 1.00 20.90 O HETATM 4337 O HOH 191 42.499 38.214 11.575 1.00 12.34 O HETATM 4338 O HOH 192 37.278 38.054 13.376 1.00 10.67 O HETATM 4339 O HOH 193 35.094 47.748 13.111 1.00 48.20 O HETATM 4340 O HOH 194 50.894 19.285 15.478 1.00 40.95 O HETATM 4341 O HOH 195 12.632 23.160 7.925 1.00 50.38 O HETATM 4342 O HOH 196 31.938 25.356 -5.545 1.00 37.78 O HETATM 4343 O HOH 197 18.083 25.121 20.522 1.00 48.81 O HETATM 4344 O HOH 198 14.596 40.478 3.776 1.00 47.45 O HETATM 4345 O HOH 199 50.274 19.961 11.117 1.00 44.44 O HETATM 4346 O HOH 200 19.665 28.559 -2.550 1.00 41.33 O HETATM 4347 O HOH 201 23.581 19.433 -6.235 1.00 42.99 O HETATM 4348 O HOH 202 27.287 16.082 -5.994 1.00 36.22 O HETATM 4349 O HOH 203 21.020 13.189 -4.433 1.00 34.69 O HETATM 4350 O HOH 204 19.105 11.027 -0.353 1.00 41.56 O HETATM 4351 O HOH 205 41.214 20.035 -0.652 1.00 36.52 O HETATM 4352 O HOH 206 13.783 19.880 18.745 1.00 43.12 O HETATM 4353 O HOH 207 15.720 37.708 6.993 1.00 42.78 O HETATM 4354 O HOH 208 36.654 41.960 19.801 1.00 31.23 O HETATM 4355 O HOH 209 39.147 46.527 7.449 1.00 44.36 O HETATM 4356 O HOH 210 35.159 49.209 5.141 1.00 35.87 O HETATM 4357 O HOH 211 48.637 37.920 7.713 1.00 31.36 O HETATM 4358 O HOH 212 43.536 43.402 17.597 1.00 33.17 O HETATM 4359 O HOH 213 46.249 44.527 30.441 1.00 39.45 O HETATM 4360 O HOH 214 48.875 35.192 30.515 1.00 33.72 O HETATM 4361 O HOH 215 54.222 31.480 14.953 1.00 44.93 O HETATM 4362 O HOH 216 37.453 36.124 21.823 1.00 39.79 O HETATM 4363 O HOH 217 48.257 3.618 15.450 1.00 21.35 O HETATM 4364 O HOH 218 34.815 7.135 28.060 1.00 9.43 O HETATM 4365 O HOH 219 30.083 22.622 20.069 1.00 11.23 O HETATM 4366 O HOH 220 36.210 6.858 20.602 1.00 10.08 O HETATM 4367 O HOH 221 36.670 23.488 26.702 1.00 11.82 O HETATM 4368 O HOH 222 37.990 35.473 -1.634 1.00 13.36 O HETATM 4369 O HOH 223 37.543 7.023 27.593 1.00 12.03 O HETATM 4370 O HOH 224 30.216 19.737 19.952 1.00 10.67 O HETATM 4371 O HOH 225 32.310 6.584 13.357 1.00 13.08 O HETATM 4372 O HOH 226 38.335 9.752 6.043 1.00 11.71 O HETATM 4373 O HOH 227 39.958 16.257 3.290 1.00 11.55 O HETATM 4374 O HOH 228 26.141 17.430 24.780 1.00 11.88 O HETATM 4375 O HOH 229 34.542 4.313 22.877 1.00 12.59 O HETATM 4376 O HOH 230 28.770 17.042 25.372 1.00 11.53 O HETATM 4377 O HOH 231 35.987 25.234 30.141 1.00 12.85 O HETATM 4378 O HOH 232 35.559 1.943 21.968 1.00 13.80 O HETATM 4379 O HOH 233 39.698 4.796 1.021 1.00 15.26 O HETATM 4380 O HOH 234 29.700 0.740 17.953 1.00 15.73 