Browse entries in the PDBbind-CN Database
HEADER 1NMK_COMPLEX COMPND 1NMK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 165 MET VAL ASN PRO THR VAL PHE PHE ASP ILE ALA VAL ASP SEQRES 2 A 165 GLY GLU PRO LEU GLY ARG VAL SER PHE GLU LEU PHE ALA SEQRES 3 A 165 ASP LYS VAL PRO LYS THR ALA GLU ASN PHE ARG ALA LEU SEQRES 4 A 165 SER THR GLY GLU LYS GLY PHE GLY TYR LYS GLY SER CYS SEQRES 5 A 165 PHE HIS ARG ILE ILE PRO GLY PHE MET CYS GLN GLY GLY SEQRES 6 A 165 ASP PHE THR ARG HIS ASN GLY THR GLY GLY LYS SER ILE SEQRES 7 A 165 TYR GLY GLU LYS PHE GLU ASP GLU ASN PHE ILE LEU LYS SEQRES 8 A 165 HIS THR GLY PRO GLY ILE LEU SER MET ALA ASN ALA GLY SEQRES 9 A 165 PRO ASN THR ASN GLY SER GLN PHE PHE ILE CYS THR ALA SEQRES 10 A 165 LYS THR GLU TRP LEU ASP GLY LYS HIS VAL VAL PHE GLY SEQRES 11 A 165 LYS VAL LYS GLU GLY MET ASN ILE VAL GLU ALA MET GLU SEQRES 12 A 165 ARG PHE GLY SER ARG ASN GLY LYS THR SER LYS LYS ILE SEQRES 13 A 165 THR ILE ALA ASP CYS GLY GLN LEU GLU HET SFM A 266 110 ATOM 1 N MET A 1 54.373 -18.619 35.011 1.00 47.76 N ATOM 2 CA MET A 1 55.530 -17.679 34.935 1.00 47.52 C ATOM 3 C MET A 1 55.332 -16.552 35.947 1.00 45.71 C ATOM 4 O MET A 1 54.320 -16.506 36.647 1.00 46.26 O ATOM 5 CB MET A 1 55.655 -17.110 33.509 1.00 48.44 C ATOM 6 CG MET A 1 54.347 -16.563 32.930 1.00 51.15 C ATOM 7 SD MET A 1 53.102 -17.842 32.685 1.00 57.76 S ATOM 8 CE MET A 1 53.441 -18.371 30.986 1.00 57.68 C ATOM 9 HA MET A 1 56.450 -18.213 35.172 1.00 0.00 H ATOM 10 HB2 MET A 1 56.385 -16.301 33.527 1.00 0.00 H ATOM 11 HB3 MET A 1 56.012 -17.905 32.854 1.00 0.00 H ATOM 12 HG2 MET A 1 54.560 -16.096 31.969 1.00 0.00 H ATOM 13 HG3 MET A 1 53.948 -15.815 33.616 1.00 0.00 H ATOM 14 HE1 MET A 1 53.322 -17.523 30.312 1.00 0.00 H ATOM 15 HE2 MET A 1 54.462 -18.748 30.921 1.00 0.00 H ATOM 16 HE3 MET A 1 52.742 -19.159 30.706 1.00 0.00 H ATOM 17 HN3 MET A 1 53.495 -18.105 34.793 1.00 0.00 H ATOM 18 HN2 MET A 1 54.314 -19.018 35.970 1.00 0.00 H ATOM 19 HN1 MET A 1 54.506 -19.387 34.323 1.00 0.00 H ATOM 20 N VAL A 2 56.363 -15.742 36.123 1.00 42.97 N ATOM 21 CA VAL A 2 56.288 -14.486 36.876 1.00 40.59 C ATOM 22 C VAL A 2 55.158 -13.494 36.472 1.00 37.17 C ATOM 23 O VAL A 2 54.868 -13.272 35.294 1.00 37.85 O ATOM 24 CB VAL A 2 57.644 -13.758 36.768 1.00 40.85 C ATOM 25 CG1 VAL A 2 57.675 -12.849 35.541 1.00 41.48 C ATOM 26 CG2 VAL A 2 57.947 -12.978 38.047 1.00 42.42 C ATOM 27 HA VAL A 2 56.042 -14.791 37.893 1.00 0.00 H ATOM 28 HB VAL A 2 58.426 -14.508 36.646 1.00 0.00 H ATOM 29 HG11 VAL A 2 57.524 -13.448 34.643 1.00 0.00 H ATOM 30 HG12 VAL A 2 56.882 -12.106 35.621 1.00 0.00 H ATOM 31 HG13 VAL A 2 58.641 -12.347 35.487 1.00 0.00 H ATOM 32 HG21 VAL A 2 57.164 -12.239 38.214 1.00 0.00 H ATOM 33 HG22 VAL A 2 57.984 -13.667 38.891 1.00 0.00 H ATOM 34 HG23 VAL A 2 58.908 -12.474 37.945 1.00 0.00 H ATOM 35 H VAL A 2 57.276 -16.011 35.705 1.00 0.00 H ATOM 36 N ASN A 3 54.531 -12.899 37.476 1.00 32.64 N ATOM 37 CA ASN A 3 53.512 -11.871 37.266 1.00 29.02 C ATOM 38 C ASN A 3 54.144 -10.619 36.626 1.00 26.17 C ATOM 39 O ASN A 3 55.260 -10.273 36.928 1.00 25.68 O ATOM 40 CB ASN A 3 52.883 -11.509 38.610 1.00 27.99 C ATOM 41 CG ASN A 3 51.914 -12.568 39.112 1.00 25.37 C ATOM 42 OD1 ASN A 3 51.638 -12.654 40.309 1.00 25.25 O ATOM 43 ND2 ASN A 3 51.371 -13.356 38.201 1.00 17.57 N ATOM 44 HA ASN A 3 52.744 -12.254 36.594 1.00 0.00 H ATOM 45 HB2 ASN A 3 53.678 -11.388 39.346 1.00 0.00 H ATOM 46 HB3 ASN A 3 52.344 -10.568 38.500 1.00 0.00 H ATOM 47 HD22 ASN A 3 51.632 -13.250 37.200 1.00 0.00 H ATOM 48 HD21 ASN A 3 50.683 -14.082 38.485 1.00 0.00 H ATOM 49 H ASN A 3 54.772 -13.173 38.450 1.00 0.00 H ATOM 50 N PRO A 4 53.453 -9.969 35.710 1.00 23.54 N ATOM 51 CA PRO A 4 53.978 -8.758 35.072 1.00 22.37 C ATOM 52 C PRO A 4 54.038 -7.559 35.999 1.00 20.72 C ATOM 53 O PRO A 4 53.342 -7.518 37.023 1.00 20.08 O ATOM 54 CB PRO A 4 52.965 -8.451 33.980 1.00 22.25 C ATOM 55 CG PRO A 4 51.866 -9.388 34.146 1.00 23.19 C ATOM 56 CD PRO A 4 52.119 -10.320 35.237 1.00 23.38 C ATOM 57 HA PRO A 4 54.999 -8.930 34.732 1.00 0.00 H ATOM 58 HD3 PRO A 4 51.382 -10.195 36.031 1.00 0.00 H ATOM 59 HD2 PRO A 4 52.094 -11.349 34.879 1.00 0.00 H ATOM 60 HG3 PRO A 4 51.737 -9.951 33.222 1.00 0.00 H ATOM 61 HG2 PRO A 4 50.954 -8.831 34.360 1.00 0.00 H ATOM 62 HB2 PRO A 4 52.604 -7.428 34.081 1.00 0.00 H ATOM 63 HB3 PRO A 4 53.422 -8.579 32.998 1.00 0.00 H ATOM 64 N THR A 5 54.886 -6.610 35.620 1.00 19.82 N ATOM 65 CA THR A 5 55.072 -5.359 36.319 1.00 19.53 C ATOM 66 C THR A 5 54.792 -4.243 35.350 1.00 18.90 C ATOM 67 O THR A 5 55.436 -4.172 34.302 1.00 18.40 O ATOM 68 CB THR A 5 56.533 -5.180 36.743 1.00 20.25 C ATOM 69 OG1 THR A 5 56.934 -6.210 37.649 1.00 21.38 O ATOM 70 CG2 THR A 5 56.738 -3.869 37.521 1.00 19.86 C ATOM 71 HA THR A 5 54.418 -5.352 37.191 1.00 0.00 H ATOM 72 HB THR A 5 57.111 -5.196 35.819 1.00 0.00 H ATOM 73 HG1 THR A 5 56.837 -7.091 37.209 1.00 0.00 H ATOM 74 HG23 THR A 5 56.452 -3.026 36.892 1.00 0.00 H ATOM 75 HG21 THR A 5 56.120 -3.880 38.419 1.00 0.00 H ATOM 76 HG22 THR A 5 57.787 -3.775 37.801 1.00 0.00 H ATOM 77 H THR A 5 55.453 -6.778 34.765 1.00 0.00 H ATOM 78 N VAL A 6 53.834 -3.382 35.692 1.00 18.11 N ATOM 79 CA VAL A 6 53.567 -2.188 34.928 1.00 17.82 C ATOM 80 C VAL A 6 53.828 -0.986 35.820 1.00 18.01 C ATOM 81 O VAL A 6 53.909 -1.122 37.044 1.00 17.01 O ATOM 82 CB VAL A 6 52.137 -2.151 34.354 1.00 18.17 C ATOM 83 CG1 VAL A 6 51.898 -3.366 33.480 1.00 18.60 C ATOM 84 CG2 VAL A 6 51.111 -2.037 35.413 1.00 19.14 C ATOM 85 HA VAL A 6 54.230 -2.173 34.063 1.00 0.00 H ATOM 86 HB VAL A 6 52.046 -1.254 33.741 1.00 0.00 H ATOM 87 HG11 VAL A 6 52.615 -3.368 32.659 1.00 0.00 H ATOM 88 HG12 VAL A 6 52.023 -4.270 34.075 1.00 0.00 H ATOM 89 HG13 VAL A 6 50.885 -3.330 33.079 1.00 0.00 H ATOM 90 HG21 VAL A 6 51.185 -2.894 36.083 1.00 0.00 H ATOM 91 HG22 VAL A 6 51.273 -1.118 35.977 1.00 0.00 H ATOM 92 HG23 VAL A 6 50.121 -2.015 34.957 1.00 0.00 H ATOM 93 H VAL A 6 53.260 -3.577 36.537 1.00 0.00 H ATOM 94 N PHE A 7 53.952 0.193 35.219 1.00 17.52 N ATOM 95 CA PHE A 7 54.244 1.381 35.992 1.00 17.88 C ATOM 96 C PHE A 7 53.453 2.572 35.414 1.00 17.24 C ATOM 97 O PHE A 7 53.042 2.558 34.244 1.00 16.42 O ATOM 98 CB PHE A 7 55.755 1.685 35.937 1.00 18.50 C ATOM 99 CG PHE A 7 56.181 2.313 34.624 1.00 20.87 C ATOM 100 CD1 PHE A 7 56.515 1.532 33.547 1.00 24.35 C ATOM 101 CD2 PHE A 7 56.150 3.678 34.456 1.00 23.21 C ATOM 102 CE1 PHE A 7 56.844 2.107 32.328 1.00 24.10 C ATOM 103 CE2 PHE A 7 56.474 4.257 33.243 1.00 24.52 C ATOM 104 CZ PHE A 7 56.828 3.466 32.184 1.00 25.39 C ATOM 105 HA PHE A 7 53.953 1.218 37.030 1.00 0.00 H ATOM 106 HB2 PHE A 7 56.002 2.370 36.748 1.00 0.00 H ATOM 107 HB3 PHE A 7 56.303 0.753 36.071 1.00 0.00 H ATOM 108 HD2 PHE A 7 55.865 4.314 35.294 1.00 0.00 H ATOM 109 HE2 PHE A 7 56.448 5.341 33.131 1.00 0.00 H ATOM 110 HZ PHE A 7 57.096 3.918 31.229 1.00 0.00 H ATOM 111 HE1 PHE A 7 57.116 1.474 31.484 1.00 0.00 H ATOM 112 HD1 PHE A 7 56.522 0.447 33.650 1.00 0.00 H ATOM 113 H PHE A 7 53.839 0.262 34.188 1.00 0.00 H ATOM 114 N PHE A 8 53.221 3.573 36.261 1.00 16.24 N ATOM 115 CA PHE A 8 52.640 4.845 35.866 1.00 16.85 C ATOM 116 C PHE A 8 53.649 5.929 36.285 1.00 17.22 C ATOM 117 O PHE A 8 54.160 5.917 37.429 1.00 17.00 O ATOM 118 CB PHE A 8 51.364 5.205 36.659 1.00 17.18 C ATOM 119 CG PHE A 8 50.132 4.397 36.334 1.00 17.42 C ATOM 120 CD1 PHE A 8 49.007 4.533 37.131 1.00 18.36 C ATOM 121 CD2 PHE A 8 50.064 3.560 35.242 1.00 16.93 C ATOM 122 CE1 PHE A 8 47.856 3.847 36.855 1.00 17.94 C ATOM 123 CE2 PHE A 8 48.924 2.882 34.969 1.00 17.31 C ATOM 124 CZ PHE A 8 47.823 3.012 35.778 1.00 17.81 C ATOM 125 HA PHE A 8 52.409 4.783 34.803 1.00 0.00 H ATOM 126 HB2 PHE A 8 51.581 5.071 37.719 1.00 0.00 H ATOM 127 HB3 PHE A 8 51.136 6.253 36.466 1.00 0.00 H ATOM 128 HD2 PHE A 8 50.933 3.443 34.594 1.00 0.00 H ATOM 129 HE2 PHE A 8 48.880 2.227 34.099 1.00 0.00 H ATOM 130 HZ PHE A 8 46.918 2.445 35.558 1.00 0.00 H ATOM 131 HE1 PHE A 8 46.977 3.967 37.488 1.00 0.00 H ATOM 132 HD1 PHE A 8 49.040 5.199 37.994 1.00 0.00 H ATOM 133 H PHE A 8 53.470 3.437 37.262 1.00 0.00 H ATOM 134 N ASP A 9 53.917 6.861 35.393 1.00 17.28 N ATOM 135 CA ASP A 9 54.666 8.051 35.754 1.00 18.02 C ATOM 136 C ASP A 9 53.588 9.106 35.956 1.00 17.43 C ATOM 137 O ASP A 9 52.865 9.442 35.025 1.00 16.94 O ATOM 138 CB ASP A 9 55.630 8.495 34.670 1.00 18.56 C ATOM 139 CG ASP A 9 56.884 7.634 34.610 1.00 21.99 C ATOM 140 OD1 ASP A 9 57.314 7.091 35.640 1.00 24.16 O ATOM 141 OD2 ASP A 9 57.495 7.428 33.557 1.00 25.76 O ATOM 142 HA ASP A 9 55.288 7.875 36.632 1.00 0.00 H ATOM 143 HB2 ASP A 9 55.122 8.439 33.707 1.00 0.00 H ATOM 144 HB3 ASP A 9 55.924 9.526 34.865 1.00 0.00 H ATOM 145 H ASP A 9 53.586 6.742 34.414 1.00 0.00 H ATOM 146 N ILE A 10 53.474 9.583 37.185 1.00 17.69 N ATOM 147 CA ILE A 10 52.455 10.545 37.558 1.00 18.60 C ATOM 148 C ILE A 10 52.927 11.996 37.476 1.00 18.67 C ATOM 149 O ILE A 10 54.036 12.309 37.862 1.00 18.84 O ATOM 150 CB ILE A 10 52.023 10.280 38.998 1.00 18.33 C ATOM 151 CG1 ILE A 10 51.570 8.841 39.167 1.00 20.54 C ATOM 152 CG2 ILE A 10 50.926 11.243 39.401 1.00 19.08 C ATOM 153 CD1 ILE A 10 50.502 8.436 38.230 1.00 22.94 C ATOM 154 HA ILE A 10 51.637 10.419 36.848 1.00 0.00 H ATOM 155 HB ILE A 10 52.879 10.440 39.653 1.00 0.00 H ATOM 156 HG12 ILE A 10 52.430 8.190 39.010 1.00 0.00 H ATOM 157 HG13 ILE A 10 51.200 8.714 40.185 1.00 0.00 H ATOM 158 HD11 ILE A 10 49.628 9.070 38.381 1.00 0.00 H ATOM 159 HD12 ILE A 10 50.859 8.545 37.206 1.00 0.00 H ATOM 160 HD13 ILE A 10 50.234 7.396 38.414 1.00 0.00 H ATOM 161 HG21 ILE A 10 51.295 12.266 39.321 1.00 0.00 H ATOM 162 HG22 ILE A 10 50.069 11.112 38.741 1.00 0.00 H ATOM 163 HG23 ILE A 10 50.628 11.042 40.430 1.00 0.00 H ATOM 164 H ILE A 10 54.141 9.255 37.912 1.00 0.00 H ATOM 165 N ALA A 11 52.063 12.872 36.994 1.00 19.27 N ATOM 166 CA ALA A 11 52.329 14.307 37.015 1.00 20.32 C ATOM 167 C ALA A 11 51.173 15.097 37.661 1.00 21.00 C ATOM 168 O ALA A 11 49.997 14.667 37.630 1.00 20.01 O ATOM 169 CB ALA A 11 52.587 14.834 35.595 1.00 20.47 C ATOM 170 HA ALA A 11 53.222 14.456 37.622 1.00 0.00 H ATOM 171 HB1 ALA A 11 53.450 14.322 35.170 1.00 0.00 H ATOM 172 HB2 ALA A 11 51.710 14.647 34.975 1.00 0.00 H ATOM 173 HB3 ALA A 11 52.783 15.905 35.636 1.00 0.00 H ATOM 174 H ALA A 11 51.169 12.529 36.588 1.00 0.00 H ATOM 175 N VAL A 12 51.533 16.263 38.200 1.00 21.90 N ATOM 176 CA VAL A 12 50.620 17.192 38.840 1.00 23.36 C ATOM 177 C VAL A 12 50.681 18.487 38.050 1.00 24.41 C ATOM 178 O VAL A 12 51.740 19.127 37.983 1.00 24.50 O ATOM 179 CB VAL A 12 51.063 17.472 40.289 1.00 23.82 C ATOM 180 CG1 VAL A 12 50.071 18.379 40.999 1.00 24.12 C ATOM 181 CG2 VAL A 12 51.252 16.169 41.055 1.00 24.68 C ATOM 182 HA VAL A 12 49.613 16.777 38.862 1.00 0.00 H ATOM 183 HB VAL A 12 52.022 17.989 40.254 1.00 0.00 H ATOM 184 HG11 VAL A 12 50.001 19.327 40.466 1.00 0.00 H ATOM 185 HG12 VAL A 12 49.092 17.899 41.019 1.00 0.00 H ATOM 186 HG13 VAL A 12 50.410 18.559 42.019 1.00 0.00 H ATOM 187 HG21 VAL A 12 50.311 15.620 41.073 1.00 0.00 H ATOM 188 HG22 VAL A 12 52.016 15.567 40.562 1.00 0.00 H ATOM 189 HG23 VAL A 12 51.565 16.391 42.075 1.00 0.00 H ATOM 190 H VAL A 12 52.539 16.525 38.159 1.00 0.00 H ATOM 191 N ASP A 13 49.554 18.875 37.470 1.00 25.04 N ATOM 192 CA ASP A 13 49.500 20.014 36.566 1.00 26.84 C ATOM 193 C ASP A 13 50.674 19.990 35.584 1.00 27.73 C ATOM 194 O ASP A 13 51.325 21.020 35.369 1.00 27.82 O ATOM 195 CB ASP A 13 49.516 21.337 37.335 1.00 26.88 C ATOM 196 CG ASP A 13 48.184 21.652 37.978 1.00 28.33 C ATOM 197 OD1 ASP A 13 47.144 21.069 37.554 1.00 28.87 O ATOM 198 OD2 ASP A 13 48.088 22.488 38.904 1.00 30.44 O ATOM 199 HA ASP A 13 48.564 19.938 36.012 1.00 0.00 H ATOM 200 HB2 ASP A 13 50.275 21.279 38.115 1.00 0.00 H ATOM 201 HB3 ASP A 13 49.769 22.140 36.643 1.00 0.00 H ATOM 202 H ASP A 13 48.679 18.348 37.668 1.00 0.00 H ATOM 203 N GLY A 14 50.949 18.818 35.009 1.00 28.36 N ATOM 204 CA GLY A 14 52.016 18.669 34.023 1.00 28.98 C ATOM 205 C GLY A 14 53.435 18.530 34.575 1.00 29.40 C ATOM 206 O GLY A 14 54.379 18.244 33.823 1.00 30.01 O ATOM 207 HA3 GLY A 14 51.996 19.546 33.376 1.00 0.00 H ATOM 208 HA2 GLY A 14 51.801 17.779 33.432 1.00 0.00 H ATOM 209 H GLY A 14 50.386 17.984 35.271 1.00 0.00 H ATOM 210 N GLU A 15 53.611 18.714 35.873 1.00 29.29 N ATOM 211 CA GLU A 15 54.946 18.589 36.435 1.00 29.63 C ATOM 212 C GLU A 15 55.117 17.204 37.015 1.00 29.22 C ATOM 213 O GLU A 15 54.258 16.749 37.781 1.00 28.50 O ATOM 214 CB GLU A 15 55.199 19.646 37.486 1.00 29.97 C ATOM 215 CG GLU A 15 55.522 21.022 36.902 1.00 34.41 C ATOM 216 CD GLU A 15 56.926 21.091 36.319 1.00 38.36 C ATOM 217 OE1 GLU A 15 57.893 20.777 37.052 1.00 40.79 O ATOM 218 OE2 GLU A 15 57.056 21.438 35.119 1.00 42.08 O ATOM 219 HA GLU A 15 55.677 18.740 35.641 1.00 0.00 H ATOM 220 HB2 GLU A 15 54.308 19.735 38.108 1.00 0.00 H ATOM 221 HB3 GLU A 15 56.040 19.326 38.102 1.00 0.00 H ATOM 222 HG2 GLU A 15 54.804 21.245 36.113 1.00 0.00 H ATOM 223 HG3 GLU A 15 55.434 21.767 37.693 1.00 0.00 H ATOM 224 H GLU A 15 52.803 18.946 36.485 1.00 0.00 H ATOM 225 N PRO A 16 56.235 16.548 36.688 1.00 28.62 N ATOM 226 CA PRO A 16 56.472 15.166 37.127 1.00 28.35 C ATOM 227 C PRO A 16 56.441 15.050 38.628 1.00 28.06 C ATOM 228 O PRO A 16 56.978 15.901 39.336 1.00 28.36 O ATOM 229 CB PRO A 16 57.897 14.846 36.616 1.00 28.82 C ATOM 230 CG PRO A 16 58.181 15.894 35.534 1.00 29.59 C ATOM 231 CD PRO A 16 57.376 17.097 35.925 1.00 28.92 C ATOM 232 HA PRO A 16 55.708 14.487 36.747 1.00 0.00 H ATOM 233 HD3 PRO A 16 57.966 17.771 36.546 1.00 0.00 H ATOM 234 HD2 PRO A 16 57.027 17.631 35.041 1.00 0.00 H ATOM 235 HG3 PRO A 16 57.869 15.527 34.556 1.00 0.00 H ATOM 236 HG2 PRO A 16 59.243 16.137 35.508 1.00 0.00 H ATOM 237 HB2 PRO A 16 58.621 14.927 37.427 1.00 0.00 H ATOM 238 HB3 PRO A 16 57.936 13.841 36.195 1.00 0.00 H ATOM 239 N LEU A 17 55.822 13.986 39.112 1.00 26.86 N ATOM 240 CA LEU A 17 55.766 13.726 40.535 1.00 26.35 C ATOM 241 C LEU A 17 56.557 12.470 40.871 1.00 25.70 C ATOM 242 O LEU A 17 57.288 12.434 41.847 1.00 24.74 O ATOM 243 CB LEU A 17 54.306 13.558 40.961 1.00 26.72 C ATOM 244 CG LEU A 17 54.066 13.352 42.455 1.00 27.42 C ATOM 245 CD1 LEU A 17 54.416 14.590 43.247 1.00 29.22 C ATOM 246 CD2 LEU A 17 52.641 12.982 42.728 1.00 28.11 C ATOM 247 HA LEU A 17 56.206 14.566 41.073 1.00 0.00 H ATOM 248 HB2 LEU A 17 53.764 14.453 40.656 1.00 0.00 H ATOM 249 HB3 LEU A 17 53.902 12.693 40.435 1.00 0.00 H ATOM 250 HG LEU A 17 54.716 12.535 42.769 1.00 0.00 H ATOM 251 HD21 LEU A 17 51.986 13.779 42.376 1.00 0.00 H ATOM 252 HD22 LEU A 17 52.401 12.056 42.205 1.00 0.00 H ATOM 253 HD23 LEU A 17 52.502 12.842 43.800 1.00 0.00 H ATOM 254 HD11 LEU A 17 55.468 14.831 43.096 1.00 0.00 H ATOM 255 HD12 LEU A 17 53.799 15.422 42.909 1.00 0.00 H ATOM 256 HD13 LEU A 17 54.233 14.406 44.306 1.00 0.00 H ATOM 257 H LEU A 17 55.365 13.321 38.455 1.00 0.00 H ATOM 258 N GLY A 18 56.397 11.434 40.059 1.00 25.16 N ATOM 259 CA GLY A 18 57.097 10.192 40.295 1.00 24.25 C ATOM 260 C GLY A 18 56.454 8.977 39.663 1.00 23.14 C ATOM 261 O GLY A 18 55.417 9.034 39.008 1.00 23.00 O ATOM 262 HA3 GLY A 18 57.148 10.029 41.372 1.00 0.00 H ATOM 263 HA2 GLY A 18 58.107 10.289 39.896 1.00 0.00 H ATOM 264 H GLY A 18 55.759 11.516 39.242 1.00 0.00 H ATOM 265 N ARG A 19 57.100 7.853 39.910 1.00 22.95 N ATOM 266 CA ARG A 19 56.719 6.588 39.336 1.00 22.60 C ATOM 267 C ARG A 19 56.157 5.663 40.394 1.00 21.80 C ATOM 268 O ARG A 19 56.661 5.583 41.512 1.00 21.43 O ATOM 269 CB ARG A 19 57.938 5.935 38.702 1.00 22.91 C ATOM 270 CG ARG A 19 57.672 4.568 38.129 1.00 23.92 C ATOM 271 CD ARG A 19 58.792 4.099 37.210 1.00 25.83 C ATOM 272 NE ARG A 19 58.878 4.905 36.000 1.00 27.32 N ATOM 273 CZ ARG A 19 59.664 4.629 34.962 1.00 30.03 C ATOM 274 NH1 ARG A 19 60.459 3.564 34.984 1.00 28.82 N ATOM 275 NH2 ARG A 19 59.648 5.420 33.894 1.00 29.69 N ATOM 276 HA ARG A 19 55.951 6.767 38.583 1.00 0.00 H ATOM 277 HB2 ARG A 19 58.294 6.580 37.899 1.00 0.00 H ATOM 278 HB3 ARG A 19 58.713 5.843 39.463 1.00 0.00 H ATOM 279 HG2 ARG A 19 57.570 3.857 38.949 1.00 0.00 H ATOM 280 HG3 ARG A 19 56.742 4.600 37.561 1.00 0.00 H ATOM 281 HD2 ARG A 19 58.607 3.062 36.930 1.00 0.00 H ATOM 282 HD3 ARG A 19 59.739 4.166 37.746 1.00 0.00 H ATOM 283 HE ARG A 19 58.283 5.756 35.943 1.00 0.00 H ATOM 284 HH12 ARG A 19 61.070 3.355 34.169 1.00 0.00 H ATOM 285 HH11 ARG A 19 60.470 2.940 35.816 1.00 0.00 H ATOM 286 HH22 ARG A 19 60.261 5.208 33.081 1.00 0.00 H ATOM 287 HH21 ARG A 19 59.023 6.251 33.872 1.00 0.00 H ATOM 288 H ARG A 19 57.921 7.882 40.548 1.00 0.00 H ATOM 289 N VAL A 20 55.060 5.001 40.043 1.00 20.74 N ATOM 290 CA VAL A 20 54.485 3.978 40.895 1.00 19.81 C ATOM 291 C VAL A 20 54.482 2.719 40.069 1.00 18.90 C ATOM 292 O VAL A 20 54.101 2.746 38.901 1.00 17.16 O ATOM 293 CB VAL A 20 53.048 4.318 41.308 1.00 20.17 C ATOM 294 CG1 VAL A 20 52.454 3.245 42.245 1.00 21.06 C ATOM 295 CG2 VAL A 20 53.048 5.641 41.972 1.00 22.10 C ATOM 296 HA VAL A 20 55.061 3.881 41.815 1.00 0.00 H ATOM 297 HB VAL A 20 52.422 4.344 40.416 1.00 0.00 H ATOM 298 HG11 VAL A 20 52.446 2.282 41.734 1.00 0.00 H ATOM 299 HG12 VAL A 20 53.063 3.174 43.146 1.00 0.00 H ATOM 300 HG13 VAL A 20 51.435 3.523 42.514 1.00 0.00 H ATOM 301 HG21 VAL A 20 53.689 5.604 42.853 1.00 0.00 H ATOM 302 HG22 VAL A 20 53.424 6.394 41.279 1.00 0.00 H ATOM 303 HG23 VAL A 20 52.031 5.896 42.271 1.00 0.00 H ATOM 304 H VAL A 20 54.603 5.222 39.135 1.00 0.00 H ATOM 305 N SER A 21 54.871 1.617 40.692 1.00 18.38 N ATOM 306 CA SER A 21 54.948 0.341 40.012 1.00 18.74 C ATOM 307 C SER A 21 54.009 -0.623 40.667 1.00 17.97 C ATOM 308 O SER A 21 53.833 -0.589 41.888 1.00 16.70 O ATOM 309 CB SER A 21 56.398 -0.200 40.084 1.00 18.79 C ATOM 310 OG SER A 21 57.227 0.565 39.254 1.00 24.08 O ATOM 311 HA SER A 21 54.668 0.464 38.966 1.00 0.00 H ATOM 312 HB2 SER A 21 56.414 -1.239 39.755 1.00 0.00 H ATOM 313 HB3 SER A 21 56.757 -0.140 41.111 1.00 0.00 H ATOM 314 HG SER A 21 58.152 0.217 39.302 1.00 0.00 H ATOM 315 H SER A 21 55.128 1.670 41.698 1.00 0.00 H ATOM 316 N PHE A 22 53.441 -1.494 39.843 1.00 17.64 N ATOM 317 CA PHE A 22 52.487 -2.477 40.301 1.00 18.08 C ATOM 318 C PHE A 22 52.824 -3.865 39.794 1.00 17.88 C ATOM 319 O PHE A 22 53.253 -4.026 38.656 1.00 17.29 O ATOM 320 CB PHE A 22 51.096 -2.214 39.727 1.00 18.04 C ATOM 321 CG PHE A 22 50.637 -0.773 39.743 1.00 19.52 C ATOM 322 CD1 PHE A 22 50.833 0.048 38.637 1.00 20.57 C ATOM 323 CD2 PHE A 22 49.899 -0.278 40.807 1.00 21.41 C ATOM 324 CE1 PHE A 22 50.365 1.335 38.613 1.00 20.35 C ATOM 325 CE2 PHE A 22 49.422 1.028 40.790 1.00 21.64 C ATOM 326 CZ PHE A 22 49.685 1.839 39.695 1.00 21.10 C ATOM 327 HA PHE A 22 52.516 -2.410 41.389 1.00 0.00 H ATOM 328 HB2 PHE A 22 51.092 -2.555 38.692 1.00 0.00 H ATOM 329 HB3 PHE A 22 50.380 -2.799 40.304 1.00 0.00 H ATOM 330 HD2 PHE A 22 49.691 -0.918 41.664 1.00 0.00 H ATOM 331 HE2 PHE A 22 48.845 1.412 41.631 1.00 0.00 H ATOM 332 HZ PHE A 22 49.352 2.877 39.693 1.00 0.00 H ATOM 333 HE1 PHE A 22 50.532 1.959 37.735 1.00 0.00 H ATOM 334 HD1 PHE A 22 51.370 -0.341 37.772 1.00 0.00 H ATOM 335 H PHE A 22 53.691 -1.468 38.834 1.00 0.00 H ATOM 336 N GLU A 23 52.545 -4.852 40.641 1.00 17.67 N ATOM 337 CA GLU A 23 52.488 -6.256 40.251 1.00 16.87 C ATOM 338 C GLU A 23 51.040 -6.633 39.923 1.00 16.52 C ATOM 339 O GLU A 23 50.130 -6.317 40.689 1.00 17.06 O ATOM 340 CB GLU A 23 52.962 -7.148 41.396 1.00 17.25 C ATOM 341 CG GLU A 23 52.910 -8.642 41.049 1.00 19.84 C ATOM 342 CD GLU A 23 53.263 -9.563 42.217 1.00 23.28 C ATOM 343 OE1 GLU A 23 53.124 -10.805 42.062 