Browse entries in the PDBbind-CN Database
HEADER 4X1P_COMPLEX COMPND 4X1P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 U 247 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 U 247 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 U 247 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 U 247 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 U 247 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 U 247 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 U 247 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 U 247 LEU ALA TYR HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 U 247 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 U 247 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 U 247 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 U 247 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 U 247 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 U 247 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 U 247 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 U 247 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 U 247 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 U 247 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 U 247 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR LYS GLU HET CYS A 422 144 SSBOND 1 CYS U 42 CYS U 58 SSBOND 2 CYS U 50 CYS U 111 SSBOND 3 CYS U 168 CYS U 182 SSBOND 4 CYS U 136 CYS U 201 SSBOND 5 CYS U 191 CYS U 220 ATOM 1 N ILE U 16 34.758 9.079 -8.202 1.00 10.97 N ATOM 2 CA ILE U 16 36.187 9.607 -8.156 1.00 11.67 C ATOM 3 C ILE U 16 36.971 9.115 -9.340 1.00 12.24 C ATOM 4 O ILE U 16 37.140 7.939 -9.433 1.00 13.25 O ATOM 5 CB ILE U 16 36.871 9.259 -6.818 1.00 14.07 C ATOM 6 CG1 ILE U 16 35.958 9.683 -5.684 1.00 11.81 C ATOM 7 CG2 ILE U 16 38.286 9.762 -6.742 1.00 14.03 C ATOM 8 CD1 ILE U 16 35.953 11.214 -5.410 1.00 13.35 C ATOM 9 HN3 ILE U 16 34.773 8.039 -8.188 1.00 0.00 H ATOM 10 HN2 ILE U 16 34.296 9.409 -9.073 1.00 0.00 H ATOM 11 HN1 ILE U 16 34.233 9.430 -7.376 1.00 0.00 H ATOM 12 N ILE U 17 37.419 10.066 -10.200 1.00 11.31 N ATOM 13 CA ILE U 17 38.283 9.688 -11.306 1.00 11.55 C ATOM 14 C ILE U 17 39.713 9.648 -10.691 1.00 12.19 C ATOM 15 O ILE U 17 40.083 10.578 -9.962 1.00 13.57 O ATOM 16 CB ILE U 17 38.337 10.821 -12.363 1.00 13.53 C ATOM 17 CG1 ILE U 17 36.922 11.261 -12.767 1.00 13.51 C ATOM 18 CG2 ILE U 17 39.248 10.504 -13.516 1.00 15.16 C ATOM 19 CD1 ILE U 17 36.014 10.164 -13.262 1.00 13.23 C ATOM 20 H ILE U 17 37.145 11.060 -10.068 1.00 0.00 H ATOM 21 N GLY U 18 40.489 8.612 -11.023 1.00 12.79 N ATOM 22 CA GLY U 18 41.808 8.475 -10.456 1.00 14.16 C ATOM 23 C GLY U 18 41.752 8.242 -8.919 1.00 15.44 C ATOM 24 O GLY U 18 40.811 7.603 -8.441 1.00 16.19 O ATOM 25 H GLY U 18 40.139 7.899 -11.695 1.00 0.00 H ATOM 26 N GLY U 19 42.702 8.765 -8.149 1.00 14.44 N ATOM 27 CA GLY U 19 42.669 8.485 -6.705 1.00 12.43 C ATOM 28 C GLY U 19 42.896 7.078 -6.380 1.00 14.11 C ATOM 29 O GLY U 19 43.536 6.343 -7.179 1.00 14.93 O ATOM 30 H GLY U 19 43.451 9.359 -8.558 1.00 0.00 H ATOM 31 N GLU U 20 42.396 6.677 -5.198 1.00 13.02 N ATOM 32 CA GLU U 20 42.701 5.392 -4.681 1.00 13.03 C ATOM 33 C GLU U 20 41.506 4.855 -3.968 1.00 13.07 C ATOM 34 O GLU U 20 40.626 5.622 -3.423 1.00 13.85 O ATOM 35 CB GLU U 20 43.931 5.469 -3.778 1.00 14.75 C ATOM 36 CG GLU U 20 43.665 6.444 -2.611 1.00 16.44 C ATOM 37 CD GLU U 20 44.953 7.086 -2.010 1.00 19.29 C ATOM 38 OE1 GLU U 20 45.721 7.746 -2.733 1.00 22.09 O ATOM 39 OE2 GLU U 20 45.157 6.936 -0.788 1.00 23.14 O ATOM 40 H GLU U 20 41.779 7.316 -4.657 1.00 0.00 H ATOM 41 N PHE U 21 41.459 3.544 -3.922 1.00 11.40 N ATOM 42 CA PHE U 21 40.458 2.930 -3.028 1.00 11.51 C ATOM 43 C PHE U 21 40.746 3.179 -1.602 1.00 13.31 C ATOM 44 O PHE U 21 41.882 3.375 -1.243 1.00 14.46 O ATOM 45 CB PHE U 21 40.248 1.453 -3.317 1.00 11.71 C ATOM 46 CG PHE U 21 39.579 1.223 -4.663 1.00 12.10 C ATOM 47 CD1 PHE U 21 38.211 1.445 -4.827 1.00 12.01 C ATOM 48 CD2 PHE U 21 40.352 0.877 -5.805 1.00 11.88 C ATOM 49 CE1 PHE U 21 37.571 1.275 -6.045 1.00 12.82 C ATOM 50 CE2 PHE U 21 39.743 0.672 -7.045 1.00 13.44 C ATOM 51 CZ PHE U 21 38.344 0.872 -7.176 1.00 12.64 C ATOM 52 H PHE U 21 42.103 2.960 -4.494 1.00 0.00 H ATOM 53 N THR U 22 39.684 3.117 -0.816 1.00 13.29 N ATOM 54 CA THR U 22 39.828 3.332 0.617 1.00 13.91 C ATOM 55 C THR U 22 38.779 2.519 1.373 1.00 13.29 C ATOM 56 O THR U 22 37.927 1.862 0.778 1.00 14.59 O ATOM 57 CB THR U 22 39.814 4.869 0.905 1.00 15.52 C ATOM 58 OG1 THR U 22 40.328 5.124 2.237 1.00 18.17 O ATOM 59 CG2 THR U 22 38.424 5.512 0.826 1.00 15.40 C ATOM 60 HG1 THR U 22 39.761 4.660 2.903 1.00 0.00 H ATOM 61 H THR U 22 38.748 2.915 -1.221 1.00 0.00 H ATOM 62 N THR U 23 38.744 2.725 2.671 1.00 13.85 N ATOM 63 CA THR U 23 37.631 2.193 3.501 1.00 12.98 C ATOM 64 C THR U 23 37.230 3.314 4.446 1.00 12.44 C ATOM 65 O THR U 23 37.841 4.359 4.558 1.00 14.67 O ATOM 66 CB THR U 23 38.050 0.954 4.340 1.00 14.63 C ATOM 67 OG1 THR U 23 39.241 1.366 5.109 1.00 17.25 O ATOM 68 CG2 THR U 23 38.308 -0.265 3.463 1.00 16.68 C ATOM 69 HG1 THR U 23 39.007 2.131 5.692 1.00 0.00 H ATOM 70 H THR U 23 39.506 3.268 3.124 1.00 0.00 H ATOM 71 N ILE U 24 36.092 3.052 5.125 1.00 12.95 N ATOM 72 CA ILE U 24 35.399 4.129 5.876 1.00 12.28 C ATOM 73 C ILE U 24 36.207 4.555 7.073 1.00 11.60 C ATOM 74 O ILE U 24 36.008 5.674 7.539 1.00 13.36 O ATOM 75 CB ILE U 24 34.026 3.560 6.249 1.00 11.76 C ATOM 76 CG1 ILE U 24 33.056 4.645 6.754 1.00 13.55 C ATOM 77 CG2 ILE U 24 34.077 2.436 7.280 1.00 14.05 C ATOM 78 CD1 ILE U 24 32.789 5.751 5.733 1.00 15.49 C ATOM 79 H ILE U 24 35.699 2.089 5.122 1.00 0.00 H ATOM 80 N GLU U 25 37.136 3.721 7.552 1.00 12.73 N ATOM 81 CA GLU U 25 37.986 4.224 8.620 1.00 12.90 C ATOM 82 C GLU U 25 38.764 5.448 8.254 1.00 12.39 C ATOM 83 O GLU U 25 39.150 6.197 9.189 1.00 13.99 O ATOM 84 CB GLU U 25 39.047 3.127 9.029 1.00 14.21 C ATOM 85 CG GLU U 25 38.432 1.887 9.682 1.00 14.07 C ATOM 86 CD GLU U 25 37.878 0.881 8.751 1.00 15.52 C ATOM 87 OE1 GLU U 25 37.880 1.102 7.494 1.00 17.73 O ATOM 88 OE2 GLU U 25 37.544 -0.213 9.226 1.00 19.59 O ATOM 89 H GLU U 25 37.246 2.757 7.178 1.00 0.00 H ATOM 90 N ASN U 26 39.039 5.673 6.962 1.00 12.35 N ATOM 91 CA ASN U 26 39.813 6.806 6.504 1.00 13.24 C ATOM 92 C ASN U 26 38.922 8.039 6.164 1.00 14.51 C ATOM 93 O ASN U 26 39.414 9.080 5.767 1.00 16.37 O ATOM 94 CB ASN U 26 40.594 6.388 5.278 1.00 13.33 C ATOM 95 CG ASN U 26 41.653 5.402 5.592 1.00 13.48 C ATOM 96 OD1 ASN U 26 42.202 5.424 6.702 1.00 15.29 O ATOM 97 ND2 ASN U 26 41.812 4.409 4.686 1.00 14.33 N ATOM 98 HD22 ASN U 26 41.319 4.456 3.771 1.00 0.00 H ATOM 99 HD21 ASN U 26 42.427 3.599 4.905 1.00 0.00 H ATOM 100 H ASN U 26 38.679 5.001 6.255 1.00 0.00 H ATOM 101 N GLN U 27 37.638 7.892 6.425 1.00 13.55 N ATOM 102 CA GLN U 27 36.683 9.040 6.155 1.00 14.37 C ATOM 103 C GLN U 27 35.407 8.721 6.969 1.00 12.62 C ATOM 104 O GLN U 27 34.296 8.501 6.433 1.00 13.20 O ATOM 105 CB GLN U 27 36.378 9.203 4.639 1.00 12.64 C ATOM 106 CG GLN U 27 35.806 10.622 4.374 1.00 14.22 C ATOM 107 CD GLN U 27 36.848 11.744 4.262 1.00 15.20 C ATOM 108 OE1 GLN U 27 36.502 12.950 3.984 1.00 15.96 O ATOM 109 NE2 GLN U 27 38.107 11.424 4.482 1.00 16.49 N ATOM 110 HE22 GLN U 27 38.362 10.441 4.705 1.00 0.00 H ATOM 111 HE21 GLN U 27 38.846 12.155 4.432 1.00 0.00 H ATOM 112 H GLN U 27 37.282 6.995 6.813 1.00 0.00 H ATOM 113 N PRO U 28 35.536 8.628 8.299 1.00 13.24 N ATOM 114 CA PRO U 28 34.441 7.951 9.033 1.00 11.73 C ATOM 115 C PRO U 28 33.167 8.791 9.284 1.00 12.00 C ATOM 116 O PRO U 28 32.190 8.237 9.800 1.00 15.72 O ATOM 117 CB PRO U 28 35.083 7.606 10.409 1.00 13.09 C ATOM 118 CG PRO U 28 36.240 8.524 10.526 1.00 14.30 C ATOM 119 CD PRO U 28 36.769 8.832 9.115 1.00 12.91 C ATOM 120 N TRP U 29 33.239 10.019 8.792 1.00 12.31 N ATOM 121 CA TRP U 29 32.033 10.907 8.715 1.00 13.38 C ATOM 122 C TRP U 29 31.304 10.691 7.432 1.00 13.03 C ATOM 123 O TRP U 29 30.201 11.257 7.208 1.00 13.06 O ATOM 124 CB TRP U 29 32.404 12.406 8.882 1.00 13.19 C ATOM 125 CG TRP U 29 33.598 12.763 8.009 1.00 14.65 C ATOM 126 CD1 TRP U 29 33.607 13.172 6.697 1.00 15.51 C ATOM 127 CD2 TRP U 29 34.987 12.710 8.413 1.00 14.00 C ATOM 128 NE1 TRP U 29 34.898 13.396 6.284 1.00 17.40 N ATOM 129 CE2 TRP U 29 35.786 13.029 7.268 1.00 15.71 C ATOM 130 CE3 TRP U 29 35.631 12.370 9.599 1.00 14.23 C ATOM 131 CZ2 TRP U 29 37.181 13.097 7.338 1.00 16.59 C ATOM 132 CZ3 TRP U 29 36.991 12.411 9.643 1.00 17.02 C ATOM 133 CH2 TRP U 29 37.752 12.752 8.523 1.00 17.11 C ATOM 134 HE1 TRP U 29 35.166 13.788 5.359 1.00 0.00 H ATOM 135 H TRP U 29 34.154 10.376 8.451 1.00 0.00 H ATOM 136 N PHE U 30 31.799 9.844 6.532 1.00 12.23 N ATOM 137 CA PHE U 30 31.138 9.798 5.206 1.00 10.74 C ATOM 138 C PHE U 30 29.824 9.028 5.301 1.00 10.73 C ATOM 139 O PHE U 30 29.777 7.949 5.898 1.00 13.11 O ATOM 140 CB PHE U 30 32.038 9.023 4.227 1.00 10.14 C ATOM 141 CG PHE U 30 31.449 8.940 2.836 1.00 10.63 C ATOM 142 CD1 PHE U 30 31.488 10.053 2.029 1.00 10.53 C ATOM 143 CD2 PHE U 30 30.807 7.775 2.422 1.00 10.41 C ATOM 144 CE1 PHE U 30 30.915 10.054 0.728 1.00 11.75 C ATOM 145 CE2 PHE U 30 30.187 7.774 1.131 1.00 10.82 C ATOM 146 CZ PHE U 30 30.269 8.869 0.315 1.00 11.69 C ATOM 147 H PHE U 30 32.616 9.239 6.750 1.00 0.00 H ATOM 148 N ALA U 31 28.744 9.616 4.731 1.00 9.92 N ATOM 149 CA ALA U 31 27.434 8.973 4.747 1.00 10.73 C ATOM 150 C ALA U 31 27.032 8.647 3.324 1.00 11.97 C ATOM 151 O ALA U 31 27.221 9.424 2.416 1.00 13.00 O ATOM 152 CB ALA U 31 26.422 10.039 5.296 1.00 11.74 C ATOM 153 H ALA U 31 28.851 10.544 4.273 1.00 0.00 H ATOM 154 N ALA U 32 26.516 7.441 3.162 1.00 11.15 N ATOM 155 CA ALA U 32 26.066 6.913 1.877 1.00 11.21 C ATOM 156 C ALA U 32 24.545 6.972 1.876 1.00 11.92 C ATOM 157 O ALA U 32 23.891 6.378 2.770 1.00 12.82 O ATOM 158 CB ALA U 32 26.589 5.478 1.802 1.00 12.25 C ATOM 159 H ALA U 32 26.425 6.832 4.000 1.00 0.00 H ATOM 160 N ILE U 33 24.006 7.760 0.911 1.00 12.06 N ATOM 161 CA ILE U 33 22.560 8.019 0.863 1.00 12.72 C ATOM 162 C ILE U 33 21.872 7.360 -0.318 1.00 12.54 C ATOM 163 O ILE U 33 22.403 7.456 -1.435 1.00 12.98 O ATOM 164 CB ILE U 33 22.376 9.542 0.837 1.00 12.30 C ATOM 165 CG1 ILE U 33 23.169 10.173 2.074 1.00 13.81 C ATOM 166 CG2 ILE U 33 20.880 9.809 0.928 1.00 12.22 C ATOM 167 CD1 ILE U 33 23.233 11.716 2.021 1.00 13.61 C ATOM 168 H ILE U 33 24.626 8.187 0.194 1.00 0.00 H ATOM 169 N TYR U 34 20.829 6.549 -0.048 1.00 13.93 N ATOM 170 CA TYR U 34 20.130 5.786 -1.024 1.00 14.39 C ATOM 171 C TYR U 34 18.637 6.188 -1.070 1.00 14.13 C ATOM 172 O TYR U 34 18.133 6.735 -0.131 1.00 14.58 O ATOM 173 CB TYR U 34 20.193 4.324 -0.683 1.00 14.67 C ATOM 174 CG TYR U 34 21.629 3.731 -0.590 1.00 13.81 C ATOM 175 CD1 TYR U 34 22.474 3.953 0.567 1.00 14.99 C ATOM 176 CD2 TYR U 34 22.084 2.892 -1.623 1.00 13.46 C ATOM 177 CE1 TYR U 34 23.779 3.385 0.636 1.00 14.63 C ATOM 178 CE2 TYR U 34 23.354 2.320 -1.548 1.00 14.50 C ATOM 179 CZ TYR U 34 24.153 2.592 -0.458 1.00 15.91 C ATOM 180 OH TYR U 34 25.433 2.045 -0.293 1.00 15.61 O ATOM 181 HH TYR U 34 25.368 1.057 -0.267 1.00 0.00 H ATOM 182 H TYR U 34 20.514 6.476 0.941 1.00 0.00 H ATOM 183 N ARG U 35 17.998 5.900 -2.207 1.00 15.59 N ATOM 184 CA ARG U 35 16.565 6.155 -2.416 1.00 17.56 C ATOM 185 C ARG U 35 15.802 4.864 -2.703 1.00 19.40 C ATOM 186 O ARG U 35 16.242 4.128 -3.465 1.00 17.90 O ATOM 187 CB ARG U 35 16.314 7.113 -3.591 1.00 21.53 C ATOM 188 CG ARG U 35 14.847 7.549 -3.714 1.00 23.38 C ATOM 189 CD ARG U 35 14.638 8.716 -4.661 1.00 25.74 C ATOM 190 NE ARG U 35 14.982 8.460 -6.051 1.00 32.93 N ATOM 191 CZ ARG U 35 14.166 7.895 -6.944 1.00 39.02 C ATOM 192 NH1 ARG U 35 12.964 7.477 -6.606 1.00 36.93 N ATOM 193 NH2 ARG U 35 14.562 7.774 -8.178 1.00 37.44 N ATOM 194 HE ARG U 35 15.932 8.737 -6.372 1.00 0.00 H ATOM 195 HH12 ARG U 35 12.346 7.040 -7.319 1.00 0.00 H ATOM 196 HH11 ARG U 35 12.633 7.584 -5.626 1.00 0.00 H ATOM 197 HH22 ARG U 35 13.937 7.336 -8.884 1.00 0.00 H ATOM 198 HH21 ARG U 35 15.504 8.115 -8.458 1.00 0.00 H ATOM 199 H ARG U 35 18.542 5.474 -2.984 1.00 0.00 H ATOM 200 N ARG U 36 14.663 4.650 -2.061 1.00 19.24 N ATOM 201 CA ARG U 36 13.774 3.543 -2.363 1.00 26.86 C ATOM 202 C ARG U 36 12.758 3.908 -3.424 1.00 28.65 C ATOM 203 O ARG U 36 12.173 4.940 -3.386 1.00 26.99 O ATOM 204 CB ARG U 36 13.085 3.023 -1.093 1.00 30.71 C ATOM 205 CG ARG U 36 12.339 1.715 -1.322 1.00 38.50 C ATOM 206 CD ARG U 36 11.451 1.299 -0.148 1.00 46.53 C ATOM 207 NE ARG U 36 10.446 0.268 -0.498 1.00 55.80 N ATOM 208 CZ ARG U 36 9.279 0.479 -1.105 1.00 52.88 C ATOM 209 NH1 ARG U 36 8.932 1.677 -1.492 1.00 46.04 N ATOM 210 NH2 ARG U 36 8.466 -0.551 -1.367 1.00 47.45 N ATOM 211 HE ARG U 36 10.673 -0.715 -0.246 1.00 0.00 H ATOM 212 HH12 ARG U 36 8.018 1.826 -1.965 1.00 0.00 H ATOM 213 HH11 ARG U 36 9.570 2.482 -1.328 1.00 0.00 H ATOM 214 HH22 ARG U 36 7.555 -0.387 -1.841 1.00 0.00 H ATOM 215 HH21 ARG U 36 8.745 -1.516 -1.097 1.00 0.00 H ATOM 216 H ARG U 36 14.392 5.308 -1.303 1.00 0.00 H ATOM 217 N HIS U 37 12.608 3.037 -4.393 1.00 26.57 N ATOM 218 CA HIS U 37 11.699 3.231 -5.491 1.00 33.32 C ATOM 219 C HIS U 37 10.353 2.638 -5.256 1.00 32.55 C ATOM 220 O HIS U 37 10.195 1.664 -4.546 1.00 35.52 O ATOM 221 CB HIS U 37 12.296 2.625 -6.719 1.00 32.27 C ATOM 222 CG HIS U 37 13.507 3.337 -7.202 1.00 32.35 C ATOM 223 ND1 HIS U 37 13.523 4.041 -8.312 1.00 37.91 N ATOM 224 CD2 HIS U 37 14.778 3.419 -6.678 1.00 35.27 C ATOM 225 CE1 HIS U 37 14.731 4.565 -8.493 1.00 39.64 C ATOM 226 NE2 HIS U 37 15.489 4.191 -7.480 1.00 33.57 N ATOM 227 H HIS U 37 13.173 2.164 -4.366 1.00 0.00 H ATOM 228 N ARG U 37A 9.374 3.283 -5.870 1.00 57.02 N ATOM 229 CA ARG U 37A 7.989 2.821 -5.913 1.00 61.99 C ATOM 230 C ARG U 37A 7.824 1.288 -5.793 1.00 65.10 C ATOM 231 O ARG U 37A 7.152 0.803 -4.900 1.00 66.30 O ATOM 232 CB ARG U 37A 7.327 3.408 -7.157 1.00 58.65 C ATOM 233 CG ARG U 37A 7.712 4.876 -7.459 1.00 58.37 C ATOM 234 CD ARG U 37A 9.141 5.302 -7.022 1.00 55.45 C ATOM 235 NE ARG U 37A 9.879 6.207 -7.906 1.00 40.87 N ATOM 236 CZ ARG U 37A 10.590 5.826 -8.958 1.00 46.57 C ATOM 237 NH1 ARG U 37A 10.663 4.574 -9.297 1.00 47.80 N ATOM 238 NH2 ARG U 37A 11.281 6.674 -9.653 1.00 51.44 N ATOM 239 HE ARG U 37A 9.843 7.224 -7.693 1.00 0.00 H ATOM 240 HH12 ARG U 37A 11.225 4.291 -10.125 1.00 0.00 H ATOM 241 HH11 ARG U 37A 10.159 3.854 -8.740 1.00 0.00 H ATOM 242 HH22 ARG U 37A 11.830 6.348 -10.474 1.00 0.00 H ATOM 243 HH21 ARG U 37A 11.286 7.680 -9.390 1.00 0.00 H ATOM 244 H ARG U 37A 9.605 4.175 -6.352 1.00 0.00 H ATOM 245 N GLY U 37B 8.458 0.530 -6.654 1.00 45.39 N ATOM 246 CA GLY U 37B 8.374 -0.898 -6.533 1.00 45.57 C ATOM 247 C GLY U 37B 9.405 -1.579 -5.667 1.00 39.79 C ATOM 248 O GLY U 37B 9.560 -2.778 -5.725 1.00 51.01 O ATOM 249 H GLY U 37B 9.017 0.959 -7.418 1.00 0.00 H ATOM 250 N GLY U 37C 10.136 -0.816 -4.857 1.00 42.18 N ATOM 251 CA GLY U 37C 10.985 -1.401 -3.836 1.00 43.03 C ATOM 252 C GLY U 37C 12.478 -1.551 -4.044 1.00 36.43 C ATOM 253 O GLY U 37C 13.171 -1.832 -3.119 1.00 42.15 O ATOM 254 H GLY U 37C 10.098 0.218 -4.958 1.00 0.00 H ATOM 255 N SER U 37D 12.956 -1.342 -5.252 1.00 31.32 N ATOM 256 CA SER U 37D 14.404 -1.321 -5.448 1.00 27.64 C ATOM 257 C SER U 37D 15.007 -0.086 -4.811 1.00 28.80 C ATOM 258 O SER U 37D 14.340 0.864 -4.692 1.00 31.87 O ATOM 259 CB SER U 37D 14.737 -1.341 -6.909 1.00 26.99 C ATOM 260 OG SER U 37D 14.053 -0.357 -7.593 1.00 39.22 O ATOM 261 HG SER U 37D 13.079 -0.501 -7.490 1.00 0.00 H ATOM 262 H SER U 37D 12.313 -1.194 -6.056 1.00 0.00 H ATOM 263 N VAL U 38 16.272 -0.174 -4.417 1.00 24.85 N ATOM 264 CA VAL U 38 16.970 0.874 -3.725 1.00 24.28 C ATOM 265 C VAL U 38 18.218 1.235 -4.513 1.00 24.47 C ATOM 266 O VAL U 38 18.967 0.391 -4.847 1.00 26.35 O ATOM 267 CB VAL U 38 17.385 0.401 -2.343 1.00 20.71 C ATOM 268 CG1 VAL U 38 18.253 1.411 -1.666 1.00 19.93 C ATOM 269 CG2 VAL U 38 16.180 0.116 -1.475 1.00 24.80 C ATOM 270 H VAL U 38 16.788 -1.054 -4.621 1.00 0.00 H ATOM 271 N THR U 39 18.387 2.493 -4.830 1.00 17.16 N ATOM 272 CA THR U 39 19.511 2.918 -5.612 1.00 17.71 C ATOM 273 C THR U 39 20.335 4.010 -4.890 1.00 15.69 C ATOM 274 O THR U 39 19.810 4.687 -4.141 1.00 15.76 O ATOM 275 CB THR U 39 19.037 3.418 -6.951 1.00 21.34 C ATOM 276 OG1 THR U 39 18.115 4.485 -6.777 1.00 22.32 O ATOM 277 CG2 THR U 39 18.373 2.260 -7.710 1.00 20.37 C ATOM 278 HG1 THR U 39 18.557 5.226 -6.291 1.00 0.00 H ATOM 279 H THR U 39 17.693 3.198 -4.509 1.00 0.00 H ATOM 280 N TYR U 40 21.631 4.098 -5.169 1.00 13.76 N ATOM 281 CA TYR U 40 22.455 5.123 -4.518 1.00 14.75 C ATOM 282 C TYR U 40 22.131 6.509 -5.090 1.00 15.69 C ATOM 283 O TYR U 40 21.938 6.683 -6.347 1.00 17.42 O ATOM 284 CB TYR U 40 23.907 4.807 -4.820 1.00 15.17 C ATOM 285 CG TYR U 40 24.836 5.710 -4.037 1.00 13.62 C ATOM 286 CD1 TYR U 40 24.961 5.562 -2.672 1.00 13.76 C ATOM 287 CD2 TYR U 40 25.651 6.614 -4.703 1.00 12.00 C ATOM 288 CE1 TYR U 40 25.847 6.353 -1.945 1.00 12.80 C ATOM 289 CE2 TYR U 40 26.563 7.438 -4.002 1.00 14.17 C ATOM 290 CZ TYR U 40 26.677 7.249 -2.622 1.00 11.88 C ATOM 291 OH TYR U 40 27.539 7.954 -1.861 1.00 12.45 O ATOM 292 HH TYR U 40 28.463 7.795 -2.178 1.00 0.00 H ATOM 293 H TYR U 40 22.062 3.440 -5.849 1.00 0.00 H ATOM 294 N VAL U 41 22.115 7.483 -4.218 1.00 12.10 N ATOM 295 CA VAL U 41 21.858 8.877 -4.567 1.00 13.62 C ATOM 296 C VAL U 41 23.101 9.663 -4.539 1.00 13.53 C ATOM 297 O VAL U 41 23.479 10.250 -5.522 1.00 15.02 O ATOM 298 CB VAL U 41 20.853 9.454 -3.568 1.00 14.79 C ATOM 299 CG1 VAL U 41 20.578 10.927 -3.888 1.00 17.98 C ATOM 300 CG2 VAL U 41 19.569 8.634 -3.605 1.00 18.63 C ATOM 301 H VAL U 41 22.295 7.252 -3.220 1.00 0.00 H ATOM 302 N CYS U 42 23.685 9.821 -3.366 1.00 12.27 N ATOM 303 CA CYS U 42 24.733 10.866 -3.210 1.00 12.96 C ATOM 304 C CYS U 42 25.449 10.532 -1.922 1.00 12.35 C ATOM 305 O CYS U 42 25.002 9.731 -1.128 1.00 12.19 O ATOM 306 CB CYS U 42 24.065 12.256 -2.932 1.00 14.96 C ATOM 307 SG CYS U 42 23.806 13.147 -4.531 1.00 19.90 S ATOM 308 H CYS U 42 23.416 9.222 -2.560 1.00 0.00 H ATOM 309 N GLY U 43 26.549 11.258 -1.725 1.00 11.70 N ATOM 310 CA GLY U 43 27.215 11.219 -0.425 1.00 10.46 C ATOM 311 C GLY U 43 26.793 12.302 0.517 1.00 11.61 C ATOM 312 O GLY U 43 25.997 13.188 0.158 1.00 11.75 O ATOM 313 H GLY U 43 26.931 11.848 -2.491 1.00 0.00 H ATOM 314 N GLY U 44 27.259 12.197 1.783 1.00 11.17 N ATOM 315 CA GLY U 44 27.017 13.275 2.730 1.00 11.49 C ATOM 316 C GLY U 44 28.093 13.189 3.811 1.00 12.62 C ATOM 317 O GLY U 44 28.912 12.281 3.748 1.00 12.90 O ATOM 318 H GLY U 44 27.787 11.351 2.077 1.00 0.00 H ATOM 319 N SER U 45 28.023 14.093 4.805 1.00 11.89 N ATOM 320 CA SER U 45 28.992 14.054 5.913 1.00 11.72 C ATOM 321 C SER U 45 28.283 14.207 7.263 1.00 13.28 C ATOM 322 O SER U 45 27.460 15.095 7.415 1.00 12.91 O ATOM 323 CB SER U 45 29.973 15.225 5.716 1.00 12.91 C ATOM 324 OG SER U 45 30.712 15.140 4.465 1.00 13.29 O ATOM 325 HG SER U 45 30.076 15.148 3.706 1.00 0.00 H ATOM 326 H SER U 45 27.282 14.822 4.791 1.00 0.00 H ATOM 327 N LEU U 46 28.702 13.406 8.244 1.00 12.96 N ATOM 328 CA LEU U 46 28.115 13.427 9.610 1.00 12.76 C ATOM 329 C LEU U 46 28.745 14.664 10.296 1.00 14.69 C ATOM 330 O LEU U 46 29.924 14.729 10.525 1.00 14.98 O ATOM 331 CB LEU U 46 28.459 12.118 10.384 1.00 12.30 C ATOM 332 CG LEU U 46 27.630 11.996 11.647 1.00 12.91 C ATOM 333 CD1 LEU U 46 26.185 11.671 11.400 1.00 12.11 C ATOM 334 CD2 LEU U 46 28.186 10.823 12.457 1.00 14.28 C ATOM 335 H LEU U 46 29.473 12.737 8.045 1.00 0.00 H ATOM 336 N ILE U 47 27.930 15.637 10.668 1.00 15.16 N ATOM 337 CA ILE U 47 28.463 16.807 11.330 1.00 15.31 C ATOM 338 C ILE U 47 28.075 16.794 12.831 1.00 17.37 C ATOM 339 O ILE U 47 28.684 17.523 13.612 1.00 18.54 O ATOM 340 CB ILE U 47 28.080 18.123 10.647 1.00 18.16 C ATOM 341 CG1 ILE U 47 26.534 18.292 10.561 1.00 17.39 C ATOM 342 CG2 ILE U 47 28.739 18.228 9.308 1.00 15.99 C ATOM 343 CD1 ILE U 47 26.051 19.706 10.140 1.00 18.61 C ATOM 344 H ILE U 47 26.909 15.561 10.485 1.00 0.00 H ATOM 345 N SER U 48 27.109 15.970 13.190 1.00 17.56 N ATOM 346 CA SER U 48 26.819 15.700 14.617 1.00 19.01 C ATOM 347 C SER U 48 26.047 14.404 14.612 1.00 19.24 C ATOM 348 O SER U 48 25.584 13.956 13.558 1.00 19.66 O ATOM 349 CB SER U 48 26.023 16.893 15.202 1.00 21.53 C ATOM 