O HETATM 4381 O HOH 235 38.063 9.630 -3.512 1.00 12.91 O HETATM 4382 O HOH 236 29.657 13.888 29.583 1.00 19.00 O HETATM 4383 O HOH 237 36.843 14.394 28.432 1.00 16.23 O HETATM 4384 O HOH 238 36.562 4.979 18.683 1.00 13.78 O HETATM 4385 O HOH 239 24.295 22.031 18.989 1.00 15.89 O HETATM 4386 O HOH 240 30.089 7.456 12.139 1.00 14.73 O HETATM 4387 O HOH 241 24.715 15.890 26.572 1.00 16.96 O HETATM 4388 O HOH 242 35.043 23.306 31.960 1.00 17.15 O HETATM 4389 O HOH 243 43.327 31.064 9.042 1.00 17.18 O HETATM 4390 O HOH 244 46.277 29.628 11.875 1.00 18.46 O HETATM 4391 O HOH 245 36.616 3.386 -4.463 1.00 20.01 O HETATM 4392 O HOH 246 42.129 20.839 31.648 1.00 14.89 O HETATM 4393 O HOH 247 43.562 2.423 23.818 1.00 18.47 O HETATM 4394 O HOH 248 43.945 22.770 9.677 1.00 18.16 O HETATM 4395 O HOH 249 35.577 0.970 16.920 1.00 17.50 O HETATM 4396 O HOH 250 50.520 4.877 17.908 1.00 19.91 O HETATM 4397 O HOH 251 52.102 26.652 23.968 1.00 20.43 O HETATM 4398 O HOH 252 32.385 5.088 6.356 1.00 20.34 O HETATM 4399 O HOH 253 47.867 8.259 8.070 1.00 17.99 O HETATM 4400 O HOH 254 24.046 24.790 25.189 1.00 22.49 O HETATM 4401 O HOH 255 29.762 21.457 30.416 1.00 17.95 O HETATM 4402 O HOH 256 45.498 3.952 27.994 1.00 19.83 O HETATM 4403 O HOH 257 40.619 8.998 -3.993 1.00 17.46 O HETATM 4404 O HOH 258 41.747 8.686 -1.651 1.00 19.42 O HETATM 4405 O HOH 259 36.935 11.709 -4.960 1.00 16.47 O HETATM 4406 O HOH 260 30.855 24.019 30.644 1.00 18.23 O HETATM 4407 O HOH 261 40.375 4.312 3.635 1.00 18.62 O HETATM 4408 O HOH 262 41.472 6.414 6.622 1.00 17.43 O HETATM 4409 O HOH 263 41.906 27.802 10.890 1.00 18.78 O HETATM 4410 O HOH 264 23.472 22.702 21.472 1.00 17.25 O HETATM 4411 O HOH 265 26.405 8.546 -7.694 1.00 23.24 O HETATM 4412 O HOH 266 29.312 3.399 17.773 1.00 19.97 O HETATM 4413 O HOH 267 32.128 34.217 25.068 1.00 18.67 O HETATM 4414 O HOH 268 36.375 8.139 -5.120 1.00 22.05 O HETATM 4415 O HOH 269 43.959 12.432 8.992 1.00 15.91 O HETATM 4416 O HOH 270 39.225 3.618 15.305 1.00 19.91 O HETATM 4417 O HOH 271 45.245 2.641 21.706 1.00 17.24 O HETATM 4418 O HOH 272 50.154 6.273 24.656 1.00 22.72 O HETATM 4419 O HOH 273 21.618 23.931 25.607 1.00 24.00 O HETATM 4420 O HOH 274 45.831 11.885 1.853 1.00 21.83 O HETATM 4421 O HOH 275 39.731 34.020 -2.986 1.00 23.83 O HETATM 4422 O HOH 276 36.480 22.735 34.159 1.00 27.93 O HETATM 4423 O HOH 277 40.282 25.153 5.259 1.00 19.83 O HETATM 4424 O HOH 278 43.278 34.431 31.015 1.00 16.34 O HETATM 4425 O HOH 