1.00 26.11 O ATOM 344 OE2 GLU A 23 53.645 -9.047 43.281 1.00 25.22 O ATOM 345 HA GLU A 23 53.132 -6.399 39.383 1.00 0.00 H ATOM 346 HB2 GLU A 23 53.991 -6.883 41.641 1.00 0.00 H ATOM 347 HB3 GLU A 23 52.326 -6.969 42.263 1.00 0.00 H ATOM 348 HG2 GLU A 23 51.900 -8.882 40.716 1.00 0.00 H ATOM 349 HG3 GLU A 23 53.614 -8.831 40.238 1.00 0.00 H ATOM 350 H GLU A 23 52.357 -4.609 41.635 1.00 0.00 H ATOM 351 N LEU A 24 50.828 -7.302 38.790 1.00 15.77 N ATOM 352 CA LEU A 24 49.529 -7.783 38.377 1.00 16.02 C ATOM 353 C LEU A 24 49.434 -9.266 38.675 1.00 16.73 C ATOM 354 O LEU A 24 50.319 -10.049 38.292 1.00 17.29 O ATOM 355 CB LEU A 24 49.321 -7.565 36.892 1.00 15.39 C ATOM 356 CG LEU A 24 49.506 -6.146 36.437 1.00 16.08 C ATOM 357 CD1 LEU A 24 49.052 -6.054 34.988 1.00 17.47 C ATOM 358 CD2 LEU A 24 48.769 -5.132 37.338 1.00 18.01 C ATOM 359 HA LEU A 24 48.763 -7.233 38.923 1.00 0.00 H ATOM 360 HB2 LEU A 24 50.033 -8.191 36.353 1.00 0.00 H ATOM 361 HB3 LEU A 24 48.306 -7.873 36.642 1.00 0.00 H ATOM 362 HG LEU A 24 50.560 -5.879 36.514 1.00 0.00 H ATOM 363 HD21 LEU A 24 47.701 -5.350 37.330 1.00 0.00 H ATOM 364 HD22 LEU A 24 49.149 -5.209 38.357 1.00 0.00 H ATOM 365 HD23 LEU A 24 48.938 -4.123 36.961 1.00 0.00 H ATOM 366 HD11 LEU A 24 49.653 -6.727 34.377 1.00 0.00 H ATOM 367 HD12 LEU A 24 48.002 -6.338 34.919 1.00 0.00 H ATOM 368 HD13 LEU A 24 49.177 -5.031 34.634 1.00 0.00 H ATOM 369 H LEU A 24 51.641 -7.488 38.169 1.00 0.00 H ATOM 370 N PHE A 25 48.350 -9.646 39.336 1.00 16.83 N ATOM 371 CA PHE A 25 48.169 -11.010 39.805 1.00 17.62 C ATOM 372 C PHE A 25 47.620 -11.909 38.693 1.00 17.91 C ATOM 373 O PHE A 25 46.498 -12.441 38.774 1.00 16.82 O ATOM 374 CB PHE A 25 47.295 -10.998 41.057 1.00 18.23 C ATOM 375 CG PHE A 25 47.899 -10.225 42.231 1.00 17.95 C ATOM 376 CD1 PHE A 25 47.114 -9.419 43.010 1.00 21.06 C ATOM 377 CD2 PHE A 25 49.218 -10.361 42.567 1.00 19.33 C ATOM 378 CE1 PHE A 25 47.641 -8.731 44.099 1.00 22.79 C ATOM 379 CE2 PHE A 25 49.766 -9.678 43.660 1.00 22.59 C ATOM 380 CZ PHE A 25 48.980 -8.856 44.417 1.00 21.76 C ATOM 381 HA PHE A 25 49.133 -11.439 40.078 1.00 0.00 H ATOM 382 HB2 PHE A 25 46.338 -10.543 40.803 1.00 0.00 H ATOM 383 HB3 PHE A 25 47.133 -12.029 41.372 1.00 0.00 H ATOM 384 HD2 PHE A 25 49.856 -11.014 41.972 1.00 0.00 H ATOM 385 HE2 PHE A 25 50.820 -9.802 43.907 1.00 0.00 H ATOM 386 HZ PHE A 25 49.403 -8.307 45.259 1.00 0.00 H ATOM 387 HE1 PHE A 25 46.996 -8.092 44.702 1.00 0.00 H ATOM 388 HD1 PHE A 25 46.055 -9.314 42.773 1.00 0.00 H ATOM 389 H PHE A 25 47.605 -8.946 39.525 1.00 0.00 H ATOM 390 N ALA A 26 48.426 -12.058 37.645 1.00 17.94 N ATOM 391 CA ALA A 26 48.039 -12.851 36.481 1.00 19.10 C ATOM 392 C ALA A 26 47.853 -14.337 36.808 1.00 19.58 C ATOM 393 O ALA A 26 47.162 -15.037 36.119 1.00 21.65 O ATOM 394 CB ALA A 26 49.043 -12.687 35.382 1.00 19.36 C ATOM 395 HA ALA A 26 47.071 -12.474 36.152 1.00 0.00 H ATOM 396 HB1 ALA A 26 49.098 -11.637 35.095 1.00 0.00 H ATOM 397 HB2 ALA A 26 50.020 -13.021 35.731 1.00 0.00 H ATOM 398 HB3 ALA A 26 48.740 -13.284 34.522 1.00 0.00 H ATOM 399 H ALA A 26 49.358 -11.597 37.655 1.00 0.00 H ATOM 400 N ASP A 27 48.400 -14.805 37.894 1.00 20.58 N ATOM 401 CA ASP A 27 48.205 -16.191 38.274 1.00 21.97 C ATOM 402 C ASP A 27 46.880 -16.405 38.964 1.00 22.15 C ATOM 403 O ASP A 27 46.493 -17.540 39.202 1.00 22.90 O ATOM 404 CB ASP A 27 49.335 -16.644 39.207 1.00 22.73 C ATOM 405 CG ASP A 27 49.509 -15.725 40.402 1.00 24.90 C ATOM 406 OD1 ASP A 27 49.915 -16.211 41.478 1.00 33.23 O ATOM 407 OD2 ASP A 27 49.231 -14.506 40.363 1.00 27.14 O ATOM 408 HA ASP A 27 48.213 -16.782 37.358 1.00 0.00 H ATOM 409 HB2 ASP A 27 49.109 -17.647 39.568 1.00 0.00 H ATOM 410 HB3 ASP A 27 50.267 -16.664 38.643 1.00 0.00 H ATOM 411 H ASP A 27 48.979 -14.181 38.491 1.00 0.00 H ATOM 412 N LYS A 28 46.173 -15.321 39.284 1.00 21.50 N ATOM 413 CA LYS A 28 44.884 -15.408 39.988 1.00 21.23 C ATOM 414 C LYS A 28 43.723 -14.891 39.155 1.00 20.17 C ATOM 415 O LYS A 28 42.654 -15.481 39.158 1.00 18.66 O ATOM 416 CB LYS A 28 44.934 -14.613 41.288 1.00 22.48 C ATOM 417 CG LYS A 28 46.105 -14.948 42.154 1.00 25.02 C ATOM 418 CD LYS A 28 45.763 -16.086 43.056 1.00 30.13 C ATOM 419 CE LYS A 28 46.913 -16.394 44.007 1.00 31.18 C ATOM 420 NZ LYS A 28 46.800 -17.823 44.354 1.00 34.40 N ATOM 421 HA LYS A 28 44.717 -16.466 40.188 1.00 0.00 H ATOM 422 HB2 LYS A 28 44.981 -13.552 41.041 1.00 0.00 H ATOM 423 HB3 LYS A 28 44.022 -14.814 41.850 1.00 0.00 H ATOM 424 HG2 LYS A 28 46.951 -15.226 41.526 1.00 0.00 H ATOM 425 HG3 LYS A 28 46.371 -14.078 42.755 1.00 0.00 H ATOM 426 HD2 LYS A 28 44.879 -15.827 43.638 1.00 0.00 H ATOM 427 HD3 LYS A 28 45.553 -16.969 42.452 1.00 0.00 H ATOM 428 HE2 LYS A 28 46.834 -15.781 44.905 1.00 0.00 H ATOM 429 HE3 LYS A 28 47.868 -16.199 43.519 1.00 0.00 H ATOM 430 HZ1 LYS A 28 45.882 -17.996 44.812 1.00 0.00 H ATOM 431 HZ2 LYS A 28 46.870 -18.395 43.488 1.00 0.00 H ATOM 432 HZ3 LYS A 28 47.568 -18.082 45.005 1.00 0.00 H ATOM 433 H LYS A 28 46.544 -14.384 39.028 1.00 0.00 H ATOM 434 N VAL A 29 43.937 -13.802 38.427 1.00 19.35 N ATOM 435 CA VAL A 29 42.892 -13.211 37.617 1.00 19.17 C ATOM 436 C VAL A 29 43.489 -12.848 36.272 1.00 18.91 C ATOM 437 O VAL A 29 43.658 -11.673 35.961 1.00 18.60 O ATOM 438 CB VAL A 29 42.296 -11.922 38.309 1.00 19.19 C ATOM 439 CG1 VAL A 29 41.276 -12.304 39.322 1.00 21.13 C ATOM 440 CG2 VAL A 29 43.381 -11.084 38.972 1.00 18.80 C ATOM 441 HA VAL A 29 42.078 -13.925 37.496 1.00 0.00 H ATOM 442 HB VAL A 29 41.831 -11.320 37.528 1.00 0.00 H ATOM 443 HG11 VAL A 29 40.469 -12.852 38.835 1.00 0.00 H ATOM 444 HG12 VAL A 29 41.738 -12.934 40.081 1.00 0.00 H ATOM 445 HG13 VAL A 29 40.875 -11.404 39.789 1.00 0.00 H ATOM 446 HG21 VAL A 29 43.885 -11.680 39.733 1.00 0.00 H ATOM 447 HG22 VAL A 29 44.104 -10.767 38.220 1.00 0.00 H ATOM 448 HG23 VAL A 29 42.929 -10.207 39.436 1.00 0.00 H ATOM 449 H VAL A 29 44.879 -13.362 38.439 1.00 0.00 H ATOM 450 N PRO A 30 43.786 -13.857 35.455 1.00 19.09 N ATOM 451 CA PRO A 30 44.486 -13.636 34.196 1.00 18.38 C ATOM 452 C PRO A 30 43.798 -12.684 33.275 1.00 17.30 C ATOM 453 O PRO A 30 44.480 -11.850 32.706 1.00 17.34 O ATOM 454 CB PRO A 30 44.525 -15.043 33.569 1.00 19.17 C ATOM 455 CG PRO A 30 43.426 -15.771 34.245 1.00 19.35 C ATOM 456 CD PRO A 30 43.483 -15.287 35.649 1.00 19.69 C ATOM 457 HA PRO A 30 45.462 -13.181 34.367 1.00 0.00 H ATOM 458 HD3 PRO A 30 42.529 -15.427 36.158 1.00 0.00 H ATOM 459 HD2 PRO A 30 44.270 -15.788 36.212 1.00 0.00 H ATOM 460 HG3 PRO A 30 43.589 -16.848 34.199 1.00 0.00 H ATOM 461 HG2 PRO A 30 42.465 -15.530 33.791 1.00 0.00 H ATOM 462 HB2 PRO A 30 44.352 -14.993 32.494 1.00 0.00 H ATOM 463 HB3 PRO A 30 45.484 -15.525 33.760 1.00 0.00 H ATOM 464 N LYS A 31 42.484 -12.794 33.122 1.00 17.18 N ATOM 465 CA LYS A 31 41.789 -11.955 32.183 1.00 17.34 C ATOM 466 C LYS A 31 41.842 -10.474 32.641 1.00 16.43 C ATOM 467 O LYS A 31 42.147 -9.583 31.861 1.00 15.38 O ATOM 468 CB LYS A 31 40.370 -12.479 31.979 1.00 18.18 C ATOM 469 CG LYS A 31 39.603 -11.785 30.880 1.00 21.18 C ATOM 470 CD LYS A 31 38.373 -12.594 30.411 1.00 25.14 C ATOM 471 CE LYS A 31 37.690 -11.931 29.207 1.00 27.70 C ATOM 472 NZ LYS A 31 36.265 -12.375 28.982 1.00 28.55 N ATOM 473 HA LYS A 31 42.281 -11.989 31.211 1.00 0.00 H ATOM 474 HB2 LYS A 31 40.429 -13.540 31.737 1.00 0.00 H ATOM 475 HB3 LYS A 31 39.821 -12.351 32.912 1.00 0.00 H ATOM 476 HG2 LYS A 31 39.264 -10.817 31.248 1.00 0.00 H ATOM 477 HG3 LYS A 31 40.268 -11.637 30.030 1.00 0.00 H ATOM 478 HD2 LYS A 31 38.695 -13.596 30.129 1.00 0.00 H ATOM 479 HD3 LYS A 31 37.659 -12.661 31.232 1.00 0.00 H ATOM 480 HE2 LYS A 31 38.267 -12.168 28.313 1.00 0.00 H ATOM 481 HE3 LYS A 31 37.692 -10.852 29.364 1.00 0.00 H ATOM 482 HZ1 LYS A 31 36.245 -13.402 28.818 1.00 0.00 H ATOM 483 HZ2 LYS A 31 35.695 -12.146 29.821 1.00 0.00 H ATOM 484 HZ3 LYS A 31 35.877 -11.882 28.153 1.00 0.00 H ATOM 485 H LYS A 31 41.954 -13.490 33.684 1.00 0.00 H ATOM 486 N THR A 32 41.586 -10.233 33.917 1.00 16.01 N ATOM 487 CA THR A 32 41.585 -8.874 34.464 1.00 14.97 C ATOM 488 C THR A 32 42.985 -8.258 34.414 1.00 15.19 C ATOM 489 O THR A 32 43.149 -7.124 34.042 1.00 13.76 O ATOM 490 CB THR A 32 41.075 -8.935 35.876 1.00 14.56 C ATOM 491 OG1 THR A 32 39.756 -9.517 35.863 1.00 15.48 O ATOM 492 CG2 THR A 32 40.910 -7.495 36.492 1.00 14.16 C ATOM 493 HA THR A 32 40.936 -8.237 33.863 1.00 0.00 H ATOM 494 HB THR A 32 41.789 -9.514 36.462 1.00 0.00 H ATOM 495 HG1 THR A 32 39.803 -10.429 35.481 1.00 0.00 H ATOM 496 HG23 THR A 32 41.882 -7.003 36.527 1.00 0.00 H ATOM 497 HG21 THR A 32 40.228 -6.912 35.872 1.00 0.00 H ATOM 498 HG22 THR A 32 40.506 -7.577 37.501 1.00 0.00 H ATOM 499 H THR A 32 41.379 -11.032 34.550 1.00 0.00 H ATOM 500 N ALA A 33 43.991 -9.042 34.779 1.00 15.45 N ATOM 501 CA ALA A 33 45.378 -8.599 34.736 1.00 15.93 C ATOM 502 C ALA A 33 45.862 -8.250 33.324 1.00 15.98 C ATOM 503 O ALA A 33 46.566 -7.258 33.124 1.00 16.02 O ATOM 504 CB ALA A 33 46.266 -9.696 35.317 1.00 16.30 C ATOM 505 HA ALA A 33 45.441 -7.684 35.324 1.00 0.00 H ATOM 506 HB1 ALA A 33 45.973 -9.891 36.349 1.00 0.00 H ATOM 507 HB2 ALA A 33 46.151 -10.605 34.727 1.00 0.00 H ATOM 508 HB3 ALA A 33 47.306 -9.372 35.289 1.00 0.00 H ATOM 509 H ALA A 33 43.782 -10.006 35.107 1.00 0.00 H ATOM 510 N GLU A 34 45.483 -9.070 32.349 1.00 15.41 N ATOM 511 CA GLU A 34 45.892 -8.863 30.967 1.00 15.35 C ATOM 512 C GLU A 34 45.305 -7.549 30.450 1.00 15.72 C ATOM 513 O GLU A 34 46.010 -6.767 29.806 1.00 15.29 O ATOM 514 CB GLU A 34 45.507 -10.077 30.101 1.00 15.16 C ATOM 515 CG GLU A 34 45.712 -9.926 28.592 1.00 17.24 C ATOM 516 CD GLU A 34 47.165 -9.686 28.191 1.00 18.20 C ATOM 517 OE1 GLU A 34 48.071 -9.777 29.050 1.00 22.10 O ATOM 518 OE2 GLU A 34 47.402 -9.372 27.013 1.00 19.16 O ATOM 519 HA GLU A 34 46.977 -8.779 30.909 1.00 0.00 H ATOM 520 HB2 GLU A 34 46.104 -10.926 30.434 1.00 0.00 H ATOM 521 HB3 GLU A 34 44.451 -10.287 30.274 1.00 0.00 H ATOM 522 HG2 GLU A 34 45.366 -10.838 28.105 1.00 0.00 H ATOM 523 HG3 GLU A 34 45.115 -9.082 28.246 1.00 0.00 H ATOM 524 H GLU A 34 44.877 -9.883 32.580 1.00 0.00 H ATOM 525 N ASN A 35 44.040 -7.273 30.791 1.00 15.22 N ATOM 526 CA ASN A 35 43.398 -6.018 30.389 1.00 15.55 C ATOM 527 C ASN A 35 44.175 -4.796 30.890 1.00 15.35 C ATOM 528 O ASN A 35 44.455 -3.865 30.122 1.00 16.14 O ATOM 529 CB ASN A 35 41.930 -5.971 30.873 1.00 15.12 C ATOM 530 CG ASN A 35 41.234 -4.676 30.513 1.00 15.59 C ATOM 531 OD1 ASN A 35 41.027 -4.382 29.344 1.00 17.73 O ATOM 532 ND2 ASN A 35 40.870 -3.889 31.524 1.00 12.34 N ATOM 533 HA ASN A 35 43.403 -5.984 29.300 1.00 0.00 H ATOM 534 HB2 ASN A 35 41.386 -6.798 30.416 1.00 0.00 H ATOM 535 HB3 ASN A 35 41.917 -6.084 31.957 1.00 0.00 H ATOM 536 HD22 ASN A 35 41.065 -4.177 32.504 1.00 0.00 H ATOM 537 HD21 ASN A 35 40.390 -2.986 31.334 1.00 0.00 H ATOM 538 H ASN A 35 43.502 -7.963 31.353 1.00 0.00 H ATOM 539 N PHE A 36 44.520 -4.788 32.169 1.00 14.79 N ATOM 540 CA PHE A 36 45.288 -3.677 32.733 1.00 15.00 C ATOM 541 C PHE A 36 46.695 -3.555 32.120 1.00 14.96 C ATOM 542 O PHE A 36 47.212 -2.436 31.902 1.00 14.07 O ATOM 543 CB PHE A 36 45.405 -3.826 34.252 1.00 14.69 C ATOM 544 CG PHE A 36 45.817 -2.566 34.957 1.00 15.13 C ATOM 545 CD1 PHE A 36 47.144 -2.322 35.250 1.00 14.76 C ATOM 546 CD2 PHE A 36 44.871 -1.625 35.324 1.00 16.29 C ATOM 547 CE1 PHE A 36 47.512 -1.177 35.897 1.00 16.29 C ATOM 548 CE2 PHE A 36 45.238 -0.460 35.985 1.00 14.44 C ATOM 549 CZ PHE A 36 46.562 -0.239 36.267 1.00 15.24 C ATOM 550 HA PHE A 36 44.742 -2.766 32.488 1.00 0.00 H ATOM 551 HB2 PHE A 36 44.436 -4.137 34.642 1.00 0.00 H ATOM 552 HB3 PHE A 36 46.145 -4.597 34.465 1.00 0.00 H ATOM 553 HD2 PHE A 36 43.821 -1.801 35.091 1.00 0.00 H ATOM 554 HE2 PHE A 36 44.483 0.270 36.276 1.00 0.00 H ATOM 555 HZ PHE A 36 46.866 0.673 36.781 1.00 0.00 H ATOM 556 HE1 PHE A 36 48.563 -0.999 36.124 1.00 0.00 H ATOM 557 HD1 PHE A 36 47.904 -3.049 34.963 1.00 0.00 H ATOM 558 H PHE A 36 44.241 -5.582 32.781 1.00 0.00 H ATOM 559 N ARG A 37 47.318 -4.702 31.873 1.00 14.69 N ATOM 560 CA ARG A 37 48.651 -4.726 31.277 1.00 14.80 C ATOM 561 C ARG A 37 48.595 -4.082 29.899 1.00 14.42 C ATOM 562 O ARG A 37 49.323 -3.164 29.621 1.00 14.53 O ATOM 563 CB ARG A 37 49.186 -6.162 31.194 1.00 14.92 C ATOM 564 CG ARG A 37 50.672 -6.255 30.796 1.00 16.94 C ATOM 565 CD ARG A 37 51.108 -7.623 30.216 1.00 18.65 C ATOM 566 NE ARG A 37 50.315 -7.974 29.054 1.00 19.23 N ATOM 567 CZ ARG A 37 50.485 -7.438 27.852 1.00 22.19 C ATOM 568 NH1 ARG A 37 51.441 -6.534 27.652 1.00 24.68 N ATOM 569 NH2 ARG A 37 49.695 -7.787 26.847 1.00 23.13 N ATOM 570 HA ARG A 37 49.337 -4.159 31.906 1.00 0.00 H ATOM 571 HB2 ARG A 37 49.062 -6.631 32.170 1.00 0.00 H ATOM 572 HB3 ARG A 37 48.598 -6.705 30.454 1.00 0.00 H ATOM 573 HG2 ARG A 37 50.870 -5.490 30.045 1.00 0.00 H ATOM 574 HG3 ARG A 37 51.273 -6.056 31.683 1.00 0.00 H ATOM 575 HD2 ARG A 37 50.981 -8.391 30.979 1.00 0.00 H ATOM 576 HD3 ARG A 37 52.158 -7.570 29.928 1.00 0.00 H ATOM 577 HE ARG A 37 49.568 -8.689 29.169 1.00 0.00 H ATOM 578 HH12 ARG A 37 51.572 -6.116 26.709 1.00 0.00 H ATOM 579 HH11 ARG A 37 52.057 -6.246 28.439 1.00 0.00 H ATOM 580 HH22 ARG A 37 49.832 -7.364 25.907 1.00 0.00 H ATOM 581 HH21 ARG A 37 48.938 -8.484 26.998 1.00 0.00 H ATOM 582 H ARG A 37 46.848 -5.599 32.108 1.00 0.00 H ATOM 583 N ALA A 38 47.699 -4.561 29.048 1.00 15.79 N ATOM 584 CA ALA A 38 47.582 -4.051 27.690 1.00 16.14 C ATOM 585 C ALA A 38 47.167 -2.593 27.657 1.00 16.51 C ATOM 586 O ALA A 38 47.595 -1.856 26.779 1.00 16.71 O ATOM 587 CB ALA A 38 46.624 -4.906 26.885 1.00 16.63 C ATOM 588 HA ALA A 38 48.571 -4.107 27.235 1.00 0.00 H ATOM 589 HB1 ALA A 38 46.995 -5.930 26.849 1.00 0.00 H ATOM 590 HB2 ALA A 38 45.641 -4.891 27.356 1.00 0.00 H ATOM 591 HB3 ALA A 38 46.549 -4.510 25.872 1.00 0.00 H ATOM 592 H ALA A 38 47.062 -5.322 29.359 1.00 0.00 H ATOM 593 N LEU A 39 46.354 -2.157 28.615 1.00 16.86 N ATOM 594 CA LEU A 39 45.958 -0.750 28.663 1.00 16.62 C ATOM 595 C LEU A 39 47.131 0.136 29.083 1.00 16.85 C ATOM 596 O LEU A 39 47.212 1.322 28.697 1.00 16.49 O ATOM 597 CB LEU A 39 44.722 -0.526 29.563 1.00 17.26 C ATOM 598 CG LEU A 39 43.415 -1.080 28.974 1.00 16.90 C ATOM 599 CD1 LEU A 39 42.218 -0.869 29.890 1.00 16.62 C ATOM 600 CD2 LEU A 39 43.128 -0.513 27.574 1.00 17.87 C ATOM 601 HA LEU A 39 45.666 -0.459 27.654 1.00 0.00 H ATOM 602 HB2 LEU A 39 44.901 -1.014 30.521 1.00 0.00 H ATOM 603 HB3 LEU A 39 44.601 0.546 29.720 1.00 0.00 H ATOM 604 HG LEU A 39 43.567 -2.155 28.882 1.00 0.00 H ATOM 605 HD21 LEU A 39 43.042 0.572 27.633 1.00 0.00 H ATOM 606 HD22 LEU A 39 43.944 -0.778 26.902 1.00 0.00 H ATOM 607 HD23 LEU A 39 42.195 -0.932 27.198 1.00 0.00 H ATOM 608 HD11 LEU A 39 42.396 -1.373 30.840 1.00 0.00 H ATOM 609 HD12 LEU A 39 42.079 0.198 30.064 1.00 0.00 H ATOM 610 HD13 LEU A 39 41.325 -1.281 29.420 1.00 0.00 H ATOM 611 H LEU A 39 45.998 -2.820 29.333 1.00 0.00 H ATOM 612 N SER A 40 48.059 -0.436 29.838 1.00 16.95 N ATOM 613 CA SER A 40 49.220 0.304 30.308 1.00 17.42 C ATOM 614 C SER A 40 50.314 0.444 29.225 1.00 18.40 C ATOM 615 O SER A 40 51.024 1.447 29.193 1.00 18.68 O ATOM 616 CB SER A 40 49.809 -0.371 31.543 1.00 17.61 C ATOM 617 OG SER A 40 48.833 -0.487 32.571 1.00 19.48 O ATOM 618 HA SER A 40 48.875 1.307 30.558 1.00 0.00 H ATOM 619 HB2 SER A 40 50.646 0.223 31.910 1.00 0.00 H ATOM 620 HB3 SER A 40 50.163 -1.366 31.272 1.00 0.00 H ATOM 621 HG SER A 40 48.073 -1.030 32.243 1.00 0.00 H ATOM 622 H SER A 40 47.954 -1.437 30.100 1.00 0.00 H ATOM 623 N THR A 41 50.466 -0.565 28.374 1.00 18.93 N ATOM 624 CA THR A 41 51.464 -0.488 27.304 1.00 19.67 C ATOM 625 C THR A 41 50.935 0.336 26.166 1.00 20.35 C ATOM 626 O THR A 41 51.704 1.000 25.495 1.00 21.04 O ATOM 627 CB THR A 41 51.827 -1.853 26.721 1.00 18.76 C ATOM 628 OG1 THR A 41 50.655 -2.515 26.202 1.00 18.42 O ATOM 629 CG2 THR A 41 52.373 -2.752 27.787 1.00 18.75 C ATOM 630 HA THR A 41 52.350 -0.046 27.760 1.00 0.00 H ATOM 631 HB THR A 41 52.561 -1.675 25.935 1.00 0.00 H ATOM 632 HG1 THR A 41 50.912 -3.396 25.830 1.00 0.00 H ATOM 633 HG23 THR A 41 53.266 -2.301 28.219 1.00 0.00 H ATOM 634 HG21 THR A 41 51.622 -2.889 28.565 1.00 0.00 H ATOM 635 HG22 THR A 41 52.627 -3.718 27.351 1.00 0.00 H ATOM 636 H THR A 41 49.873 -1.414 28.468 1.00 0.00 H ATOM 637 N GLY A 42 49.628 0.272 25.938 1.00 20.74 N ATOM 638 CA GLY A 42 49.013 0.973 24.822 1.00 21.53 C ATOM 639 C GLY A 42 48.991 0.144 23.537 1.00 22.43 C ATOM 640 O GLY A 42 48.581 0.625 22.485 1.00 22.46 O ATOM 641 HA3 GLY A 42 49.573 1.889 24.635 1.00 0.00 H ATOM 642 HA2 GLY A 42 47.987 1.224 25.092 1.00 0.00 H ATOM 643 H GLY A 42 49.030 -0.293 26.573 1.00 0.00 H ATOM 644 N GLU A 43 49.368 -1.127 23.639 1.00 23.17 N ATOM 645 CA GLU A 43 49.569 -1.971 22.460 1.00 23.92 C ATOM 646 C GLU A 43 48.360 -2.262 21.574 1.00 24.99 C ATOM 647 O GLU A 43 48.532 -2.684 20.442 1.00 25.11 O ATOM 648 CB GLU A 43 50.214 -3.288 22.875 1.00 23.56 C ATOM 649 CG GLU A 43 49.280 -4.229 23.609 1.00 22.17 C ATOM 650 CD GLU A 43 50.041 -5.315 24.347 1.00 20.27 C ATOM 651 OE1 GLU A 43 49.741 -6.494 24.120 1.00 19.21 O ATOM 652 OE2 GLU A 43 50.948 -4.984 25.142 1.00 21.67 O ATOM 653 HA GLU A 43 50.214 -1.362 21.826 1.00 0.00 H ATOM 654 HB2 GLU A 43 50.573 -3.792 21.977 1.00 0.00 H ATOM 655 HB3 GLU A 43 51.059 -3.066 23.527 1.00 0.00 H ATOM 656 HG2 GLU A 43 48.695 -3.656 24.329 1.00 0.00 H ATOM 657 HG3 GLU A 43 48.610 -4.696 22.887 1.00 0.00 H ATOM 658 H GLU A 43 49.525 -1.533 24.584 1.00 0.00 H ATOM 659 N LYS A 44 47.139 -2.076 22.061 1.00 26.04 N ATOM 660 CA LYS A 44 45.994 -2.310 21.199 1.00 26.14 C ATOM 661 C LYS A 44 45.567 -1.039 20.508 1.00 26.05 C ATOM 662 O LYS A 44 44.573 -1.048 19.774 1.00 27.76 O ATOM 663 CB LYS A 44 44.800 -2.866 21.959 1.00 26.61 C ATOM 664 CG LYS A 44 45.016 -4.232 22.582 1.00 28.57 C ATOM 665 CD LYS A 44 45.001 -5.353 21.568 1.00 32.69 C ATOM 666 CE LYS A 44 45.422 -6.691 22.213 1.00 34.35 C ATOM 667 NZ LYS A 44 45.262 -7.873 21.279 1.00 36.94 N ATOM 668 HA LYS A 44 46.317 -3.048 20.465 1.00 0.00 H ATOM 669 HB2 LYS A 44 44.551 -2.166 22.756 1.00 0.00 H ATOM 670 HB3 LYS A 44 43.962 -2.939 21.266 1.00 0.00 H ATOM 671 HG2 LYS A 44 45.981 -4.234 23.089 1.00 0.00 H ATOM 672 HG3 LYS A 44 44.225 -4.411 23.310 1.00 0.00 H ATOM 673 HD2 LYS A 44 43.994 -5.454 21.163 1.00 0.00 H ATOM 674 HD3 LYS A 44 45.693 -5.113 20.761 1.00 0.00 H ATOM 675 HE2 LYS A 44 44.807 -6.860 23.097 1.00 0.00 H ATOM 676 HE3 LYS A 44 46.469 -6.620 22.509 1.00 0.00 H ATOM 677 HZ1 LYS A 44 44.265 -7.957 20.996 1.00 0.00 H ATOM 678 HZ2 LYS A 44 45.852 -7.729 20.435 1.00 0.00 H ATOM 679 HZ3 LYS A 44 45.560 -8.742 21.767 1.00 0.00 H ATOM 680 H LYS A 44 47.005 -1.767 23.045 1.00 0.00 H ATOM 681 N GLY A 45 46.280 0.054 20.734 1.00 25.89 N ATOM 682 CA GLY A 45 45.927 1.330 20.124 1.00 25.52 C ATOM 683 C GLY A 45 45.219 2.363 21.014 1.00 25.42 C ATOM 684 O GLY A 45 44.941 3.494 20.555 1.00 25.83 O ATOM 685 HA3 GLY A 45 45.270 1.119 19.280 1.00 0.00 H ATOM 686 HA2 GLY A 45 46.848 1.786 19.761 1.00 0.00 H ATOM 687 H GLY A 45 47.109 0.001 21.360 1.00 0.00 H ATOM 688 N PHE A 46 44.923 1.999 22.262 1.00 23.58 N ATOM 689 CA PHE A 46 44.282 2.902 23.205 1.00 22.95 C ATOM 690 C PHE A 46 44.720 2.496 24.617 1.00 22.36 C ATOM 691 O PHE A 46 45.227 1.385 24.813 1.00 21.37 O ATOM 692 CB PHE A 46 42.767 2.847 23.057 1.00 22.76 C ATOM 693 CG PHE A 46 42.205 1.468 23.113 1.00 24.38 C ATOM 694 CD1 PHE A 46 41.814 0.924 24.317 1.00 24.33 C ATOM 695 CD2 PHE A 46 42.096 0.698 21.966 1.00 25.80 C ATOM 696 CE1 PHE A 46 41.298 -0.339 24.377 1.00 24.67 C ATOM 697 CE2 PHE A 46 41.585 -0.565 22.014 1.00 