350 OG SER U 48 24.669 16.800 14.766 1.00 24.49 O ATOM 351 HG SER U 48 24.279 15.948 15.084 1.00 0.00 H ATOM 352 H SER U 48 26.540 15.501 12.457 1.00 0.00 H ATOM 353 N PRO U 49 25.838 13.783 15.772 1.00 19.29 N ATOM 354 CA PRO U 49 25.211 12.483 15.733 1.00 18.32 C ATOM 355 C PRO U 49 23.914 12.418 14.999 1.00 18.17 C ATOM 356 O PRO U 49 23.609 11.356 14.490 1.00 17.40 O ATOM 357 CB PRO U 49 25.019 12.129 17.214 1.00 21.40 C ATOM 358 CG PRO U 49 26.184 12.861 17.847 1.00 23.98 C ATOM 359 CD PRO U 49 26.322 14.155 17.107 1.00 20.65 C ATOM 360 N CYS U 50 23.082 13.469 15.019 1.00 17.97 N ATOM 361 CA CYS U 50 21.770 13.352 14.382 1.00 20.06 C ATOM 362 C CYS U 50 21.746 14.054 13.040 1.00 18.95 C ATOM 363 O CYS U 50 20.730 14.059 12.403 1.00 18.49 O ATOM 364 CB CYS U 50 20.629 13.961 15.208 1.00 18.45 C ATOM 365 SG CYS U 50 20.641 13.254 16.901 1.00 22.92 S ATOM 366 H CYS U 50 23.366 14.356 15.481 1.00 0.00 H ATOM 367 N TRP U 51 22.870 14.535 12.564 1.00 18.59 N ATOM 368 CA TRP U 51 22.808 15.405 11.308 1.00 17.45 C ATOM 369 C TRP U 51 23.837 15.090 10.291 1.00 17.05 C ATOM 370 O TRP U 51 25.044 15.120 10.575 1.00 15.23 O ATOM 371 CB TRP U 51 22.997 16.852 11.699 1.00 18.05 C ATOM 372 CG TRP U 51 21.751 17.353 12.438 1.00 17.46 C ATOM 373 CD1 TRP U 51 21.579 17.520 13.815 1.00 21.42 C ATOM 374 CD2 TRP U 51 20.481 17.766 11.821 1.00 19.11 C ATOM 375 NE1 TRP U 51 20.282 18.000 14.085 1.00 20.25 N ATOM 376 CE2 TRP U 51 19.592 18.201 12.941 1.00 19.82 C ATOM 377 CE3 TRP U 51 20.049 17.905 10.517 1.00 18.94 C ATOM 378 CZ2 TRP U 51 18.299 18.664 12.721 1.00 19.64 C ATOM 379 CZ3 TRP U 51 18.735 18.394 10.292 1.00 16.96 C ATOM 380 CH2 TRP U 51 17.876 18.770 11.383 1.00 21.34 C ATOM 381 HE1 TRP U 51 19.906 18.176 15.038 1.00 0.00 H ATOM 382 H TRP U 51 23.778 14.330 13.028 1.00 0.00 H ATOM 383 N VAL U 52 23.354 14.861 9.088 1.00 15.15 N ATOM 384 CA VAL U 52 24.189 14.685 7.914 1.00 13.91 C ATOM 385 C VAL U 52 23.990 15.869 6.966 1.00 15.52 C ATOM 386 O VAL U 52 22.868 16.299 6.718 1.00 15.46 O ATOM 387 CB VAL U 52 23.823 13.376 7.195 1.00 14.41 C ATOM 388 CG1 VAL U 52 24.457 13.279 5.808 1.00 15.57 C ATOM 389 CG2 VAL U 52 24.324 12.143 7.985 1.00 15.93 C ATOM 390 H VAL U 52 22.322 14.803 8.973 1.00 0.00 H ATOM 391 N ILE U 53 25.104 16.387 6.438 1.00 11.09 N ATOM 392 CA ILE U 53 25.069 17.486 5.457 1.00 11.77 C ATOM 393 C ILE U 53 25.403 17.020 4.092 1.00 13.53 C ATOM 394 O ILE U 53 26.305 16.178 3.928 1.00 11.86 O ATOM 395 CB ILE U 53 25.879 18.701 5.971 1.00 13.47 C ATOM 396 CG1 ILE U 53 25.460 20.013 5.256 1.00 12.54 C ATOM 397 CG2 ILE U 53 27.360 18.404 5.892 1.00 10.54 C ATOM 398 CD1 ILE U 53 26.113 21.205 5.911 1.00 14.89 C ATOM 399 H ILE U 53 26.025 16.002 6.729 1.00 0.00 H ATOM 400 N SER U 54 24.669 17.530 3.096 1.00 10.54 N ATOM 401 CA SER U 54 24.794 17.046 1.698 1.00 12.14 C ATOM 402 C SER U 54 24.392 18.197 0.786 1.00 11.97 C ATOM 403 O SER U 54 24.587 19.360 1.201 1.00 13.27 O ATOM 404 CB SER U 54 23.918 15.753 1.538 1.00 11.10 C ATOM 405 OG SER U 54 24.190 15.165 0.231 1.00 11.77 O ATOM 406 HG SER U 54 25.150 14.932 0.169 1.00 0.00 H ATOM 407 H SER U 54 23.990 18.289 3.308 1.00 0.00 H ATOM 408 N ALA U 55 24.031 17.888 -0.456 1.00 12.44 N ATOM 409 CA ALA U 55 23.793 18.948 -1.461 1.00 12.17 C ATOM 410 C ALA U 55 22.267 18.855 -1.798 1.00 12.51 C ATOM 411 O ALA U 55 21.753 17.761 -2.081 1.00 13.71 O ATOM 412 CB ALA U 55 24.594 18.592 -2.728 1.00 13.22 C ATOM 413 H ALA U 55 23.915 16.890 -0.724 1.00 0.00 H ATOM 414 N THR U 56 21.565 19.995 -1.865 1.00 12.75 N ATOM 415 CA THR U 56 20.170 19.998 -2.295 1.00 13.08 C ATOM 416 C THR U 56 19.917 19.396 -3.667 1.00 13.71 C ATOM 417 O THR U 56 18.881 18.716 -3.817 1.00 14.50 O ATOM 418 CB THR U 56 19.618 21.474 -2.242 1.00 13.10 C ATOM 419 OG1 THR U 56 19.323 21.768 -0.872 1.00 14.27 O ATOM 420 CG2 THR U 56 18.295 21.567 -2.986 1.00 12.71 C ATOM 421 HG1 THR U 56 20.149 21.685 -0.333 1.00 0.00 H ATOM 422 H THR U 56 22.022 20.893 -1.606 1.00 0.00 H ATOM 423 N HIS U 57 20.796 19.540 -4.672 1.00 12.51 N ATOM 424 CA HIS U 57 20.427 19.013 -5.999 1.00 13.06 C ATOM 425 C HIS U 57 20.205 17.517 -5.986 1.00 13.73 C ATOM 426 O HIS U 57 19.518 16.950 -6.888 1.00 16.62 O ATOM 427 CB HIS U 57 21.439 19.491 -7.078 1.00 13.81 C ATOM 428 CG HIS U 57 22.655 18.586 -7.210 1.00 12.98 C ATOM 429 ND1 HIS U 57 23.876 18.929 -6.666 1.00 13.91 N ATOM 430 CD2 HIS U 57 22.813 17.385 -7.873 1.00 14.34 C ATOM 431 CE1 HIS U 57 24.782 17.994 -7.017 1.00 13.27 C ATOM 432 NE2 HIS U 57 24.116 17.021 -7.769 1.00 14.87 N ATOM 433 H HIS U 57 21.711 20.010 -4.519 1.00 0.00 H ATOM 434 N CYS U 58 20.812 16.836 -4.965 1.00 13.61 N ATOM 435 CA CYS U 58 20.696 15.390 -4.927 1.00 14.95 C ATOM 436 C CYS U 58 19.279 14.947 -4.592 1.00 13.65 C ATOM 437 O CYS U 58 18.884 13.823 -4.889 1.00 16.40 O ATOM 438 CB CYS U 58 21.484 14.878 -3.751 1.00 15.44 C ATOM 439 SG CYS U 58 23.301 15.063 -3.987 1.00 18.46 S ATOM 440 H CYS U 58 21.345 17.345 -4.231 1.00 0.00 H ATOM 441 N PHE U 59 18.453 15.847 -4.029 1.00 15.36 N ATOM 442 CA PHE U 59 17.129 15.474 -3.430 1.00 14.44 C ATOM 443 C PHE U 59 15.958 16.276 -4.045 1.00 15.01 C ATOM 444 O PHE U 59 14.781 15.932 -3.788 1.00 17.01 O ATOM 445 CB PHE U 59 17.121 15.799 -1.916 1.00 14.59 C ATOM 446 CG PHE U 59 18.313 15.207 -1.218 1.00 14.95 C ATOM 447 CD1 PHE U 59 18.313 13.861 -0.890 1.00 15.79 C ATOM 448 CD2 PHE U 59 19.427 15.966 -0.919 1.00 15.60 C ATOM 449 CE1 PHE U 59 19.453 13.228 -0.308 1.00 16.61 C ATOM 450 CE2 PHE U 59 20.547 15.347 -0.325 1.00 15.76 C ATOM 451 CZ PHE U 59 20.534 14.003 0.037 1.00 17.60 C ATOM 452 H PHE U 59 18.745 16.845 -4.008 1.00 0.00 H ATOM 453 N ILE U 60 16.295 17.282 -4.853 1.00 16.26 N ATOM 454 CA ILE U 60 15.306 18.346 -5.255 1.00 20.35 C ATOM 455 C ILE U 60 14.194 17.710 -6.098 1.00 21.40 C ATOM 456 O ILE U 60 12.987 18.065 -5.940 1.00 25.41 O ATOM 457 CB ILE U 60 15.974 19.482 -6.039 1.00 18.78 C ATOM 458 CG1 ILE U 60 14.986 20.655 -6.219 1.00 20.87 C ATOM 459 CG2 ILE U 60 16.426 19.036 -7.443 1.00 22.90 C ATOM 460 CD1 ILE U 60 14.509 21.346 -4.968 1.00 21.02 C ATOM 461 H ILE U 60 17.268 17.334 -5.216 1.00 0.00 H ATOM 462 N ASP U 60A 14.442 16.463 -6.899 1.00 18.57 N ATOM 463 CA ASP U 60A 13.414 15.763 -7.713 1.00 22.70 C ATOM 464 C ASP U 60A 12.490 14.873 -6.924 1.00 22.41 C ATOM 465 O ASP U 60A 11.416 14.478 -7.388 1.00 22.09 O ATOM 466 CB ASP U 60A 14.063 15.046 -8.885 1.00 24.36 C ATOM 467 CG ASP U 60A 14.678 16.062 -9.913 1.00 27.78 C ATOM 468 OD1 ASP U 60A 14.496 17.312 -9.787 1.00 35.13 O ATOM 469 OD2 ASP U 60A 15.404 15.618 -10.801 1.00 36.36 O ATOM 470 H ASP U 60A 15.401 16.061 -6.883 1.00 0.00 H ATOM 471 N TYR U 60B 13.096 14.403 -5.666 1.00 22.26 N ATOM 472 CA TYR U 60B 12.361 13.540 -4.805 1.00 23.86 C ATOM 473 C TYR U 60B 12.455 14.076 -3.387 1.00 22.10 C ATOM 474 O TYR U 60B 13.144 13.549 -2.486 1.00 19.76 O ATOM 475 CB TYR U 60B 12.842 12.131 -4.904 1.00 23.62 C ATOM 476 CG TYR U 60B 12.629 11.579 -6.268 1.00 28.24 C ATOM 477 CD1 TYR U 60B 13.582 11.699 -7.278 1.00 28.97 C ATOM 478 CD2 TYR U 60B 11.446 10.921 -6.552 1.00 33.69 C ATOM 479 CE1 TYR U 60B 13.357 11.138 -8.554 1.00 34.31 C ATOM 480 CE2 TYR U 60B 11.217 10.365 -7.794 1.00 35.64 C ATOM 481 CZ TYR U 60B 12.147 10.476 -8.775 1.00 36.89 C ATOM 482 OH TYR U 60B 11.767 9.867 -9.944 1.00 37.68 O ATOM 483 HH TYR U 60B 12.481 9.980 -10.621 1.00 0.00 H ATOM 484 H TYR U 60B 14.058 14.701 -5.408 1.00 0.00 H ATOM 485 N PRO U 60C 11.620 15.146 -3.013 1.00 18.88 N ATOM 486 CA PRO U 60C 11.969 15.860 -1.774 1.00 18.39 C ATOM 487 C PRO U 60C 11.390 15.218 -0.546 1.00 20.84 C ATOM 488 O PRO U 60C 11.478 15.812 0.585 1.00 23.35 O ATOM 489 CB PRO U 60C 11.337 17.259 -1.998 1.00 22.19 C ATOM 490 CG PRO U 60C 10.304 17.023 -3.072 1.00 22.83 C ATOM 491 CD PRO U 60C 10.818 15.961 -3.979 1.00 20.72 C ATOM 492 N LYS U 61 10.770 14.067 -0.719 1.00 21.52 N ATOM 493 CA LYS U 61 10.061 13.438 0.390 1.00 23.59 C ATOM 494 C LYS U 61 11.038 12.582 1.241 1.00 21.76 C ATOM 495 O LYS U 61 11.642 11.614 0.706 1.00 23.06 O ATOM 496 CB LYS U 61 8.967 12.550 -0.146 1.00 30.49 C ATOM 497 CG LYS U 61 7.636 13.248 -0.393 1.00 41.32 C ATOM 498 CD LYS U 61 6.655 12.335 -1.138 1.00 46.58 C ATOM 499 CE LYS U 61 6.693 10.851 -0.714 1.00 57.11 C ATOM 500 NZ LYS U 61 6.322 10.552 0.707 1.00 62.92 N ATOM 501 HZ1 LYS U 61 6.976 11.048 1.346 1.00 0.00 H ATOM 502 HZ2 LYS U 61 5.349 10.874 0.885 1.00 0.00 H ATOM 503 HZ3 LYS U 61 6.384 9.527 0.872 1.00 0.00 H ATOM 504 H LYS U 61 10.787 13.605 -1.651 1.00 0.00 H ATOM 505 N LYS U 62 11.145 12.964 2.522 1.00 19.48 N ATOM 506 CA LYS U 62 12.116 12.350 3.470 1.00 18.37 C ATOM 507 C LYS U 62 11.940 10.857 3.502 1.00 19.39 C ATOM 508 O LYS U 62 12.902 10.074 3.827 1.00 20.58 O ATOM 509 CB LYS U 62 11.983 12.870 4.918 1.00 21.47 C ATOM 510 CG LYS U 62 10.604 12.701 5.508 1.00 24.67 C ATOM 511 CD LYS U 62 10.650 13.428 6.864 1.00 23.82 C ATOM 512 CE LYS U 62 9.336 13.249 7.498 1.00 27.11 C ATOM 513 NZ LYS U 62 9.390 14.031 8.735 1.00 29.51 N ATOM 514 HZ1 LYS U 62 10.156 13.670 9.339 1.00 0.00 H ATOM 515 HZ2 LYS U 62 9.569 15.029 8.505 1.00 0.00 H ATOM 516 HZ3 LYS U 62 8.483 13.947 9.237 1.00 0.00 H ATOM 517 H LYS U 62 10.523 13.722 2.869 1.00 0.00 H ATOM 518 N GLU U 62A 10.633 10.142 3.347 1.00 22.47 N ATOM 519 CA GLU U 62A 10.378 8.736 3.597 1.00 24.70 C ATOM 520 C GLU U 62A 11.063 7.899 2.552 1.00 22.74 C ATOM 521 O GLU U 62A 11.154 6.677 2.721 1.00 28.36 O ATOM 522 CB GLU U 62A 8.851 8.497 3.521 1.00 24.60 C ATOM 523 CG GLU U 62A 8.057 9.116 4.674 1.00 32.72 C ATOM 524 CD GLU U 62A 7.768 10.605 4.514 1.00 36.23 C ATOM 525 OE1 GLU U 62A 7.924 11.188 3.405 1.00 28.73 O ATOM 526 OE2 GLU U 62A 7.329 11.205 5.547 1.00 39.98 O ATOM 527 H GLU U 62A 9.825 10.713 3.027 1.00 0.00 H ATOM 528 N ASP U 63 11.563 8.553 1.493 1.00 22.95 N ATOM 529 CA ASP U 63 12.100 7.857 0.344 1.00 26.61 C ATOM 530 C ASP U 63 13.576 7.448 0.614 1.00 25.08 C ATOM 531 O ASP U 63 14.138 6.708 -0.190 1.00 27.03 O ATOM 532 CB ASP U 63 12.144 8.738 -0.926 1.00 27.03 C ATOM 533 CG ASP U 63 10.769 9.033 -1.507 1.00 33.63 C ATOM 534 OD1 ASP U 63 9.778 8.473 -1.064 1.00 29.68 O ATOM 535 OD2 ASP U 63 10.726 9.842 -2.438 1.00 36.53 O ATOM 536 H ASP U 63 11.565 9.593 1.498 1.00 0.00 H ATOM 537 N TYR U 64 14.175 7.900 1.693 1.00 21.56 N ATOM 538 CA TYR U 64 15.643 7.809 1.769 1.00 18.22 C ATOM 539 C TYR U 64 16.139 6.895 2.867 1.00 18.27 C ATOM 540 O TYR U 64 15.501 6.727 3.917 1.00 19.34 O ATOM 541 CB TYR U 64 16.260 9.191 1.947 1.00 17.40 C ATOM 542 CG TYR U 64 16.076 10.021 0.735 1.00 15.41 C ATOM 543 CD1 TYR U 64 16.945 9.973 -0.330 1.00 16.32 C ATOM 544 CD2 TYR U 64 14.956 10.850 0.641 1.00 16.61 C ATOM 545 CE1 TYR U 64 16.766 10.702 -1.489 1.00 16.00 C ATOM 546 CE2 TYR U 64 14.704 11.580 -0.507 1.00 18.42 C ATOM 547 CZ TYR U 64 15.570 11.502 -1.582 1.00 14.90 C ATOM 548 OH TYR U 64 15.444 12.232 -2.743 1.00 16.89 O ATOM 549 HH TYR U 64 16.184 12.000 -3.359 1.00 0.00 H ATOM 550 H TYR U 64 13.626 8.312 2.474 1.00 0.00 H ATOM 551 N ILE U 65 17.301 6.283 2.596 1.00 16.16 N ATOM 552 CA ILE U 65 18.002 5.538 3.623 1.00 16.94 C ATOM 553 C ILE U 65 19.447 6.063 3.658 1.00 16.15 C ATOM 554 O ILE U 65 20.040 6.309 2.626 1.00 17.25 O ATOM 555 CB ILE U 65 18.103 4.071 3.208 1.00 20.34 C ATOM 556 CG1 ILE U 65 16.719 3.574 2.801 1.00 23.21 C ATOM 557 CG2 ILE U 65 18.607 3.253 4.369 1.00 22.26 C ATOM 558 CD1 ILE U 65 16.642 2.196 2.144 1.00 27.51 C ATOM 559 H ILE U 65 17.703 6.344 1.639 1.00 0.00 H ATOM 560 N VAL U 66 19.980 6.246 4.856 1.00 14.95 N ATOM 561 CA VAL U 66 21.300 6.717 5.098 1.00 14.46 C ATOM 562 C VAL U 66 22.107 5.687 5.873 1.00 14.88 C ATOM 563 O VAL U 66 21.697 5.191 6.943 1.00 15.38 O ATOM 564 CB VAL U 66 21.286 7.964 5.940 1.00 15.52 C ATOM 565 CG1 VAL U 66 22.699 8.535 6.150 1.00 17.57 C ATOM 566 CG2 VAL U 66 20.469 9.019 5.172 1.00 15.46 C ATOM 567 H VAL U 66 19.388 6.029 5.683 1.00 0.00 H ATOM 568 N TYR U 67 23.256 5.360 5.296 1.00 14.05 N ATOM 569 CA TYR U 67 24.203 4.499 6.090 1.00 16.24 C ATOM 570 C TYR U 67 25.379 5.261 6.562 1.00 15.03 C ATOM 571 O TYR U 67 25.952 6.134 5.824 1.00 14.73 O ATOM 572 CB TYR U 67 24.663 3.300 5.309 1.00 15.12 C ATOM 573 CG TYR U 67 23.591 2.299 4.947 1.00 15.68 C ATOM 574 CD1 TYR U 67 22.832 2.479 3.775 1.00 17.55 C ATOM 575 CD2 TYR U 67 23.387 1.099 5.710 1.00 17.73 C ATOM 576 CE1 TYR U 67 21.813 1.594 3.433 1.00 20.82 C ATOM 577 CE2 TYR U 67 22.393 0.233 5.357 1.00 19.25 C ATOM 578 CZ TYR U 67 21.662 0.448 4.216 1.00 24.73 C ATOM 579 OH TYR U 67 20.704 -0.439 3.829 1.00 27.96 O ATOM 580 HH TYR U 67 20.283 -0.123 2.990 1.00 0.00 H ATOM 581 H TYR U 67 23.493 5.684 4.337 1.00 0.00 H ATOM 582 N LEU U 68 25.857 4.896 7.755 1.00 15.25 N ATOM 583 CA LEU U 68 27.147 5.331 8.273 1.00 15.31 C ATOM 584 C LEU U 68 28.013 4.072 8.493 1.00 13.70 C ATOM 585 O LEU U 68 27.490 3.032 8.660 1.00 15.82 O ATOM 586 CB LEU U 68 27.000 6.095 9.582 1.00 16.36 C ATOM 587 CG LEU U 68 26.121 7.363 9.510 1.00 16.59 C ATOM 588 CD1 LEU U 68 26.087 7.963 10.925 1.00 16.73 C ATOM 589 CD2 LEU U 68 26.791 8.354 8.624 1.00 17.14 C ATOM 590 H LEU U 68 25.277 4.267 8.346 1.00 0.00 H ATOM 591 N GLY U 69 29.331 4.256 8.443 1.00 14.04 N ATOM 592 CA GLY U 69 30.260 3.172 8.647 1.00 14.77 C ATOM 593 C GLY U 69 30.257 2.150 7.514 1.00 13.10 C ATOM 594 O GLY U 69 30.610 0.954 7.720 1.00 15.08 O ATOM 595 H GLY U 69 29.701 5.209 8.251 1.00 0.00 H ATOM 596 N ARG U 70 29.927 2.606 6.303 1.00 14.48 N ATOM 597 CA ARG U 70 29.880 1.701 5.132 1.00 14.02 C ATOM 598 C ARG U 70 31.018 1.978 4.135 1.00 15.70 C ATOM 599 O ARG U 70 31.251 3.121 3.702 1.00 15.95 O ATOM 600 CB ARG U 70 28.519 1.946 4.415 1.00 20.24 C ATOM 601 CG ARG U 70 28.006 0.741 3.721 1.00 21.02 C ATOM 602 CD ARG U 70 26.548 0.879 3.391 1.00 18.31 C ATOM 603 NE ARG U 70 26.244 0.167 2.163 1.00 25.32 N ATOM 604 CZ ARG U 70 25.393 -0.843 2.117 1.00 27.14 C ATOM 605 NH1 ARG U 70 24.880 -1.341 3.252 1.00 27.29 N ATOM 606 NH2 ARG U 70 25.100 -1.432 0.965 1.00 28.74 N ATOM 607 HE ARG U 70 26.715 0.464 1.284 1.00 0.00 H ATOM 608 HH12 ARG U 70 24.210 -2.136 3.215 1.00 0.00 H ATOM 609 HH11 ARG U 70 25.152 -0.932 4.169 1.00 0.00 H ATOM 610 HH22 ARG U 70 24.429 -2.226 0.943 1.00 0.00 H ATOM 611 HH21 ARG U 70 25.542 -1.100 0.084 1.00 0.00 H ATOM 612 H ARG U 70 29.699 3.613 6.180 1.00 0.00 H ATOM 613 N SER U 71 31.707 0.914 3.787 1.00 12.98 N ATOM 614 CA SER U 71 32.875 1.013 2.867 1.00 14.20 C ATOM 615 C SER U 71 32.509 0.582 1.522 1.00 14.34 C ATOM 616 O SER U 71 33.338 0.781 0.602 1.00 15.75 O ATOM 617 CB SER U 71 34.015 0.110 3.380 1.00 17.10 C ATOM 618 OG SER U 71 34.577 0.708 4.598 1.00 16.35 O ATOM 619 HG SER U 71 35.311 0.136 4.937 1.00 0.00 H ATOM 620 H SER U 71 31.431 -0.016 4.162 1.00 0.00 H ATOM 621 N ARG U 72 31.417 -0.146 1.400 1.00 13.19 N ATOM 622 CA ARG U 72 31.038 -0.793 0.112 1.00 15.19 C ATOM 623 C ARG U 72 29.645 -0.340 -0.347 1.00 15.89 C ATOM 624 O ARG U 72 28.741 -0.066 0.477 1.00 16.35 O ATOM 625 CB ARG U 72 31.136 -2.350 0.159 1.00 17.06 C ATOM 626 CG ARG U 72 32.644 -2.770 0.113 1.00 19.76 C ATOM 627 CD ARG U 72 32.900 -4.292 0.018 1.00 24.68 C ATOM 628 NE ARG U 72 32.502 -4.815 -1.317 1.00 32.57 N ATOM 629 CZ ARG U 72 33.179 -4.749 -2.510 1.00 35.07 C ATOM 630 NH1 ARG U 72 34.408 -4.149 -2.721 1.00 22.23 N ATOM 631 NH2 ARG U 72 32.586 -5.380 -3.560 1.00 30.91 N ATOM 632 HE ARG U 72 31.582 -5.298 -1.351 1.00 0.00 H ATOM 633 HH12 ARG U 72 34.834 -4.156 -3.670 1.00 0.00 H ATOM 634 HH11 ARG U 72 34.906 -3.691 -1.931 1.00 0.00 H ATOM 635 HH22 ARG U 72 33.041 -5.372 -4.495 1.00 0.00 H ATOM 636 HH21 ARG U 72 31.678 -5.870 -3.427 1.00 0.00 H ATOM 637 H ARG U 72 30.801 -0.273 2.228 1.00 0.00 H ATOM 638 N LEU U 73 29.457 -0.223 -1.651 1.00 14.59 N ATOM 639 CA LEU U 73 28.202 0.338 -2.186 1.00 15.67 C ATOM 640 C LEU U 73 27.003 -0.602 -2.048 1.00 15.59 C ATOM 641 O LEU U 73 25.904 -0.174 -1.653 1.00 16.62 O ATOM 642 CB LEU U 73 28.446 0.733 -3.668 1.00 15.71 C ATOM 643 CG LEU U 73 27.294 1.534 -4.283 1.00 16.55 C ATOM 644 CD1 LEU U 73 27.074 2.833 -3.543 1.00 15.74 C ATOM 645 CD2 LEU U 73 27.517 1.707 -5.783 1.00 18.54 C ATOM 646 H LEU U 73 30.203 -0.530 -2.307 1.00 0.00 H ATOM 647 N ASN U 74 27.228 -1.878 -2.320 1.00 16.96 N ATOM 648 CA ASN U 74 26.140 -2.863 -2.351 1.00 17.41 C ATOM 649 C ASN U 74 26.298 -4.039 -1.488 1.00 20.10 C ATOM 650 O ASN U 74 25.583 -5.016 -1.718 1.00 22.21 O ATOM 651 CB ASN U 74 26.008 -3.321 -3.776 1.00 21.58 C ATOM 652 CG ASN U 74 25.511 -2.233 -4.672 1.00 26.49 C ATOM 653 OD1 ASN U 74 24.428 -1.787 -4.491 1.00 34.52 O ATOM 654 ND2 ASN U 74 26.285 -1.831 -5.638 1.00 28.54 N ATOM 655 HD22 ASN U 74 27.228 -2.252 -5.758 1.00 0.00 H ATOM 656 HD21 ASN U 74 25.960 -1.089 -6.290 1.00 0.00 H ATOM 657 H ASN U 74 28.200 -2.190 -2.517 1.00 0.00 H ATOM 658 N SER U 75 27.143 -3.976 -0.493 1.00 20.37 N ATOM 659 CA SER U 75 27.134 -4.935 0.586 1.00 25.63 C ATOM 660 C SER U 75 27.404 -4.324 1.908 1.00 24.21 C ATOM 661 O SER U 75 27.894 -3.170 2.037 1.00 23.69 O ATOM 662 CB SER U 75 28.126 -6.046 0.344 1.00 32.11 C ATOM 663 OG SER U 75 29.380 -5.475 0.267 1.00 34.20 O ATOM 664 HG SER U 75 30.054 -6.182 0.108 1.00 0.00 H ATOM 665 H SER U 75 27.845 -3.209 -0.478 1.00 0.00 H ATOM 666 N ASN U 76 27.118 -5.079 2.940 1.00 24.28 N ATOM 667 CA ASN U 76 27.182 -4.507 4.278 1.00 30.01 C ATOM 668 C ASN U 76 28.632 -4.517 4.737 1.00 26.83 C ATOM 669 O ASN U 76 29.444 -5.334 4.310 1.00 25.88 O ATOM 670 CB ASN U 76 26.235 -5.209 5.265 1.00 35.46 C ATOM 671 CG ASN U 76 24.784 -5.191 4.785 1.00 39.29 C ATOM 672 OD1 ASN U 76 24.207 -6.239 4.499 1.00 49.61 O ATOM 673 ND2 ASN U 76 24.219 -4.015 4.631 1.00 39.27 N ATOM 674 HD22 ASN U 76 24.739 -3.151 4.884 1.00 0.00 H ATOM 675 HD21 ASN U 76 23.251 -3.948 4.256 1.00 0.00 H ATOM 676 H ASN U 76 26.849 -6.074 2.805 1.00 0.00 H ATOM 677 N THR U 77 28.989 -3.498 5.483 1.00 19.37 N ATOM 678 CA THR U 77 30.284 -3.459 6.105 1.00 17.21 C ATOM 679 C THR U 77 29.984 -3.721 7.559 1.00 17.69 C ATOM 680 O THR U 77 29.065 -3.145 8.129 1.00 18.19 O ATOM 681 CB THR U 77 30.817 -1.994 6.001 1.00 18.55 C ATOM 682 OG1 THR U 77 31.088 -1.698 4.614 1.00 19.33 O ATOM 683 CG2 THR U 77 32.094 -1.778 6.769 1.00 18.69 C ATOM 684 HG1 THR U 77 30.254 -1.791 4.089 1.00 0.00 H ATOM 685 H THR U 77 28.327 -2.709 5.626 1.00 0.00 H ATOM 686 N GLN U 78 30.839 -4.517 8.223 1.00 16.84 N ATOM 687 CA GLN U 78 30.600 -4.863 9.610 1.00 17.72 C ATOM 688 C GLN U 78 30.661 -3.564 10.418 1.00 18.13 C ATOM 689 O GLN U 78 31.561 -2.726 10.294 1.00 18.13 O ATOM 690 CB GLN U 78 31.682 -5.881 10.055 1.00 17.99 C ATOM 691 CG GLN U 78 31.708 -6.316 11.502 1.00 18.05 C ATOM 692 CD GLN U 78 32.506 -7.541 11.658 1.00 19.40 C ATOM 693 OE1 GLN U 78 33.699 -7.523 11.587 1.00 19.21 O ATOM 694 NE2 GLN U 78 31.813 -8.674 11.785 1.00 21.68 N ATOM 695 HE22 GLN U 78 30.775 -8.645 11.843 1.00 0.00 H ATOM 696 HE21 GLN U 78 32.311 -9.586 11.826 1.00 0.00 H ATOM 697 H GLN U 78 31.680 -4.888 7.737 1.00 0.00 H ATOM 698 N GLY U 79 29.725 -3.441 11.320 1.00 19.38 N ATOM 699 CA GLY U 79 29.732 -2.301 12.186 1.00 18.51 C ATOM 700 C GLY U 79 28.844 -1.183 11.624 1.00 20.93 C ATOM 701 O GLY U 79 28.628 -0.174 12.297 1.00 22.39 O ATOM 702 H GLY U 79 28.982 -4.164 11.408 1.00 0.00 H ATOM 703 N GLU U 80 28.332 -1.323 10.408 1.00 16.82 N ATOM 704 CA GLU U 80 27.633 -0.119 9.865 1.00 16.94 C ATOM 705 C GLU U 80 26.343 0.161 10.593 1.00 18.94 C ATOM 706 O GLU U 80 25.751 -0.691 11.242 1.00 17.46 O ATOM 707 CB GLU U 80 27.371 -0.291 8.363 1.00 16.79 C ATOM 708 CG GLU U 80 26.300 -1.345 8.148 1.00 18.49 C ATOM 709 CD GLU U 80 25.931 -1.635 6.669 1.00 23.31 C ATOM 710 OE1 GLU U 80 26.806 -1.582 5.828 1.00 23.95 O ATOM 711 OE2 GLU U 80 24.764 -1.973 6.380 1.00 24.26 O ATOM 712 H GLU U 80 28.412 -2.209 9.870 1.00 0.00 H ATOM 713 N MET U 81 25.828 1.369 10.407 1.00 16.16 N ATOM 714 CA MET U 81 24.521 1.729 10.992 1.00 19.15 C ATOM 715 C MET U 81 23.575 2.286 9.917 1.00 17.05 C ATOM 716 O MET U 81 23.979 3.019 9.004 1.00 16.80 O ATOM 717 CB MET U 81 24.635 2.778 12.115 1.00 21.60 C ATOM 718 CG MET U 81 25.098 2.255 13.454 1.00 22.56 C ATOM 719 SD MET U 81 25.075 3.593 14.755 1.00 27.40 S ATOM 720 CE MET U 81 23.362 3.703 15.337 1.00 24.87 C ATOM 721 H MET U 81 26.350 2.070 9.843 1.00 0.00 H ATOM 722 