279 37.123 31.052 32.941 1.00 22.79 O HETATM 4426 O HOH 280 34.688 0.512 1.653 1.00 25.24 O HETATM 4427 O HOH 281 41.420 26.154 2.147 1.00 24.08 O HETATM 4428 O HOH 282 26.377 15.950 28.717 1.00 29.79 O HETATM 4429 O HOH 283 43.238 10.156 0.122 1.00 17.89 O HETATM 4430 O HOH 284 42.032 32.744 32.742 1.00 21.02 O HETATM 4431 O HOH 285 49.273 17.467 18.790 1.00 26.46 O HETATM 4432 O HOH 286 41.706 6.008 -0.596 1.00 20.04 O HETATM 4433 O HOH 287 43.383 18.720 30.402 1.00 24.24 O HETATM 4434 O HOH 288 44.744 2.010 26.280 1.00 24.38 O HETATM 4435 O HOH 289 31.892 37.681 -2.938 1.00 19.97 O HETATM 4436 O HOH 290 38.839 2.053 7.873 1.00 30.34 O HETATM 4437 O HOH 291 34.319 10.756 -5.331 1.00 21.92 O HETATM 4438 O HOH 292 38.618 2.600 -0.342 1.00 24.41 O HETATM 4439 O HOH 293 19.875 23.605 23.561 1.00 26.50 O HETATM 4440 O HOH 294 44.025 7.380 0.313 1.00 24.56 O HETATM 4441 O HOH 295 42.627 3.846 9.795 1.00 23.75 O HETATM 4442 O HOH 296 39.559 19.807 32.509 1.00 31.61 O HETATM 4443 O HOH 297 44.389 28.535 8.241 1.00 24.14 O HETATM 4444 O HOH 298 28.074 9.803 10.730 1.00 24.13 O HETATM 4445 O HOH 299 38.718 4.745 28.607 1.00 20.78 O HETATM 4446 O HOH 300 42.853 4.382 3.202 1.00 30.32 O HETATM 4447 O HOH 301 38.677 21.050 34.708 1.00 31.16 O HETATM 4448 O HOH 302 37.164 2.537 19.838 1.00 28.75 O HETATM 4449 O HOH 303 45.547 2.093 14.950 1.00 32.09 O HETATM 4450 O HOH 304 38.856 2.202 -3.074 1.00 37.30 O HETATM 4451 O HOH 305 46.565 10.717 8.411 1.00 28.13 O HETATM 4452 O HOH 306 37.378 0.546 0.805 1.00 37.66 O HETATM 4453 O HOH 307 43.644 31.953 6.591 1.00 27.83 O HETATM 4454 O HOH 308 42.218 35.504 0.990 1.00 30.68 O HETATM 4455 O HOH 309 52.168 34.838 19.657 1.00 26.20 O HETATM 4456 O HOH 310 34.138 16.496 29.258 1.00 36.80 O HETATM 4457 O HOH 311 32.498 23.676 32.868 1.00 26.15 O HETATM 4458 O HOH 312 44.360 1.293 17.136 1.00 25.76 O HETATM 4459 O HOH 313 51.748 22.849 23.010 1.00 28.06 O HETATM 4460 O HOH 314 43.609 2.341 19.646 1.00 33.00 O HETATM 4461 O HOH 315 40.420 29.961 4.734 1.00 29.13 O HETATM 4462 O HOH 316 45.214 4.101 11.723 1.00 32.36 O HETATM 4463 O HOH 317 56.146 8.827 23.600 1.00 33.11 O HETATM 4464 O HOH 318 41.657 1.121 15.658 1.00 38.21 O HETATM 4465 O HOH 319 44.179 15.338 2.299 1.00 29.96 O HETATM 4466 O HOH 320 27.569 9.132 19.791 1.00 25.09 O HETATM 4467 O HOH 321 42.137 25.305 9.055 1.00 34.64 O HETATM 4468 O HOH 322 37.309 5.735 -5.792 1.00 24.13 O HETATM 4469 O HOH 323 39.494 32.950 33.143 