26.77 C ATOM 698 CZ PHE A 46 41.181 -1.092 23.235 1.00 27.66 C ATOM 699 HA PHE A 46 44.582 3.932 23.009 1.00 0.00 H ATOM 700 HB2 PHE A 46 42.322 3.432 23.861 1.00 0.00 H ATOM 701 HB3 PHE A 46 42.499 3.288 22.097 1.00 0.00 H ATOM 702 HD2 PHE A 46 42.424 1.108 21.011 1.00 0.00 H ATOM 703 HE2 PHE A 46 41.494 -1.156 21.103 1.00 0.00 H ATOM 704 HZ PHE A 46 40.772 -2.101 23.286 1.00 0.00 H ATOM 705 HE1 PHE A 46 40.978 -0.750 25.334 1.00 0.00 H ATOM 706 HD1 PHE A 46 41.918 1.508 25.231 1.00 0.00 H ATOM 707 H PHE A 46 45.159 1.035 22.572 1.00 0.00 H ATOM 708 N GLY A 47 44.553 3.387 25.592 1.00 21.12 N ATOM 709 CA GLY A 47 45.014 3.084 26.937 1.00 20.31 C ATOM 710 C GLY A 47 45.121 4.247 27.897 1.00 19.24 C ATOM 711 O GLY A 47 44.676 5.340 27.613 1.00 18.79 O ATOM 712 HA3 GLY A 47 46.003 2.632 26.854 1.00 0.00 H ATOM 713 HA2 GLY A 47 44.321 2.362 27.369 1.00 0.00 H ATOM 714 H GLY A 47 44.094 4.298 25.392 1.00 0.00 H ATOM 715 N TYR A 48 45.746 4.007 29.042 1.00 18.75 N ATOM 716 CA TYR A 48 45.750 4.983 30.121 1.00 18.89 C ATOM 717 C TYR A 48 46.625 6.212 29.894 1.00 19.84 C ATOM 718 O TYR A 48 46.491 7.192 30.601 1.00 18.43 O ATOM 719 CB TYR A 48 46.232 4.316 31.391 1.00 18.72 C ATOM 720 CG TYR A 48 45.340 3.218 31.911 1.00 17.52 C ATOM 721 CD1 TYR A 48 43.979 3.435 32.110 1.00 19.49 C ATOM 722 CD2 TYR A 48 45.857 1.984 32.229 1.00 16.64 C ATOM 723 CE1 TYR A 48 43.163 2.439 32.602 1.00 18.03 C ATOM 724 CE2 TYR A 48 45.049 0.977 32.729 1.00 15.49 C ATOM 725 CZ TYR A 48 43.708 1.216 32.907 1.00 16.24 C ATOM 726 OH TYR A 48 42.920 0.247 33.401 1.00 13.91 O ATOM 727 HA TYR A 48 44.721 5.337 30.180 1.00 0.00 H ATOM 728 HB3 TYR A 48 46.315 5.080 32.164 1.00 0.00 H ATOM 729 HB2 TYR A 48 47.216 3.889 31.197 1.00 0.00 H ATOM 730 HD2 TYR A 48 46.921 1.796 32.085 1.00 0.00 H ATOM 731 HE2 TYR A 48 45.473 0.004 32.979 1.00 0.00 H ATOM 732 HE1 TYR A 48 42.098 2.620 32.747 1.00 0.00 H ATOM 733 HD1 TYR A 48 43.552 4.409 31.873 1.00 0.00 H ATOM 734 HH TYR A 48 41.990 0.580 33.466 1.00 0.00 H ATOM 735 H TYR A 48 46.243 3.103 29.171 1.00 0.00 H ATOM 736 N LYS A 49 47.550 6.139 28.945 1.00 20.68 N ATOM 737 CA LYS A 49 48.480 7.232 28.720 1.00 22.25 C ATOM 738 C LYS A 49 47.761 8.546 28.479 1.00 21.88 C ATOM 739 O LYS A 49 46.923 8.652 27.599 1.00 21.43 O ATOM 740 CB LYS A 49 49.389 6.910 27.528 1.00 23.70 C ATOM 741 CG LYS A 49 50.436 7.982 27.242 1.00 28.41 C ATOM 742 CD LYS A 49 51.285 7.578 26.038 1.00 33.68 C ATOM 743 CE LYS A 49 52.328 8.640 25.742 1.00 39.11 C ATOM 744 NZ LYS A 49 53.226 8.245 24.584 1.00 42.83 N ATOM 745 HA LYS A 49 49.082 7.343 29.622 1.00 0.00 H ATOM 746 HB2 LYS A 49 49.905 5.972 27.733 1.00 0.00 H ATOM 747 HB3 LYS A 49 48.765 6.794 26.642 1.00 0.00 H ATOM 748 HG2 LYS A 49 49.936 8.927 27.030 1.00 0.00 H ATOM 749 HG3 LYS A 49 51.079 8.100 28.114 1.00 0.00 H ATOM 750 HD2 LYS A 49 51.785 6.634 26.252 1.00 0.00 H ATOM 751 HD3 LYS A 49 50.639 7.457 25.168 1.00 0.00 H ATOM 752 HE2 LYS A 49 52.942 8.788 26.630 1.00 0.00 H ATOM 753 HE3 LYS A 49 51.821 9.572 25.493 1.00 0.00 H ATOM 754 HZ1 LYS A 49 53.719 7.359 24.816 1.00 0.00 H ATOM 755 HZ2 LYS A 49 52.648 8.108 23.730 1.00 0.00 H ATOM 756 HZ3 LYS A 49 53.924 8.998 24.415 1.00 0.00 H ATOM 757 H LYS A 49 47.610 5.286 28.353 1.00 0.00 H ATOM 758 N GLY A 50 48.081 9.551 29.283 1.00 22.35 N ATOM 759 CA GLY A 50 47.435 10.837 29.149 1.00 22.58 C ATOM 760 C GLY A 50 46.120 10.999 29.924 1.00 22.92 C ATOM 761 O GLY A 50 45.571 12.121 29.952 1.00 24.33 O ATOM 762 HA3 GLY A 50 47.224 10.999 28.092 1.00 0.00 H ATOM 763 HA2 GLY A 50 48.129 11.600 29.501 1.00 0.00 H ATOM 764 H GLY A 50 48.804 9.412 30.017 1.00 0.00 H ATOM 765 N SER A 51 45.610 9.943 30.557 1.00 21.83 N ATOM 766 CA SER A 51 44.331 10.053 31.289 1.00 21.29 C ATOM 767 C SER A 51 44.579 10.584 32.720 1.00 21.67 C ATOM 768 O SER A 51 45.719 10.677 33.153 1.00 21.68 O ATOM 769 CB SER A 51 43.599 8.711 31.296 1.00 20.59 C ATOM 770 OG SER A 51 44.265 7.784 32.125 1.00 18.77 O ATOM 771 HA SER A 51 43.688 10.769 30.778 1.00 0.00 H ATOM 772 HB2 SER A 51 43.560 8.319 30.280 1.00 0.00 H ATOM 773 HB3 SER A 51 42.585 8.858 31.666 1.00 0.00 H ATOM 774 HG SER A 51 44.299 8.135 33.050 1.00 0.00 H ATOM 775 H SER A 51 46.116 9.035 30.536 1.00 0.00 H ATOM 776 N CYS A 52 43.532 10.932 33.456 1.00 21.83 N ATOM 777 CA CYS A 52 43.732 11.499 34.787 1.00 23.42 C ATOM 778 C CYS A 52 43.030 10.724 35.901 1.00 20.85 C ATOM 779 O CYS A 52 42.209 9.859 35.662 1.00 20.93 O ATOM 780 CB CYS A 52 43.278 12.959 34.815 1.00 23.99 C ATOM 781 SG CYS A 52 41.489 13.154 34.796 1.00 36.74 S ATOM 782 HA CYS A 52 44.802 11.428 34.983 1.00 0.00 H ATOM 783 HB2 CYS A 52 43.690 13.466 33.942 1.00 0.00 H ATOM 784 HB3 CYS A 52 43.667 13.424 35.721 1.00 0.00 H ATOM 785 HG CYS A 52 40.978 12.583 33.648 1.00 0.00 H ATOM 786 H CYS A 52 42.569 10.801 33.086 1.00 0.00 H ATOM 787 N PHE A 53 43.383 11.034 37.126 1.00 19.10 N ATOM 788 CA PHE A 53 42.699 10.469 38.264 1.00 18.65 C ATOM 789 C PHE A 53 41.560 11.438 38.612 1.00 17.72 C ATOM 790 O PHE A 53 41.800 12.549 39.063 1.00 18.13 O ATOM 791 CB PHE A 53 43.670 10.300 39.416 1.00 18.00 C ATOM 792 CG PHE A 53 44.506 9.063 39.323 1.00 18.85 C ATOM 793 CD1 PHE A 53 44.112 7.895 39.959 1.00 18.62 C ATOM 794 CD2 PHE A 53 45.708 9.067 38.617 1.00 18.07 C ATOM 795 CE1 PHE A 53 44.915 6.756 39.892 1.00 18.87 C ATOM 796 CE2 PHE A 53 46.494 7.946 38.548 1.00 18.42 C ATOM 797 CZ PHE A 53 46.105 6.786 39.180 1.00 18.43 C ATOM 798 HA PHE A 53 42.294 9.480 38.049 1.00 0.00 H ATOM 799 HB2 PHE A 53 44.334 11.164 39.436 1.00 0.00 H ATOM 800 HB3 PHE A 53 43.100 10.261 40.344 1.00 0.00 H ATOM 801 HD2 PHE A 53 46.029 9.978 38.111 1.00 0.00 H ATOM 802 HE2 PHE A 53 47.430 7.973 37.991 1.00 0.00 H ATOM 803 HZ PHE A 53 46.730 5.895 39.121 1.00 0.00 H ATOM 804 HE1 PHE A 53 44.607 5.842 40.400 1.00 0.00 H ATOM 805 HD1 PHE A 53 43.173 7.867 40.512 1.00 0.00 H ATOM 806 H PHE A 53 44.169 11.698 37.279 1.00 0.00 H ATOM 807 N HIS A 54 40.324 11.025 38.386 1.00 16.92 N ATOM 808 CA HIS A 54 39.175 11.933 38.533 1.00 16.95 C ATOM 809 C HIS A 54 38.565 11.987 39.916 1.00 17.01 C ATOM 810 O HIS A 54 37.899 12.955 40.257 1.00 16.34 O ATOM 811 CB HIS A 54 38.095 11.595 37.526 1.00 16.97 C ATOM 812 CG HIS A 54 37.507 10.229 37.682 1.00 17.75 C ATOM 813 ND1 HIS A 54 38.085 9.102 37.138 1.00 16.87 N ATOM 814 CD2 HIS A 54 36.372 9.811 38.295 1.00 19.09 C ATOM 815 CE1 HIS A 54 37.319 8.053 37.386 1.00 16.85 C ATOM 816 NE2 HIS A 54 36.277 8.454 38.094 1.00 17.80 N ATOM 817 HA HIS A 54 39.589 12.924 38.348 1.00 0.00 H ATOM 818 HB2 HIS A 54 37.292 12.325 37.629 1.00 0.00 H ATOM 819 HB3 HIS A 54 38.525 11.669 36.527 1.00 0.00 H ATOM 820 HD2 HIS A 54 35.667 10.434 38.845 1.00 0.00 H ATOM 821 HE1 HIS A 54 37.514 7.031 37.062 1.00 0.00 H ATOM 822 H HIS A 54 40.161 10.039 38.099 1.00 0.00 H ATOM 823 N ARG A 55 38.860 10.987 40.734 1.00 16.79 N ATOM 824 CA ARG A 55 38.309 10.936 42.076 1.00 16.83 C ATOM 825 C ARG A 55 39.389 10.482 43.061 1.00 16.72 C ATOM 826 O ARG A 55 39.897 9.340 42.979 1.00 15.77 O ATOM 827 CB ARG A 55 37.082 9.990 42.095 1.00 17.15 C ATOM 828 CG ARG A 55 36.185 10.165 43.275 1.00 18.96 C ATOM 829 CD ARG A 55 34.961 9.242 43.295 1.00 19.92 C ATOM 830 NE ARG A 55 33.938 9.577 42.303 1.00 17.92 N ATOM 831 CZ ARG A 55 33.424 8.713 41.439 1.00 20.27 C ATOM 832 NH1 ARG A 55 32.483 9.111 40.587 1.00 20.50 N ATOM 833 NH2 ARG A 55 33.822 7.448 41.429 1.00 22.45 N ATOM 834 HA ARG A 55 37.975 11.928 42.382 1.00 0.00 H ATOM 835 HB2 ARG A 55 36.498 10.171 41.193 1.00 0.00 H ATOM 836 HB3 ARG A 55 37.444 8.962 42.091 1.00 0.00 H ATOM 837 HG2 ARG A 55 36.768 9.975 44.176 1.00 0.00 H ATOM 838 HG3 ARG A 55 35.832 11.196 43.283 1.00 0.00 H ATOM 839 HD2 ARG A 55 34.508 9.297 44.285 1.00 0.00 H ATOM 840 HD3 ARG A 55 35.299 8.223 43.107 1.00 0.00 H ATOM 841 HE ARG A 55 33.592 10.557 42.274 1.00 0.00 H ATOM 842 HH12 ARG A 55 32.077 8.436 39.908 1.00 0.00 H ATOM 843 HH11 ARG A 55 32.153 10.097 40.600 1.00 0.00 H ATOM 844 HH22 ARG A 55 33.412 6.779 40.747 1.00 0.00 H ATOM 845 HH21 ARG A 55 34.545 7.125 42.104 1.00 0.00 H ATOM 846 H ARG A 55 39.494 10.229 40.410 1.00 0.00 H ATOM 847 N ILE A 56 39.766 11.363 43.979 1.00 15.85 N ATOM 848 CA ILE A 56 40.789 11.015 44.987 1.00 17.01 C ATOM 849 C ILE A 56 40.288 11.357 46.405 1.00 17.00 C ATOM 850 O ILE A 56 40.051 12.523 46.711 1.00 17.12 O ATOM 851 CB ILE A 56 42.112 11.768 44.684 1.00 16.80 C ATOM 852 CG1 ILE A 56 42.821 11.167 43.477 1.00 17.25 C ATOM 853 CG2 ILE A 56 43.060 11.673 45.841 1.00 17.85 C ATOM 854 CD1 ILE A 56 44.159 11.823 43.154 1.00 18.59 C ATOM 855 HA ILE A 56 40.977 9.942 44.939 1.00 0.00 H ATOM 856 HB ILE A 56 41.842 12.806 44.491 1.00 0.00 H ATOM 857 HG12 ILE A 56 42.996 10.109 43.673 1.00 0.00 H ATOM 858 HG13 ILE A 56 42.169 11.271 42.609 1.00 0.00 H ATOM 859 HD11 ILE A 56 44.002 12.881 42.942 1.00 0.00 H ATOM 860 HD12 ILE A 56 44.829 11.718 44.007 1.00 0.00 H ATOM 861 HD13 ILE A 56 44.599 11.338 42.283 1.00 0.00 H ATOM 862 HG21 ILE A 56 42.599 12.116 46.724 1.00 0.00 H ATOM 863 HG22 ILE A 56 43.290 10.625 46.036 1.00 0.00 H ATOM 864 HG23 ILE A 56 43.978 12.209 45.602 1.00 0.00 H ATOM 865 H ILE A 56 39.336 12.310 43.989 1.00 0.00 H ATOM 866 N ILE A 57 40.122 10.353 47.257 1.00 16.71 N ATOM 867 CA ILE A 57 39.628 10.560 48.614 1.00 16.97 C ATOM 868 C ILE A 57 40.676 10.099 49.614 1.00 16.80 C ATOM 869 O ILE A 57 40.943 8.900 49.744 1.00 16.12 O ATOM 870 CB ILE A 57 38.310 9.800 48.798 1.00 17.38 C ATOM 871 CG1 ILE A 57 37.290 10.308 47.771 1.00 17.64 C ATOM 872 CG2 ILE A 57 37.805 9.908 50.270 1.00 19.06 C ATOM 873 CD1 ILE A 57 35.933 9.547 47.792 1.00 18.20 C ATOM 874 HA ILE A 57 39.439 11.620 48.785 1.00 0.00 H ATOM 875 HB ILE A 57 38.463 8.736 48.615 1.00 0.00 H ATOM 876 HG12 ILE A 57 37.095 11.361 47.974 1.00 0.00 H ATOM 877 HG13 ILE A 57 37.725 10.205 46.777 1.00 0.00 H ATOM 878 HD11 ILE A 57 36.106 8.492 47.578 1.00 0.00 H ATOM 879 HD12 ILE A 57 35.476 9.649 48.776 1.00 0.00 H ATOM 880 HD13 ILE A 57 35.270 9.968 47.036 1.00 0.00 H ATOM 881 HG21 ILE A 57 38.552 9.483 50.941 1.00 0.00 H ATOM 882 HG22 ILE A 57 37.643 10.956 50.521 1.00 0.00 H ATOM 883 HG23 ILE A 57 36.868 9.360 50.373 1.00 0.00 H ATOM 884 H ILE A 57 40.352 9.387 46.947 1.00 0.00 H ATOM 885 N PRO A 58 41.329 11.054 50.272 1.00 17.19 N ATOM 886 CA PRO A 58 42.412 10.730 51.198 1.00 18.08 C ATOM 887 C PRO A 58 41.983 9.737 52.253 1.00 18.27 C ATOM 888 O PRO A 58 40.867 9.831 52.773 1.00 19.03 O ATOM 889 CB PRO A 58 42.780 12.092 51.811 1.00 18.14 C ATOM 890 CG PRO A 58 42.384 13.085 50.770 1.00 16.86 C ATOM 891 CD PRO A 58 41.158 12.507 50.118 1.00 17.45 C ATOM 892 HA PRO A 58 43.254 10.248 50.702 1.00 0.00 H ATOM 893 HD3 PRO A 58 40.253 12.847 50.622 1.00 0.00 H ATOM 894 HD2 PRO A 58 41.112 12.783 49.065 1.00 0.00 H ATOM 895 HG3 PRO A 58 43.182 13.211 50.039 1.00 0.00 H ATOM 896 HG2 PRO A 58 42.156 14.048 51.227 1.00 0.00 H ATOM 897 HB2 PRO A 58 42.228 12.261 52.736 1.00 0.00 H ATOM 898 HB3 PRO A 58 43.850 12.149 52.012 1.00 0.00 H ATOM 899 N GLY A 59 42.847 8.769 52.510 1.00 18.37 N ATOM 900 CA GLY A 59 42.573 7.714 53.465 1.00 18.87 C ATOM 901 C GLY A 59 41.673 6.609 52.948 1.00 18.62 C ATOM 902 O GLY A 59 41.349 5.697 53.674 1.00 18.96 O ATOM 903 HA3 GLY A 59 42.096 8.161 54.337 1.00 0.00 H ATOM 904 HA2 GLY A 59 43.523 7.268 53.761 1.00 0.00 H ATOM 905 H GLY A 59 43.758 8.765 52.008 1.00 0.00 H ATOM 906 N PHE A 60 41.259 6.671 51.693 1.00 18.13 N ATOM 907 CA PHE A 60 40.362 5.648 51.169 1.00 16.93 C ATOM 908 C PHE A 60 40.893 5.150 49.813 1.00 15.58 C ATOM 909 O PHE A 60 41.410 4.057 49.733 1.00 14.73 O ATOM 910 CB PHE A 60 38.938 6.214 51.053 1.00 17.18 C ATOM 911 CG PHE A 60 37.956 5.284 50.393 1.00 18.40 C ATOM 912 CD1 PHE A 60 36.973 5.783 49.554 1.00 20.17 C ATOM 913 CD2 PHE A 60 37.997 3.928 50.622 1.00 20.62 C ATOM 914 CE1 PHE A 60 36.046 4.940 48.961 1.00 21.58 C ATOM 915 CE2 PHE A 60 37.081 3.080 50.017 1.00 20.96 C ATOM 916 CZ PHE A 60 36.104 3.594 49.186 1.00 20.93 C ATOM 917 HA PHE A 60 40.324 4.797 51.850 1.00 0.00 H ATOM 918 HB2 PHE A 60 38.576 6.438 52.057 1.00 0.00 H ATOM 919 HB3 PHE A 60 38.982 7.134 50.471 1.00 0.00 H ATOM 920 HD2 PHE A 60 38.757 3.516 51.286 1.00 0.00 H ATOM 921 HE2 PHE A 60 37.132 2.006 50.197 1.00 0.00 H ATOM 922 HZ PHE A 60 35.383 2.928 48.712 1.00 0.00 H ATOM 923 HE1 PHE A 60 35.271 5.351 48.315 1.00 0.00 H ATOM 924 HD1 PHE A 60 36.928 6.854 49.357 1.00 0.00 H ATOM 925 H PHE A 60 41.574 7.450 51.080 1.00 0.00 H ATOM 926 N MET A 61 40.807 5.959 48.766 1.00 14.23 N ATOM 927 CA MET A 61 41.279 5.500 47.461 1.00 14.19 C ATOM 928 C MET A 61 41.517 6.586 46.418 1.00 13.74 C ATOM 929 O MET A 61 41.145 7.745 46.589 1.00 13.29 O ATOM 930 CB MET A 61 40.308 4.414 46.916 1.00 14.63 C ATOM 931 CG MET A 61 38.902 4.920 46.657 1.00 14.91 C ATOM 932 SD MET A 61 38.719 5.554 44.994 1.00 16.73 S ATOM 933 CE MET A 61 37.704 6.957 45.173 1.00 17.16 C ATOM 934 HA MET A 61 42.272 5.088 47.639 1.00 0.00 H ATOM 935 HB2 MET A 61 40.713 4.030 45.980 1.00 0.00 H ATOM 936 HB3 MET A 61 40.253 3.605 47.645 1.00 0.00 H ATOM 937 HG2 MET A 61 38.678 5.717 47.365 1.00 0.00 H ATOM 938 HG3 MET A 61 38.199 4.099 46.801 1.00 0.00 H ATOM 939 HE1 MET A 61 36.748 6.660 45.603 1.00 0.00 H ATOM 940 HE2 MET A 61 38.192 7.675 45.831 1.00 0.00 H ATOM 941 HE3 MET A 61 37.539 7.411 44.196 1.00 0.00 H ATOM 942 H MET A 61 40.407 6.913 48.873 1.00 0.00 H ATOM 943 N CYS A 62 42.231 6.191 45.364 1.00 13.52 N ATOM 944 CA CYS A 62 42.482 7.006 44.192 1.00 13.14 C ATOM 945 C CYS A 62 41.932 6.237 42.989 1.00 12.81 C ATOM 946 O CYS A 62 42.389 5.106 42.698 1.00 12.51 O ATOM 947 CB CYS A 62 43.994 7.194 43.981 1.00 13.95 C ATOM 948 SG CYS A 62 44.834 8.085 45.285 1.00 15.31 S ATOM 949 HA CYS A 62 42.015 7.984 44.311 1.00 0.00 H ATOM 950 HB2 CYS A 62 44.140 7.740 43.049 1.00 0.00 H ATOM 951 HB3 CYS A 62 44.449 6.207 43.898 1.00 0.00 H ATOM 952 HG CYS A 62 46.176 8.187 44.980 1.00 0.00 H ATOM 953 H CYS A 62 42.635 5.233 45.384 1.00 0.00 H ATOM 954 N GLN A 63 40.982 6.840 42.288 1.00 11.39 N ATOM 955 CA GLN A 63 40.358 6.235 41.114 1.00 11.74 C ATOM 956 C GLN A 63 40.712 6.958 39.808 1.00 11.89 C ATOM 957 O GLN A 63 40.746 8.183 39.741 1.00 9.91 O ATOM 958 CB GLN A 63 38.832 6.251 41.302 1.00 11.11 C ATOM 959 CG GLN A 63 38.022 5.446 40.295 1.00 11.26 C ATOM 960 CD GLN A 63 36.490 5.479 40.602 1.00 11.70 C ATOM 961 OE1 GLN A 63 36.102 5.775 41.730 1.00 11.99 O ATOM 962 NE2 GLN A 63 35.661 5.171 39.607 1.00 8.29 N ATOM 963 HA GLN A 63 40.738 5.217 41.029 1.00 0.00 H ATOM 964 HB2 GLN A 63 38.615 5.857 42.295 1.00 0.00 H ATOM 965 HB3 GLN A 63 38.500 7.288 41.243 1.00 0.00 H ATOM 966 HG2 GLN A 63 38.189 5.859 39.300 1.00 0.00 H ATOM 967 HG3 GLN A 63 38.362 4.411 40.319 1.00 0.00 H ATOM 968 HE22 GLN A 63 36.041 4.927 38.670 1.00 0.00 H ATOM 969 HE21 GLN A 63 34.633 5.174 39.767 1.00 0.00 H ATOM 970 H GLN A 63 40.667 7.785 42.587 1.00 0.00 H ATOM 971 N GLY A 64 40.940 6.187 38.756 1.00 13.26 N ATOM 972 CA GLY A 64 41.234 6.758 37.462 1.00 14.04 C ATOM 973 C GLY A 64 40.854 5.767 36.397 1.00 14.82 C ATOM 974 O GLY A 64 40.104 4.831 36.655 1.00 14.40 O ATOM 975 HA3 GLY A 64 42.299 6.980 37.393 1.00 0.00 H ATOM 976 HA2 GLY A 64 40.663 7.677 37.328 1.00 0.00 H ATOM 977 H GLY A 64 40.907 5.153 38.863 1.00 0.00 H ATOM 978 N GLY A 65 41.337 6.003 35.182 1.00 15.31 N ATOM 979 CA GLY A 65 41.139 5.054 34.098 1.00 15.34 C ATOM 980 C GLY A 65 40.136 5.408 33.034 1.00 15.34 C ATOM 981 O GLY A 65 39.916 4.597 32.158 1.00 15.42 O ATOM 982 HA3 GLY A 65 40.822 4.111 34.544 1.00 0.00 H ATOM 983 HA2 GLY A 65 42.102 4.916 33.606 1.00 0.00 H ATOM 984 H GLY A 65 41.865 6.881 35.003 1.00 0.00 H ATOM 985 N ASP A 66 39.488 6.566 33.114 1.00 16.07 N ATOM 986 CA ASP A 66 38.562 6.975 32.046 1.00 16.62 C ATOM 987 C ASP A 66 39.314 7.742 30.936 1.00 18.23 C ATOM 988 O ASP A 66 39.465 8.997 30.988 1.00 18.69 O ATOM 989 CB ASP A 66 37.452 7.834 32.619 1.00 17.06 C ATOM 990 CG ASP A 66 36.479 8.333 31.577 1.00 16.47 C ATOM 991 OD1 ASP A 66 36.619 8.010 30.392 1.00 14.42 O ATOM 992 OD2 ASP A 66 35.535 9.078 31.874 1.00 18.87 O ATOM 993 HA ASP A 66 38.124 6.079 31.607 1.00 0.00 H ATOM 994 HB2 ASP A 66 36.901 7.244 33.351 1.00 0.00 H ATOM 995 HB3 ASP A 66 37.902 8.696 33.113 1.00 0.00 H ATOM 996 H ASP A 66 39.636 7.186 33.936 1.00 0.00 H ATOM 997 N PHE A 67 39.778 6.993 29.942 1.00 18.05 N ATOM 998 CA PHE A 67 40.453 7.575 28.807 1.00 19.24 C ATOM 999 C PHE A 67 39.527 7.776 27.594 1.00 20.62 C ATOM 1000 O PHE A 67 40.014 8.155 26.521 1.00 21.64 O ATOM 1001 CB PHE A 67 41.673 6.727 28.417 1.00 19.22 C ATOM 1002 CG PHE A 67 41.330 5.325 28.063 1.00 19.61 C ATOM 1003 CD1 PHE A 67 40.861 5.009 26.800 1.00 22.66 C ATOM 1004 CD2 PHE A 67 41.460 4.314 28.998 1.00 20.72 C ATOM 1005 CE1 PHE A 67 40.530 3.699 26.475 1.00 23.16 C ATOM 1006 CE2 PHE A 67 41.134 3.006 28.673 1.00 21.29 C ATOM 1007 CZ PHE A 67 40.655 2.698 27.432 1.00 22.57 C ATOM 1008 HA PHE A 67 40.784 8.567 29.114 1.00 0.00 H ATOM 1009 HB2 PHE A 67 42.157 7.192 27.558 1.00 0.00 H ATOM 1010 HB3 PHE A 67 42.366 6.711 29.258 1.00 0.00 H ATOM 1011 HD2 PHE A 67 41.822 4.548 29.999 1.00 0.00 H ATOM 1012 HE2 PHE A 67 41.261 2.217 29.414 1.00 0.00 H ATOM 1013 HZ PHE A 67 40.372 1.673 27.193 1.00 0.00 H ATOM 1014 HE1 PHE A 67 40.174 3.457 25.474 1.00 0.00 H ATOM 1015 HD1 PHE A 67 40.750 5.795 26.053 1.00 0.00 H ATOM 1016 H PHE A 67 39.652 5.961 29.983 1.00 0.00 H ATOM 1017 N THR A 68 38.224 7.528 27.726 1.00 21.43 N ATOM 1018 CA THR A 68 37.332 7.771 26.604 1.00 23.13 C ATOM 1019 C THR A 68 36.505 9.025 26.772 1.00 24.26 C ATOM 1020 O THR A 68 36.276 9.730 25.802 1.00 24.82 O ATOM 1021 CB THR A 68 36.374 6.595 26.272 1.00 22.76 C ATOM 1022 OG1 THR A 68 35.492 6.335 27.366 1.00 23.75 O ATOM 1023 CG2 THR A 68 37.119 5.323 26.024 1.00 22.84 C ATOM 1024 HA THR A 68 38.020 7.890 25.767 1.00 0.00 H ATOM 1025 HB THR A 68 35.827 6.897 25.379 1.00 0.00 H ATOM 1026 HG1 THR A 68 34.892 5.583 27.133 1.00 0.00 H ATOM 1027 HG23 THR A 68 37.811 5.465 25.194 1.00 0.00 H ATOM 1028 HG21 THR A 68 37.676 5.049 26.920 1.00 0.00 H ATOM 1029 HG22 THR A 68 36.412 4.531 25.778 1.00 0.00 H ATOM 1030 H THR A 68 37.848 7.163 28.625 1.00 0.00 H ATOM 1031 N ARG A 69 36.037 9.312 27.973 1.00 25.10 N ATOM 1032 CA ARG A 69 35.243 10.537 28.148 1.00 26.42 C ATOM 1033 C ARG A 69 35.937 11.533 29.042 1.00 25.93 C ATOM 1034 O ARG A 69 35.565 12.683 29.074 1.00 25.50 O ATOM 1035 CB ARG A 69 33.844 10.235 28.680 1.00 26.48 C ATOM 1036 CG ARG A 69 32.980 9.443 27.706 1.00 30.72 C ATOM 1037 CD ARG A 69 31.640 8.974 28.291 1.00 36.09 C ATOM 1038 NE ARG A 69 31.048 7.884 27.514 1.00 41.66 N ATOM 1039 CZ ARG A 69 30.021 7.129 27.908 1.00 45.77 C ATOM 1040 NH1 ARG A 69 29.430 7.338 29.086 1.00 46.99 N ATOM 1041 NH2 ARG A 69 29.584 6.154 27.112 1.00 46.76 N ATOM 1042 HA ARG A 69 35.142 10.983 27.158 1.00 0.00 H ATOM 1043 HB2 ARG A 69 33.942 9.660 29.601 1.00 0.00 H ATOM 1044 HB3 ARG A 69 33.345 11.180 28.894 1.00 0.00 H ATOM 1045 HG2 ARG A 69 32.774 10.073 26.841 1.00 0.00 H ATOM 1046 HG3 ARG A 69 33.541 8.564 27.388 1.00 0.00 H ATOM 1047 HD2 ARG A 69 30.947 9.815 28.300 1.00 0.00 H ATOM 1048 HD3 ARG A 69 31.804 8.629 29.312 1.00 0.00 H ATOM 1049 HE ARG A 69 31.461 7.682 26.581 1.00 0.00 H ATOM 1050 HH12 ARG A 69 28.630 6.741 29.380 1.00 0.00 H ATOM 1051 HH11 ARG A 69 29.769 8.098 29.710 1.00 0.00 H ATOM 1052 HH22 ARG A 69 28.784 5.559 27.409 1.00 0.00 H ATOM 1053 HH21 ARG A 69 30.043 5.988 26.194 1.00 0.00 H ATOM 1054 H ARG A 69 36.226 8.684 28.780 1.00 0.00 H ATOM 1055 N HIS A 70 36.948 11.088 29.772 1.00 26.49 N ATOM 1056 CA HIS A 70 37.718 11.971 30.633 1.00 26.85 C ATOM 