N LYS U 82 22.327 1.887 9.980 1.00 15.82 N ATOM 723 CA LYS U 82 21.356 2.251 8.968 1.00 19.01 C ATOM 724 C LYS U 82 20.289 3.205 9.573 1.00 20.13 C ATOM 725 O LYS U 82 19.743 2.941 10.662 1.00 20.39 O ATOM 726 CB LYS U 82 20.635 0.989 8.462 1.00 20.93 C ATOM 727 CG LYS U 82 19.548 1.236 7.431 1.00 22.46 C ATOM 728 CD LYS U 82 18.796 -0.062 7.256 1.00 27.05 C ATOM 729 CE LYS U 82 17.775 0.046 6.136 1.00 33.38 C ATOM 730 NZ LYS U 82 17.204 -1.311 5.883 1.00 35.40 N ATOM 731 HZ1 LYS U 82 17.967 -1.961 5.607 1.00 0.00 H ATOM 732 HZ2 LYS U 82 16.746 -1.660 6.749 1.00 0.00 H ATOM 733 HZ3 LYS U 82 16.502 -1.253 5.118 1.00 0.00 H ATOM 734 H LYS U 82 22.026 1.293 10.779 1.00 0.00 H ATOM 735 N PHE U 83 19.953 4.263 8.864 1.00 16.56 N ATOM 736 CA PHE U 83 18.997 5.277 9.423 1.00 16.36 C ATOM 737 C PHE U 83 17.946 5.673 8.413 1.00 17.92 C ATOM 738 O PHE U 83 18.152 5.588 7.217 1.00 19.09 O ATOM 739 CB PHE U 83 19.715 6.601 9.699 1.00 15.84 C ATOM 740 CG PHE U 83 20.905 6.455 10.625 1.00 18.17 C ATOM 741 CD1 PHE U 83 22.132 5.928 10.172 1.00 16.61 C ATOM 742 CD2 PHE U 83 20.681 6.662 11.992 1.00 18.47 C ATOM 743 CE1 PHE U 83 23.209 5.842 11.084 1.00 17.85 C ATOM 744 CE2 PHE U 83 21.724 6.453 12.882 1.00 19.56 C ATOM 745 CZ PHE U 83 22.953 6.004 12.425 1.00 20.44 C ATOM 746 H PHE U 83 20.352 4.397 7.913 1.00 0.00 H ATOM 747 N GLU U 84 16.761 5.991 8.945 1.00 19.32 N ATOM 748 CA GLU U 84 15.707 6.686 8.174 1.00 20.46 C ATOM 749 C GLU U 84 16.057 8.138 8.227 1.00 18.04 C ATOM 750 O GLU U 84 16.875 8.593 9.042 1.00 18.57 O ATOM 751 CB GLU U 84 14.380 6.582 8.907 1.00 24.59 C ATOM 752 CG GLU U 84 13.967 5.153 9.142 1.00 35.87 C ATOM 753 CD GLU U 84 14.047 4.367 7.865 1.00 46.56 C ATOM 754 OE1 GLU U 84 13.575 4.868 6.806 1.00 57.96 O ATOM 755 OE2 GLU U 84 14.613 3.246 7.887 1.00 53.84 O ATOM 756 H GLU U 84 16.574 5.741 9.937 1.00 0.00 H ATOM 757 N VAL U 85 15.368 8.934 7.382 1.00 17.52 N ATOM 758 CA VAL U 85 15.560 10.364 7.408 1.00 17.15 C ATOM 759 C VAL U 85 14.364 11.005 8.117 1.00 18.57 C ATOM 760 O VAL U 85 13.276 10.945 7.599 1.00 21.16 O ATOM 761 CB VAL U 85 15.776 10.982 6.044 1.00 16.27 C ATOM 762 CG1 VAL U 85 15.847 12.491 6.087 1.00 15.74 C ATOM 763 CG2 VAL U 85 17.073 10.368 5.460 1.00 16.22 C ATOM 764 H VAL U 85 14.695 8.514 6.709 1.00 0.00 H ATOM 765 N GLU U 86 14.627 11.542 9.307 1.00 18.32 N ATOM 766 CA GLU U 86 13.544 12.168 10.071 1.00 20.35 C ATOM 767 C GLU U 86 13.107 13.556 9.504 1.00 21.18 C ATOM 768 O GLU U 86 11.919 13.915 9.558 1.00 21.57 O ATOM 769 CB GLU U 86 14.048 12.370 11.454 1.00 19.95 C ATOM 770 CG GLU U 86 12.944 12.743 12.407 1.00 21.78 C ATOM 771 CD GLU U 86 13.470 12.981 13.816 1.00 24.49 C ATOM 772 OE1 GLU U 86 14.524 12.430 14.207 1.00 24.67 O ATOM 773 OE2 GLU U 86 12.797 13.718 14.596 1.00 28.86 O ATOM 774 H GLU U 86 15.593 11.517 9.691 1.00 0.00 H ATOM 775 N ASN U 87 14.032 14.311 8.904 1.00 17.48 N ATOM 776 CA ASN U 87 13.742 15.580 8.277 1.00 16.70 C ATOM 777 C ASN U 87 14.725 15.799 7.147 1.00 19.08 C ATOM 778 O ASN U 87 15.917 15.519 7.299 1.00 18.41 O ATOM 779 CB ASN U 87 13.827 16.727 9.295 1.00 19.00 C ATOM 780 CG ASN U 87 12.851 16.507 10.440 1.00 23.43 C ATOM 781 OD1 ASN U 87 13.251 16.008 11.480 1.00 26.74 O ATOM 782 ND2 ASN U 87 11.536 16.748 10.193 1.00 20.02 N ATOM 783 HD22 ASN U 87 11.246 17.175 9.290 1.00 0.00 H ATOM 784 HD21 ASN U 87 10.820 16.505 10.907 1.00 0.00 H ATOM 785 H ASN U 87 15.013 13.967 8.887 1.00 0.00 H ATOM 786 N LEU U 88 14.210 16.170 5.988 1.00 16.90 N ATOM 787 CA LEU U 88 15.045 16.475 4.854 1.00 15.05 C ATOM 788 C LEU U 88 14.947 17.978 4.555 1.00 15.58 C ATOM 789 O LEU U 88 13.854 18.470 4.179 1.00 19.06 O ATOM 790 CB LEU U 88 14.621 15.662 3.628 1.00 15.58 C ATOM 791 CG LEU U 88 15.362 15.940 2.309 1.00 14.94 C ATOM 792 CD1 LEU U 88 16.838 15.614 2.490 1.00 15.46 C ATOM 793 CD2 LEU U 88 14.854 14.967 1.253 1.00 17.00 C ATOM 794 H LEU U 88 13.177 16.244 5.892 1.00 0.00 H ATOM 795 N ILE U 89 16.019 18.715 4.818 1.00 17.85 N ATOM 796 CA ILE U 89 15.959 20.200 4.812 1.00 14.61 C ATOM 797 C ILE U 89 16.786 20.675 3.615 1.00 15.26 C ATOM 798 O ILE U 89 18.014 20.492 3.565 1.00 15.36 O ATOM 799 CB ILE U 89 16.509 20.812 6.101 1.00 16.07 C ATOM 800 CG1 ILE U 89 15.634 20.352 7.306 1.00 18.24 C ATOM 801 CG2 ILE U 89 16.573 22.354 5.981 1.00 16.72 C ATOM 802 CD1 ILE U 89 16.112 20.889 8.623 1.00 20.65 C ATOM 803 H ILE U 89 16.921 18.243 5.033 1.00 0.00 H ATOM 804 N LEU U 90 16.117 21.329 2.641 1.00 14.42 N ATOM 805 CA LEU U 90 16.722 21.759 1.429 1.00 13.58 C ATOM 806 C LEU U 90 16.861 23.306 1.551 1.00 13.74 C ATOM 807 O LEU U 90 15.999 23.951 2.207 1.00 18.84 O ATOM 808 CB LEU U 90 15.851 21.420 0.246 1.00 14.37 C ATOM 809 CG LEU U 90 15.582 19.961 0.111 1.00 15.42 C ATOM 810 CD1 LEU U 90 14.825 19.644 -1.171 1.00 16.54 C ATOM 811 CD2 LEU U 90 16.862 19.053 0.216 1.00 16.57 C ATOM 812 H LEU U 90 15.107 21.528 2.785 1.00 0.00 H ATOM 813 N HIS U 91 17.846 23.921 0.854 1.00 12.81 N ATOM 814 CA HIS U 91 18.052 25.372 1.020 1.00 13.62 C ATOM 815 C HIS U 91 17.053 26.159 0.185 1.00 14.10 C ATOM 816 O HIS U 91 16.945 25.945 -1.007 1.00 16.21 O ATOM 817 CB HIS U 91 19.474 25.732 0.607 1.00 15.10 C ATOM 818 CG HIS U 91 19.910 27.105 1.069 1.00 16.03 C ATOM 819 ND1 HIS U 91 19.352 28.259 0.597 1.00 15.59 N ATOM 820 CD2 HIS U 91 20.856 27.485 2.038 1.00 16.16 C ATOM 821 CE1 HIS U 91 19.890 29.318 1.233 1.00 16.71 C ATOM 822 NE2 HIS U 91 20.792 28.858 2.143 1.00 14.99 N ATOM 823 H HIS U 91 18.451 23.375 0.208 1.00 0.00 H ATOM 824 N LYS U 92 16.291 27.054 0.842 1.00 14.95 N ATOM 825 CA LYS U 92 15.209 27.660 0.060 1.00 17.81 C ATOM 826 C LYS U 92 15.674 28.523 -1.090 1.00 17.91 C ATOM 827 O LYS U 92 14.838 28.836 -1.987 1.00 18.18 O ATOM 828 CB LYS U 92 14.335 28.497 1.001 1.00 21.64 C ATOM 829 CG LYS U 92 13.538 27.594 1.877 1.00 27.22 C ATOM 830 CD LYS U 92 12.690 28.394 2.853 1.00 30.35 C ATOM 831 CE LYS U 92 11.424 27.604 3.044 1.00 36.25 C ATOM 832 NZ LYS U 92 11.865 26.409 3.827 1.00 40.10 N ATOM 833 HZ1 LYS U 92 12.579 25.884 3.283 1.00 0.00 H ATOM 834 HZ2 LYS U 92 12.276 26.720 4.730 1.00 0.00 H ATOM 835 HZ3 LYS U 92 11.046 25.795 4.010 1.00 0.00 H ATOM 836 H LYS U 92 16.459 27.299 1.839 1.00 0.00 H ATOM 837 N ASP U 93 16.932 28.938 -1.092 1.00 15.39 N ATOM 838 CA ASP U 93 17.484 29.751 -2.223 1.00 17.23 C ATOM 839 C ASP U 93 18.204 28.966 -3.301 1.00 14.36 C ATOM 840 O ASP U 93 18.968 29.577 -4.090 1.00 15.65 O ATOM 841 CB ASP U 93 18.359 30.869 -1.701 1.00 21.57 C ATOM 842 CG ASP U 93 17.575 31.805 -0.803 1.00 22.58 C ATOM 843 OD1 ASP U 93 16.464 32.185 -1.191 1.00 22.91 O ATOM 844 OD2 ASP U 93 18.048 32.141 0.281 1.00 25.30 O ATOM 845 H ASP U 93 17.550 28.694 -0.292 1.00 0.00 H ATOM 846 N TYR U 94 18.057 27.628 -3.203 1.00 15.20 N ATOM 847 CA TYR U 94 18.554 26.787 -4.278 1.00 14.07 C ATOM 848 C TYR U 94 18.146 27.325 -5.673 1.00 14.74 C ATOM 849 O TYR U 94 16.986 27.692 -5.919 1.00 16.59 O ATOM 850 CB TYR U 94 18.096 25.376 -4.064 1.00 16.08 C ATOM 851 CG TYR U 94 18.389 24.443 -5.222 1.00 15.54 C ATOM 852 CD1 TYR U 94 19.639 23.838 -5.273 1.00 14.43 C ATOM 853 CD2 TYR U 94 17.406 24.063 -6.180 1.00 15.16 C ATOM 854 CE1 TYR U 94 19.935 22.950 -6.304 1.00 15.41 C ATOM 855 CE2 TYR U 94 17.702 23.155 -7.209 1.00 14.25 C ATOM 856 CZ TYR U 94 18.963 22.594 -7.221 1.00 17.10 C ATOM 857 OH TYR U 94 19.215 21.621 -8.200 1.00 17.17 O ATOM 858 HH TYR U 94 19.090 22.018 -9.098 1.00 0.00 H ATOM 859 H TYR U 94 17.596 27.206 -2.372 1.00 0.00 H ATOM 860 N SER U 95 19.144 27.359 -6.527 1.00 15.20 N ATOM 861 CA SER U 95 18.822 27.464 -7.912 1.00 16.12 C ATOM 862 C SER U 95 19.826 26.729 -8.756 1.00 17.36 C ATOM 863 O SER U 95 20.893 26.529 -8.377 1.00 18.36 O ATOM 864 CB SER U 95 18.753 28.909 -8.312 1.00 17.34 C ATOM 865 OG SER U 95 19.950 29.511 -8.157 1.00 19.92 O ATOM 866 HG SER U 95 20.623 29.056 -8.723 1.00 0.00 H ATOM 867 H SER U 95 20.132 27.311 -6.205 1.00 0.00 H ATOM 868 N ALA U 96 19.445 26.460 -9.971 1.00 18.75 N ATOM 869 CA ALA U 96 20.315 25.777 -10.887 1.00 21.29 C ATOM 870 C ALA U 96 20.031 26.234 -12.300 1.00 31.02 C ATOM 871 O ALA U 96 18.954 26.600 -12.627 1.00 30.24 O ATOM 872 CB ALA U 96 20.085 24.307 -10.752 1.00 18.18 C ATOM 873 H ALA U 96 18.495 26.744 -10.284 1.00 0.00 H ATOM 874 N ASP U 97 21.043 26.187 -13.127 1.00 45.21 N ATOM 875 CA ASP U 97 20.856 26.206 -14.562 1.00 43.13 C ATOM 876 C ASP U 97 21.581 25.005 -14.952 1.00 49.52 C ATOM 877 O ASP U 97 22.386 24.613 -14.190 1.00 47.83 O ATOM 878 CB ASP U 97 21.513 27.404 -15.165 1.00 44.15 C ATOM 879 CG ASP U 97 22.988 27.459 -14.946 1.00 48.56 C ATOM 880 OD1 ASP U 97 23.620 26.431 -14.841 1.00 51.98 O ATOM 881 OD2 ASP U 97 23.522 28.566 -14.910 1.00 49.23 O ATOM 882 H ASP U 97 22.008 26.135 -12.743 1.00 0.00 H ATOM 883 N THR U 97A 21.370 24.420 -16.130 1.00 68.60 N ATOM 884 CA THR U 97A 21.851 23.043 -16.384 1.00 79.12 C ATOM 885 C THR U 97A 23.135 22.608 -15.736 1.00 79.93 C ATOM 886 O THR U 97A 23.335 21.409 -15.582 1.00 73.94 O ATOM 887 CB THR U 97A 22.065 22.633 -17.850 1.00 78.98 C ATOM 888 OG1 THR U 97A 22.537 23.716 -18.650 1.00 72.41 O ATOM 889 CG2 THR U 97A 20.860 22.011 -18.422 1.00 74.62 C ATOM 890 HG1 THR U 97A 22.660 23.407 -19.582 1.00 0.00 H ATOM 891 H THR U 97A 20.863 24.935 -16.878 1.00 0.00 H ATOM 892 N LEU U 97B 24.002 23.568 -15.421 1.00 33.17 N ATOM 893 CA LEU U 97B 25.291 23.342 -14.843 1.00 31.95 C ATOM 894 C LEU U 97B 25.425 23.734 -13.357 1.00 27.43 C ATOM 895 O LEU U 97B 25.591 22.917 -12.523 1.00 30.27 O ATOM 896 CB LEU U 97B 26.306 24.126 -15.677 1.00 30.94 C ATOM 897 CG LEU U 97B 27.716 23.663 -15.556 1.00 32.03 C ATOM 898 CD1 LEU U 97B 27.885 22.179 -15.672 1.00 36.69 C ATOM 899 CD2 LEU U 97B 28.684 24.390 -16.450 1.00 29.34 C ATOM 900 H LEU U 97B 23.722 24.552 -15.608 1.00 0.00 H ATOM 901 N ALA U 98 25.395 24.998 -13.069 1.00 26.94 N ATOM 902 CA ALA U 98 25.848 25.507 -11.812 1.00 21.62 C ATOM 903 C ALA U 98 24.723 25.440 -10.801 1.00 24.42 C ATOM 904 O ALA U 98 23.609 25.738 -11.099 1.00 29.17 O ATOM 905 CB ALA U 98 26.342 26.899 -11.983 1.00 26.08 C ATOM 906 H ALA U 98 25.028 25.665 -13.778 1.00 0.00 H ATOM 907 N TYR U 99 24.947 24.874 -9.652 1.00 16.45 N ATOM 908 CA TYR U 99 23.930 24.897 -8.671 1.00 15.98 C ATOM 909 C TYR U 99 24.356 26.008 -7.724 1.00 18.40 C ATOM 910 O TYR U 99 25.444 26.189 -7.494 1.00 20.10 O ATOM 911 CB TYR U 99 23.802 23.560 -7.930 1.00 14.44 C ATOM 912 CG TYR U 99 23.475 22.374 -8.773 1.00 14.47 C ATOM 913 CD1 TYR U 99 22.247 22.230 -9.315 1.00 16.78 C ATOM 914 CD2 TYR U 99 24.404 21.442 -9.057 1.00 14.02 C ATOM 915 CE1 TYR U 99 21.930 21.160 -10.083 1.00 17.01 C ATOM 916 CE2 TYR U 99 24.103 20.378 -9.840 1.00 16.03 C ATOM 917 CZ TYR U 99 22.867 20.232 -10.355 1.00 18.20 C ATOM 918 OH TYR U 99 22.575 19.196 -11.136 1.00 21.14 O ATOM 919 HH TYR U 99 22.720 18.355 -10.634 1.00 0.00 H ATOM 920 H TYR U 99 25.859 24.412 -9.458 1.00 0.00 H ATOM 921 N HIS U 100 23.431 26.762 -7.208 1.00 16.54 N ATOM 922 CA HIS U 100 23.616 27.755 -6.188 1.00 15.35 C ATOM 923 C HIS U 100 22.891 27.308 -4.928 1.00 15.27 C ATOM 924 O HIS U 100 21.920 26.687 -4.932 1.00 15.29 O ATOM 925 CB HIS U 100 23.032 29.090 -6.644 1.00 17.74 C ATOM 926 CG HIS U 100 23.702 29.675 -7.858 1.00 20.27 C ATOM 927 ND1 HIS U 100 23.481 29.238 -9.080 1.00 25.67 N ATOM 928 CD2 HIS U 100 24.600 30.672 -7.980 1.00 24.41 C ATOM 929 CE1 HIS U 100 24.218 29.913 -9.940 1.00 21.19 C ATOM 930 NE2 HIS U 100 24.901 30.785 -9.267 1.00 25.94 N ATOM 931 H HIS U 100 22.464 26.633 -7.569 1.00 0.00 H ATOM 932 N ASN U 101 23.457 27.637 -3.826 1.00 15.31 N ATOM 933 CA ASN U 101 23.017 27.240 -2.489 1.00 12.73 C ATOM 934 C ASN U 101 22.791 25.804 -2.392 1.00 13.45 C ATOM 935 O ASN U 101 21.771 25.296 -1.934 1.00 13.39 O ATOM 936 CB ASN U 101 21.761 28.094 -2.167 1.00 15.71 C ATOM 937 CG ASN U 101 22.150 29.556 -2.106 1.00 15.29 C ATOM 938 OD1 ASN U 101 23.136 29.935 -1.424 1.00 18.70 O ATOM 939 ND2 ASN U 101 21.442 30.408 -2.909 1.00 19.36 N ATOM 940 HD22 ASN U 101 20.632 30.054 -3.457 1.00 0.00 H ATOM 941 HD21 ASN U 101 21.714 31.410 -2.971 1.00 0.00 H ATOM 942 H ASN U 101 24.303 28.239 -3.888 1.00 0.00 H ATOM 943 N ASP U 102 23.828 25.074 -2.857 1.00 13.85 N ATOM 944 CA ASP U 102 23.567 23.636 -3.008 1.00 12.11 C ATOM 945 C ASP U 102 23.979 22.905 -1.698 1.00 12.99 C ATOM 946 O ASP U 102 25.136 22.375 -1.512 1.00 13.71 O ATOM 947 CB ASP U 102 24.397 23.122 -4.264 1.00 12.10 C ATOM 948 CG ASP U 102 23.973 21.735 -4.721 1.00 12.47 C ATOM 949 OD1 ASP U 102 22.889 21.235 -4.323 1.00 12.62 O ATOM 950 OD2 ASP U 102 24.767 21.162 -5.497 1.00 13.62 O ATOM 951 H ASP U 102 24.747 25.500 -3.092 1.00 0.00 H ATOM 952 N ILE U 103 23.055 22.967 -0.746 1.00 11.74 N ATOM 953 CA ILE U 103 23.369 22.496 0.598 1.00 13.00 C ATOM 954 C ILE U 103 22.071 22.022 1.197 1.00 13.84 C ATOM 955 O ILE U 103 21.023 22.580 0.958 1.00 14.58 O ATOM 956 CB ILE U 103 24.099 23.603 1.402 1.00 11.68 C ATOM 957 CG1 ILE U 103 24.514 23.032 2.742 1.00 11.86 C ATOM 958 CG2 ILE U 103 23.172 24.775 1.704 1.00 13.66 C ATOM 959 CD1 ILE U 103 25.480 24.028 3.423 1.00 15.21 C ATOM 960 H ILE U 103 22.112 23.350 -0.958 1.00 0.00 H ATOM 961 N ALA U 104 22.143 20.906 1.908 1.00 13.08 N ATOM 962 CA ALA U 104 20.990 20.169 2.485 1.00 12.49 C ATOM 963 C ALA U 104 21.369 19.478 3.768 1.00 14.68 C ATOM 964 O ALA U 104 22.527 19.135 4.011 1.00 14.57 O ATOM 965 CB ALA U 104 20.418 19.172 1.487 1.00 14.17 C ATOM 966 H ALA U 104 23.090 20.512 2.077 1.00 0.00 H ATOM 967 N LEU U 105 20.385 19.386 4.641 1.00 15.08 N ATOM 968 CA LEU U 105 20.572 18.672 5.922 1.00 14.41 C ATOM 969 C LEU U 105 19.618 17.540 6.076 1.00 16.99 C ATOM 970 O LEU U 105 18.450 17.612 5.682 1.00 18.43 O ATOM 971 CB LEU U 105 20.371 19.652 7.067 1.00 14.26 C ATOM 972 CG LEU U 105 21.525 20.637 7.270 1.00 12.95 C ATOM 973 CD1 LEU U 105 21.018 21.739 8.159 1.00 14.92 C ATOM 974 CD2 LEU U 105 22.674 20.050 8.070 1.00 14.33 C ATOM 975 H LEU U 105 19.465 19.821 4.426 1.00 0.00 H ATOM 976 N LEU U 106 20.111 16.403 6.538 1.00 13.35 N ATOM 977 CA LEU U 106 19.282 15.210 6.735 1.00 14.08 C ATOM 978 C LEU U 106 19.399 14.936 8.232 1.00 14.44 C ATOM 979 O LEU U 106 20.504 14.715 8.757 1.00 15.28 O ATOM 980 CB LEU U 106 19.772 14.008 5.893 1.00 14.75 C ATOM 981 CG LEU U 106 19.664 14.252 4.417 1.00 14.19 C ATOM 982 CD1 LEU U 106 21.026 14.888 4.042 1.00 19.49 C ATOM 983 CD2 LEU U 106 19.690 12.873 3.784 1.00 17.62 C ATOM 984 H LEU U 106 21.124 16.353 6.770 1.00 0.00 H ATOM 985 N LYS U 107 18.268 15.018 8.949 1.00 14.37 N ATOM 986 CA LYS U 107 18.280 14.544 10.319 1.00 15.03 C ATOM 987 C LYS U 107 18.035 13.075 10.310 1.00 16.06 C ATOM 988 O LYS U 107 17.062 12.591 9.749 1.00 16.86 O ATOM 989 CB LYS U 107 17.133 15.302 11.123 1.00 16.60 C ATOM 990 CG LYS U 107 17.256 14.993 12.611 1.00 18.76 C ATOM 991 CD LYS U 107 16.191 15.650 13.556 1.00 22.46 C ATOM 992 CE LYS U 107 16.660 15.736 15.000 1.00 28.63 C ATOM 993 NZ LYS U 107 15.536 16.485 15.717 1.00 30.97 N ATOM 994 HZ1 LYS U 107 15.419 17.425 15.288 1.00 0.00 H ATOM 995 HZ2 LYS U 107 14.650 15.948 15.626 1.00 0.00 H ATOM 996 HZ3 LYS U 107 15.777 16.589 16.723 1.00 0.00 H ATOM 997 H LYS U 107 17.401 15.413 8.531 1.00 0.00 H ATOM 998 N ILE U 108 18.946 12.318 10.922 1.00 15.25 N ATOM 999 CA ILE U 108 18.861 10.890 10.839 1.00 18.00 C ATOM 1000 C ILE U 108 18.312 10.220 12.089 1.00 18.20 C ATOM 1001 O ILE U 108 18.591 10.676 13.212 1.00 21.69 O ATOM 1002 CB ILE U 108 20.219 10.318 10.444 1.00 15.77 C ATOM 1003 CG1 ILE U 108 21.353 10.844 11.350 1.00 19.35 C ATOM 1004 CG2 ILE U 108 20.491 10.602 8.933 1.00 15.41 C ATOM 1005 CD1 ILE U 108 22.591 9.945 11.201 1.00 19.35 C ATOM 1006 H ILE U 108 19.717 12.763 11.459 1.00 0.00 H ATOM 1007 N ARG U 109 17.597 9.123 11.881 1.00 19.04 N ATOM 1008 CA ARG U 109 17.053 8.430 13.041 1.00 22.75 C ATOM 1009 C ARG U 109 16.929 6.979 12.699 1.00 20.42 C ATOM 1010 O ARG U 109 16.264 6.586 11.711 1.00 20.47 O ATOM 1011 CB ARG U 109 15.676 9.052 13.419 1.00 25.13 C ATOM 1012 CG ARG U 109 15.147 8.618 14.785 1.00 30.10 C ATOM 1013 CD ARG U 109 13.762 9.200 15.022 1.00 33.71 C ATOM 1014 NE ARG U 109 12.795 8.249 14.477 1.00 49.68 N ATOM 1015 CZ ARG U 109 12.049 7.414 15.219 1.00 56.40 C ATOM 1016 NH1 ARG U 109 11.217 6.556 14.641 1.00 55.99 N ATOM 1017 NH2 ARG U 109 12.104 7.446 16.543 1.00 54.70 N ATOM 1018 HE ARG U 109 12.676 8.217 13.444 1.00 0.00 H ATOM 1019 HH12 ARG U 109 10.644 5.914 15.225 1.00 0.00 H ATOM 1020 HH11 ARG U 109 11.138 6.526 13.604 1.00 0.00 H ATOM 1021 HH22 ARG U 109 11.520 6.793 17.104 1.00 0.00 H ATOM 1022 HH21 ARG U 109 12.731 8.124 17.021 1.00 0.00 H ATOM 1023 H ARG U 109 17.429 8.768 10.918 1.00 0.00 H ATOM 1024 N SER U 110 17.526 6.120 13.526 1.00 22.35 N ATOM 1025 CA SER U 110 17.344 4.697 13.261 1.00 25.39 C ATOM 1026 C SER U 110 15.921 4.262 13.535 1.00 26.99 C ATOM 1027 O SER U 110 15.238 4.888 14.343 1.00 26.27 O ATOM 1028 CB SER U 110 18.300 3.833 14.117 1.00 29.13 C ATOM 1029 OG SER U 110 18.027 3.950 15.517 1.00 27.72 O ATOM 1030 HG SER U 110 18.660 3.382 16.024 1.00 0.00 H ATOM 1031 H SER U 110 18.099 6.451 14.328 1.00 0.00 H ATOM 1032 N LYS U 110A 15.616 2.827 13.126 1.00 28.45 N ATOM 1033 CA LYS U 110A 14.284 2.283 13.346 1.00 31.19 C ATOM 1034 C LYS U 110A 14.123 2.315 14.863 1.00 31.80 C ATOM 1035 O LYS U 110A 13.062 2.128 15.427 1.00 33.30 O ATOM 1036 CB LYS U 110A 14.290 0.874 12.787 1.00 36.06 C ATOM 1037 CG LYS U 110A 13.136 -0.032 13.159 1.00 44.75 C ATOM 1038 CD LYS U 110A 13.457 -1.405 12.550 1.00 52.17 C ATOM 1039 CE LYS U 110A 13.158 -2.581 13.472 1.00 58.68 C ATOM 1040 NZ LYS U 110A 11.726 -2.975 13.419 1.00 66.49 N ATOM 1041 HZ1 LYS U 110A 11.135 -2.171 13.713 1.00 0.00 H ATOM 1042 HZ2 LYS U 110A 11.479 -3.251 12.447 1.00 0.00 H ATOM 1043 HZ3 LYS U 110A 11.565 -3.778 14.060 1.00 0.00 H ATOM 1044 H LYS U 110A 16.356 2.239 12.692 1.00 0.00 H ATOM 1045 N GLU U 110B 15.153 2.138 15.955 1.00 32.92 N ATOM 1046 CA GLU U 110B 15.256 2.133 17.388 1.00 29.15 C ATOM 1047 C GLU U 110B 15.181 3.562 17.889 1.00 26.49 C ATOM 1048 O GLU U 110B 15.078 3.784 19.109 1.00 31.91 O ATOM 1049 CB GLU U 110B 16.544 1.472 17.859 1.00 32.99 C ATOM 1050 CG GLU U 110B 16.659 -0.017 17.493 1.00 32.49 C ATOM 1051 CD GLU U 110B 16.871 -0.279 16.002 1.00 37.77 C ATOM 1052 OE1 GLU U 110B 17.625 0.497 15.340 1.00 34.50 O ATOM 1053 OE2 GLU U 110B 16.294 -1.279 15.490 1.00 42.26 O ATOM 1054 H GLU U 110B 16.088 1.964 15.534 1.00 0.00 H ATOM 1055 N GLY U 110C 14.857 4.757 16.909 1.00 26.19 N ATOM 1056 CA GLY U 110C 14.693 6.101 17.417 1.00 25.76 C ATOM 1057 C GLY U 110C 16.050 6.516 17.899 1.00 25.24 C ATOM 1058 O GLY U 110C 16.255 7.523 18.647 1.00 29.00 O ATOM 1059 H GLY U 110C 14.761 4.576 15.889 1.00 0.00 H ATOM 1060 N ARG U 110D 17.445 6.085 17.434 1.00 23.09 N ATOM 1061 CA ARG U 110D 18.684 6.660 17.890 1.00 23.33 C ATOM 1062 C ARG U 110D 19.385 7.416 16.767 1.00 22.20 C ATOM 1063 O ARG U 110D 19.043 7.229 15.603 1.00 24.34 O ATOM 1064 CB ARG U 110D 19.603 5.516 18.345 1.00 33.16 C ATOM 1065 CG ARG U 110D 19.046 4.732 19.509 1.00 42.15 C ATOM 1066 CD ARG U 110D 19.351 5.413 20.838 1.00 53.77 C ATOM 1067 NE ARG U 110D 18.380 4.981 21.862 1.00 73.56 N ATOM 1068 CZ ARG U 110D 18.494 3.899 22.644 1.00 74.72 C ATOM 1069 NH1 ARG U 110D 19.564 3.118 22.558 1.00 75.22 N ATOM 1070 NH2 ARG U 110D 17.535 3.600 23.528 1.00 72.06 N ATOM 1071 HE ARG U 110D 17.531 5.569 21.988 1.00 0.00 H ATOM 1072 HH12 ARG U 110D 19.646 2.280 23.168 1.00 0.00 H ATOM 1073 HH11 ARG U 110D 20.320 3.344 21.881 1.00 0.00 H ATOM 1074 HH22 ARG U 110D 17.629 2.759 24.132 1.00 0.00 H ATOM 1075 HH21 ARG U 110D 16.696 4.209 23.611 1.00 0.00 H ATOM 1076 H ARG U 110D 17.501 5.317 16.735 1.00 0.00 H ATOM 1077 N CYS U 111 20.289 8.295 17.135 1.00 22.73 N ATOM 1078 CA CYS U 111 21.194 8.933 16.192 1.00 20.75 C ATOM 1079 C CYS U 111 22.480 8.131 16.095 1.00 23.75 C ATOM 1080 O CYS U 111 22.552 7.022 16.635 1.00 23.60 O ATOM 1081 CB CYS U 111 21.478 10.348 16.699 1.00 20.10 C ATOM 1082 SG CYS U 111 19.962 11.385 16.700 1.00 26.23 S ATOM 1083 H CYS U 111 20.361 8.545 18.142 1.00 0.00 H ATOM 1084 N ALA U 112 23.485 8.646 15.364 1.00 21.01 N ATOM 1085 CA ALA U 112 24.757 7.935 15.217 1.00 20.45 C ATOM 1086 C ALA U 112 25.422 7.782 16.597 1.00 21.24 C ATOM 1087 