1.00 29.28 O HETATM 4470 O HOH 324 31.723 19.840 31.114 1.00 28.39 O HETATM 4471 O HOH 325 21.095 19.634 20.316 1.00 30.14 O HETATM 4472 O HOH 326 28.980 6.029 10.015 1.00 31.06 O HETATM 4473 O HOH 327 44.802 10.966 6.337 1.00 27.18 O HETATM 4474 O HOH 328 46.841 6.336 6.474 1.00 35.15 O HETATM 4475 O HOH 329 41.238 33.877 3.060 1.00 21.26 O HETATM 4476 O HOH 330 55.544 8.841 15.604 1.00 26.30 O HETATM 4477 O HOH 331 39.445 14.630 -7.000 1.00 32.07 O HETATM 4478 O HOH 332 36.303 36.529 24.418 1.00 25.04 O HETATM 4479 O HOH 333 45.240 13.873 5.692 1.00 29.12 O HETATM 4480 O HOH 334 47.071 13.226 3.677 1.00 28.06 O HETATM 4481 O HOH 335 25.950 14.255 -4.463 1.00 29.57 O HETATM 4482 O HOH 336 56.219 8.818 26.700 1.00 42.09 O HETATM 4483 O HOH 337 31.235 16.893 29.541 1.00 40.65 O HETATM 4484 O HOH 338 42.447 27.406 6.677 1.00 28.55 O HETATM 4485 O HOH 339 48.475 25.549 32.932 1.00 32.51 O HETATM 4486 O HOH 340 47.214 0.846 22.421 1.00 32.64 O HETATM 4487 O HOH 341 49.463 6.032 27.283 1.00 28.83 O HETATM 4488 O HOH 342 21.112 17.666 25.447 1.00 42.68 O HETATM 4489 O HOH 343 48.387 3.926 28.159 1.00 35.55 O HETATM 4490 O HOH 344 49.855 2.615 21.865 1.00 32.25 O HETATM 4491 O HOH 345 40.540 22.738 7.034 1.00 32.96 O HETATM 4492 O HOH 346 45.352 6.084 33.944 1.00 36.97 O HETATM 4493 O HOH 347 51.143 22.401 15.235 1.00 27.00 O HETATM 4494 O HOH 348 37.958 16.413 28.428 1.00 37.94 O HETATM 4495 O HOH 349 53.612 7.778 22.930 1.00 47.07 O HETATM 4496 O HOH 350 40.830 2.369 19.971 1.00 31.83 O HETATM 4497 O HOH 351 48.996 30.717 30.161 1.00 30.99 O HETATM 4498 O HOH 352 34.857 19.373 32.736 1.00 34.38 O HETATM 4499 O HOH 353 17.754 10.499 -5.139 1.00 37.35 O HETATM 4500 O HOH 354 42.752 4.160 7.266 1.00 41.24 O HETATM 4501 O HOH 355 51.027 23.102 17.718 1.00 31.58 O HETATM 4502 O HOH 356 51.437 19.442 18.623 1.00 30.87 O HETATM 4503 O HOH 357 40.412 6.246 -5.153 1.00 33.48 O HETATM 4504 O HOH 358 50.539 3.561 24.255 1.00 31.50 O HETATM 4505 O HOH 359 41.495 31.636 5.872 1.00 33.32 O HETATM 4506 O HOH 360 23.200 4.604 5.860 1.00 29.59 O HETATM 4507 O HOH 361 42.321 34.163 -1.788 1.00 42.45 O HETATM 4508 O HOH 362 43.682 3.883 30.170 1.00 29.57 O HETATM 4509 O HOH 363 51.309 2.850 19.648 1.00 34.26 O HETATM 4510 O HOH 364 29.621 3.361 -6.006 1.00 32.99 O HETATM 4511 O HOH 365 39.452 41.980 32.718 1.00 32.96 O HETATM 4512 O HOH 366 42.235 -0.111 23.467 1.00 37.35 O HETATM 4513 O HOH 367 39.089 11.906 -6.670 1.00 34.26 O HETATM 