1057 C HIS A 70 36.872 12.709 31.680 1.00 27.21 C ATOM 1058 O HIS A 70 37.248 13.795 32.129 1.00 27.30 O ATOM 1059 CB HIS A 70 38.504 12.979 29.779 1.00 27.75 C ATOM 1060 CG HIS A 70 39.514 12.342 28.871 1.00 27.37 C ATOM 1061 ND1 HIS A 70 40.768 11.966 29.302 1.00 28.98 N ATOM 1062 CD2 HIS A 70 39.457 12.023 27.560 1.00 26.17 C ATOM 1063 CE1 HIS A 70 41.437 11.435 28.294 1.00 27.26 C ATOM 1064 NE2 HIS A 70 40.661 11.458 27.226 1.00 27.01 N ATOM 1065 HA HIS A 70 38.403 11.334 31.193 1.00 0.00 H ATOM 1066 HB2 HIS A 70 37.796 13.539 29.168 1.00 0.00 H ATOM 1067 HB3 HIS A 70 39.026 13.664 30.448 1.00 0.00 H ATOM 1068 HD2 HIS A 70 38.611 12.185 26.892 1.00 0.00 H ATOM 1069 HE1 HIS A 70 42.454 11.045 28.337 1.00 0.00 H ATOM 1070 H HIS A 70 37.198 10.079 29.728 1.00 0.00 H ATOM 1071 N ASN A 71 35.770 12.100 32.115 1.00 26.43 N ATOM 1072 CA ASN A 71 34.928 12.723 33.115 1.00 26.12 C ATOM 1073 C ASN A 71 34.409 11.757 34.189 1.00 25.56 C ATOM 1074 O ASN A 71 33.508 12.108 34.932 1.00 25.93 O ATOM 1075 CB ASN A 71 33.742 13.398 32.432 1.00 26.47 C ATOM 1076 CG ASN A 71 32.766 12.401 31.834 1.00 27.67 C ATOM 1077 OD1 ASN A 71 32.900 11.174 32.002 1.00 26.60 O ATOM 1078 ND2 ASN A 71 31.757 12.925 31.142 1.00 26.18 N ATOM 1079 HA ASN A 71 35.556 13.449 33.631 1.00 0.00 H ATOM 1080 HB2 ASN A 71 33.214 14.005 33.168 1.00 0.00 H ATOM 1081 HB3 ASN A 71 34.117 14.040 31.635 1.00 0.00 H ATOM 1082 HD22 ASN A 71 31.685 13.956 31.027 1.00 0.00 H ATOM 1083 HD21 ASN A 71 31.040 12.303 30.716 1.00 0.00 H ATOM 1084 H ASN A 71 35.512 11.168 31.733 1.00 0.00 H ATOM 1085 N GLY A 72 34.942 10.536 34.241 1.00 23.91 N ATOM 1086 CA GLY A 72 34.513 9.574 35.228 1.00 22.39 C ATOM 1087 C GLY A 72 33.388 8.658 34.811 1.00 21.67 C ATOM 1088 O GLY A 72 33.007 7.746 35.559 1.00 20.48 O ATOM 1089 HA3 GLY A 72 34.187 10.124 36.111 1.00 0.00 H ATOM 1090 HA2 GLY A 72 35.371 8.953 35.485 1.00 0.00 H ATOM 1091 H GLY A 72 35.680 10.272 33.558 1.00 0.00 H ATOM 1092 N THR A 73 32.831 8.870 33.632 1.00 20.40 N ATOM 1093 CA THR A 73 31.732 8.019 33.228 1.00 20.19 C ATOM 1094 C THR A 73 32.140 7.024 32.139 1.00 19.61 C ATOM 1095 O THR A 73 31.362 6.150 31.826 1.00 19.47 O ATOM 1096 CB THR A 73 30.508 8.838 32.733 1.00 20.25 C ATOM 1097 OG1 THR A 73 30.817 9.458 31.488 1.00 20.39 O ATOM 1098 CG2 THR A 73 30.187 10.010 33.640 1.00 22.55 C ATOM 1099 HA THR A 73 31.448 7.465 34.123 1.00 0.00 H ATOM 1100 HB THR A 73 29.682 8.128 32.688 1.00 0.00 H ATOM 1101 HG1 THR A 73 31.592 10.063 31.605 1.00 0.00 H ATOM 1102 HG23 THR A 73 29.933 9.640 34.633 1.00 0.00 H ATOM 1103 HG21 THR A 73 31.056 10.665 33.706 1.00 0.00 H ATOM 1104 HG22 THR A 73 29.342 10.564 33.230 1.00 0.00 H ATOM 1105 H THR A 73 33.174 9.629 33.010 1.00 0.00 H ATOM 1106 N GLY A 74 33.340 7.144 31.572 1.00 19.42 N ATOM 1107 CA GLY A 74 33.759 6.259 30.496 1.00 19.17 C ATOM 1108 C GLY A 74 34.827 5.210 30.792 1.00 19.96 C ATOM 1109 O GLY A 74 35.031 4.802 31.927 1.00 19.95 O ATOM 1110 HA3 GLY A 74 34.139 6.888 29.691 1.00 0.00 H ATOM 1111 HA2 GLY A 74 32.872 5.727 30.152 1.00 0.00 H ATOM 1112 H GLY A 74 33.990 7.885 31.905 1.00 0.00 H ATOM 1113 N GLY A 75 35.509 4.781 29.738 1.00 19.98 N ATOM 1114 CA GLY A 75 36.514 3.734 29.803 1.00 20.06 C ATOM 1115 C GLY A 75 35.995 2.521 29.039 1.00 20.49 C ATOM 1116 O GLY A 75 34.785 2.407 28.818 1.00 19.52 O ATOM 1117 HA3 GLY A 75 36.698 3.464 30.843 1.00 0.00 H ATOM 1118 HA2 GLY A 75 37.442 4.085 29.351 1.00 0.00 H ATOM 1119 H GLY A 75 35.313 5.218 28.815 1.00 0.00 H ATOM 1120 N LYS A 76 36.908 1.660 28.583 1.00 20.19 N ATOM 1121 CA LYS A 76 36.552 0.411 27.928 1.00 20.20 C ATOM 1122 C LYS A 76 37.708 -0.568 28.105 1.00 18.97 C ATOM 1123 O LYS A 76 38.822 -0.164 28.406 1.00 19.14 O ATOM 1124 CB LYS A 76 36.204 0.621 26.443 1.00 20.99 C ATOM 1125 CG LYS A 76 37.335 1.107 25.572 1.00 24.21 C ATOM 1126 CD LYS A 76 36.869 1.343 24.145 1.00 28.55 C ATOM 1127 CE LYS A 76 38.012 1.298 23.144 1.00 31.02 C ATOM 1128 NZ LYS A 76 38.388 2.651 22.673 1.00 34.74 N ATOM 1129 HA LYS A 76 35.653 0.002 28.389 1.00 0.00 H ATOM 1130 HB2 LYS A 76 35.856 -0.331 26.042 1.00 0.00 H ATOM 1131 HB3 LYS A 76 35.399 1.353 26.387 1.00 0.00 H ATOM 1132 HG2 LYS A 76 37.721 2.041 25.979 1.00 0.00 H ATOM 1133 HG3 LYS A 76 38.128 0.359 25.568 1.00 0.00 H ATOM 1134 HD2 LYS A 76 36.143 0.573 23.882 1.00 0.00 H ATOM 1135 HD3 LYS A 76 36.394 2.322 24.090 1.00 0.00 H ATOM 1136 HE2 LYS A 76 37.706 0.698 22.287 1.00 0.00 H ATOM 1137 HE3 LYS A 76 38.878 0.836 23.618 1.00 0.00 H ATOM 1138 HZ1 LYS A 76 37.569 3.097 22.213 1.00 0.00 H ATOM 1139 HZ2 LYS A 76 38.688 3.228 23.484 1.00 0.00 H ATOM 1140 HZ3 LYS A 76 39.171 2.575 21.992 1.00 0.00 H ATOM 1141 H LYS A 76 37.915 1.892 28.701 1.00 0.00 H ATOM 1142 N SER A 77 37.434 -1.855 27.957 1.00 18.29 N ATOM 1143 CA SER A 77 38.449 -2.888 28.121 1.00 18.28 C ATOM 1144 C SER A 77 38.967 -3.337 26.777 1.00 18.72 C ATOM 1145 O SER A 77 38.420 -2.956 25.756 1.00 18.48 O ATOM 1146 CB SER A 77 37.844 -4.111 28.784 1.00 18.07 C ATOM 1147 OG SER A 77 37.190 -4.911 27.819 1.00 16.52 O ATOM 1148 HA SER A 77 39.252 -2.466 28.726 1.00 0.00 H ATOM 1149 HB2 SER A 77 37.124 -3.794 29.538 1.00 0.00 H ATOM 1150 HB3 SER A 77 38.634 -4.692 29.259 1.00 0.00 H ATOM 1151 HG SER A 77 36.471 -4.384 27.388 1.00 0.00 H ATOM 1152 H SER A 77 36.463 -2.138 27.716 1.00 0.00 H ATOM 1153 N ILE A 78 40.004 -4.172 26.777 1.00 19.32 N ATOM 1154 CA ILE A 78 40.520 -4.698 25.529 1.00 20.46 C ATOM 1155 C ILE A 78 39.624 -5.755 24.949 1.00 21.01 C ATOM 1156 O ILE A 78 39.877 -6.211 23.859 1.00 20.90 O ATOM 1157 CB ILE A 78 41.922 -5.273 25.667 1.00 20.60 C ATOM 1158 CG1 ILE A 78 41.955 -6.410 26.680 1.00 21.46 C ATOM 1159 CG2 ILE A 78 42.887 -4.164 26.001 1.00 20.71 C ATOM 1160 CD1 ILE A 78 43.289 -7.188 26.675 1.00 20.92 C ATOM 1161 HA ILE A 78 40.557 -3.842 24.855 1.00 0.00 H ATOM 1162 HB ILE A 78 42.232 -5.711 24.718 1.00 0.00 H ATOM 1163 HG12 ILE A 78 41.800 -5.993 27.675 1.00 0.00 H ATOM 1164 HG13 ILE A 78 41.147 -7.104 26.449 1.00 0.00 H ATOM 1165 HD11 ILE A 78 43.453 -7.620 25.688 1.00 0.00 H ATOM 1166 HD12 ILE A 78 44.106 -6.507 26.915 1.00 0.00 H ATOM 1167 HD13 ILE A 78 43.247 -7.984 27.419 1.00 0.00 H ATOM 1168 HG21 ILE A 78 42.874 -3.421 25.204 1.00 0.00 H ATOM 1169 HG22 ILE A 78 42.590 -3.697 26.940 1.00 0.00 H ATOM 1170 HG23 ILE A 78 43.891 -4.576 26.100 1.00 0.00 H ATOM 1171 H ILE A 78 40.446 -4.448 27.677 1.00 0.00 H ATOM 1172 N TYR A 79 38.597 -6.165 25.676 1.00 21.64 N ATOM 1173 CA TYR A 79 37.713 -7.188 25.173 1.00 22.53 C ATOM 1174 C TYR A 79 36.402 -6.596 24.686 1.00 24.16 C ATOM 1175 O TYR A 79 35.559 -7.334 24.202 1.00 25.45 O ATOM 1176 CB TYR A 79 37.376 -8.207 26.265 1.00 22.89 C ATOM 1177 CG TYR A 79 38.568 -8.703 27.030 1.00 22.06 C ATOM 1178 CD1 TYR A 79 38.789 -8.284 28.337 1.00 23.21 C ATOM 1179 CD2 TYR A 79 39.498 -9.559 26.441 1.00 21.85 C ATOM 1180 CE1 TYR A 79 39.901 -8.708 29.051 1.00 21.44 C ATOM 1181 CE2 TYR A 79 40.609 -9.992 27.142 1.00 22.98 C ATOM 1182 CZ TYR A 79 40.807 -9.555 28.451 1.00 21.12 C ATOM 1183 OH TYR A 79 41.895 -9.966 29.171 1.00 18.24 O ATOM 1184 HA TYR A 79 38.237 -7.671 24.348 1.00 0.00 H ATOM 1185 HB3 TYR A 79 36.889 -9.063 25.797 1.00 0.00 H ATOM 1186 HB2 TYR A 79 36.688 -7.740 26.969 1.00 0.00 H ATOM 1187 HD2 TYR A 79 39.347 -9.891 25.414 1.00 0.00 H ATOM 1188 HE2 TYR A 79 41.324 -10.669 26.675 1.00 0.00 H ATOM 1189 HE1 TYR A 79 40.056 -8.374 30.077 1.00 0.00 H ATOM 1190 HD1 TYR A 79 38.075 -7.610 28.810 1.00 0.00 H ATOM 1191 HH TYR A 79 41.867 -9.556 30.072 1.00 0.00 H ATOM 1192 H TYR A 79 38.427 -5.748 26.613 1.00 0.00 H ATOM 1193 N GLY A 80 36.217 -5.285 24.819 1.00 25.03 N ATOM 1194 CA GLY A 80 34.942 -4.645 24.496 1.00 25.59 C ATOM 1195 C GLY A 80 34.542 -3.658 25.590 1.00 26.00 C ATOM 1196 O GLY A 80 35.293 -3.453 26.537 1.00 26.19 O ATOM 1197 HA3 GLY A 80 34.171 -5.410 24.404 1.00 0.00 H ATOM 1198 HA2 GLY A 80 35.038 -4.112 23.550 1.00 0.00 H ATOM 1199 H GLY A 80 37.003 -4.697 25.163 1.00 0.00 H ATOM 1200 N GLU A 81 33.370 -3.050 25.481 1.00 26.45 N ATOM 1201 CA GLU A 81 32.934 -2.067 26.472 1.00 27.44 C ATOM 1202 C GLU A 81 32.961 -2.600 27.911 1.00 26.65 C ATOM 1203 O GLU A 81 33.334 -1.864 28.835 1.00 26.10 O ATOM 1204 CB GLU A 81 31.519 -1.556 26.178 1.00 28.31 C ATOM 1205 CG GLU A 81 31.421 -0.803 24.852 1.00 33.42 C ATOM 1206 CD GLU A 81 31.209 -1.709 23.672 1.00 35.15 C ATOM 1207 OE1 GLU A 81 31.109 -2.927 23.862 1.00 37.91 O ATOM 1208 OE2 GLU A 81 31.136 -1.175 22.556 1.00 40.79 O ATOM 1209 HA GLU A 81 33.654 -1.253 26.391 1.00 0.00 H ATOM 1210 HB2 GLU A 81 30.841 -2.409 26.145 1.00 0.00 H ATOM 1211 HB3 GLU A 81 31.217 -0.885 26.982 1.00 0.00 H ATOM 1212 HG2 GLU A 81 30.584 -0.107 24.909 1.00 0.00 H ATOM 1213 HG3 GLU A 81 32.346 -0.246 24.700 1.00 0.00 H ATOM 1214 H GLU A 81 32.750 -3.276 24.677 1.00 0.00 H ATOM 1215 N LYS A 82 32.559 -3.856 28.102 1.00 25.08 N ATOM 1216 CA LYS A 82 32.461 -4.427 29.439 1.00 24.91 C ATOM 1217 C LYS A 82 32.915 -5.872 29.417 1.00 23.58 C ATOM 1218 O LYS A 82 32.807 -6.528 28.382 1.00 23.39 O ATOM 1219 CB LYS A 82 31.016 -4.425 29.932 1.00 25.39 C ATOM 1220 CG LYS A 82 30.319 -3.081 30.004 1.00 28.57 C ATOM 1221 CD LYS A 82 28.787 -3.294 30.151 1.00 30.57 C ATOM 1222 CE LYS A 82 28.042 -1.952 30.166 1.00 33.83 C ATOM 1223 NZ LYS A 82 26.662 -2.037 30.715 1.00 33.19 N ATOM 1224 HA LYS A 82 33.086 -3.822 30.096 1.00 0.00 H ATOM 1225 HB2 LYS A 82 30.438 -5.061 29.261 1.00 0.00 H ATOM 1226 HB3 LYS A 82 31.009 -4.854 30.934 1.00 0.00 H ATOM 1227 HG2 LYS A 82 30.692 -2.524 30.864 1.00 0.00 H ATOM 1228 HG3 LYS A 82 30.521 -2.518 29.093 1.00 0.00 H ATOM 1229 HD2 LYS A 82 28.428 -3.891 29.313 1.00 0.00 H ATOM 1230 HD3 LYS A 82 28.588 -3.822 31.084 1.00 0.00 H ATOM 1231 HE2 LYS A 82 27.983 -1.580 29.143 1.00 0.00 H ATOM 1232 HE3 LYS A 82 28.611 -1.249 30.774 1.00 0.00 H ATOM 1233 HZ1 LYS A 82 26.101 -2.696 30.138 1.00 0.00 H ATOM 1234 HZ2 LYS A 82 26.701 -2.380 31.696 1.00 0.00 H ATOM 1235 HZ3 LYS A 82 26.223 -1.095 30.693 1.00 0.00 H ATOM 1236 H LYS A 82 32.310 -4.441 27.279 1.00 0.00 H ATOM 1237 N PHE A 83 33.465 -6.347 30.532 1.00 21.64 N ATOM 1238 CA PHE A 83 33.806 -7.755 30.671 1.00 20.45 C ATOM 1239 C PHE A 83 33.381 -8.206 32.058 1.00 20.35 C ATOM 1240 O PHE A 83 33.122 -7.384 32.957 1.00 20.19 O ATOM 1241 CB PHE A 83 35.255 -8.104 30.290 1.00 20.03 C ATOM 1242 CG PHE A 83 36.314 -7.643 31.255 1.00 18.22 C ATOM 1243 CD1 PHE A 83 36.832 -8.506 32.191 1.00 17.03 C ATOM 1244 CD2 PHE A 83 36.835 -6.373 31.177 1.00 15.87 C ATOM 1245 CE1 PHE A 83 37.818 -8.095 33.045 1.00 17.73 C ATOM 1246 CE2 PHE A 83 37.831 -5.955 32.035 1.00 15.14 C ATOM 1247 CZ PHE A 83 38.328 -6.813 32.956 1.00 16.01 C ATOM 1248 HA PHE A 83 33.250 -8.331 29.931 1.00 0.00 H ATOM 1249 HB2 PHE A 83 35.327 -9.188 30.206 1.00 0.00 H ATOM 1250 HB3 PHE A 83 35.465 -7.651 29.321 1.00 0.00 H ATOM 1251 HD2 PHE A 83 36.454 -5.684 30.423 1.00 0.00 H ATOM 1252 HE2 PHE A 83 38.216 -4.937 31.971 1.00 0.00 H ATOM 1253 HZ PHE A 83 39.127 -6.495 33.625 1.00 0.00 H ATOM 1254 HE1 PHE A 83 38.203 -8.781 33.799 1.00 0.00 H ATOM 1255 HD1 PHE A 83 36.454 -9.526 32.253 1.00 0.00 H ATOM 1256 H PHE A 83 33.655 -5.697 31.322 1.00 0.00 H ATOM 1257 N GLU A 84 33.243 -9.510 32.206 1.00 19.55 N ATOM 1258 CA GLU A 84 32.673 -10.078 33.415 1.00 19.82 C ATOM 1259 C GLU A 84 33.599 -9.988 34.621 1.00 18.10 C ATOM 1260 O GLU A 84 34.800 -9.781 34.485 1.00 17.44 O ATOM 1261 CB GLU A 84 32.284 -11.545 33.169 1.00 20.37 C ATOM 1262 CG GLU A 84 33.465 -12.464 32.896 1.00 24.46 C ATOM 1263 CD GLU A 84 34.123 -12.220 31.524 1.00 28.29 C ATOM 1264 OE1 GLU A 84 35.197 -12.782 31.301 1.00 31.07 O ATOM 1265 OE2 GLU A 84 33.573 -11.479 30.661 1.00 30.65 O ATOM 1266 HA GLU A 84 31.791 -9.483 33.652 1.00 0.00 H ATOM 1267 HB2 GLU A 84 31.760 -11.913 34.051 1.00 0.00 H ATOM 1268 HB3 GLU A 84 31.615 -11.582 32.309 1.00 0.00 H ATOM 1269 HG2 GLU A 84 34.214 -12.306 33.672 1.00 0.00 H ATOM 1270 HG3 GLU A 84 33.117 -13.496 32.934 1.00 0.00 H ATOM 1271 H GLU A 84 33.549 -10.144 31.441 1.00 0.00 H ATOM 1272 N ASP A 85 33.000 -10.093 35.797 1.00 17.07 N ATOM 1273 CA ASP A 85 33.739 -10.207 37.042 1.00 16.57 C ATOM 1274 C ASP A 85 34.357 -11.608 37.039 1.00 16.76 C ATOM 1275 O ASP A 85 33.661 -12.627 37.091 1.00 14.57 O ATOM 1276 CB ASP A 85 32.794 -10.039 38.222 1.00 16.84 C ATOM 1277 CG ASP A 85 32.234 -8.649 38.306 1.00 14.61 C ATOM 1278 OD1 ASP A 85 31.028 -8.504 38.506 1.00 14.60 O ATOM 1279 OD2 ASP A 85 32.932 -7.639 38.176 1.00 13.95 O ATOM 1280 HA ASP A 85 34.507 -9.439 37.130 1.00 0.00 H ATOM 1281 HB2 ASP A 85 31.970 -10.744 38.115 1.00 0.00 H ATOM 1282 HB3 ASP A 85 33.338 -10.255 39.141 1.00 0.00 H ATOM 1283 H ASP A 85 31.961 -10.094 35.831 1.00 0.00 H ATOM 1284 N GLU A 86 35.674 -11.649 36.962 1.00 17.27 N ATOM 1285 CA GLU A 86 36.382 -12.905 36.799 1.00 18.04 C ATOM 1286 C GLU A 86 36.265 -13.812 38.020 1.00 18.73 C ATOM 1287 O GLU A 86 35.950 -15.003 37.922 1.00 18.05 O ATOM 1288 CB GLU A 86 37.831 -12.601 36.480 1.00 17.96 C ATOM 1289 CG GLU A 86 38.592 -13.734 35.828 1.00 18.34 C ATOM 1290 CD GLU A 86 39.966 -13.292 35.347 1.00 19.31 C ATOM 1291 OE1 GLU A 86 40.403 -12.131 35.587 1.00 17.41 O ATOM 1292 OE2 GLU A 86 40.616 -14.095 34.688 1.00 22.38 O ATOM 1293 HA GLU A 86 35.924 -13.457 35.978 1.00 0.00 H ATOM 1294 HB2 GLU A 86 37.857 -11.744 35.807 1.00 0.00 H ATOM 1295 HB3 GLU A 86 38.336 -12.345 37.411 1.00 0.00 H ATOM 1296 HG2 GLU A 86 38.714 -14.539 36.552 1.00 0.00 H ATOM 1297 HG3 GLU A 86 38.020 -14.098 34.975 1.00 0.00 H ATOM 1298 H GLU A 86 36.215 -10.763 37.019 1.00 0.00 H ATOM 1299 N ASN A 87 36.596 -13.259 39.175 1.00 19.92 N ATOM 1300 CA ASN A 87 36.386 -13.958 40.428 1.00 20.46 C ATOM 1301 C ASN A 87 36.558 -12.964 41.565 1.00 21.28 C ATOM 1302 O ASN A 87 36.926 -11.800 41.330 1.00 20.09 O ATOM 1303 CB ASN A 87 37.302 -15.174 40.561 1.00 20.85 C ATOM 1304 CG ASN A 87 38.800 -14.796 40.605 1.00 21.61 C ATOM 1305 OD1 ASN A 87 39.242 -14.135 41.537 1.00 20.53 O ATOM 1306 ND2 ASN A 87 39.566 -15.227 39.602 1.00 21.51 N ATOM 1307 HA ASN A 87 35.373 -14.360 40.462 1.00 0.00 H ATOM 1308 HB2 ASN A 87 37.049 -15.702 41.481 1.00 0.00 H ATOM 1309 HB3 ASN A 87 37.134 -15.832 39.708 1.00 0.00 H ATOM 1310 HD22 ASN A 87 39.148 -15.786 38.831 1.00 0.00 H ATOM 1311 HD21 ASN A 87 40.582 -15.004 39.591 1.00 0.00 H ATOM 1312 H ASN A 87 37.014 -12.307 39.185 1.00 0.00 H ATOM 1313 N PHE A 88 36.242 -13.384 42.786 1.00 21.20 N ATOM 1314 CA PHE A 88 36.424 -12.504 43.937 1.00 21.91 C ATOM 1315 C PHE A 88 37.311 -13.174 44.936 1.00 22.51 C ATOM 1316 O PHE A 88 37.056 -13.115 46.136 1.00 24.22 O ATOM 1317 CB PHE A 88 35.097 -12.144 44.572 1.00 22.00 C ATOM 1318 CG PHE A 88 34.220 -11.333 43.683 1.00 21.65 C ATOM 1319 CD1 PHE A 88 34.431 -9.979 43.550 1.00 22.07 C ATOM 1320 CD2 PHE A 88 33.208 -11.930 42.946 1.00 22.99 C ATOM 1321 CE1 PHE A 88 33.633 -9.211 42.709 1.00 22.52 C ATOM 1322 CE2 PHE A 88 32.408 -11.163 42.105 1.00 24.35 C ATOM 1323 CZ PHE A 88 32.627 -9.791 41.989 1.00 22.04 C ATOM 1324 HA PHE A 88 36.888 -11.578 43.596 1.00 0.00 H ATOM 1325 HB2 PHE A 88 34.574 -13.066 44.827 1.00 0.00 H ATOM 1326 HB3 PHE A 88 35.291 -11.574 45.481 1.00 0.00 H ATOM 1327 HD2 PHE A 88 33.039 -13.004 43.026 1.00 0.00 H ATOM 1328 HE2 PHE A 88 31.608 -11.636 41.535 1.00 0.00 H ATOM 1329 HZ PHE A 88 32.002 -9.187 41.331 1.00 0.00 H ATOM 1330 HE1 PHE A 88 33.811 -8.139 42.624 1.00 0.00 H ATOM 1331 HD1 PHE A 88 35.235 -9.502 44.112 1.00 0.00 H ATOM 1332 H PHE A 88 35.864 -14.343 42.922 1.00 0.00 H ATOM 1333 N ILE A 89 38.373 -13.797 44.447 1.00 22.71 N ATOM 1334 CA ILE A 89 39.277 -14.526 45.318 1.00 23.32 C ATOM 1335 C ILE A 89 40.094 -13.614 46.240 1.00 22.61 C ATOM 1336 O ILE A 89 40.228 -13.891 47.426 1.00 23.72 O ATOM 1337 CB ILE A 89 40.212 -15.389 44.479 1.00 23.56 C ATOM 1338 CG1 ILE A 89 39.413 -16.501 43.811 1.00 25.95 C ATOM 1339 CG2 ILE A 89 41.310 -15.996 45.380 1.00 25.80 C ATOM 1340 CD1 ILE A 89 40.149 -17.169 42.670 1.00 28.94 C ATOM 1341 HA ILE A 89 38.661 -15.151 45.964 1.00 0.00 H ATOM 1342 HB ILE A 89 40.683 -14.775 43.712 1.00 0.00 H ATOM 1343 HG12 ILE A 89 39.179 -17.257 44.561 1.00 0.00 H ATOM 1344 HG13 ILE A 89 38.487 -16.076 43.423 1.00 0.00 H ATOM 1345 HD11 ILE A 89 40.381 -16.428 41.905 1.00 0.00 H ATOM 1346 HD12 ILE A 89 41.074 -17.609 43.044 1.00 0.00 H ATOM 1347 HD13 ILE A 89 39.521 -17.950 42.242 1.00 0.00 H ATOM 1348 HG21 ILE A 89 41.880 -15.193 45.847 1.00 0.00 H ATOM 1349 HG22 ILE A 89 40.846 -16.610 46.152 1.00 0.00 H ATOM 1350 HG23 ILE A 89 41.975 -16.612 44.775 1.00 0.00 H ATOM 1351 H ILE A 89 38.562 -13.763 43.425 1.00 0.00 H ATOM 1352 N LEU A 90 40.642 -12.544 45.682 1.00 21.31 N ATOM 1353 CA LEU A 90 41.503 -11.629 46.411 1.00 20.74 C ATOM 1354 C LEU A 90 40.717 -10.557 47.158 1.00 19.51 C ATOM 1355 O LEU A 90 39.651 -10.164 46.730 1.00 18.93 O ATOM 1356 CB LEU A 90 42.486 -10.998 45.444 1.00 20.99 C ATOM 1357 CG LEU A 90 43.459 -12.043 44.868 1.00 23.18 C ATOM 1358 CD1 LEU A 90 44.395 -11.415 43.826 1.00 24.67 C ATOM 1359 CD2 LEU A 90 44.275 -12.736 45.975 1.00 24.20 C ATOM 1360 HA LEU A 90 42.040 -12.200 47.169 1.00 0.00 H ATOM 1361 HB2 LEU A 90 41.933 -10.539 44.625 1.00 0.00 H ATOM 1362 HB3 LEU A 90 43.058 -10.232 45.968 1.00 0.00 H ATOM 1363 HG LEU A 90 42.854 -12.803 44.374 1.00 0.00 H ATOM 1364 HD21 LEU A 90 44.855 -11.990 46.518 1.00 0.00 H ATOM 1365 HD22 LEU A 90 43.597 -13.241 46.662 1.00 0.00 H ATOM 1366 HD23 LEU A 90 44.949 -13.465 45.525 1.00 0.00 H ATOM 1367 HD11 LEU A 90 43.803 -11.003 43.009 1.00 0.00 H ATOM 1368 HD12 LEU A 90 44.975 -10.619 44.293 1.00 0.00 H ATOM 1369 HD13 LEU A 90 45.069 -12.178 43.438 1.00 0.00 H ATOM 1370 H LEU A 90 40.447 -12.351 44.679 1.00 0.00 H ATOM 1371 N LYS A 91 41.247 -10.109 48.284 1.00 18.56 N ATOM 1372 CA LYS A 91 40.549 -9.135 49.101 1.00 18.62 C ATOM 1373 C LYS A 91 41.249 -7.813 49.197 1.00 17.14 C ATOM 1374 O LYS A 91 42.405 -7.666 48.845 1.00 16.34 O ATOM 1375 CB LYS A 91 40.324 -9.686 50.504 1.00 19.65 C ATOM 1376 CG LYS A 91 39.324 -10.839 50.525 1.00 23.01 C ATOM 1377 CD LYS A 91 39.376 -11.533 51.870 1.00 29.35 C ATOM 1378 CE LYS A 91 39.573 -13.024 51.720 1.00 33.11 C ATOM 1379 NZ LYS A 91 38.266 -13.704 51.603 1.00 35.98 N ATOM 1380 HA LYS A 91 39.598 -8.955 48.600 1.00 0.00 H ATOM 1381 HB2 LYS A 91 41.276 -10.042 50.897 1.00 0.00 H ATOM 1382 HB3 LYS A 91 39.947 -8.884 51.139 1.00 0.00 H ATOM 1383 HG2 LYS A 91 38.320 -10.451 50.355 1.00 0.00 H ATOM 1384 HG3 LYS A 91 39.575 -11.551 49.739 1.00 0.00 H ATOM 1385 HD2 LYS A 91 40.204 -11.123 52.448 1.00 0.00 H ATOM 1386 HD3 LYS A 91 38.440 -11.351 52.399 1.00 0.00 H ATOM 1387 HE2 LYS A 91 40.101 -13.407 52.593 1.00 0.00 H ATOM 1388 HE3 LYS A 91 40.163 -13.221 50.825 1.00 0.00 H ATOM 1389 HZ1 LYS A 91 37.703 -13.519 52.458 1.00 0.00 H ATOM 1390 HZ2 LYS A 91 37.762 -13.342 50.769 1.00 0.00 H ATOM 1391 HZ3 LYS A 91 38.417 -14.728 51.501 1.00 0.00 H ATOM 1392 H LYS A 91 42.178 -10.460 48.588 1.00 0.00 H ATOM 1393 N HIS A 92 40.527 -6.834 49.687 1.00 16.33 N ATOM 1394 CA HIS A 92 41.075 -5.499 49.812 1.00 16.54 C ATOM 1395 C HIS A 92 41.707 -5.447 51.171 1.00 17.38 C ATOM 1396 O HIS A 92 41.133 -4.906 52.134 1.00 17.82 O ATOM 1397 CB HIS A 92 39.988 -4.450 49.656 1.00 15.78 C ATOM 1398 CG HIS A 92 39.268 -4.491 48.339 1.00 14.21 C ATOM 1399 ND1 HIS A 92 38.158 -5.278 48.124 1.00 11.15 N ATOM 1400 CD2 HIS A 92 39.445 -3.775 47.198 1.00 12.69 C ATOM 1401 CE1 HIS A 92 37.696 -5.063 46.903 1.00 11.48 C ATOM 1402 NE2 HIS A 92 38.443 -4.140 46.327 1.00 9.53 N ATOM 1403 HA HIS A 92 41.806 -5.286 49.032 1.00 0.00 H ATOM 1404 HB2 HIS A 92 39.256 -4.598 50.450 1.00 