O ALA U 112 25.392 8.695 17.432 1.00 24.81 O ATOM 1088 CB ALA U 112 25.698 8.716 14.322 1.00 22.42 C ATOM 1089 H ALA U 112 23.356 9.565 14.895 1.00 0.00 H ATOM 1090 N GLN U 113 26.079 6.628 16.765 1.00 20.01 N ATOM 1091 CA GLN U 113 26.901 6.352 17.921 1.00 22.65 C ATOM 1092 C GLN U 113 28.303 6.140 17.412 1.00 19.69 C ATOM 1093 O GLN U 113 28.552 5.210 16.639 1.00 21.83 O ATOM 1094 CB GLN U 113 26.350 5.106 18.576 1.00 26.89 C ATOM 1095 CG GLN U 113 25.068 5.512 19.299 1.00 39.57 C ATOM 1096 CD GLN U 113 24.222 4.367 19.806 1.00 47.75 C ATOM 1097 OE1 GLN U 113 23.380 4.583 20.685 1.00 58.41 O ATOM 1098 NE2 GLN U 113 24.424 3.152 19.263 1.00 47.27 N ATOM 1099 HE22 GLN U 113 25.146 3.026 18.526 1.00 0.00 H ATOM 1100 HE21 GLN U 113 23.858 2.340 19.581 1.00 0.00 H ATOM 1101 H GLN U 113 25.994 5.897 16.030 1.00 0.00 H ATOM 1102 N PRO U 114 29.230 7.058 17.767 1.00 21.67 N ATOM 1103 CA PRO U 114 30.610 7.059 17.260 1.00 21.28 C ATOM 1104 C PRO U 114 31.304 5.744 17.581 1.00 24.32 C ATOM 1105 O PRO U 114 31.056 5.139 18.624 1.00 24.85 O ATOM 1106 CB PRO U 114 31.245 8.224 17.978 1.00 23.88 C ATOM 1107 CG PRO U 114 30.073 9.128 18.316 1.00 22.09 C ATOM 1108 CD PRO U 114 28.958 8.213 18.632 1.00 25.61 C ATOM 1109 N SER U 115 32.151 5.284 16.659 1.00 20.16 N ATOM 1110 CA SER U 115 32.827 3.983 16.797 1.00 17.51 C ATOM 1111 C SER U 115 34.104 4.158 15.955 1.00 20.01 C ATOM 1112 O SER U 115 34.380 5.228 15.440 1.00 20.86 O ATOM 1113 CB SER U 115 31.961 2.901 16.201 1.00 19.73 C ATOM 1114 OG SER U 115 31.895 3.036 14.794 1.00 19.71 O ATOM 1115 HG SER U 115 31.324 2.319 14.421 1.00 0.00 H ATOM 1116 H SER U 115 32.340 5.863 15.816 1.00 0.00 H ATOM 1117 N ARG U 116 34.891 3.076 15.789 1.00 18.04 N ATOM 1118 CA ARG U 116 36.049 3.139 14.874 1.00 18.45 C ATOM 1119 C ARG U 116 35.706 3.536 13.426 1.00 20.57 C ATOM 1120 O ARG U 116 36.535 4.107 12.749 1.00 19.25 O ATOM 1121 CB ARG U 116 36.756 1.778 14.981 1.00 17.96 C ATOM 1122 CG ARG U 116 38.246 1.900 14.649 1.00 20.51 C ATOM 1123 CD ARG U 116 39.050 0.635 15.085 1.00 18.31 C ATOM 1124 NE ARG U 116 38.796 -0.425 14.182 1.00 19.28 N ATOM 1125 CZ ARG U 116 39.275 -1.665 14.327 1.00 20.31 C ATOM 1126 NH1 ARG U 116 39.823 -2.064 15.489 1.00 21.05 N ATOM 1127 NH2 ARG U 116 39.081 -2.566 13.367 1.00 19.08 N ATOM 1128 HE ARG U 116 38.199 -0.227 13.354 1.00 0.00 H ATOM 1129 HH12 ARG U 116 40.191 -3.032 15.585 1.00 0.00 H ATOM 1130 HH11 ARG U 116 39.879 -1.404 16.291 1.00 0.00 H ATOM 1131 HH22 ARG U 116 39.452 -3.531 13.477 1.00 0.00 H ATOM 1132 HH21 ARG U 116 38.558 -2.305 12.507 1.00 0.00 H ATOM 1133 H ARG U 116 34.683 2.197 16.305 1.00 0.00 H ATOM 1134 N THR U 117 34.482 3.249 12.983 1.00 16.02 N ATOM 1135 CA THR U 117 34.027 3.511 11.601 1.00 15.53 C ATOM 1136 C THR U 117 33.084 4.669 11.437 1.00 15.61 C ATOM 1137 O THR U 117 32.633 4.889 10.309 1.00 17.25 O ATOM 1138 CB THR U 117 33.426 2.262 10.990 1.00 15.69 C ATOM 1139 OG1 THR U 117 32.387 1.714 11.802 1.00 17.12 O ATOM 1140 CG2 THR U 117 34.571 1.202 10.981 1.00 17.56 C ATOM 1141 HG1 THR U 117 32.023 0.902 11.367 1.00 0.00 H ATOM 1142 H THR U 117 33.809 2.816 13.647 1.00 0.00 H ATOM 1143 N ILE U 118 32.742 5.367 12.544 1.00 15.29 N ATOM 1144 CA ILE U 118 31.645 6.396 12.483 1.00 16.33 C ATOM 1145 C ILE U 118 32.062 7.535 13.391 1.00 17.82 C ATOM 1146 O ILE U 118 32.275 7.312 14.587 1.00 19.12 O ATOM 1147 CB ILE U 118 30.291 5.854 12.993 1.00 17.22 C ATOM 1148 CG1 ILE U 118 29.794 4.621 12.159 1.00 17.34 C ATOM 1149 CG2 ILE U 118 29.302 7.073 12.994 1.00 18.86 C ATOM 1150 CD1 ILE U 118 28.440 4.058 12.569 1.00 19.59 C ATOM 1151 H ILE U 118 33.239 5.192 13.441 1.00 0.00 H ATOM 1152 N GLN U 119 32.300 8.731 12.834 1.00 14.74 N ATOM 1153 CA GLN U 119 32.842 9.878 13.579 1.00 14.94 C ATOM 1154 C GLN U 119 32.277 11.111 12.922 1.00 17.73 C ATOM 1155 O GLN U 119 31.862 11.026 11.764 1.00 20.80 O ATOM 1156 CB GLN U 119 34.378 9.936 13.543 1.00 19.11 C ATOM 1157 CG GLN U 119 35.045 8.771 14.274 1.00 22.08 C ATOM 1158 CD GLN U 119 34.995 8.875 15.807 1.00 25.54 C ATOM 1159 OE1 GLN U 119 35.211 9.966 16.350 1.00 30.48 O ATOM 1160 NE2 GLN U 119 34.771 7.746 16.507 1.00 27.47 N ATOM 1161 HE22 GLN U 119 34.594 6.851 16.008 1.00 0.00 H ATOM 1162 HE21 GLN U 119 34.775 7.769 17.547 1.00 0.00 H ATOM 1163 H GLN U 119 32.091 8.854 11.823 1.00 0.00 H ATOM 1164 N THR U 120 32.226 12.243 13.633 1.00 18.86 N ATOM 1165 CA THR U 120 31.846 13.505 12.999 1.00 16.87 C ATOM 1166 C THR U 120 33.060 14.258 12.428 1.00 16.66 C ATOM 1167 O THR U 120 34.203 13.990 12.826 1.00 18.65 O ATOM 1168 CB THR U 120 31.137 14.421 14.041 1.00 17.63 C ATOM 1169 OG1 THR U 120 32.066 14.828 15.082 1.00 21.38 O ATOM 1170 CG2 THR U 120 29.921 13.716 14.611 1.00 20.48 C ATOM 1171 HG1 THR U 120 31.597 15.408 15.733 1.00 0.00 H ATOM 1172 H THR U 120 32.459 12.225 14.646 1.00 0.00 H ATOM 1173 N ILE U 121 32.795 15.185 11.481 1.00 13.24 N ATOM 1174 CA ILE U 121 33.764 16.059 10.922 1.00 15.08 C ATOM 1175 C ILE U 121 33.429 17.508 11.394 1.00 15.95 C ATOM 1176 O ILE U 121 32.229 17.910 11.386 1.00 17.82 O ATOM 1177 CB ILE U 121 33.821 15.986 9.338 1.00 15.05 C ATOM 1178 CG1 ILE U 121 34.916 16.857 8.680 1.00 18.53 C ATOM 1179 CG2 ILE U 121 32.465 16.310 8.753 1.00 14.54 C ATOM 1180 CD1 ILE U 121 36.292 16.524 9.185 1.00 23.84 C ATOM 1181 H ILE U 121 31.816 15.263 11.139 1.00 0.00 H ATOM 1182 N ALA U 122 34.452 18.207 11.831 1.00 15.08 N ATOM 1183 CA ALA U 122 34.314 19.553 12.251 1.00 15.06 C ATOM 1184 C ALA U 122 33.892 20.488 11.113 1.00 15.44 C ATOM 1185 O ALA U 122 34.413 20.442 9.976 1.00 16.03 O ATOM 1186 CB ALA U 122 35.620 20.105 12.851 1.00 18.05 C ATOM 1187 H ALA U 122 35.390 17.759 11.870 1.00 0.00 H ATOM 1188 N LEU U 123 33.014 21.458 11.427 1.00 15.47 N ATOM 1189 CA LEU U 123 32.805 22.552 10.515 1.00 14.82 C ATOM 1190 C LEU U 123 33.853 23.650 10.594 1.00 17.10 C ATOM 1191 O LEU U 123 34.546 23.760 11.667 1.00 19.01 O ATOM 1192 CB LEU U 123 31.424 23.210 10.804 1.00 17.53 C ATOM 1193 CG LEU U 123 30.173 22.335 10.601 1.00 20.35 C ATOM 1194 CD1 LEU U 123 28.896 23.024 11.193 1.00 19.31 C ATOM 1195 CD2 LEU U 123 29.901 22.084 9.117 1.00 21.41 C ATOM 1196 H LEU U 123 32.489 21.418 12.324 1.00 0.00 H ATOM 1197 N PRO U 124 34.098 24.394 9.520 1.00 17.46 N ATOM 1198 CA PRO U 124 35.109 25.515 9.528 1.00 16.59 C ATOM 1199 C PRO U 124 34.606 26.671 10.366 1.00 18.61 C ATOM 1200 O PRO U 124 33.413 26.654 10.665 1.00 18.36 O ATOM 1201 CB PRO U 124 35.162 26.008 8.068 1.00 18.93 C ATOM 1202 CG PRO U 124 33.792 25.612 7.521 1.00 16.74 C ATOM 1203 CD PRO U 124 33.431 24.284 8.199 1.00 17.53 C ATOM 1204 N SER U 125 35.515 27.559 10.789 1.00 19.03 N ATOM 1205 CA SER U 125 35.068 28.860 11.394 1.00 20.31 C ATOM 1206 C SER U 125 34.535 29.672 10.243 1.00 19.43 C ATOM 1207 O SER U 125 34.916 29.491 9.084 1.00 20.54 O ATOM 1208 CB SER U 125 36.291 29.600 11.932 1.00 23.96 C ATOM 1209 OG SER U 125 36.774 28.913 13.043 1.00 35.22 O ATOM 1210 HG SER U 125 37.568 29.384 13.401 1.00 0.00 H ATOM 1211 H SER U 125 36.529 27.348 10.699 1.00 0.00 H ATOM 1212 N MET U 126 33.703 30.685 10.539 1.00 18.37 N ATOM 1213 CA MET U 126 33.100 31.447 9.446 1.00 17.99 C ATOM 1214 C MET U 126 34.129 32.160 8.575 1.00 19.90 C ATOM 1215 O MET U 126 35.166 32.710 9.073 1.00 19.20 O ATOM 1216 CB MET U 126 32.069 32.492 9.966 1.00 18.84 C ATOM 1217 CG MET U 126 32.835 33.547 10.810 1.00 16.49 C ATOM 1218 SD MET U 126 31.522 34.605 11.521 1.00 19.48 S ATOM 1219 CE MET U 126 32.601 35.697 12.503 1.00 18.54 C ATOM 1220 H MET U 126 33.491 30.923 11.529 1.00 0.00 H ATOM 1221 N TYR U 127 33.916 32.088 7.298 1.00 17.00 N ATOM 1222 CA TYR U 127 34.708 32.872 6.313 1.00 22.53 C ATOM 1223 C TYR U 127 36.222 32.555 6.515 1.00 20.96 C ATOM 1224 O TYR U 127 37.092 33.465 6.464 1.00 23.37 O ATOM 1225 CB TYR U 127 34.417 34.406 6.462 1.00 20.17 C ATOM 1226 CG TYR U 127 33.111 34.808 5.867 1.00 19.85 C ATOM 1227 CD1 TYR U 127 31.906 34.459 6.457 1.00 24.04 C ATOM 1228 CD2 TYR U 127 33.055 35.476 4.623 1.00 26.01 C ATOM 1229 CE1 TYR U 127 30.682 34.765 5.860 1.00 25.78 C ATOM 1230 CE2 TYR U 127 31.816 35.771 4.056 1.00 25.45 C ATOM 1231 CZ TYR U 127 30.657 35.389 4.657 1.00 27.89 C ATOM 1232 OH TYR U 127 29.403 35.653 4.169 1.00 30.32 O ATOM 1233 HH TYR U 127 28.725 35.274 4.782 1.00 0.00 H ATOM 1234 H TYR U 127 33.164 31.459 6.950 1.00 0.00 H ATOM 1235 N ASN U 128 36.536 31.299 6.831 1.00 24.85 N ATOM 1236 CA ASN U 128 37.919 30.892 7.190 1.00 25.15 C ATOM 1237 C ASN U 128 38.226 29.676 6.348 1.00 21.76 C ATOM 1238 O ASN U 128 37.857 28.563 6.729 1.00 27.41 O ATOM 1239 CB ASN U 128 38.041 30.550 8.686 1.00 27.90 C ATOM 1240 CG ASN U 128 39.458 30.119 9.081 1.00 35.20 C ATOM 1241 OD1 ASN U 128 39.690 29.649 10.204 1.00 44.33 O ATOM 1242 ND2 ASN U 128 40.395 30.300 8.186 1.00 33.08 N ATOM 1243 HD22 ASN U 128 40.155 30.698 7.255 1.00 0.00 H ATOM 1244 HD21 ASN U 128 41.379 30.046 8.405 1.00 0.00 H ATOM 1245 H ASN U 128 35.786 30.578 6.826 1.00 0.00 H ATOM 1246 N ASP U 129 38.806 29.916 5.166 1.00 19.80 N ATOM 1247 CA ASP U 129 39.146 28.792 4.256 1.00 20.97 C ATOM 1248 C ASP U 129 40.651 28.711 4.048 1.00 20.74 C ATOM 1249 O ASP U 129 41.387 29.684 4.263 1.00 22.18 O ATOM 1250 CB ASP U 129 38.467 29.025 2.919 1.00 20.43 C ATOM 1251 CG ASP U 129 36.939 29.077 3.045 1.00 25.43 C ATOM 1252 OD1 ASP U 129 36.354 28.177 3.677 1.00 25.21 O ATOM 1253 OD2 ASP U 129 36.396 30.079 2.562 1.00 27.46 O ATOM 1254 H ASP U 129 39.020 30.894 4.883 1.00 0.00 H ATOM 1255 N PRO U 130 41.151 27.543 3.598 1.00 20.47 N ATOM 1256 CA PRO U 130 42.594 27.447 3.372 1.00 19.65 C ATOM 1257 C PRO U 130 43.035 28.267 2.192 1.00 20.76 C ATOM 1258 O PRO U 130 42.240 28.621 1.325 1.00 21.43 O ATOM 1259 CB PRO U 130 42.769 25.929 3.019 1.00 20.42 C ATOM 1260 CG PRO U 130 41.568 25.265 3.663 1.00 19.20 C ATOM 1261 CD PRO U 130 40.453 26.237 3.395 1.00 23.03 C ATOM 1262 N GLN U 131 44.317 28.566 2.126 1.00 22.54 N ATOM 1263 CA GLN U 131 44.886 29.316 0.994 1.00 22.05 C ATOM 1264 C GLN U 131 44.719 28.596 -0.338 1.00 23.10 C ATOM 1265 O GLN U 131 44.766 27.388 -0.385 1.00 21.24 O ATOM 1266 CB GLN U 131 46.403 29.508 1.194 1.00 26.15 C ATOM 1267 CG GLN U 131 46.770 29.972 2.601 1.00 37.58 C ATOM 1268 CD GLN U 131 45.978 31.204 3.032 1.00 48.38 C ATOM 1269 OE1 GLN U 131 45.080 31.121 3.890 1.00 58.34 O ATOM 1270 NE2 GLN U 131 46.301 32.361 2.438 1.00 51.08 N ATOM 1271 HE22 GLN U 131 47.058 32.386 1.726 1.00 0.00 H ATOM 1272 HE21 GLN U 131 45.794 33.234 2.689 1.00 0.00 H ATOM 1273 H GLN U 131 44.946 28.263 2.897 1.00 0.00 H ATOM 1274 N PHE U 132 44.546 29.310 -1.432 1.00 21.78 N ATOM 1275 CA PHE U 132 44.461 28.607 -2.672 1.00 24.30 C ATOM 1276 C PHE U 132 45.802 27.855 -2.885 1.00 21.10 C ATOM 1277 O PHE U 132 46.870 28.309 -2.433 1.00 24.45 O ATOM 1278 CB PHE U 132 44.143 29.552 -3.850 1.00 28.90 C ATOM 1279 CG PHE U 132 45.344 30.375 -4.313 1.00 36.68 C ATOM 1280 CD1 PHE U 132 46.382 29.779 -5.083 1.00 42.31 C ATOM 1281 CD2 PHE U 132 45.437 31.753 -4.015 1.00 45.70 C ATOM 1282 CE1 PHE U 132 47.483 30.519 -5.514 1.00 44.99 C ATOM 1283 CE2 PHE U 132 46.552 32.495 -4.451 1.00 44.80 C ATOM 1284 CZ PHE U 132 47.566 31.873 -5.200 1.00 43.52 C ATOM 1285 H PHE U 132 44.474 30.347 -1.394 1.00 0.00 H ATOM 1286 N GLY U 133 45.746 26.701 -3.564 1.00 18.53 N ATOM 1287 CA GLY U 133 46.916 25.843 -3.725 1.00 20.40 C ATOM 1288 C GLY U 133 47.005 24.786 -2.627 1.00 18.81 C ATOM 1289 O GLY U 133 47.739 23.824 -2.830 1.00 20.98 O ATOM 1290 H GLY U 133 44.843 26.408 -3.989 1.00 0.00 H ATOM 1291 N THR U 134 46.257 24.923 -1.523 1.00 19.94 N ATOM 1292 CA THR U 134 46.211 23.897 -0.433 1.00 17.82 C ATOM 1293 C THR U 134 45.643 22.615 -1.046 1.00 16.79 C ATOM 1294 O THR U 134 44.695 22.628 -1.826 1.00 18.72 O ATOM 1295 CB THR U 134 45.276 24.305 0.725 1.00 18.41 C ATOM 1296 OG1 THR U 134 45.855 25.524 1.228 1.00 22.09 O ATOM 1297 CG2 THR U 134 45.257 23.259 1.861 1.00 21.01 C ATOM 1298 HG1 THR U 134 45.873 26.202 0.506 1.00 0.00 H ATOM 1299 H THR U 134 45.681 25.783 -1.418 1.00 0.00 H ATOM 1300 N SER U 135 46.231 21.490 -0.673 1.00 16.66 N ATOM 1301 CA SER U 135 45.666 20.189 -1.045 1.00 16.36 C ATOM 1302 C SER U 135 44.597 19.720 -0.051 1.00 15.99 C ATOM 1303 O SER U 135 44.761 19.774 1.187 1.00 18.16 O ATOM 1304 CB SER U 135 46.762 19.178 -1.002 1.00 17.80 C ATOM 1305 OG SER U 135 47.784 19.420 -1.962 1.00 21.05 O ATOM 1306 HG SER U 135 48.188 20.308 -1.795 1.00 0.00 H ATOM 1307 H SER U 135 47.104 21.529 -0.109 1.00 0.00 H ATOM 1308 N CYS U 136 43.463 19.214 -0.595 1.00 15.57 N ATOM 1309 CA CYS U 136 42.379 18.728 0.252 1.00 14.95 C ATOM 1310 C CYS U 136 41.969 17.396 -0.295 1.00 14.17 C ATOM 1311 O CYS U 136 42.337 17.033 -1.442 1.00 16.06 O ATOM 1312 CB CYS U 136 41.168 19.663 0.080 1.00 13.67 C ATOM 1313 SG CYS U 136 41.631 21.348 0.757 1.00 19.93 S ATOM 1314 H CYS U 136 43.364 19.172 -1.629 1.00 0.00 H ATOM 1315 N GLU U 137 41.106 16.686 0.399 1.00 14.31 N ATOM 1316 CA GLU U 137 40.707 15.395 -0.039 1.00 13.52 C ATOM 1317 C GLU U 137 39.205 15.388 -0.389 1.00 14.95 C ATOM 1318 O GLU U 137 38.450 16.150 0.190 1.00 14.89 O ATOM 1319 CB GLU U 137 41.058 14.282 0.994 1.00 17.27 C ATOM 1320 CG GLU U 137 40.397 14.385 2.355 1.00 15.70 C ATOM 1321 CD GLU U 137 41.054 13.432 3.412 1.00 20.16 C ATOM 1322 OE1 GLU U 137 42.268 13.095 3.300 1.00 24.91 O ATOM 1323 OE2 GLU U 137 40.357 13.022 4.340 1.00 22.30 O ATOM 1324 H GLU U 137 40.711 17.075 1.279 1.00 0.00 H ATOM 1325 N ILE U 138 38.799 14.478 -1.278 1.00 11.21 N ATOM 1326 CA ILE U 138 37.408 14.265 -1.661 1.00 12.41 C ATOM 1327 C ILE U 138 37.138 12.760 -1.596 1.00 12.35 C ATOM 1328 O ILE U 138 38.066 11.977 -1.870 1.00 13.00 O ATOM 1329 CB ILE U 138 37.011 14.775 -3.073 1.00 13.04 C ATOM 1330 CG1 ILE U 138 38.059 14.461 -4.087 1.00 13.03 C ATOM 1331 CG2 ILE U 138 36.925 16.309 -3.007 1.00 14.90 C ATOM 1332 CD1 ILE U 138 37.606 14.914 -5.507 1.00 14.00 C ATOM 1333 H ILE U 138 39.523 13.881 -1.727 1.00 0.00 H ATOM 1334 N THR U 139 35.903 12.337 -1.238 1.00 10.81 N ATOM 1335 CA THR U 139 35.605 10.915 -1.022 1.00 11.46 C ATOM 1336 C THR U 139 34.238 10.616 -1.695 1.00 12.04 C ATOM 1337 O THR U 139 33.308 11.471 -1.564 1.00 12.57 O ATOM 1338 CB THR U 139 35.465 10.617 0.496 1.00 13.16 C ATOM 1339 OG1 THR U 139 36.722 11.032 1.102 1.00 12.63 O ATOM 1340 CG2 THR U 139 35.296 9.151 0.784 1.00 12.81 C ATOM 1341 HG1 THR U 139 36.863 11.998 0.938 1.00 0.00 H ATOM 1342 H THR U 139 35.145 13.038 -1.113 1.00 0.00 H ATOM 1343 N GLY U 140 34.090 9.419 -2.253 1.00 11.26 N ATOM 1344 CA GLY U 140 32.747 9.069 -2.688 1.00 11.05 C ATOM 1345 C GLY U 140 32.698 7.777 -3.470 1.00 10.59 C ATOM 1346 O GLY U 140 33.777 7.156 -3.729 1.00 13.21 O ATOM 1347 H GLY U 140 34.892 8.767 -2.372 1.00 0.00 H ATOM 1348 N PHE U 141 31.495 7.351 -3.801 1.00 10.72 N ATOM 1349 CA PHE U 141 31.243 6.177 -4.627 1.00 11.79 C ATOM 1350 C PHE U 141 30.866 6.596 -6.037 1.00 11.27 C ATOM 1351 O PHE U 141 30.396 5.768 -6.820 1.00 10.50 O ATOM 1352 CB PHE U 141 30.031 5.466 -4.065 1.00 12.02 C ATOM 1353 CG PHE U 141 30.265 4.669 -2.758 1.00 12.08 C ATOM 1354 CD1 PHE U 141 31.067 3.503 -2.734 1.00 11.41 C ATOM 1355 CD2 PHE U 141 29.636 5.030 -1.548 1.00 13.28 C ATOM 1356 CE1 PHE U 141 31.245 2.757 -1.601 1.00 12.78 C ATOM 1357 CE2 PHE U 141 29.871 4.265 -0.364 1.00 11.96 C ATOM 1358 CZ PHE U 141 30.710 3.118 -0.408 1.00 13.61 C ATOM 1359 H PHE U 141 30.675 7.886 -3.451 1.00 0.00 H ATOM 1360 N GLY U 142 31.273 7.785 -6.497 1.00 10.48 N ATOM 1361 CA GLY U 142 30.906 8.151 -7.868 1.00 11.86 C ATOM 1362 C GLY U 142 31.745 7.463 -8.945 1.00 11.14 C ATOM 1363 O GLY U 142 32.721 6.711 -8.651 1.00 12.53 O ATOM 1364 H GLY U 142 31.832 8.429 -5.901 1.00 0.00 H ATOM 1365 N LYS U 143 31.435 7.818 -10.178 1.00 12.51 N ATOM 1366 CA LYS U 143 32.051 7.103 -11.328 1.00 13.81 C ATOM 1367 C LYS U 143 33.542 7.204 -11.307 1.00 12.70 C ATOM 1368 O LYS U 143 34.144 8.254 -10.924 1.00 11.45 O ATOM 1369 CB LYS U 143 31.522 7.682 -12.651 1.00 13.83 C ATOM 1370 CG LYS U 143 30.083 7.260 -12.932 1.00 16.76 C ATOM 1371 CD LYS U 143 29.713 7.623 -14.381 1.00 21.41 C ATOM 1372 CE LYS U 143 28.273 7.310 -14.668 1.00 25.35 C ATOM 1373 NZ LYS U 143 28.079 7.990 -16.001 1.00 31.65 N ATOM 1374 HZ1 LYS U 143 28.268 9.008 -15.900 1.00 0.00 H ATOM 1375 HZ2 LYS U 143 28.736 7.582 -16.696 1.00 0.00 H ATOM 1376 HZ3 LYS U 143 27.100 7.848 -16.322 1.00 0.00 H ATOM 1377 H LYS U 143 30.763 8.594 -10.345 1.00 0.00 H ATOM 1378 N GLU U 144 34.163 6.107 -11.781 1.00 13.03 N ATOM 1379 CA GLU U 144 35.616 6.168 -11.896 1.00 13.14 C ATOM 1380 C GLU U 144 36.139 6.695 -13.281 1.00 13.13 C ATOM 1381 O GLU U 144 37.358 7.021 -13.453 1.00 14.94 O ATOM 1382 CB GLU U 144 36.196 4.752 -11.713 1.00 13.83 C ATOM 1383 CG GLU U 144 35.928 4.153 -10.369 1.00 13.43 C ATOM 1384 CD GLU U 144 36.884 3.004 -10.115 1.00 13.59 C ATOM 1385 OE1 GLU U 144 36.394 1.919 -10.319 1.00 17.78 O ATOM 1386 OE2 GLU U 144 38.099 3.252 -9.926 1.00 13.68 O ATOM 1387 H GLU U 144 33.631 5.256 -12.053 1.00 0.00 H ATOM 1388 N GLN U 145 35.219 6.663 -14.240 1.00 12.94 N ATOM 1389 CA GLN U 145 35.441 7.237 -15.607 1.00 14.77 C ATOM 1390 C GLN U 145 34.132 7.876 -15.992 1.00 16.15 C ATOM 1391 O GLN U 145 33.050 7.391 -15.659 1.00 15.02 O ATOM 1392 CB GLN U 145 35.800 6.159 -16.644 1.00 16.82 C ATOM 1393 CG GLN U 145 37.064 5.468 -16.331 1.00 20.09 C ATOM 1394 CD GLN U 145 37.327 4.396 -17.360 1.00 27.02 C ATOM 1395 OE1 GLN U 145 36.530 3.396 -17.533 1.00 28.35 O ATOM 1396 NE2 GLN U 145 38.411 4.546 -18.030 1.00 23.96 N ATOM 1397 HE22 GLN U 145 39.021 5.370 -17.854 1.00 0.00 H ATOM 1398 HE21 GLN U 145 38.679 3.844 -18.749 1.00 0.00 H ATOM 1399 H GLN U 145 34.302 6.219 -14.032 1.00 0.00 H ATOM 1400 N SER U 146 34.221 8.998 -16.727 1.00 17.17 N ATOM 1401 CA SER U 146 33.045 9.707 -17.179 1.00 18.52 C ATOM 1402 C SER U 146 32.049 8.799 -17.989 1.00 20.25 C ATOM 1403 O SER U 146 30.829 8.938 -17.825 1.00 22.91 O ATOM 1404 CB SER U 146 33.488 10.950 -17.996 1.00 18.70 C ATOM 1405 OG SER U 146 34.255 11.832 -17.182 1.00 17.87 O ATOM 1406 HG SER U 146 34.529 12.618 -17.717 1.00 0.00 H ATOM 1407 H SER U 146 35.161 9.366 -16.977 1.00 0.00 H ATOM 1408 N THR U 147 32.594 7.833 -18.735 1.00 22.92 N ATOM 1409 CA THR U 147 31.752 7.048 -19.640 1.00 24.86 C ATOM 1410 C THR U 147 31.238 5.788 -18.942 1.00 22.92 C ATOM 1411 O THR U 147 30.488 5.001 -19.523 1.00 25.87 O ATOM 1412 CB THR U 147 32.594 6.647 -20.852 1.00 22.96 C ATOM 1413 OG1 THR U 147 33.770 5.985 -20.448 1.00 27.07 O ATOM 1414 CG2 THR U 147 33.000 8.011 -21.736 1.00 28.14 C ATOM 1415 HG1 THR U 147 33.530 5.169 -19.941 1.00 0.00 H ATOM 1416 H THR U 147 33.614 7.639 -18.673 1.00 0.00 H ATOM 1417 N ASP U 148 31.705 5.509 -17.727 1.00 19.55 N ATOM 1418 CA ASP U 148 31.265 4.304 -17.051 1.00 18.36 C ATOM 1419 C ASP U 148 29.791 4.264 -16.854 1.00 23.25 C ATOM 1420 O ASP U 148 29.119 5.301 -16.684 1.00 21.63 O ATOM 1421 CB ASP U 148 31.919 4.182 -15.642 1.00 16.27 C ATOM 1422 CG ASP U 148 33.351 3.685 -15.695 1.00 18.17 C ATOM 1423 OD1 ASP U 148 33.911 3.355 -16.737 1.00 17.40 O ATOM 1424 OD2 ASP U 148 33.985 3.710 -14.593 1.00 15.49 O ATOM 1425 H ASP U 148 32.381 6.151 -17.266 1.00 0.00 H ATOM 1426 N TYR U 149 29.273 3.050 -16.925 1.00 19.96 N ATOM 1427 CA TYR U 149 27.908 2.860 -16.627 1.00 23.45 C ATOM 1428 C TYR U 149 27.710 2.504 -15.163 1.00 22.59 C ATOM 1429 O TYR U 149 26.701 2.844 -14.607 1.00 31.00 O ATOM 1430 CB TYR U 149 27.413 1.725 -17.551 1.00 27.89 C ATOM 1431 CG TYR U 149 25.919 1.575 -17.516 1.00 42.66 C ATOM 1432 CD1 TYR U 149 25.058 2.691 -17.748 1.00 46.19 C ATOM 1433 CD2 TYR U 149 25.344 0.325 -17.264 1.00 45.20 C ATOM 1434 CE1 TYR U 149 23.670 2.541 -17.713 1.00 48.34 C ATOM 1435 CE2 TYR U 149 23.961 0.157 -17.226 1.00 44.55 C ATOM 1436 CZ TYR U 149 23.133 1.250 -17.449 1.00 48.05 C ATOM 1437 OH TYR U 149 21.788 1.028 -17.396 1.00 49.05 O ATOM 1438 HH TYR U 149 21.538 0.359 -18.082 1.00 0.00 H ATOM 1439 H TYR U 149 29.867 2.242 -17.198 1.00 0.00 H ATOM 1440 N LEU U 150 28.693 1.850 -14.521 1.00 17.93 N ATOM 1441 CA LEU U 150 28.554 1.404 -13.151 1.00 17.15 C ATOM 1442 C LEU U 150 29.361 2.316 -12.192 1.00 13.31 C ATOM 1443 O LEU U 150 30.228 3.034 -12.623 1.00 17.12 O ATOM 1444 CB LEU U 150 29.129 0.009 -12.963 