4514 O HOH 368 22.637 17.373 27.389 1.00 35.49 O HETATM 4515 O HOH 369 26.913 7.339 17.943 1.00 32.79 O HETATM 4516 O HOH 370 39.183 1.650 4.095 1.00 42.46 O HETATM 4517 O HOH 371 24.808 27.171 28.987 1.00 35.77 O HETATM 4518 O HOH 372 57.044 11.082 15.890 1.00 34.36 O HETATM 4519 O HOH 373 25.900 35.464 33.519 1.00 39.06 O HETATM 4520 O HOH 374 45.528 4.291 6.956 1.00 39.91 O HETATM 4521 O HOH 375 32.834 4.518 3.904 1.00 34.25 O HETATM 4522 O HOH 376 21.370 11.145 -2.181 1.00 29.72 O HETATM 4523 O HOH 377 39.642 3.291 17.891 1.00 35.68 O HETATM 4524 O HOH 378 49.314 3.976 7.134 1.00 29.25 O HETATM 4525 O HOH 379 48.500 13.020 7.824 1.00 33.15 O HETATM 4526 O HOH 380 45.288 10.080 3.901 1.00 38.30 O HETATM 4527 O HOH 381 42.831 0.316 27.290 1.00 34.40 O HETATM 4528 O HOH 382 25.321 4.579 8.229 1.00 46.38 O HETATM 4529 O HOH 383 18.152 21.536 23.765 1.00 40.48 O HETATM 4530 O HOH 384 53.436 24.603 23.540 1.00 36.14 O HETATM 4531 O HOH 385 18.703 17.386 18.971 1.00 44.43 O HETATM 4532 O HOH 386 30.401 8.066 9.804 1.00 62.22 O HETATM 4533 O HOH 387 56.873 6.529 22.729 1.00 33.58 O HETATM 4534 O HOH 388 33.722 1.218 8.333 1.00 34.76 O HETATM 4535 O HOH 389 37.117 28.322 -2.300 1.00 42.53 O HETATM 4536 O HOH 390 35.939 2.307 10.697 1.00 44.15 O HETATM 4537 O HOH 391 48.755 14.051 22.896 1.00 38.70 O HETATM 4538 O HOH 392 36.829 0.790 14.395 1.00 43.25 O HETATM 4539 O HOH 393 31.133 33.373 -2.318 1.00 28.52 O HETATM 4540 O HOH 394 38.652 28.687 35.832 1.00 38.40 O HETATM 4541 O HOH 395 51.961 28.411 16.252 1.00 25.81 O HETATM 4542 O HOH 396 48.879 32.681 32.216 1.00 37.10 O HETATM 4543 O HOH 397 34.131 36.669 31.427 1.00 37.51 O HETATM 4544 O HOH 398 51.411 25.662 13.254 1.00 29.74 O HETATM 4545 O HOH 399 29.131 26.211 33.764 1.00 32.67 O HETATM 4546 O HOH 400 39.478 7.808 30.212 1.00 23.56 O HETATM 4547 O HOH 401 35.407 9.850 10.730 1.00 10.82 O HETATM 4548 O HOH 402 32.024 21.391 34.334 1.00 56.78 O HETATM 4549 O HOH 403 37.568 39.073 24.255 1.00 32.95 O HETATM 4550 O HOH 404 44.812 36.536 31.744 1.00 34.36 O HETATM 4551 O HOH 405 35.828 39.205 32.602 1.00 39.18 O HETATM 4552 O HOH 406 51.426 25.448 16.090 1.00 33.47 O HETATM 4553 O HOH 407 52.894 23.665 13.136 1.00 43.85 O HETATM 4554 O HOH 408 49.975 28.427 10.443 1.00 39.22 O HETATM 4555 O HOH 409 23.706 30.305 34.583 1.00 41.74 O HETATM 4556 O HOH 410 49.388 2.122 26.265 1.00 37.13 O HETATM 4557 O HOH 411 40.995 4.338 5.812 1.00 47.38 O HETATM 4558 O HOH 412 