0.00 H ATOM 1405 HB3 HIS A 92 40.445 -3.467 49.764 1.00 0.00 H ATOM 1406 HD2 HIS A 92 40.234 -3.047 47.008 1.00 0.00 H ATOM 1407 HE1 HIS A 92 36.841 -5.564 46.449 1.00 0.00 H ATOM 1408 H HIS A 92 39.549 -7.018 49.989 1.00 0.00 H ATOM 1409 N THR A 93 42.919 -5.982 51.227 1.00 17.97 N ATOM 1410 CA THR A 93 43.592 -6.248 52.481 1.00 19.31 C ATOM 1411 C THR A 93 44.466 -5.132 53.013 1.00 19.60 C ATOM 1412 O THR A 93 44.945 -5.242 54.110 1.00 19.55 O ATOM 1413 CB THR A 93 44.495 -7.481 52.327 1.00 20.04 C ATOM 1414 OG1 THR A 93 45.324 -7.306 51.170 1.00 21.66 O ATOM 1415 CG2 THR A 93 43.706 -8.707 52.007 1.00 21.04 C ATOM 1416 HA THR A 93 42.779 -6.385 53.195 1.00 0.00 H ATOM 1417 HB THR A 93 45.043 -7.586 53.264 1.00 0.00 H ATOM 1418 HG1 THR A 93 44.752 -7.206 50.368 1.00 0.00 H ATOM 1419 HG23 THR A 93 43.034 -8.931 52.835 1.00 0.00 H ATOM 1420 HG21 THR A 93 43.124 -8.537 51.101 1.00 0.00 H ATOM 1421 HG22 THR A 93 44.386 -9.545 51.852 1.00 0.00 H ATOM 1422 H THR A 93 43.404 -6.219 50.338 1.00 0.00 H ATOM 1423 N GLY A 94 44.658 -4.058 52.268 1.00 19.67 N ATOM 1424 CA GLY A 94 45.479 -2.984 52.767 1.00 20.30 C ATOM 1425 C GLY A 94 45.875 -1.961 51.719 1.00 20.60 C ATOM 1426 O GLY A 94 45.430 -2.019 50.567 1.00 20.58 O ATOM 1427 HA3 GLY A 94 46.389 -3.415 53.184 1.00 0.00 H ATOM 1428 HA2 GLY A 94 44.928 -2.470 53.555 1.00 0.00 H ATOM 1429 H GLY A 94 44.219 -3.988 51.328 1.00 0.00 H ATOM 1430 N PRO A 95 46.711 -1.017 52.127 1.00 20.80 N ATOM 1431 CA PRO A 95 47.170 0.052 51.232 1.00 21.03 C ATOM 1432 C PRO A 95 47.894 -0.512 50.025 1.00 20.16 C ATOM 1433 O PRO A 95 48.662 -1.446 50.173 1.00 19.52 O ATOM 1434 CB PRO A 95 48.162 0.863 52.102 1.00 21.40 C ATOM 1435 CG PRO A 95 47.936 0.447 53.499 1.00 21.70 C ATOM 1436 CD PRO A 95 47.296 -0.909 53.470 1.00 21.85 C ATOM 1437 HA PRO A 95 46.341 0.645 50.846 1.00 0.00 H ATOM 1438 HD3 PRO A 95 48.040 -1.689 53.629 1.00 0.00 H ATOM 1439 HD2 PRO A 95 46.522 -0.986 54.234 1.00 0.00 H ATOM 1440 HG3 PRO A 95 47.278 1.159 53.997 1.00 0.00 H ATOM 1441 HG2 PRO A 95 48.886 0.399 54.031 1.00 0.00 H ATOM 1442 HB2 PRO A 95 49.188 0.645 51.806 1.00 0.00 H ATOM 1443 HB3 PRO A 95 47.973 1.931 51.992 1.00 0.00 H ATOM 1444 N GLY A 96 47.640 0.046 48.851 1.00 19.08 N ATOM 1445 CA GLY A 96 48.317 -0.367 47.649 1.00 18.43 C ATOM 1446 C GLY A 96 47.569 -1.376 46.802 1.00 18.49 C ATOM 1447 O GLY A 96 48.015 -1.664 45.685 1.00 19.30 O ATOM 1448 HA3 GLY A 96 49.272 -0.808 47.934 1.00 0.00 H ATOM 1449 HA2 GLY A 96 48.495 0.519 47.040 1.00 0.00 H ATOM 1450 H GLY A 96 46.931 0.805 48.796 1.00 0.00 H ATOM 1451 N ILE A 97 46.438 -1.886 47.288 1.00 17.09 N ATOM 1452 CA ILE A 97 45.668 -2.853 46.533 1.00 17.06 C ATOM 1453 C ILE A 97 45.033 -2.189 45.310 1.00 16.22 C ATOM 1454 O ILE A 97 44.533 -1.069 45.404 1.00 15.78 O ATOM 1455 CB ILE A 97 44.623 -3.529 47.454 1.00 17.38 C ATOM 1456 CG1 ILE A 97 45.306 -4.520 48.399 1.00 18.57 C ATOM 1457 CG2 ILE A 97 43.546 -4.215 46.648 1.00 17.39 C ATOM 1458 CD1 ILE A 97 45.836 -5.799 47.726 1.00 20.17 C ATOM 1459 HA ILE A 97 46.327 -3.637 46.160 1.00 0.00 H ATOM 1460 HB ILE A 97 44.146 -2.752 48.051 1.00 0.00 H ATOM 1461 HG12 ILE A 97 46.147 -4.013 48.872 1.00 0.00 H ATOM 1462 HG13 ILE A 97 44.585 -4.813 49.162 1.00 0.00 H ATOM 1463 HD11 ILE A 97 45.008 -6.332 47.258 1.00 0.00 H ATOM 1464 HD12 ILE A 97 46.572 -5.531 46.968 1.00 0.00 H ATOM 1465 HD13 ILE A 97 46.302 -6.437 48.477 1.00 0.00 H ATOM 1466 HG21 ILE A 97 43.037 -3.480 46.025 1.00 0.00 H ATOM 1467 HG22 ILE A 97 43.998 -4.979 46.015 1.00 0.00 H ATOM 1468 HG23 ILE A 97 42.828 -4.680 47.324 1.00 0.00 H ATOM 1469 H ILE A 97 46.102 -1.585 48.225 1.00 0.00 H ATOM 1470 N LEU A 98 45.114 -2.871 44.159 1.00 15.14 N ATOM 1471 CA LEU A 98 44.589 -2.379 42.901 1.00 15.47 C ATOM 1472 C LEU A 98 43.334 -3.187 42.587 1.00 14.41 C ATOM 1473 O LEU A 98 43.348 -4.421 42.556 1.00 13.94 O ATOM 1474 CB LEU A 98 45.645 -2.519 41.782 1.00 16.36 C ATOM 1475 CG LEU A 98 45.530 -1.862 40.410 1.00 20.48 C ATOM 1476 CD1 LEU A 98 45.385 -0.364 40.503 1.00 24.36 C ATOM 1477 CD2 LEU A 98 46.842 -2.195 39.652 1.00 20.11 C ATOM 1478 HA LEU A 98 44.343 -1.319 42.970 1.00 0.00 H ATOM 1479 HB2 LEU A 98 46.578 -2.150 42.209 1.00 0.00 H ATOM 1480 HB3 LEU A 98 45.732 -3.589 41.591 1.00 0.00 H ATOM 1481 HG LEU A 98 44.642 -2.237 39.901 1.00 0.00 H ATOM 1482 HD21 LEU A 98 47.692 -1.796 40.206 1.00 0.00 H ATOM 1483 HD22 LEU A 98 46.942 -3.276 39.560 1.00 0.00 H ATOM 1484 HD23 LEU A 98 46.811 -1.746 38.659 1.00 0.00 H ATOM 1485 HD11 LEU A 98 44.486 -0.122 41.070 1.00 0.00 H ATOM 1486 HD12 LEU A 98 46.257 0.054 41.006 1.00 0.00 H ATOM 1487 HD13 LEU A 98 45.307 0.055 39.500 1.00 0.00 H ATOM 1488 H LEU A 98 45.578 -3.802 44.169 1.00 0.00 H ATOM 1489 N SER A 99 42.235 -2.479 42.378 1.00 13.58 N ATOM 1490 CA SER A 99 40.945 -3.104 42.183 1.00 13.51 C ATOM 1491 C SER A 99 40.160 -2.412 41.084 1.00 13.04 C ATOM 1492 O SER A 99 40.367 -1.216 40.823 1.00 12.30 O ATOM 1493 CB SER A 99 40.176 -3.036 43.525 1.00 13.60 C ATOM 1494 OG SER A 99 38.969 -3.766 43.438 1.00 13.83 O ATOM 1495 HA SER A 99 41.081 -4.141 41.874 1.00 0.00 H ATOM 1496 HB2 SER A 99 39.951 -1.995 43.758 1.00 0.00 H ATOM 1497 HB3 SER A 99 40.795 -3.458 44.316 1.00 0.00 H ATOM 1498 HG SER A 99 38.490 -3.713 44.303 1.00 0.00 H ATOM 1499 H SER A 99 42.301 -1.441 42.353 1.00 0.00 H ATOM 1500 N MET A 100 39.255 -3.158 40.444 1.00 12.31 N ATOM 1501 CA MET A 100 38.494 -2.651 39.309 1.00 12.31 C ATOM 1502 C MET A 100 37.244 -1.924 39.751 1.00 12.31 C ATOM 1503 O MET A 100 36.426 -2.449 40.529 1.00 11.64 O ATOM 1504 CB MET A 100 38.029 -3.795 38.405 1.00 11.95 C ATOM 1505 CG MET A 100 39.130 -4.442 37.588 1.00 14.31 C ATOM 1506 SD MET A 100 40.001 -3.313 36.560 1.00 16.50 S ATOM 1507 CE MET A 100 38.784 -3.057 35.364 1.00 18.03 C ATOM 1508 HA MET A 100 39.164 -1.974 38.780 1.00 0.00 H ATOM 1509 HB2 MET A 100 37.576 -4.562 39.033 1.00 0.00 H ATOM 1510 HB3 MET A 100 37.281 -3.402 37.717 1.00 0.00 H ATOM 1511 HG2 MET A 100 38.684 -5.210 36.956 1.00 0.00 H ATOM 1512 HG3 MET A 100 39.841 -4.904 38.273 1.00 0.00 H ATOM 1513 HE1 MET A 100 38.538 -4.007 34.888 1.00 0.00 H ATOM 1514 HE2 MET A 100 37.893 -2.645 35.837 1.00 0.00 H ATOM 1515 HE3 MET A 100 39.155 -2.359 34.614 1.00 0.00 H ATOM 1516 H MET A 100 39.088 -4.133 40.766 1.00 0.00 H ATOM 1517 N ALA A 101 37.029 -0.740 39.198 1.00 12.04 N ATOM 1518 CA ALA A 101 35.804 -0.020 39.455 1.00 11.58 C ATOM 1519 C ALA A 101 34.715 -0.586 38.521 1.00 12.12 C ATOM 1520 O ALA A 101 35.025 -1.164 37.490 1.00 12.68 O ATOM 1521 CB ALA A 101 36.000 1.433 39.222 1.00 12.49 C ATOM 1522 HA ALA A 101 35.501 -0.145 40.495 1.00 0.00 H ATOM 1523 HB1 ALA A 101 36.778 1.805 39.889 1.00 0.00 H ATOM 1524 HB2 ALA A 101 36.298 1.597 38.186 1.00 0.00 H ATOM 1525 HB3 ALA A 101 35.067 1.961 39.420 1.00 0.00 H ATOM 1526 H ALA A 101 37.749 -0.325 38.573 1.00 0.00 H ATOM 1527 N ASN A 102 33.446 -0.412 38.851 1.00 11.38 N ATOM 1528 CA ASN A 102 32.409 -0.979 38.018 1.00 12.55 C ATOM 1529 C ASN A 102 31.068 -0.256 38.173 1.00 13.02 C ATOM 1530 O ASN A 102 30.918 0.689 38.967 1.00 13.87 O ATOM 1531 CB ASN A 102 32.301 -2.480 38.307 1.00 12.56 C ATOM 1532 CG ASN A 102 31.796 -2.771 39.708 1.00 14.31 C ATOM 1533 OD1 ASN A 102 30.770 -2.233 40.138 1.00 15.51 O ATOM 1534 ND2 ASN A 102 32.494 -3.643 40.419 1.00 10.72 N ATOM 1535 HA ASN A 102 32.685 -0.840 36.973 1.00 0.00 H ATOM 1536 HB2 ASN A 102 31.613 -2.925 37.588 1.00 0.00 H ATOM 1537 HB3 ASN A 102 33.287 -2.930 38.191 1.00 0.00 H ATOM 1538 HD22 ASN A 102 33.352 -4.072 40.018 1.00 0.00 H ATOM 1539 HD21 ASN A 102 32.184 -3.899 41.378 1.00 0.00 H ATOM 1540 H ASN A 102 33.196 0.129 39.703 1.00 0.00 H ATOM 1541 N ALA A 103 30.105 -0.623 37.352 1.00 13.29 N ATOM 1542 CA ALA A 103 28.793 0.007 37.439 1.00 14.12 C ATOM 1543 C ALA A 103 27.736 -1.056 37.597 1.00 14.82 C ATOM 1544 O ALA A 103 26.650 -0.959 37.064 1.00 14.85 O ATOM 1545 CB ALA A 103 28.519 0.871 36.194 1.00 14.40 C ATOM 1546 HA ALA A 103 28.769 0.664 38.309 1.00 0.00 H ATOM 1547 HB1 ALA A 103 29.279 1.649 36.119 1.00 0.00 H ATOM 1548 HB2 ALA A 103 28.550 0.243 35.304 1.00 0.00 H ATOM 1549 HB3 ALA A 103 27.535 1.331 36.282 1.00 0.00 H ATOM 1550 H ALA A 103 30.281 -1.362 36.642 1.00 0.00 H ATOM 1551 N GLY A 104 28.046 -2.055 38.404 1.00 15.91 N ATOM 1552 CA GLY A 104 27.145 -3.172 38.577 1.00 16.09 C ATOM 1553 C GLY A 104 27.905 -4.423 38.214 1.00 17.07 C ATOM 1554 O GLY A 104 29.112 -4.387 37.863 1.00 16.37 O ATOM 1555 HA3 GLY A 104 26.280 -3.058 37.924 1.00 0.00 H ATOM 1556 HA2 GLY A 104 26.812 -3.225 39.613 1.00 0.00 H ATOM 1557 H GLY A 104 28.948 -2.038 38.921 1.00 0.00 H ATOM 1558 N PRO A 105 27.204 -5.545 38.294 1.00 18.03 N ATOM 1559 CA PRO A 105 27.806 -6.855 38.027 1.00 17.82 C ATOM 1560 C PRO A 105 28.249 -6.967 36.577 1.00 17.09 C ATOM 1561 O PRO A 105 27.534 -6.531 35.702 1.00 16.00 O ATOM 1562 CB PRO A 105 26.651 -7.827 38.280 1.00 18.01 C ATOM 1563 CG PRO A 105 25.645 -7.081 38.985 1.00 18.86 C ATOM 1564 CD PRO A 105 25.766 -5.646 38.592 1.00 18.23 C ATOM 1565 HA PRO A 105 28.688 -7.042 38.639 1.00 0.00 H ATOM 1566 HD3 PRO A 105 25.160 -5.420 37.714 1.00 0.00 H ATOM 1567 HD2 PRO A 105 25.481 -4.983 39.409 1.00 0.00 H ATOM 1568 HG3 PRO A 105 25.795 -7.183 40.060 1.00 0.00 H ATOM 1569 HG2 PRO A 105 24.656 -7.454 38.720 1.00 0.00 H ATOM 1570 HB2 PRO A 105 26.254 -8.197 37.335 1.00 0.00 H ATOM 1571 HB3 PRO A 105 26.990 -8.668 38.884 1.00 0.00 H ATOM 1572 N ASN A 106 29.424 -7.524 36.344 1.00 16.47 N ATOM 1573 CA ASN A 106 29.920 -7.751 35.005 1.00 16.56 C ATOM 1574 C ASN A 106 29.974 -6.511 34.125 1.00 16.39 C ATOM 1575 O ASN A 106 29.586 -6.557 32.971 1.00 17.03 O ATOM 1576 CB ASN A 106 29.082 -8.856 34.338 1.00 16.44 C ATOM 1577 CG ASN A 106 29.083 -10.121 35.156 1.00 15.57 C ATOM 1578 OD1 ASN A 106 30.128 -10.610 35.531 1.00 16.67 O ATOM 1579 ND2 ASN A 106 27.914 -10.629 35.462 1.00 18.15 N ATOM 1580 HA ASN A 106 30.960 -8.061 35.110 1.00 0.00 H ATOM 1581 HB2 ASN A 106 28.056 -8.505 34.229 1.00 0.00 H ATOM 1582 HB3 ASN A 106 29.498 -9.070 33.353 1.00 0.00 H ATOM 1583 HD22 ASN A 106 27.044 -10.175 35.118 1.00 0.00 H ATOM 1584 HD21 ASN A 106 27.857 -11.486 36.049 1.00 0.00 H ATOM 1585 H ASN A 106 30.013 -7.809 37.152 1.00 0.00 H ATOM 1586 N THR A 107 30.470 -5.405 34.665 1.00 16.01 N ATOM 1587 CA THR A 107 30.619 -4.191 33.892 1.00 15.52 C ATOM 1588 C THR A 107 32.044 -3.641 33.965 1.00 16.10 C ATOM 1589 O THR A 107 32.244 -2.442 33.794 1.00 16.46 O ATOM 1590 CB THR A 107 29.633 -3.091 34.367 1.00 16.03 C ATOM 1591 OG1 THR A 107 29.803 -2.843 35.771 1.00 13.77 O ATOM 1592 CG2 THR A 107 28.171 -3.527 34.192 1.00 16.60 C ATOM 1593 HA THR A 107 30.394 -4.458 32.859 1.00 0.00 H ATOM 1594 HB THR A 107 29.847 -2.207 33.766 1.00 0.00 H ATOM 1595 HG1 THR A 107 29.627 -3.676 36.276 1.00 0.00 H ATOM 1596 HG23 THR A 107 27.978 -3.731 33.139 1.00 0.00 H ATOM 1597 HG21 THR A 107 27.989 -4.428 34.778 1.00 0.00 H ATOM 1598 HG22 THR A 107 27.512 -2.730 34.536 1.00 0.00 H ATOM 1599 H THR A 107 30.758 -5.411 35.664 1.00 0.00 H ATOM 1600 N ASN A 108 33.038 -4.498 34.189 1.00 14.78 N ATOM 1601 CA ASN A 108 34.417 -4.036 34.163 1.00 14.56 C ATOM 1602 C ASN A 108 34.815 -3.425 32.820 1.00 14.11 C ATOM 1603 O ASN A 108 34.558 -4.011 31.777 1.00 14.44 O ATOM 1604 CB ASN A 108 35.340 -5.192 34.487 1.00 13.86 C ATOM 1605 CG ASN A 108 35.051 -5.746 35.850 1.00 15.07 C ATOM 1606 OD1 ASN A 108 35.261 -5.045 36.852 1.00 16.30 O ATOM 1607 ND2 ASN A 108 34.490 -6.954 35.905 1.00 10.85 N ATOM 1608 HA ASN A 108 34.507 -3.248 34.911 1.00 0.00 H ATOM 1609 HB2 ASN A 108 35.200 -5.979 33.745 1.00 0.00 H ATOM 1610 HB3 ASN A 108 36.372 -4.844 34.455 1.00 0.00 H ATOM 1611 HD22 ASN A 108 34.338 -7.497 35.031 1.00 0.00 H ATOM 1612 HD21 ASN A 108 34.204 -7.353 36.822 1.00 0.00 H ATOM 1613 H ASN A 108 32.828 -5.498 34.383 1.00 0.00 H ATOM 1614 N GLY A 109 35.440 -2.259 32.869 1.00 12.68 N ATOM 1615 CA GLY A 109 35.921 -1.573 31.690 1.00 12.94 C ATOM 1616 C GLY A 109 37.405 -1.279 31.816 1.00 12.52 C ATOM 1617 O GLY A 109 38.234 -2.196 31.689 1.00 12.96 O ATOM 1618 HA3 GLY A 109 35.378 -0.635 31.573 1.00 0.00 H ATOM 1619 HA2 GLY A 109 35.752 -2.201 30.815 1.00 0.00 H ATOM 1620 H GLY A 109 35.592 -1.816 33.798 1.00 0.00 H ATOM 1621 N SER A 110 37.752 -0.018 32.075 1.00 11.41 N ATOM 1622 CA SER A 110 39.146 0.350 32.290 1.00 11.49 C ATOM 1623 C SER A 110 39.357 1.046 33.631 1.00 11.44 C ATOM 1624 O SER A 110 40.487 1.164 34.109 1.00 11.64 O ATOM 1625 CB SER A 110 39.646 1.265 31.165 1.00 11.36 C ATOM 1626 OG SER A 110 38.877 2.438 31.112 1.00 12.34 O ATOM 1627 HA SER A 110 39.717 -0.579 32.292 1.00 0.00 H ATOM 1628 HB2 SER A 110 39.568 0.740 30.213 1.00 0.00 H ATOM 1629 HB3 SER A 110 40.688 1.526 31.350 1.00 0.00 H ATOM 1630 HG SER A 110 38.949 2.918 31.975 1.00 0.00 H ATOM 1631 H SER A 110 37.016 0.715 32.124 1.00 0.00 H ATOM 1632 N GLN A 111 38.282 1.524 34.250 1.00 11.03 N ATOM 1633 CA GLN A 111 38.434 2.259 35.494 1.00 11.04 C ATOM 1634 C GLN A 111 38.859 1.348 36.620 1.00 11.14 C ATOM 1635 O GLN A 111 38.347 0.237 36.771 1.00 10.88 O ATOM 1636 CB GLN A 111 37.160 3.005 35.837 1.00 10.95 C ATOM 1637 CG GLN A 111 36.978 4.272 34.971 1.00 11.21 C ATOM 1638 CD GLN A 111 35.868 5.161 35.512 1.00 12.41 C ATOM 1639 OE1 GLN A 111 35.872 5.478 36.694 1.00 11.11 O ATOM 1640 NE2 GLN A 111 34.910 5.535 34.661 1.00 11.71 N ATOM 1641 HA GLN A 111 39.226 2.995 35.356 1.00 0.00 H ATOM 1642 HB2 GLN A 111 36.310 2.343 35.675 1.00 0.00 H ATOM 1643 HB3 GLN A 111 37.195 3.298 36.886 1.00 0.00 H ATOM 1644 HG2 GLN A 111 37.912 4.834 34.965 1.00 0.00 H ATOM 1645 HG3 GLN A 111 36.729 3.973 33.953 1.00 0.00 H ATOM 1646 HE22 GLN A 111 34.954 5.238 33.665 1.00 0.00 H ATOM 1647 HE21 GLN A 111 34.120 6.123 34.994 1.00 0.00 H ATOM 1648 H GLN A 111 37.336 1.372 33.845 1.00 0.00 H ATOM 1649 N PHE A 112 39.783 1.853 37.426 1.00 10.55 N ATOM 1650 CA PHE A 112 40.353 1.107 38.526 1.00 10.65 C ATOM 1651 C PHE A 112 40.527 2.053 39.689 1.00 10.55 C ATOM 1652 O PHE A 112 40.458 3.274 39.519 1.00 9.88 O ATOM 1653 CB PHE A 112 41.749 0.601 38.108 1.00 10.95 C ATOM 1654 CG PHE A 112 42.705 1.715 37.816 1.00 12.40 C ATOM 1655 CD1 PHE A 112 42.720 2.317 36.579 1.00 16.08 C ATOM 1656 CD2 PHE A 112 43.520 2.220 38.790 1.00 13.72 C ATOM 1657 CE1 PHE A 112 43.539 3.389 36.318 1.00 14.47 C ATOM 1658 CE2 PHE A 112 44.346 3.299 38.529 1.00 15.98 C ATOM 1659 CZ PHE A 112 44.348 3.884 37.299 1.00 15.73 C ATOM 1660 HA PHE A 112 39.709 0.269 38.794 1.00 0.00 H ATOM 1661 HB2 PHE A 112 42.157 -0.006 38.917 1.00 0.00 H ATOM 1662 HB3 PHE A 112 41.644 -0.012 37.213 1.00 0.00 H ATOM 1663 HD2 PHE A 112 43.519 1.768 39.782 1.00 0.00 H ATOM 1664 HE2 PHE A 112 44.999 3.683 39.313 1.00 0.00 H ATOM 1665 HZ PHE A 112 44.991 4.741 37.100 1.00 0.00 H ATOM 1666 HE1 PHE A 112 43.542 3.844 35.327 1.00 0.00 H ATOM 1667 HD1 PHE A 112 42.070 1.936 35.791 1.00 0.00 H ATOM 1668 H PHE A 112 40.111 2.826 37.260 1.00 0.00 H ATOM 1669 N PHE A 113 40.770 1.493 40.872 1.00 11.57 N ATOM 1670 CA PHE A 113 41.210 2.295 42.019 1.00 11.37 C ATOM 1671 C PHE A 113 42.359 1.657 42.803 1.00 12.04 C ATOM 1672 O PHE A 113 42.517 0.410 42.817 1.00 12.03 O ATOM 1673 CB PHE A 113 40.059 2.636 42.967 1.00 11.11 C ATOM 1674 CG PHE A 113 39.304 1.454 43.491 1.00 10.83 C ATOM 1675 CD1 PHE A 113 38.448 0.743 42.678 1.00 12.03 C ATOM 1676 CD2 PHE A 113 39.429 1.072 44.828 1.00 12.52 C ATOM 1677 CE1 PHE A 113 37.718 -0.342 43.192 1.00 13.66 C ATOM 1678 CE2 PHE A 113 38.704 -0.007 45.343 1.00 13.12 C ATOM 1679 CZ PHE A 113 37.838 -0.696 44.539 1.00 11.73 C ATOM 1680 HA PHE A 113 41.587 3.220 41.582 1.00 0.00 H ATOM 1681 HB2 PHE A 113 40.470 3.180 43.817 1.00 0.00 H ATOM 1682 HB3 PHE A 113 39.358 3.276 42.432 1.00 0.00 H ATOM 1683 HD2 PHE A 113 40.104 1.625 45.482 1.00 0.00 H ATOM 1684 HE2 PHE A 113 38.829 -0.299 46.386 1.00 0.00 H ATOM 1685 HZ PHE A 113 37.246 -1.515 44.946 1.00 0.00 H ATOM 1686 HE1 PHE A 113 37.056 -0.910 42.538 1.00 0.00 H ATOM 1687 HD1 PHE A 113 38.337 1.024 41.631 1.00 0.00 H ATOM 1688 H PHE A 113 40.645 0.467 40.985 1.00 0.00 H ATOM 1689 N ILE A 114 43.183 2.527 43.399 1.00 11.97 N ATOM 1690 CA ILE A 114 44.225 2.130 44.309 1.00 13.38 C ATOM 1691 C ILE A 114 43.779 2.432 45.746 1.00 14.26 C ATOM 1692 O ILE A 114 43.531 3.578 46.109 1.00 14.26 O ATOM 1693 CB ILE A 114 45.547 2.864 44.049 1.00 13.06 C ATOM 1694 CG1 ILE A 114 46.039 2.694 42.623 1.00 14.27 C ATOM 1695 CG2 ILE A 114 46.613 2.335 44.967 1.00 13.29 C ATOM 1696 CD1 ILE A 114 46.888 3.842 42.181 1.00 15.58 C ATOM 1697 HA ILE A 114 44.396 1.064 44.158 1.00 0.00 H ATOM 1698 HB ILE A 114 45.354 3.922 44.228 1.00 0.00 H ATOM 1699 HG12 ILE A 114 46.626 1.778 42.560 1.00 0.00 H ATOM 1700 HG13 ILE A 114 45.177 2.618 41.960 1.00 0.00 H ATOM 1701 HD11 ILE A 114 46.307 4.763 42.233 1.00 0.00 H ATOM 1702 HD12 ILE A 114 47.757 3.922 42.834 1.00 0.00 H ATOM 1703 HD13 ILE A 114 47.216 3.676 41.155 1.00 0.00 H ATOM 1704 HG21 ILE A 114 46.310 2.493 46.002 1.00 0.00 H ATOM 1705 HG22 ILE A 114 46.751 1.269 44.786 1.00 0.00 H ATOM 1706 HG23 ILE A 114 47.549 2.861 44.776 1.00 0.00 H ATOM 1707 H ILE A 114 43.065 3.540 43.195 1.00 0.00 H ATOM 1708 N CYS A 115 43.715 1.393 46.560 1.00 16.20 N ATOM 1709 CA CYS A 115 43.367 1.524 47.965 1.00 18.26 C ATOM 1710 C CYS A 115 44.467 2.084 48.796 1.00 19.70 C ATOM 1711 O CYS A 115 45.625 1.663 48.665 1.00 19.59 O ATOM 1712 CB CYS A 115 43.112 0.158 48.536 1.00 19.22 C ATOM 1713 SG CYS A 115 41.481 -0.401 48.077 1.00 20.96 S ATOM 1714 HA CYS A 115 42.504 2.189 47.995 1.00 0.00 H ATOM 1715 HB2 CYS A 115 43.187 0.201 49.623 1.00 0.00 H ATOM 1716 HB3 CYS A 115 43.855 -0.540 48.149 1.00 0.00 H ATOM 1717 HG CYS A 115 40.539 0.480 48.568 1.00 0.00 H ATOM 1718 H CYS A 115 43.921 0.447 46.181 1.00 0.00 H ATOM 1719 N THR A 116 44.133 3.014 49.679 1.00 20.55 N ATOM 1720 CA THR A 116 45.152 3.501 50.569 1.00 22.23 C ATOM 1721 C THR A 116 44.876 3.028 51.995 1.00 23.57 C ATOM 1722 O THR A 116 45.472 3.540 52.925 1.00 24.84 O ATOM 1723 CB THR A 116 45.325 5.020 50.481 1.00 22.24 C ATOM 1724 OG1 THR A 116 44.070 5.693 50.663 1.00 22.80 O ATOM 1725 CG2 THR A 116 45.754 5.421 49.070 1.00 22.91 C ATOM 1726 HA THR A 116 46.106 3.079 50.253 1.00 0.00 H ATOM 1727 HB THR A 116 46.055 5.289 51.244 1.00 0.00 H ATOM 1728 HG1 THR A 116 44.209 6.671 50.602 1.00 0.00 H ATOM 1729 HG23 THR A 116 46.710 4.953 48.836 1.00 0.00 H ATOM 1730 HG21 THR A 116 45.001 5.090 48.355 1.00 0.00 H ATOM 1731 HG22 THR A 116 45.856 6.505 49.017 1.00 0.00 H ATOM 1732 H THR A 116 43.161 3.381 49.727 1.00 0.00 H ATOM 1733 N ALA A 117 44.000 2.037 52.158 1.00 24.36 N ATOM 1734 CA ALA A 117 43.693 1.485 53.484 1.00 24.98 C ATOM 1735 C ALA A 117 43.054 0.131 53.336 1.00 25.29 C ATOM 1736 O ALA A 117 42.693 -0.276 52.241 1.00 25.88 O ATOM 1737 CB ALA A 117 42.761 2.408 54.253 1.00 25.24 C ATOM 1738 HA ALA A 117 44.625 1.392 54.041 1.00 0.00 H ATOM 1739 HB1 ALA A 117 43.237 3.380 54.379 1.00 0.00 H ATOM 1740 HB2 ALA A 117 41.830 2.527 53.698 1.00 0.00 H ATOM 1741 HB3 ALA A 117 42.550 1.976 55.231 1.00 0.00 H ATOM 1742 H ALA A 117 43.520 1.644 51.323 1.00 0.00 H ATOM 1743 N LYS A 118 42.897 -0.587 54.437 1.00 25.40 N ATOM 1744 CA LYS A 118 42.183 -1.840 54.375 1.00 25.56 C ATOM 1745 C LYS A 118 40.719 -1.470 54.496 1.00 24.84 C ATOM 1746 O LYS A 118 40.353 -0.772 55.425 1.00 24.45 O ATOM 1747 CB LYS A 118 42.585 -2.759 55.528 1.00 26.36 C ATOM 1748 CG LYS A 118 41.729 -4.017 55.637 1.00 28.86 C ATOM 1749 CD LYS A 118 42.407 -5.053 56.546 1.00 33.43 C ATOM 1750 CE LYS A 118 41.444 -6.112 57.071 1.00 34.46 C ATOM 1751 NZ LYS A 118 40.886 -5.810 58.427 1.00 38.19 N