1.00 18.48 C ATOM 1445 CG LEU U 150 28.452 -1.172 -13.746 1.00 19.37 C ATOM 1446 CD1 LEU U 150 29.418 -2.335 -13.782 1.00 21.32 C ATOM 1447 CD2 LEU U 150 27.297 -1.651 -12.971 1.00 23.07 C ATOM 1448 H LEU U 150 29.582 1.658 -15.025 1.00 0.00 H ATOM 1449 N TYR U 151 28.927 2.300 -10.934 1.00 14.04 N ATOM 1450 CA TYR U 151 29.631 3.013 -9.879 1.00 14.37 C ATOM 1451 C TYR U 151 30.580 1.958 -9.295 1.00 13.99 C ATOM 1452 O TYR U 151 30.260 0.748 -9.283 1.00 15.93 O ATOM 1453 CB TYR U 151 28.638 3.421 -8.790 1.00 16.77 C ATOM 1454 CG TYR U 151 27.777 4.687 -9.048 1.00 17.52 C ATOM 1455 CD1 TYR U 151 28.150 5.633 -9.955 1.00 22.04 C ATOM 1456 CD2 TYR U 151 26.561 4.780 -8.422 1.00 26.68 C ATOM 1457 CE1 TYR U 151 27.354 6.761 -10.176 1.00 22.41 C ATOM 1458 CE2 TYR U 151 25.742 5.912 -8.636 1.00 27.66 C ATOM 1459 CZ TYR U 151 26.183 6.861 -9.531 1.00 24.91 C ATOM 1460 OH TYR U 151 25.412 7.987 -9.812 1.00 27.46 O ATOM 1461 HH TYR U 151 25.885 8.553 -10.472 1.00 0.00 H ATOM 1462 H TYR U 151 28.066 1.766 -10.700 1.00 0.00 H ATOM 1463 N PRO U 152 31.722 2.361 -8.707 1.00 14.36 N ATOM 1464 CA PRO U 152 32.598 1.418 -8.052 1.00 13.32 C ATOM 1465 C PRO U 152 31.920 0.810 -6.849 1.00 13.78 C ATOM 1466 O PRO U 152 31.102 1.442 -6.179 1.00 14.23 O ATOM 1467 CB PRO U 152 33.773 2.228 -7.599 1.00 13.06 C ATOM 1468 CG PRO U 152 33.199 3.642 -7.502 1.00 11.82 C ATOM 1469 CD PRO U 152 32.173 3.750 -8.617 1.00 15.18 C ATOM 1470 N GLU U 153 32.235 -0.452 -6.544 1.00 13.44 N ATOM 1471 CA GLU U 153 31.693 -1.077 -5.350 1.00 15.02 C ATOM 1472 C GLU U 153 32.432 -0.643 -4.082 1.00 12.42 C ATOM 1473 O GLU U 153 31.895 -0.848 -2.988 1.00 15.04 O ATOM 1474 CB GLU U 153 31.796 -2.603 -5.529 1.00 19.73 C ATOM 1475 CG GLU U 153 31.118 -3.583 -4.542 1.00 23.60 C ATOM 1476 CD GLU U 153 29.648 -3.246 -4.200 1.00 29.15 C ATOM 1477 OE1 GLU U 153 28.902 -2.780 -5.135 1.00 32.90 O ATOM 1478 OE2 GLU U 153 29.366 -3.454 -2.972 1.00 33.43 O ATOM 1479 H GLU U 153 32.872 -0.990 -7.165 1.00 0.00 H ATOM 1480 N GLN U 154 33.650 -0.133 -4.214 1.00 12.85 N ATOM 1481 CA GLN U 154 34.475 0.187 -3.020 1.00 11.29 C ATOM 1482 C GLN U 154 34.682 1.703 -2.991 1.00 11.39 C ATOM 1483 O GLN U 154 34.921 2.328 -4.037 1.00 13.03 O ATOM 1484 CB GLN U 154 35.868 -0.495 -3.213 1.00 13.15 C ATOM 1485 CG GLN U 154 36.794 -0.283 -1.973 1.00 13.91 C ATOM 1486 CD GLN U 154 36.392 -1.196 -0.822 1.00 16.36 C ATOM 1487 OE1 GLN U 154 35.918 -2.371 -1.015 1.00 19.09 O ATOM 1488 NE2 GLN U 154 36.628 -0.715 0.399 1.00 16.47 N ATOM 1489 HE22 GLN U 154 37.013 0.244 0.515 1.00 0.00 H ATOM 1490 HE21 GLN U 154 36.427 -1.299 1.236 1.00 0.00 H ATOM 1491 H GLN U 154 34.032 0.045 -5.165 1.00 0.00 H ATOM 1492 N LEU U 155 34.666 2.253 -1.776 1.00 11.36 N ATOM 1493 CA LEU U 155 34.742 3.724 -1.614 1.00 10.90 C ATOM 1494 C LEU U 155 36.121 4.193 -2.134 1.00 12.36 C ATOM 1495 O LEU U 155 37.137 3.459 -2.077 1.00 12.21 O ATOM 1496 CB LEU U 155 34.637 4.019 -0.128 1.00 11.86 C ATOM 1497 CG LEU U 155 34.578 5.477 0.309 1.00 10.64 C ATOM 1498 CD1 LEU U 155 33.234 6.094 -0.201 1.00 10.54 C ATOM 1499 CD2 LEU U 155 34.647 5.583 1.865 1.00 11.54 C ATOM 1500 H LEU U 155 34.600 1.644 -0.935 1.00 0.00 H ATOM 1501 N LYS U 156 36.177 5.413 -2.658 1.00 11.55 N ATOM 1502 CA LYS U 156 37.398 5.985 -3.189 1.00 12.11 C ATOM 1503 C LYS U 156 37.633 7.326 -2.600 1.00 12.23 C ATOM 1504 O LYS U 156 36.724 8.007 -2.120 1.00 12.64 O ATOM 1505 CB LYS U 156 37.386 6.186 -4.699 1.00 11.64 C ATOM 1506 CG LYS U 156 37.295 4.783 -5.434 1.00 11.28 C ATOM 1507 CD LYS U 156 37.461 4.937 -6.955 1.00 10.93 C ATOM 1508 CE LYS U 156 38.875 5.435 -7.402 1.00 12.25 C ATOM 1509 NZ LYS U 156 38.885 5.627 -8.887 1.00 14.53 N ATOM 1510 HZ1 LYS U 156 38.670 4.723 -9.354 1.00 0.00 H ATOM 1511 HZ2 LYS U 156 38.168 6.333 -9.149 1.00 0.00 H ATOM 1512 HZ3 LYS U 156 39.824 5.958 -9.186 1.00 0.00 H ATOM 1513 H LYS U 156 35.307 5.982 -2.688 1.00 0.00 H ATOM 1514 N MET U 157 38.914 7.758 -2.641 1.00 11.90 N ATOM 1515 CA MET U 157 39.255 9.114 -2.262 1.00 12.87 C ATOM 1516 C MET U 157 40.355 9.626 -3.196 1.00 13.57 C ATOM 1517 O MET U 157 41.113 8.814 -3.767 1.00 13.35 O ATOM 1518 CB MET U 157 39.710 9.216 -0.798 1.00 15.52 C ATOM 1519 CG MET U 157 40.783 8.295 -0.288 1.00 23.07 C ATOM 1520 SD MET U 157 40.929 8.729 1.507 1.00 34.76 S ATOM 1521 CE MET U 157 40.721 10.496 1.586 1.00 17.58 C ATOM 1522 H MET U 157 39.665 7.108 -2.949 1.00 0.00 H ATOM 1523 N THR U 158 40.468 10.942 -3.301 1.00 13.25 N ATOM 1524 CA THR U 158 41.613 11.504 -4.012 1.00 12.30 C ATOM 1525 C THR U 158 41.918 12.861 -3.414 1.00 13.73 C ATOM 1526 O THR U 158 41.276 13.342 -2.439 1.00 12.82 O ATOM 1527 CB THR U 158 41.303 11.624 -5.526 1.00 14.36 C ATOM 1528 OG1 THR U 158 42.549 11.832 -6.204 1.00 15.13 O ATOM 1529 CG2 THR U 158 40.363 12.727 -5.869 1.00 12.84 C ATOM 1530 HG1 THR U 158 42.384 11.913 -7.177 1.00 0.00 H ATOM 1531 H THR U 158 39.750 11.567 -2.882 1.00 0.00 H ATOM 1532 N VAL U 159 42.944 13.512 -3.975 1.00 12.64 N ATOM 1533 CA VAL U 159 43.461 14.789 -3.494 1.00 14.67 C ATOM 1534 C VAL U 159 43.381 15.785 -4.667 1.00 15.19 C ATOM 1535 O VAL U 159 43.701 15.468 -5.786 1.00 16.92 O ATOM 1536 CB VAL U 159 44.953 14.699 -3.013 1.00 17.17 C ATOM 1537 CG1 VAL U 159 45.528 16.085 -2.654 1.00 21.83 C ATOM 1538 CG2 VAL U 159 44.968 13.869 -1.742 1.00 18.12 C ATOM 1539 H VAL U 159 43.401 13.082 -4.804 1.00 0.00 H ATOM 1540 N VAL U 160 42.795 16.957 -4.387 1.00 14.59 N ATOM 1541 CA VAL U 160 42.707 18.052 -5.319 1.00 14.93 C ATOM 1542 C VAL U 160 43.187 19.330 -4.634 1.00 15.03 C ATOM 1543 O VAL U 160 43.260 19.373 -3.434 1.00 16.78 O ATOM 1544 CB VAL U 160 41.273 18.216 -5.879 1.00 15.53 C ATOM 1545 CG1 VAL U 160 40.954 17.090 -6.886 1.00 17.73 C ATOM 1546 CG2 VAL U 160 40.305 18.296 -4.730 1.00 15.04 C ATOM 1547 H VAL U 160 42.380 17.084 -3.442 1.00 0.00 H ATOM 1548 N LYS U 161 43.578 20.324 -5.397 1.00 15.66 N ATOM 1549 CA LYS U 161 44.119 21.598 -4.810 1.00 15.28 C ATOM 1550 C LYS U 161 43.122 22.701 -5.009 1.00 16.38 C ATOM 1551 O LYS U 161 42.495 22.766 -6.082 1.00 16.20 O ATOM 1552 CB LYS U 161 45.497 21.982 -5.448 1.00 16.22 C ATOM 1553 CG LYS U 161 46.501 20.893 -5.177 1.00 21.52 C ATOM 1554 CD LYS U 161 47.738 21.455 -5.828 1.00 26.60 C ATOM 1555 CE LYS U 161 48.940 20.676 -5.451 1.00 31.72 C ATOM 1556 NZ LYS U 161 50.025 21.698 -5.499 1.00 34.06 N ATOM 1557 HZ1 LYS U 161 50.087 22.092 -6.460 1.00 0.00 H ATOM 1558 HZ2 LYS U 161 49.812 22.460 -4.824 1.00 0.00 H ATOM 1559 HZ3 LYS U 161 50.930 21.253 -5.247 1.00 0.00 H ATOM 1560 H LYS U 161 43.512 20.228 -6.430 1.00 0.00 H ATOM 1561 N LEU U 162 42.985 23.530 -3.998 1.00 16.20 N ATOM 1562 CA LEU U 162 42.040 24.627 -4.045 1.00 18.11 C ATOM 1563 C LEU U 162 42.525 25.612 -5.095 1.00 21.83 C ATOM 1564 O LEU U 162 43.735 25.893 -5.207 1.00 19.44 O ATOM 1565 CB LEU U 162 42.061 25.332 -2.748 1.00 17.42 C ATOM 1566 CG LEU U 162 41.075 24.904 -1.710 1.00 22.10 C ATOM 1567 CD1 LEU U 162 40.401 23.579 -1.983 1.00 26.81 C ATOM 1568 CD2 LEU U 162 41.261 25.250 -0.246 1.00 22.74 C ATOM 1569 H LEU U 162 43.567 23.396 -3.147 1.00 0.00 H ATOM 1570 N ILE U 163 41.574 26.130 -5.865 1.00 18.21 N ATOM 1571 CA ILE U 163 41.875 27.123 -6.934 1.00 19.17 C ATOM 1572 C ILE U 163 41.231 28.453 -6.605 1.00 22.33 C ATOM 1573 O ILE U 163 40.107 28.435 -6.150 1.00 22.91 O ATOM 1574 CB ILE U 163 41.272 26.533 -8.229 1.00 22.91 C ATOM 1575 CG1 ILE U 163 42.195 25.390 -8.719 1.00 28.03 C ATOM 1576 CG2 ILE U 163 41.056 27.543 -9.331 1.00 23.60 C ATOM 1577 CD1 ILE U 163 41.554 24.536 -9.785 1.00 33.29 C ATOM 1578 H ILE U 163 40.588 25.833 -5.717 1.00 0.00 H ATOM 1579 N SER U 164 41.919 29.598 -6.862 1.00 22.60 N ATOM 1580 CA SER U 164 41.325 30.932 -6.431 1.00 23.38 C ATOM 1581 C SER U 164 40.035 31.274 -7.192 1.00 25.10 C ATOM 1582 O SER U 164 39.872 30.782 -8.339 1.00 22.92 O ATOM 1583 CB SER U 164 42.312 32.075 -6.699 1.00 25.78 C ATOM 1584 OG SER U 164 42.723 32.033 -8.031 1.00 27.89 O ATOM 1585 HG SER U 164 43.360 32.771 -8.202 1.00 0.00 H ATOM 1586 H SER U 164 42.839 29.563 -7.346 1.00 0.00 H ATOM 1587 N HIS U 165 39.128 32.058 -6.589 1.00 21.60 N ATOM 1588 CA HIS U 165 37.925 32.523 -7.297 1.00 26.89 C ATOM 1589 C HIS U 165 38.402 33.276 -8.512 1.00 26.02 C ATOM 1590 O HIS U 165 37.831 33.143 -9.576 1.00 23.21 O ATOM 1591 CB HIS U 165 36.969 33.386 -6.452 1.00 25.66 C ATOM 1592 CG HIS U 165 35.694 33.759 -7.204 1.00 30.49 C ATOM 1593 ND1 HIS U 165 35.471 35.013 -7.727 1.00 34.41 N ATOM 1594 CD2 HIS U 165 34.599 32.978 -7.609 1.00 34.60 C ATOM 1595 CE1 HIS U 165 34.284 35.031 -8.395 1.00 31.38 C ATOM 1596 NE2 HIS U 165 33.757 33.790 -8.343 1.00 36.40 N ATOM 1597 H HIS U 165 39.279 32.343 -5.600 1.00 0.00 H ATOM 1598 N ARG U 166 39.515 34.002 -8.380 1.00 27.24 N ATOM 1599 CA ARG U 166 39.997 34.664 -9.579 1.00 29.80 C ATOM 1600 C ARG U 166 40.351 33.731 -10.758 1.00 29.21 C ATOM 1601 O ARG U 166 40.077 34.029 -11.937 1.00 26.61 O ATOM 1602 CB ARG U 166 41.194 35.616 -9.309 1.00 36.51 C ATOM 1603 CG ARG U 166 41.856 36.040 -10.641 1.00 43.42 C ATOM 1604 CD ARG U 166 42.488 37.420 -10.685 1.00 59.14 C ATOM 1605 NE ARG U 166 43.853 37.446 -10.129 1.00 64.73 N ATOM 1606 CZ ARG U 166 44.958 37.789 -10.802 1.00 69.70 C ATOM 1607 NH1 ARG U 166 46.127 37.784 -10.171 1.00 67.51 N ATOM 1608 NH2 ARG U 166 44.911 38.140 -12.092 1.00 71.38 N ATOM 1609 HE ARG U 166 43.967 37.175 -9.131 1.00 0.00 H ATOM 1610 HH12 ARG U 166 46.994 38.048 -10.681 1.00 0.00 H ATOM 1611 HH11 ARG U 166 46.175 37.516 -9.167 1.00 0.00 H ATOM 1612 HH22 ARG U 166 45.785 38.402 -12.592 1.00 0.00 H ATOM 1613 HH21 ARG U 166 44.001 38.151 -12.595 1.00 0.00 H ATOM 1614 H ARG U 166 40.009 34.088 -7.469 1.00 0.00 H ATOM 1615 N GLU U 167 41.061 32.654 -10.473 1.00 25.69 N ATOM 1616 CA GLU U 167 41.447 31.722 -11.535 1.00 25.10 C ATOM 1617 C GLU U 167 40.161 31.040 -12.059 1.00 21.42 C ATOM 1618 O GLU U 167 39.957 30.834 -13.322 1.00 22.96 O ATOM 1619 CB GLU U 167 42.460 30.680 -10.992 1.00 22.35 C ATOM 1620 CG GLU U 167 42.943 29.848 -12.168 1.00 30.70 C ATOM 1621 CD GLU U 167 44.164 29.000 -11.933 1.00 34.25 C ATOM 1622 OE1 GLU U 167 44.373 28.598 -10.766 1.00 40.93 O ATOM 1623 OE2 GLU U 167 44.886 28.709 -12.953 1.00 36.54 O ATOM 1624 H GLU U 167 41.347 32.467 -9.491 1.00 0.00 H ATOM 1625 N CYS U 168 39.205 30.738 -11.140 1.00 19.50 N ATOM 1626 CA CYS U 168 38.099 29.925 -11.575 1.00 20.23 C ATOM 1627 C CYS U 168 37.083 30.743 -12.426 1.00 20.92 C ATOM 1628 O CYS U 168 36.284 30.180 -13.171 1.00 22.50 O ATOM 1629 CB CYS U 168 37.362 29.336 -10.340 1.00 18.94 C ATOM 1630 SG CYS U 168 36.605 27.734 -10.815 1.00 21.84 S ATOM 1631 H CYS U 168 39.270 31.081 -10.160 1.00 0.00 H ATOM 1632 N GLN U 169 37.076 32.058 -12.192 1.00 21.10 N ATOM 1633 CA GLN U 169 36.126 32.984 -12.853 1.00 24.61 C ATOM 1634 C GLN U 169 36.588 33.374 -14.234 1.00 25.30 C ATOM 1635 O GLN U 169 35.767 34.006 -14.942 1.00 25.66 O ATOM 1636 CB GLN U 169 35.872 34.240 -12.033 1.00 23.68 C ATOM 1637 CG GLN U 169 37.071 35.184 -12.076 1.00 27.72 C ATOM 1638 CD GLN U 169 36.844 36.458 -11.252 1.00 36.67 C ATOM 1639 OE1 GLN U 169 35.752 36.668 -10.692 1.00 40.62 O ATOM 1640 NE2 GLN U 169 37.868 37.306 -11.174 1.00 35.10 N ATOM 1641 HE22 GLN U 169 38.762 37.088 -11.659 1.00 0.00 H ATOM 1642 HE21 GLN U 169 37.774 38.186 -10.628 1.00 0.00 H ATOM 1643 H GLN U 169 37.766 32.448 -11.518 1.00 0.00 H ATOM 1644 N GLN U 170 37.801 32.994 -14.650 1.00 22.04 N ATOM 1645 CA GLN U 170 38.324 33.319 -15.982 1.00 23.62 C ATOM 1646 C GLN U 170 37.463 32.630 -17.017 1.00 23.30 C ATOM 1647 O GLN U 170 36.739 31.595 -16.783 1.00 19.15 O ATOM 1648 CB GLN U 170 39.699 32.720 -16.192 1.00 24.50 C ATOM 1649 CG GLN U 170 40.824 33.295 -15.405 1.00 24.76 C ATOM 1650 CD GLN U 170 42.064 32.548 -15.811 1.00 30.30 C ATOM 1651 OE1 GLN U 170 42.800 32.972 -16.697 1.00 30.44 O ATOM 1652 NE2 GLN U 170 42.233 31.345 -15.254 1.00 26.24 N ATOM 1653 HE22 GLN U 170 41.587 31.023 -14.505 1.00 0.00 H ATOM 1654 HE21 GLN U 170 43.011 30.731 -15.569 1.00 0.00 H ATOM 1655 H GLN U 170 38.400 32.444 -14.001 1.00 0.00 H ATOM 1656 N PRO U 170A 36.952 33.387 -18.143 1.00 20.82 N ATOM 1657 CA PRO U 170A 36.018 32.741 -19.118 1.00 24.31 C ATOM 1658 C PRO U 170A 36.506 31.354 -19.570 1.00 23.19 C ATOM 1659 O PRO U 170A 35.678 30.435 -19.660 1.00 21.71 O ATOM 1660 CB PRO U 170A 36.042 33.721 -20.296 1.00 27.23 C ATOM 1661 CG PRO U 170A 36.283 35.058 -19.632 1.00 24.64 C ATOM 1662 CD PRO U 170A 37.217 34.828 -18.473 1.00 21.70 C ATOM 1663 N HIS U 170B 37.919 30.961 -19.667 1.00 19.80 N ATOM 1664 CA HIS U 170B 38.304 29.633 -20.182 1.00 23.87 C ATOM 1665 C HIS U 170B 38.155 28.629 -19.056 1.00 25.05 C ATOM 1666 O HIS U 170B 38.244 27.413 -19.344 1.00 21.61 O ATOM 1667 CB HIS U 170B 39.677 29.524 -20.880 1.00 28.34 C ATOM 1668 CG HIS U 170B 40.882 29.717 -19.977 1.00 27.34 C ATOM 1669 ND1 HIS U 170B 41.171 30.917 -19.378 1.00 26.32 N ATOM 1670 CD2 HIS U 170B 41.910 28.813 -19.597 1.00 28.47 C ATOM 1671 CE1 HIS U 170B 42.304 30.804 -18.666 1.00 28.85 C ATOM 1672 NE2 HIS U 170B 42.755 29.496 -18.777 1.00 27.86 N ATOM 1673 H HIS U 170B 38.658 31.629 -19.368 1.00 0.00 H ATOM 1674 N TYR U 171 37.923 29.096 -17.826 1.00 19.39 N ATOM 1675 CA TYR U 171 37.472 28.166 -16.757 1.00 20.51 C ATOM 1676 C TYR U 171 35.954 28.205 -16.722 1.00 17.69 C ATOM 1677 O TYR U 171 35.339 27.745 -17.702 1.00 22.24 O ATOM 1678 CB TYR U 171 38.073 28.482 -15.390 1.00 19.76 C ATOM 1679 CG TYR U 171 39.493 27.944 -15.217 1.00 19.00 C ATOM 1680 CD1 TYR U 171 40.453 28.159 -16.198 1.00 20.16 C ATOM 1681 CD2 TYR U 171 39.846 27.202 -14.065 1.00 21.62 C ATOM 1682 CE1 TYR U 171 41.778 27.661 -16.050 1.00 24.72 C ATOM 1683 CE2 TYR U 171 41.154 26.729 -13.896 1.00 24.92 C ATOM 1684 CZ TYR U 171 42.110 26.941 -14.865 1.00 25.86 C ATOM 1685 OH TYR U 171 43.400 26.392 -14.606 1.00 26.62 O ATOM 1686 HH TYR U 171 43.763 26.784 -13.773 1.00 0.00 H ATOM 1687 H TYR U 171 38.057 30.106 -17.617 1.00 0.00 H ATOM 1688 N TYR U 172 35.330 28.830 -15.690 1.00 17.76 N ATOM 1689 CA TYR U 172 33.920 28.856 -15.568 1.00 20.32 C ATOM 1690 C TYR U 172 33.203 30.186 -15.737 1.00 22.20 C ATOM 1691 O TYR U 172 31.957 30.241 -15.598 1.00 23.51 O ATOM 1692 CB TYR U 172 33.440 28.268 -14.248 1.00 19.52 C ATOM 1693 CG TYR U 172 33.550 26.743 -14.171 1.00 18.07 C ATOM 1694 CD1 TYR U 172 33.065 25.962 -15.197 1.00 18.35 C ATOM 1695 CD2 TYR U 172 34.212 26.153 -13.085 1.00 16.09 C ATOM 1696 CE1 TYR U 172 33.138 24.564 -15.137 1.00 18.82 C ATOM 1697 CE2 TYR U 172 34.346 24.758 -13.033 1.00 16.75 C ATOM 1698 CZ TYR U 172 33.781 23.993 -14.083 1.00 17.67 C ATOM 1699 OH TYR U 172 33.895 22.591 -14.114 1.00 16.16 O ATOM 1700 HH TYR U 172 33.474 22.209 -13.303 1.00 0.00 H ATOM 1701 H TYR U 172 35.907 29.305 -14.966 1.00 0.00 H ATOM 1702 N GLY U 173 33.943 31.274 -15.930 1.00 24.23 N ATOM 1703 CA GLY U 173 33.222 32.595 -16.039 1.00 23.70 C ATOM 1704 C GLY U 173 32.396 32.937 -14.813 1.00 26.54 C ATOM 1705 O GLY U 173 32.801 32.671 -13.652 1.00 26.71 O ATOM 1706 H GLY U 173 34.979 31.217 -16.003 1.00 0.00 H ATOM 1707 N SER U 174 31.219 33.514 -15.056 1.00 30.36 N ATOM 1708 CA SER U 174 30.326 33.975 -13.981 1.00 26.93 C ATOM 1709 C SER U 174 29.556 32.868 -13.314 1.00 29.83 C ATOM 1710 O SER U 174 28.826 33.126 -12.362 1.00 33.07 O ATOM 1711 CB SER U 174 29.299 34.953 -14.570 1.00 30.07 C ATOM 1712 OG SER U 174 28.651 34.312 -15.683 1.00 34.13 O ATOM 1713 HG SER U 174 27.984 34.930 -16.076 1.00 0.00 H ATOM 1714 H SER U 174 30.920 33.643 -16.044 1.00 0.00 H ATOM 1715 N GLU U 175 29.724 31.627 -13.811 1.00 25.47 N ATOM 1716 CA GLU U 175 29.001 30.480 -13.231 1.00 26.89 C ATOM 1717 C GLU U 175 29.425 30.231 -11.790 1.00 24.62 C ATOM 1718 O GLU U 175 28.624 29.699 -10.966 1.00 27.64 O ATOM 1719 CB GLU U 175 29.234 29.198 -14.060 1.00 27.26 C ATOM 1720 CG GLU U 175 28.661 29.209 -15.482 1.00 35.46 C ATOM 1721 CD GLU U 175 27.144 28.892 -15.523 1.00 40.35 C ATOM 1722 OE1 GLU U 175 26.392 29.070 -14.515 1.00 45.03 O ATOM 1723 OE2 GLU U 175 26.696 28.435 -16.590 1.00 50.78 O ATOM 1724 H GLU U 175 30.370 31.476 -14.612 1.00 0.00 H ATOM 1725 N VAL U 176 30.683 30.564 -11.478 1.00 22.45 N ATOM 1726 CA VAL U 176 31.216 30.362 -10.092 1.00 22.74 C ATOM 1727 C VAL U 176 31.033 31.621 -9.319 1.00 25.93 C ATOM 1728 O VAL U 176 31.250 32.711 -9.915 1.00 27.35 O ATOM 1729 CB VAL U 176 32.707 29.960 -10.053 1.00 24.98 C ATOM 1730 CG1 VAL U 176 32.843 28.526 -10.559 1.00 21.83 C ATOM 1731 CG2 VAL U 176 33.536 30.847 -10.943 1.00 26.56 C ATOM 1732 H VAL U 176 31.301 30.970 -12.209 1.00 0.00 H ATOM 1733 N THR U 177 30.610 31.503 -8.034 1.00 21.24 N ATOM 1734 CA THR U 177 30.370 32.694 -7.187 1.00 21.82 C ATOM 1735 C THR U 177 31.262 32.570 -5.994 1.00 26.84 C ATOM 1736 O THR U 177 31.863 31.547 -5.805 1.00 23.35 O ATOM 1737 CB THR U 177 28.922 32.779 -6.675 1.00 23.01 C ATOM 1738 OG1 THR U 177 28.614 31.714 -5.724 1.00 21.21 O ATOM 1739 CG2 THR U 177 27.944 32.650 -7.829 1.00 21.56 C ATOM 1740 HG1 THR U 177 27.676 31.805 -5.421 1.00 0.00 H ATOM 1741 H THR U 177 30.451 30.555 -7.636 1.00 0.00 H ATOM 1742 N THR U 178 31.318 33.587 -5.144 1.00 25.33 N ATOM 1743 CA THR U 178 32.139 33.485 -3.986 1.00 27.30 C ATOM 1744 C THR U 178 31.563 32.569 -2.891 1.00 22.82 C ATOM 1745 O THR U 178 32.225 32.347 -1.879 1.00 20.75 O ATOM 1746 CB THR U 178 32.369 34.876 -3.403 1.00 31.65 C ATOM 1747 OG1 THR U 178 31.097 35.398 -3.091 1.00 30.85 O ATOM 1748 CG2 THR U 178 32.989 35.737 -4.430 1.00 30.92 C ATOM 1749 HG1 THR U 178 31.199 36.305 -2.708 1.00 0.00 H ATOM 1750 H THR U 178 30.767 34.451 -5.322 1.00 0.00 H ATOM 1751 N LYS U 179 30.344 32.023 -3.063 1.00 20.90 N ATOM 1752 CA LYS U 179 29.802 31.027 -2.120 1.00 19.97 C ATOM 1753 C LYS U 179 30.162 29.555 -2.597 1.00 16.20 C ATOM 1754 O LYS U 179 29.658 28.600 -1.965 1.00 17.12 O ATOM 1755 CB LYS U 179 28.304 31.182 -2.018 1.00 21.15 C ATOM 1756 CG LYS U 179 27.835 32.485 -1.392 1.00 24.95 C ATOM 1757 CD LYS U 179 26.305 32.528 -1.525 1.00 26.87 C ATOM 1758 CE LYS U 179 25.691 31.655 -0.485 1.00 32.23 C ATOM 1759 NZ LYS U 179 24.263 31.976 -0.103 1.00 30.22 N ATOM 1760 HZ1 LYS U 179 24.215 32.946 0.270 1.00 0.00 H ATOM 1761 HZ2 LYS U 179 23.654 31.895 -0.942 1.00 0.00 H ATOM 1762 HZ3 LYS U 179 23.941 31.307 0.625 1.00 0.00 H ATOM 1763 H LYS U 179 29.770 32.311 -3.881 1.00 0.00 H ATOM 1764 N MET U 180 31.039 29.475 -3.593 1.00 16.62 N ATOM 1765 CA MET U 180 31.528 28.195 -4.115 1.00 16.94 C ATOM 1766 C MET U 180 33.035 28.245 -4.047 1.00 17.58 C ATOM 1767 O MET U 180 33.695 29.303 -4.111 1.00 22.62 O ATOM 1768 CB MET U 180 31.106 28.048 -5.567 1.00 17.17 C ATOM 1769 CG MET U 180 29.603 28.213 -5.799 1.00 15.71 C ATOM 1770 SD MET U 180 29.220 28.215 -7.545 1.00 17.66 S ATOM 1771 CE MET U 180 27.572 28.870 -7.562 1.00 17.59 C ATOM 1772 H MET U 180 31.392 30.356 -4.019 1.00 0.00 H ATOM 1773 N LEU U 181 33.640 27.047 -3.986 1.00 15.70 N ATOM 1774 CA LEU U 181 35.119 26.880 -4.077 1.00 15.43 C ATOM 1775 C LEU U 181 35.409 25.956 -5.219 1.00 15.90 C ATOM 1776 O LEU U 181 34.720 24.943 -5.365 1.00 16.14 O ATOM 1777 CB LEU U 181 35.651 26.199 -2.791 1.00 16.79 C ATOM 1778 CG LEU U 181 35.537 26.969 -1.488 1.00 21.03 C ATOM 1779 CD1 LEU U 181 35.855 26.047 -0.321 1.00 23.51 C ATOM 1780 CD2 LEU U 181 36.569 28.087 -1.486 1.00 25.08 C ATOM 1781 H LEU U 181 33.050 26.198 -3.870 1.00 0.00 H ATOM 1782 N CYS U 182 36.420 26.253 -6.014 1.00 16.14 N ATOM 1783 CA CYS U 182 36.880 25.351 -7.109 1.00 15.75 C ATOM 1784 C CYS U 182 38.063 24.546 -6.567 1.00 15.85 C ATOM 1785 O CYS U 182 38.882 25.026 -5.800 1.00 15.35 O ATOM 1786 CB CYS U 182 37.327 26.184 -8.298 1.00 16.64 C ATOM 1787 SG CYS U 182 35.899 26.991 -9.057 1.00 20.00 S ATOM 1788 H CYS U 182 36.917 27.155 -5.871 1.00 0.00 H ATOM 1789 N ALA U 183 38.231 23.344 -7.071 1.00 14.25 N ATOM 1790 CA ALA U 183 39.437 22.552 -6.719 1.00 13.42 C ATOM 1791 C ALA U 183 39.645 21.555 -7.833 1.00 13.80 C ATOM 1792 O ALA U 183 38.666 21.006 -8.421 1.00 14.91 O ATOM 1793 CB ALA U 183 39.223 21.841 -5.362 1.00 15.37 C ATOM 1794 H ALA U 183 37.519 22.947 -7.717 1.00 0.00 H ATOM 1795 N ALA U 184 40.900 21.330 -8.191 1.00 13.77 N ATOM 1796 CA ALA U 184 41.262 20.408 -9.292 1.00 15.04 C ATOM 1797 C ALA U 184 42.627 19.878 -9.153 