23.489 1.403 1.842 1.00 42.09 O HETATM 4559 O HOH 413 30.322 10.039 -9.708 1.00 39.56 O HETATM 4560 O HOH 414 33.827 32.313 32.854 1.00 58.66 O HETATM 4561 O HOH 415 43.883 41.684 34.103 1.00 46.74 O HETATM 4562 O HOH 416 47.342 29.946 7.880 1.00 48.68 O HETATM 4563 O HOH 417 27.548 36.374 31.297 1.00 45.32 O HETATM 4564 O HOH 418 27.128 19.797 27.374 1.00 32.90 O HETATM 4565 O HOH 419 27.511 5.636 13.253 1.00 44.23 O HETATM 4566 O HOH 420 31.030 2.601 7.399 1.00 38.67 O HETATM 4567 O HOH 421 36.401 9.139 -7.802 1.00 31.44 O HETATM 4568 C1 PPF A 422 36.797 35.631 17.334 1.00 0.17 C HETATM 4569 O4 PPF A 422 37.580 35.578 18.344 1.00 -0.49 O HETATM 4570 O5 PPF A 422 36.370 34.543 16.812 1.00 -0.49 O HETATM 4571 P1 PPF A 422 36.252 37.215 16.688 1.00 0.09 P HETATM 4572 O1 PPF A 422 35.474 36.803 15.471 1.00 -0.59 O HETATM 4573 O2 PPF A 422 37.436 38.066 16.293 1.00 -0.59 O HETATM 4574 O3 PPF A 422 35.431 37.815 17.776 1.00 -0.59 O CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 102 100 101 4147 CONECT 986 984 985 4148 CONECT 1702 1701 4148 CONECT 2074 2075 2090 2091 2092 CONECT 2090 2074 CONECT 2091 2074 CONECT 2092 2074 CONECT 2175 2173 2174 4148 CONECT 3059 3057 3058 4147 CONECT 3775 3774 4147 CONECT 4147 102 3059 3775 CONECT 4148 986 1702 2175 CONECT 4568 4569 4570 4571 CONECT 4569 4568 CONECT 4570 4568 CONECT 4571 4568 4572 4573 4574 CONECT 4572 4571 CONECT 4573 4571 CONECT 4574 4571 MASTER 0 0 0 0 0 0 0 0 4572 2 23 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 1nki
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2it4
RCSB PDB
PDBbind
PPF
2rk8
RCSB PDB
PDBbind
PPF
3t01
RCSB PDB
PDBbind
PPF
Entry Information
PDB ID
1nki
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
fosfomycin resistance protein
Ligand Name
PPF
EC.Number
E.C.2.5.1.18
Resolution
0.95(Å)
Affinity (Kd/Ki/IC50)
Kd=0.2uM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v43 pp. 13666-73, 2004
Ligand Properties
Formula
CH
4
O
5
P
Molecular Weight
127.013
Exact Mass
126.980
No. of atoms
11
No. of bonds
10
Polar Surface Area
111.58
LOGP Value
-1.26 (
Computed with XLOGP3
)
-0.60 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 0
Canonical SMILES
OC(=O)P(O)(O)O
InChI String
InChI=1S/CH5O5P/c2-1(3)7(4,5)6/h4-7H,(H,2,3)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9I4K6
Entrez Gene ID
NCBI Entrez Gene ID:
877785
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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