ATOM 1752 HA LYS A 118 42.403 -2.377 53.452 1.00 0.00 H ATOM 1753 HB2 LYS A 118 43.623 -3.060 55.383 1.00 0.00 H ATOM 1754 HB3 LYS A 118 42.497 -2.201 56.460 1.00 0.00 H ATOM 1755 HG2 LYS A 118 40.757 -3.755 56.055 1.00 0.00 H ATOM 1756 HG3 LYS A 118 41.593 -4.445 54.644 1.00 0.00 H ATOM 1757 HD2 LYS A 118 43.194 -5.550 55.979 1.00 0.00 H ATOM 1758 HD3 LYS A 118 42.848 -4.533 57.396 1.00 0.00 H ATOM 1759 HE2 LYS A 118 41.975 -7.063 57.123 1.00 0.00 H ATOM 1760 HE3 LYS A 118 40.614 -6.198 56.370 1.00 0.00 H ATOM 1761 HZ1 LYS A 118 41.665 -5.736 59.112 1.00 0.00 H ATOM 1762 HZ2 LYS A 118 40.365 -4.910 58.394 1.00 0.00 H ATOM 1763 HZ3 LYS A 118 40.242 -6.575 58.714 1.00 0.00 H ATOM 1764 H LYS A 118 43.286 -0.250 55.341 1.00 0.00 H ATOM 1765 N THR A 119 39.893 -1.906 53.559 1.00 24.31 N ATOM 1766 CA THR A 119 38.464 -1.648 53.622 1.00 24.10 C ATOM 1767 C THR A 119 37.670 -2.917 53.327 1.00 23.55 C ATOM 1768 O THR A 119 37.375 -3.269 52.173 1.00 23.09 O ATOM 1769 CB THR A 119 38.066 -0.562 52.650 1.00 24.50 C ATOM 1770 OG1 THR A 119 38.830 0.616 52.905 1.00 25.99 O ATOM 1771 CG2 THR A 119 36.587 -0.162 52.890 1.00 26.05 C ATOM 1772 HA THR A 119 38.235 -1.314 54.634 1.00 0.00 H ATOM 1773 HB THR A 119 38.226 -0.939 51.640 1.00 0.00 H ATOM 1774 HG1 THR A 119 38.660 0.925 53.830 1.00 0.00 H ATOM 1775 HG23 THR A 119 35.945 -1.024 52.711 1.00 0.00 H ATOM 1776 HG21 THR A 119 36.466 0.175 53.919 1.00 0.00 H ATOM 1777 HG22 THR A 119 36.315 0.643 52.208 1.00 0.00 H ATOM 1778 H THR A 119 40.276 -2.447 52.757 1.00 0.00 H ATOM 1779 N GLU A 120 37.305 -3.589 54.401 1.00 22.41 N ATOM 1780 CA GLU A 120 36.567 -4.823 54.338 1.00 22.30 C ATOM 1781 C GLU A 120 35.274 -4.770 53.549 1.00 19.55 C ATOM 1782 O GLU A 120 34.928 -5.766 52.907 1.00 17.74 O ATOM 1783 CB GLU A 120 36.224 -5.296 55.767 1.00 23.15 C ATOM 1784 CG GLU A 120 37.452 -5.488 56.648 1.00 29.89 C ATOM 1785 CD GLU A 120 37.117 -6.004 58.034 1.00 37.36 C ATOM 1786 OE1 GLU A 120 35.919 -6.176 58.333 1.00 42.43 O ATOM 1787 OE2 GLU A 120 38.059 -6.188 58.832 1.00 41.79 O ATOM 1788 HA GLU A 120 37.228 -5.511 53.811 1.00 0.00 H ATOM 1789 HB2 GLU A 120 35.577 -4.552 56.232 1.00 0.00 H ATOM 1790 HB3 GLU A 120 35.694 -6.246 55.700 1.00 0.00 H ATOM 1791 HG2 GLU A 120 38.118 -6.202 56.164 1.00 0.00 H ATOM 1792 HG3 GLU A 120 37.960 -4.529 56.748 1.00 0.00 H ATOM 1793 H GLU A 120 37.562 -3.211 55.335 1.00 0.00 H ATOM 1794 N TRP A 121 34.530 -3.664 53.643 1.00 17.81 N ATOM 1795 CA TRP A 121 33.233 -3.605 52.971 1.00 16.89 C ATOM 1796 C TRP A 121 33.312 -3.637 51.447 1.00 16.31 C ATOM 1797 O TRP A 121 32.293 -3.853 50.798 1.00 16.49 O ATOM 1798 CB TRP A 121 32.347 -2.449 53.473 1.00 17.27 C ATOM 1799 CG TRP A 121 32.877 -1.072 53.291 1.00 15.77 C ATOM 1800 CD1 TRP A 121 33.496 -0.310 54.223 1.00 16.19 C ATOM 1801 CD2 TRP A 121 32.802 -0.288 52.111 1.00 16.12 C ATOM 1802 NE1 TRP A 121 33.825 0.910 53.689 1.00 16.66 N ATOM 1803 CE2 TRP A 121 33.399 0.939 52.385 1.00 16.30 C ATOM 1804 CE3 TRP A 121 32.286 -0.508 50.830 1.00 18.18 C ATOM 1805 CZ2 TRP A 121 33.512 1.930 51.441 1.00 15.94 C ATOM 1806 CZ3 TRP A 121 32.401 0.477 49.901 1.00 18.09 C ATOM 1807 CH2 TRP A 121 33.019 1.678 50.206 1.00 18.24 C ATOM 1808 HA TRP A 121 32.742 -4.535 53.258 1.00 0.00 H ATOM 1809 HB2 TRP A 121 31.395 -2.509 52.945 1.00 0.00 H ATOM 1810 HB3 TRP A 121 32.180 -2.600 54.539 1.00 0.00 H ATOM 1811 HE1 TRP A 121 34.314 1.681 54.187 1.00 0.00 H ATOM 1812 HD1 TRP A 121 33.703 -0.620 55.247 1.00 0.00 H ATOM 1813 HZ2 TRP A 121 33.982 2.885 51.678 1.00 0.00 H ATOM 1814 HH2 TRP A 121 33.111 2.440 49.432 1.00 0.00 H ATOM 1815 HZ3 TRP A 121 32.000 0.319 48.900 1.00 0.00 H ATOM 1816 HE3 TRP A 121 31.801 -1.452 50.581 1.00 0.00 H ATOM 1817 H TRP A 121 34.872 -2.849 54.191 1.00 0.00 H ATOM 1818 N LEU A 122 34.508 -3.469 50.868 1.00 15.85 N ATOM 1819 CA LEU A 122 34.663 -3.498 49.389 1.00 15.57 C ATOM 1820 C LEU A 122 34.664 -4.924 48.855 1.00 15.21 C ATOM 1821 O LEU A 122 34.319 -5.182 47.702 1.00 13.91 O ATOM 1822 CB LEU A 122 35.963 -2.814 48.955 1.00 15.79 C ATOM 1823 CG LEU A 122 35.929 -1.279 48.967 1.00 15.79 C ATOM 1824 CD1 LEU A 122 37.302 -0.681 48.752 1.00 15.05 C ATOM 1825 CD2 LEU A 122 35.000 -0.781 47.911 1.00 18.01 C ATOM 1826 HA LEU A 122 33.810 -2.959 48.976 1.00 0.00 H ATOM 1827 HB2 LEU A 122 36.757 -3.139 49.628 1.00 0.00 H ATOM 1828 HB3 LEU A 122 36.193 -3.139 47.940 1.00 0.00 H ATOM 1829 HG LEU A 122 35.577 -0.969 49.951 1.00 0.00 H ATOM 1830 HD21 LEU A 122 35.343 -1.125 46.935 1.00 0.00 H ATOM 1831 HD22 LEU A 122 33.997 -1.164 48.101 1.00 0.00 H ATOM 1832 HD23 LEU A 122 34.983 0.309 47.928 1.00 0.00 H ATOM 1833 HD11 LEU A 122 37.970 -1.014 49.546 1.00 0.00 H ATOM 1834 HD12 LEU A 122 37.692 -1.006 47.787 1.00 0.00 H ATOM 1835 HD13 LEU A 122 37.230 0.406 48.768 1.00 0.00 H ATOM 1836 H LEU A 122 35.346 -3.315 51.465 1.00 0.00 H ATOM 1837 N ASP A 123 35.011 -5.851 49.736 1.00 15.05 N ATOM 1838 CA ASP A 123 35.155 -7.245 49.349 1.00 15.65 C ATOM 1839 C ASP A 123 33.891 -7.784 48.757 1.00 15.66 C ATOM 1840 O ASP A 123 32.811 -7.497 49.252 1.00 16.16 O ATOM 1841 CB ASP A 123 35.592 -8.067 50.545 1.00 15.42 C ATOM 1842 CG ASP A 123 37.011 -7.789 50.930 1.00 17.50 C ATOM 1843 OD1 ASP A 123 37.404 -8.174 52.052 1.00 18.38 O ATOM 1844 OD2 ASP A 123 37.817 -7.197 50.158 1.00 16.78 O ATOM 1845 HA ASP A 123 35.922 -7.311 48.577 1.00 0.00 H ATOM 1846 HB2 ASP A 123 34.945 -7.830 51.390 1.00 0.00 H ATOM 1847 HB3 ASP A 123 35.495 -9.125 50.300 1.00 0.00 H ATOM 1848 H ASP A 123 35.184 -5.576 50.724 1.00 0.00 H ATOM 1849 N GLY A 124 34.030 -8.522 47.655 1.00 15.82 N ATOM 1850 CA GLY A 124 32.891 -9.109 46.967 1.00 15.46 C ATOM 1851 C GLY A 124 32.182 -8.095 46.102 1.00 15.78 C ATOM 1852 O GLY A 124 31.232 -8.425 45.383 1.00 16.19 O ATOM 1853 HA3 GLY A 124 32.190 -9.495 47.707 1.00 0.00 H ATOM 1854 HA2 GLY A 124 33.241 -9.928 46.338 1.00 0.00 H ATOM 1855 H GLY A 124 34.985 -8.683 47.275 1.00 0.00 H ATOM 1856 N LYS A 125 32.602 -6.847 46.185 1.00 15.02 N ATOM 1857 CA LYS A 125 31.962 -5.799 45.393 1.00 15.11 C ATOM 1858 C LYS A 125 32.794 -5.358 44.179 1.00 14.47 C ATOM 1859 O LYS A 125 32.259 -4.726 43.262 1.00 14.59 O ATOM 1860 CB LYS A 125 31.676 -4.580 46.261 1.00 15.48 C ATOM 1861 CG LYS A 125 30.599 -4.812 47.362 1.00 15.46 C ATOM 1862 CD LYS A 125 30.339 -3.523 48.123 1.00 15.56 C ATOM 1863 CE LYS A 125 29.306 -3.708 49.252 1.00 14.37 C ATOM 1864 NZ LYS A 125 29.643 -4.816 50.210 1.00 12.55 N ATOM 1865 HA LYS A 125 31.035 -6.232 45.017 1.00 0.00 H ATOM 1866 HB2 LYS A 125 32.604 -4.283 46.749 1.00 0.00 H ATOM 1867 HB3 LYS A 125 31.333 -3.773 45.613 1.00 0.00 H ATOM 1868 HG2 LYS A 125 29.673 -5.148 46.895 1.00 0.00 H ATOM 1869 HG3 LYS A 125 30.952 -5.575 48.056 1.00 0.00 H ATOM 1870 HD2 LYS A 125 31.277 -3.178 48.559 1.00 0.00 H ATOM 1871 HD3 LYS A 125 29.966 -2.773 47.426 1.00 0.00 H ATOM 1872 HE2 LYS A 125 28.339 -3.927 48.800 1.00 0.00 H ATOM 1873 HE3 LYS A 125 29.240 -2.776 49.814 1.00 0.00 H ATOM 1874 HZ1 LYS A 125 29.698 -5.716 49.692 1.00 0.00 H ATOM 1875 HZ2 LYS A 125 30.559 -4.617 50.660 1.00 0.00 H ATOM 1876 HZ3 LYS A 125 28.904 -4.879 50.939 1.00 0.00 H ATOM 1877 H LYS A 125 33.392 -6.608 46.817 1.00 0.00 H ATOM 1878 N HIS A 126 34.087 -5.668 44.205 1.00 13.35 N ATOM 1879 CA HIS A 126 35.053 -5.254 43.168 1.00 13.32 C ATOM 1880 C HIS A 126 36.078 -6.353 43.002 1.00 12.57 C ATOM 1881 O HIS A 126 36.368 -7.030 43.965 1.00 12.28 O ATOM 1882 CB HIS A 126 35.775 -3.987 43.606 1.00 13.16 C ATOM 1883 CG HIS A 126 34.857 -2.818 43.745 1.00 14.71 C ATOM 1884 ND1 HIS A 126 34.476 -2.050 42.666 1.00 12.41 N ATOM 1885 CD2 HIS A 126 34.168 -2.344 44.817 1.00 16.28 C ATOM 1886 CE1 HIS A 126 33.599 -1.142 43.070 1.00 16.34 C ATOM 1887 NE2 HIS A 126 33.403 -1.289 44.372 1.00 15.77 N ATOM 1888 HA HIS A 126 34.524 -5.068 42.233 1.00 0.00 H ATOM 1889 HB2 HIS A 126 36.252 -4.172 44.568 1.00 0.00 H ATOM 1890 HB3 HIS A 126 36.537 -3.746 42.865 1.00 0.00 H ATOM 1891 HD2 HIS A 126 34.213 -2.727 45.837 1.00 0.00 H ATOM 1892 HE1 HIS A 126 33.118 -0.397 42.436 1.00 0.00 H ATOM 1893 H HIS A 126 34.438 -6.235 45.003 1.00 0.00 H ATOM 1894 N VAL A 127 36.629 -6.525 41.798 1.00 12.25 N ATOM 1895 CA VAL A 127 37.663 -7.530 41.569 1.00 11.58 C ATOM 1896 C VAL A 127 39.039 -6.964 41.784 1.00 11.66 C ATOM 1897 O VAL A 127 39.475 -6.060 41.071 1.00 12.83 O ATOM 1898 CB VAL A 127 37.592 -8.083 40.136 1.00 11.20 C ATOM 1899 CG1 VAL A 127 38.744 -9.014 39.868 1.00 11.23 C ATOM 1900 CG2 VAL A 127 36.308 -8.812 39.918 1.00 12.89 C ATOM 1901 HA VAL A 127 37.480 -8.330 42.286 1.00 0.00 H ATOM 1902 HB VAL A 127 37.647 -7.238 39.449 1.00 0.00 H ATOM 1903 HG11 VAL A 127 39.683 -8.474 39.992 1.00 0.00 H ATOM 1904 HG12 VAL A 127 38.707 -9.847 40.570 1.00 0.00 H ATOM 1905 HG13 VAL A 127 38.673 -9.393 38.849 1.00 0.00 H ATOM 1906 HG21 VAL A 127 36.239 -9.642 40.621 1.00 0.00 H ATOM 1907 HG22 VAL A 127 35.473 -8.130 40.076 1.00 0.00 H ATOM 1908 HG23 VAL A 127 36.278 -9.195 38.898 1.00 0.00 H ATOM 1909 H VAL A 127 36.315 -5.930 41.005 1.00 0.00 H ATOM 1910 N VAL A 128 39.757 -7.545 42.733 1.00 12.00 N ATOM 1911 CA VAL A 128 41.109 -7.159 43.072 1.00 11.83 C ATOM 1912 C VAL A 128 42.051 -7.899 42.119 1.00 12.22 C ATOM 1913 O VAL A 128 41.864 -9.096 41.902 1.00 12.40 O ATOM 1914 CB VAL A 128 41.386 -7.521 44.538 1.00 10.98 C ATOM 1915 CG1 VAL A 128 42.857 -7.312 44.926 1.00 11.23 C ATOM 1916 CG2 VAL A 128 40.507 -6.707 45.458 1.00 12.58 C ATOM 1917 HA VAL A 128 41.260 -6.085 42.965 1.00 0.00 H ATOM 1918 HB VAL A 128 41.158 -8.581 44.646 1.00 0.00 H ATOM 1919 HG11 VAL A 128 43.490 -7.940 44.299 1.00 0.00 H ATOM 1920 HG12 VAL A 128 43.124 -6.265 44.781 1.00 0.00 H ATOM 1921 HG13 VAL A 128 42.997 -7.583 45.972 1.00 0.00 H ATOM 1922 HG21 VAL A 128 40.711 -5.647 45.309 1.00 0.00 H ATOM 1923 HG22 VAL A 128 39.460 -6.912 45.233 1.00 0.00 H ATOM 1924 HG23 VAL A 128 40.717 -6.977 46.493 1.00 0.00 H ATOM 1925 H VAL A 128 39.323 -8.325 43.266 1.00 0.00 H ATOM 1926 N PHE A 129 43.067 -7.220 41.572 1.00 13.00 N ATOM 1927 CA PHE A 129 43.929 -7.845 40.551 1.00 13.69 C ATOM 1928 C PHE A 129 45.414 -7.444 40.608 1.00 14.38 C ATOM 1929 O PHE A 129 46.231 -7.830 39.749 1.00 14.63 O ATOM 1930 CB PHE A 129 43.339 -7.545 39.164 1.00 13.76 C ATOM 1931 CG PHE A 129 43.408 -6.091 38.781 1.00 14.43 C ATOM 1932 CD1 PHE A 129 44.469 -5.597 38.056 1.00 14.74 C ATOM 1933 CD2 PHE A 129 42.404 -5.225 39.151 1.00 13.04 C ATOM 1934 CE1 PHE A 129 44.515 -4.255 37.698 1.00 15.72 C ATOM 1935 CE2 PHE A 129 42.463 -3.891 38.834 1.00 15.52 C ATOM 1936 CZ PHE A 129 43.518 -3.397 38.103 1.00 15.05 C ATOM 1937 HA PHE A 129 43.933 -8.914 40.762 1.00 0.00 H ATOM 1938 HB2 PHE A 129 43.890 -8.123 38.422 1.00 0.00 H ATOM 1939 HB3 PHE A 129 42.294 -7.853 39.160 1.00 0.00 H ATOM 1940 HD2 PHE A 129 41.547 -5.606 39.706 1.00 0.00 H ATOM 1941 HE2 PHE A 129 41.670 -3.220 39.163 1.00 0.00 H ATOM 1942 HZ PHE A 129 43.564 -2.338 37.847 1.00 0.00 H ATOM 1943 HE1 PHE A 129 45.343 -3.881 37.095 1.00 0.00 H ATOM 1944 HD1 PHE A 129 45.279 -6.264 37.761 1.00 0.00 H ATOM 1945 H PHE A 129 43.251 -6.241 41.870 1.00 0.00 H ATOM 1946 N GLY A 130 45.787 -6.683 41.627 1.00 14.74 N ATOM 1947 CA GLY A 130 47.171 -6.291 41.785 1.00 15.32 C ATOM 1948 C GLY A 130 47.485 -5.492 43.033 1.00 15.78 C ATOM 1949 O GLY A 130 46.634 -5.233 43.871 1.00 15.52 O ATOM 1950 HA3 GLY A 130 47.450 -5.688 40.921 1.00 0.00 H ATOM 1951 HA2 GLY A 130 47.777 -7.197 41.805 1.00 0.00 H ATOM 1952 H GLY A 130 45.079 -6.365 42.319 1.00 0.00 H ATOM 1953 N LYS A 131 48.738 -5.089 43.143 1.00 16.84 N ATOM 1954 CA LYS A 131 49.157 -4.254 44.234 1.00 18.35 C ATOM 1955 C LYS A 131 50.365 -3.411 43.878 1.00 18.56 C ATOM 1956 O LYS A 131 51.185 -3.778 43.014 1.00 18.37 O ATOM 1957 CB LYS A 131 49.511 -5.084 45.457 1.00 18.84 C ATOM 1958 CG LYS A 131 50.820 -5.716 45.372 1.00 23.11 C ATOM 1959 CD LYS A 131 51.177 -6.365 46.690 1.00 28.81 C ATOM 1960 CE LYS A 131 52.676 -6.733 46.738 1.00 33.32 C ATOM 1961 NZ LYS A 131 52.994 -8.005 45.997 1.00 35.91 N ATOM 1962 HA LYS A 131 48.312 -3.600 44.451 1.00 0.00 H ATOM 1963 HB2 LYS A 131 49.498 -4.433 46.331 1.00 0.00 H ATOM 1964 HB3 LYS A 131 48.758 -5.864 45.575 1.00 0.00 H ATOM 1965 HG2 LYS A 131 50.803 -6.475 44.590 1.00 0.00 H ATOM 1966 HG3 LYS A 131 51.568 -4.962 45.128 1.00 0.00 H ATOM 1967 HD2 LYS A 131 50.954 -5.672 47.501 1.00 0.00 H ATOM 1968 HD3 LYS A 131 50.583 -7.271 46.814 1.00 0.00 H ATOM 1969 HE2 LYS A 131 52.971 -6.855 47.780 1.00 0.00 H ATOM 1970 HE3 LYS A 131 53.248 -5.919 46.293 1.00 0.00 H ATOM 1971 HZ1 LYS A 131 52.461 -8.793 46.418 1.00 0.00 H ATOM 1972 HZ2 LYS A 131 52.726 -7.899 44.998 1.00 0.00 H ATOM 1973 HZ3 LYS A 131 54.014 -8.199 46.065 1.00 0.00 H ATOM 1974 H LYS A 131 49.433 -5.381 42.427 1.00 0.00 H ATOM 1975 N VAL A 132 50.473 -2.287 44.575 1.00 18.32 N ATOM 1976 CA VAL A 132 51.603 -1.411 44.420 1.00 19.03 C ATOM 1977 C VAL A 132 52.831 -2.167 44.871 1.00 20.38 C ATOM 1978 O VAL A 132 52.863 -2.761 45.946 1.00 19.84 O ATOM 1979 CB VAL A 132 51.443 -0.123 45.259 1.00 19.30 C ATOM 1980 CG1 VAL A 132 52.792 0.619 45.390 1.00 18.95 C ATOM 1981 CG2 VAL A 132 50.349 0.770 44.638 1.00 18.80 C ATOM 1982 HA VAL A 132 51.687 -1.107 43.376 1.00 0.00 H ATOM 1983 HB VAL A 132 51.129 -0.388 46.269 1.00 0.00 H ATOM 1984 HG11 VAL A 132 53.517 -0.031 45.879 1.00 0.00 H ATOM 1985 HG12 VAL A 132 53.155 0.888 44.398 1.00 0.00 H ATOM 1986 HG13 VAL A 132 52.652 1.522 45.985 1.00 0.00 H ATOM 1987 HG21 VAL A 132 50.633 1.035 43.619 1.00 0.00 H ATOM 1988 HG22 VAL A 132 49.404 0.228 44.624 1.00 0.00 H ATOM 1989 HG23 VAL A 132 50.240 1.677 45.233 1.00 0.00 H ATOM 1990 H VAL A 132 49.723 -2.034 45.249 1.00 0.00 H ATOM 1991 N LYS A 133 53.850 -2.127 44.037 1.00 21.97 N ATOM 1992 CA LYS A 133 55.087 -2.810 44.306 1.00 24.15 C ATOM 1993 C LYS A 133 56.077 -1.779 44.839 1.00 24.22 C ATOM 1994 O LYS A 133 56.673 -1.980 45.867 1.00 23.89 O ATOM 1995 CB LYS A 133 55.579 -3.443 43.010 1.00 25.31 C ATOM 1996 CG LYS A 133 56.558 -4.563 43.183 1.00 29.11 C ATOM 1997 CD LYS A 133 57.275 -4.823 41.862 1.00 34.21 C ATOM 1998 CE LYS A 133 58.450 -5.744 42.052 1.00 38.12 C ATOM 1999 NZ LYS A 133 58.789 -6.419 40.771 1.00 40.49 N ATOM 2000 HA LYS A 133 54.967 -3.601 45.046 1.00 0.00 H ATOM 2001 HB2 LYS A 133 54.713 -3.831 42.473 1.00 0.00 H ATOM 2002 HB3 LYS A 133 56.057 -2.665 42.414 1.00 0.00 H ATOM 2003 HG2 LYS A 133 57.288 -4.293 43.946 1.00 0.00 H ATOM 2004 HG3 LYS A 133 56.028 -5.464 43.492 1.00 0.00 H ATOM 2005 HD2 LYS A 133 56.575 -5.279 41.161 1.00 0.00 H ATOM 2006 HD3 LYS A 133 57.628 -3.875 41.456 1.00 0.00 H ATOM 2007 HE2 LYS A 133 58.200 -6.496 42.800 1.00 0.00 H ATOM 2008 HE3 LYS A 133 59.309 -5.166 42.393 1.00 0.00 H ATOM 2009 HZ1 LYS A 133 57.971 -6.973 40.446 1.00 0.00 H ATOM 2010 HZ2 LYS A 133 59.030 -5.703 40.056 1.00 0.00 H ATOM 2011 HZ3 LYS A 133 59.602 -7.051 40.918 1.00 0.00 H ATOM 2012 H LYS A 133 53.757 -1.584 43.155 1.00 0.00 H ATOM 2013 N GLU A 134 56.217 -0.660 44.139 1.00 25.10 N ATOM 2014 CA GLU A 134 57.053 0.435 44.597 1.00 26.29 C ATOM 2015 C GLU A 134 56.394 1.767 44.284 1.00 25.52 C ATOM 2016 O GLU A 134 55.654 1.882 43.314 1.00 25.09 O ATOM 2017 CB GLU A 134 58.427 0.364 43.916 1.00 27.51 C ATOM 2018 CG GLU A 134 59.182 -0.912 44.248 1.00 32.58 C ATOM 2019 CD GLU A 134 60.551 -0.960 43.591 1.00 39.28 C ATOM 2020 OE1 GLU A 134 60.918 0.020 42.887 1.00 43.15 O ATOM 2021 OE2 GLU A 134 61.253 -1.981 43.780 1.00 44.61 O ATOM 2022 HA GLU A 134 57.181 0.349 45.676 1.00 0.00 H ATOM 2023 HB2 GLU A 134 58.284 0.414 42.837 1.00 0.00 H ATOM 2024 HB3 GLU A 134 59.023 1.217 44.242 1.00 0.00 H ATOM 2025 HG2 GLU A 134 59.309 -0.973 45.329 1.00 0.00 H ATOM 2026 HG3 GLU A 134 58.598 -1.765 43.903 1.00 0.00 H ATOM 2027 H GLU A 134 55.712 -0.565 43.235 1.00 0.00 H ATOM 2028 N GLY A 135 56.692 2.788 45.076 1.00 25.17 N ATOM 2029 CA GLY A 135 56.139 4.111 44.843 1.00 25.10 C ATOM 2030 C GLY A 135 54.887 4.428 45.667 1.00 25.51 C ATOM 2031 O GLY A 135 54.058 5.277 45.306 1.00 24.33 O ATOM 2032 HA3 GLY A 135 55.882 4.192 43.787 1.00 0.00 H ATOM 2033 HA2 GLY A 135 56.904 4.848 45.087 1.00 0.00 H ATOM 2034 H GLY A 135 57.334 2.639 45.880 1.00 0.00 H ATOM 2035 N MET A 136 54.744 3.740 46.791 1.00 25.77 N ATOM 2036 CA MET A 136 53.660 4.011 47.715 1.00 26.65 C ATOM 2037 C MET A 136 53.750 5.481 48.192 1.00 26.63 C ATOM 2038 O MET A 136 52.718 6.105 48.468 1.00 26.96 O ATOM 2039 CB MET A 136 53.742 3.022 48.881 1.00 27.29 C ATOM 2040 CG MET A 136 52.412 2.673 49.538 1.00 30.88 C ATOM 2041 SD MET A 136 51.020 2.276 48.418 1.00 34.90 S ATOM 2042 CE MET A 136 49.730 3.134 49.307 1.00 33.95 C ATOM 2043 HA MET A 136 52.693 3.880 47.229 1.00 0.00 H ATOM 2044 HB2 MET A 136 54.186 2.099 48.508 1.00 0.00 H ATOM 2045 HB3 MET A 136 54.391 3.454 49.643 1.00 0.00 H ATOM 2046 HG2 MET A 136 52.112 3.524 50.149 1.00 0.00 H ATOM 2047 HG3 MET A 136 52.577 1.807 50.179 1.00 0.00 H ATOM 2048 HE1 MET A 136 49.643 2.718 50.311 1.00 0.00 H ATOM 2049 HE2 MET A 136 49.978 4.193 49.372 1.00 0.00 H ATOM 2050 HE3 MET A 136 48.784 3.013 48.779 1.00 0.00 H ATOM 2051 H MET A 136 55.426 2.988 47.016 1.00 0.00 H ATOM 2052 N ASN A 137 54.971 6.039 48.251 1.00 25.75 N ATOM 2053 CA ASN A 137 55.182 7.434 48.668 1.00 25.67 C ATOM 2054 C ASN A 137 54.555 8.363 47.659 1.00 24.30 C ATOM 2055 O ASN A 137 54.071 9.446 48.004 1.00 24.39 O ATOM 2056 CB ASN A 137 56.685 7.782 48.788 1.00 25.82 C ATOM 2057 CG ASN A 137 57.418 7.648 47.456 1.00 27.33 C ATOM 2058 OD1 ASN A 137 57.241 6.654 46.754 1.00 31.44 O ATOM 2059 ND2 ASN A 137 58.218 8.649 47.094 1.00 29.43 N ATOM 2060 HA ASN A 137 54.720 7.554 49.648 1.00 0.00 H ATOM 2061 HB2 ASN A 137 56.780 8.809 49.139 1.00 0.00 H ATOM 2062 HB3 ASN A 137 57.145 7.108 49.511 1.00 0.00 H ATOM 2063 HD22 ASN A 137 58.338 9.471 47.720 1.00 0.00 H ATOM 2064 HD21 ASN A 137 58.723 8.609 46.186 1.00 0.00 H ATOM 2065 H ASN A 137 55.798 5.463 47.992 1.00 0.00 H ATOM 2066 N ILE A 138 54.545 7.925 46.403 1.00 23.08 N ATOM 2067 CA ILE A 138 53.963 8.722 45.320 1.00 21.93 C ATOM 2068 C ILE A 138 52.425 8.717 45.438 1.00 20.28 C ATOM 2069 O ILE A 138 51.763 9.725 45.159 1.00 18.98 O ATOM 2070 CB ILE A 138 54.402 8.204 43.940 1.00 21.86 C ATOM 2071 CG1 ILE A 138 55.927 8.364 43.712 1.00 24.36 C ATOM 2072 CG2 ILE A 138 53.618 8.883 42.848 1.00 23.28 C ATOM 2073 CD1 ILE A 138 56.478 9.795 43.796 1.00 26.24 C ATOM 2074 HA ILE A 138 54.327 9.745 45.414 1.00 0.00 H ATOM 2075 HB ILE A 138 54.189 7.135 43.910 1.00 0.00 H ATOM 2076 HG12 ILE A 138 56.441 7.765 44.464 1.00 0.00 H ATOM 2077 HG13 ILE A 138 56.158 7.976 42.720 1.00 0.00 H ATOM 2078 HD11 ILE A 138 55.994 10.414 43.041 1.00 0.00 H ATOM 2079 HD12 ILE A 138 56.277 10.203 44.787 1.00 0.00 H ATOM 2080 HD13 ILE A 138 57.554 9.780 43.620 1.00 0.00 H ATOM 2081 HG21 ILE A 138 52.556 8.677 42.983 1.00 0.00 H ATOM 2082 HG22 ILE A 138 53.789 9.958 42.894 1.00 0.00 H ATOM 2083 HG23 ILE A 138 53.943 8.503 41.879 1.00 0.00 H ATOM 2084 H ILE A 138 54.959 6.996 46.185 1.00 0.00 H ATOM 2085 N VAL A 139 51.862 7.589 45.837 1.00 19.56 N ATOM 2086 CA VAL A 139 50.420 7.499 45.998 1.00 19.36 C ATOM 2087 C VAL A 139 49.995 8.414 47.153 1.00 20.23 C ATOM 2088 O VAL A 139 48.982 9.079 47.081 1.00 19.97 O ATOM 2089 CB VAL A 139 49.962 6.062 46.274 1.00 20.05 C ATOM 2090 CG1 VAL A 139 48.419 6.029 46.542 1.00 20.33 C ATOM 2091 CG2 VAL A 139 50.308 5.140 45.102 1.00 19.04 C ATOM 2092 HA VAL A 139 49.949 7.814 45.067 1.00 0.00 H ATOM 2093 HB VAL A 139 50.488 5.703 47.159 1.00 0.00 H ATOM 2094 HG11 VAL A 139 48.188 6.650 47.407 1.00 0.00 H ATOM 2095 HG12 VAL A 139 47.891 6.411 45.668 1.00 0.00 H ATOM 2096 HG13 VAL