1.00 15.71 C ATOM 1798 O ALA U 184 43.386 20.355 -8.316 1.00 16.35 O ATOM 1799 CB ALA U 184 41.088 21.152 -10.572 1.00 16.64 C ATOM 1800 H ALA U 184 41.661 21.820 -7.679 1.00 0.00 H ATOM 1801 N ASP U 185 42.948 18.894 -9.988 1.00 14.43 N ATOM 1802 CA ASP U 185 44.298 18.391 -9.953 1.00 15.47 C ATOM 1803 C ASP U 185 45.135 19.250 -10.910 1.00 16.55 C ATOM 1804 O ASP U 185 44.703 19.619 -12.001 1.00 15.43 O ATOM 1805 CB ASP U 185 44.237 16.955 -10.567 1.00 15.62 C ATOM 1806 CG ASP U 185 45.621 16.280 -10.571 1.00 17.29 C ATOM 1807 OD1 ASP U 185 46.215 16.021 -9.528 1.00 21.79 O ATOM 1808 OD2 ASP U 185 46.088 16.088 -11.679 1.00 20.70 O ATOM 1809 H ASP U 185 42.246 18.499 -10.646 1.00 0.00 H ATOM 1810 N PRO U 185A 46.586 19.498 -10.772 1.00 21.01 N ATOM 1811 CA PRO U 185A 47.283 20.366 -11.732 1.00 18.16 C ATOM 1812 C PRO U 185A 47.335 19.746 -13.141 1.00 19.89 C ATOM 1813 O PRO U 185A 47.373 20.434 -14.182 1.00 22.69 O ATOM 1814 CB PRO U 185A 48.682 20.406 -11.126 1.00 18.63 C ATOM 1815 CG PRO U 185A 48.391 20.336 -9.617 1.00 22.14 C ATOM 1816 CD PRO U 185A 47.300 19.348 -9.485 1.00 20.74 C ATOM 1817 N GLN U 185B 47.454 18.307 -13.244 1.00 20.30 N ATOM 1818 CA GLN U 185B 47.365 17.572 -14.478 1.00 20.86 C ATOM 1819 C GLN U 185B 45.930 17.325 -14.958 1.00 17.72 C ATOM 1820 O GLN U 185B 45.763 16.607 -15.981 1.00 16.29 O ATOM 1821 CB GLN U 185B 48.172 16.267 -14.322 1.00 22.98 C ATOM 1822 CG GLN U 185B 49.677 16.499 -14.166 1.00 25.74 C ATOM 1823 CD GLN U 185B 50.436 16.399 -15.494 1.00 27.13 C ATOM 1824 OE1 GLN U 185B 49.874 16.220 -16.558 1.00 24.16 O ATOM 1825 NE2 GLN U 185B 51.739 16.450 -15.410 1.00 30.11 N ATOM 1826 HE22 GLN U 185B 52.195 16.604 -14.488 1.00 0.00 H ATOM 1827 HE21 GLN U 185B 52.320 16.336 -16.265 1.00 0.00 H ATOM 1828 H GLN U 185B 47.614 17.769 -12.369 1.00 0.00 H ATOM 1829 N TRP U 186 44.877 17.782 -14.222 1.00 18.37 N ATOM 1830 CA TRP U 186 43.468 17.355 -14.519 1.00 16.65 C ATOM 1831 C TRP U 186 43.233 15.887 -14.554 1.00 16.78 C ATOM 1832 O TRP U 186 42.358 15.399 -15.249 1.00 19.00 O ATOM 1833 CB TRP U 186 42.973 17.964 -15.871 1.00 19.68 C ATOM 1834 CG TRP U 186 43.335 19.410 -15.879 1.00 18.32 C ATOM 1835 CD1 TRP U 186 44.419 19.999 -16.536 1.00 17.99 C ATOM 1836 CD2 TRP U 186 42.645 20.551 -15.177 1.00 19.84 C ATOM 1837 NE1 TRP U 186 44.488 21.320 -16.230 1.00 21.91 N ATOM 1838 CE2 TRP U 186 43.411 21.739 -15.516 1.00 20.35 C ATOM 1839 CE3 TRP U 186 41.479 20.680 -14.426 1.00 21.03 C ATOM 1840 CZ2 TRP U 186 43.053 23.012 -15.040 1.00 22.51 C ATOM 1841 CZ3 TRP U 186 41.123 21.941 -13.957 1.00 19.91 C ATOM 1842 CH2 TRP U 186 41.889 23.085 -14.252 1.00 23.36 C ATOM 1843 HE1 TRP U 186 45.275 21.940 -16.510 1.00 0.00 H ATOM 1844 H TRP U 186 45.054 18.441 -13.437 1.00 0.00 H ATOM 1845 N LYS U 187 43.998 15.100 -13.808 1.00 15.69 N ATOM 1846 CA LYS U 187 43.877 13.634 -13.980 1.00 17.40 C ATOM 1847 C LYS U 187 43.023 12.962 -12.891 1.00 17.57 C ATOM 1848 O LYS U 187 42.760 11.797 -12.960 1.00 21.09 O ATOM 1849 CB LYS U 187 45.296 13.014 -14.051 1.00 19.20 C ATOM 1850 CG LYS U 187 45.995 13.017 -12.713 1.00 22.50 C ATOM 1851 CD LYS U 187 47.388 12.365 -12.761 1.00 31.18 C ATOM 1852 CE LYS U 187 48.008 12.458 -11.374 1.00 28.77 C ATOM 1853 NZ LYS U 187 48.777 11.265 -10.982 1.00 36.82 N ATOM 1854 HZ1 LYS U 187 48.151 10.434 -10.985 1.00 0.00 H ATOM 1855 HZ2 LYS U 187 49.554 11.117 -11.657 1.00 0.00 H ATOM 1856 HZ3 LYS U 187 49.167 11.404 -10.028 1.00 0.00 H ATOM 1857 H LYS U 187 44.666 15.503 -13.120 1.00 0.00 H ATOM 1858 N THR U 188 42.514 13.717 -11.920 1.00 15.28 N ATOM 1859 CA THR U 188 41.742 13.130 -10.828 1.00 14.91 C ATOM 1860 C THR U 188 40.723 14.166 -10.451 1.00 15.19 C ATOM 1861 O THR U 188 40.998 15.365 -10.530 1.00 14.96 O ATOM 1862 CB THR U 188 42.672 12.707 -9.662 1.00 16.14 C ATOM 1863 OG1 THR U 188 41.897 12.015 -8.698 1.00 15.91 O ATOM 1864 CG2 THR U 188 43.343 13.889 -8.966 1.00 14.89 C ATOM 1865 HG1 THR U 188 42.478 11.738 -7.946 1.00 0.00 H ATOM 1866 H THR U 188 42.669 14.745 -11.939 1.00 0.00 H ATOM 1867 N ASP U 189 39.532 13.730 -10.046 1.00 15.22 N ATOM 1868 CA ASP U 189 38.472 14.673 -9.800 1.00 15.59 C ATOM 1869 C ASP U 189 37.284 13.943 -9.182 1.00 14.13 C ATOM 1870 O ASP U 189 37.282 12.692 -9.142 1.00 13.97 O ATOM 1871 CB ASP U 189 38.025 15.280 -11.142 1.00 12.81 C ATOM 1872 CG ASP U 189 37.152 16.595 -10.983 1.00 15.78 C ATOM 1873 OD1 ASP U 189 36.934 17.059 -9.867 1.00 14.67 O ATOM 1874 OD2 ASP U 189 36.686 17.149 -12.040 1.00 17.03 O ATOM 1875 H ASP U 189 39.368 12.712 -9.908 1.00 0.00 H ATOM 1876 N SER U 190 36.319 14.724 -8.695 1.00 13.59 N ATOM 1877 CA SER U 190 35.020 14.091 -8.374 1.00 13.38 C ATOM 1878 C SER U 190 34.228 13.879 -9.684 1.00 13.61 C ATOM 1879 O SER U 190 34.558 14.462 -10.737 1.00 14.61 O ATOM 1880 CB SER U 190 34.224 14.873 -7.341 1.00 15.18 C ATOM 1881 OG SER U 190 34.281 16.295 -7.651 1.00 15.63 O ATOM 1882 HG SER U 190 35.224 16.597 -7.637 1.00 0.00 H ATOM 1883 H SER U 190 36.474 15.742 -8.546 1.00 0.00 H ATOM 1884 N CYS U 191 33.263 12.963 -9.645 1.00 12.04 N ATOM 1885 CA CYS U 191 32.432 12.724 -10.833 1.00 12.18 C ATOM 1886 C CYS U 191 31.028 12.382 -10.437 1.00 12.80 C ATOM 1887 O CYS U 191 30.643 12.514 -9.303 1.00 11.21 O ATOM 1888 CB CYS U 191 33.155 11.705 -11.750 1.00 12.79 C ATOM 1889 SG CYS U 191 32.551 11.620 -13.481 1.00 16.03 S ATOM 1890 H CYS U 191 33.097 12.417 -8.775 1.00 0.00 H ATOM 1891 N GLN U 192 30.174 12.053 -11.441 1.00 11.99 N ATOM 1892 CA GLN U 192 28.766 11.742 -11.191 1.00 13.91 C ATOM 1893 C GLN U 192 28.641 10.712 -10.067 1.00 12.82 C ATOM 1894 O GLN U 192 29.343 9.624 -10.121 1.00 11.96 O ATOM 1895 CB GLN U 192 28.138 11.161 -12.484 1.00 16.41 C ATOM 1896 CG GLN U 192 26.667 10.781 -12.239 1.00 20.36 C ATOM 1897 CD GLN U 192 25.847 10.375 -13.450 1.00 32.28 C ATOM 1898 OE1 GLN U 192 26.316 9.792 -14.391 1.00 39.74 O ATOM 1899 NE2 GLN U 192 24.555 10.699 -13.382 1.00 36.88 N ATOM 1900 HE22 GLN U 192 24.189 11.204 -12.550 1.00 0.00 H ATOM 1901 HE21 GLN U 192 23.914 10.447 -14.161 1.00 0.00 H ATOM 1902 H GLN U 192 30.532 12.021 -12.417 1.00 0.00 H ATOM 1903 N GLY U 193 27.795 10.984 -9.072 1.00 11.42 N ATOM 1904 CA GLY U 193 27.593 10.121 -7.924 1.00 12.46 C ATOM 1905 C GLY U 193 28.453 10.504 -6.712 1.00 12.22 C ATOM 1906 O GLY U 193 28.183 10.045 -5.614 1.00 13.37 O ATOM 1907 H GLY U 193 27.248 11.867 -9.123 1.00 0.00 H ATOM 1908 N ASP U 194 29.368 11.455 -6.907 1.00 10.14 N ATOM 1909 CA ASP U 194 30.120 11.966 -5.788 1.00 12.23 C ATOM 1910 C ASP U 194 29.472 13.172 -5.117 1.00 10.91 C ATOM 1911 O ASP U 194 29.950 13.657 -4.057 1.00 10.92 O ATOM 1912 CB ASP U 194 31.547 12.393 -6.250 1.00 10.15 C ATOM 1913 CG ASP U 194 32.485 11.168 -6.481 1.00 10.29 C ATOM 1914 OD1 ASP U 194 32.407 10.151 -5.700 1.00 11.64 O ATOM 1915 OD2 ASP U 194 33.200 11.268 -7.494 1.00 12.69 O ATOM 1916 H ASP U 194 29.538 11.827 -7.863 1.00 0.00 H ATOM 1917 N SER U 195 28.451 13.749 -5.767 1.00 11.66 N ATOM 1918 CA SER U 195 27.876 14.970 -5.202 1.00 11.57 C ATOM 1919 C SER U 195 27.370 14.720 -3.820 1.00 10.14 C ATOM 1920 O SER U 195 27.005 13.621 -3.393 1.00 11.60 O ATOM 1921 CB SER U 195 26.689 15.412 -6.042 1.00 13.73 C ATOM 1922 OG SER U 195 27.142 15.863 -7.313 1.00 13.67 O ATOM 1923 HG SER U 195 26.366 16.150 -7.856 1.00 0.00 H ATOM 1924 H SER U 195 28.078 13.340 -6.648 1.00 0.00 H ATOM 1925 N GLY U 196 27.418 15.797 -3.060 1.00 10.86 N ATOM 1926 CA GLY U 196 26.950 15.741 -1.646 1.00 10.88 C ATOM 1927 C GLY U 196 28.101 15.439 -0.675 1.00 10.87 C ATOM 1928 O GLY U 196 27.983 15.653 0.579 1.00 11.58 O ATOM 1929 H GLY U 196 27.784 16.689 -3.449 1.00 0.00 H ATOM 1930 N GLY U 197 29.140 14.798 -1.218 1.00 11.37 N ATOM 1931 CA GLY U 197 30.246 14.306 -0.296 1.00 12.68 C ATOM 1932 C GLY U 197 31.239 15.360 0.128 1.00 13.61 C ATOM 1933 O GLY U 197 31.181 16.503 -0.292 1.00 12.82 O ATOM 1934 H GLY U 197 29.191 14.639 -2.245 1.00 0.00 H ATOM 1935 N PRO U 198 32.153 14.988 1.034 1.00 11.87 N ATOM 1936 CA PRO U 198 33.022 15.926 1.662 1.00 11.46 C ATOM 1937 C PRO U 198 34.241 16.326 0.840 1.00 12.06 C ATOM 1938 O PRO U 198 34.890 15.479 0.233 1.00 12.42 O ATOM 1939 CB PRO U 198 33.493 15.154 2.885 1.00 11.86 C ATOM 1940 CG PRO U 198 33.439 13.688 2.487 1.00 11.39 C ATOM 1941 CD PRO U 198 32.214 13.652 1.641 1.00 11.26 C ATOM 1942 N LEU U 199 34.549 17.612 0.848 1.00 13.81 N ATOM 1943 CA LEU U 199 35.905 18.155 0.566 1.00 13.25 C ATOM 1944 C LEU U 199 36.471 18.542 1.907 1.00 13.74 C ATOM 1945 O LEU U 199 35.966 19.481 2.587 1.00 13.84 O ATOM 1946 CB LEU U 199 35.751 19.397 -0.346 1.00 13.61 C ATOM 1947 CG LEU U 199 37.044 20.202 -0.614 1.00 15.18 C ATOM 1948 CD1 LEU U 199 37.858 19.532 -1.642 1.00 16.90 C ATOM 1949 CD2 LEU U 199 36.797 21.646 -1.053 1.00 16.75 C ATOM 1950 H LEU U 199 33.791 18.290 1.066 1.00 0.00 H ATOM 1951 N VAL U 200 37.502 17.825 2.349 1.00 13.86 N ATOM 1952 CA VAL U 200 38.099 17.967 3.690 1.00 13.57 C ATOM 1953 C VAL U 200 39.510 18.535 3.566 1.00 16.06 C ATOM 1954 O VAL U 200 40.361 18.045 2.789 1.00 15.53 O ATOM 1955 CB VAL U 200 38.079 16.622 4.465 1.00 12.94 C ATOM 1956 CG1 VAL U 200 38.916 16.728 5.779 1.00 15.52 C ATOM 1957 CG2 VAL U 200 36.653 16.216 4.758 1.00 16.12 C ATOM 1958 H VAL U 200 37.913 17.118 1.706 1.00 0.00 H ATOM 1959 N CYS U 201 39.801 19.553 4.369 1.00 14.61 N ATOM 1960 CA CYS U 201 41.079 20.207 4.336 1.00 16.20 C ATOM 1961 C CYS U 201 41.536 20.343 5.759 1.00 19.39 C ATOM 1962 O CYS U 201 40.711 20.423 6.646 1.00 18.04 O ATOM 1963 CB CYS U 201 40.950 21.587 3.759 1.00 17.61 C ATOM 1964 SG CYS U 201 40.199 21.784 2.148 1.00 18.10 S ATOM 1965 H CYS U 201 39.081 19.886 5.042 1.00 0.00 H ATOM 1966 N SER U 202 42.852 20.348 5.974 1.00 19.69 N ATOM 1967 CA SER U 202 43.352 20.305 7.321 1.00 27.17 C ATOM 1968 C SER U 202 43.658 21.739 7.554 1.00 26.54 C ATOM 1969 O SER U 202 44.459 22.289 6.875 1.00 33.00 O ATOM 1970 CB SER U 202 44.573 19.374 7.463 1.00 26.00 C ATOM 1971 OG SER U 202 45.183 19.575 8.774 1.00 31.38 O ATOM 1972 HG SER U 202 45.967 18.978 8.867 1.00 0.00 H ATOM 1973 H SER U 202 43.513 20.383 5.172 1.00 0.00 H ATOM 1974 N LEU U 203 42.926 22.364 8.470 1.00 37.71 N ATOM 1975 CA LEU U 203 43.066 23.815 8.722 1.00 40.37 C ATOM 1976 C LEU U 203 43.650 23.897 10.129 1.00 43.72 C ATOM 1977 O LEU U 203 42.967 23.626 11.131 1.00 39.18 O ATOM 1978 CB LEU U 203 41.728 24.545 8.552 1.00 41.33 C ATOM 1979 CG LEU U 203 41.646 25.998 8.072 1.00 42.40 C ATOM 1980 CD1 LEU U 203 42.849 26.495 7.282 1.00 42.00 C ATOM 1981 CD2 LEU U 203 40.422 26.164 7.210 1.00 41.07 C ATOM 1982 H LEU U 203 42.236 21.818 9.025 1.00 0.00 H ATOM 1983 N GLN U 204 44.962 24.155 10.132 1.00 48.82 N ATOM 1984 CA GLN U 204 45.847 24.090 11.301 1.00 53.06 C ATOM 1985 C GLN U 204 45.586 22.872 12.160 1.00 52.73 C ATOM 1986 O GLN U 204 44.991 22.963 13.232 1.00 56.17 O ATOM 1987 CB GLN U 204 45.874 25.409 12.132 1.00 59.55 C ATOM 1988 CG GLN U 204 44.527 26.115 12.380 1.00 65.70 C ATOM 1989 CD GLN U 204 43.966 26.848 11.145 1.00 70.26 C ATOM 1990 OE1 GLN U 204 44.460 26.681 10.026 1.00 76.54 O ATOM 1991 NE2 GLN U 204 42.921 27.660 11.351 1.00 65.21 N ATOM 1992 HE22 GLN U 204 42.533 27.775 12.309 1.00 0.00 H ATOM 1993 HE21 GLN U 204 42.498 28.176 10.553 1.00 0.00 H ATOM 1994 H GLN U 204 45.394 24.426 9.225 1.00 0.00 H ATOM 1995 N GLY U 205 46.024 21.715 11.671 1.00 55.07 N ATOM 1996 CA GLY U 205 45.806 20.463 12.383 1.00 49.94 C ATOM 1997 C GLY U 205 44.383 19.914 12.483 1.00 49.90 C ATOM 1998 O GLY U 205 44.217 18.706 12.773 1.00 49.84 O ATOM 1999 H GLY U 205 46.532 21.704 10.763 1.00 0.00 H ATOM 2000 N ARG U 206 43.338 20.725 12.233 1.00 36.27 N ATOM 2001 CA ARG U 206 42.015 20.130 12.431 1.00 29.40 C ATOM 2002 C ARG U 206 41.457 19.761 11.049 1.00 23.20 C ATOM 2003 O ARG U 206 41.452 20.587 10.196 1.00 23.31 O ATOM 2004 CB ARG U 206 41.056 21.039 13.227 1.00 36.57 C ATOM 2005 CG ARG U 206 39.974 20.271 14.010 1.00 49.08 C ATOM 2006 CD ARG U 206 40.473 19.628 15.345 1.00 59.77 C ATOM 2007 NE ARG U 206 39.760 18.371 15.743 1.00 61.77 N ATOM 2008 CZ ARG U 206 40.316 17.282 16.306 1.00 51.20 C ATOM 2009 NH1 ARG U 206 41.613 17.213 16.553 1.00 51.16 N ATOM 2010 NH2 ARG U 206 39.575 16.243 16.620 1.00 43.45 N ATOM 2011 HE ARG U 206 38.736 18.337 15.567 1.00 0.00 H ATOM 2012 HH12 ARG U 206 42.015 16.358 16.989 1.00 0.00 H ATOM 2013 HH11 ARG U 206 42.232 18.013 16.311 1.00 0.00 H ATOM 2014 HH22 ARG U 206 40.012 15.405 17.055 1.00 0.00 H ATOM 2015 HH21 ARG U 206 38.552 16.259 16.434 1.00 0.00 H ATOM 2016 H ARG U 206 43.462 21.709 11.920 1.00 0.00 H ATOM 2017 N MET U 207 41.016 18.531 10.878 1.00 23.92 N ATOM 2018 CA MET U 207 40.335 18.144 9.584 1.00 21.66 C ATOM 2019 C MET U 207 38.992 18.896 9.584 1.00 19.73 C ATOM 2020 O MET U 207 38.271 18.845 10.609 1.00 19.95 O ATOM 2021 CB MET U 207 40.104 16.657 9.601 1.00 24.32 C ATOM 2022 CG MET U 207 41.414 15.849 9.735 1.00 27.83 C ATOM 2023 SD MET U 207 42.264 15.942 8.161 1.00 31.32 S ATOM 2024 CE MET U 207 41.595 14.439 7.449 1.00 29.39 C ATOM 2025 H MET U 207 41.136 17.826 11.633 1.00 0.00 H ATOM 2026 N THR U 208 38.708 19.572 8.479 1.00 17.27 N ATOM 2027 CA THR U 208 37.574 20.545 8.420 1.00 15.67 C ATOM 2028 C THR U 208 36.769 20.256 7.188 1.00 15.30 C ATOM 2029 O THR U 208 37.336 20.015 6.157 1.00 14.55 O ATOM 2030 CB THR U 208 38.152 21.986 8.363 1.00 18.19 C ATOM 2031 OG1 THR U 208 38.909 22.184 9.559 1.00 19.82 O ATOM 2032 CG2 THR U 208 37.114 22.988 8.403 1.00 17.41 C ATOM 2033 HG1 THR U 208 39.639 21.516 9.601 1.00 0.00 H ATOM 2034 H THR U 208 39.290 19.421 7.630 1.00 0.00 H ATOM 2035 N LEU U 209 35.459 20.259 7.322 1.00 15.73 N ATOM 2036 CA LEU U 209 34.576 20.209 6.099 1.00 13.97 C ATOM 2037 C LEU U 209 34.572 21.533 5.349 1.00 14.01 C ATOM 2038 O LEU U 209 33.653 22.388 5.565 1.00 16.39 O ATOM 2039 CB LEU U 209 33.156 19.781 6.495 1.00 14.29 C ATOM 2040 CG LEU U 209 32.183 19.491 5.309 1.00 13.98 C ATOM 2041 CD1 LEU U 209 32.721 18.220 4.582 1.00 15.24 C ATOM 2042 CD2 LEU U 209 30.769 19.245 5.865 1.00 14.14 C ATOM 2043 H LEU U 209 35.033 20.296 8.270 1.00 0.00 H ATOM 2044 N THR U 210 35.519 21.737 4.447 1.00 12.30 N ATOM 2045 CA THR U 210 35.665 22.971 3.754 1.00 11.99 C ATOM 2046 C THR U 210 34.599 23.069 2.658 1.00 13.80 C ATOM 2047 O THR U 210 34.115 24.179 2.330 1.00 15.21 O ATOM 2048 CB THR U 210 37.055 23.040 3.181 1.00 14.81 C ATOM 2049 OG1 THR U 210 37.929 23.248 4.306 1.00 15.71 O ATOM 2050 CG2 THR U 210 37.190 24.144 2.292 1.00 13.63 C ATOM 2051 HG1 THR U 210 37.684 24.092 4.761 1.00 0.00 H ATOM 2052 H THR U 210 36.183 20.965 4.236 1.00 0.00 H ATOM 2053 N GLY U 211 34.244 21.918 2.059 1.00 12.25 N ATOM 2054 CA GLY U 211 33.376 21.991 0.871 1.00 12.22 C ATOM 2055 C GLY U 211 32.464 20.711 0.781 1.00 10.49 C ATOM 2056 O GLY U 211 32.628 19.735 1.495 1.00 12.86 O ATOM 2057 H GLY U 211 34.573 21.002 2.425 1.00 0.00 H ATOM 2058 N ILE U 212 31.444 20.862 -0.073 1.00 12.22 N ATOM 2059 CA ILE U 212 30.451 19.781 -0.349 1.00 10.13 C ATOM 2060 C ILE U 212 30.445 19.692 -1.844 1.00 12.34 C ATOM 2061 O ILE U 212 30.304 20.692 -2.560 1.00 12.54 O ATOM 2062 CB ILE U 212 29.008 20.107 0.205 1.00 12.26 C ATOM 2063 CG1 ILE U 212 29.104 20.128 1.741 1.00 12.31 C ATOM 2064 CG2 ILE U 212 28.021 19.075 -0.347 1.00 13.17 C ATOM 2065 CD1 ILE U 212 27.759 20.750 2.208 1.00 13.61 C ATOM 2066 H ILE U 212 31.339 21.772 -0.566 1.00 0.00 H ATOM 2067 N VAL U 213 30.658 18.480 -2.366 1.00 11.81 N ATOM 2068 CA VAL U 213 30.765 18.315 -3.853 1.00 11.38 C ATOM 2069 C VAL U 213 29.439 18.774 -4.461 1.00 10.20 C ATOM 2070 O VAL U 213 28.360 18.273 -4.092 1.00 12.03 O ATOM 2071 CB VAL U 213 30.930 16.787 -4.194 1.00 12.60 C ATOM 2072 CG1 VAL U 213 31.013 16.529 -5.747 1.00 13.00 C ATOM 2073 CG2 VAL U 213 32.243 16.206 -3.548 1.00 13.26 C ATOM 2074 H VAL U 213 30.749 17.653 -1.742 1.00 0.00 H ATOM 2075 N SER U 214 29.538 19.629 -5.464 1.00 11.52 N ATOM 2076 CA SER U 214 28.310 20.222 -6.071 1.00 11.44 C ATOM 2077 C SER U 214 28.186 20.053 -7.575 1.00 12.82 C ATOM 2078 O SER U 214 27.237 19.441 -8.023 1.00 13.59 O ATOM 2079 CB SER U 214 28.205 21.730 -5.644 1.00 11.60 C ATOM 2080 OG SER U 214 27.003 22.350 -6.208 1.00 13.02 O ATOM 2081 HG SER U 214 26.201 21.869 -5.882 1.00 0.00 H ATOM 2082 H SER U 214 30.475 19.890 -5.832 1.00 0.00 H ATOM 2083 N TRP U 215 29.138 20.540 -8.339 1.00 13.71 N ATOM 2084 CA TRP U 215 29.042 20.482 -9.777 1.00 13.78 C ATOM 2085 C TRP U 215 30.353 20.591 -10.497 1.00 15.96 C ATOM 2086 O TRP U 215 31.351 20.931 -9.946 1.00 14.10 O ATOM 2087 CB TRP U 215 27.987 21.512 -10.376 1.00 14.11 C ATOM 2088 CG TRP U 215 28.318 22.992 -10.139 1.00 14.75 C ATOM 2089 CD1 TRP U 215 28.134 23.729 -8.961 1.00 13.97 C ATOM 2090 CD2 TRP U 215 29.043 23.883 -11.036 1.00 13.94 C ATOM 2091 NE1 TRP U 215 28.620 24.999 -9.109 1.00 14.35 N ATOM 2092 CE2 TRP U 215 29.165 25.136 -10.377 1.00 15.58 C ATOM 2093 CE3 TRP U 215 29.535 23.740 -12.357 1.00 15.92 C ATOM 2094 CZ2 TRP U 215 29.802 26.246 -10.977 1.00 15.48 C ATOM 2095 CZ3 TRP U 215 30.145 24.809 -12.945 1.00 15.53 C ATOM 2096 CH2 TRP U 215 30.299 26.054 -12.272 1.00 16.74 C ATOM 2097 HE1 TRP U 215 28.586 25.745 -8.385 1.00 0.00 H ATOM 2098 H TRP U 215 29.974 20.974 -7.899 1.00 0.00 H ATOM 2099 N GLY U 216 30.284 20.283 -11.773 1.00 12.69 N ATOM 2100 CA GLY U 216 31.442 20.600 -12.672 1.00 13.67 C ATOM 2101 C GLY U 216 31.118 20.270 -14.099 1.00 15.01 C ATOM 2102 O GLY U 216 30.151 19.539 -14.344 1.00 16.11 O ATOM 2103 H GLY U 216 29.433 19.823 -12.156 1.00 0.00 H ATOM 2104 N ARG U 217 31.849 20.831 -15.057 1.00 15.67 N ATOM 2105 CA ARG U 217 31.632 20.405 -16.423 1.00 15.91 C ATOM 2106 C ARG U 217 32.473 19.131 -16.674 1.00 15.13 C ATOM 2107 O ARG U 217 33.693 19.208 -16.602 1.00 18.02 O ATOM 2108 CB ARG U 217 31.971 21.522 -17.449 1.00 20.15 C ATOM 2109 CG ARG U 217 31.576 21.134 -18.846 1.00 23.48 C ATOM 2110 CD ARG U 217 31.921 22.225 -19.821 1.00 28.57 C ATOM 2111 NE ARG U 217 31.070 22.032 -21.006 1.00 35.13 N ATOM 2112 CZ ARG U 217 30.017 22.791 -21.310 1.00 42.28 C ATOM 2113 NH1 ARG U 217 29.674 23.822 -20.513 1.00 38.79 N ATOM 2114 NH2 ARG U 217 29.319 22.524 -22.411 1.00 42.37 N ATOM 2115 HE ARG U 217 31.306 21.250 -21.650 1.00 0.00 H ATOM 2116 HH12 ARG U 217 28.852 24.413 -20.752 1.00 0.00 H ATOM 2117 HH11 ARG U 217 30.231 24.027 -19.659 1.00 0.00 H ATOM 2118 HH22 ARG U 217 28.495 23.109 -22.659 1.00 0.00 H ATOM 2119 HH21 ARG U 217 29.597 21.731 -23.023 1.00 0.00 H ATOM 2120 H ARG U 217 32.558 21.557 -14.831 1.00 0.00 H ATOM 2121 N GLY U 219 31.878 18.094 -17.013 1.00 15.80 N ATOM 2122 CA GLY U 219 32.595 16.827 -17.261 1.00 14.70 C ATOM 2123 C GLY U 219 33.156 16.360 -15.959 1.00 15.49 C ATOM 2124 O GLY U 219 32.708 16.811 -14.892 1.00 17.53 O ATOM 2125 H GLY U 219 30.844 18.119 -17.125 1.00 0.00 H ATOM 2126 N CYS U 220 34.174 15.494 -16.023 1.00 14.96 N ATOM 2127 CA CYS U 220 34.956 15.024 -14.831 1.00 14.82 C ATOM 2128 C CYS U 220 36.411 15.031 -15.292 1.00 14.12 C ATOM 2129 O CYS U 220 36.740 14.441 -16.365 1.00 16.43 O ATOM 2130 CB CYS U 220 34.557 13.610 -14.431 1.00 15.11 C ATOM 2131 SG CYS U 220 32.760 13.541 -14.135 1.00 15.75 S ATOM 2132 H CYS U 220 34.440 15.123 -16.957 1.00 0.00 H ATOM 2133 N ALA U 221 37.310 15.548 -14.459 1.00 16.22 N ATOM 2134 CA ALA U 221 38.718 15.603 -14.777 1.00 17.41 C ATOM 2135 C ALA U 221 39.018 16.103 -16.217 1.00 17.92 C ATOM 2136 O ALA U 221 39.769 15.486 -16.998 1.00 19.91 O ATOM 2137 CB ALA U 221 39.279 14.174 -14.542 1.00 16.04 C ATOM 2138 H ALA U 221 36.987 15.926 -13.546 1.00 0.00 H ATOM 2139 N LEU U 222 38.409 17.239 -16.557 1.00 20.84 N ATOM 2140 CA LEU U 222 38.497 17.841 -17.869 1.00 22.53 C ATOM 2141 C LEU U 222 39.329 19.100 -17.619 1.00 19.01 C ATOM 2142 O LEU U 222 39.058 19.826 -16.695 1.00 20.62 O ATOM 2143 CB LEU U 222 37.098 18.210 -18.283 1.00 27.82 C ATOM 2144 CG LEU U 222 36.601 18.193 -19.700 1.00 35.47 C ATOM 2145 CD1 LEU U 222 36.399 16.726 -20.059 1.00 40.74 C ATOM 2146 CD2 LEU U 222 35.266 18.916 -19.734 1.00 29.74 C ATOM 2147 H LEU U 222 37.836 17.721 -15.835 1.00 0.00 H ATOM 2148 N LYS U 223 40.363 19.314 -18.429 1.00 20.52 N ATOM 2149 CA LYS U 223 41.222 20.494 -18.429 1.00 19.42 C ATOM 2150 C LYS U 223 40.351 21.804 -18.427 1.00 18.25 C ATOM 2151 O LYS U 223 39.376 21.935 -19.223 1.00 20.96 O ATOM 2152 CB LYS U 223 42.133 20.460 -19.698 1.00 22.15 C ATOM 2153 CG LYS U 223 43.151 21.577 -19.774 1.00 27.24 C ATOM 2154 CD LYS U 223 44.081 21.389 -20.990 1.00 31.59 C ATOM 2155 CE LYS U 223 45.296 22.293 -20.894 1.00 35.83 C ATOM 2156 NZ LYS U 223 44.783 23.666 -20.611 1.00 42.82 N ATOM 2157 HZ1 LYS U 223 44.156 23.967 -21.384 1.00 0.00 H ATOM 2158 HZ2 LYS U 223 44.253 23.659 -19.716 1.00 0.00 H ATOM 2159 HZ3 LYS U 223 45.584 24.325 -20.536 1.00 0.00 H ATOM 2160 H LYS U 223 40.579 18.573 -19.126 1.00 0.00 H ATOM 2161 N ASP U 223A 40.899 22.694 -17.463 1.00 19.14 N ATOM 2162 CA ASP U 223A 40.228 23.991 -17.271 1.00 19.79 C ATOM 2163 C ASP U 223A 38.823 23.934 -16.773 1.00 19.09 C ATOM 2164 O ASP U 223A 38.114 24.915 -16.828 1.00 22.86 O ATOM 2165 CB ASP U 223A 40.311 24.867 -18.557 1.00 21.67 C ATOM 2166 CG ASP U 223A 41.759 25.204 -18.936 1.00 20.35 C ATOM 2167 OD1 ASP U 223A 42.713 24.946 -18.150 1.00 24.70 O ATOM 2168 OD2 ASP U 223A 41.912 25.669 -20.086 1.00 28.52 O ATOM 2169 H ASP U 223A 41.744 22.438 -16.913 1.00 0.00 H ATOM 2170 N LYS U 224 38.399 22.794 -16.179 1.00 17.15 N ATOM 2171 CA LYS U 224 37.068 22.730 -15.694 1.00 17.65 C ATOM 2172 C LYS U 224 37.130 22.069 -14.323 1.00 16.90 C ATOM 2173 O LYS U 224 36.962 20.828 -14.176 1.00 16.92 O ATOM 2174 CB LYS U 224 36.112 21.929 -16.634 1.00 19.40 C ATOM 2175 CG LYS U 224 36.021 22.386 -18.101 1.00 19.24 C ATOM 2176 CD LYS U 224 35.445 23.796 -18.135 1.00 23.20 C ATOM 2177 CE LYS U 224 35.658 24.357 -19.541 1.00 27.15 C ATOM 2178 NZ LYS U 224 35.966 25.792 -19.529 1.00 29.36 N ATOM 2179 HZ1 LYS U 224 35.178 26.311 -19.091 1.00 0.00 H ATOM 2180 HZ2 LYS U 224 36.836 25.954 -18.982 1.00 0.00 H ATOM 2181 HZ3 LYS U 224 36.102 26.124 -20.505 1.00 0.00 H ATOM 2182 H LYS U 224 39.038 21.979 -16.080 1.00 0.00 H ATOM 2183 N PRO U 225 37.389 22.868 -13.294 1.00 16.65 N ATOM 2184 CA PRO U 225 37.489 22.282 -11.972 1.00 15.88 C ATOM 2185 C PRO U 225 36.228 21.676 -11.381 1.00 15.21 C ATOM 2186 O PRO U 225 35.122 21.877 -11.875 1.00 16.33 O ATOM 2187 CB PRO U 225 37.895 23.474 -11.068 1.00 18.32 C ATOM 2188 CG PRO U 225 38.560 24.420 -11.961 1.00 19.53 C ATOM 2189 CD PRO U 225 37.791 24.293 -13.286 1.00 17.47 C ATOM 2190 N GLY U 226 36.382 20.898 -10.301 1.00 14.60 N ATOM 2191 CA GLY U 226 35.186 20.598 -9.519 1.00 14.97 C ATOM 2192 C GLY U 226 34.810 21.838 -8.699 1.00 15.17 C ATOM 2193 O GLY U 226 35.656 22.674 -8.299 1.00 14.46 O ATOM 2194 H GLY U 226 37.314 20.524 -10.031 1.00 0.00 H ATOM 2195 N VAL U 227 33.509 21.999 -8.525 1.00 13.20 N ATOM 2196 CA VAL U 227 32.975 23.103 -7.782 1.00 13.00 C ATOM 2197 C VAL U 227 32.195 22.611 -6.573 1.00 12.76 C ATOM 2198 O VAL U 227 31.529 21.580 -6.629 1.00 13.40 O ATOM 2199 CB VAL U 227 32.087 24.021 -8.708 1.00 13.59 C ATOM 2200 CG1 VAL U 227 31.736 25.339 -7.959 1.00 14.94 C ATOM 2201 CG2 VAL U 227 32.850 24.364 -9.947 1.00 12.73 C ATOM 2202 H VAL U 227 32.854 21.305 -8.939 1.00 0.00 H ATOM 2203 N TYR U 228 32.461 23.252 -5.437 1.00 14.07 N ATOM 2204 CA TYR U 228 32.029 22.832 -4.108 1.00 12.60 C ATOM 2205 C TYR U 228 31.322 23.932 -3.394 1.00 12.72 C ATOM 2206 O TYR U 228 31.693 25.081 -3.508 1.00 15.32 O ATOM 2207 CB TYR U 228 33.282 22.411 -3.261 1.00 12.11 C ATOM 2208 CG TYR U 228 34.081 21.322 -3.911 1.00 11.81 C ATOM 2209 CD1 TYR U 228 34.934 21.564 -5.011 1.00 11.68 C ATOM 2210 CD2 TYR U 228 33.854 19.984 -3.524 1.00 11.56 C ATOM 2211 CE1 TYR U 228 35.567 20.532 -5.680 1.00 12.21 C ATOM 2212 CE2 TYR U 228 34.513 18.905 -4.180 1.00 13.05 C ATOM 2213 CZ TYR U 228 35.318 19.167 -5.247 1.00 13.03 C ATOM 2214 OH TYR U 228 35.895 18.055 -5.899 1.00 13.38 O ATOM 2215 HH TYR U 228 36.455 18.370 -6.652 1.00 0.00 H ATOM 2216 H TYR U 228 33.023 24.124 -5.502 1.00 0.00 H ATOM 2217 N THR U 229 30.337 23.588 -2.606 1.00 12.59 N ATOM 2218 CA THR U 229 29.659 24.572 -1.803 1.00 12.27 C ATOM 2219 C THR U 229 30.689 25.003 -0.762 1.00 13.90 C ATOM 2220 O THR U 229 31.279 24.146 -0.073 1.00 13.70 O ATOM 2221 CB THR U 229 28.450 23.918 -1.184 1.00 12.99 C ATOM 2222 OG1 THR U 229 27.559 23.522 -2.225 1.00 12.76 O ATOM 2223 CG2 THR U 229 27.730 24.878 -0.190 1.00 15.26 C ATOM 2224 HG1 THR U 229 27.282 24.320 -2.742 1.00 0.00 H ATOM 2225 H THR U 229 30.040 22.592 -2.559 1.00 0.00 H ATOM 2226 N ARG U 230 30.730 26.299 -0.479 1.00 14.17 N ATOM 2227 CA ARG U 230 31.782 26.815 0.439 1.00 13.59 C ATOM 2228 C ARG U 230 31.099 26.866 1.751 1.00 15.05 C ATOM 2229 O ARG U 230 30.383 27.873 2.104 1.00 13.72 O ATOM 2230 CB ARG U 230 32.151 28.244 -0.044 1.00 14.44 C ATOM 2231 CG ARG U 230 33.295 28.911 0.740 1.00 15.84 C ATOM 2232 CD ARG U 230 33.543 30.221 0.021 1.00 19.12 C ATOM 2233 NE ARG U 230 34.897 30.692 0.263 1.00 25.48 N ATOM 2234 CZ ARG U 230 35.524 31.682 -0.352 1.00 22.07 C ATOM 2235 NH1 ARG U 230 34.960 32.474 -1.254 1.00 23.36 N ATOM 2236 NH2 ARG U 230 36.784 31.919 0.052 1.00 24.05 N ATOM 2237 HE ARG U 230 35.433 30.195 1.003 1.00 0.00 H ATOM 2238 HH12 ARG U 230 35.514 33.234 -1.698 1.00 0.00 H ATOM 2239 HH11 ARG U 230 33.964 32.335 -1.517 1.00 0.00 H ATOM 2240 HH22 ARG U 230 37.336 32.682 -0.388 1.00 0.00 H ATOM 2241 HH21 ARG U 230 37.207 31.339 0.805 1.00 0.00 H ATOM 2242 H ARG U 230 30.033 26.949 -0.895 1.00 0.00 H ATOM 2243 N VAL U 231 31.370 25.863 2.580 1.00 13.10 N ATOM 2244 CA VAL U 231 30.651 25.580 3.871 1.00 13.06 C ATOM 2245 C VAL U 231 30.832 26.793 4.843 1.00 14.26 C ATOM 2246 O VAL U 231 29.911 27.098 5.577 1.00 14.67 O ATOM 2247 CB VAL U 231 31.131 24.239 4.515 1.00 15.00 C ATOM 2248 CG1 VAL U 231 30.431 24.054 5.876 1.00 15.93 C ATOM 2249 CG2 VAL U 231 30.682 23.056 3.597 1.00 13.56 C ATOM 2250 H VAL U 231 32.143 25.220 2.314 1.00 0.00 H ATOM 2251 N SER U 232 32.020 27.401 4.830 1.00 13.58 N ATOM 2252 CA SER U 232 32.246 28.509 5.751 1.00 16.06 C ATOM 2253 C SER U 232 31.366 29.734 5.470 1.00 17.18 C ATOM 2254 O SER U 232 31.446 30.705 6.264 1.00 16.70 O ATOM 2255 CB SER U 232 33.710 28.951 5.741 1.00 17.33 C ATOM 2256 OG SER U 232 34.096 29.599 4.565 1.00 16.52 O ATOM 2257 HG SER U 232 35.050 29.855 4.629 1.00 0.00 H ATOM 2258 H SER U 232 32.768 27.091 4.177 1.00 0.00 H ATOM 2259 N HIS U 233 30.628 29.795 4.343 1.00 14.56 N ATOM 2260 CA HIS U 233 29.678 30.868 4.093 1.00 17.36 C ATOM 2261 C HIS U 233 28.277 30.459 4.443 1.00 17.52 C ATOM 2262 O HIS U 233 27.361 31.264 4.169 1.00 19.23 O ATOM 2263 CB HIS U 233 29.767 31.364 2.637 1.00 18.73 C ATOM 2264 CG HIS U 233 31.024 32.151 2.324 1.00 21.31 C ATOM 2265 ND1 HIS U 233 32.289 31.839 2.827 1.00 24.05 N ATOM 2266 CD2 HIS U 233 31.195 33.304 1.520 1.00 20.26 C ATOM 2267 CE1 HIS U 233 33.216 32.753 2.336 1.00 21.74 C ATOM 2268 NE2 HIS U 233 32.551 33.615 1.532 1.00 24.25 N ATOM 2269 H HIS U 233 30.742 29.049 3.628 1.00 0.00 H ATOM 2270 N PHE U 234 28.084 29.309 5.062 1.00 15.65 N ATOM 2271 CA PHE U 234 26.663 28.897 5.384 1.00 14.78 C ATOM 2272 C PHE U 234 26.443 28.546 6.830 1.00 14.20 C ATOM 2273 O PHE U 234 25.520 27.836 7.172 1.00 15.73 O ATOM 2274 CB PHE U 234 26.197 27.608 4.527 1.00 14.75 C ATOM 2275 CG PHE U 234 26.026 27.900 3.093 1.00 15.62 C ATOM 2276 CD1 PHE U 234 27.122 27.922 2.205 1.00 13.95 C ATOM 2277 CD2 PHE U 234 24.762 28.259 2.632 1.00 14.95 C ATOM 2278 CE1 PHE U 234 26.918 28.267 0.859 1.00 14.83 C ATOM 2279 CE2 PHE U 234 24.559 28.525 1.240 1.00 13.94 C ATOM 2280 CZ PHE U 234 25.656 28.560 0.387 1.00 16.58 C ATOM 2281 H PHE U 234 28.887 28.702 5.322 1.00 0.00 H ATOM 2282 N LEU U 235 27.328 29.007 7.726 1.00 16.05 N ATOM 2283 CA LEU U 235 27.217 28.574 9.111 1.00 15.78 C ATOM 2284 C LEU U 235 25.902 28.980 9.836 1.00 17.27 C ATOM 2285 O LEU U 235 25.375 28.226 10.658 1.00 18.98 O ATOM 2286 CB LEU U 235 28.482 29.028 9.876 1.00 17.69 C ATOM 2287 CG LEU U 235 29.773 28.425 9.265 1.00 15.94 C ATOM 2288 CD1 LEU U 235 30.847 28.992 10.170 1.00 17.93 C ATOM 2289 CD2 LEU U 235 29.661 26.894 9.274 1.00 17.53 C ATOM 2290 H LEU U 235 28.081 29.663 7.436 1.00 0.00 H ATOM 2291 N PRO U 236 25.436 30.201 9.545 1.00 18.78 N ATOM 2292 CA PRO U 236 24.155 30.602 10.179 1.00 22.00 C ATOM 2293 C PRO U 236 23.013 29.724 9.745 1.00 20.25 C ATOM 2294 O PRO U 236 22.263 29.228 10.599 1.00 22.23 O ATOM 2295 CB PRO U 236 23.997 32.014 9.641 1.00 19.34 C ATOM 2296 CG PRO U 236 25.426 32.534 9.553 1.00 21.84 C ATOM 2297 CD PRO U 236 26.019 31.309 8.785 1.00 20.55 C ATOM 2298 N TRP U 237 22.985 29.442 8.440 1.00 18.58 N ATOM 2299 CA TRP U 237 21.954 28.510 7.889 1.00 15.57 C ATOM 2300 C TRP U 237 22.074 27.176 8.581 1.00 16.11 C ATOM 2301 O TRP U 237 21.123 26.523 8.991 1.00 18.57 O ATOM 2302 CB TRP U 237 22.094 28.453 6.368 1.00 15.05 C ATOM 2303 CG TRP U 237 21.018 27.563 5.716 1.00 13.77 C ATOM 2304 CD1 TRP U 237 19.767 27.971 5.236 1.00 16.65 C ATOM 2305 CD2 TRP U 237 21.072 26.103 5.456 1.00 15.32 C ATOM 2306 NE1 TRP U 237 19.061 26.897 4.778 1.00 15.95 N ATOM 2307 CE2 TRP U 237 19.818 25.746 4.860 1.00 14.81 C ATOM 2308 CE3 TRP U 237 22.055 25.093 5.645 1.00 15.74 C ATOM 2309 CZ2 TRP U 237 19.515 24.413 4.499 1.00 16.51 C ATOM 2310 CZ3 TRP U 237 21.748 23.759 5.257 1.00 17.61 C ATOM 2311 CH2 TRP U 237 20.542 23.436 4.706 1.00 18.82 C ATOM 2312 HE1 TRP U 237 18.087 26.940 4.417 1.00 0.00 H ATOM 2313 H TRP U 237 23.685 29.873 7.803 1.00 0.00 H ATOM 2314 N ILE U 238 23.319 26.667 8.668 1.00 16.04 N ATOM 2315 CA ILE U 238 23.498 25.355 9.281 1.00 17.17 C ATOM 2316 C ILE U 238 23.105 25.354 10.756 1.00 19.13 C ATOM 2317 O ILE U 238 22.371 24.470 11.224 1.00 21.11 O ATOM 2318 CB ILE U 238 24.960 24.885 9.162 1.00 17.71 C ATOM 2319 CG1 ILE U 238 25.307 24.636 7.674 1.00 17.48 C ATOM 2320 CG2 ILE U 238 25.143 23.615 9.938 1.00 16.90 C ATOM 2321 CD1 ILE U 238 26.821 24.440 7.466 1.00 18.08 C ATOM 2322 H ILE U 238 24.136 27.199 8.305 1.00 0.00 H ATOM 2323 N ARG U 239 23.491 26.406 11.454 1.00 20.40 N ATOM 2324 CA ARG U 239 23.175 26.480 12.913 1.00 24.62 C ATOM 2325 C ARG U 239 21.716 26.604 13.142 1.00 24.29 C ATOM 2326 O ARG U 239 21.202 26.011 14.034 1.00 23.89 O ATOM 2327 CB ARG U 239 23.860 27.671 13.547 1.00 27.10 C ATOM 2328 CG ARG U 239 24.976 27.281 14.532 1.00 40.14 C ATOM 2329 CD ARG U 239 25.491 28.476 15.366 1.00 39.82 C ATOM 2330 NE ARG U 239 25.558 29.701 14.561 1.00 34.73 N ATOM 2331 CZ ARG U 239 26.579 30.107 13.821 1.00 32.87 C ATOM 2332 NH1 ARG U 239 27.791 29.471 13.821 1.00 25.90 N ATOM 2333 NH2 ARG U 239 26.407 31.218 13.101 1.00 28.45 N ATOM 2334 HE ARG U 239 24.718 30.313 14.573 1.00 0.00 H ATOM 2335 HH12 ARG U 239 28.564 29.826 13.223 1.00 0.00 H ATOM 2336 HH11 ARG U 239 27.938 28.633 14.419 1.00 0.00 H ATOM 2337 HH22 ARG U 239 27.180 31.576 12.504 1.00 0.00 H ATOM 2338 HH21 ARG U 239 25.500 31.726 13.137 1.00 0.00 H ATOM 2339 H ARG U 239 24.012 27.178 10.992 1.00 0.00 H ATOM 2340 N SER U 240 21.044 27.407 12.349 1.00 25.86 N ATOM 2341 CA SER U 240 19.600 27.483 12.542 1.00 23.68 C ATOM 2342 C SER U 240 18.843 26.162 12.251 1.00 28.50 C ATOM 2343 O SER U 240 18.033 25.673 13.057 1.00 30.94 O ATOM 2344 CB SER U 240 19.038 28.701 11.815 1.00 27.86 C ATOM 2345 OG SER U 240 18.849 28.562 10.383 1.00 25.43 O ATOM 2346 HG SER U 240 18.217 27.821 10.205 1.00 0.00 H ATOM 2347 H SER U 240 21.522 27.966 11.614 1.00 0.00 H ATOM 2348 N HIS U 241 19.164 25.487 11.180 1.00 21.24 N ATOM 2349 CA HIS U 241 18.336 24.394 10.734 1.00 21.98 C ATOM 2350 C HIS U 241 18.598 23.140 11.516 1.00 27.30 C ATOM 2351 O HIS U 241 17.811 22.214 11.469 1.00 26.71 O ATOM 2352 CB HIS U 241 18.492 24.187 9.262 1.00 21.52 C ATOM 2353 CG HIS U 241 17.853 25.287 8.447 1.00 20.99 C ATOM 2354 ND1 HIS U 241 18.506 26.476 8.134 1.00 21.61 N ATOM 2355 CD2 HIS U 241 16.568 25.421 7.951 1.00 21.80 C ATOM 2356 CE1 HIS U 241 17.661 27.289 7.439 1.00 21.87 C ATOM 2357 NE2 HIS U 241 16.509 26.639 7.286 1.00 21.69 N ATOM 2358 H HIS U 241 20.020 25.739 10.647 1.00 0.00 H ATOM 2359 N THR U 242 19.722 23.106 12.207 1.00 28.74 N ATOM 2360 CA THR U 242 20.089 21.914 12.919 1.00 29.24 C ATOM 2361 C THR U 242 19.650 22.069 14.337 1.00 35.84 C ATOM 2362 O THR U 242 19.418 21.047 15.008 1.00 37.39 O ATOM 2363 CB THR U 242 21.621 21.665 12.955 1.00 25.61 C ATOM 2364 OG1 THR U 242 22.317 22.794 13.504 1.00 21.12 O ATOM 2365 CG2 THR U 242 22.116 21.394 11.590 1.00 24.57 C ATOM 2366 HG1 THR U 242 22.139 23.593 12.947 1.00 0.00 H ATOM 2367 H THR U 242 20.341 23.941 12.236 1.00 0.00 H ATOM 2368 N LYS U 243 19.588 23.321 14.831 1.00 48.11 N ATOM 2369 CA LYS U 243 19.324 23.569 16.269 1.00 52.66 C ATOM 2370 C LYS U 243 17.892 23.132 16.416 1.00 57.47 C ATOM 2371 O LYS U 243 17.504 22.524 17.429 1.00 59.72 O ATOM 2372 CB LYS U 243 19.566 25.025 16.722 1.00 49.12 C ATOM 2373 CG LYS U 243 18.347 25.913 16.855 1.00 49.80 C ATOM 2374 CD LYS U 243 18.737 27.248 17.447 1.00 58.50 C ATOM 2375 CE LYS U 243 17.523 28.168 17.580 1.00 66.11 C ATOM 2376 NZ LYS U 243 17.572 28.934 18.865 1.00 67.63 N ATOM 2377 HZ1 LYS U 243 17.577 28.268 19.664 1.00 0.00 H ATOM 2378 HZ2 LYS U 243 18.436 29.513 18.889 1.00 0.00 H ATOM 2379 HZ3 LYS U 243 16.737 29.551 18.931 1.00 0.00 H ATOM 2380 H LYS U 243 19.728 24.129 14.191 1.00 0.00 H ATOM 2381 N GLU U 244 17.165 23.444 15.339 1.00 55.24 N ATOM 2382 CA GLU U 244 15.856 22.945 14.994 1.00 50.29 C ATOM 2383 C GLU U 244 15.161 22.360 16.187 1.00 46.50 C ATOM 2384 O GLU U 244 15.416 21.215 16.532 1.00 63.11 O ATOM 2385 CB GLU U 244 16.001 21.951 13.839 1.00 42.12 C ATOM 2386 CG GLU U 244 14.733 21.364 13.245 1.00 42.22 C ATOM 2387 CD GLU U 244 14.589 19.854 13.561 1.00 44.59 C ATOM 2388 OE1 GLU U 244 15.183 19.324 14.565 1.00 42.59 O ATOM 2389 OE2 GLU U 244 13.862 19.185 12.769 1.00 42.90 O ATOM 2390 H GLU U 244 17.590 24.122 14.675 1.00 0.00 H TER 2391 GLU U 244 HETATM 2392 O HOH 1 32.111 17.161 15.268 1.00 37.23 O HETATM 2393 O HOH 2 29.175 -1.431 2.963 1.00 30.24 O HETATM 2394 O HOH 3 15.980 1.612 9.046 1.00 30.23 O HETATM 2395 O HOH 4 43.114 11.560 5.039 1.00 31.92 O HETATM 2396 O HOH 5 25.425 -7.485 -1.424 1.00 28.07 O HETATM 2397 O HOH 6 48.517 9.308 -12.525 1.00 23.93 O HETATM 2398 O HOH 7 19.981 19.583 16.972 1.00 44.04 O HETATM 2399 O HOH 8 49.276 21.454 -1.906 1.00 33.64 O HETATM 2400 O HOH 9 45.862 26.563 -10.555 1.00 37.31 O HETATM 2401 O HOH 10 33.776 3.628 -19.478 1.00 23.89 O HETATM 2402 O HOH 11 43.512 5.586 0.618 1.00 25.19 O HETATM 2403 O HOH 12 45.701 8.585 -5.142 1.00 33.40 O HETATM 2404 O HOH 13 31.369 0.086 10.103 1.00 17.02 O HETATM 2405 O HOH 14 23.547 16.665 -11.416 1.00 26.34 O HETATM 2406 O HOH 15 30.768 2.743 -20.726 1.00 33.81 O HETATM 2407 O HOH 16 34.313 26.639 3.365 1.00 20.01 O HETATM 2408 O HOH 17 11.492 -0.666 -7.664 1.00 37.55 O HETATM 2409 O HOH 18 19.886 2.466 16.525 1.00 33.70 O HETATM 2410 O HOH 19 45.580 16.881 -7.174 1.00 19.26 O HETATM 2411 O HOH 20 30.974 19.087 13.317 1.00 25.97 O HETATM 2412 O HOH 21 44.531 19.966 3.759 1.00 34.28 O HETATM 2413 O HOH 22 10.182 12.315 -2.987 1.00 33.22 O HETATM 2414 O HOH 23 17.614 20.854 -10.088 1.00 29.53 O HETATM 2415 O HOH 24 32.790 3.703 -12.289 1.00 13.50 O HETATM 2416 O HOH 25 10.809 19.457 -5.702 1.00 29.91 O HETATM 2417 O HOH 26 39.306 32.380 4.509 1.00 31.51 O HETATM 2418 O HOH 27 29.557 5.588 20.701 1.00 36.01 O HETATM 2419 O HOH 28 12.499 17.974 1.630 1.00 29.36 O HETATM 2420 O HOH 29 37.279 -0.830 11.757 1.00 22.75 O HETATM 2421 O HOH 30 17.493 1.736 11.256 1.00 27.73 O HETATM 2422 O HOH 31 50.148 24.011 -4.260 1.00 44.20 O HETATM 2423 O HOH 32 17.197 9.704 -6.743 1.00 36.17 O HETATM 2424 O HOH 33 11.476 7.832 -4.447 1.00 35.85 O HETATM 2425 O HOH 34 21.881 13.864 -8.169 1.00 28.04 O HETATM 2426 O HOH 35 37.669 18.603 -7.795 1.00 14.07 O HETATM 2427 O HOH 36 27.431 25.068 -6.136 1.00 15.38 O HETATM 2428 O HOH 37 19.053 6.963 -6.952 1.00 34.00 O HETATM 2429 O HOH 38 40.463 5.989 -17.148 1.00 53.30 O HETATM 2430 O HOH 39 43.246 32.300 2.364 1.00 62.57 O HETATM 2431 O HOH 40 22.710 -2.345 8.032 1.00 31.40 O HETATM 2432 O HOH 41 12.091 19.478 5.916 1.00 25.03 O HETATM 2433 O HOH 42 14.896 25.079 4.365 1.00 29.43 O HETATM 2434 O HOH 43 17.116 11.824 -5.046 1.00 23.91 O HETATM 2435 O HOH 44 29.013 16.584 2.865 1.00 13.09 O HETATM 2436 O HOH 45 30.309 6.854 8.286 1.00 16.02 O HETATM 2437 O HOH 46 44.764 29.873 -15.365 1.00 34.22 O HETATM 2438 O HOH 47 12.176 28.422 -1.966 1.00 20.15 O HETATM 2439 O HOH 48 25.441 5.222 -14.733 1.00 39.36 O HETATM 2440 O HOH 49 34.081 14.082 -18.655 1.00 18.45 O HETATM 2441 O HOH 50 17.011 11.998 15.156 1.00 29.62 O HETATM 2442 O HOH 51 37.124 13.737 1.479 1.00 14.47 O HETATM 2443 O HOH 52 13.673 7.901 5.520 1.00 20.25 O HETATM 2444 O HOH 53 20.999 -1.458 -18.100 1.00 28.28 O HETATM 2445 O HOH 54 39.548 6.239 -12.072 1.00 23.21 O HETATM 2446 O HOH 55 36.134 2.072 -14.432 1.00 20.97 O HETATM 2447 O HOH 56 36.126 -2.636 2.243 1.00 38.54 O HETATM 2448 O HOH 57 36.858 24.612 12.797 1.00 42.68 O HETATM 2449 O HOH 58 39.024 3.355 -20.387 1.00 25.64 O HETATM 2450 O HOH 59 11.237 9.162 7.740 1.00 30.04 O HETATM 2451 O HOH 60 25.647 -3.399 11.366 1.00 20.13 O HETATM 2452 O HOH 61 23.166 15.882 16.831 1.00 23.07 O HETATM 2453 O HOH 62 18.837 31.676 -5.809 1.00 31.09 O HETATM 2454 O HOH 63 29.409 9.401 -3.272 1.00 10.93 O HETATM 2455 O HOH 64 28.295 -0.964 -8.484 1.00 28.28 O HETATM 2456 O HOH 65 45.384 32.639 -8.038 1.00 45.69 O HETATM 2457 O HOH 66 33.938 1.329 -11.355 1.00 17.19 O HETATM 2458 O HOH 67 24.865 31.820 2.556 1.00 29.51 O HETATM 2459 O HOH 68 26.558 25.662 -3.595 1.00 17.02 O HETATM 2460 O HOH 69 31.612 -1.488 -10.087 1.00 23.72 O HETATM 2461 O HOH 70 44.770 6.511 -9.615 1.00 21.61 O HETATM 2462 O HOH 71 36.867 33.544 11.051 1.00 34.78 O HETATM 2463 O HOH 72 30.678 11.650 -2.313 1.00 11.20 O HETATM 2464 O HOH 73 29.733 1.089 14.464 1.00 22.35 O HETATM 2465 O HOH 74 9.297 -2.703 14.660 1.00 47.94 O HETATM 2466 O HOH 75 30.198 35.240 -10.025 1.00 37.46 O HETATM 2467 O HOH 76 14.516 28.268 -4.855 1.00 19.22 O HETATM 2468 O HOH 77 16.257 27.642 10.459 1.00 34.15 O HETATM 2469 O HOH 78 32.941 30.722 -19.668 1.00 43.04 O HETATM 2470 O HOH 79 47.728 16.621 -18.246 1.00 28.37 O HETATM 2471 O HOH 80 40.524 36.634 -23.327 1.00 23.67 O HETATM 2472 O HOH 81 34.473 6.808 -6.519 1.00 12.12 O HETATM 2473 O HOH 82 29.096 31.592 7.428 1.00 18.69 O HETATM 2474 O HOH 83 35.586 -0.862 6.657 1.00 26.21 O HETATM 2475 O HOH 84 35.862 18.410 -15.010 1.00 20.78 O HETATM 2476 O HOH 85 38.671 18.788 -13.102 1.00 19.45 O HETATM 2477 O HOH 86 37.148 17.123 12.492 1.00 20.34 O HETATM 2478 O HOH 87 19.414 30.807 8.821 1.00 39.65 O HETATM 2479 O HOH 88 17.258 15.372 -7.344 1.00 23.54 O HETATM 2480 O HOH 89 48.367 21.453 1.136 1.00 29.06 O HETATM 2481 O HOH 90 35.159 -8.216 9.293 1.00 26.04 O HETATM 2482 O HOH 91 37.155 26.010 5.278 1.00 23.85 O HETATM 2483 O HOH 92 36.801 1.708 -19.767 1.00 21.08 O HETATM 2484 O HOH 93 22.709 24.839 16.111 1.00 38.13 O HETATM 2485 O HOH 94 38.707 13.701 -18.916 1.00 34.78 O HETATM 2486 O HOH 95 13.246 24.470 1.819 1.00 32.26 O HETATM 2487 O HOH 96 35.913 31.053 -4.277 1.00 33.11 O HETATM 2488 O HOH 97 39.554 0.918 -10.594 1.00 23.07 O HETATM 2489 O HOH 98 44.511 29.242 -7.956 1.00 32.04 O HETATM 2490 O HOH 99 13.325 4.749 3.982 1.00 39.02 O HETATM 2491 O HOH 100 45.672 26.593 -7.160 1.00 30.25 O HETATM 2492 O HOH 101 16.461 27.395 3.658 1.00 20.05 O HETATM 2493 O HOH 102 53.880 10.464 1.566 1.00 57.64 O HETATM 2494 O HOH 103 41.061 17.873 -11.878 1.00 15.73 O HETATM 2495 O HOH 104 31.748 21.515 13.984 1.00 24.70 O HETATM 2496 O HOH 105 42.056 13.785 -17.588 1.00 22.59 O HETATM 2497 O HOH 106 34.493 0.625 17.210 1.00 26.40 O HETATM 2498 O HOH 107 17.660 31.879 3.109 1.00 36.86 O HETATM 2499 O HOH 108 45.169 22.443 -9.148 1.00 24.73 O HETATM 2500 O HOH 109 37.180 29.021 -6.018 1.00 29.79 O HETATM 2501 O HOH 110 31.483 25.132 -18.693 1.00 32.29 O HETATM 2502 O HOH 111 22.326 30.697 3.790 1.00 20.37 O HETATM 2503 O HOH 112 13.281 21.934 2.845 1.00 19.29 O HETATM 2504 O HOH 113 31.677 26.418 12.994 1.00 31.35 O HETATM 2505 O HOH 114 9.722 15.385 3.333 1.00 30.39 O HETATM 2506 O HOH 115 26.891 28.114 -2.781 1.00 20.13 O HETATM 2507 O HOH 116 30.318 35.961 -6.547 1.00 40.23 O HETATM 2508 O HOH 117 29.151 5.197 5.096 1.00 12.57 O HETATM 2509 O HOH 118 44.327 32.151 -0.701 1.00 46.81 O HETATM 2510 O HOH 119 38.152 27.271 9.393 1.00 