A 139 48.107 5.003 46.736 1.00 0.00 H ATOM 2097 HG21 VAL A 139 49.811 5.498 44.200 1.00 0.00 H ATOM 2098 HG22 VAL A 139 51.387 5.140 44.948 1.00 0.00 H ATOM 2099 HG23 VAL A 139 49.971 4.128 45.326 1.00 0.00 H ATOM 2100 H VAL A 139 52.456 6.759 46.037 1.00 0.00 H ATOM 2101 N GLU A 140 50.800 8.457 48.204 1.00 20.97 N ATOM 2102 CA GLU A 140 50.511 9.292 49.345 1.00 22.65 C ATOM 2103 C GLU A 140 50.526 10.759 48.892 1.00 22.63 C ATOM 2104 O GLU A 140 49.626 11.528 49.231 1.00 22.26 O ATOM 2105 CB GLU A 140 51.484 8.982 50.490 1.00 23.10 C ATOM 2106 CG GLU A 140 51.265 7.585 51.060 1.00 27.41 C ATOM 2107 CD GLU A 140 52.339 7.126 52.047 1.00 33.43 C ATOM 2108 OE1 GLU A 140 51.968 6.582 53.113 1.00 38.09 O ATOM 2109 OE2 GLU A 140 53.548 7.290 51.761 1.00 36.99 O ATOM 2110 HA GLU A 140 49.518 9.086 49.744 1.00 0.00 H ATOM 2111 HB2 GLU A 140 52.505 9.054 50.114 1.00 0.00 H ATOM 2112 HB3 GLU A 140 51.338 9.714 51.285 1.00 0.00 H ATOM 2113 HG2 GLU A 140 50.304 7.574 51.573 1.00 0.00 H ATOM 2114 HG3 GLU A 140 51.241 6.879 50.230 1.00 0.00 H ATOM 2115 H GLU A 140 51.662 7.875 48.207 1.00 0.00 H ATOM 2116 N ALA A 141 51.490 11.128 48.052 1.00 22.28 N ATOM 2117 CA ALA A 141 51.574 12.505 47.562 1.00 21.86 C ATOM 2118 C ALA A 141 50.364 12.910 46.723 1.00 21.71 C ATOM 2119 O ALA A 141 49.926 14.058 46.797 1.00 20.07 O ATOM 2120 CB ALA A 141 52.866 12.733 46.778 1.00 22.21 C ATOM 2121 HA ALA A 141 51.579 13.144 48.445 1.00 0.00 H ATOM 2122 HB1 ALA A 141 53.721 12.540 47.426 1.00 0.00 H ATOM 2123 HB2 ALA A 141 52.896 12.056 45.924 1.00 0.00 H ATOM 2124 HB3 ALA A 141 52.899 13.764 46.427 1.00 0.00 H ATOM 2125 H ALA A 141 52.193 10.429 47.739 1.00 0.00 H ATOM 2126 N MET A 142 49.848 11.988 45.909 1.00 22.01 N ATOM 2127 CA MET A 142 48.659 12.257 45.100 1.00 22.45 C ATOM 2128 C MET A 142 47.472 12.558 46.001 1.00 22.65 C ATOM 2129 O MET A 142 46.617 13.377 45.662 1.00 22.36 O ATOM 2130 CB MET A 142 48.281 11.037 44.243 1.00 22.71 C ATOM 2131 CG MET A 142 49.252 10.679 43.145 1.00 24.68 C ATOM 2132 SD MET A 142 48.952 9.004 42.541 1.00 27.86 S ATOM 2133 CE MET A 142 47.464 9.252 41.738 1.00 27.23 C ATOM 2134 HA MET A 142 48.892 13.107 44.458 1.00 0.00 H ATOM 2135 HB2 MET A 142 48.194 10.176 44.906 1.00 0.00 H ATOM 2136 HB3 MET A 142 47.314 11.239 43.782 1.00 0.00 H ATOM 2137 HG2 MET A 142 50.269 10.742 43.533 1.00 0.00 H ATOM 2138 HG3 MET A 142 49.134 11.382 42.321 1.00 0.00 H ATOM 2139 HE1 MET A 142 46.722 9.608 42.453 1.00 0.00 H ATOM 2140 HE2 MET A 142 47.597 9.993 40.950 1.00 0.00 H ATOM 2141 HE3 MET A 142 47.127 8.312 41.301 1.00 0.00 H ATOM 2142 H MET A 142 50.302 11.054 45.848 1.00 0.00 H ATOM 2143 N GLU A 143 47.413 11.886 47.142 1.00 23.28 N ATOM 2144 CA GLU A 143 46.292 12.059 48.082 1.00 24.88 C ATOM 2145 C GLU A 143 46.139 13.465 48.637 1.00 25.00 C ATOM 2146 O GLU A 143 45.043 13.881 48.990 1.00 25.13 O ATOM 2147 CB GLU A 143 46.465 11.159 49.281 1.00 24.77 C ATOM 2148 CG GLU A 143 46.003 9.752 49.084 1.00 25.97 C ATOM 2149 CD GLU A 143 46.148 8.975 50.364 1.00 28.95 C ATOM 2150 OE1 GLU A 143 45.120 8.563 50.939 1.00 30.58 O ATOM 2151 OE2 GLU A 143 47.304 8.804 50.803 1.00 31.54 O ATOM 2152 HA GLU A 143 45.410 11.818 47.488 1.00 0.00 H ATOM 2153 HB2 GLU A 143 47.524 11.135 49.537 1.00 0.00 H ATOM 2154 HB3 GLU A 143 45.902 11.587 50.110 1.00 0.00 H ATOM 2155 HG2 GLU A 143 44.956 9.755 48.781 1.00 0.00 H ATOM 2156 HG3 GLU A 143 46.604 9.281 48.306 1.00 0.00 H ATOM 2157 H GLU A 143 48.176 11.221 47.379 1.00 0.00 H ATOM 2158 N ARG A 144 47.257 14.164 48.753 1.00 25.19 N ATOM 2159 CA ARG A 144 47.279 15.515 49.265 1.00 25.89 C ATOM 2160 C ARG A 144 46.457 16.431 48.394 1.00 24.37 C ATOM 2161 O ARG A 144 46.101 17.523 48.817 1.00 24.08 O ATOM 2162 CB ARG A 144 48.726 16.032 49.300 1.00 26.95 C ATOM 2163 CG ARG A 144 49.484 15.597 50.542 1.00 32.86 C ATOM 2164 CD ARG A 144 49.548 14.093 50.715 1.00 41.01 C ATOM 2165 NE ARG A 144 49.573 13.635 52.109 1.00 47.65 N ATOM 2166 CZ ARG A 144 48.512 13.153 52.777 1.00 53.17 C ATOM 2167 NH1 ARG A 144 47.307 13.082 52.199 1.00 54.00 N ATOM 2168 NH2 ARG A 144 48.653 12.750 54.045 1.00 55.34 N ATOM 2169 HA ARG A 144 46.858 15.505 50.270 1.00 0.00 H ATOM 2170 HB2 ARG A 144 49.251 15.654 48.423 1.00 0.00 H ATOM 2171 HB3 ARG A 144 48.706 17.121 49.269 1.00 0.00 H ATOM 2172 HG2 ARG A 144 50.502 15.981 50.477 1.00 0.00 H ATOM 2173 HG3 ARG A 144 48.991 16.024 51.415 1.00 0.00 H ATOM 2174 HD2 ARG A 144 50.452 13.733 50.223 1.00 0.00 H ATOM 2175 HD3 ARG A 144 48.674 13.658 50.230 1.00 0.00 H ATOM 2176 HE ARG A 144 50.479 13.687 52.617 1.00 0.00 H ATOM 2177 HH12 ARG A 144 46.496 12.706 52.731 1.00 0.00 H ATOM 2178 HH11 ARG A 144 47.181 13.403 51.218 1.00 0.00 H ATOM 2179 HH22 ARG A 144 47.834 12.376 54.566 1.00 0.00 H ATOM 2180 HH21 ARG A 144 49.581 12.811 54.510 1.00 0.00 H ATOM 2181 H ARG A 144 48.154 13.724 48.465 1.00 0.00 H ATOM 2182 N PHE A 145 46.182 16.007 47.163 1.00 22.52 N ATOM 2183 CA PHE A 145 45.447 16.853 46.252 1.00 22.04 C ATOM 2184 C PHE A 145 43.965 16.475 46.157 1.00 20.98 C ATOM 2185 O PHE A 145 43.202 17.119 45.452 1.00 21.08 O ATOM 2186 CB PHE A 145 46.141 16.885 44.882 1.00 22.21 C ATOM 2187 CG PHE A 145 47.505 17.477 44.932 1.00 23.49 C ATOM 2188 CD1 PHE A 145 48.625 16.695 44.756 1.00 25.48 C ATOM 2189 CD2 PHE A 145 47.677 18.822 45.204 1.00 25.19 C ATOM 2190 CE1 PHE A 145 49.879 17.249 44.811 1.00 25.58 C ATOM 2191 CE2 PHE A 145 48.933 19.358 45.284 1.00 26.06 C ATOM 2192 CZ PHE A 145 50.032 18.572 45.086 1.00 25.36 C ATOM 2193 HA PHE A 145 45.455 17.866 46.655 1.00 0.00 H ATOM 2194 HB2 PHE A 145 46.219 15.864 44.509 1.00 0.00 H ATOM 2195 HB3 PHE A 145 45.531 17.475 44.198 1.00 0.00 H ATOM 2196 HD2 PHE A 145 46.806 19.459 45.356 1.00 0.00 H ATOM 2197 HE2 PHE A 145 49.057 20.418 45.507 1.00 0.00 H ATOM 2198 HZ PHE A 145 51.031 19.004 45.148 1.00 0.00 H ATOM 2199 HE1 PHE A 145 50.756 16.626 44.634 1.00 0.00 H ATOM 2200 HD1 PHE A 145 48.514 15.626 44.571 1.00 0.00 H ATOM 2201 H PHE A 145 46.497 15.064 46.856 1.00 0.00 H ATOM 2202 N GLY A 146 43.544 15.456 46.884 1.00 19.69 N ATOM 2203 CA GLY A 146 42.136 15.097 46.863 1.00 20.50 C ATOM 2204 C GLY A 146 41.304 15.787 47.956 1.00 20.29 C ATOM 2205 O GLY A 146 41.754 16.702 48.621 1.00 20.34 O ATOM 2206 HA3 GLY A 146 42.054 14.018 46.997 1.00 0.00 H ATOM 2207 HA2 GLY A 146 41.725 15.373 45.892 1.00 0.00 H ATOM 2208 H GLY A 146 44.214 14.915 47.467 1.00 0.00 H ATOM 2209 N SER A 147 40.082 15.332 48.145 1.00 20.77 N ATOM 2210 CA SER A 147 39.207 15.879 49.181 1.00 21.47 C ATOM 2211 C SER A 147 38.152 14.830 49.511 1.00 22.54 C ATOM 2212 O SER A 147 37.997 13.854 48.765 1.00 21.62 O ATOM 2213 CB SER A 147 38.519 17.139 48.685 1.00 21.23 C ATOM 2214 OG SER A 147 37.654 16.797 47.630 1.00 21.17 O ATOM 2215 HA SER A 147 39.796 16.130 50.063 1.00 0.00 H ATOM 2216 HB2 SER A 147 39.266 17.850 48.331 1.00 0.00 H ATOM 2217 HB3 SER A 147 37.947 17.589 49.497 1.00 0.00 H ATOM 2218 HG SER A 147 38.177 16.388 46.896 1.00 0.00 H ATOM 2219 H SER A 147 39.730 14.562 47.541 1.00 0.00 H ATOM 2220 N ARG A 148 37.431 15.058 50.613 1.00 23.86 N ATOM 2221 CA ARG A 148 36.413 14.136 51.121 1.00 25.30 C ATOM 2222 C ARG A 148 35.405 13.708 50.068 1.00 25.11 C ATOM 2223 O ARG A 148 34.973 12.574 50.056 1.00 24.99 O ATOM 2224 CB ARG A 148 35.685 14.767 52.320 1.00 26.50 C ATOM 2225 CG ARG A 148 36.571 14.821 53.574 1.00 31.26 C ATOM 2226 CD ARG A 148 35.831 14.639 54.900 1.00 37.86 C ATOM 2227 NE ARG A 148 35.399 15.917 55.471 1.00 44.19 N ATOM 2228 CZ ARG A 148 34.120 16.276 55.703 1.00 49.56 C ATOM 2229 NH1 ARG A 148 33.864 17.477 56.216 1.00 51.65 N ATOM 2230 NH2 ARG A 148 33.100 15.464 55.416 1.00 49.57 N ATOM 2231 HA ARG A 148 36.939 13.233 51.431 1.00 0.00 H ATOM 2232 HB2 ARG A 148 35.388 15.782 52.056 1.00 0.00 H ATOM 2233 HB3 ARG A 148 34.797 14.176 52.543 1.00 0.00 H ATOM 2234 HG2 ARG A 148 37.319 14.032 53.493 1.00 0.00 H ATOM 2235 HG3 ARG A 148 37.068 15.791 53.595 1.00 0.00 H ATOM 2236 HD2 ARG A 148 36.495 14.144 55.608 1.00 0.00 H ATOM 2237 HD3 ARG A 148 34.953 14.015 54.730 1.00 0.00 H ATOM 2238 HE ARG A 148 36.140 16.604 55.718 1.00 0.00 H ATOM 2239 HH12 ARG A 148 32.882 17.765 56.399 1.00 0.00 H ATOM 2240 HH11 ARG A 148 34.646 18.127 56.433 1.00 0.00 H ATOM 2241 HH22 ARG A 148 32.124 15.768 55.606 1.00 0.00 H ATOM 2242 HH21 ARG A 148 33.282 14.527 55.002 1.00 0.00 H ATOM 2243 H ARG A 148 37.602 15.939 51.139 1.00 0.00 H ATOM 2244 N ASN A 149 35.052 14.607 49.167 1.00 25.32 N ATOM 2245 CA ASN A 149 34.124 14.272 48.098 1.00 26.05 C ATOM 2246 C ASN A 149 34.829 13.791 46.817 1.00 25.35 C ATOM 2247 O ASN A 149 34.165 13.490 45.845 1.00 26.22 O ATOM 2248 CB ASN A 149 33.260 15.478 47.755 1.00 26.90 C ATOM 2249 CG ASN A 149 34.088 16.673 47.357 1.00 30.01 C ATOM 2250 OD1 ASN A 149 34.414 17.526 48.201 1.00 36.31 O ATOM 2251 ND2 ASN A 149 34.484 16.724 46.092 1.00 31.34 N ATOM 2252 HA ASN A 149 33.512 13.451 48.471 1.00 0.00 H ATOM 2253 HB2 ASN A 149 32.601 15.215 46.927 1.00 0.00 H ATOM 2254 HB3 ASN A 149 32.660 15.740 48.626 1.00 0.00 H ATOM 2255 HD22 ASN A 149 34.184 15.986 45.423 1.00 0.00 H ATOM 2256 HD21 ASN A 149 35.094 17.502 45.769 1.00 0.00 H ATOM 2257 H ASN A 149 35.443 15.569 49.223 1.00 0.00 H ATOM 2258 N GLY A 150 36.158 13.756 46.791 1.00 23.62 N ATOM 2259 CA GLY A 150 36.863 13.225 45.641 1.00 22.99 C ATOM 2260 C GLY A 150 37.379 14.182 44.579 1.00 22.55 C ATOM 2261 O GLY A 150 38.190 13.791 43.739 1.00 22.09 O ATOM 2262 HA3 GLY A 150 36.184 12.533 45.143 1.00 0.00 H ATOM 2263 HA2 GLY A 150 37.725 12.676 46.021 1.00 0.00 H ATOM 2264 H GLY A 150 36.698 14.114 47.605 1.00 0.00 H ATOM 2265 N LYS A 151 36.905 15.423 44.596 1.00 21.77 N ATOM 2266 CA LYS A 151 37.332 16.403 43.628 1.00 22.38 C ATOM 2267 C LYS A 151 38.803 16.752 43.897 1.00 20.54 C ATOM 2268 O LYS A 151 39.178 16.989 45.033 1.00 19.70 O ATOM 2269 CB LYS A 151 36.443 17.646 43.711 1.00 23.38 C ATOM 2270 CG LYS A 151 36.843 18.723 42.729 1.00 29.49 C ATOM 2271 CD LYS A 151 35.937 19.955 42.864 1.00 37.16 C ATOM 2272 CE LYS A 151 36.359 21.070 41.890 1.00 41.19 C ATOM 2273 NZ LYS A 151 35.475 22.272 41.992 1.00 44.06 N ATOM 2274 HA LYS A 151 37.241 16.000 42.619 1.00 0.00 H ATOM 2275 HB2 LYS A 151 35.414 17.352 43.505 1.00 0.00 H ATOM 2276 HB3 LYS A 151 36.508 18.054 44.720 1.00 0.00 H ATOM 2277 HG2 LYS A 151 37.875 19.016 42.922 1.00 0.00 H ATOM 2278 HG3 LYS A 151 36.762 18.330 41.716 1.00 0.00 H ATOM 2279 HD2 LYS A 151 34.909 19.665 42.648 1.00 0.00 H ATOM 2280 HD3 LYS A 151 36.000 20.332 43.885 1.00 0.00 H ATOM 2281 HE2 LYS A 151 36.311 20.684 40.872 1.00 0.00 H ATOM 2282 HE3 LYS A 151 37.383 21.366 42.117 1.00 0.00 H ATOM 2283 HZ1 LYS A 151 34.496 22.001 41.769 1.00 0.00 H ATOM 2284 HZ2 LYS A 151 35.519 22.652 42.959 1.00 0.00 H ATOM 2285 HZ3 LYS A 151 35.797 22.996 41.318 1.00 0.00 H ATOM 2286 H LYS A 151 36.212 15.693 45.322 1.00 0.00 H ATOM 2287 N THR A 152 39.640 16.744 42.871 1.00 19.39 N ATOM 2288 CA THR A 152 41.059 17.084 43.070 1.00 19.64 C ATOM 2289 C THR A 152 41.258 18.576 42.878 1.00 19.83 C ATOM 2290 O THR A 152 40.583 19.173 42.071 1.00 18.58 O ATOM 2291 CB THR A 152 41.983 16.323 42.086 1.00 19.51 C ATOM 2292 OG1 THR A 152 41.517 16.492 40.742 1.00 18.13 O ATOM 2293 CG2 THR A 152 41.933 14.821 42.310 1.00 18.73 C ATOM 2294 HA THR A 152 41.326 16.788 44.085 1.00 0.00 H ATOM 2295 HB THR A 152 42.984 16.721 42.249 1.00 0.00 H ATOM 2296 HG1 THR A 152 42.114 16.002 40.123 1.00 0.00 H ATOM 2297 HG23 THR A 152 42.275 14.594 43.320 1.00 0.00 H ATOM 2298 HG21 THR A 152 40.909 14.470 42.184 1.00 0.00 H ATOM 2299 HG22 THR A 152 42.580 14.325 41.586 1.00 0.00 H ATOM 2300 H THR A 152 39.294 16.497 41.922 1.00 0.00 H ATOM 2301 N SER A 153 42.202 19.156 43.612 1.00 21.05 N ATOM 2302 CA SER A 153 42.489 20.595 43.520 1.00 22.08 C ATOM 2303 C SER A 153 43.501 20.854 42.403 1.00 23.31 C ATOM 2304 O SER A 153 43.687 21.990 41.958 1.00 22.71 O ATOM 2305 CB SER A 153 43.014 21.134 44.850 1.00 21.99 C ATOM 2306 OG SER A 153 44.163 20.446 45.310 1.00 23.20 O ATOM 2307 HA SER A 153 41.561 21.118 43.288 1.00 0.00 H ATOM 2308 HB2 SER A 153 42.228 21.038 45.599 1.00 0.00 H ATOM 2309 HB3 SER A 153 43.266 22.187 44.723 1.00 0.00 H ATOM 2310 HG SER A 153 43.944 19.489 45.438 1.00 0.00 H ATOM 2311 H SER A 153 42.755 18.573 44.272 1.00 0.00 H ATOM 2312 N LYS A 154 44.169 19.789 41.972 1.00 24.07 N ATOM 2313 CA LYS A 154 45.063 19.866 40.826 1.00 25.36 C ATOM 2314 C LYS A 154 44.875 18.655 39.905 1.00 24.81 C ATOM 2315 O LYS A 154 44.453 17.586 40.349 1.00 25.16 O ATOM 2316 CB LYS A 154 46.519 19.961 41.289 1.00 25.91 C ATOM 2317 CG LYS A 154 46.809 21.181 42.105 1.00 28.48 C ATOM 2318 CD LYS A 154 48.281 21.348 42.390 1.00 32.67 C ATOM 2319 CE LYS A 154 48.540 22.624 43.202 1.00 33.57 C ATOM 2320 NZ LYS A 154 49.993 22.822 43.391 1.00 35.31 N ATOM 2321 HA LYS A 154 44.816 20.766 40.262 1.00 0.00 H ATOM 2322 HB2 LYS A 154 46.748 19.081 41.890 1.00 0.00 H ATOM 2323 HB3 LYS A 154 47.161 19.974 40.408 1.00 0.00 H ATOM 2324 HG2 LYS A 154 46.456 22.058 41.562 1.00 0.00 H ATOM 2325 HG3 LYS A 154 46.276 21.103 43.052 1.00 0.00 H ATOM 2326 HD2 LYS A 154 48.635 20.486 42.956 1.00 0.00 H ATOM 2327 HD3 LYS A 154 48.823 21.409 41.446 1.00 0.00 H ATOM 2328 HE2 LYS A 154 48.059 22.535 44.176 1.00 0.00 H ATOM 2329 HE3 LYS A 154 48.126 23.480 42.670 1.00 0.00 H ATOM 2330 HZ1 LYS A 154 50.389 22.007 43.901 1.00 0.00 H ATOM 2331 HZ2 LYS A 154 50.453 22.909 42.463 1.00 0.00 H ATOM 2332 HZ3 LYS A 154 50.155 23.689 43.942 1.00 0.00 H ATOM 2333 H LYS A 154 44.050 18.881 42.464 1.00 0.00 H ATOM 2334 N LYS A 155 45.219 18.825 38.626 1.00 25.01 N ATOM 2335 CA LYS A 155 45.097 17.748 37.650 1.00 25.14 C ATOM 2336 C LYS A 155 46.196 16.726 37.894 1.00 23.75 C ATOM 2337 O LYS A 155 47.380 17.064 37.846 1.00 22.98 O ATOM 2338 CB LYS A 155 45.199 18.276 36.226 1.00 26.10 C ATOM 2339 CG LYS A 155 43.923 18.896 35.714 1.00 32.40 C ATOM 2340 CD LYS A 155 44.016 19.301 34.259 1.00 39.47 C ATOM 2341 CE LYS A 155 42.696 19.919 33.786 1.00 43.61 C ATOM 2342 NZ LYS A 155 42.802 20.370 32.357 1.00 47.31 N ATOM 2343 HA LYS A 155 44.118 17.285 37.769 1.00 0.00 H ATOM 2344 HB2 LYS A 155 45.985 19.031 36.194 1.00 0.00 H ATOM 2345 HB3 LYS A 155 45.466 17.447 35.570 1.00 0.00 H ATOM 2346 HG2 LYS A 155 43.114 18.173 35.825 1.00 0.00 H ATOM 2347 HG3 LYS A 155 43.701 19.781 36.310 1.00 0.00 H ATOM 2348 HD2 LYS A 155 44.817 20.031 34.140 1.00 0.00 H ATOM 2349 HD3 LYS A 155 44.237 18.421 33.655 1.00 0.00 H ATOM 2350 HE2 LYS A 155 42.456 20.776 34.415 1.00 0.00 H ATOM 2351 HE3 LYS A 155 41.903 19.176 33.869 1.00 0.00 H ATOM 2352 HZ1 LYS A 155 43.556 21.082 32.274 1.00 0.00 H ATOM 2353 HZ2 LYS A 155 43.027 19.554 31.753 1.00 0.00 H ATOM 2354 HZ3 LYS A 155 41.897 20.785 32.058 1.00 0.00 H ATOM 2355 H LYS A 155 45.583 19.749 38.318 1.00 0.00 H ATOM 2356 N ILE A 156 45.793 15.499 38.198 1.00 21.74 N ATOM 2357 CA ILE A 156 46.718 14.401 38.411 1.00 21.53 C ATOM 2358 C ILE A 156 46.603 13.496 37.194 1.00 21.44 C ATOM 2359 O ILE A 156 45.565 12.851 36.971 1.00 21.10 O ATOM 2360 CB ILE A 156 46.341 13.644 39.693 1.00 22.18 C ATOM 2361 CG1 ILE A 156 46.129 14.609 40.871 1.00 22.76 C ATOM 2362 CG2 ILE A 156 47.334 12.543 40.004 1.00 22.51 C ATOM 2363 CD1 ILE A 156 47.383 15.254 41.387 1.00 25.91 C ATOM 2364 HA ILE A 156 47.742 14.755 38.531 1.00 0.00 H ATOM 2365 HB ILE A 156 45.384 13.150 39.522 1.00 0.00 H ATOM 2366 HG12 ILE A 156 45.450 15.398 40.546 1.00 0.00 H ATOM 2367 HG13 ILE A 156 45.672 14.052 41.689 1.00 0.00 H ATOM 2368 HD11 ILE A 156 48.072 14.482 41.731 1.00 0.00 H ATOM 2369 HD12 ILE A 156 47.850 15.829 40.587 1.00 0.00 H ATOM 2370 HD13 ILE A 156 47.135 15.917 42.216 1.00 0.00 H ATOM 2371 HG21 ILE A 156 47.357 11.832 39.178 1.00 0.00 H ATOM 2372 HG22 ILE A 156 48.325 12.977 40.139 1.00 0.00 H ATOM 2373 HG23 ILE A 156 47.033 12.031 40.918 1.00 0.00 H ATOM 2374 H ILE A 156 44.773 15.317 38.287 1.00 0.00 H ATOM 2375 N THR A 157 47.650 13.453 36.381 1.00 20.73 N ATOM 2376 CA THR A 157 47.622 12.653 35.196 1.00 21.12 C ATOM 2377 C THR A 157 48.702 11.559 35.134 1.00 20.74 C ATOM 2378 O THR A 157 49.766 11.610 35.802 1.00 19.17 O ATOM 2379 CB THR A 157 47.756 13.557 33.970 1.00 21.81 C ATOM 2380 OG1 THR A 157 48.979 14.289 34.050 1.00 24.51 O ATOM 2381 CG2 THR A 157 46.709 14.650 33.995 1.00 23.72 C ATOM 2382 HA THR A 157 46.664 12.133 35.212 1.00 0.00 H ATOM 2383 HB THR A 157 47.678 12.912 33.094 1.00 0.00 H ATOM 2384 HG1 THR A 157 48.978 14.843 34.871 1.00 0.00 H ATOM 2385 HG23 THR A 157 45.717 14.202 33.938 1.00 0.00 H ATOM 2386 HG21 THR A 157 46.800 15.218 34.921 1.00 0.00 H ATOM 2387 HG22 THR A 157 46.859 15.314 33.144 1.00 0.00 H ATOM 2388 H THR A 157 48.500 14.007 36.608 1.00 0.00 H ATOM 2389 N ILE A 158 48.390 10.552 34.323 1.00 19.62 N ATOM 2390 CA ILE A 158 49.354 9.534 34.012 1.00 19.70 C ATOM 2391 C ILE A 158 50.098 10.051 32.770 1.00 19.86 C ATOM 2392 O ILE A 158 49.600 9.938 31.648 1.00 20.05 O ATOM 2393 CB ILE A 158 48.647 8.211 33.748 1.00 19.75 C ATOM 2394 CG1 ILE A 158 47.860 7.765 34.979 1.00 19.15 C ATOM 2395 CG2 ILE A 158 49.661 7.126 33.350 1.00 19.48 C ATOM 2396 CD1 ILE A 158 46.959 6.593 34.704 1.00 20.31 C ATOM 2397 HA ILE A 158 50.050 9.345 34.829 1.00 0.00 H ATOM 2398 HB ILE A 158 47.950 8.359 32.923 1.00 0.00 H ATOM 2399 HG12 ILE A 158 48.566 7.486 35.761 1.00 0.00 H ATOM 2400 HG13 ILE A 158 47.250 8.600 35.323 1.00 0.00 H ATOM 2401 HD11 ILE A 158 46.241 6.862 33.929 1.00 0.00 H ATOM 2402 HD12 ILE A 158 47.558 5.747 34.367 1.00 0.00 H ATOM 2403 HD13 ILE A 158 46.427 6.323 35.616 1.00 0.00 H ATOM 2404 HG21 ILE A 158 50.185 7.434 32.445 1.00 0.00 H ATOM 2405 HG22 ILE A 158 50.380 6.988 34.158 1.00 0.00 H ATOM 2406 HG23 ILE A 158 49.135 6.189 33.166 1.00 0.00 H ATOM 2407 H ILE A 158 47.437 10.501 33.909 1.00 0.00 H ATOM 2408 N ALA A 159 51.281 10.629 32.978 1.00 20.06 N ATOM 2409 CA ALA A 159 52.049 11.234 31.878 1.00 20.28 C ATOM 2410 C ALA A 159 52.607 10.175 30.981 1.00 20.49 C ATOM 2411 O ALA A 159 52.774 10.397 29.782 1.00 21.58 O ATOM 2412 CB ALA A 159 53.181 12.107 32.394 1.00 20.45 C ATOM 2413 HA ALA A 159 51.360 11.864 31.315 1.00 0.00 H ATOM 2414 HB1 ALA A 159 52.769 12.909 33.007 1.00 0.00 H ATOM 2415 HB2 ALA A 159 53.860 11.502 32.994 1.00 0.00 H ATOM 2416 HB3 ALA A 159 53.722 12.534 31.550 1.00 0.00 H ATOM 2417 H ALA A 159 51.671 10.653 33.942 1.00 0.00 H ATOM 2418 N ASP A 160 52.914 9.018 31.551 1.00 20.09 N ATOM 2419 CA ASP A 160 53.397 7.918 30.748 1.00 20.10 C ATOM 2420 C ASP A 160 53.224 6.648 31.540 1.00 19.13 C ATOM 2421 O ASP A 160 53.065 6.683 32.753 1.00 18.56 O ATOM 2422 CB ASP A 160 54.874 8.103 30.409 1.00 20.46 C ATOM 2423 CG ASP A 160 55.337 7.168 29.322 1.00 23.18 C ATOM 2424 OD1 ASP A 160 54.481 6.618 28.572 1.00 21.64 O ATOM 2425 OD2 ASP A 160 56.549 6.935 29.148 1.00 26.67 O ATOM 2426 HA ASP A 160 52.834 7.875 29.815 1.00 0.00 H ATOM 2427 HB2 ASP A 160 55.031 9.130 30.078 1.00 0.00 H ATOM 2428 HB3 ASP A 160 55.465 7.917 31.306 1.00 0.00 H ATOM 2429 H ASP A 160 52.807 8.902 32.579 1.00 0.00 H ATOM 2430 N CYS A 161 53.234 5.527 30.843 1.00 18.29 N ATOM 2431 CA CYS A 161 53.046 4.249 31.483 1.00 17.98 C ATOM 2432 C CYS A 161 53.458 3.144 30.525 1.00 18.15 C ATOM 2433 O CYS A 161 53.507 3.353 29.310 1.00 17.59 O ATOM 2434 CB CYS A 161 51.585 4.106 31.893 1.00 16.92 C ATOM 2435 SG CYS A 161 50.396 4.350 30.562 1.00 18.44 S ATOM 2436 HA CYS A 161 53.665 4.176 32.378 1.00 0.00 H ATOM 2437 HB2 CYS A 161 51.378 4.841 32.671 1.00 0.00 H ATOM 2438 HB3 CYS A 161 51.443 3.103 32.295 1.00 0.00 H ATOM 2439 HG CYS A 161 50.623 3.419 29.569 1.00 0.00 H ATOM 2440 H CYS A 161 53.380 5.566 29.814 1.00 0.00 H ATOM 2441 N GLY A 162 53.722 1.965 31.076 1.00 17.86 N ATOM 2442 CA GLY A 162 54.146 0.846 30.272 1.00 18.69 C ATOM 2443 C GLY A 162 54.426 -0.366 31.134 1.00 19.00 C ATOM 2444 O GLY A 162 54.000 -0.461 32.298 1.00 19.12 O ATOM 2445 HA3 GLY A 162 55.054 1.118 29.733 1.00 0.00 H ATOM 2446 HA2 GLY A 162 53.360 0.602 29.558 1.00 0.00 H ATOM 2447 H GLY A 162 53.621 1.847 32.104 1.00 0.00 H ATOM 2448 N GLN A 163 55.125 -1.321 30.545 1.00 19.66 N ATOM 2449 CA GLN A 163 55.463 -2.554 31.215 1.00 19.80 C ATOM 2450 C GLN A 163 56.970 -2.647 31.408 1.00 21.47 C ATOM 2451 O GLN A 163 57.724 -2.246 30.543 1.00 19.79 O ATOM 2452 CB GLN A 163 54.993 -3.713 30.387 1.00 20.11 C ATOM 2453 CG GLN A 163 55.245 -5.044 31.034 1.00 20.34 C ATOM 2454 CD GLN A 163 54.701 -6.200 30.239 1.00 20.48 C ATOM 2455 OE1 GLN A 163 54.028 -6.020 29.226 1.00 19.81 O ATOM 2456 NE2 GLN A 163 54.965 -7.392 30.717 1.00 21.51 N ATOM 2457 HA GLN A 163 54.978 -2.576 32.191 1.00 0.00 H ATOM 2458 HB2 GLN A 163 53.921 -3.607 30.219 1.00 0.00 H ATOM 2459 HB3 GLN A 163 55.514 -3.689 29.430 1.00 0.00 H ATOM 2460 HG2 GLN A 163 56.321 -5.177 31.147 1.00 0.00 H ATOM 2461 HG3 GLN A 163 54.774 -5.047 32.017 1.00 0.00 H ATOM 2462 HE22 GLN A 163 55.540 -7.491 31.578 1.00 0.00 H ATOM 2463 HE21 GLN A 163 54.600 -8.238 30.235 1.00 0.00 H ATOM 2464 H GLN A 163 55.442 -1.179 29.565 1.00 0.00 H ATOM 2465 N LEU A 164 57.383 -3.160 32.558 1.00 23.56 N ATOM 2466 CA LEU A 164 58.789 -3.340 32.867 1.00 26.07 C ATOM 2467 C LEU A 164 59.129 -4.805 32.857 1.00 28.33 C ATOM 2468 O LEU A 164 58.407 -5.639 33.406 1.00 27.46 O ATOM 2469 CB LEU A 164 59.106 -2.816 34.263 1.00 26.12 C ATOM 2470 CG LEU A 164 59.011 -1.305 34.487 1.00 27.14 C ATOM 2471 CD1 LEU A 164 59.448 -0.982 35.897 1.00 28.53 C ATOM 2472 CD2 LEU A 164 59.876 -0.538 33.499 1.00 28.35 C ATOM 2473 HA LEU A 164 59.365 -2.796 32.118 1.00 0.00 H ATOM 2474 HB2 LEU A 164 58.414 -3.294 34.957 1.00 0.00 H ATOM 2475 HB3 LEU A 164 60.125 -3.119 34.502 1.00 0.00 H ATOM 2476 HG LEU A 164 57.975 -1.002 34.333 1.00 0.00 H ATOM 2477 HD21 LEU A 164 60.917 -0.840 33.618 1.00 0.00 H ATOM 2478 HD22 LEU A 164 59.547 -0.758 32.483 1.00 0.00 H ATOM 2479 HD23 LEU A 164 59.782 0.531 33.690 1.00 0.00 H ATOM 2480 HD11 LEU A 164 58.799 -1.498 36.604 1.00 0.00 H ATOM 2481 HD12 LEU A 164 60.478 -1.309 36.041 1.00 0.00 H ATOM 2482 HD13 LEU A 164 59.381 0.094 36.059 1.00 0.00 H ATOM 2483 H LEU A 164 56.674 -3.444 33.264 1.00 0.00 H ATOM 2484 N GLU A 165 60.234 -5.145 32.225 1.00 31.83 N ATOM 2485 CA GLU A 165 60.668 -6.530 32.293 1.00 34.74 C ATOM 2486 C GLU A 165 62.117 -6.539 32.760 1.00 36.26 C ATOM 2487 O GLU A 165 62.435 -6.739 33.944 1.00 37.97 O ATOM 2488 CB GLU A 165 60.409 -7.244 30.969 1.00 35.44 C ATOM 2489 CG GLU A 165 58.956 -7.124 30.503 1.00 36.57 C ATOM 2490 CD GLU A 165 58.683 -7.903 29.226 1.00 43.93 C ATOM 2491 OE1 GLU A 165 59.556 -8.729 28.849 1.00 50.14 O ATOM 2492 OE2 GLU A 165 57.619 -7.705 28.578 1.00 45.71 O ATOM 2493 HA GLU A 165 60.091 -7.103 33.019 1.00 0.00 H ATOM 2494 OXT GLU A 165 63.053 -6.263 32.024 1.00 38.63 O ATOM 2495 HB2 GLU A 165 61.056 -6.810 30.207 1.00 0.00 H ATOM 2496 HB3 GLU A 165 60.650 -8.300 31.090 1.00 0.00 H ATOM 2497 HG2 GLU A 165 58.305 -7.504 31.290 1.00 0.00 H ATOM 2498 HG3 GLU A 165 58.732 -6.072 30.325 1.00 0.00 H ATOM 2499 H GLU A 165 60.782 -4.440 31.691 1.00 0.00 H TER 2500 GLU A 165 HETATM 2501 O HOH 1 33.509 7.700 38.244 1.00 12.13 O HETATM 2502 O HOH 2 36.116 -0.715 35.188 1.00 12.45 O HETATM 2503 O HOH 3 31.592 -5.556 37.381 1.00 13.45 O HETATM 2504 O HOH 4 39.657 8.884 34.687 1.00 13.47 O HETATM 2505 O HOH 5 34.870 -5.509 39.693 1.00 14.48 O HETATM 2506 O HOH 6 48.566 3.623 27.348 1.00 14.73 O HETATM 2507 O HOH 7 40.476 -11.749 42.696 1.00 17.50 O HETATM 2508 O HOH 8 37.059 -9.196 36.382 1.00 17.60 O HETATM 2509 O HOH 9 38.478 -9.880 44.101 1.00 17.93 O HETATM 2510 O HOH 10 36.744 -8.472 46.485 1.00 18.35 O HETATM 2511 O HOH 11 41.690 -4.686 34.108 1.00 18.64 O HETATM 2512 O HOH 12 46.086 -1.099 24.631 1.00 18.65 O HETATM 2513 O HOH 13 42.996 15.088 38.687 1.00 19.90 O HETATM 2514 O HOH 14 39.553 -7.050 53.370 1.00 20.76 O HETATM 2515 O HOH 15 55.110 4.569 26.647 1.00 21.28 O HETATM 2516 O HOH 16 43.567 7.595 34.586 1.00 21.50 O HETATM 2517 O HOH 17 35.585 1.714 32.775 1.00 22.97 O HETATM 2518 O HOH 18 41.109 11.053 32.122 1.00 23.50 O HETATM 2519 O HOH 19 56.572 -7.417 33.416 1.00 24.41 O HETATM 2520 O HOH 20 29.995 -7.299 49.762 1.00 25.18 O HETATM 2521 O HOH 21 39.950 19.522 45.962 1.00 27.64 O HETATM 2522 O HOH 22 56.260 11.761 36.056 1.00 27.87 O HETATM 2523 O HOH 23 51.957 -15.517 36.338 1.00 28.18 O HETATM 2524 O HOH 24 39.074 12.097 53.093 1.00 28.46 O HETATM 2525 O HOH 25 61.339 1.952 37.323 1.00 28.71 O HETATM 2526 O HOH 26 48.840 16.768 35.089 1.00 28.82 O HETATM 2527 O HOH 27 38.569 15.583 40.237 1.00 28.98 O HETATM 2528 O HOH 28 35.036 -15.776 43.284 1.00 29.33 O HETATM 2529 O HOH 29 43.321 -11.738 49.666 1.00 29.90 O HETATM 2530 O HOH 30 44.494 0.047 56.625 1.00 30.40 O HETATM 2531 O HOH 31 43.583 6.268 24.323 1.00 30.83 O HETATM 2532 O HOH 32 42.806 -2.308 50.462 1.00 32.59 O HETATM 2533 O HOH 33 33.588 -8.711 27.077 1.00 32.77 O HETATM 2534 O HOH 34 31.252 3.411 31.335 1.00 32.79 O HETATM 2535 O HOH 35 32.865 1.548 32.151 1.00 33.55 O HETATM 2536 O HOH 36 51.380 3.952 26.993 1.00 33.61 O HETATM 2537 O HOH 37 42.760 -12.407 28.119 1.00 33.73 O HETATM 2538 O HOH 38 30.017 -8.181 30.724 1.00 33.83 O HETATM 2539 O HOH 39 55.200 1.181 52.296 1.00 33.93 O HETATM 2540 O HOH 40 57.472 -8.828 36.589 1.00 33.93 O HETATM 2541 O HOH 41 25.421 -9.175 34.634 1.00 34.04 O HETATM 2542 O HOH 42 37.488 -2.730 23.234 1.00 34.10 O HETATM 2543 O HOH 43 48.834 10.639 52.360 1.00 34.25 O HETATM 2544 O HOH 44 51.188 -2.379 48.115 1.00 34.67 O HETATM 2545 O HOH 45 47.725 4.659 25.093 1.00 34.68 O HETATM 2546 O HOH 46 33.674 13.089 43.484 1.00 35.38 O HETATM 2547 O HOH 47 34.617 10.465 51.822 1.00 36.13 O HETATM 2548 O HOH 48 46.511 7.250 25.561 1.00 36.52 O HETATM 2549 O HOH 49 57.092 6.670 51.451 1.00 36.74 O HETATM 2550 O HOH 50 33.160 5.377 26.629 1.00 37.08 O HETATM 2551 O HOH 51 49.751 25.374 44.455 1.00 37.30 O HETATM 2552 O HOH 52 48.446 3.529 22.201 1.00 37.76 O HETATM 2553 O HOH 53 48.799 -10.975 31.440 1.00 37.96 O HETATM 2554 O HOH 54 29.809 10.297 38.069 1.00 38.22 O HETATM 2555 O HOH 55 38.195 2.652 54.566 1.00 38.28 O HETATM 2556 O HOH 56 60.259 -5.928 36.433 1.00 38.30 O HETATM 2557 O HOH 57 47.144 -12.690 32.457 1.00 38.67 O HETATM 2558 O HOH 58 26.823 -6.309 31.999 1.00 38.82 O HETATM 2559 O HOH 59 38.242 -17.399 37.957 1.00 38.94 O HETATM 2560 O HOH 60 46.599 -3.876 18.068 1.00 39.35 O HETATM 2561 O HOH 61 39.496 1.340 56.909 1.00 39.82 O HETATM 2562 O HOH 62 29.621 -8.099 43.338 1.00 39.83 O HETATM 2563 O HOH 63 40.605 -8.785 54.965 1.00 40.13 O HETATM 2564 O HOH 64 48.085 17.682 33.043 1.00 40.32 O HETATM 2565 O HOH 65 59.478 8.404 41.506 1.00 40.71 O HETATM 2566 O HOH 66 31.800 8.322 24.671 1.00 40.92 O HETATM 2567 O HOH 67 36.204 4.184 22.000 1.00 40.97 O HETATM 2568 O HOH 68 44.735 -8.979 48.618 1.00 40.98 O HETATM 2569 O HOH 69 39.785 15.438 36.392 1.00 41.36 O HETATM 2570 O HOH 70 40.141 0.710 50.191 1.00 41.58 O HETATM 2571 O HOH 71 32.289 11.142 45.823 1.00 41.76 O HETATM 2572 O HOH 72 58.539 22.601 33.173 1.00 42.29 O HETATM 2573 O HOH 73 29.773 1.496 32.829 1.00 42.64 O HETATM 2574 O HOH 74 34.043 11.064 23.795 1.00 42.69 O HETATM 2575 O HOH 75 43.238 6.304 21.223 1.00 43.17 O HETATM 2576 O HOH 76 59.114 6.276 44.113 1.00 43.66 O HETATM 2577 O HOH 77 40.184 14.890 52.606 1.00 43.90 O HETATM 2578 O HOH 78 58.266 14.764 43.235 1.00 44.51 O HETATM 2579 O HOH 79 58.354 7.581 30.453 1.00 44.60 O HETATM 2580 O HOH 80 45.399 5.448 55.054 1.00 44.68 O HETATM 2581 O HOH 81 31.686 -12.406 29.655 1.00 45.88 O HETATM 2582 O HOH 82 39.010 8.429 54.696 1.00 46.31 O HETATM 2583 O HOH 83 30.659 -6.608 40.054 1.00 46.40 O HETATM 2584 O HOH 84 24.951 -3.696 35.425 1.00 46.95 O HETATM 2585 O HOH 85 47.223 -0.043 57.044 1.00 47.53 O HETATM 2586 O HOH 86 34.843 -11.051 27.296 1.00 47.82 O HETATM 2587 O HOH 87 42.511 17.186 51.199 1.00 48.47 O HETATM 2588 O HOH 88 29.264 -10.049 39.354 1.00 49.33 O HETATM 2589 O HOH 89 44.149 9.683 27.671 1.00 50.22 O HETATM 2590 O HOH 90 46.319 -19.706 41.242 1.00 51.28 O HETATM 2591 O HOH 91 59.638 0.128 39.612 1.00 54.49 O HETATM 2592 O HOH 92 56.401 -20.306 35.732 1.00 54.86 O HETATM 2593 O HOH 93 52.634 21.263 40.133 1.00 55.68 O HETATM 2594 O HOH 94 55.672 -5.572 26.671 1.00 60.28 O HETATM 2595 O HOH 95 52.728 9.749 53.539 1.00 61.40 O HETATM 2596 O HOH 96 31.821 11.624 42.795 1.00 68.46 O HETATM 2597 O HOH 97 31.309 -14.566 35.455 1.00 74.98 O HETATM 2598 O HOH 98 25.977 3.228 37.573 1.00 25.01 O HETATM 2599 O HOH 99 36.596 15.638 57.504 1.00 42.50 O HETATM 2600 O HOH 100 32.758 8.455 54.110 1.00 49.05 O HETATM 2601 C54 SFM A 101 27.838 5.634 32.702 1.00 0.01 C HETATM 2602 C53 SFM A 101 27.501 6.441 33.960 1.00 0.10 C HETATM 2603 O71 SFM A 101 27.155 7.598 33.739 1.00 -0.39 O HETATM 2604 C52 SFM A 101 27.611 5.863 35.342 1.00 0.02 C HETATM 2605 C51 SFM A 101 28.155 6.862 36.353 1.00 -0.01 C HETATM 2606 C14 SFM A 101 28.117 6.285 37.775 1.00 0.08 C HETATM 2607 C13 SFM A 101 29.064 5.085 37.709 1.00 0.18 C HETATM 2608 O70 SFM A 101 28.583 3.980 37.625 1.00 -0.40 O HETATM 2609 N12 SFM A 101 30.378 5.247 37.738 1.00 -0.27 N HETATM 2610 C11 SFM A 101 31.217 4.064 37.724 1.00 0.13 C HETATM 2611 C55 SFM A 101 32.331 4.137 36.635 1.00 -0.01 C HETATM 2612 C56 SFM A 101 31.720 3.929 35.223 1.00 -0.06 C HETATM 2613 H12 SFM A 101 32.517 3.983 34.467 1.00 0.02 H HETATM 2614 H13 SFM A 101 30.975 4.714 35.027 1.00 0.02 H HETATM 2615 H14 SFM A 101 31.235 2.943 35.175 1.00 0.02 H HETATM 2616 C57 SFM A 101 33.310 2.978 36.828 1.00 -0.06 C HETATM 2617 H15 SFM A 101 33.785 3.060 37.816 1.00 0.02 H HETATM 2618 H16 SFM A 101 34.082 3.016 36.045 1.00 0.02 H HETATM 2619 H17 SFM A 101 32.767 2.024 36.761 1.00 0.02 H HETATM 2620 H11 SFM A 101 32.851 5.104 36.696 1.00 0.03 H HETATM 2621 C10 SFM A 101 31.846 4.115 39.109 1.00 0.20 C HETATM 2622 N9 SFM A 101 31.560 3.161 39.982 1.00 -0.26 N HETATM 2623 C8 SFM A 101 31.963 3.247 41.393 1.00 0.14 C HETATM 2624 C58 SFM A 101 30.743 2.680 42.144 1.00 0.02 C HETATM 2625 C59 SFM A 101 30.861 2.549 43.625 1.00 -0.05 C HETATM 2626 C64 SFM A 101 30.417 3.569 44.452 1.00 -0.07 C HETATM 2627 C63 SFM A 101 30.533 3.492 45.827 1.00 -0.08 C HETATM 2628 C62 SFM A 101 31.057 2.345 46.413 1.00 -0.04 C HETATM 2629 C61 SFM A 101 31.466 1.307 45.581 1.00 0.08 C HETATM 2630 O68 SFM A 101 31.970 0.166 46.117 1.00 -0.33 O HETATM 2631 H25 SFM A 101 32.199 -0.436 45.419 1.00 0.25 H HETATM 2632 C60 SFM A 101 31.384 1.403 44.212 1.00 -0.03 C HETATM 2633 H26 SFM A 101 31.727 0.584 43.590 1.00 0.05 H HETATM 2634 H24 SFM A 101 31.145 2.261 47.490 1.00 0.05 H HETATM 2635 H23 SFM A 101 30.216 4.323 46.447 1.00 0.06 H HETATM 2636 H22 SFM A 101 29.967 4.450 44.009 1.00 0.05 H HETATM 2637 H20 SFM A 101 30.539 1.679 41.737 1.00 0.05 H HETATM 2638 H21 SFM A 101 29.889 3.341 41.936 1.00 0.05 H HETATM 2639 C7 SFM A 101 33.266 2.481 41.713 1.00 0.24 C HETATM 2640 O67 SFM A 101 33.449 1.373 41.229 1.00 -0.39 O HETATM 2641 N6 SFM A 101 34.188 3.090 42.523 1.00 -0.24 N HETATM 2642 C5 SFM A 101 35.309 2.348 43.122 1.00 0.07 C HETATM 2643 C4 SFM A 101 35.283 2.246 44.661 1.00 -0.02 C HETATM 2644 C3 SFM A 101 34.937 3.591 45.281 1.00 0.01 C HETATM 2645 C2 SFM A 101 33.710 4.244 44.623 1.00 0.10 C HETATM 2646 N65 SFM A 101 33.865 4.308 43.146 1.00 0.38 N HETATM 2647 H34 SFM A 101 32.996 4.637 42.756 1.00 0.23 H HETATM 2648 H35 SFM A 101 34.598 4.968 42.938 1.00 0.23 H HETATM 2649 C1 SFM A 101 33.561 5.634 45.193 1.00 0.29 C HETATM 2650 O66 SFM A 101 34.012 6.609 44.621 1.00 -0.36 O HETATM 2651 O65 SFM A 101 32.914 5.622 46.347 1.00 -0.26 O HETATM 2652 C23 SFM A 101 32.674 6.887 46.997 1.00 0.12 C HETATM 2653 C22 SFM A 101 31.259 7.441 46.693 1.00 0.01 C HETATM 2654 C21 SFM A 101 31.063 7.856 45.247 1.00 -0.08 C HETATM 2655 C20 SFM A 101 29.940 7.614 44.615 1.00 -0.09 C HETATM 2656 C19 SFM A 101 29.782 7.977 43.357 1.00 -0.09 C HETATM 2657 C18 SFM A 101 28.644 7.725 42.749 1.00 -0.06 C HETATM 2658 C17 SFM A 101 28.504 8.146 41.268 1.00 0.09 C HETATM 2659 O73 SFM A 101 27.451 9.086 41.055 1.00 -0.38 O HETATM 2660 H44 SFM A 101 27.409 9.309 40.133 1.00 0.21 H HETATM 2661 C16 SFM A 101 28.359 6.906 40.360 1.00 0.02 C HETATM 2662 C50 SFM A 101 29.497 5.962 40.765 1.00 -0.06 C HETATM 2663 H46 SFM A 101 29.453 5.050 40.152 1.00 0.02 H HETATM 2664 H47 SFM A 101 29.392 5.695 41.827 1.00 0.02 H HETATM 2665 H48 SFM A 101 30.463 6.463 40.607 1.00 0.02 H HETATM 2666 C15 SFM A 101 28.566 7.350 38.860 1.00 0.08 C HETATM 2667 O72 SFM A 101 29.942 7.694 38.631 1.00 -0.39 O HETATM 2668 H50 SFM A 101 30.188 8.410 39.205 1.00 0.21 H HETATM 2669 H49 SFM A 101 27.955 8.252 38.704 1.00 0.06 H HETATM 2670 H45 SFM A 101 27.378 6.427 40.491 1.00 0.04 H HETATM 2671 H43 SFM A 101 29.441 8.649 40.986 1.00 0.08 H HETATM 2672 H42 SFM A 101 27.825 7.235 43.273 1.00 0.06 H HETATM 2673 H41 SFM A 101 30.588 8.482 42.826 1.00 0.04 H HETATM 2674 H40 SFM A 101 29.128 7.107 45.135 1.00 0.04 H HETATM 2675 H39 SFM A 101 31.871 8.365 44.724 1.00 0.06 H HETATM 2676 H37 SFM A 101 31.085 8.319 47.333 1.00 0.05 H HETATM 2677 H38 SFM A 101 30.522 6.661 46.933 1.00 0.05 H HETATM 2678 C24 SFM A 101 32.810 6.606 48.468 1.00 -0.05 C HETATM 2679 C49 SFM A 101 32.361 5.238 48.929 1.00 -0.04 C HETATM 2680 H51 SFM A 101 32.508 5.151 50.016 1.00 0.04 H HETATM 2681 H52 SFM A 101 32.953 4.466 48.416 1.00 0.04 H HETATM 2682 H53 SFM A 101 31.296 5.102 48.691 1.00 0.04 H HETATM 2683 C25 SFM A 101 33.232 7.477 49.304 1.00 -0.08 C HETATM 2684 C26 SFM A 101 33.295 7.077 50.750 1.00 0.05 C HETATM 2685 O78 SFM A 101 33.850 8.139 51.444 1.00 -0.39 O HETATM 2686 H57 SFM A 101 33.304 8.908 51.333 1.00 0.21 H HETATM 2687 H55 SFM A 101 33.923 6.181 50.866 1.00 0.06 H HETATM 2688 H56 SFM A 101 32.283 6.867 51.128 1.00 0.06 H HETATM 2689 H54 SFM A 101 33.534 8.472 48.979 1.00 0.03 H HETATM 2690 H36 SFM A 101 33.425 7.624 46.675 1.00 0.08 H HETATM 2691 H33 SFM A 101 32.813 3.653 44.860 1.00 0.11 H HETATM 2692 H31 SFM A 101 35.799 4.265 45.166 1.00 0.03 H HETATM 2693 H32 SFM A 101 34.727 3.443 46.350 1.00 0.03 H HETATM 2694 H29 SFM A 101 36.273 1.927 45.019 1.00 0.03 H HETATM 2695 H30 SFM A 101 34.528 1.505 44.962 1.00 0.03 H HETATM 2696 H27 SFM A 101 36.243 2.850 42.830 1.00 0.06 H HETATM 2697 H28 SFM A 101 35.298 1.327 42.713 1.00 0.06 H HETATM 2698 H19 SFM A 101 32.115 4.301 41.670 1.00 0.08 H HETATM 2699 H18 SFM A 101 31.054 2.357 39.671 1.00 0.19 H HETATM 2700 O69 SFM A 101 32.629 5.019 39.413 1.00 -0.39 O HETATM 2701 H10 SFM A 101 30.618 3.152 37.581 1.00 0.08 H HETATM 2702 H9 SFM A 101 30.781 6.162 37.769 1.00 0.19 H HETATM 2703 H8 SFM A 101 27.099 5.948 38.019 1.00 0.06 H HETATM 2704 H6 SFM A 101 27.544 7.776 36.320 1.00 0.03 H HETATM 2705 H7 SFM A 101 29.195 7.107 36.092 1.00 0.03 H HETATM 2706 H4 SFM A 101 28.285 4.994 35.308 1.00 0.05 H HETATM 2707 H5 SFM A 101 26.612 5.540 35.669 1.00 0.05 H HETATM 2708 H1 SFM A 101 28.137 4.615 32.989 1.00 0.05 H HETATM 2709 H2 SFM A 101 28.665 6.121 32.165 1.00 0.05 H HETATM 2710 H3 SFM A 101 26.954 5.587 32.049 1.00 0.05 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 2601 2602 2708 2709 2710 CONECT 2602 2601 2603 2604 CONECT 2603 2602 CONECT 2604 2602 2605 2706 2707 CONECT 2605 2604 2606 2704 2705 CONECT 2606 2605 2607 2666 2703 CONECT 2607 2606 2608 2609 CONECT 2608 2607 CONECT 2609 2607 2610 2702 CONECT 2610 2609 2611 2621 2701 CONECT 2611 2610 2612 2616 2620 CONECT 2612 2611 2613 2614 2615 CONECT 2613 2612 CONECT 2614 2612 CONECT 2615 2612 CONECT 2616 2611 2617 2618 2619 CONECT 2617 2616 CONECT 2618 2616 CONECT 2619 2616 CONECT 2620 2611 CONECT 2621 2610 2622 2700 CONECT 2622 2621 2623 2699 CONECT 2623 2622 2624 2639 2698 CONECT 2624 2623 2625 2637 2638 CONECT 2625 2624 2626 2632 CONECT 2626 2625 2627 2636 CONECT 2627 2626 2628 2635 CONECT 2628 2627 2629 2634 CONECT 2629 2628 2630 2632 CONECT 2630 2629 2631 CONECT 2631 2630 CONECT 2632 2625 2629 2633 CONECT 2633 2632 CONECT 2634 2628 CONECT 2635 2627 CONECT 2636 2626 CONECT 2637 2624 CONECT 2638 2624 CONECT 2639 2623 2640 2641 CONECT 2640 2639 CONECT 2641 2639 2642 2646 CONECT 2642 2641 2643 2696 2697 CONECT 2643 2642 2644 2694 2695 CONECT 2644 2643 2645 2692 2693 CONECT 2645 2644 2646 2649 2691 CONECT 2646 2641 2645 2647 2648 CONECT 2647 2646 CONECT 2648 2646 CONECT 2649 2645 2650 2651 CONECT 2650 2649 CONECT 2651 2649 2652 CONECT 2652 2651 2653 2678 2690 CONECT 2653 2652 2654 2676 2677 CONECT 2654 2653 2655 2675 CONECT 2655 2654 2656 2674 CONECT 2656 2655 2657 2673 CONECT 2657 2656 2658 2672 CONECT 2658 2657 2659 2661 2671 CONECT 2659 2658 2660 CONECT 2660 2659 CONECT 2661 2658 2662 2666 2670 CONECT 2662 2661 2663 2664 2665 CONECT 2663 2662 CONECT 2664 2662 CONECT 2665 2662 CONECT 2666 2606 2661 2667 2669 CONECT 2667 2666 2668 CONECT 2668 2667 CONECT 2669 2666 CONECT 2670 2661 CONECT 2671 2658 CONECT 2672 2657 CONECT 2673 2656 CONECT 2674 2655 CONECT 2675 2654 CONECT 2676 2653 CONECT 2677 2653 CONECT 2678 2652 2679 2683 CONECT 2679 2678 2680 2681 2682 CONECT 2680 2679 CONECT 2681 2679 CONECT 2682 2679 CONECT 2683 2678 2684 2689 CONECT 2684 2683 2685 2687 2688 CONECT 2685 2684 2686 CONECT 2686 2685 CONECT 2687 2684 CONECT 2688 2684 CONECT 2689 2683 CONECT 2690 2652 CONECT 2691 2645 CONECT 2692 2644 CONECT 2693 2644 CONECT 2694 2643 CONECT 2695 2643 CONECT 2696 2642 CONECT 2697 2642 CONECT 2698 2623 CONECT 2699 2622 CONECT 2700 2621 CONECT 2701 2610 CONECT 2702 2609 CONECT 2703 2606 CONECT 2704 2605 CONECT 2705 2605 CONECT 2706 2604 CONECT 2707 2604 CONECT 2708 2601 CONECT 2709 2601 CONECT 2710 2601 MASTER 0 0 0 0 0 0 0 0 2709 1 114 13 END
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Structure:
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PDBbind
165aa, >6GJJ_1|Chain... at 100%
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165aa, >6GJL_1|Chain... at 100%
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165aa, >6GJM_1|Chain... at 100%
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1nmk
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
peptidyl-prolyl cis-trans isomerase a
Ligand Name
SFM
EC.Number
E.C.5.2.1.8
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
IC50=5.7nM
Release Year
2003
Protein/NA Sequence
Check fasta file
Primary Reference
J.Am.Chem.Soc. v125 pp. 3849-59, 2003
Ligand Properties
Formula
C
3
9
H
5
7
N
4
O
1
0
Molecular Weight
741.891
Exact Mass
741.407
No. of atoms
110
No. of bonds
112
Polar Surface Area
219.41
LOGP Value
2.89 (
Computed with XLOGP3
)
2.90 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 3
Canonical SMILES
OC/C=C(/[C@@H]1C/C=C/C=C/[C@H](O)[C@H](C)[C@@H](O)[C@@H](CCC(=O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N2[NH2+][C@H](C(=O)O1)CCC2)Cc1cccc(c1)O)C(C)C)\C
InChI String
InChI=1S/C39H56N4O10/c1-23(2)34-37(50)40-31(22-27-11-9-12-28(46)21-27)38(51)43-19-10-13-30(42-43)39(52)53-33(24(3)18-20-44)15-8-6-7-14-32(47)26(5)35(48)29(36(49)41-34)17-16-25(4)45/h6-9,11-12,14,18,21,23,26,29-35,42,44,46-48H,10,13,15-17,19-20,22H2,1-5H3,(H,40,50)(H,41,49)/p+1/b8-6+,14-7+,24-18+/t26-,29+,30-,31-,32-,33-,34-,35+/m0/s1
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):
P62937
Entrez Gene ID
NCBI Entrez Gene ID:
5478
ASD
Information of known allosteric effects of PDB entries
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