35.37 O HETATM 2511 O HOH 120 26.653 0.688 -9.962 1.00 26.71 O HETATM 2512 O HOH 121 10.439 0.943 -8.818 1.00 52.71 O HETATM 2513 O HOH 122 44.258 22.525 -11.633 1.00 27.36 O HETATM 2514 O HOH 123 18.911 29.454 -13.433 1.00 41.96 O HETATM 2515 O HOH 124 24.056 30.921 6.094 1.00 20.24 O HETATM 2516 O HOH 125 33.211 -0.043 14.056 1.00 34.05 O HETATM 2517 O HOH 126 40.556 35.038 -5.793 1.00 29.00 O HETATM 2518 O HOH 127 17.236 -2.990 -4.413 1.00 33.85 O HETATM 2519 O HOH 128 33.502 -3.301 3.899 1.00 31.11 O HETATM 2520 O HOH 129 32.389 30.958 13.211 1.00 23.68 O HETATM 2521 O HOH 130 25.643 29.586 -4.443 1.00 21.78 O HETATM 2522 O HOH 131 15.460 29.153 -8.044 1.00 22.12 O HETATM 2523 O HOH 132 11.243 6.772 6.747 1.00 34.10 O HETATM 2524 O HOH 133 51.227 21.560 -8.263 1.00 44.30 O HETATM 2525 O HOH 134 45.035 10.130 -9.490 1.00 28.70 O HETATM 2526 O HOH 135 32.551 11.563 16.555 1.00 25.74 O HETATM 2527 O HOH 136 41.762 4.676 -9.020 1.00 29.30 O HETATM 2528 O HOH 137 43.063 29.580 6.789 1.00 57.00 O HETATM 2529 O HOH 138 29.066 26.728 13.479 1.00 27.99 O HETATM 2530 O HOH 139 43.838 8.938 -13.120 1.00 39.67 O HETATM 2531 O HOH 140 22.614 2.483 -7.600 1.00 27.60 O HETATM 2532 O HOH 141 34.444 -2.332 9.157 1.00 33.47 O HETATM 2533 O HOH 142 19.238 18.089 -9.827 1.00 34.46 O HETATM 2534 O HOH 143 37.305 14.601 12.635 1.00 33.97 O HETATM 2535 O HOH 144 20.618 29.106 -11.299 1.00 36.39 O HETATM 2536 O HOH 145 38.645 31.854 12.299 1.00 38.49 O HETATM 2537 O HOH 146 33.510 -5.541 6.646 1.00 36.00 O HETATM 2538 O HOH 147 10.050 23.936 5.437 1.00 40.54 O HETATM 2539 O HOH 148 29.333 -7.554 7.020 1.00 40.10 O HETATM 2540 O HOH 149 25.321 32.930 -5.078 1.00 33.05 O HETATM 2541 O HOH 150 10.733 -3.082 0.780 1.00 42.41 O HETATM 2542 O HOH 151 30.893 -10.351 8.627 1.00 30.51 O HETATM 2543 O HOH 152 22.438 32.957 -5.512 1.00 45.36 O HETATM 2544 O HOH 153 13.551 24.288 6.865 1.00 31.95 O HETATM 2545 O HOH 154 16.713 31.579 -8.160 1.00 29.33 O HETATM 2546 O HOH 155 18.323 0.142 20.449 1.00 50.32 O HETATM 2547 O HOH 156 21.240 15.421 -10.230 1.00 44.02 O HETATM 2548 O HOH 157 20.070 32.019 4.497 1.00 42.57 O HETATM 2549 O HOH 158 14.194 23.805 10.509 1.00 38.88 O HETATM 2550 O HOH 159 11.758 20.425 1.223 1.00 23.51 O HETATM 2551 O HOH 160 12.340 22.139 5.387 1.00 31.39 O HETATM 2552 O HOH 161 12.847 2.889 2.480 1.00 40.74 O HETATM 2553 O HOH 162 49.541 23.639 -9.154 1.00 37.44 O HETATM 2554 O HOH 163 42.116 2.063 -9.842 1.00 49.07 O HETATM 2555 O HOH 164 47.749 17.817 -5.896 1.00 36.15 O HETATM 2556 O HOH 165 11.469 24.294 0.133 1.00 28.96 O HETATM 2557 O HOH 166 32.286 28.440 14.489 1.00 34.46 O HETATM 2558 O HOH 167 38.342 22.290 13.928 1.00 46.81 O HETATM 2559 O HOH 168 35.676 34.268 13.304 1.00 27.61 O HETATM 2560 O HOH 169 46.539 24.357 -8.652 1.00 29.41 O HETATM 2561 O HOH 170 29.091 17.466 -17.970 1.00 26.98 O HETATM 2562 O HOH 171 26.557 17.822 -10.148 1.00 16.35 O HETATM 2563 O HOH 172 28.019 18.828 -20.988 1.00 34.39 O HETATM 2564 O HOH 173 28.768 10.844 -15.849 1.00 34.69 O HETATM 2565 O HOH 174 27.329 16.141 -20.623 1.00 31.41 O HETATM 2566 N CYS A 175 26.561 21.838 -28.656 1.00 0.24 N HETATM 2567 CA CYS A 175 27.256 21.184 -27.493 1.00 0.08 C HETATM 2568 C CYS A 175 26.435 21.052 -26.179 1.00 0.23 C HETATM 2569 O CYS A 175 26.063 19.927 -25.815 1.00 -0.39 O HETATM 2570 N CYS A 175 26.146 22.190 -25.489 1.00 -0.25 N HETATM 2571 CA CYS A 175 25.774 22.272 -24.059 1.00 0.13 C HETATM 2572 C CYS A 175 25.320 20.955 -23.402 1.00 0.20 C HETATM 2573 O CYS A 175 24.539 20.235 -24.021 1.00 -0.39 O HETATM 2574 N CYS A 175 25.725 20.615 -22.168 1.00 -0.26 N HETATM 2575 CA CYS A 175 26.333 21.418 -21.063 1.00 0.13 C HETATM 2576 C CYS A 175 25.554 20.986 -19.799 1.00 0.20 C HETATM 2577 O CYS A 175 24.492 21.546 -19.478 1.00 -0.39 O HETATM 2578 N CYS A 175 26.054 19.960 -19.113 1.00 -0.26 N HETATM 2579 CA CYS A 175 25.326 19.309 -17.995 1.00 0.14 C HETATM 2580 C CYS A 175 26.380 19.129 -16.922 1.00 0.21 C HETATM 2581 O CYS A 175 27.544 19.237 -17.222 1.00 -0.39 O HETATM 2582 N CYS A 175 25.986 18.960 -15.666 1.00 -0.26 N HETATM 2583 CA CYS A 175 27.015 18.691 -14.640 1.00 0.15 C HETATM 2584 C CYS A 175 27.517 17.258 -14.645 1.00 0.20 C HETATM 2585 O CYS A 175 26.707 16.304 -14.644 1.00 -0.39 O HETATM 2586 N CYS A 175 29.038 17.066 -14.671 1.00 -0.27 N HETATM 2587 CA CYS A 175 29.091 15.644 -14.378 1.00 0.11 C HETATM 2588 CB CYS A 175 29.102 15.246 -12.885 1.00 -0.03 C HETATM 2589 H35 CYS A 175 29.143 14.150 -12.798 1.00 0.03 H HETATM 2590 H36 CYS A 175 28.188 15.618 -12.399 1.00 0.03 H HETATM 2591 H37 CYS A 175 29.983 15.686 -12.395 1.00 0.03 H HETATM 2592 C CYS A 175 29.360 14.623 -15.478 1.00 0.11 C HETATM 2593 O CYS A 175 29.310 13.363 -14.867 1.00 -0.35 O HETATM 2594 H39 CYS A 175 29.705 12.718 -15.442 1.00 0.22 H HETATM 2595 N CYS A 175 28.832 15.311 -16.786 1.00 0.27 N HETATM 2596 CA CYS A 175 28.914 14.071 -17.644 1.00 0.08 C HETATM 2597 C CYS A 175 30.066 14.204 -18.667 1.00 0.23 C HETATM 2598 O CYS A 175 31.268 13.935 -18.357 1.00 -0.39 O HETATM 2599 N CYS A 175 29.729 14.626 -19.872 1.00 -0.26 N HETATM 2600 CA CYS A 175 30.749 14.980 -20.865 1.00 0.13 C HETATM 2601 C CYS A 175 30.939 16.505 -21.052 1.00 0.20 C HETATM 2602 O CYS A 175 30.163 17.341 -20.539 1.00 -0.39 O HETATM 2603 N CYS A 175 31.969 16.868 -21.809 1.00 -0.26 N HETATM 2604 CA CYS A 175 32.095 18.277 -22.168 1.00 0.14 C HETATM 2605 C CYS A 175 30.784 18.735 -22.865 1.00 0.21 C HETATM 2606 O CYS A 175 30.202 19.781 -22.486 1.00 -0.39 O HETATM 2607 N CYS A 175 30.437 17.970 -23.913 1.00 -0.27 N HETATM 2608 CA CYS A 175 29.252 18.132 -24.757 1.00 0.10 C HETATM 2609 C CYS A 175 28.407 16.888 -24.644 1.00 0.06 C HETATM 2610 O CYS A 175 28.803 15.853 -25.154 1.00 -0.57 O HETATM 2611 OXT CYS A 175 27.346 16.944 -24.045 1.00 -0.57 O HETATM 2612 CB CYS A 175 29.692 18.255 -26.221 1.00 0.04 C HETATM 2613 SG CYS A 175 30.788 19.677 -26.509 1.00 -0.09 S HETATM 2614 SG CYS A 175 29.657 21.230 -25.804 1.00 -0.08 S HETATM 2615 CB CYS A 175 28.653 21.823 -27.236 1.00 0.06 C HETATM 2616 H5 CYS A 175 28.493 22.902 -27.093 1.00 0.05 H HETATM 2617 H6 CYS A 175 29.255 21.658 -28.142 1.00 0.05 H HETATM 2618 H67 CYS A 175 28.796 18.369 -26.849 1.00 0.04 H HETATM 2619 H68 CYS A 175 30.226 17.336 -26.506 1.00 0.04 H HETATM 2620 H66 CYS A 175 28.681 19.020 -24.448 1.00 0.07 H HETATM 2621 H65 CYS A 175 31.050 17.213 -24.140 1.00 0.19 H HETATM 2622 CB CYS A 175 33.303 18.496 -23.107 1.00 0.04 C HETATM 2623 CG CYS A 175 33.885 19.908 -23.012 1.00 0.04 C HETATM 2624 OD1 CYS A 175 33.314 20.802 -22.337 1.00 -0.57 O HETATM 2625 OD2 CYS A 175 34.976 20.116 -23.582 1.00 -0.57 O HETATM 2626 H63 CYS A 175 32.978 18.320 -24.143 1.00 0.05 H HETATM 2627 H64 CYS A 175 34.089 17.774 -22.841 1.00 0.05 H HETATM 2628 H62 CYS A 175 32.245 18.869 -21.253 1.00 0.08 H HETATM 2629 H61 CYS A 175 32.639 16.195 -22.124 1.00 0.19 H HETATM 2630 CB CYS A 175 30.402 14.346 -22.219 1.00 -0.01 C HETATM 2631 CG CYS A 175 29.951 12.890 -22.121 1.00 -0.04 C HETATM 2632 CD1 CYS A 175 29.192 12.480 -23.394 1.00 -0.06 C HETATM 2633 H55 CYS A 175 28.874 11.431 -23.309 1.00 0.02 H HETATM 2634 H56 CYS A 175 29.852 12.594 -24.267 1.00 0.02 H HETATM 2635 H57 CYS A 175 28.308 13.123 -23.517 1.00 0.02 H HETATM 2636 CD2 CYS A 175 31.127 11.923 -21.870 1.00 -0.06 C HETATM 2637 H58 CYS A 175 31.662 12.226 -20.958 1.00 0.02 H HETATM 2638 H59 CYS A 175 31.816 11.954 -22.727 1.00 0.02 H HETATM 2639 H60 CYS A 175 30.741 10.900 -21.746 1.00 0.02 H HETATM 2640 H54 CYS A 175 29.261 12.809 -21.268 1.00 0.03 H HETATM 2641 H52 CYS A 175 31.294 14.390 -22.861 1.00 0.03 H HETATM 2642 H53 CYS A 175 29.591 14.930 -22.678 1.00 0.03 H HETATM 2643 H51 CYS A 175 31.707 14.563 -20.520 1.00 0.08 H HETATM 2644 H50 CYS A 175 28.761 14.706 -20.112 1.00 0.19 H HETATM 2645 CB CYS A 175 27.522 13.810 -18.242 1.00 0.04 C HETATM 2646 CG CYS A 175 27.409 12.643 -19.238 1.00 -0.05 C HETATM 2647 CD1 CYS A 175 28.106 11.419 -19.036 1.00 -0.07 C HETATM 2648 CE1 CYS A 175 27.994 10.379 -19.957 1.00 -0.04 C HETATM 2649 CZ CYS A 175 27.145 10.541 -21.062 1.00 0.08 C HETATM 2650 CE2 CYS A 175 26.454 11.742 -21.291 1.00 -0.04 C HETATM 2651 CD2 CYS A 175 26.576 12.772 -20.382 1.00 -0.07 C HETATM 2652 H46 CYS A 175 26.028 13.694 -20.543 1.00 0.05 H HETATM 2653 H48 CYS A 175 25.832 11.858 -22.171 1.00 0.05 H HETATM 2654 OH CYS A 175 27.011 9.489 -21.981 1.00 -0.34 O HETATM 2655 H49 CYS A 175 27.534 8.750 -21.693 1.00 0.25 H HETATM 2656 H47 CYS A 175 28.553 9.460 -19.822 1.00 0.05 H HETATM 2657 H45 CYS A 175 28.730 11.294 -18.158 1.00 0.05 H HETATM 2658 H43 CYS A 175 27.205 14.726 -18.763 1.00 0.05 H HETATM 2659 H44 CYS A 175 26.834 13.606 -17.409 1.00 0.05 H HETATM 2660 H42 CYS A 175 29.158 13.216 -16.996 1.00 0.11 H HETATM 2661 H40 CYS A 175 29.435 16.051 -17.110 1.00 0.21 H HETATM 2662 H41 CYS A 175 27.891 15.660 -16.692 1.00 0.21 H HETATM 2663 H38 CYS A 175 30.441 14.674 -15.676 1.00 0.12 H HETATM 2664 H34 CYS A 175 28.002 15.520 -14.467 1.00 0.06 H HETATM 2665 H33 CYS A 175 29.773 17.723 -14.839 1.00 0.19 H HETATM 2666 CB CYS A 175 26.487 19.097 -13.285 1.00 0.08 C HETATM 2667 OG CYS A 175 27.529 18.864 -12.375 1.00 -0.39 O HETATM 2668 H32 CYS A 175 27.245 19.105 -11.501 1.00 0.21 H HETATM 2669 H30 CYS A 175 25.607 18.492 -13.021 1.00 0.06 H HETATM 2670 H31 CYS A 175 26.212 20.162 -13.286 1.00 0.06 H HETATM 2671 H29 CYS A 175 27.880 19.332 -14.867 1.00 0.08 H HETATM 2672 H28 CYS A 175 25.018 19.013 -15.420 1.00 0.19 H HETATM 2673 CB CYS A 175 24.782 17.931 -18.417 1.00 0.02 C HETATM 2674 CG CYS A 175 23.610 18.010 -19.342 1.00 -0.05 C HETATM 2675 CD1 CYS A 175 22.313 18.109 -18.830 1.00 -0.07 C HETATM 2676 CE1 CYS A 175 21.215 18.229 -19.671 1.00 -0.04 C HETATM 2677 CZ CYS A 175 21.415 18.231 -21.063 1.00 0.08 C HETATM 2678 CE2 CYS A 175 22.702 18.127 -21.608 1.00 -0.04 C HETATM 2679 CD2 CYS A 175 23.791 18.020 -20.746 1.00 -0.07 C HETATM 2680 H24 CYS A 175 24.791 17.943 -21.156 1.00 0.05 H HETATM 2681 H26 CYS A 175 22.848 18.130 -22.682 1.00 0.05 H HETATM 2682 OH CYS A 175 20.315 18.335 -21.894 1.00 -0.34 O HETATM 2683 H27 CYS A 175 19.527 18.396 -21.368 1.00 0.25 H HETATM 2684 H25 CYS A 175 20.216 18.320 -19.260 1.00 0.05 H HETATM 2685 H23 CYS A 175 22.162 18.092 -17.757 1.00 0.05 H HETATM 2686 H21 CYS A 175 24.475 17.386 -17.512 1.00 0.05 H HETATM 2687 H22 CYS A 175 25.588 17.378 -18.922 1.00 0.05 H HETATM 2688 H20 CYS A 175 24.501 19.944 -17.641 1.00 0.08 H HETATM 2689 H19 CYS A 175 26.958 19.613 -19.362 1.00 0.19 H HETATM 2690 CB CYS A 175 26.238 22.917 -21.257 1.00 -0.02 C HETATM 2691 H16 CYS A 175 26.707 23.428 -20.403 1.00 0.03 H HETATM 2692 H17 CYS A 175 25.180 23.212 -21.325 1.00 0.03 H HETATM 2693 H18 CYS A 175 26.758 23.200 -22.184 1.00 0.03 H HETATM 2694 H15 CYS A 175 27.396 21.152 -20.962 1.00 0.08 H HETATM 2695 H14 CYS A 175 25.597 19.648 -21.948 1.00 0.19 H HETATM 2696 CB CYS A 175 24.647 23.321 -24.078 1.00 -0.01 C HETATM 2697 CG CYS A 175 25.107 24.295 -25.129 1.00 -0.03 C HETATM 2698 CD CYS A 175 25.920 23.503 -26.145 1.00 0.04 C HETATM 2699 H12 CYS A 175 25.358 23.379 -27.082 1.00 0.05 H HETATM 2700 H13 CYS A 175 26.877 24.004 -26.355 1.00 0.05 H HETATM 2701 H10 CYS A 175 25.732 25.077 -24.672 1.00 0.03 H HETATM 2702 H11 CYS A 175 24.239 24.759 -25.619 1.00 0.03 H HETATM 2703 H8 CYS A 175 24.549 23.813 -23.099 1.00 0.03 H HETATM 2704 H9 CYS A 175 23.686 22.864 -24.357 1.00 0.03 H HETATM 2705 H7 CYS A 175 26.632 22.648 -23.482 1.00 0.08 H HETATM 2706 H4 CYS A 175 27.448 20.150 -27.816 1.00 0.11 H HETATM 2707 H1 CYS A 175 27.185 21.868 -29.447 1.00 0.20 H HETATM 2708 H2 CYS A 175 26.294 22.776 -28.403 1.00 0.20 H HETATM 2709 H3 CYS A 175 25.738 21.308 -28.897 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1082 CONECT 439 307 438 CONECT 1082 365 1081 CONECT 1313 1312 1964 CONECT 1630 1629 1787 CONECT 1787 1630 1786 CONECT 1889 1888 2131 CONECT 1964 1313 1963 CONECT 2131 1889 2130 CONECT 2566 2567 2707 2708 2709 CONECT 2567 2566 2568 2615 2706 CONECT 2568 2567 2569 2570 CONECT 2569 2568 CONECT 2570 2568 2571 2698 CONECT 2571 2570 2572 2696 2705 CONECT 2572 2571 2573 2574 CONECT 2573 2572 CONECT 2574 2572 2575 2695 CONECT 2575 2574 2576 2690 2694 CONECT 2576 2575 2577 2578 CONECT 2577 2576 CONECT 2578 2576 2579 2689 CONECT 2579 2578 2580 2673 2688 CONECT 2580 2579 2581 2582 CONECT 2581 2580 CONECT 2582 2580 2583 2672 CONECT 2583 2582 2584 2666 2671 CONECT 2584 2583 2585 2586 CONECT 2585 2584 CONECT 2586 2584 2587 2665 CONECT 2587 2586 2588 2592 2664 CONECT 2588 2587 2589 2590 2591 CONECT 2589 2588 CONECT 2590 2588 CONECT 2591 2588 CONECT 2592 2587 2593 2595 2663 CONECT 2593 2592 2594 CONECT 2594 2593 CONECT 2595 2592 2596 2661 2662 CONECT 2596 2595 2597 2645 2660 CONECT 2597 2596 2598 2599 CONECT 2598 2597 CONECT 2599 2597 2600 2644 CONECT 2600 2599 2601 2630 2643 CONECT 2601 2600 2602 2603 CONECT 2602 2601 CONECT 2603 2601 2604 2629 CONECT 2604 2603 2605 2622 2628 CONECT 2605 2604 2606 2607 CONECT 2606 2605 CONECT 2607 2605 2608 2621 CONECT 2608 2607 2609 2612 2620 CONECT 2609 2608 2610 2611 CONECT 2610 2609 CONECT 2611 2609 CONECT 2612 2608 2613 2618 2619 CONECT 2613 2612 2614 CONECT 2614 2613 2615 CONECT 2615 2567 2614 2616 2617 CONECT 2616 2615 CONECT 2617 2615 CONECT 2618 2612 CONECT 2619 2612 CONECT 2620 2608 CONECT 2621 2607 CONECT 2622 2604 2623 2626 2627 CONECT 2623 2622 2624 2625 CONECT 2624 2623 CONECT 2625 2623 CONECT 2626 2622 CONECT 2627 2622 CONECT 2628 2604 CONECT 2629 2603 CONECT 2630 2600 2631 2641 2642 CONECT 2631 2630 2632 2636 2640 CONECT 2632 2631 2633 2634 2635 CONECT 2633 2632 CONECT 2634 2632 CONECT 2635 2632 CONECT 2636 2631 2637 2638 2639 CONECT 2637 2636 CONECT 2638 2636 CONECT 2639 2636 CONECT 2640 2631 CONECT 2641 2630 CONECT 2642 2630 CONECT 2643 2600 CONECT 2644 2599 CONECT 2645 2596 2646 2658 2659 CONECT 2646 2645 2647 2651 CONECT 2647 2646 2648 2657 CONECT 2648 2647 2649 2656 CONECT 2649 2648 2650 2654 CONECT 2650 2649 2651 2653 CONECT 2651 2646 2650 2652 CONECT 2652 2651 CONECT 2653 2650 CONECT 2654 2649 2655 CONECT 2655 2654 CONECT 2656 2648 CONECT 2657 2647 CONECT 2658 2645 CONECT 2659 2645 CONECT 2660 2596 CONECT 2661 2595 CONECT 2662 2595 CONECT 2663 2592 CONECT 2664 2587 CONECT 2665 2586 CONECT 2666 2583 2667 2669 2670 CONECT 2667 2666 2668 CONECT 2668 2667 CONECT 2669 2666 CONECT 2670 2666 CONECT 2671 2583 CONECT 2672 2582 CONECT 2673 2579 2674 2686 2687 CONECT 2674 2673 2675 2679 CONECT 2675 2674 2676 2685 CONECT 2676 2675 2677 2684 CONECT 2677 2676 2678 2682 CONECT 2678 2677 2679 2681 CONECT 2679 2674 2678 2680 CONECT 2680 2679 CONECT 2681 2678 CONECT 2682 2677 2683 CONECT 2683 2682 CONECT 2684 2676 CONECT 2685 2675 CONECT 2686 2673 CONECT 2687 2673 CONECT 2688 2579 CONECT 2689 2578 CONECT 2690 2575 2691 2692 2693 CONECT 2691 2690 CONECT 2692 2690 CONECT 2693 2690 CONECT 2694 2575 CONECT 2695 2574 CONECT 2696 2571 2697 2703 2704 CONECT 2697 2696 2698 2701 2702 CONECT 2698 2570 2697 2699 2700 CONECT 2699 2698 CONECT 2700 2698 CONECT 2701 2697 CONECT 2702 2697 CONECT 2703 2696 CONECT 2704 2696 CONECT 2705 2571 CONECT 2706 2567 CONECT 2707 2566 CONECT 2708 2566 CONECT 2709 2566 MASTER 0 0 0 0 0 0 0 0 2708 1 158 19 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4x1p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1ejn
RCSB PDB
PDBbind
253aa, >1EJN_1|Chain... at 99%
1f5k
RCSB PDB
PDBbind
253aa, >1F5K_1|Chain... at 99%
1f5l
RCSB PDB
PDBbind
253aa, >1F5L_1|Chain... at 99%
1f92
RCSB PDB
PDBbind
253aa, >1F92_1|Chain... at 99%
1fv9
RCSB PDB
PDBbind
245aa, >1FV9_1|Chain... at 99%
1owd
RCSB PDB
PDBbind
245aa, >1OWD_1|Chain... at 99%
1owe
RCSB PDB
PDBbind
245aa, >1OWE_1|Chain... at 99%
1owh
RCSB PDB
PDBbind
245aa, >1OWH_1|Chain... at 99%
1owi
RCSB PDB
PDBbind
245aa, >1OWI_1|Chain... at 99%
1owj
RCSB PDB
PDBbind
245aa, >1OWJ_1|Chain... at 99%
1owk
RCSB PDB
PDBbind
245aa, >1OWK_1|Chain... at 99%
1sc8
RCSB PDB
PDBbind
262aa, >1SC8_1|Chain... at 99%
1sqa
RCSB PDB
PDBbind
245aa, >1SQA_1|Chain... at 99%
1sqo
RCSB PDB
PDBbind
245aa, >1SQO_1|Chain... at 99%
1sqt
RCSB PDB
PDBbind
245aa, >1SQT_1|Chain... at 99%
1u6q
RCSB PDB
PDBbind
245aa, >1U6Q_1|Chain... at 99%
1vj9
RCSB PDB
PDBbind
262aa, >1VJ9_1|Chain... at 99%
1vja
RCSB PDB
PDBbind
262aa, >1VJA_1|Chain... at 99%
1w0z
RCSB PDB
PDBbind
247aa, >1W0Z_1|Chain... at 99%
1w10
RCSB PDB
PDBbind
247aa, >1W10_1|Chain... at 99%
1w11
RCSB PDB
PDBbind
247aa, >1W11_1|Chain... at 99%
1w12
RCSB PDB
PDBbind
247aa, >1W12_1|Chain... at 99%
1w13
RCSB PDB
PDBbind
247aa, >1W13_1|Chain... at 99%
1w14
RCSB PDB
PDBbind
247aa, >1W14_1|Chain... at 99%
2r2w
RCSB PDB
PDBbind
253aa, >2R2W_1|Chain... at 99%
2vin
RCSB PDB
PDBbind
253aa, >2VIN_1|Chain... at 99%
2vio
RCSB PDB
PDBbind
253aa, >2VIO_1|Chain... at 99%
2vip
RCSB PDB
PDBbind
253aa, >2VIP_1|Chain... at 99%
2viq
RCSB PDB
PDBbind
253aa, >2VIQ_1|Chain... at 99%
2viv
RCSB PDB
PDBbind
253aa, >2VIV_1|Chain... at 99%
2viw
RCSB PDB
PDBbind
253aa, >2VIW_1|Chain... at 99%
2vnt
RCSB PDB
PDBbind
276aa, >2VNT_1|Chains... at 96%
3kgp
RCSB PDB
PDBbind
253aa, >3KGP_1|Chain... at 99%
3khv
RCSB PDB
PDBbind
253aa, >3KHV_1|Chain... at 99%
3kid
RCSB PDB
PDBbind
253aa, >3KID_1|Chain... at 99%
3mhw
RCSB PDB
PDBbind
247aa, >3MHW_1|Chain... at 99%
4h42
RCSB PDB
PDBbind
248aa, >4H42_1|Chain... at 99%
4mnv
RCSB PDB
PDBbind
245aa, >4MNV_1|Chain... at 99%
4x1n
RCSB PDB
PDBbind
247aa, >4X1N_2|Chain... at 98%
4x1q
RCSB PDB
PDBbind
247aa, >4X1Q_2|Chain... at 98%
4x1r
RCSB PDB
PDBbind
247aa, >4X1R_2|Chain... at 98%
4x1s
RCSB PDB
PDBbind
247aa, >4X1S_2|Chain... at 98%
4zhl
RCSB PDB
PDBbind
247aa, >4ZHL_1|Chain... at 98%
4zhm
RCSB PDB
PDBbind
247aa, >4ZHM_2|Chain... at 98%
5wxp
RCSB PDB
PDBbind
253aa, >5WXP_1|Chain... at 99%
5xg4
RCSB PDB
PDBbind
246aa, >5XG4_1|Chain... at 99%
5z1c
RCSB PDB
PDBbind
245aa, >5Z1C_1|Chain... at 99%
5za7
RCSB PDB
PDBbind
253aa, >5ZA7_1|Chain... at 99%
5za8
RCSB PDB
PDBbind
253aa, >5ZA8_1|Chain... at 99%
5za9
RCSB PDB
PDBbind
253aa, >5ZA9_1|Chain... at 99%
5zae
RCSB PDB
PDBbind
253aa, >5ZAE_1|Chain... at 99%
5zaf
RCSB PDB
PDBbind
253aa, >5ZAF_1|Chain... at 99%
5zag
RCSB PDB
PDBbind
253aa, >5ZAG_1|Chain... at 99%
5zah
RCSB PDB
PDBbind
253aa, >5ZAH_1|Chain... at 99%
5zaj
RCSB PDB
PDBbind
253aa, >5ZAJ_1|Chain... at 99%
5zc5
RCSB PDB
PDBbind
253aa, >5ZC5_1|Chain... at 99%
6nmb
RCSB PDB
PDBbind
281aa, >6NMB_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aqc
RCSB PDB
PDBbind
10-mer
1awi
RCSB PDB
PDBbind
10-mer
1aze
RCSB PDB
PDBbind
10-mer
1bjr
RCSB PDB
PDBbind
10-mer
1cka
RCSB PDB
PDBbind
10-mer
1ckb
RCSB PDB
PDBbind
10-mer
1eb1
RCSB PDB
PDBbind
10-mer
1gbq
RCSB PDB
PDBbind
10-mer
1gvu
RCSB PDB
PDBbind
10-mer
1him
RCSB PDB
PDBbind
10-mer
1jd5
RCSB PDB
PDBbind
10-mer
1jd6
RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxd
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e34
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
4x1p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Urokinase-type plasminogen activator
Ligand Name
10-mer
EC.Number
E.C.3.4.21.73
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Kd=62.8uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Int.J.Biochem.Cell Biol. Vol. 62: pp. 88-92
Ligand Properties
Formula
C
4
8
H
7
0
N
1
0
O
1
6
S
2
Molecular Weight
1107.260
Exact Mass
1106.440
No. of atoms
146
No. of bonds
149
Polar Surface Area
474.38
LOGP Value
-3.05 (
Computed with XLOGP3
)
-1.03 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 26
No. of Rings: 4
Canonical SMILES
OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH2+][C@@H]([C@H](NC1=O)C)O)Cc1ccc(cc1)O)CC(C)C)CC(=O)O)C(=O)O
InChI String
InChI=1S/C48H68N10O16S2/c1-23(2)16-31-41(66)55-34(19-38(62)63)44(69)57-36(48(73)74)22-76-75-21-30(49)47(72)58-15-5-6-37(58)46(71)51-25(4)40(65)53-33(18-27-9-13-29(61)14-10-27)43(68)56-35(20-59)45(70)50-24(3)39(64)52-32(42(67)54-31)17-26-7-11-28(60)12-8-26/h7-14,23-25,30-37,39,52,59-61,64H,5-6,15-22,49H2,1-4H3,(H,50,70)(H,51,71)(H,53,65)(H,54,67)(H,55,66)(H,56,68)(H,57,69)(H,62,63)(H,73,74)/p+2/t24-,25+,30+,31+,32+,33+,34+,35+,36+,37+,39-/m1/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):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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